data_r2z3zsf
# 
loop_
_audit.revision_id 
_audit.creation_date 
_audit.update_record 
1_0 2008-02-19 'Initial release'        
1_1 2013-10-02 'Format standardization' 
# 
_cell.entry_id      2z3z 
_cell.length_a      149.8250 
_cell.length_b      149.8250 
_cell.length_c      161.5060 
_cell.angle_alpha   90.0000 
_cell.angle_beta    90.0000 
_cell.angle_gamma   120.0000 
# 
_diffrn.id                  1 
_diffrn.crystal_id          1 
_diffrn.ambient_temp        ? 
_diffrn.crystal_treatment   ? 
_diffrn.details             ? 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   1.00000 
# 
_diffrn_reflns.diffrn_id         1 
_diffrn_reflns.pdbx_d_res_high   1.950 
_diffrn_reflns.pdbx_d_res_low    130.189 
_diffrn_reflns.limit_h_max       66 
_diffrn_reflns.limit_h_min       0 
_diffrn_reflns.limit_k_max       38 
_diffrn_reflns.limit_k_min       0 
_diffrn_reflns.limit_l_max       82 
_diffrn_reflns.limit_l_min       0 
_diffrn_reflns.number            77984 
_diffrn_reflns.pdbx_number_obs   75314 
# 
_entry.id   2z3z 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               2z3z 
_symmetry.space_group_name_H-M   'P 63 2 2' 
_symmetry.Int_Tables_number      182 
# 
loop_
_symmetry_equiv.id 
_symmetry_equiv.pos_as_xyz 
1  'X,  Y,  Z'         
2  'X-Y,  X,  Z+1/2'   
3  '-Y,  X-Y,  Z'      
4  '-X,  -Y,  Z+1/2'   
5  '-X+Y,  -X,  Z'     
6  'Y,  -X+Y,  Z+1/2'  
7  '-Y,  -X,  -Z+1/2'  
8  'X-Y,  -Y,  -Z'     
9  'X,  X-Y,  -Z+1/2'  
10 'Y,  X,  -Z'        
11 '-X+Y,  Y,  -Z+1/2' 
12 '-X,  -X+Y,  -Z'    
# 
#
loop_
_refln.crystal_id
_refln.wavelength_id
_refln.scale_group_code
_refln.index_h
_refln.index_k
_refln.index_l
_refln.status
_refln.F_meas_au
_refln.F_meas_sigma_au
_refln.intensity_meas
_refln.intensity_sigma
_refln.pdbx_I_plus
_refln.pdbx_I_plus_sigma
_refln.pdbx_I_minus
_refln.pdbx_I_minus_sigma
_refln.pdbx_F_plus
_refln.pdbx_F_plus_sigma
_refln.pdbx_F_minus
_refln.pdbx_F_minus_sigma
_refln.pdbx_anom_difference
_refln.pdbx_anom_difference_sigma
1 1 1    0    0    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    0    0    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    0    0    6 o   1936.7   30.1 37543.1562 1164.0249 37543.1562 1164.0249 37543.1562 1164.0249     1936.7     30.1     1936.7       30.1     0.0     0.0 
1 1 1    0    0    8 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    0    0   10 o    706.7    8.7 4997.0703 122.5962  4997.0703 122.5962  4997.0703 122.5962      706.7      8.7      706.7        8.7     0.0     0.0 
1 1 1    0    0   12 o   2773.1   42.6 76983.9922 2360.6145 76983.9922 2360.6145 76983.9922 2360.6145     2773.1     42.6     2773.1       42.6     0.0     0.0 
1 1 1    0    0   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    0    0   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    0    0   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    0    0   20 o    241.9    5.5  586.1629  26.8179   586.1629  26.8179   586.1629  26.8179      241.9      5.5      241.9        5.5     0.0     0.0 
1 1 1    0    0   22 o    901.8   11.6 8137.3198 209.4351  8137.3198 209.4351  8137.3198 209.4351      901.8     11.6      901.8       11.6     0.0     0.0 
1 1 1    0    0   24 o   2461.8   27.1 60642.3125 1335.7872 60642.3125 1335.7872 60642.3125 1335.7872     2461.8     27.1     2461.8       27.1     0.0     0.0 
1 1 1    0    0   26 o   1176.2   14.0 13842.5098 330.1157 13842.5098 330.1157 13842.5098 330.1157     1176.2     14.0     1176.2       14.0     0.0     0.0 
1 1 1    0    0   28 o    195.1    9.9  383.7515  38.3113   383.7515  38.3113   383.7515  38.3113      195.1      9.9      195.1        9.9     0.0     0.0 
1 1 1    0    0   30 o    983.5   12.2 9676.7949 240.0841  9676.7949 240.0841  9676.7949 240.0841      983.5     12.2      983.5       12.2     0.0     0.0 
1 1 1    0    0   32 o   1399.0   16.8 19582.1816 471.2290 19582.1816 471.2290 19582.1816 471.2290     1399.0     16.8     1399.0       16.8     0.0     0.0 
1 1 1    0    0   34 o   1409.0   18.2 19865.6836 513.3714 19865.6836 513.3714 19865.6836 513.3714     1409.0     18.2     1409.0       18.2     0.0     0.0 
1 1 1    0    0   36 o    906.5   13.7 8223.5205 248.3849  8223.5205 248.3849  8223.5205 248.3849      906.5     13.7      906.5       13.7     0.0     0.0 
1 1 1    0    0   38 o    759.5   13.7 5774.1509 207.5195  5774.1509 207.5195  5774.1509 207.5195      759.5     13.7      759.5       13.7     0.0     0.0 
1 1 1    0    0   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    0    0   42 o   2629.6   42.2 69247.0312 2219.5012 69247.0312 2219.5012 69247.0312 2219.5012     2629.6     42.2     2629.6       42.2     0.0     0.0 
1 1 1    0    0   44 o   1527.3   17.9 23339.2422 545.9360 23339.2422 545.9360 23339.2422 545.9360     1527.3     17.9     1527.3       17.9     0.0     0.0 
1 1 1    0    0   46 o    663.8   11.0 4410.2690 145.5829  4410.2690 145.5829  4410.2690 145.5829      663.8     11.0      663.8       11.0     0.0     0.0 
1 1 1    0    0   48 o    813.8   10.6 6626.5776 173.0394  6626.5776 173.0394  6626.5776 173.0394      813.8     10.6      813.8       10.6     0.0     0.0 
1 1 1    0    0   50 o    735.0   12.2 5407.0010 179.4246  5407.0010 179.4246  5407.0010 179.4246      735.0     12.2      735.0       12.2     0.0     0.0 
1 1 1    0    0   52 o    739.6   10.5 5473.4072 155.1608  5473.4072 155.1608  5473.4072 155.1608      739.6     10.5      739.6       10.5     0.0     0.0 
1 1 1    0    0   54 o    580.9   12.0 3379.0566 139.8362  3379.0566 139.8362  3379.0566 139.8362      580.9     12.0      580.9       12.0     0.0     0.0 
1 1 1    0    0   56 o     92.4   53.2  110.4642 155.1608   110.4642 155.1608   110.4642 155.1608       92.4     53.2       92.4       53.2     0.0     0.0 
1 1 1    0    0   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    0    0   60 o    813.9   13.5 6632.9629 219.0129  6632.9629 219.0129  6632.9629 219.0129      813.9     13.5      813.9       13.5     0.0     0.0 
1 1 1    0    0   62 o    815.0   11.6 6648.2866 189.6409  6648.2866 189.6409  6648.2866 189.6409      815.0     11.6      815.0       11.6     0.0     0.0 
1 1 1    0    0   64 o    121.2   37.2  183.2557  78.5382   183.2557  78.5382   183.2557  78.5382      121.2     37.2      121.2       37.2     0.0     0.0 
1 1 1    0    0   66 o   1484.5   16.7 22069.8613 494.2158 22069.8613 494.2158 22069.8613 494.2158     1484.5     16.7     1484.5       16.7     0.0     0.0 
1 1 1    0    0   68 o    229.1   20.4  538.2737  91.9471   538.2737  91.9471   538.2737  91.9471      229.1     20.4      229.1       20.4     0.0     0.0 
1 1 1    0    0   70 o    849.2   12.0 7221.6797 203.0499  7221.6797 203.0499  7221.6797 203.0499      849.2     12.0      849.2       12.0     0.0     0.0 
1 1 1    0    0   72 o    484.2   10.5 2349.1211 101.5249  2349.1211 101.5249  2349.1211 101.5249      484.2     10.5      484.2       10.5     0.0     0.0 
1 1 1    0    0   74 f    142.3   31.3  230.5063  77.8996   230.5063  77.8996   230.5063  77.8996      142.3     31.3      142.3       31.3     0.0     0.0 
1 1 1    0    0   76 o   1093.7   13.6 11984.4121 297.5511 11984.4121 297.5511 11984.4121 297.5511     1093.7     13.6     1093.7       13.6     0.0     0.0 
1 1 1    0    0   78 o    922.3   12.0 8522.9873 221.5670  8522.9873 221.5670  8522.9873 221.5670      922.3     12.0      922.3       12.0     0.0     0.0 
1 1 1    0    0   80 o    276.4   11.7  769.4186  64.4907   769.4186  64.4907   769.4186  64.4907      276.4     11.7      276.4       11.7     0.0     0.0 
1 1 1    0    0   82 o    463.3    9.8 2153.0950  90.6701  2153.0950  90.6701  2153.0950  90.6701      463.3      9.8      463.3        9.8     0.0     0.0 
1 1 1    1    0    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    0    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    0    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    0    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    0    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    0    5 o   1165.4   19.2 13597.3184 446.9651 13597.3184 446.9651 13597.3184 446.9651     1165.4     19.2     1165.4       19.2     0.0     0.0 
1 1 1    1    0    6 o    727.2    4.9 5288.8745  71.5144  5288.8745  71.5144  5288.8745  71.5144      727.2      4.9      727.2        4.9     0.0     0.0 
1 1 1    1    0    7 o    495.9    2.6 2459.5854  25.5409  2459.5854  25.5409  2459.5854  25.5409      495.9      2.6      495.9        2.6     0.0     0.0 
1 1 1    1    0    8 o    379.7    2.1 1441.7819  15.9630  1441.7819  15.9630  1441.7819  15.9630      379.7      2.1      379.7        2.1     0.0     0.0 
1 1 1    1    0    9 o    643.2    3.2 4137.6201  40.8654  4137.6201  40.8654  4137.6201  40.8654      643.2      3.2      643.2        3.2     0.0     0.0 
1 1 1    1    0   10 o    100.1    1.9  100.2479   3.8311   100.2479   3.8311   100.2479   3.8311      100.1      1.9      100.1        1.9     0.0     0.0 
1 1 1    1    0   11 o    707.5    3.5 5005.3711  49.1662  5005.3711  49.1662  5005.3711  49.1662      707.5      3.5      707.5        3.5     0.0     0.0 
1 1 1    1    0   12 o    170.8    1.7  291.8044   5.7467   291.8044   5.7467   291.8044   5.7467      170.8      1.7      170.8        1.7     0.0     0.0 
1 1 1    1    0   13 o    949.3    4.6 9013.3711  86.8389  9013.3711  86.8389  9013.3711  86.8389      949.3      4.6      949.3        4.6     0.0     0.0 
1 1 1    1    0   14 o    999.4    4.7 9988.3945  94.5012  9988.3945  94.5012  9988.3945  94.5012      999.4      4.7      999.4        4.7     0.0     0.0 
1 1 1    1    0   15 o   3391.2   19.8 115076.2891 1340.2568 115076.2891 1340.2568 115076.2891 1340.2568     3391.2     19.8     3391.2       19.8     0.0     0.0 
1 1 1    1    0   16 f    670.1    3.4 4490.7227  45.3350  4490.7227  45.3350  4490.7227  45.3350      670.1      3.4      670.1        3.4     0.0     0.0 
1 1 1    1    0   17 o    513.7    3.0 2639.0098  31.2876  2639.0098  31.2876  2639.0098  31.2876      513.7      3.0      513.7        3.0     0.0     0.0 
1 1 1    1    0   18 o    899.5    4.4 8091.9849  79.1767  8091.9849  79.1767  8091.9849  79.1767      899.5      4.4      899.5        4.4     0.0     0.0 
1 1 1    1    0   19 o    712.4    3.7 5074.9697  52.9973  5074.9697  52.9973  5074.9697  52.9973      712.4      3.7      712.4        3.7     0.0     0.0 
1 1 1    1    0   20 o    267.5    2.4  715.7827  12.7704   715.7827  12.7704   715.7827  12.7704      267.5      2.4      267.5        2.4     0.0     0.0 
1 1 1    1    0   21 o   1025.3    4.9 10514.5352 100.8864 10514.5352 100.8864 10514.5352 100.8864     1025.3      4.9     1025.3        4.9     0.0     0.0 
1 1 1    1    0   22 o    156.0    3.7  243.9153  11.4934   243.9153  11.4934   243.9153  11.4934      156.0      3.7      156.0        3.7     0.0     0.0 
1 1 1    1    0   23 f   2614.9   12.3 68405.4609 641.7142 68405.4609 641.7142 68405.4609 641.7142     2614.9     12.3     2614.9       12.3     0.0     0.0 
1 1 1    1    0   24 o     12.2    9.0  -39.5883  14.6860   -39.5883  14.6860   -39.5883  14.6860       12.2      9.0       12.2        9.0     0.0     0.0 
1 1 1    1    0   25 o   1183.4    5.5 14005.3330 130.2584 14005.3330 130.2584 14005.3330 130.2584     1183.4      5.5     1183.4        5.5     0.0     0.0 
1 1 1    1    0   26 o    217.5    2.8  473.1445  12.1319   473.1445  12.1319   473.1445  12.1319      217.5      2.8      217.5        2.8     0.0     0.0 
1 1 1    1    0   27 o    580.3    3.4 3367.5632  38.9498  3367.5632  38.9498  3367.5632  38.9498      580.3      3.4      580.3        3.4     0.0     0.0 
1 1 1    1    0   28 f    694.1    3.7 4818.9229  51.7203  4818.9229  51.7203  4818.9229  51.7203      694.1      3.7      694.1        3.7     0.0     0.0 
1 1 1    1    0   29 o    601.8    3.4 3621.6948  40.8654  3621.6948  40.8654  3621.6948  40.8654      601.8      3.4      601.8        3.4     0.0     0.0 
1 1 1    1    0   30 o    766.4    4.0 5875.0371  61.2981  5875.0371  61.2981  5875.0371  61.2981      766.4      4.0      766.4        4.0     0.0     0.0 
1 1 1    1    0   31 o    439.2    3.0 1928.9739  26.1794  1928.9739  26.1794  1928.9739  26.1794      439.2      3.0      439.2        3.0     0.0     0.0 
1 1 1    1    0   32 o    108.2   11.1  120.6806  23.6253   120.6806  23.6253   120.6806  23.6253      108.2     11.1      108.2       11.1     0.0     0.0 
1 1 1    1    0   33 o   1567.5    7.3 24573.5039 228.5907 24573.5039 228.5907 24573.5039 228.5907     1567.5      7.3     1567.5        7.3     0.0     0.0 
1 1 1    1    0   34 o    933.2    5.3 8709.4346  99.6094  8709.4346  99.6094  8709.4346  99.6094      933.2      5.3      933.2        5.3     0.0     0.0 
1 1 1    1    0   35 o   2357.3   11.7 55582.6719 553.5982 55582.6719 553.5982 55582.6719 553.5982     2357.3     11.7     2357.3       11.7     0.0     0.0 
1 1 1    1    0   36 o   1002.5   10.3 10054.7998 206.2425 10054.7998 206.2425 10054.7998 206.2425     1002.5     10.3     1002.5       10.3     0.0     0.0 
1 1 1    1    0   37 o   1640.2    8.1 26907.3008 266.2635 26907.3008 266.2635 26907.3008 266.2635     1640.2      8.1     1640.2        8.1     0.0     0.0 
1 1 1    1    0   38 o   1161.2    5.8 13486.2158 134.7281 13486.2158 134.7281 13486.2158 134.7281     1161.2      5.8     1161.2        5.8     0.0     0.0 
1 1 1    1    0   39 o   1239.2    8.2 15359.6377 204.3269 15359.6377 204.3269 15359.6377 204.3269     1239.2      8.2     1239.2        8.2     0.0     0.0 
1 1 1    1    0   40 o    211.1    6.4  446.9651  26.8179   446.9651  26.8179   446.9651  26.8179      211.1      6.4      211.1        6.4     0.0     0.0 
1 1 1    1    0   41 o    489.2    4.3 2393.8176  42.1424  2393.8176  42.1424  2393.8176  42.1424      489.2      4.3      489.2        4.3     0.0     0.0 
1 1 1    1    0   42 o   1558.3    7.4 24286.8086 229.2293 24286.8086 229.2293 24286.8086 229.2293     1558.3      7.4     1558.3        7.4     0.0     0.0 
1 1 1    1    0   43 o    694.0    4.2 4817.0073  58.1055  4817.0073  58.1055  4817.0073  58.1055      694.0      4.2      694.0        4.2     0.0     0.0 
1 1 1    1    0   44 o   1243.6    6.1 15466.9102 151.3296 15466.9102 151.3296 15466.9102 151.3296     1243.6      6.1     1243.6        6.1     0.0     0.0 
1 1 1    1    0   45 o    651.3    3.9 4242.9761  50.4432  4242.9761  50.4432  4242.9761  50.4432      651.3      3.9      651.3        3.9     0.0     0.0 
1 1 1    1    0   46 o    784.8    4.3 6160.4565  67.6833  6160.4565  67.6833  6160.4565  67.6833      784.8      4.3      784.8        4.3     0.0     0.0 
1 1 1    1    0   47 o     48.8   23.2   35.1187  25.5409    35.1187  25.5409    35.1187  25.5409       48.8     23.2       48.8       23.2     0.0     0.0 
1 1 1    1    0   48 o     18.6   13.7  -68.3218  30.0105   -68.3218  30.0105   -68.3218  30.0105       18.6     13.7       18.6       13.7     0.0     0.0 
1 1 1    1    0   49 o    166.7    7.7  279.6725  25.5409   279.6725  25.5409   279.6725  25.5409      166.7      7.7      166.7        7.7     0.0     0.0 
1 1 1    1    0   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    0   51 o    542.4    3.8 2942.3076  41.5039  2942.3076  41.5039  2942.3076  41.5039      542.4      3.8      542.4        3.8     0.0     0.0 
1 1 1    1    0   52 o    394.2    4.2 1554.8002  33.2031  1554.8002  33.2031  1554.8002  33.2031      394.2      4.2      394.2        4.2     0.0     0.0 
1 1 1    1    0   53 o    213.6    8.1  458.4586  34.4802   458.4586  34.4802   458.4586  34.4802      213.6      8.1      213.6        8.1     0.0     0.0 
1 1 1    1    0   54 o   1152.8    6.0 13295.2969 139.1977 13295.2969 139.1977 13295.2969 139.1977     1152.8      6.0     1152.8        6.0     0.0     0.0 
1 1 1    1    0   55 f   1107.9    5.6 12277.4941 123.2347 12277.4941 123.2347 12277.4941 123.2347     1107.9      5.6     1107.9        5.6     0.0     0.0 
1 1 1    1    0   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    0   57 o    870.4    4.6 7577.9751  79.8152  7577.9751  79.8152  7577.9751  79.8152      870.4      4.6      870.4        4.6     0.0     0.0 
1 1 1    1    0   58 o    961.8    5.5 9254.0947 105.3561  9254.0947 105.3561  9254.0947 105.3561      961.8      5.5      961.8        5.5     0.0     0.0 
1 1 1    1    0   59 o     26.5   18.3  -19.1556  30.6490   -19.1556  30.6490   -19.1556  30.6490       26.5     18.3       26.5       18.3     0.0     0.0 
1 1 1    1    0   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    0   61 o    339.0    4.8 1150.6160  32.5646  1150.6160  32.5646  1150.6160  32.5646      339.0      4.8      339.0        4.8     0.0     0.0 
1 1 1    1    0   62 o   1186.4    5.8 14083.2334 137.9207 14083.2334 137.9207 14083.2334 137.9207     1186.4      5.8     1186.4        5.8     0.0     0.0 
1 1 1    1    0   63 o     20.9   15.4  -84.9234  37.6728   -84.9234  37.6728   -84.9234  37.6728       20.9     15.4       20.9       15.4     0.0     0.0 
1 1 1    1    0   64 o    127.9   11.4  167.9312  28.7335   167.9312  28.7335   167.9312  28.7335      127.9     11.4      127.9       11.4     0.0     0.0 
1 1 1    1    0   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    0   66 o    490.9    4.9 2411.6963  48.5276  2411.6963  48.5276  2411.6963  48.5276      490.9      4.9      490.9        4.9     0.0     0.0 
1 1 1    1    0   67 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    0   68 o    102.8   13.7  111.7413  27.4564   111.7413  27.4564   111.7413  27.4564      102.8     13.7      102.8       13.7     0.0     0.0 
1 1 1    1    0   69 o    380.4    4.5 1448.1671  34.4802  1448.1671  34.4802  1448.1671  34.4802      380.4      4.5      380.4        4.5     0.0     0.0 
1 1 1    1    0   70 o    202.5    8.2  413.1235  33.2031   413.1235  33.2031   413.1235  33.2031      202.5      8.2      202.5        8.2     0.0     0.0 
1 1 1    1    0   71 o    387.4    4.5 1502.4414  35.1187  1502.4414  35.1187  1502.4414  35.1187      387.4      4.5      387.4        4.5     0.0     0.0 
1 1 1    1    0   72 o     28.2   19.3  -14.6860  31.9261   -14.6860  31.9261   -14.6860  31.9261       28.2     19.3       28.2       19.3     0.0     0.0 
1 1 1    1    0   73 o     26.4   18.4  -22.3483  31.9261   -22.3483  31.9261   -22.3483  31.9261       26.4     18.4       26.4       18.4     0.0     0.0 
1 1 1    1    0   74 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    0   75 o     68.6   25.6   64.4907  32.5646    64.4907  32.5646    64.4907  32.5646       68.6     25.6       68.6       25.6     0.0     0.0 
1 1 1    1    0   76 o    325.8    6.5 1065.0541  42.1424  1065.0541  42.1424  1065.0541  42.1424      325.8      6.5      325.8        6.5     0.0     0.0 
1 1 1    1    0   77 o     72.4   25.4   70.2374  33.2031    70.2374  33.2031    70.2374  33.2031       72.4     25.4       72.4       25.4     0.0     0.0 
1 1 1    1    0   78 o    240.0    7.5  579.7776  35.7572   579.7776  35.7572   579.7776  35.7572      240.0      7.5      240.0        7.5     0.0     0.0 
1 1 1    1    0   79 o    268.3    6.7  723.4450  35.7572   723.4450  35.7572   723.4450  35.7572      268.3      6.7      268.3        6.7     0.0     0.0 
1 1 1    1    0   80 o    203.9    7.9  419.5087  31.9261   419.5087  31.9261   419.5087  31.9261      203.9      7.9      203.9        7.9     0.0     0.0 
1 1 1    1    0   81 o    176.1    9.7  315.4297  33.8416   315.4297  33.8416   315.4297  33.8416      176.1      9.7      176.1        9.7     0.0     0.0 
1 1 1    1    0   82 o     92.8   15.1   93.2242  26.1794    93.2242  26.1794    93.2242  26.1794       92.8     15.1       92.8       15.1     0.0     0.0 
1 1 1    1    1    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    1    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    1    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    1    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    1    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    1    5 o    174.3    2.0  303.9363   7.0237   303.9363   7.0237   303.9363   7.0237      174.3      2.0      174.3        2.0     0.0     0.0 
1 1 1    1    1    6 o     90.7    2.5   82.3693   4.4697    82.3693   4.4697    82.3693   4.4697       90.7      2.5       90.7        2.5     0.0     0.0 
1 1 1    1    1    7 o     54.0    3.0   29.3720   3.1926    29.3720   3.1926    29.3720   3.1926       54.0      3.0       54.0        3.0     0.0     0.0 
1 1 1    1    1    8 o   1257.7    5.9 15820.0127 147.4985 15820.0127 147.4985 15820.0127 147.4985     1257.7      5.9     1257.7        5.9     0.0     0.0 
1 1 1    1    1    9 o    985.0    4.7 9702.3359  93.2242  9702.3359  93.2242  9702.3359  93.2242      985.0      4.7      985.0        4.7     0.0     0.0 
1 1 1    1    1   10 o   1037.1    4.9 10756.5352 101.5249 10756.5352 101.5249 10756.5352 101.5249     1037.1      4.9     1037.1        4.9     0.0     0.0 
1 1 1    1    1   11 o    232.7    1.6  541.4664   7.6623   541.4664   7.6623   541.4664   7.6623      232.7      1.6      232.7        1.6     0.0     0.0 
1 1 1    1    1   12 o    560.4    2.9 3140.2493  32.5646  3140.2493  32.5646  3140.2493  32.5646      560.4      2.9      560.4        2.9     0.0     0.0 
1 1 1    1    1   13 o   1534.1    7.0 23539.0996 215.8203 23539.0996 215.8203 23539.0996 215.8203     1534.1      7.0     1534.1        7.0     0.0     0.0 
1 1 1    1    1   14 o   2099.1    9.5 44069.4844 399.7145 44069.4844 399.7145 44069.4844 399.7145     2099.1      9.5     2099.1        9.5     0.0     0.0 
1 1 1    1    1   15 o    477.0    2.6 2275.0525  24.9023  2275.0525  24.9023  2275.0525  24.9023      477.0      2.6      477.0        2.6     0.0     0.0 
1 1 1    1    1   16 o   1813.9    8.3 32908.7656 301.3822 32908.7656 301.3822 32908.7656 301.3822     1813.9      8.3     1813.9        8.3     0.0     0.0 
1 1 1    1    1   17 o   2694.8   29.6 72738.4688 1596.9426 72738.4688 1596.9426 72738.4688 1596.9426     2694.8     29.6     2694.8       29.6     0.0     0.0 
1 1 1    1    1   18 o   2981.3   17.5 88933.9297 1040.7903 88933.9297 1040.7903 88933.9297 1040.7903     2981.3     17.5     2981.3       17.5     0.0     0.0 
1 1 1    1    1   19 o   1149.9    5.4 13223.7832 125.1502 13223.7832 125.1502 13223.7832 125.1502     1149.9      5.4     1149.9        5.4     0.0     0.0 
1 1 1    1    1   20 o    311.6    2.7  971.1914  16.6016   971.1914  16.6016   971.1914  16.6016      311.6      2.7      311.6        2.7     0.0     0.0 
1 1 1    1    1   21 o   1281.3    6.0 16418.3066 154.5222 16418.3066 154.5222 16418.3066 154.5222     1281.3      6.0     1281.3        6.0     0.0     0.0 
1 1 1    1    1   22 f    603.6    3.2 3643.4043  38.9498  3643.4043  38.9498  3643.4043  38.9498      603.6      3.2      603.6        3.2     0.0     0.0 
1 1 1    1    1   23 o   1443.3    6.7 20834.9609 192.1950 20834.9609 192.1950 20834.9609 192.1950     1443.3      6.7     1443.3        6.7     0.0     0.0 
1 1 1    1    1   24 o   1288.2    6.0 16596.4531 154.5222 16596.4531 154.5222 16596.4531 154.5222     1288.2      6.0     1288.2        6.0     0.0     0.0 
1 1 1    1    1   25 o    571.2    3.2 3262.8455  36.3957  3262.8455  36.3957  3262.8455  36.3957      571.2      3.2      571.2        3.2     0.0     0.0 
1 1 1    1    1   26 o    714.0    3.8 5097.9570  54.9129  5097.9570  54.9129  5097.9570  54.9129      714.0      3.8      714.0        3.8     0.0     0.0 
1 1 1    1    1   27 o    748.5    3.9 5603.6655  58.7440  5603.6655  58.7440  5603.6655  58.7440      748.5      3.9      748.5        3.9     0.0     0.0 
1 1 1    1    1   28 o    416.3    3.2 1733.5862  26.8179  1733.5862  26.8179  1733.5862  26.8179      416.3      3.2      416.3        3.2     0.0     0.0 
1 1 1    1    1   29 o   3632.7   16.1 132051.3906 1172.9642 132051.3906 1172.9642 132051.3906 1172.9642     3632.7     16.1     3632.7       16.1     0.0     0.0 
1 1 1    1    1   30 o    334.9    3.7 1121.8824  24.9023  1121.8824  24.9023  1121.8824  24.9023      334.9      3.7      334.9        3.7     0.0     0.0 
1 1 1    1    1   31 o     17.1   11.8   -8.3008  12.7704    -8.3008  12.7704    -8.3008  12.7704       17.1     11.8       17.1       11.8     0.0     0.0 
1 1 1    1    1   32 o    219.6    6.0  483.3608  26.1794   483.3608  26.1794   483.3608  26.1794      219.6      6.0      219.6        6.0     0.0     0.0 
1 1 1    1    1   33 o   1604.1    7.4 25734.3379 238.1686 25734.3379 238.1686 25734.3379 238.1686     1604.1      7.4     1604.1        7.4     0.0     0.0 
1 1 1    1    1   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    1   35 o   1640.0    8.3 26899.6387 273.2873 26899.6387 273.2873 26899.6387 273.2873     1640.0      8.3     1640.0        8.3     0.0     0.0 
1 1 1    1    1   36 o    964.5    4.7 9302.6221  91.3086  9302.6221  91.3086  9302.6221  91.3086      964.5      4.7      964.5        4.7     0.0     0.0 
1 1 1    1    1   37 o    205.7    6.7  424.6169  27.4564   424.6169  27.4564   424.6169  27.4564      205.7      6.7      205.7        6.7     0.0     0.0 
1 1 1    1    1   38 o   2048.0    9.3 41951.5117 380.5589 41951.5117 380.5589 41951.5117 380.5589     2048.0      9.3     2048.0        9.3     0.0     0.0 
1 1 1    1    1   39 o    513.4    3.9 2635.8171  39.5883  2635.8171  39.5883  2635.8171  39.5883      513.4      3.9      513.4        3.9     0.0     0.0 
1 1 1    1    1   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    1   41 o    228.3    5.7  522.3107  26.1794   522.3107  26.1794   522.3107  26.1794      228.3      5.7      228.3        5.7     0.0     0.0 
1 1 1    1    1   42 o    492.0    3.8 2421.2742  37.6728  2421.2742  37.6728  2421.2742  37.6728      492.0      3.8      492.0        3.8     0.0     0.0 
1 1 1    1    1   43 o   1336.2    6.3 17858.1738 169.2082 17858.1738 169.2082 17858.1738 169.2082     1336.2      6.3     1336.2        6.3     0.0     0.0 
1 1 1    1    1   44 o     17.1   12.8 -128.9814  36.3957  -128.9814  36.3957  -128.9814  36.3957       17.1     12.8       17.1       12.8     0.0     0.0 
1 1 1    1    1   45 o    115.2   12.5  137.2822  28.0950   137.2822  28.0950   137.2822  28.0950      115.2     12.5      115.2       12.5     0.0     0.0 
1 1 1    1    1   46 o    669.6    4.0 4483.6987  52.9973  4483.6987  52.9973  4483.6987  52.9973      669.6      4.0      669.6        4.0     0.0     0.0 
1 1 1    1    1   47 o    194.5    8.4  380.5589  32.5646   380.5589  32.5646   380.5589  32.5646      194.5      8.4      194.5        8.4     0.0     0.0 
1 1 1    1    1   48 o   1003.0    5.0 10061.8242 100.2479 10061.8242 100.2479 10061.8242 100.2479     1003.0      5.0     1003.0        5.0     0.0     0.0 
1 1 1    1    1   49 o    999.7    5.0 9996.6943 100.2479  9996.6943 100.2479  9996.6943 100.2479      999.7      5.0      999.7        5.0     0.0     0.0 
1 1 1    1    1   50 o    354.7    4.6 1258.5261  32.5646  1258.5261  32.5646  1258.5261  32.5646      354.7      4.6      354.7        4.6     0.0     0.0 
1 1 1    1    1   51 o     20.1   14.4  -31.9261  24.2638   -31.9261  24.2638   -31.9261  24.2638       20.1     14.4       20.1       14.4     0.0     0.0 
1 1 1    1    1   52 o    598.1    3.8 3577.6365  45.9736  3577.6365  45.9736  3577.6365  45.9736      598.1      3.8      598.1        3.8     0.0     0.0 
1 1 1    1    1   53 o    490.2    4.1 2403.3953  40.2269  2403.3953  40.2269  2403.3953  40.2269      490.2      4.1      490.2        4.1     0.0     0.0 
1 1 1    1    1   54 o    749.2    4.7 5613.8823  70.8759  5613.8823  70.8759  5613.8823  70.8759      749.2      4.7      749.2        4.7     0.0     0.0 
1 1 1    1    1   55 o     43.7   26.4   19.7942  41.5039    19.7942  41.5039    19.7942  41.5039       43.7     26.4       43.7       26.4     0.0     0.0 
1 1 1    1    1   56 o    526.7    4.7 2775.0151  49.1662  2775.0151  49.1662  2775.0151  49.1662      526.7      4.7      526.7        4.7     0.0     0.0 
1 1 1    1    1   57 o    125.9   14.0  164.7386  34.4802   164.7386  34.4802   164.7386  34.4802      125.9     14.0      125.9       14.0     0.0     0.0 
1 1 1    1    1   58 o    516.4    3.9 2667.7432  40.2269  2667.7432  40.2269  2667.7432  40.2269      516.4      3.9      516.4        3.9     0.0     0.0 
1 1 1    1    1   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    1   60 o    253.7    5.8  644.9069  29.3720   644.9069  29.3720   644.9069  29.3720      253.7      5.8      253.7        5.8     0.0     0.0 
1 1 1    1    1   61 o    210.8    7.0  446.3266  29.3720   446.3266  29.3720   446.3266  29.3720      210.8      7.0      210.8        7.0     0.0     0.0 
1 1 1    1    1   62 f    424.4    5.4 1802.5465  45.9736  1802.5465  45.9736  1802.5465  45.9736      424.4      5.4      424.4        5.4     0.0     0.0 
1 1 1    1    1   63 o    543.0    3.9 2949.3313  42.1424  2949.3313  42.1424  2949.3313  42.1424      543.0      3.9      543.0        3.9     0.0     0.0 
1 1 1    1    1   64 o    222.1    6.6  494.8542  29.3720   494.8542  29.3720   494.8542  29.3720      222.1      6.6      222.1        6.6     0.0     0.0 
1 1 1    1    1   65 o    339.1    5.0 1151.2545  33.8416  1151.2545  33.8416  1151.2545  33.8416      339.1      5.0      339.1        5.0     0.0     0.0 
1 1 1    1    1   66 o    152.9    9.5  236.8915  28.7335   236.8915  28.7335   236.8915  28.7335      152.9      9.5      152.9        9.5     0.0     0.0 
1 1 1    1    1   67 o    120.6   12.4  150.6911  29.3720   150.6911  29.3720   150.6911  29.3720      120.6     12.4      120.6       12.4     0.0     0.0 
1 1 1    1    1   68 o     19.5   14.2  -53.6358  28.7335   -53.6358  28.7335   -53.6358  28.7335       19.5     14.2       19.5       14.2     0.0     0.0 
1 1 1    1    1   69 o    445.9    4.2 1989.6334  37.6728  1989.6334  37.6728  1989.6334  37.6728      445.9      4.2      445.9        4.2     0.0     0.0 
1 1 1    1    1   70 o    265.5    5.8  706.8434  30.6490   706.8434  30.6490   706.8434  30.6490      265.5      5.8      265.5        5.8     0.0     0.0 
1 1 1    1    1   71 o    275.8    5.9  762.3948  32.5646   762.3948  32.5646   762.3948  32.5646      275.8      5.9      275.8        5.9     0.0     0.0 
1 1 1    1    1   72 o    162.6    9.9  268.1791  31.9261   268.1791  31.9261   268.1791  31.9261      162.6      9.9      162.6        9.9     0.0     0.0 
1 1 1    1    1   73 o     49.9   25.5   37.6728  31.9261    37.6728  31.9261    37.6728  31.9261       49.9     25.5       49.9       25.5     0.0     0.0 
1 1 1    1    1   74 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    1    1   75 o    273.0    6.1  747.7088  33.2031   747.7088  33.2031   747.7088  33.2031      273.0      6.1      273.0        6.1     0.0     0.0 
1 1 1    1    1   76 f     35.4   22.3    8.3008  32.5646     8.3008  32.5646     8.3008  32.5646       35.4     22.3       35.4       22.3     0.0     0.0 
1 1 1    1    1   77 o    411.6    4.6 1696.5520  37.6728  1696.5520  37.6728  1696.5520  37.6728      411.6      4.6      411.6        4.6     0.0     0.0 
1 1 1    1    1   78 o     15.2   11.4 -106.6331  29.3720  -106.6331  29.3720  -106.6331  29.3720       15.2     11.4       15.2       11.4     0.0     0.0 
1 1 1    1    1   79 o     68.9   23.7   63.2136  29.3720    63.2136  29.3720    63.2136  29.3720       68.9     23.7       68.9       23.7     0.0     0.0 
1 1 1    1    1   80 o     17.7   13.1  -76.6226  30.0105   -76.6226  30.0105   -76.6226  30.0105       17.7     13.1       17.7       13.1     0.0     0.0 
1 1 1    1    1   81 o    123.3   15.1  161.5460  36.3957   161.5460  36.3957   161.5460  36.3957      123.3     15.1      123.3       15.1     0.0     0.0 
1 1 1    1    1   82 o     16.5   12.3  -77.8996  28.0950   -77.8996  28.0950   -77.8996  28.0950       16.5     12.3       16.5       12.3     0.0     0.0 
1 1 1    2    0    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    0    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    0    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    0    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    0    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    0    5 o    716.8    4.8 5139.4609  68.9603  5139.4609  68.9603  5139.4609  68.9603      716.8      4.8      716.8        4.8     0.0     0.0 
1 1 1    2    0    6 o   1188.8    7.9 14134.3154 187.0868 14134.3154 187.0868 14134.3154 187.0868     1188.8      7.9     1188.8        7.9     0.0     0.0 
1 1 1    2    0    7 o   1077.8    5.1 11617.2627 109.1872 11617.2627 109.1872 11617.2627 109.1872     1077.8      5.1     1077.8        5.1     0.0     0.0 
1 1 1    2    0    8 o    503.9    2.6 2539.4006  26.1794  2539.4006  26.1794  2539.4006  26.1794      503.9      2.6      503.9        2.6     0.0     0.0 
1 1 1    2    0    9 o   2093.1    9.5 43816.6328 397.7990 43816.6328 397.7990 43816.6328 397.7990     2093.1      9.5     2093.1        9.5     0.0     0.0 
1 1 1    2    0   10 o    176.9    1.8  312.8756   6.3852   312.8756   6.3852   312.8756   6.3852      176.9      1.8      176.9        1.8     0.0     0.0 
1 1 1    2    0   11 o   1748.6    8.0 30579.4395 280.3110 30579.4395 280.3110 30579.4395 280.3110     1748.6      8.0     1748.6        8.0     0.0     0.0 
1 1 1    2    0   12 o   1931.0    8.8 37292.2148 340.9706 37292.2148 340.9706 37292.2148 340.9706     1931.0      8.8     1931.0        8.8     0.0     0.0 
1 1 1    2    0   13 o    731.7    3.8 5354.0039  55.5514  5354.0039  55.5514  5354.0039  55.5514      731.7      3.8      731.7        3.8     0.0     0.0 
1 1 1    2    0   14 o    518.5    2.8 2688.1760  29.3720  2688.1760  29.3720  2688.1760  29.3720      518.5      2.8      518.5        2.8     0.0     0.0 
1 1 1    2    0   15 o     93.4    3.1   87.4775   5.7467    87.4775   5.7467    87.4775   5.7467       93.4      3.1       93.4        3.1     0.0     0.0 
1 1 1    2    0   16 o    574.0    3.2 3294.7715  37.0343  3294.7715  37.0343  3294.7715  37.0343      574.0      3.2      574.0        3.2     0.0     0.0 
1 1 1    2    0   17 o   1209.9    5.7 14640.0244 138.5592 14640.0244 138.5592 14640.0244 138.5592     1209.9      5.7     1209.9        5.7     0.0     0.0 
1 1 1    2    0   18 o    298.5    2.2  891.3762  13.4090   891.3762  13.4090   891.3762  13.4090      298.5      2.2      298.5        2.2     0.0     0.0 
1 1 1    2    0   19 o    885.5    4.3 7842.3223  76.6226  7842.3223  76.6226  7842.3223  76.6226      885.5      4.3      885.5        4.3     0.0     0.0 
1 1 1    2    0   20 o    446.9    2.6 1997.2955  22.9868  1997.2955  22.9868  1997.2955  22.9868      446.9      2.6      446.9        2.6     0.0     0.0 
1 1 1    2    0   21 o   1663.1    7.7 27665.2285 254.7701 27665.2285 254.7701 27665.2285 254.7701     1663.1      7.7     1663.1        7.7     0.0     0.0 
1 1 1    2    0   22 o     10.8    7.9  -17.2401   8.9393   -17.2401   8.9393   -17.2401   8.9393       10.8      7.9       10.8        7.9     0.0     0.0 
1 1 1    2    0   23 o    294.0    2.4  864.5582  14.0475   864.5582  14.0475   864.5582  14.0475      294.0      2.4      294.0        2.4     0.0     0.0 
1 1 1    2    0   24 o    638.7    3.3 4079.5149  42.1424  4079.5149  42.1424  4079.5149  42.1424      638.7      3.3      638.7        3.3     0.0     0.0 
1 1 1    2    0   25 o      9.3    6.9  -34.4802  10.2163   -34.4802  10.2163   -34.4802  10.2163        9.3      6.9        9.3        6.9     0.0     0.0 
1 1 1    2    0   26 o    902.2    4.4 8141.1509  79.8152  8141.1509  79.8152  8141.1509  79.8152      902.2      4.4      902.2        4.4     0.0     0.0 
1 1 1    2    0   27 o    368.1    2.7 1355.5814  19.7942  1355.5814  19.7942  1355.5814  19.7942      368.1      2.7      368.1        2.7     0.0     0.0 
1 1 1    2    0   28 o   1133.3    5.5 12845.7783 123.8732 12845.7783 123.8732 12845.7783 123.8732     1133.3      5.5     1133.3        5.5     0.0     0.0 
1 1 1    2    0   29 o    546.4    3.4 2985.7271  37.6728  2985.7271  37.6728  2985.7271  37.6728      546.4      3.4      546.4        3.4     0.0     0.0 
1 1 1    2    0   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    0   31 o    357.3    2.9 1277.0432  21.0712  1277.0432  21.0712  1277.0432  21.0712      357.3      2.9      357.3        2.9     0.0     0.0 
1 1 1    2    0   32 o   1930.6   10.7 37281.3633 413.7620 37281.3633 413.7620 37281.3633 413.7620     1930.6     10.7     1930.6       10.7     0.0     0.0 
1 1 1    2    0   33 o    901.0    4.6 8118.1641  83.0078  8118.1641  83.0078  8118.1641  83.0078      901.0      4.6      901.0        4.6     0.0     0.0 
1 1 1    2    0   34 o     45.4   19.4   29.3720  17.8786    29.3720  17.8786    29.3720  17.8786       45.4     19.4       45.4       19.4     0.0     0.0 
1 1 1    2    0   35 o    594.4    4.0 3533.5789  47.2506  3533.5789  47.2506  3533.5789  47.2506      594.4      4.0      594.4        4.0     0.0     0.0 
1 1 1    2    0   36 o    631.4    3.7 3986.9292  46.6121  3986.9292  46.6121  3986.9292  46.6121      631.4      3.7      631.4        3.7     0.0     0.0 
1 1 1    2    0   37 o   1236.4    6.4 15289.4004 157.7148 15289.4004 157.7148 15289.4004 157.7148     1236.4      6.4     1236.4        6.4     0.0     0.0 
1 1 1    2    0   38 o    487.1    3.7 2373.3850  35.7572  2373.3850  35.7572  2373.3850  35.7572      487.1      3.7      487.1        3.7     0.0     0.0 
1 1 1    2    0   39 o   1666.9    7.6 27789.0996 254.7701 27789.0996 254.7701 27789.0996 254.7701     1666.9      7.6     1666.9        7.6     0.0     0.0 
1 1 1    2    0   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    0   41 o     36.6   21.1   17.2401  24.2638    17.2401  24.2638    17.2401  24.2638       36.6     21.1       36.6       21.1     0.0     0.0 
1 1 1    2    0   42 o    253.5    5.3  643.6298  26.8179   643.6298  26.8179   643.6298  26.8179      253.5      5.3      253.5        5.3     0.0     0.0 
1 1 1    2    0   43 o    948.8    5.1 9003.7930  97.6938  9003.7930  97.6938  9003.7930  97.6938      948.8      5.1      948.8        5.1     0.0     0.0 
1 1 1    2    0   44 f    288.7    5.2  834.5477  30.0105   834.5477  30.0105   834.5477  30.0105      288.7      5.2      288.7        5.2     0.0     0.0 
1 1 1    2    0   45 o    342.5    4.6 1173.6028  31.2876  1173.6028  31.2876  1173.6028  31.2876      342.5      4.6      342.5        4.6     0.0     0.0 
1 1 1    2    0   46 o    197.0    7.0  389.4982  27.4564   389.4982  27.4564   389.4982  27.4564      197.0      7.0      197.0        7.0     0.0     0.0 
1 1 1    2    0   47 o    565.4    4.2 3197.0779  47.8891  3197.0779  47.8891  3197.0779  47.8891      565.4      4.2      565.4        4.2     0.0     0.0 
1 1 1    2    0   48 o    199.1    6.6  397.7990  26.1794   397.7990  26.1794   397.7990  26.1794      199.1      6.6      199.1        6.6     0.0     0.0 
1 1 1    2    0   49 o    289.4    5.7  838.3789  33.2031   838.3789  33.2031   838.3789  33.2031      289.4      5.7      289.4        5.7     0.0     0.0 
1 1 1    2    0   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    0   51 f     47.3   23.6   33.2031  26.8179    33.2031  26.8179    33.2031  26.8179       47.3     23.6       47.3       23.6     0.0     0.0 
1 1 1    2    0   52 o    338.2    4.6 1144.8693  31.2876  1144.8693  31.2876  1144.8693  31.2876      338.2      4.6      338.2        4.6     0.0     0.0 
1 1 1    2    0   53 o    345.1    4.8 1191.4814  33.2031  1191.4814  33.2031  1191.4814  33.2031      345.1      4.8      345.1        4.8     0.0     0.0 
1 1 1    2    0   54 o    724.1    4.2 5244.1782  61.2981  5244.1782  61.2981  5244.1782  61.2981      724.1      4.2      724.1        4.2     0.0     0.0 
1 1 1    2    0   55 o    324.8    4.9 1056.1147  31.9261  1056.1147  31.9261  1056.1147  31.9261      324.8      4.9      324.8        4.9     0.0     0.0 
1 1 1    2    0   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    0   57 o   1151.8    5.7 13272.3115 130.2584 13272.3115 130.2584 13272.3115 130.2584     1151.8      5.7     1151.8        5.7     0.0     0.0 
1 1 1    2    0   58 o     91.1   19.6   93.8627  31.2876    93.8627  31.2876    93.8627  31.2876       91.1     19.6       91.1       19.6     0.0     0.0 
1 1 1    2    0   59 o    364.6    4.6 1330.0405  33.8416  1330.0405  33.8416  1330.0405  33.8416      364.6      4.6      364.6        4.6     0.0     0.0 
1 1 1    2    0   60 o     18.2   13.3  -52.3588  26.1794   -52.3588  26.1794   -52.3588  26.1794       18.2     13.3       18.2       13.3     0.0     0.0 
1 1 1    2    0   61 o    713.5    4.3 5092.2100  61.2981  5092.2100  61.2981  5092.2100  61.2981      713.5      4.3      713.5        4.3     0.0     0.0 
1 1 1    2    0   62 o    121.4   13.4  153.2452  31.9261   153.2452  31.9261   153.2452  31.9261      121.4     13.4      121.4       13.4     0.0     0.0 
1 1 1    2    0   63 o     24.4   17.1  -27.4564  30.0105   -27.4564  30.0105   -27.4564  30.0105       24.4     17.1       24.4       17.1     0.0     0.0 
1 1 1    2    0   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    0   65 o    122.1   12.3  153.8837  29.3720   153.8837  29.3720   153.8837  29.3720      122.1     12.3      122.1       12.3     0.0     0.0 
1 1 1    2    0   66 f    345.5    4.7 1194.6740  32.5646  1194.6740  32.5646  1194.6740  32.5646      345.5      4.7      345.5        4.7     0.0     0.0 
1 1 1    2    0   67 o     17.7   13.0  -60.0210  26.8179   -60.0210  26.8179   -60.0210  26.8179       17.7     13.0       17.7       13.0     0.0     0.0 
1 1 1    2    0   68 o    302.5    5.1  916.2786  30.6490   916.2786  30.6490   916.2786  30.6490      302.5      5.1      302.5        5.1     0.0     0.0 
1 1 1    2    0   69 o    105.5   14.5  114.9339  30.0105   114.9339  30.0105   114.9339  30.0105      105.5     14.5      105.5       14.5     0.0     0.0 
1 1 1    2    0   70 o    228.0    6.5  521.6721  29.3720   521.6721  29.3720   521.6721  29.3720      228.0      6.5      228.0        6.5     0.0     0.0 
1 1 1    2    0   71 o     35.8   22.1   10.8549  30.6490    10.8549  30.6490    10.8549  30.6490       35.8     22.1       35.8       22.1     0.0     0.0 
1 1 1    2    0   72 o    100.4   15.4  106.6331  29.3720   106.6331  29.3720   106.6331  29.3720      100.4     15.4      100.4       15.4     0.0     0.0 
1 1 1    2    0   73 o    423.5    4.5 1795.5229  38.3113  1795.5229  38.3113  1795.5229  38.3113      423.5      4.5      423.5        4.5     0.0     0.0 
1 1 1    2    0   74 o    114.3   13.7  137.2822  30.6490   137.2822  30.6490   137.2822  30.6490      114.3     13.7      114.3       13.7     0.0     0.0 
1 1 1    2    0   75 o     37.2   22.9   12.7704  32.5646    12.7704  32.5646    12.7704  32.5646       37.2     22.9       37.2       22.9     0.0     0.0 
1 1 1    2    0   76 o    172.6    8.7  301.3822  30.0105   301.3822  30.0105   301.3822  30.0105      172.6      8.7      172.6        8.7     0.0     0.0 
1 1 1    2    0   77 o     98.8   18.7  108.5487  33.2031   108.5487  33.2031   108.5487  33.2031       98.8     18.7       98.8       18.7     0.0     0.0 
1 1 1    2    0   78 f    113.4   17.1  136.6436  37.0343   136.6436  37.0343   136.6436  37.0343      113.4     17.1      113.4       17.1     0.0     0.0 
1 1 1    2    0   79 o    316.4    5.4 1003.7560  33.8416  1003.7560  33.8416  1003.7560  33.8416      316.4      5.4      316.4        5.4     0.0     0.0 
1 1 1    2    0   80 o     98.1   16.6  104.7175  30.0105   104.7175  30.0105   104.7175  30.0105       98.1     16.6       98.1       16.6     0.0     0.0 
1 1 1    2    0   81 o     76.8   23.4   75.3456  31.2876    75.3456  31.2876    75.3456  31.2876       76.8     23.4       76.8       23.4     0.0     0.0 
1 1 1    2    0   82 o    225.8    8.2  515.2869  37.0343   515.2869  37.0343   515.2869  37.0343      225.8      8.2      225.8        8.2     0.0     0.0 
1 1 1    2    1    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    1    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    1    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    1    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    1    4 o    274.3    2.1    0.0000   0.0000          ?        ?   752.1785  11.4934          ?        ?      274.3        2.1       ?       ? 
1 1 1    2    1    5 o    525.1    2.6    0.0000   0.0000          ?        ?  2757.7749  27.4564          ?        ?      525.1        2.6       ?       ? 
1 1 1    2    1    6 o    361.9    1.5    0.0000   0.0000          ?        ?  1309.6079  10.8549          ?        ?      361.9        1.5       ?       ? 
1 1 1    2    1    7 o    746.9    2.6    0.0000   0.0000          ?        ?  5578.1250  38.9498          ?        ?      746.9        2.6       ?       ? 
1 1 1    2    1    8 o    645.7    2.3    0.0000   0.0000          ?        ?  4169.5464  29.3720          ?        ?      645.7        2.3       ?       ? 
1 1 1    2    1    9 o    891.4    3.0    0.0000   0.0000          ?        ?  7945.7632  54.2743          ?        ?      891.4        3.0       ?       ? 
1 1 1    2    1   10 o   1934.6    6.3    0.0000   0.0000          ?        ? 37428.8594 241.9997          ?        ?     1934.6        6.3       ?       ? 
1 1 1    2    1   11 o    804.8    2.8    0.0000   0.0000          ?        ?  6476.5249  44.6965          ?        ?      804.8        2.8       ?       ? 
1 1 1    2    1   12 o   1138.0    3.8    0.0000   0.0000          ?        ? 12951.1348  87.4775          ?        ?     1138.0        3.8       ?       ? 
1 1 1    2    1   13 o   1393.1    4.6    0.0000   0.0000          ?        ? 19408.5039 127.0658          ?        ?     1393.1        4.6       ?       ? 
1 1 1    2    1   14 o   1189.9    4.0    0.0000   0.0000          ?        ? 14158.5781  95.1397          ?        ?     1189.9        4.0       ?       ? 
1 1 1    2    1   15 o   1186.8    4.0    0.0000   0.0000          ?        ? 14085.7871  93.8627          ?        ?     1186.8        4.0       ?       ? 
1 1 1    2    1   16 o   1072.8    3.6    0.0000   0.0000          ?        ? 11508.7139  77.8996          ?        ?     1072.8        3.6       ?       ? 
1 1 1    2    1   17 o   1764.7    5.7    0.0000   0.0000          ?        ? 31145.1699 200.4958          ?        ?     1764.7        5.7       ?       ? 
1 1 1    2    1   18 o   1456.0    4.8    0.0000   0.0000          ?        ? 21201.4707 138.5592          ?        ?     1456.0        4.8       ?       ? 
1 1 1    2    1   19 o   2185.5    7.0    0.0000   0.0000          ?        ? 47771.6328 304.5748          ?        ?     2185.5        7.0       ?       ? 
1 1 1    2    1   20 o    447.1    1.8    0.0000   0.0000          ?        ?  1998.5726  15.9630          ?        ?      447.1        1.8       ?       ? 
1 1 1    2    1   21 o   1191.6    4.0    0.0000   0.0000          ?        ? 14198.8047  94.5012          ?        ?     1191.6        4.0       ?       ? 
1 1 1    2    1   22 o   1365.5    4.5    0.0000   0.0000          ?        ? 18646.7480 121.9576          ?        ?     1365.5        4.5       ?       ? 
1 1 1    2    1   23 o   1096.8    3.7    0.0000   0.0000          ?        ? 12031.0244  80.4537          ?        ?     1096.8        3.7       ?       ? 
1 1 1    2    1   24 o    468.9    1.9    0.0000   0.0000          ?        ?  2198.4299  17.8786          ?        ?      468.9        1.9       ?       ? 
1 1 1    2    1   25 o    331.7    1.6    0.0000   0.0000          ?        ?  1100.1727  10.8549          ?        ?      331.7        1.6       ?       ? 
1 1 1    2    1   26 o    710.9    2.6    0.0000   0.0000          ?        ?  5054.5371  37.0343          ?        ?      710.9        2.6       ?       ? 
1 1 1    2    1   27 o    394.1    2.1    0.0000   0.0000          ?        ?  1552.8845  16.6016          ?        ?      394.1        2.1       ?       ? 
1 1 1    2    1   28 o    916.1    3.2    0.0000   0.0000          ?        ?  8392.7285  58.1055          ?        ?      916.1        3.2       ?       ? 
1 1 1    2    1   29 o   1203.2    4.1    0.0000   0.0000          ?        ? 14479.1172  97.6938          ?        ?     1203.2        4.1       ?       ? 
1 1 1    2    1   30 o   1119.9    3.8    0.0000   0.0000          ?        ? 12542.4805  85.5619          ?        ?     1119.9        3.8       ?       ? 
1 1 1    2    1   31 o    907.0    3.4    0.0000   0.0000          ?        ?  8226.7129  61.2981          ?        ?      907.0        3.4       ?       ? 
1 1 1    2    1   32 o    585.5    3.2    0.0000   0.0000          ?        ?  3428.2227  37.6728          ?        ?      585.5        3.2       ?       ? 
1 1 1    2    1   33 o   2070.8    7.0    0.0000   0.0000          ?        ? 42889.4961 288.6118          ?        ?     2070.8        7.0       ?       ? 
1 1 1    2    1   34 o     28.6   12.8    0.0000   0.0000          ?        ?    -7.6623  15.3245          ?        ?       28.6       12.8       ?       ? 
1 1 1    2    1   35 o    832.2    3.3    0.0000   0.0000          ?        ?  6925.4053  54.9129          ?        ?      832.2        3.3       ?       ? 
1 1 1    2    1   36 o    858.8    3.1    0.0000   0.0000          ?        ?  7376.2017  53.6358          ?        ?      858.8        3.1       ?       ? 
1 1 1    2    1   37 o   1204.3    4.1    0.0000   0.0000          ?        ? 14504.0186  98.3323          ?        ?     1204.3        4.1       ?       ? 
1 1 1    2    1   38 o   1256.0    4.3    0.0000   0.0000          ?        ? 15775.3164 107.9102          ?        ?     1256.0        4.3       ?       ? 
1 1 1    2    1   39 o    863.8    3.2    0.0000   0.0000          ?        ?  7461.1250  54.9129          ?        ?      863.8        3.2       ?       ? 
1 1 1    2    1   40 o    963.4    3.3    0.0000   0.0000          ?        ?  9282.1885  64.4907          ?        ?      963.4        3.3       ?       ? 
1 1 1    2    1   41 o    457.0    3.0    0.0000   0.0000          ?        ?  2088.6042  27.4564          ?        ?      457.0        3.0       ?       ? 
1 1 1    2    1   42 o    647.8    3.0    0.0000   0.0000          ?        ?  4197.0024  38.3113          ?        ?      647.8        3.0       ?       ? 
1 1 1    2    1   43 o    335.0    3.0    0.0000   0.0000          ?        ?  1122.5210  20.4327          ?        ?      335.0        3.0       ?       ? 
1 1 1    2    1   44 o   1353.9    4.6    0.0000   0.0000          ?        ? 18333.2324 125.7888          ?        ?     1353.9        4.6       ?       ? 
1 1 1    2    1   45 o   1406.3    4.7    0.0000   0.0000          ?        ? 19780.1230 131.5355          ?        ?     1406.3        4.7       ?       ? 
1 1 1    2    1   46 o    714.9    2.8    0.0000   0.0000          ?        ?  5110.7271  40.2269          ?        ?      714.9        2.8       ?       ? 
1 1 1    2    1   47 o   1520.2    5.0    0.0000   0.0000          ?        ? 23115.1211 153.2452          ?        ?     1520.2        5.0       ?       ? 
1 1 1    2    1   48 f    552.3    2.8    0.0000   0.0000          ?        ?  3050.8562  31.2876          ?        ?      552.3        2.8       ?       ? 
1 1 1    2    1   49 o    335.8    3.2    0.0000   0.0000          ?        ?  1127.6293  21.7097          ?        ?      335.8        3.2       ?       ? 
1 1 1    2    1   50 o    381.1    2.7    0.0000   0.0000          ?        ?  1452.6367  20.4327          ?        ?      381.1        2.7       ?       ? 
1 1 1    2    1   51 o    282.9    3.5    0.0000   0.0000          ?        ?   800.7061  19.7942          ?        ?      282.9        3.5       ?       ? 
1 1 1    2    1   52 o    455.2    3.1    0.0000   0.0000          ?        ?  2072.6414  28.0950          ?        ?      455.2        3.1       ?       ? 
1 1 1    2    1   53 o    681.6    2.9    0.0000   0.0000          ?        ?  4645.8833  38.9498          ?        ?      681.6        2.9       ?       ? 
1 1 1    2    1   54 o    880.3    3.4    0.0000   0.0000          ?        ?  7750.3760  59.3825          ?        ?      880.3        3.4       ?       ? 
1 1 1    2    1   55 o    770.9    3.2    0.0000   0.0000          ?        ?  5943.3594  49.8047          ?        ?      770.9        3.2       ?       ? 
1 1 1    2    1   56 o    153.9    6.4    0.0000   0.0000          ?        ?   236.8915  19.7942          ?        ?      153.9        6.4       ?       ? 
1 1 1    2    1   57 o    251.5    4.2    0.0000   0.0000          ?        ?   632.7749  21.0712          ?        ?      251.5        4.2       ?       ? 
1 1 1    2    1   58 o     50.7   17.0    0.0000   0.0000          ?        ?    24.2638  20.4327          ?        ?       50.7       17.0       ?       ? 
1 1 1    2    1   59 o    401.7    2.9    0.0000   0.0000          ?        ?  1614.1827  23.6253          ?        ?      401.7        2.9       ?       ? 
1 1 1    2    1   60 o     99.4    9.6    0.0000   0.0000          ?        ?    98.9709  19.1556          ?        ?       99.4        9.6       ?       ? 
1 1 1    2    1   61 o     23.6   11.6    0.0000   0.0000          ?        ?   -37.0343  18.5171          ?        ?       23.6       11.6       ?       ? 
1 1 1    2    1   62 o    548.1    3.0    0.0000   0.0000          ?        ?  3005.5215  32.5646          ?        ?      548.1        3.0       ?       ? 
1 1 1    2    1   63 o    412.0    2.9    0.0000   0.0000          ?        ?  1697.8290  24.2638          ?        ?      412.0        2.9       ?       ? 
1 1 1    2    1   64 o     27.8   13.3    0.0000   0.0000          ?        ?   -26.8179  20.4327          ?        ?       27.8       13.3       ?       ? 
1 1 1    2    1   65 o    375.3    3.3    0.0000   0.0000          ?        ?  1409.2172  24.9023          ?        ?      375.3        3.3       ?       ? 
1 1 1    2    1   66 o    333.0    3.2    0.0000   0.0000          ?        ?  1109.1121  21.0712          ?        ?      333.0        3.2       ?       ? 
1 1 1    2    1   67 o    264.5    4.2    0.0000   0.0000          ?        ?   700.4582  22.3483          ?        ?      264.5        4.2       ?       ? 
1 1 1    2    1   68 o    364.7    3.2    0.0000   0.0000          ?        ?  1330.6791  23.6253          ?        ?      364.7        3.2       ?       ? 
1 1 1    2    1   69 o    203.9    5.0    0.0000   0.0000          ?        ?   416.3161  20.4327          ?        ?      203.9        5.0       ?       ? 
1 1 1    2    1   70 o    389.1    3.0    0.0000   0.0000          ?        ?  1514.5732  23.6253          ?        ?      389.1        3.0       ?       ? 
1 1 1    2    1   71 o    313.8    4.0    0.0000   0.0000          ?        ?   985.8774  24.9023          ?        ?      313.8        4.0       ?       ? 
1 1 1    2    1   72 o    162.3    6.9    0.0000   0.0000          ?        ?   264.3480  22.3483          ?        ?      162.3        6.9       ?       ? 
1 1 1    2    1   73 o    179.1    6.2    0.0000   0.0000          ?        ?   321.8149  22.3483          ?        ?      179.1        6.2       ?       ? 
1 1 1    2    1   74 o     31.8   14.7    0.0000   0.0000          ?        ?   -16.6016  21.7097          ?        ?       31.8       14.7       ?       ? 
1 1 1    2    1   75 o    396.7    3.2    0.0000   0.0000          ?        ?  1575.2328  25.5409          ?        ?      396.7        3.2       ?       ? 
1 1 1    2    1   76 o    218.9    5.0    0.0000   0.0000          ?        ?   480.1682  21.7097          ?        ?      218.9        5.0       ?       ? 
1 1 1    2    1   77 o    274.6    4.1    0.0000   0.0000          ?        ?   755.3711  22.3483          ?        ?      274.6        4.1       ?       ? 
1 1 1    2    1   78 o    137.3    8.6    0.0000   0.0000          ?        ?   190.2794  23.6253          ?        ?      137.3        8.6       ?       ? 
1 1 1    2    1   79 o    264.7    4.1    0.0000   0.0000          ?        ?   702.3738  21.7097          ?        ?      264.7        4.1       ?       ? 
1 1 1    2    1   80 o     23.0   11.4    0.0000   0.0000          ?        ?   -53.6358  21.0712          ?        ?       23.0       11.4       ?       ? 
1 1 1    2    1   81 o    156.1    7.4    0.0000   0.0000          ?        ?   245.8308  22.9868          ?        ?      156.1        7.4       ?       ? 
1 1 1    2    1   82 o     60.3   17.2    0.0000   0.0000          ?        ?    39.5883  21.7097          ?        ?       60.3       17.2       ?       ? 
1 1 1    2    2    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    2    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    2    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    2    3 o    427.8    4.8 1830.6416  40.8654  1830.6416  40.8654  1830.6416  40.8654      427.8      4.8      427.8        4.8     0.0     0.0 
1 1 1    2    2    4 o    535.0    4.2 2863.1309  44.6965  2863.1309  44.6965  2863.1309  44.6965      535.0      4.2      535.0        4.2     0.0     0.0 
1 1 1    2    2    5 o    110.4    1.7  121.9576   3.8311   121.9576   3.8311   121.9576   3.8311      110.4      1.7      110.4        1.7     0.0     0.0 
1 1 1    2    2    6 o   1392.7    6.4 19397.0098 178.7861 19397.0098 178.7861 19397.0098 178.7861     1392.7      6.4     1392.7        6.4     0.0     0.0 
1 1 1    2    2    7 o    901.1    4.3 8121.3569  77.8996  8121.3569  77.8996  8121.3569  77.8996      901.1      4.3      901.1        4.3     0.0     0.0 
1 1 1    2    2    8 o    480.6    2.5 2309.5327  24.2638  2309.5327  24.2638  2309.5327  24.2638      480.6      2.5      480.6        2.5     0.0     0.0 
1 1 1    2    2    9 o   2164.0    9.7 46837.4766 420.7858 46837.4766 420.7858 46837.4766 420.7858     2164.0      9.7     2164.0        9.7     0.0     0.0 
1 1 1    2    2   10 o   1536.7    7.1 23617.0000 218.3744 23617.0000 218.3744 23617.0000 218.3744     1536.7      7.1     1536.7        7.1     0.0     0.0 
1 1 1    2    2   11 o    786.6    3.8 6188.5518  60.0210  6188.5518  60.0210  6188.5518  60.0210      786.6      3.8      786.6        3.8     0.0     0.0 
1 1 1    2    2   12 o   2007.1    9.5 40291.3555 381.8359 40291.3555 381.8359 40291.3555 381.8359     2007.1      9.5     2007.1        9.5     0.0     0.0 
1 1 1    2    2   13 o    153.5    2.1  235.6145   6.3852   235.6145   6.3852   235.6145   6.3852      153.5      2.1      153.5        2.1     0.0     0.0 
1 1 1    2    2   14 o    119.2    2.7  142.3903   6.3852   142.3903   6.3852   142.3903   6.3852      119.2      2.7      119.2        2.7     0.0     0.0 
1 1 1    2    2   15 o    900.4    4.4 8107.9478  79.1767  8107.9478  79.1767  8107.9478  79.1767      900.4      4.4      900.4        4.4     0.0     0.0 
1 1 1    2    2   16 o   2042.8    9.3 41738.8789 378.6433 41738.8789 378.6433 41738.8789 378.6433     2042.8      9.3     2042.8        9.3     0.0     0.0 
1 1 1    2    2   17 o    261.7    2.9  685.1337  15.3245   685.1337  15.3245   685.1337  15.3245      261.7      2.9      261.7        2.9     0.0     0.0 
1 1 1    2    2   18 o    233.9    2.2  547.2130  10.2163   547.2130  10.2163   547.2130  10.2163      233.9      2.2      233.9        2.2     0.0     0.0 
1 1 1    2    2   19 f    658.7    3.4 4338.7544  44.6965  4338.7544  44.6965  4338.7544  44.6965      658.7      3.4      658.7        3.4     0.0     0.0 
1 1 1    2    2   20 o    110.6    3.5  122.5962   7.6623   122.5962   7.6623   122.5962   7.6623      110.6      3.5      110.6        3.5     0.0     0.0 
1 1 1    2    2   21 o    477.9    3.1 2284.6304  30.0105  2284.6304  30.0105  2284.6304  30.0105      477.9      3.1      477.9        3.1     0.0     0.0 
1 1 1    2    2   22 o    179.2    2.5  321.1764   8.9393   321.1764   8.9393   321.1764   8.9393      179.2      2.5      179.2        2.5     0.0     0.0 
1 1 1    2    2   23 o    240.5    2.5  578.5006  12.1319   578.5006  12.1319   578.5006  12.1319      240.5      2.5      240.5        2.5     0.0     0.0 
1 1 1    2    2   24 o    373.2    2.5 1392.6157  18.5171  1392.6157  18.5171  1392.6157  18.5171      373.2      2.5      373.2        2.5     0.0     0.0 
1 1 1    2    2   25 o    650.9    3.5 4237.2295  45.9736  4237.2295  45.9736  4237.2295  45.9736      650.9      3.5      650.9        3.5     0.0     0.0 
1 1 1    2    2   26 o    313.8    2.4  984.6003  15.3245   984.6003  15.3245   984.6003  15.3245      313.8      2.4      313.8        2.4     0.0     0.0 
1 1 1    2    2   27 o    409.1    2.5 1673.5652  20.4327  1673.5652  20.4327  1673.5652  20.4327      409.1      2.5      409.1        2.5     0.0     0.0 
1 1 1    2    2   28 o    249.5    2.9  622.5586  14.6860   622.5586  14.6860   622.5586  14.6860      249.5      2.9      249.5        2.9     0.0     0.0 
1 1 1    2    2   29 o    468.4    3.0 2194.5989  28.0950  2194.5989  28.0950  2194.5989  28.0950      468.4      3.0      468.4        3.0     0.0     0.0 
1 1 1    2    2   30 o   1048.4    5.1 10992.1494 106.6331 10992.1494 106.6331 10992.1494 106.6331     1048.4      5.1     1048.4        5.1     0.0     0.0 
1 1 1    2    2   31 o   2216.6   10.0 49145.7305 443.1340 49145.7305 443.1340 49145.7305 443.1340     2216.6     10.0     2216.6       10.0     0.0     0.0 
1 1 1    2    2   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    2   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    2   34 o     51.5   32.2   17.8786  66.4062    17.8786  66.4062    17.8786  66.4062       51.5     32.2       51.5       32.2     0.0     0.0 
1 1 1    2    2   35 o   1263.0    6.4 15953.4629 162.1845 15953.4629 162.1845 15953.4629 162.1845     1263.0      6.4     1263.0        6.4     0.0     0.0 
1 1 1    2    2   36 o    108.6   14.5  120.6806  31.2876   120.6806  31.2876   120.6806  31.2876      108.6     14.5      108.6       14.5     0.0     0.0 
1 1 1    2    2   37 o   2568.6   12.1 65995.6797 619.3660 65995.6797 619.3660 65995.6797 619.3660     2568.6     12.1     2568.6       12.1     0.0     0.0 
1 1 1    2    2   38 o    988.8    4.9 9777.6816  97.6938  9777.6816  97.6938  9777.6816  97.6938      988.8      4.9      988.8        4.9     0.0     0.0 
1 1 1    2    2   39 o   1373.1    6.6 18856.1836 181.9787 18856.1836 181.9787 18856.1836 181.9787     1373.1      6.6     1373.1        6.6     0.0     0.0 
1 1 1    2    2   40 o    377.0    4.2 1421.9877  31.9261  1421.9877  31.9261  1421.9877  31.9261      377.0      4.2      377.0        4.2     0.0     0.0 
1 1 1    2    2   41 o    642.4    3.9 4126.7651  49.8047  4126.7651  49.8047  4126.7651  49.8047      642.4      3.9      642.4        3.9     0.0     0.0 
1 1 1    2    2   42 o    490.2    4.4 2404.0339  43.4195  2404.0339  43.4195  2404.0339  43.4195      490.2      4.4      490.2        4.4     0.0     0.0 
1 1 1    2    2   43 o    702.1    4.0 4930.0254  56.8284  4930.0254  56.8284  4930.0254  56.8284      702.1      4.0      702.1        4.0     0.0     0.0 
1 1 1    2    2   44 o   1202.2    5.8 14455.4902 138.5592 14455.4902 138.5592 14455.4902 138.5592     1202.2      5.8     1202.2        5.8     0.0     0.0 
1 1 1    2    2   45 o   1925.5    8.9 37087.2500 342.2476 37087.2500 342.2476 37087.2500 342.2476     1925.5      8.9     1925.5        8.9     0.0     0.0 
1 1 1    2    2   46 o    637.8    4.0 4068.0212  51.0817  4068.0212  51.0817  4068.0212  51.0817      637.8      4.0      637.8        4.0     0.0     0.0 
1 1 1    2    2   47 o    215.5    8.5  466.7593  36.3957   466.7593  36.3957   466.7593  36.3957      215.5      8.5      215.5        8.5     0.0     0.0 
1 1 1    2    2   48 o   1483.7    7.0 22019.4180 206.2425 22019.4180 206.2425 22019.4180 206.2425     1483.7      7.0     1483.7        7.0     0.0     0.0 
1 1 1    2    2   49 o    244.6    6.4  599.5718  31.2876   599.5718  31.2876   599.5718  31.2876      244.6      6.4      244.6        6.4     0.0     0.0 
1 1 1    2    2   50 o    659.5    4.8 4350.8867  63.8522  4350.8867  63.8522  4350.8867  63.8522      659.5      4.8      659.5        4.8     0.0     0.0 
1 1 1    2    2   51 o    634.0    4.0 4020.1321  50.4432  4020.1321  50.4432  4020.1321  50.4432      634.0      4.0      634.0        4.0     0.0     0.0 
1 1 1    2    2   52 o    476.0    3.9 2266.1133  37.0343  2266.1133  37.0343  2266.1133  37.0343      476.0      3.9      476.0        3.9     0.0     0.0 
1 1 1    2    2   53 o     18.9   13.8  -49.8047  26.8179   -49.8047  26.8179   -49.8047  26.8179       18.9     13.8       18.9       13.8     0.0     0.0 
1 1 1    2    2   54 o     46.8   23.3   32.5646  26.1794    32.5646  26.1794    32.5646  26.1794       46.8     23.3       46.8       23.3     0.0     0.0 
1 1 1    2    2   55 o     28.9   19.5  -11.4934  31.2876   -11.4934  31.2876   -11.4934  31.2876       28.9     19.5       28.9       19.5     0.0     0.0 
1 1 1    2    2   56 o    334.7    4.8 1121.2440  31.9261  1121.2440  31.9261  1121.2440  31.9261      334.7      4.8      334.7        4.8     0.0     0.0 
1 1 1    2    2   57 o     25.2   17.3  -15.3245  26.8179   -15.3245  26.8179   -15.3245  26.8179       25.2     17.3       25.2       17.3     0.0     0.0 
1 1 1    2    2   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    2    2   59 o    393.9    4.6 1552.8845  36.3957  1552.8845  36.3957  1552.8845  36.3957      393.9      4.6      393.9        4.6     0.0     0.0 
1 1 1    2    2   60 o    344.4    4.5 1187.0117  30.6490  1187.0117  30.6490  1187.0117  30.6490      344.4      4.5      344.4        4.5     0.0     0.0 
1 1 1    2    2   61 o    354.2    4.2 1255.3335  30.0105  1255.3335  30.0105  1255.3335  30.0105      354.2      4.2      354.2        4.2     0.0     0.0 
1 1 1    2    2   62 o    415.7    4.3 1729.1165  35.7572  1729.1165  35.7572  1729.1165  35.7572      415.7      4.3      415.7        4.3     0.0     0.0 
1 1 1    2    2   63 o    172.6    8.0  300.1052  27.4564   300.1052  27.4564   300.1052  27.4564      172.6      8.0      172.6        8.0     0.0     0.0 
1 1 1    2    2   64 o    298.8    5.2  893.9303  31.2876   893.9303  31.2876   893.9303  31.2876      298.8      5.2      298.8        5.2     0.0     0.0 
1 1 1    2    2   65 o     16.0   11.9  -77.2611  26.8179   -77.2611  26.8179   -77.2611  26.8179       16.0     11.9       16.0       11.9     0.0     0.0 
1 1 1    2    2   66 o     96.8   16.5  100.8864  29.3720   100.8864  29.3720   100.8864  29.3720       96.8     16.5       96.8       16.5     0.0     0.0 
1 1 1    2    2   67 o     23.2   16.5  -31.2876  29.3720   -31.2876  29.3720   -31.2876  29.3720       23.2     16.5       23.2       16.5     0.0     0.0 
1 1 1    2    2   68 o     19.1   13.9  -48.5276  26.8179   -48.5276  26.8179   -48.5276  26.8179       19.1     13.9       19.1       13.9     0.0     0.0 
1 1 1    2    2   69 o    767.8    4.2 5898.6626  64.4907  5898.6626  64.4907  5898.6626  64.4907      767.8      4.2      767.8        4.2     0.0     0.0 
1 1 1    2    2   70 f    120.2   13.6  150.6911  31.9261   150.6911  31.9261   150.6911  31.9261      120.2     13.6      120.2       13.6     0.0     0.0 
1 1 1    2    2   71 o    135.3   11.5  187.7254  30.6490   187.7254  30.6490   187.7254  30.6490      135.3     11.5      135.3       11.5     0.0     0.0 
1 1 1    2    2   72 o    445.9    4.3 1990.2720  38.3113  1990.2720  38.3113  1990.2720  38.3113      445.9      4.3      445.9        4.3     0.0     0.0 
1 1 1    2    2   73 o    371.1    4.7 1379.2067  35.1187  1379.2067  35.1187  1379.2067  35.1187      371.1      4.7      371.1        4.7     0.0     0.0 
1 1 1    2    2   74 o    193.5    8.3  377.3663  31.9261   377.3663  31.9261   377.3663  31.9261      193.5      8.3      193.5        8.3     0.0     0.0 
1 1 1    2    2   75 o    195.8    8.0  386.3056  31.2876   386.3056  31.2876   386.3056  31.2876      195.8      8.0      195.8        8.0     0.0     0.0 
1 1 1    2    2   76 o    270.9    6.0  736.2155  32.5646   736.2155  32.5646   736.2155  32.5646      270.9      6.0      270.9        6.0     0.0     0.0 
1 1 1    2    2   77 o    214.5    7.3  462.9282  31.2876   462.9282  31.2876   462.9282  31.2876      214.5      7.3      214.5        7.3     0.0     0.0 
1 1 1    2    2   78 o     27.5   18.6  -11.4934  29.3720   -11.4934  29.3720   -11.4934  29.3720       27.5     18.6       27.5       18.6     0.0     0.0 
1 1 1    2    2   79 o     79.3   21.5   76.6226  29.3720    76.6226  29.3720    76.6226  29.3720       79.3     21.5       79.3       21.5     0.0     0.0 
1 1 1    2    2   80 o     89.1   18.7   90.6701  29.3720    90.6701  29.3720    90.6701  29.3720       89.1     18.7       89.1       18.7     0.0     0.0 
1 1 1    2    2   81 o    167.7    8.8  285.4192  29.3720   285.4192  29.3720   285.4192  29.3720      167.7      8.8      167.7        8.8     0.0     0.0 
1 1 1    2    2   82 o     77.8   28.5   84.9234  40.8654    84.9234  40.8654    84.9234  40.8654       77.8     28.5       77.8       28.5     0.0     0.0 
1 1 1    3    0    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    0    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    0    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    0    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    0    4 o   1652.4   18.4 27326.1719 609.1497 27326.1719 609.1497 27326.1719 609.1497     1652.4     18.4     1652.4       18.4     0.0     0.0 
1 1 1    3    0    5 o    366.1    2.8 1340.2568  20.4327  1340.2568  20.4327  1340.2568  20.4327      366.1      2.8      366.1        2.8     0.0     0.0 
1 1 1    3    0    6 o    177.9    1.4  316.7067   5.1082   316.7067   5.1082   316.7067   5.1082      177.9      1.4      177.9        1.4     0.0     0.0 
1 1 1    3    0    7 f    626.3    3.2 3922.4382  39.5883  3922.4382  39.5883  3922.4382  39.5883      626.3      3.2      626.3        3.2     0.0     0.0 
1 1 1    3    0    8 o    216.3    1.6  468.0364   7.0237   468.0364   7.0237   468.0364   7.0237      216.3      1.6      216.3        1.6     0.0     0.0 
1 1 1    3    0    9 o    966.3    4.9 9337.7402  94.5012  9337.7402  94.5012  9337.7402  94.5012      966.3      4.9      966.3        4.9     0.0     0.0 
1 1 1    3    0   10 o    630.5    3.2 3976.0742  40.8654  3976.0742  40.8654  3976.0742  40.8654      630.5      3.2      630.5        3.2     0.0     0.0 
1 1 1    3    0   11 o   2124.6    9.6 45146.0312 409.9309 45146.0312 409.9309 45146.0312 409.9309     2124.6      9.6     2124.6        9.6     0.0     0.0 
1 1 1    3    0   12 o    106.8    2.4  114.2954   5.1082   114.2954   5.1082   114.2954   5.1082      106.8      2.4      106.8        2.4     0.0     0.0 
1 1 1    3    0   13 o   3186.8   18.6 101614.3281 1184.4576 101614.3281 1184.4576 101614.3281 1184.4576     3186.8     18.6     3186.8       18.6     0.0     0.0 
1 1 1    3    0   14 o    765.9    3.8 5866.0981  58.1055  5866.0981  58.1055  5866.0981  58.1055      765.9      3.8      765.9        3.8     0.0     0.0 
1 1 1    3    0   15 o    336.8    2.3 1134.6530  15.3245  1134.6530  15.3245  1134.6530  15.3245      336.8      2.3      336.8        2.3     0.0     0.0 
1 1 1    3    0   16 o   1389.4    6.5 19305.7012 181.9787 19305.7012 181.9787 19305.7012 181.9787     1389.4      6.5     1389.4        6.5     0.0     0.0 
1 1 1    3    0   17 o   2999.6   13.4 90007.2891 805.1758 90007.2891 805.1758 90007.2891 805.1758     2999.6     13.4     2999.6       13.4     0.0     0.0 
1 1 1    3    0   18 o    432.3    2.5 1868.9529  21.7097  1868.9529  21.7097  1868.9529  21.7097      432.3      2.5      432.3        2.5     0.0     0.0 
1 1 1    3    0   19 o   2164.9    9.8 46878.3438 422.7013 46878.3438 422.7013 46878.3438 422.7013     2164.9      9.8     2164.9        9.8     0.0     0.0 
1 1 1    3    0   20 o    332.1    2.3 1103.3654  15.3245  1103.3654  15.3245  1103.3654  15.3245      332.1      2.3      332.1        2.3     0.0     0.0 
1 1 1    3    0   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    0   22 o    473.0    2.7 2237.3796  25.5409  2237.3796  25.5409  2237.3796  25.5409      473.0      2.7      473.0        2.7     0.0     0.0 
1 1 1    3    0   23 o   1482.0    6.9 21968.3359 203.6884 21968.3359 203.6884 21968.3359 203.6884     1482.0      6.9     1482.0        6.9     0.0     0.0 
1 1 1    3    0   24 f    359.6    2.5 1293.0063  17.8786  1293.0063  17.8786  1293.0063  17.8786      359.6      2.5      359.6        2.5     0.0     0.0 
1 1 1    3    0   25 o    179.1    3.2  321.1764  11.4934   321.1764  11.4934   321.1764  11.4934      179.1      3.2      179.1        3.2     0.0     0.0 
1 1 1    3    0   26 o    482.5    3.0 2328.6885  29.3720  2328.6885  29.3720  2328.6885  29.3720      482.5      3.0      482.5        3.0     0.0     0.0 
1 1 1    3    0   27 o   1749.2    8.0 30602.4277 280.3110 30602.4277 280.3110 30602.4277 280.3110     1749.2      8.0     1749.2        8.0     0.0     0.0 
1 1 1    3    0   28 o   1947.3    8.9 37930.7383 347.9943 37930.7383 347.9943 37930.7383 347.9943     1947.3      8.9     1947.3        8.9     0.0     0.0 
1 1 1    3    0   29 f    643.5    3.6 4140.8130  45.9736  4140.8130  45.9736  4140.8130  45.9736      643.5      3.6      643.5        3.6     0.0     0.0 
1 1 1    3    0   30 o    754.3    4.1 5690.5049  61.2981  5690.5049  61.2981  5690.5049  61.2981      754.3      4.1      754.3        4.1     0.0     0.0 
1 1 1    3    0   31 o    705.0    3.8 4970.8906  52.9973  4970.8906  52.9973  4970.8906  52.9973      705.0      3.8      705.0        3.8     0.0     0.0 
1 1 1    3    0   32 o    343.8    4.4 1182.5420  30.0105  1182.5420  30.0105  1182.5420  30.0105      343.8      4.4      343.8        4.4     0.0     0.0 
1 1 1    3    0   33 o    147.5    6.7  219.0129  19.7942   219.0129  19.7942   219.0129  19.7942      147.5      6.7      147.5        6.7     0.0     0.0 
1 1 1    3    0   34 o     15.5   11.6 -107.2716  30.0105  -107.2716  30.0105  -107.2716  30.0105       15.5     11.6       15.5       11.6     0.0     0.0 
1 1 1    3    0   35 o    411.6    3.4 1694.6364  28.0950  1694.6364  28.0950  1694.6364  28.0950      411.6      3.4      411.6        3.4     0.0     0.0 
1 1 1    3    0   36 o    157.4    8.2  249.6619  25.5409   249.6619  25.5409   249.6619  25.5409      157.4      8.2      157.4        8.2     0.0     0.0 
1 1 1    3    0   37 o    709.3    4.3 5031.5503  61.2981  5031.5503  61.2981  5031.5503  61.2981      709.3      4.3      709.3        4.3     0.0     0.0 
1 1 1    3    0   38 o     21.7   15.5  -36.3957  28.0950   -36.3957  28.0950   -36.3957  28.0950       21.7     15.5       21.7       15.5     0.0     0.0 
1 1 1    3    0   39 o    347.2    4.0 1206.1674  28.0950  1206.1674  28.0950  1206.1674  28.0950      347.2      4.0      347.2        4.0     0.0     0.0 
1 1 1    3    0   40 o     28.6   21.1 -204.9654  78.5382  -204.9654  78.5382  -204.9654  78.5382       28.6     21.1       28.6       21.1     0.0     0.0 
1 1 1    3    0   41 o   1684.9    7.8 28395.6953 263.0709 28395.6953 263.0709 28395.6953 263.0709     1684.9      7.8     1684.9        7.8     0.0     0.0 
1 1 1    3    0   42 o    670.8    4.7 4500.3003  63.2136  4500.3003  63.2136  4500.3003  63.2136      670.8      4.7      670.8        4.7     0.0     0.0 
1 1 1    3    0   43 o    635.5    4.3 4039.9265  54.9129  4039.9265  54.9129  4039.9265  54.9129      635.5      4.3      635.5        4.3     0.0     0.0 
1 1 1    3    0   44 o    394.7    5.6 1558.6313  44.0580  1558.6313  44.0580  1558.6313  44.0580      394.7      5.6      394.7        5.6     0.0     0.0 
1 1 1    3    0   45 o   1148.5    5.8 13192.4961 133.4510 13192.4961 133.4510 13192.4961 133.4510     1148.5      5.8     1148.5        5.8     0.0     0.0 
1 1 1    3    0   46 o    840.9    4.4 7072.2651  74.0685  7072.2651  74.0685  7072.2651  74.0685      840.9      4.4      840.9        4.4     0.0     0.0 
1 1 1    3    0   47 o    621.9    4.3 3868.8027  53.6358  3868.8027  53.6358  3868.8027  53.6358      621.9      4.3      621.9        4.3     0.0     0.0 
1 1 1    3    0   48 o   1321.9    6.4 17477.6133 170.4853 17477.6133 170.4853 17477.6133 170.4853     1321.9      6.4     1321.9        6.4     0.0     0.0 
1 1 1    3    0   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    0   50 o     16.5   12.3  -75.9841  27.4564   -75.9841  27.4564   -75.9841  27.4564       16.5     12.3       16.5       12.3     0.0     0.0 
1 1 1    3    0   51 o    951.1    4.9 9047.2129  92.5856  9047.2129  92.5856  9047.2129  92.5856      951.1      4.9      951.1        4.9     0.0     0.0 
1 1 1    3    0   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    0   53 o    482.6    4.2 2329.9653  40.2269  2329.9653  40.2269  2329.9653  40.2269      482.6      4.2      482.6        4.2     0.0     0.0 
1 1 1    3    0   54 o     32.8   20.4    8.3008  26.1794     8.3008  26.1794     8.3008  26.1794       32.8     20.4       32.8       20.4     0.0     0.0 
1 1 1    3    0   55 o    275.9    5.2  762.3948  28.7335   762.3948  28.7335   762.3948  28.7335      275.9      5.2      275.9        5.2     0.0     0.0 
1 1 1    3    0   56 o    210.4    7.3  444.4110  30.6490   444.4110  30.6490   444.4110  30.6490      210.4      7.3      210.4        7.3     0.0     0.0 
1 1 1    3    0   57 o    289.6    6.1  840.2945  35.1187   840.2945  35.1187   840.2945  35.1187      289.6      6.1      289.6        6.1     0.0     0.0 
1 1 1    3    0   58 o    833.9    4.5 6956.0547  75.3456  6956.0547  75.3456  6956.0547  75.3456      833.9      4.5      833.9        4.5     0.0     0.0 
1 1 1    3    0   59 o    115.3   12.7  137.9207  28.7335   137.9207  28.7335   137.9207  28.7335      115.3     12.7      115.3       12.7     0.0     0.0 
1 1 1    3    0   60 o    496.4    3.9 2465.3320  38.9498  2465.3320  38.9498  2465.3320  38.9498      496.4      3.9      496.4        3.9     0.0     0.0 
1 1 1    3    0   61 o    536.1    4.4 2875.2627  47.2506  2875.2627  47.2506  2875.2627  47.2506      536.1      4.4      536.1        4.4     0.0     0.0 
1 1 1    3    0   62 o     18.0   13.3  -67.0448  28.7335   -67.0448  28.7335   -67.0448  28.7335       18.0     13.3       18.0       13.3     0.0     0.0 
1 1 1    3    0   63 o    302.9    5.1  918.8326  30.6490   918.8326  30.6490   918.8326  30.6490      302.9      5.1      302.9        5.1     0.0     0.0 
1 1 1    3    0   64 o    108.8   13.2  123.8732  28.0950   123.8732  28.0950   123.8732  28.0950      108.8     13.2      108.8       13.2     0.0     0.0 
1 1 1    3    0   65 o    218.5    7.2  479.5297  31.2876   479.5297  31.2876   479.5297  31.2876      218.5      7.2      218.5        7.2     0.0     0.0 
1 1 1    3    0   66 o     92.0   17.4   93.2242  28.7335    93.2242  28.7335    93.2242  28.7335       92.0     17.4       92.0       17.4     0.0     0.0 
1 1 1    3    0   67 o    407.1    4.2 1658.8792  33.8416  1658.8792  33.8416  1658.8792  33.8416      407.1      4.2      407.1        4.2     0.0     0.0 
1 1 1    3    0   68 o     66.5   24.1   59.3825  29.3720    59.3825  29.3720    59.3825  29.3720       66.5     24.1       66.5       24.1     0.0     0.0 
1 1 1    3    0   69 o    317.7    5.0 1010.7797  31.9261  1010.7797  31.9261  1010.7797  31.9261      317.7      5.0      317.7        5.0     0.0     0.0 
1 1 1    3    0   70 o    299.2    5.0  896.4843  30.0105   896.4843  30.0105   896.4843  30.0105      299.2      5.0      299.2        5.0     0.0     0.0 
1 1 1    3    0   71 o    424.5    4.5 1803.8236  38.3113  1803.8236  38.3113  1803.8236  38.3113      424.5      4.5      424.5        4.5     0.0     0.0 
1 1 1    3    0   72 o     29.7   19.6   -3.1926  28.7335    -3.1926  28.7335    -3.1926  28.7335       29.7     19.6       29.7       19.6     0.0     0.0 
1 1 1    3    0   73 o    393.1    4.7 1547.1379  37.0343  1547.1379  37.0343  1547.1379  37.0343      393.1      4.7      393.1        4.7     0.0     0.0 
1 1 1    3    0   74 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    0   75 f    207.9    7.5  434.8332  31.2876   434.8332  31.2876   434.8332  31.2876      207.9      7.5      207.9        7.5     0.0     0.0 
1 1 1    3    0   76 o    106.3   15.2  118.1265  31.2876   118.1265  31.2876   118.1265  31.2876      106.3     15.2      106.3       15.2     0.0     0.0 
1 1 1    3    0   77 o     36.9   22.4   14.6860  30.0105    14.6860  30.0105    14.6860  30.0105       36.9     22.4       36.9       22.4     0.0     0.0 
1 1 1    3    0   78 o     73.5   22.4   68.3218  28.7335    68.3218  28.7335    68.3218  28.7335       73.5     22.4       73.5       22.4     0.0     0.0 
1 1 1    3    0   79 o    268.1    5.7  721.5294  30.6490   721.5294  30.6490   721.5294  30.6490      268.1      5.7      268.1        5.7     0.0     0.0 
1 1 1    3    0   80 o    114.1   15.3  139.1977  33.8416   139.1977  33.8416   139.1977  33.8416      114.1     15.3      114.1       15.3     0.0     0.0 
1 1 1    3    0   81 o     90.3   19.3   93.8627  30.6490    93.8627  30.6490    93.8627  30.6490       90.3     19.3       90.3       19.3     0.0     0.0 
1 1 1    3    0   82 o     81.2   21.4   80.4537  30.0105    80.4537  30.0105    80.4537  30.0105       81.2     21.4       81.2       21.4     0.0     0.0 
1 1 1    3    1    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    1    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    1    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    1    3 o   1242.8    8.1    0.0000   0.0000          ?        ? 15449.0303 201.1343          ?        ?     1242.8        8.1       ?       ? 
1 1 1    3    1    4 o    661.9    3.5    0.0000   0.0000          ?        ?  4381.5356  45.9736          ?        ?      661.9        3.5       ?       ? 
1 1 1    3    1    5 o   1409.7    5.1    0.0000   0.0000          ?        ? 19872.7090 144.9444          ?        ?     1409.7        5.1       ?       ? 
1 1 1    3    1    6 o   1380.4    4.5    0.0000   0.0000          ?        ? 19057.3164 123.8732          ?        ?     1380.4        4.5       ?       ? 
1 1 1    3    1    7 o    835.0    2.8    0.0000   0.0000          ?        ?  6972.0176  47.2506          ?        ?      835.0        2.8       ?       ? 
1 1 1    3    1    8 o    421.2    1.6    0.0000   0.0000          ?        ?  1773.8130  13.4090          ?        ?      421.2        1.6       ?       ? 
1 1 1    3    1    9 o   1019.1    3.4    0.0000   0.0000          ?        ? 10386.8311  69.5989          ?        ?     1019.1        3.4       ?       ? 
1 1 1    3    1   10 o    399.2    1.6    0.0000   0.0000          ?        ?  1593.7500  12.7704          ?        ?      399.2        1.6       ?       ? 
1 1 1    3    1   11 o   1432.2    4.8    0.0000   0.0000          ?        ? 20511.8672 137.2822          ?        ?     1432.2        4.8       ?       ? 
1 1 1    3    1   12 o   1397.2    4.6    0.0000   0.0000          ?        ? 19522.7988 127.7043          ?        ?     1397.2        4.6       ?       ? 
1 1 1    3    1   13 o    678.4    2.4    0.0000   0.0000          ?        ?  4601.8257  33.2031          ?        ?      678.4        2.4       ?       ? 
1 1 1    3    1   14 o   1705.9    5.5    0.0000   0.0000          ?        ? 29103.8164 189.0024          ?        ?     1705.9        5.5       ?       ? 
1 1 1    3    1   15 o   1603.5    5.2    0.0000   0.0000          ?        ? 25713.2656 167.9312          ?        ?     1603.5        5.2       ?       ? 
1 1 1    3    1   16 o   2659.6    8.4    0.0000   0.0000          ?        ? 70748.8359 448.2422          ?        ?     2659.6        8.4       ?       ? 
1 1 1    3    1   17 o    291.3    1.6    0.0000   0.0000          ?        ?   848.5952   9.5778          ?        ?      291.3        1.6       ?       ? 
1 1 1    3    1   18 o   2608.1    8.2    0.0000   0.0000          ?        ? 68036.3906 429.7251          ?        ?     2608.1        8.2       ?       ? 
1 1 1    3    1   19 o    388.3    1.7    0.0000   0.0000          ?        ?  1507.5496  13.4090          ?        ?      388.3        1.7       ?       ? 
1 1 1    3    1   20 o   1370.5    4.6    0.0000   0.0000          ?        ? 18784.6680 125.7888          ?        ?     1370.5        4.6       ?       ? 
1 1 1    3    1   21 o    339.0    1.6    0.0000   0.0000          ?        ?  1149.3389  10.8549          ?        ?      339.0        1.6       ?       ? 
1 1 1    3    1   22 o   1574.3    5.2    0.0000   0.0000          ?        ? 24788.0488 164.7386          ?        ?     1574.3        5.2       ?       ? 
1 1 1    3    1   23 o    489.1    2.0    0.0000   0.0000          ?        ?  2391.9021  19.7942          ?        ?      489.1        2.0       ?       ? 
1 1 1    3    1   24 o    208.2    2.0    0.0000   0.0000          ?        ?   433.5562   8.3008          ?        ?      208.2        2.0       ?       ? 
1 1 1    3    1   25 f    389.8    1.8    0.0000   0.0000          ?        ?  1519.6815  14.0475          ?        ?      389.8        1.8       ?       ? 
1 1 1    3    1   26 o   1440.8    4.7    0.0000   0.0000          ?        ? 20761.5312 136.6436          ?        ?     1440.8        4.7       ?       ? 
1 1 1    3    1   27 o    634.5    2.4    0.0000   0.0000          ?        ?  4025.8789  30.0105          ?        ?      634.5        2.4       ?       ? 
1 1 1    3    1   28 o   1462.6    5.0    0.0000   0.0000          ?        ? 21395.5820 144.9444          ?        ?     1462.6        5.0       ?       ? 
1 1 1    3    1   29 o    727.3    2.9    0.0000   0.0000          ?        ?  5289.5132  41.5039          ?        ?      727.3        2.9       ?       ? 
1 1 1    3    1   30 o   2049.3    6.6    0.0000   0.0000          ?        ? 42005.1445 270.0946          ?        ?     2049.3        6.6       ?       ? 
1 1 1    3    1   31 o   1494.8    4.9    0.0000   0.0000          ?        ? 22346.9805 147.4985          ?        ?     1494.8        4.9       ?       ? 
1 1 1    3    1   32 o   1388.3    5.6    0.0000   0.0000          ?        ? 19276.3281 156.4378          ?        ?     1388.3        5.6       ?       ? 
1 1 1    3    1   33 o    814.4    3.8    0.0000   0.0000          ?        ?  6632.9629  61.2981          ?        ?      814.4        3.8       ?       ? 
1 1 1    3    1   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    1   35 o   2015.2    9.1    0.0000   0.0000          ?        ? 40618.9141 367.7885          ?        ?     2015.2        9.1       ?       ? 
1 1 1    3    1   36 o    949.3    3.3    0.0000   0.0000          ?        ?  9012.7324  63.2136          ?        ?      949.3        3.3       ?       ? 
1 1 1    3    1   37 o   1271.0    4.4    0.0000   0.0000          ?        ? 16156.5127 111.7413          ?        ?     1271.0        4.4       ?       ? 
1 1 1    3    1   38 o   2261.3    7.3    0.0000   0.0000          ?        ? 51141.7500 328.2001          ?        ?     2261.3        7.3       ?       ? 
1 1 1    3    1   39 o   1189.9    4.1    0.0000   0.0000          ?        ? 14159.2168  96.4168          ?        ?     1189.9        4.1       ?       ? 
1 1 1    3    1   40 o    394.9    2.6    0.0000   0.0000          ?        ?  1559.2698  20.4327          ?        ?      394.9        2.6       ?       ? 
1 1 1    3    1   41 o    780.9    3.1    0.0000   0.0000          ?        ?  6098.5200  49.1662          ?        ?      780.9        3.1       ?       ? 
1 1 1    3    1   42 o    686.8    2.7    0.0000   0.0000          ?        ?  4717.3975  37.6728          ?        ?      686.8        2.7       ?       ? 
1 1 1    3    1   43 o    743.0    3.1    0.0000   0.0000          ?        ?  5521.2964  45.9736          ?        ?      743.0        3.1       ?       ? 
1 1 1    3    1   44 o    200.9    5.1    0.0000   0.0000          ?        ?   403.5457  20.4327          ?        ?      200.9        5.1       ?       ? 
1 1 1    3    1   45 o    905.9    3.3    0.0000   0.0000          ?        ?  8206.9189  60.0210          ?        ?      905.9        3.3       ?       ? 
1 1 1    3    1   46 o   1030.2    3.6    0.0000   0.0000          ?        ? 10612.8682  74.7070          ?        ?     1030.2        3.6       ?       ? 
1 1 1    3    1   47 o   1163.7    4.1    0.0000   0.0000          ?        ? 13543.6826  95.1397          ?        ?     1163.7        4.1       ?       ? 
1 1 1    3    1   48 o    611.8    2.9    0.0000   0.0000          ?        ?  3743.6521  35.7572          ?        ?      611.8        2.9       ?       ? 
1 1 1    3    1   49 o    167.8    5.9    0.0000   0.0000          ?        ?   281.5880  19.7942          ?        ?      167.8        5.9       ?       ? 
1 1 1    3    1   50 o    489.9    2.9    0.0000   0.0000          ?        ?  2400.2026  28.0950          ?        ?      489.9        2.9       ?       ? 
1 1 1    3    1   51 o    726.1    3.0    0.0000   0.0000          ?        ?  5272.9116  43.4195          ?        ?      726.1        3.0       ?       ? 
1 1 1    3    1   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    1   53 o    388.3    3.0    0.0000   0.0000          ?        ?  1508.1881  22.9868          ?        ?      388.3        3.0       ?       ? 
1 1 1    3    1   54 o     33.7   15.6    0.0000   0.0000          ?        ?   -21.0712  24.9023          ?        ?       33.7       15.6       ?       ? 
1 1 1    3    1   55 o    985.3    3.6    0.0000   0.0000          ?        ?  9709.3594  70.2374          ?        ?      985.3        3.6       ?       ? 
1 1 1    3    1   56 o     85.6   11.9    0.0000   0.0000          ?        ?    73.4300  20.4327          ?        ?       85.6       11.9       ?       ? 
1 1 1    3    1   57 o    227.1    4.5    0.0000   0.0000          ?        ?   515.9255  20.4327          ?        ?      227.1        4.5       ?       ? 
1 1 1    3    1   58 o    121.9    8.1    0.0000   0.0000          ?        ?   148.7755  19.7942          ?        ?      121.9        8.1       ?       ? 
1 1 1    3    1   59 o    639.4    2.8    0.0000   0.0000          ?        ?  4089.0928  36.3957          ?        ?      639.4        2.8       ?       ? 
1 1 1    3    1   60 o    162.9    6.1    0.0000   0.0000          ?        ?   265.6250  19.7942          ?        ?      162.9        6.1       ?       ? 
1 1 1    3    1   61 o    318.7    3.2    0.0000   0.0000          ?        ?  1015.8879  20.4327          ?        ?      318.7        3.2       ?       ? 
1 1 1    3    1   62 o    167.7    5.9    0.0000   0.0000          ?        ?   281.5880  19.7942          ?        ?      167.7        5.9       ?       ? 
1 1 1    3    1   63 o    285.5    3.6    0.0000   0.0000          ?        ?   815.3921  20.4327          ?        ?      285.5        3.6       ?       ? 
1 1 1    3    1   64 f    556.3    2.8    0.0000   0.0000          ?        ?  3095.5527  30.6490          ?        ?      556.3        2.8       ?       ? 
1 1 1    3    1   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    1   66 o     21.8   10.9    0.0000   0.0000          ?        ?   -50.4432  19.1556          ?        ?       21.8       10.9       ?       ? 
1 1 1    3    1   67 o    255.0    4.0    0.0000   0.0000          ?        ?   650.6536  20.4327          ?        ?      255.0        4.0       ?       ? 
1 1 1    3    1   68 o    286.9    3.8    0.0000   0.0000          ?        ?   823.6929  21.7097          ?        ?      286.9        3.8       ?       ? 
1 1 1    3    1   69 o    130.8    8.3    0.0000   0.0000          ?        ?   171.7623  21.7097          ?        ?      130.8        8.3       ?       ? 
1 1 1    3    1   70 o     86.0   12.6    0.0000   0.0000          ?        ?    74.7070  21.7097          ?        ?       86.0       12.6       ?       ? 
1 1 1    3    1   71 f    167.8    6.7    0.0000   0.0000          ?        ?   282.2266  22.3483          ?        ?      167.8        6.7       ?       ? 
1 1 1    3    1   72 o    162.5    7.1    0.0000   0.0000          ?        ?   264.9865  22.9868          ?        ?      162.5        7.1       ?       ? 
1 1 1    3    1   73 o    468.9    3.0    0.0000   0.0000          ?        ?  2200.3455  28.0950          ?        ?      468.9        3.0       ?       ? 
1 1 1    3    1   74 o    201.9    5.7    0.0000   0.0000          ?        ?   408.6538  22.9868          ?        ?      201.9        5.7       ?       ? 
1 1 1    3    1   75 o     48.8   17.5    0.0000   0.0000          ?        ?    21.0712  21.7097          ?        ?       48.8       17.5       ?       ? 
1 1 1    3    1   76 o    154.2    7.0    0.0000   0.0000          ?        ?   238.8071  21.7097          ?        ?      154.2        7.0       ?       ? 
1 1 1    3    1   77 o    148.1    8.0    0.0000   0.0000          ?        ?   220.9285  23.6253          ?        ?      148.1        8.0       ?       ? 
1 1 1    3    1   78 o    218.8    5.1    0.0000   0.0000          ?        ?   480.1682  22.3483          ?        ?      218.8        5.1       ?       ? 
1 1 1    3    1   79 o    217.6    5.0    0.0000   0.0000          ?        ?   475.0601  21.7097          ?        ?      217.6        5.0       ?       ? 
1 1 1    3    1   80 o     28.0   13.4    0.0000   0.0000          ?        ?   -30.0105  21.7097          ?        ?       28.0       13.4       ?       ? 
1 1 1    3    1   81 o     39.3   16.2    0.0000   0.0000          ?        ?     6.3852  20.4327          ?        ?       39.3       16.2       ?       ? 
1 1 1    3    1   82 o     75.2   14.5    0.0000   0.0000          ?        ?    60.6596  21.0712          ?        ?       75.2       14.5       ?       ? 
1 1 1    3    2    0 o    107.7    2.4  116.2109   5.1082   116.2109   5.1082   116.2109   5.1082      107.7      2.4      107.7        2.4     0.0     0.0 
1 1 1    3    2    1 o    773.5    5.2    0.0000   0.0000          ?        ?  5983.5859  79.8152          ?        ?      773.5        5.2       ?       ? 
1 1 1    3    2    2 o    938.5    4.8    0.0000   0.0000          ?        ?  8809.0439  89.3930          ?        ?      938.5        4.8       ?       ? 
1 1 1    3    2    3 f   1417.9    7.4    0.0000   0.0000          ?        ? 20107.6855 210.7121          ?        ?     1417.9        7.4       ?       ? 
1 1 1    3    2    4 o   1330.8    4.9    0.0000   0.0000          ?        ? 17711.9512 130.2584          ?        ?     1330.8        4.9       ?       ? 
1 1 1    3    2    5 o    868.8    2.9    0.0000   0.0000          ?        ?  7547.9639  50.4432          ?        ?      868.8        2.9       ?       ? 
1 1 1    3    2    6 o    771.7    2.6    0.0000   0.0000          ?        ?  5955.4912  40.8654          ?        ?      771.7        2.6       ?       ? 
1 1 1    3    2    7 f    681.4    2.4    0.0000   0.0000          ?        ?  4643.3291  32.5646          ?        ?      681.4        2.4       ?       ? 
1 1 1    3    2    8 o   1857.6    6.0    0.0000   0.0000          ?        ? 34509.5391 222.2055          ?        ?     1857.6        6.0       ?       ? 
1 1 1    3    2    9 o   1161.5    3.8    0.0000   0.0000          ?        ? 13491.9619  89.3930          ?        ?     1161.5        3.8       ?       ? 
1 1 1    3    2   10 o   1100.9    3.7    0.0000   0.0000          ?        ? 12121.0566  81.0922          ?        ?     1100.9        3.7       ?       ? 
1 1 1    3    2   11 o   1195.0    4.0    0.0000   0.0000          ?        ? 14281.8125  95.1397          ?        ?     1195.0        4.0       ?       ? 
1 1 1    3    2   12 o   2339.3    7.4    0.0000   0.0000          ?        ? 54728.9688 347.9943          ?        ?     2339.3        7.4       ?       ? 
1 1 1    3    2   13 o   1187.8    4.0    0.0000   0.0000          ?        ? 14108.1357  95.7782          ?        ?     1187.8        4.0       ?       ? 
1 1 1    3    2   14 o   3430.5   18.6    0.0000   0.0000          ?        ? 117793.8359 1275.1277          ?        ?     3430.5       18.6       ?       ? 
1 1 1    3    2   15 o    368.4    1.6    0.0000   0.0000          ?        ?  1357.4971  12.1319          ?        ?      368.4        1.6       ?       ? 
1 1 1    3    2   16 o   3151.2    9.9    0.0000   0.0000          ?        ? 99327.7891 625.7512          ?        ?     3151.2        9.9       ?       ? 
1 1 1    3    2   17 o    921.2    3.2    0.0000   0.0000          ?        ?  8486.5908  58.7440          ?        ?      921.2        3.2       ?       ? 
1 1 1    3    2   18 o    598.0    2.2    0.0000   0.0000          ?        ?  3576.3594  26.1794          ?        ?      598.0        2.2       ?       ? 
1 1 1    3    2   19 o    573.6    2.2    0.0000   0.0000          ?        ?  3290.3018  25.5409          ?        ?      573.6        2.2       ?       ? 
1 1 1    3    2   20 o    642.3    2.3    0.0000   0.0000          ?        ?  4126.1270  30.0105          ?        ?      642.3        2.3       ?       ? 
1 1 1    3    2   21 o    998.4    3.4    0.0000   0.0000          ?        ?  9968.5996  68.3218          ?        ?      998.4        3.4       ?       ? 
1 1 1    3    2   22 o    350.1    1.7    0.0000   0.0000          ?        ?  1225.9615  12.1319          ?        ?      350.1        1.7       ?       ? 
1 1 1    3    2   23 f    811.3    2.9    0.0000   0.0000          ?        ?  6581.8813  46.6121          ?        ?      811.3        2.9       ?       ? 
1 1 1    3    2   24 o   1395.0    4.6    0.0000   0.0000          ?        ? 19462.1387 128.3428          ?        ?     1395.0        4.6       ?       ? 
1 1 1    3    2   25 o    778.1    2.8    0.0000   0.0000          ?        ?  6054.4619  43.4195          ?        ?      778.1        2.8       ?       ? 
1 1 1    3    2   26 f    654.4    2.4    0.0000   0.0000          ?        ?  4281.9258  31.2876          ?        ?      654.4        2.4       ?       ? 
1 1 1    3    2   27 o   1189.8    4.0    0.0000   0.0000          ?        ? 14157.9404  94.5012          ?        ?     1189.8        4.0       ?       ? 
1 1 1    3    2   28 o    357.4    2.1    0.0000   0.0000          ?        ?  1277.6818  15.3245          ?        ?      357.4        2.1       ?       ? 
1 1 1    3    2   29 o    844.9    3.0    0.0000   0.0000          ?        ?  7139.3101  50.4432          ?        ?      844.9        3.0       ?       ? 
1 1 1    3    2   30 o    799.2    2.9    0.0000   0.0000          ?        ?  6387.1318  46.6121          ?        ?      799.2        2.9       ?       ? 
1 1 1    3    2   31 o    646.3    2.5    0.0000   0.0000          ?        ?  4176.5698  32.5646          ?        ?      646.3        2.5       ?       ? 
1 1 1    3    2   32 o    906.9    4.5    0.0000   0.0000          ?        ?  8225.4355  81.7308          ?        ?      906.9        4.5       ?       ? 
1 1 1    3    2   33 o   1259.3    4.3    0.0000   0.0000          ?        ? 15860.2383 107.2716          ?        ?     1259.3        4.3       ?       ? 
1 1 1    3    2   34 o    393.3    2.8    0.0000   0.0000          ?        ?  1546.4994  21.7097          ?        ?      393.3        2.8       ?       ? 
1 1 1    3    2   35 o   1522.9    5.2    0.0000   0.0000          ?        ? 23194.2988 159.6304          ?        ?     1522.9        5.2       ?       ? 
1 1 1    3    2   36 o   1429.7    4.7    0.0000   0.0000          ?        ? 20440.3535 135.3666          ?        ?     1429.7        4.7       ?       ? 
1 1 1    3    2   37 o   1150.1    4.1    0.0000   0.0000          ?        ? 13228.2520  93.8627          ?        ?     1150.1        4.1       ?       ? 
1 1 1    3    2   38 o    825.8    3.0    0.0000   0.0000          ?        ?  6819.4111  49.1662          ?        ?      825.8        3.0       ?       ? 
1 1 1    3    2   39 f    963.9    3.4    0.0000   0.0000          ?        ?  9291.7666  65.7677          ?        ?      963.9        3.4       ?       ? 
1 1 1    3    2   40 o   1579.9    5.2    0.0000   0.0000          ?        ? 24964.2793 163.4615          ?        ?     1579.9        5.2       ?       ? 
1 1 1    3    2   41 o    688.7    3.0    0.0000   0.0000          ?        ?  4742.9385  40.8654          ?        ?      688.7        3.0       ?       ? 
1 1 1    3    2   42 o    764.6    3.1    0.0000   0.0000          ?        ?  5846.3037  47.2506          ?        ?      764.6        3.1       ?       ? 
1 1 1    3    2   43 o    912.3    3.4    0.0000   0.0000          ?        ?  8323.7676  61.9366          ?        ?      912.3        3.4       ?       ? 
1 1 1    3    2   44 o   1186.1    4.3    0.0000   0.0000          ?        ? 14069.1846 101.5249          ?        ?     1186.1        4.3       ?       ? 
1 1 1    3    2   45 o   1019.5    3.8    0.0000   0.0000          ?        ? 10393.8555  77.2611          ?        ?     1019.5        3.8       ?       ? 
1 1 1    3    2   46 o    515.3    3.0    0.0000   0.0000          ?        ?  2654.9729  30.6490          ?        ?      515.3        3.0       ?       ? 
1 1 1    3    2   47 o    353.8    3.2    0.0000   0.0000          ?        ?  1251.5024  22.9868          ?        ?      353.8        3.2       ?       ? 
1 1 1    3    2   48 o    330.6    3.5    0.0000   0.0000          ?        ?  1093.1490  22.9868          ?        ?      330.6        3.5       ?       ? 
1 1 1    3    2   49 o    146.2    6.3    0.0000   0.0000          ?        ?   213.9047  18.5171          ?        ?      146.2        6.3       ?       ? 
1 1 1    3    2   50 o    447.1    2.8    0.0000   0.0000          ?        ?  1999.2113  24.9023          ?        ?      447.1        2.8       ?       ? 
1 1 1    3    2   51 o   1098.5    4.0    0.0000   0.0000          ?        ? 12068.0586  87.4775          ?        ?     1098.5        4.0       ?       ? 
1 1 1    3    2   52 o    769.9    3.0    0.0000   0.0000          ?        ?  5928.0352  45.9736          ?        ?      769.9        3.0       ?       ? 
1 1 1    3    2   53 o    490.7    2.7    0.0000   0.0000          ?        ?  2407.8650  26.8179          ?        ?      490.7        2.7       ?       ? 
1 1 1    3    2   54 o    212.0    4.7    0.0000   0.0000          ?        ?   449.5192  19.7942          ?        ?      212.0        4.7       ?       ? 
1 1 1    3    2   55 o    260.1    4.3    0.0000   0.0000          ?        ?   676.8329  22.3483          ?        ?      260.1        4.3       ?       ? 
1 1 1    3    2   56 o    714.8    3.1    0.0000   0.0000          ?        ?  5110.7271  44.0580          ?        ?      714.8        3.1       ?       ? 
1 1 1    3    2   57 o    380.5    3.2    0.0000   0.0000          ?        ?  1448.1671  24.2638          ?        ?      380.5        3.2       ?       ? 
1 1 1    3    2   58 o    246.8    4.1    0.0000   0.0000          ?        ?   609.1497  20.4327          ?        ?      246.8        4.1       ?       ? 
1 1 1    3    2   59 o     73.6   13.5    0.0000   0.0000          ?        ?    56.1899  19.1556          ?        ?       73.6       13.5       ?       ? 
1 1 1    3    2   60 o    561.2    2.7    0.0000   0.0000          ?        ?  3150.4656  30.6490          ?        ?      561.2        2.7       ?       ? 
1 1 1    3    2   61 o    258.5    3.8    0.0000   0.0000          ?        ?   668.5321  19.7942          ?        ?      258.5        3.8       ?       ? 
1 1 1    3    2   62 o    513.3    2.8    0.0000   0.0000          ?        ?  2635.8171  28.7335          ?        ?      513.3        2.8       ?       ? 
1 1 1    3    2   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    2   64 o     42.5   16.0    0.0000   0.0000          ?        ?    13.4090  18.5171          ?        ?       42.5       16.0       ?       ? 
1 1 1    3    2   65 o     24.3   11.9    0.0000   0.0000          ?        ?   -36.3957  19.1556          ?        ?       24.3       11.9       ?       ? 
1 1 1    3    2   66 o    245.7    4.2    0.0000   0.0000          ?        ?   604.0414  20.4327          ?        ?      245.7        4.2       ?       ? 
1 1 1    3    2   67 o    141.0    6.8    0.0000   0.0000          ?        ?   199.2188  19.1556          ?        ?      141.0        6.8       ?       ? 
1 1 1    3    2   68 o    451.9    2.8    0.0000   0.0000          ?        ?  2043.2692  25.5409          ?        ?      451.9        2.8       ?       ? 
1 1 1    3    2   69 o    128.3    9.0    0.0000   0.0000          ?        ?   165.3771  22.9868          ?        ?      128.3        9.0       ?       ? 
1 1 1    3    2   70 o    181.0    6.2    0.0000   0.0000          ?        ?   328.2001  22.3483          ?        ?      181.0        6.2       ?       ? 
1 1 1    3    2   71 o    135.3    8.3    0.0000   0.0000          ?        ?   183.8942  22.3483          ?        ?      135.3        8.3       ?       ? 
1 1 1    3    2   72 o    193.4    5.4    0.0000   0.0000          ?        ?   374.8122  21.0712          ?        ?      193.4        5.4       ?       ? 
1 1 1    3    2   73 o    144.1    8.0    0.0000   0.0000          ?        ?   208.7966  22.9868          ?        ?      144.1        8.0       ?       ? 
1 1 1    3    2   74 o    255.0    4.4    0.0000   0.0000          ?        ?   651.2921  22.3483          ?        ?      255.0        4.4       ?       ? 
1 1 1    3    2   75 o     24.1   12.0    0.0000   0.0000          ?        ?   -54.2743  22.3483          ?        ?       24.1       12.0       ?       ? 
1 1 1    3    2   76 f     52.9   18.1    0.0000   0.0000          ?        ?    26.8179  22.9868          ?        ?       52.9       18.1       ?       ? 
1 1 1    3    2   77 o    103.4    9.6    0.0000   0.0000          ?        ?   107.9102  19.7942          ?        ?      103.4        9.6       ?       ? 
1 1 1    3    2   78 o    235.4    4.7    0.0000   0.0000          ?        ?   555.5138  22.3483          ?        ?      235.4        4.7       ?       ? 
1 1 1    3    2   79 o    106.2    9.9    0.0000   0.0000          ?        ?   114.2954  21.0712          ?        ?      106.2        9.9       ?       ? 
1 1 1    3    2   80 o     31.8   14.6    0.0000   0.0000          ?        ?   -14.0475  21.0712          ?        ?       31.8       14.6       ?       ? 
1 1 1    3    2   81 o    191.6    6.2    0.0000   0.0000          ?        ?   369.7040  23.6253          ?        ?      191.6        6.2       ?       ? 
1 1 1    3    2   82 o     70.2   17.7    0.0000   0.0000          ?        ?    54.2743  24.9023          ?        ?       70.2       17.7       ?       ? 
1 1 1    3    3    0 o    558.1    6.8 3115.9856  75.3456  3115.9856  75.3456  3115.9856  75.3456      558.1      6.8      558.1        6.8     0.0     0.0 
1 1 1    3    3    1 o    507.2    3.9 2572.6035  39.5883  2572.6035  39.5883  2572.6035  39.5883      507.2      3.9      507.2        3.9     0.0     0.0 
1 1 1    3    3    2 o    513.1    3.0 2632.6245  31.2876  2632.6245  31.2876  2632.6245  31.2876      513.1      3.0      513.1        3.0     0.0     0.0 
1 1 1    3    3    3 o   1097.4    5.9 12043.7949 129.6199 12043.7949 129.6199 12043.7949 129.6199     1097.4      5.9     1097.4        5.9     0.0     0.0 
1 1 1    3    3    4 f    392.3    2.2 1538.8372  17.2401  1538.8372  17.2401  1538.8372  17.2401      392.3      2.2      392.3        2.2     0.0     0.0 
1 1 1    3    3    5 o    355.0    2.0 1260.4417  14.0475  1260.4417  14.0475  1260.4417  14.0475      355.0      2.0      355.0        2.0     0.0     0.0 
1 1 1    3    3    6 o    166.1    1.9  275.8413   6.3852   275.8413   6.3852   275.8413   6.3852      166.1      1.9      166.1        1.9     0.0     0.0 
1 1 1    3    3    7 o    834.2    4.1 6959.8857  67.6833  6959.8857  67.6833  6959.8857  67.6833      834.2      4.1      834.2        4.1     0.0     0.0 
1 1 1    3    3    8 o    173.0    1.7  299.4666   5.7467   299.4666   5.7467   299.4666   5.7467      173.0      1.7      173.0        1.7     0.0     0.0 
1 1 1    3    3    9 o    879.1    4.2 7729.3042  74.0685  7729.3042  74.0685  7729.3042  74.0685      879.1      4.2      879.1        4.2     0.0     0.0 
1 1 1    3    3   10 o    551.9    3.0 3045.7480  33.2031  3045.7480  33.2031  3045.7480  33.2031      551.9      3.0      551.9        3.0     0.0     0.0 
1 1 1    3    3   11 o   1875.1    8.5 35165.3008 319.8993 35165.3008 319.8993 35165.3008 319.8993     1875.1      8.5     1875.1        8.5     0.0     0.0 
1 1 1    3    3   12 o    152.8    2.3  233.6989   7.0237   233.6989   7.0237   233.6989   7.0237      152.8      2.3      152.8        2.3     0.0     0.0 
1 1 1    3    3   13 o   2273.6   10.3 51704.9297 466.7593 51704.9297 466.7593 51704.9297 466.7593     2273.6     10.3     2273.6       10.3     0.0     0.0 
1 1 1    3    3   14 o   1329.7    6.2 17682.5801 166.0156 17682.5801 166.0156 17682.5801 166.0156     1329.7      6.2     1329.7        6.2     0.0     0.0 
1 1 1    3    3   15 o    333.7    2.5 1113.5817  16.6016  1113.5817  16.6016  1113.5817  16.6016      333.7      2.5      333.7        2.5     0.0     0.0 
1 1 1    3    3   16 f   1568.8    7.2 24616.2852 226.6752 24616.2852 226.6752 24616.2852 226.6752     1568.8      7.2     1568.8        7.2     0.0     0.0 
1 1 1    3    3   17 o   2852.0   12.8 81365.5312 728.5532 81365.5312 728.5532 81365.5312 728.5532     2852.0     12.8     2852.0       12.8     0.0     0.0 
1 1 1    3    3   18 o    730.1    3.7 5330.3784  53.6358  5330.3784  53.6358  5330.3784  53.6358      730.1      3.7      730.1        3.7     0.0     0.0 
1 1 1    3    3   19 o    879.2    4.3 7729.9429  75.3456  7729.9429  75.3456  7729.9429  75.3456      879.2      4.3      879.2        4.3     0.0     0.0 
1 1 1    3    3   20 o    797.5    3.9 6360.3140  62.5751  6360.3140  62.5751  6360.3140  62.5751      797.5      3.9      797.5        3.9     0.0     0.0 
1 1 1    3    3   21 o    521.2    2.8 2716.9094  29.3720  2716.9094  29.3720  2716.9094  29.3720      521.2      2.8      521.2        2.8     0.0     0.0 
1 1 1    3    3   22 o   1184.4    5.6 14030.2363 132.1740 14030.2363 132.1740 14030.2363 132.1740     1184.4      5.6     1184.4        5.6     0.0     0.0 
1 1 1    3    3   23 o   1635.0    7.5 26738.7324 245.8308 26738.7324 245.8308 26738.7324 245.8308     1635.0      7.5     1635.0        7.5     0.0     0.0 
1 1 1    3    3   24 f     22.6   13.1    6.3852   9.5778     6.3852   9.5778     6.3852   9.5778       22.6     13.1       22.6       13.1     0.0     0.0 
1 1 1    3    3   25 o   1876.0    8.5 35201.0586 319.8993 35201.0586 319.8993 35201.0586 319.8993     1876.0      8.5     1876.0        8.5     0.0     0.0 
1 1 1    3    3   26 o    132.5    4.3  176.2320  11.4934   176.2320  11.4934   176.2320  11.4934      132.5      4.3      132.5        4.3     0.0     0.0 
1 1 1    3    3   27 o    112.7    5.1  127.7043  11.4934   127.7043  11.4934   127.7043  11.4934      112.7      5.1      112.7        5.1     0.0     0.0 
1 1 1    3    3   28 o    905.4    4.5 8199.2559  82.3693  8199.2559  82.3693  8199.2559  82.3693      905.4      4.5      905.4        4.5     0.0     0.0 
1 1 1    3    3   29 o   1868.6    9.0 34925.2188 337.1394 34925.2188 337.1394 34925.2188 337.1394     1868.6      9.0     1868.6        9.0     0.0     0.0 
1 1 1    3    3   30 o    192.1    4.5  369.7040  17.2401   369.7040  17.2401   369.7040  17.2401      192.1      4.5      192.1        4.5     0.0     0.0 
1 1 1    3    3   31 o   1212.0    6.1 14692.3828 148.7755 14692.3828 148.7755 14692.3828 148.7755     1212.0      6.1     1212.0        6.1     0.0     0.0 
1 1 1    3    3   32 o    512.8    4.0 2630.7090  41.5039  2630.7090  41.5039  2630.7090  41.5039      512.8      4.0      512.8        4.0     0.0     0.0 
1 1 1    3    3   33 o   1105.7    5.3 12227.0508 117.4880 12227.0508 117.4880 12227.0508 117.4880     1105.7      5.3     1105.7        5.3     0.0     0.0 
1 1 1    3    3   34 o    899.3    5.0 8088.1533  89.3930  8088.1533  89.3930  8088.1533  89.3930      899.3      5.0      899.3        5.0     0.0     0.0 
1 1 1    3    3   35 o    639.5    3.8 4090.3694  49.1662  4090.3694  49.1662  4090.3694  49.1662      639.5      3.8      639.5        3.8     0.0     0.0 
1 1 1    3    3   36 o   1044.2    5.7 10904.0332 119.4035 10904.0332 119.4035 10904.0332 119.4035     1044.2      5.7     1044.2        5.7     0.0     0.0 
1 1 1    3    3   37 o   1989.3    9.1 39581.9570 363.9573 39581.9570 363.9573 39581.9570 363.9573     1989.3      9.1     1989.3        9.1     0.0     0.0 
1 1 1    3    3   38 o    433.9    3.8 1883.0002  32.5646  1883.0002  32.5646  1883.0002  32.5646      433.9      3.8      433.9        3.8     0.0     0.0 
1 1 1    3    3   39 o    898.4    5.0 8072.1899  90.0316  8072.1899  90.0316  8072.1899  90.0316      898.4      5.0      898.4        5.0     0.0     0.0 
1 1 1    3    3   40 o    711.4    4.2 5060.9224  59.3825  5060.9224  59.3825  5060.9224  59.3825      711.4      4.2      711.4        4.2     0.0     0.0 
1 1 1    3    3   41 o    504.3    3.6 2543.2314  36.3957  2543.2314  36.3957  2543.2314  36.3957      504.3      3.6      504.3        3.6     0.0     0.0 
1 1 1    3    3   42 o     52.0   22.0   38.3113  22.9868    38.3113  22.9868    38.3113  22.9868       52.0     22.0       52.0       22.0     0.0     0.0 
1 1 1    3    3   43 o    106.1   12.0  116.8494  24.9023   116.8494  24.9023   116.8494  24.9023      106.1     12.0      106.1       12.0     0.0     0.0 
1 1 1    3    3   44 o     22.7   15.8  -17.2401  23.6253   -17.2401  23.6253   -17.2401  23.6253       22.7     15.8       22.7       15.8     0.0     0.0 
1 1 1    3    3   45 f    847.0    4.6 7175.7065  77.2611  7175.7065  77.2611  7175.7065  77.2611      847.0      4.6      847.0        4.6     0.0     0.0 
1 1 1    3    3   46 o    170.4    8.3  292.4429  28.0950   292.4429  28.0950   292.4429  28.0950      170.4      8.3      170.4        8.3     0.0     0.0 
1 1 1    3    3   47 o    837.8    4.9 7020.5454  82.3693  7020.5454  82.3693  7020.5454  82.3693      837.8      4.9      837.8        4.9     0.0     0.0 
1 1 1    3    3   48 o    429.9    3.8 1848.5201  32.5646  1848.5201  32.5646  1848.5201  32.5646      429.9      3.8      429.9        3.8     0.0     0.0 
1 1 1    3    3   49 o    509.8    4.5 2600.0601  45.9736  2600.0601  45.9736  2600.0601  45.9736      509.8      4.5      509.8        4.5     0.0     0.0 
1 1 1    3    3   50 o    205.8    7.6  425.2554  31.2876   425.2554  31.2876   425.2554  31.2876      205.8      7.6      205.8        7.6     0.0     0.0 
1 1 1    3    3   51 o    902.8    4.7 8151.3667  84.9234  8151.3667  84.9234  8151.3667  84.9234      902.8      4.7      902.8        4.7     0.0     0.0 
1 1 1    3    3   52 o    542.4    4.1 2942.9460  44.0580  2942.9460  44.0580  2942.9460  44.0580      542.4      4.1      542.4        4.1     0.0     0.0 
1 1 1    3    3   53 o    373.8    4.5 1398.3623  33.8416  1398.3623  33.8416  1398.3623  33.8416      373.8      4.5      373.8        4.5     0.0     0.0 
1 1 1    3    3   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    3   55 o    442.8    4.4 1961.5386  38.9498  1961.5386  38.9498  1961.5386  38.9498      442.8      4.4      442.8        4.4     0.0     0.0 
1 1 1    3    3   56 o    577.7    3.9 3338.1909  44.6965  3338.1909  44.6965  3338.1909  44.6965      577.7      3.9      577.7        3.9     0.0     0.0 
1 1 1    3    3   57 o    407.8    4.1 1663.9874  33.2031  1663.9874  33.2031  1663.9874  33.2031      407.8      4.1      407.8        4.1     0.0     0.0 
1 1 1    3    3   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    3   59 o    612.4    4.0 3751.3145  48.5276  3751.3145  48.5276  3751.3145  48.5276      612.4      4.0      612.4        4.0     0.0     0.0 
1 1 1    3    3   60 o    127.2   11.5  166.0156  28.7335   166.0156  28.7335   166.0156  28.7335      127.2     11.5      127.2       11.5     0.0     0.0 
1 1 1    3    3   61 o    109.5   12.2  124.5117  26.1794   124.5117  26.1794   124.5117  26.1794      109.5     12.2      109.5       12.2     0.0     0.0 
1 1 1    3    3   62 o    409.4    4.2 1677.3964  34.4802  1677.3964  34.4802  1677.3964  34.4802      409.4      4.2      409.4        4.2     0.0     0.0 
1 1 1    3    3   63 o    225.9    6.4  512.0943  28.7335   512.0943  28.7335   512.0943  28.7335      225.9      6.4      225.9        6.4     0.0     0.0 
1 1 1    3    3   64 f    104.9   13.7  112.3798  28.7335   112.3798  28.7335   112.3798  28.7335      104.9     13.7      104.9       13.7     0.0     0.0 
1 1 1    3    3   65 o    132.5   11.7  180.0631  30.6490   180.0631  30.6490   180.0631  30.6490      132.5     11.7      132.5       11.7     0.0     0.0 
1 1 1    3    3   66 o    349.7    4.7 1224.0459  32.5646  1224.0459  32.5646  1224.0459  32.5646      349.7      4.7      349.7        4.7     0.0     0.0 
1 1 1    3    3   67 o     46.6   23.5   32.5646  26.8179    32.5646  26.8179    32.5646  26.8179       46.6     23.5       46.6       23.5     0.0     0.0 
1 1 1    3    3   68 o    241.0    6.0  582.3317  28.7335   582.3317  28.7335   582.3317  28.7335      241.0      6.0      241.0        6.0     0.0     0.0 
1 1 1    3    3   69 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    3   70 o    748.4    4.4 5604.9429  65.7677  5604.9429  65.7677  5604.9429  65.7677      748.4      4.4      748.4        4.4     0.0     0.0 
1 1 1    3    3   71 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    3   72 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    3    3   73 o    522.7    4.2 2734.1497  44.0580  2734.1497  44.0580  2734.1497  44.0580      522.7      4.2      522.7        4.2     0.0     0.0 
1 1 1    3    3   74 o    150.1   10.1  229.2293  30.0105   229.2293  30.0105   229.2293  30.0105      150.1     10.1      150.1       10.1     0.0     0.0 
1 1 1    3    3   75 o     18.3   13.5  -77.8996  31.2876   -77.8996  31.2876   -77.8996  31.2876       18.3     13.5       18.3       13.5     0.0     0.0 
1 1 1    3    3   76 o    278.8    6.0  779.6349  33.2031   779.6349  33.2031   779.6349  33.2031      278.8      6.0      278.8        6.0     0.0     0.0 
1 1 1    3    3   77 o     30.7   20.3   -3.8311  31.2876    -3.8311  31.2876    -3.8311  31.2876       30.7     20.3       30.7       20.3     0.0     0.0 
1 1 1    3    3   78 f    224.3    7.1  506.3477  31.9261   506.3477  31.9261   506.3477  31.9261      224.3      7.1      224.3        7.1     0.0     0.0 
1 1 1    3    3   79 f    302.7    5.3  918.8326  31.9261   918.8326  31.9261   918.8326  31.9261      302.7      5.3      302.7        5.3     0.0     0.0 
1 1 1    3    3   80 o     31.8   20.4    3.8311  28.7335     3.8311  28.7335     3.8311  28.7335       31.8     20.4       31.8       20.4     0.0     0.0 
1 1 1    3    3   81 o     22.3   16.2  -49.1662  33.2031   -49.1662  33.2031   -49.1662  33.2031       22.3     16.2       22.3       16.2     0.0     0.0 
1 1 1    3    3   82 o    150.0   12.5  233.0604  37.0343   233.0604  37.0343   233.0604  37.0343      150.0     12.5      150.0       12.5     0.0     0.0 
1 1 1    4    0    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    4    0    1 o    654.4    8.2 4284.4800 106.6331  4284.4800 106.6331  4284.4800 106.6331      654.4      8.2      654.4        8.2     0.0     0.0 
1 1 1    4    0    2 o    464.3    5.8 2156.9260  54.2743  2156.9260  54.2743  2156.9260  54.2743      464.3      5.8      464.3        5.8     0.0     0.0 
1 1 1    4    0    3 o    695.2    5.8 4833.6089  80.4537  4833.6089  80.4537  4833.6089  80.4537      695.2      5.8      695.2        5.8     0.0     0.0 
1 1 1    4    0    4 f    235.1    2.2  552.9597  10.2163   552.9597  10.2163   552.9597  10.2163      235.1      2.2      235.1        2.2     0.0     0.0 
1 1 1    4    0    5 o   1324.2    6.1 17537.6348 161.5460 17537.6348 161.5460 17537.6348 161.5460     1324.2      6.1     1324.2        6.1     0.0     0.0 
1 1 1    4    0    6 o   1128.8    5.3 12742.3379 118.7650 12742.3379 118.7650 12742.3379 118.7650     1128.8      5.3     1128.8        5.3     0.0     0.0 
1 1 1    4    0    7 o    943.3    4.5 8899.7148  84.2849  8899.7148  84.2849  8899.7148  84.2849      943.3      4.5      943.3        4.5     0.0     0.0 
1 1 1    4    0    8 o     73.6    2.2   54.2743   3.1926    54.2743   3.1926    54.2743   3.1926       73.6      2.2       73.6        2.2     0.0     0.0 
1 1 1    4    0    9 f    236.6    1.9  559.9835   8.9393   559.9835   8.9393   559.9835   8.9393      236.6      1.9      236.6        1.9     0.0     0.0 
1 1 1    4    0   10 o   1671.1    8.0 27930.8496 267.5406 27930.8496 267.5406 27930.8496 267.5406     1671.1      8.0     1671.1        8.0     0.0     0.0 
1 1 1    4    0   11 o    238.2    2.0  567.6458   9.5778   567.6458   9.5778   567.6458   9.5778      238.2      2.0      238.2        2.0     0.0     0.0 
1 1 1    4    0   12 o   1929.0    8.8 37217.5117 338.4165 37217.5117 338.4165 37217.5117 338.4165     1929.0      8.8     1929.0        8.8     0.0     0.0 
1 1 1    4    0   13 o   2273.3   10.3 51689.6055 467.3978 51689.6055 467.3978 51689.6055 467.3978     2273.3     10.3     2273.3       10.3     0.0     0.0 
1 1 1    4    0   14 o    928.6    4.4 8624.5117  82.3693  8624.5117  82.3693  8624.5117  82.3693      928.6      4.4      928.6        4.4     0.0     0.0 
1 1 1    4    0   15 o   3969.0   61.6 158481.7031 4887.8828 158481.7031 4887.8828 158481.7031 4887.8828     3969.0     61.6     3969.0       61.6     0.0     0.0 
1 1 1    4    0   16 f    836.6    4.2 7000.1128  70.2374  7000.1128  70.2374  7000.1128  70.2374      836.6      4.2      836.6        4.2     0.0     0.0 
1 1 1    4    0   17 o    312.8    2.3  978.8537  14.6860   978.8537  14.6860   978.8537  14.6860      312.8      2.3      312.8        2.3     0.0     0.0 
1 1 1    4    0   18 f    992.9    4.7 9859.4121  93.8627  9859.4121  93.8627  9859.4121  93.8627      992.9      4.7      992.9        4.7     0.0     0.0 
1 1 1    4    0   19 o    553.0    2.9 3058.5186  32.5646  3058.5186  32.5646  3058.5186  32.5646      553.0      2.9      553.0        2.9     0.0     0.0 
1 1 1    4    0   20 o    855.1    4.2 7312.9883  71.5144  7312.9883  71.5144  7312.9883  71.5144      855.1      4.2      855.1        4.2     0.0     0.0 
1 1 1    4    0   21 o    717.7    3.6 5151.5923  52.3588  5151.5923  52.3588  5151.5923  52.3588      717.7      3.6      717.7        3.6     0.0     0.0 
1 1 1    4    0   22 o    482.1    2.7 2324.8572  26.1794  2324.8572  26.1794  2324.8572  26.1794      482.1      2.7      482.1        2.7     0.0     0.0 
1 1 1    4    0   23 o    780.0    4.0 6084.4727  61.9366  6084.4727  61.9366  6084.4727  61.9366      780.0      4.0      780.0        4.0     0.0     0.0 
1 1 1    4    0   24 o    843.2    4.2 7111.2148  70.8759  7111.2148  70.8759  7111.2148  70.8759      843.2      4.2      843.2        4.2     0.0     0.0 
1 1 1    4    0   25 o    102.0    5.0  104.7175  10.2163   104.7175  10.2163   104.7175  10.2163      102.0      5.0      102.0        5.0     0.0     0.0 
1 1 1    4    0   26 o   1580.8    7.3 24993.6523 229.8678 24993.6523 229.8678 24993.6523 229.8678     1580.8      7.3     1580.8        7.3     0.0     0.0 
1 1 1    4    0   27 o    726.2    3.8 5274.8271  54.9129  5274.8271  54.9129  5274.8271  54.9129      726.2      3.8      726.2        3.8     0.0     0.0 
1 1 1    4    0   28 o    716.0    3.7 5127.3286  52.3588  5127.3286  52.3588  5127.3286  52.3588      716.0      3.7      716.0        3.7     0.0     0.0 
1 1 1    4    0   29 o    945.0    4.6 8930.3633  87.4775  8930.3633  87.4775  8930.3633  87.4775      945.0      4.6      945.0        4.6     0.0     0.0 
1 1 1    4    0   30 o    593.8    3.4 3526.5549  40.2269  3526.5549  40.2269  3526.5549  40.2269      593.8      3.4      593.8        3.4     0.0     0.0 
1 1 1    4    0   31 o   1271.8    6.0 16177.5850 152.6067 16177.5850 152.6067 16177.5850 152.6067     1271.8      6.0     1271.8        6.0     0.0     0.0 
1 1 1    4    0   32 o   1165.6    6.8 13588.3789 159.6304 13588.3789 159.6304 13588.3789 159.6304     1165.6      6.8     1165.6        6.8     0.0     0.0 
1 1 1    4    0   33 o   1707.4    7.9 29156.8125 268.1791 29156.8125 268.1791 29156.8125 268.1791     1707.4      7.9     1707.4        7.9     0.0     0.0 
1 1 1    4    0   34 o    114.2   12.9  135.3666  28.7335   135.3666  28.7335   135.3666  28.7335      114.2     12.9      114.2       12.9     0.0     0.0 
1 1 1    4    0   35 o   1285.9    6.7 16537.0703 171.7623 16537.0703 171.7623 16537.0703 171.7623     1285.9      6.7     1285.9        6.7     0.0     0.0 
1 1 1    4    0   36 o   1589.1    7.4 25257.3613 233.6989 25257.3613 233.6989 25257.3613 233.6989     1589.1      7.4     1589.1        7.4     0.0     0.0 
1 1 1    4    0   37 o   1413.5    6.8 19981.8945 192.8335 19981.8945 192.8335 19981.8945 192.8335     1413.5      6.8     1413.5        6.8     0.0     0.0 
1 1 1    4    0   38 o   1225.1    6.1 15011.0039 150.0526 15011.0039 150.0526 15011.0039 150.0526     1225.1      6.1     1225.1        6.1     0.0     0.0 
1 1 1    4    0   39 o    909.4    4.6 8270.7705  84.2849  8270.7705  84.2849  8270.7705  84.2849      909.4      4.6      909.4        4.6     0.0     0.0 
1 1 1    4    0   40 o   1097.3    5.6 12042.5176 122.5962 12042.5176 122.5962 12042.5176 122.5962     1097.3      5.6     1097.3        5.6     0.0     0.0 
1 1 1    4    0   41 o    239.4    5.9  574.0309  28.0950   574.0309  28.0950   574.0309  28.0950      239.4      5.9      239.4        5.9     0.0     0.0 
1 1 1    4    0   42 o    248.4    6.8  618.7275  33.8416   618.7275  33.8416   618.7275  33.8416      248.4      6.8      248.4        6.8     0.0     0.0 
1 1 1    4    0   43 f   1716.5    8.0 29469.0508 273.2873 29469.0508 273.2873 29469.0508 273.2873     1716.5      8.0     1716.5        8.0     0.0     0.0 
1 1 1    4    0   44 o   1947.2    8.9 37925.6328 346.7172 37925.6328 346.7172 37925.6328 346.7172     1947.2      8.9     1947.2        8.9     0.0     0.0 
1 1 1    4    0   45 o    792.1    4.4 6274.7520  69.5989  6274.7520  69.5989  6274.7520  69.5989      792.1      4.4      792.1        4.4     0.0     0.0 
1 1 1    4    0   46 o    588.4    4.1 3463.3416  48.5276  3463.3416  48.5276  3463.3416  48.5276      588.4      4.1      588.4        4.1     0.0     0.0 
1 1 1    4    0   47 o    685.1    4.2 4695.0493  58.1055  4695.0493  58.1055  4695.0493  58.1055      685.1      4.2      685.1        4.2     0.0     0.0 
1 1 1    4    0   48 o    529.1    4.1 2799.9172  43.4195  2799.9172  43.4195  2799.9172  43.4195      529.1      4.1      529.1        4.1     0.0     0.0 
1 1 1    4    0   49 o    480.8    4.0 2312.7253  38.3113  2312.7253  38.3113  2312.7253  38.3113      480.8      4.0      480.8        4.0     0.0     0.0 
1 1 1    4    0   50 f     15.4   11.5  -81.0922  26.1794   -81.0922  26.1794   -81.0922  26.1794       15.4     11.5       15.4       11.5     0.0     0.0 
1 1 1    4    0   51 o    335.0    4.6 1123.1595  30.6490  1123.1595  30.6490  1123.1595  30.6490      335.0      4.6      335.0        4.6     0.0     0.0 
1 1 1    4    0   52 o    598.8    4.1 3586.5762  49.1662  3586.5762  49.1662  3586.5762  49.1662      598.8      4.1      598.8        4.1     0.0     0.0 
1 1 1    4    0   53 o    300.6    5.2  904.7851  31.2876   904.7851  31.2876   904.7851  31.2876      300.6      5.2      300.6        5.2     0.0     0.0 
1 1 1    4    0   54 o    270.4    5.6  732.3843  30.0105   732.3843  30.0105   732.3843  30.0105      270.4      5.6      270.4        5.6     0.0     0.0 
1 1 1    4    0   55 o    511.0    3.9 2611.5535  39.5883  2611.5535  39.5883  2611.5535  39.5883      511.0      3.9      511.0        3.9     0.0     0.0 
1 1 1    4    0   56 f    756.2    4.2 5719.8765  63.2136  5719.8765  63.2136  5719.8765  63.2136      756.2      4.2      756.2        4.2     0.0     0.0 
1 1 1    4    0   57 o    386.2    5.0 1492.8635  38.3113  1492.8635  38.3113  1492.8635  38.3113      386.2      5.0      386.2        5.0     0.0     0.0 
1 1 1    4    0   58 o    205.6    7.2  424.6169  29.3720   424.6169  29.3720   424.6169  29.3720      205.6      7.2      205.6        7.2     0.0     0.0 
1 1 1    4    0   59 o     80.5   20.7   76.6226  28.7335    76.6226  28.7335    76.6226  28.7335       80.5     20.7       80.5       20.7     0.0     0.0 
1 1 1    4    0   60 o    147.1   10.7  220.2900  31.2876   220.2900  31.2876   220.2900  31.2876      147.1     10.7      147.1       10.7     0.0     0.0 
1 1 1    4    0   61 o    360.6    4.3 1301.3071  30.6490  1301.3071  30.6490  1301.3071  30.6490      360.6      4.3      360.6        4.3     0.0     0.0 
1 1 1    4    0   62 o     15.3   11.4  -77.8996  25.5409   -77.8996  25.5409   -77.8996  25.5409       15.3     11.4       15.3       11.4     0.0     0.0 
1 1 1    4    0   63 o    297.1    5.2  883.7139  30.6490   883.7139  30.6490   883.7139  30.6490      297.1      5.2      297.1        5.2     0.0     0.0 
1 1 1    4    0   64 o    124.5   10.9  158.9919  26.8179   158.9919  26.8179   158.9919  26.8179      124.5     10.9      124.5       10.9     0.0     0.0 
1 1 1    4    0   65 o    276.7    5.5  766.8644  30.6490   766.8644  30.6490   766.8644  30.6490      276.7      5.5      276.7        5.5     0.0     0.0 
1 1 1    4    0   66 o    355.7    4.7 1266.8269  33.2031  1266.8269  33.2031  1266.8269  33.2031      355.7      4.7      355.7        4.7     0.0     0.0 
1 1 1    4    0   67 o    221.9    6.6  494.2158  29.3720   494.2158  29.3720   494.2158  29.3720      221.9      6.6      221.9        6.6     0.0     0.0 
1 1 1    4    0   68 o    397.8    4.4 1583.5337  35.1187  1583.5337  35.1187  1583.5337  35.1187      397.8      4.4      397.8        4.4     0.0     0.0 
1 1 1    4    0   69 o    333.1    4.9 1111.0276  32.5646  1111.0276  32.5646  1111.0276  32.5646      333.1      4.9      333.1        4.9     0.0     0.0 
1 1 1    4    0   70 o    159.2    9.3  256.6857  29.3720   256.6857  29.3720   256.6857  29.3720      159.2      9.3      159.2        9.3     0.0     0.0 
1 1 1    4    0   71 o     33.5   21.4    5.1082  30.6490     5.1082  30.6490     5.1082  30.6490       33.5     21.4       33.5       21.4     0.0     0.0 
1 1 1    4    0   72 o     19.8   14.5  -72.7915  33.2031   -72.7915  33.2031   -72.7915  33.2031       19.8     14.5       19.8       14.5     0.0     0.0 
1 1 1    4    0   73 o    208.0    8.0  435.4717  33.2031   435.4717  33.2031   435.4717  33.2031      208.0      8.0      208.0        8.0     0.0     0.0 
1 1 1    4    0   74 o     20.4   14.8  -52.3588  30.0105   -52.3588  30.0105   -52.3588  30.0105       20.4     14.8       20.4       14.8     0.0     0.0 
1 1 1    4    0   75 o    290.2    5.6  844.1255  32.5646   844.1255  32.5646   844.1255  32.5646      290.2      5.6      290.2        5.6     0.0     0.0 
1 1 1    4    0   76 o    217.7    7.5  476.9756  32.5646   476.9756  32.5646   476.9756  32.5646      217.7      7.5      217.7        7.5     0.0     0.0 
1 1 1    4    0   77 o     74.4   23.5   70.8759  30.6490    70.8759  30.6490    70.8759  30.6490       74.4     23.5       74.4       23.5     0.0     0.0 
1 1 1    4    0   78 o    110.8   13.6  129.6199  29.3720   129.6199  29.3720   129.6199  29.3720      110.8     13.6      110.8       13.6     0.0     0.0 
1 1 1    4    0   79 o    154.9   10.0  244.5538  30.6490   244.5538  30.6490   244.5538  30.6490      154.9     10.0      154.9       10.0     0.0     0.0 
1 1 1    4    0   80 o    235.6    6.9  558.7064  32.5646   558.7064  32.5646   558.7064  32.5646      235.6      6.9      235.6        6.9     0.0     0.0 
1 1 1    4    0   81 o     75.6   19.1   68.3218  24.9023    68.3218  24.9023    68.3218  24.9023       75.6     19.1       75.6       19.1     0.0     0.0 
1 1 1    4    0   82 o     31.9   20.7    1.9156  30.6490     1.9156  30.6490     1.9156  30.6490       31.9     20.7       31.9       20.7     0.0     0.0 
1 1 1    4    1    0 o    165.4    3.1  273.9258  10.2163   273.9258  10.2163   273.9258  10.2163      165.4      3.1      165.4        3.1     0.0     0.0 
1 1 1    4    1    1 o    845.6    4.9    0.0000   0.0000          ?        ?  7151.4424  83.6463          ?        ?      845.6        4.9       ?       ? 
1 1 1    4    1    2 o    406.0    2.6    0.0000   0.0000          ?        ?  1648.0244  21.0712          ?        ?      406.0        2.6       ?       ? 
1 1 1    4    1    3 o    695.4    3.4    0.0000   0.0000          ?        ?  4835.5244  46.6121          ?        ?      695.4        3.4       ?       ? 
1 1 1    4    1    4 o    694.6    2.4    0.0000   0.0000          ?        ?  4825.3081  33.2031          ?        ?      694.6        2.4       ?       ? 
1 1 1    4    1    5 o   1085.3    3.6    0.0000   0.0000          ?        ? 11780.0859  79.1767          ?        ?     1085.3        3.6       ?       ? 
1 1 1    4    1    6 o    856.3    2.9    0.0000   0.0000          ?        ?  7332.7827  50.4432          ?        ?      856.3        2.9       ?       ? 
1 1 1    4    1    7 o   1196.1    3.9    0.0000   0.0000          ?        ? 14307.3535  93.8627          ?        ?     1196.1        3.9       ?       ? 
1 1 1    4    1    8 o    537.2    2.0    0.0000   0.0000          ?        ?  2885.4792  21.0712          ?        ?      537.2        2.0       ?       ? 
1 1 1    4    1    9 o    727.6    2.5    0.0000   0.0000          ?        ?  5293.9824  37.0343          ?        ?      727.6        2.5       ?       ? 
1 1 1    4    1   10 o    410.2    1.6    0.0000   0.0000          ?        ?  1682.5045  13.4090          ?        ?      410.2        1.6       ?       ? 
1 1 1    4    1   11 o    445.8    1.9    0.0000   0.0000          ?        ?  1987.7178  17.2401          ?        ?      445.8        1.9       ?       ? 
1 1 1    4    1   12 o   1077.6    3.6    0.0000   0.0000          ?        ? 11612.1543  77.8996          ?        ?     1077.6        3.6       ?       ? 
1 1 1    4    1   13 f   1032.1    3.5    0.0000   0.0000          ?        ? 10652.4570  71.5144          ?        ?     1032.1        3.5       ?       ? 
1 1 1    4    1   14 o   1767.4    5.8    0.0000   0.0000          ?        ? 31240.9492 204.9654          ?        ?     1767.4        5.8       ?       ? 
1 1 1    4    1   15 o   1126.4    3.7    0.0000   0.0000          ?        ? 12688.0635  84.2849          ?        ?     1126.4        3.7       ?       ? 
1 1 1    4    1   16 o    485.4    1.8    0.0000   0.0000          ?        ?  2356.1448  17.8786          ?        ?      485.4        1.8       ?       ? 
1 1 1    4    1   17 o    710.1    2.6    0.0000   0.0000          ?        ?  5042.4053  37.0343          ?        ?      710.1        2.6       ?       ? 
1 1 1    4    1   18 o   2464.1    7.8    0.0000   0.0000          ?        ? 60730.4297 385.0285          ?        ?     2464.1        7.8       ?       ? 
1 1 1    4    1   19 o    869.6    3.0    0.0000   0.0000          ?        ?  7562.0117  52.3588          ?        ?      869.6        3.0       ?       ? 
1 1 1    4    1   20 f   1707.4    5.5    0.0000   0.0000          ?        ? 29156.1758 189.0024          ?        ?     1707.4        5.5       ?       ? 
1 1 1    4    1   21 o   1147.3    3.8    0.0000   0.0000          ?        ? 13163.7627  88.1160          ?        ?     1147.3        3.8       ?       ? 
1 1 1    4    1   22 o    919.8    3.2    0.0000   0.0000          ?        ?  8459.7734  58.1055          ?        ?      919.8        3.2       ?       ? 
1 1 1    4    1   23 o    725.3    2.6    0.0000   0.0000          ?        ?  5260.7798  37.6728          ?        ?      725.3        2.6       ?       ? 
1 1 1    4    1   24 o   1012.9    3.4    0.0000   0.0000          ?        ? 10260.4043  69.5989          ?        ?     1012.9        3.4       ?       ? 
1 1 1    4    1   25 o    928.3    3.3    0.0000   0.0000          ?        ?  8618.7656  60.6596          ?        ?      928.3        3.3       ?       ? 
1 1 1    4    1   26 o    712.2    2.7    0.0000   0.0000          ?        ?  5072.4160  38.3113          ?        ?      712.2        2.7       ?       ? 
1 1 1    4    1   27 f    185.2    2.2    0.0000   0.0000          ?        ?   342.8861   8.3008          ?        ?      185.2        2.2       ?       ? 
1 1 1    4    1   28 o    945.1    3.2    0.0000   0.0000          ?        ?  8931.6406  61.2981          ?        ?      945.1        3.2       ?       ? 
1 1 1    4    1   29 o    479.8    2.1    0.0000   0.0000          ?        ?  2302.5090  20.4327          ?        ?      479.8        2.1       ?       ? 
1 1 1    4    1   30 o   1028.9    3.6    0.0000   0.0000          ?        ? 10587.3271  73.4300          ?        ?     1028.9        3.6       ?       ? 
1 1 1    4    1   31 o   1759.3    5.7    0.0000   0.0000          ?        ? 30953.6133 201.1343          ?        ?     1759.3        5.7       ?       ? 
1 1 1    4    1   32 o   1883.1    8.0    0.0000   0.0000          ?        ? 35469.8750 302.0207          ?        ?     1883.1        8.0       ?       ? 
1 1 1    4    1   33 o   1130.5    3.9    0.0000   0.0000          ?        ? 12780.0107  88.7545          ?        ?     1130.5        3.9       ?       ? 
1 1 1    4    1   34 o   1220.6    4.6    0.0000   0.0000          ?        ? 14899.2627 111.7413          ?        ?     1220.6        4.6       ?       ? 
1 1 1    4    1   35 o    615.7    2.7    0.0000   0.0000          ?        ?  3791.5413  33.2031          ?        ?      615.7        2.7       ?       ? 
1 1 1    4    1   36 o    946.2    3.3    0.0000   0.0000          ?        ?  8952.7119  63.2136          ?        ?      946.2        3.3       ?       ? 
1 1 1    4    1   37 o   1435.9    4.7    0.0000   0.0000          ?        ? 20620.4160 136.0051          ?        ?     1435.9        4.7       ?       ? 
1 1 1    4    1   38 o   1154.3    4.0    0.0000   0.0000          ?        ? 13324.6699  93.2242          ?        ?     1154.3        4.0       ?       ? 
1 1 1    4    1   39 o    438.2    2.5    0.0000   0.0000          ?        ?  1920.6730  21.7097          ?        ?      438.2        2.5       ?       ? 
1 1 1    4    1   40 o   1256.9    4.4    0.0000   0.0000          ?        ? 15800.2178 111.1028          ?        ?     1256.9        4.4       ?       ? 
1 1 1    4    1   41 o    300.9    3.2    0.0000   0.0000          ?        ?   905.4237  19.1556          ?        ?      300.9        3.2       ?       ? 
1 1 1    4    1   42 o   1187.2    4.0    0.0000   0.0000          ?        ? 14094.7256  95.7782          ?        ?     1187.2        4.0       ?       ? 
1 1 1    4    1   43 o   1159.4    4.0    0.0000   0.0000          ?        ? 13442.7959  92.5856          ?        ?     1159.4        4.0       ?       ? 
1 1 1    4    1   44 o   1030.4    3.7    0.0000   0.0000          ?        ? 10618.6143  76.6226          ?        ?     1030.4        3.7       ?       ? 
1 1 1    4    1   45 o    635.0    2.7    0.0000   0.0000          ?        ?  4032.9023  34.4802          ?        ?      635.0        2.7       ?       ? 
1 1 1    4    1   46 o     31.4   14.6    0.0000   0.0000          ?        ?   -21.0712  22.3483          ?        ?       31.4       14.6       ?       ? 
1 1 1    4    1   47 o   1081.6    4.0    0.0000   0.0000          ?        ? 11699.6318  85.5619          ?        ?     1081.6        4.0       ?       ? 
1 1 1    4    1   48 o    247.6    4.3    0.0000   0.0000          ?        ?   612.9808  21.0712          ?        ?      247.6        4.3       ?       ? 
1 1 1    4    1   49 o    810.8    3.2    0.0000   0.0000          ?        ?  6574.2188  51.7203          ?        ?      810.8        3.2       ?       ? 
1 1 1    4    1   50 f    930.1    3.4    0.0000   0.0000          ?        ?  8651.9678  62.5751          ?        ?      930.1        3.4       ?       ? 
1 1 1    4    1   51 o     82.6   13.1    0.0000   0.0000          ?        ?    68.3218  21.7097          ?        ?       82.6       13.1       ?       ? 
1 1 1    4    1   52 o    647.3    2.8    0.0000   0.0000          ?        ?  4190.6172  36.3957          ?        ?      647.3        2.8       ?       ? 
1 1 1    4    1   53 o    614.3    2.7    0.0000   0.0000          ?        ?  3774.3013  33.2031          ?        ?      614.3        2.7       ?       ? 
1 1 1    4    1   54 o    598.8    2.8    0.0000   0.0000          ?        ?  3586.5762  33.8416          ?        ?      598.8        2.8       ?       ? 
1 1 1    4    1   55 o    506.5    2.8    0.0000   0.0000          ?        ?  2566.2183  28.7335          ?        ?      506.5        2.8       ?       ? 
1 1 1    4    1   56 o    260.1    4.1    0.0000   0.0000          ?        ?   676.8329  21.0712          ?        ?      260.1        4.1       ?       ? 
1 1 1    4    1   57 o    547.4    2.9    0.0000   0.0000          ?        ?  2996.5820  31.9261          ?        ?      547.4        2.9       ?       ? 
1 1 1    4    1   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    4    1   59 o     32.1   14.2    0.0000   0.0000          ?        ?    -5.7467  17.8786          ?        ?       32.1       14.2       ?       ? 
1 1 1    4    1   60 o    560.1    2.7    0.0000   0.0000          ?        ?  3137.6953  30.6490          ?        ?      560.1        2.7       ?       ? 
1 1 1    4    1   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    4    1   62 o     84.0   11.4    0.0000   0.0000          ?        ?    70.8759  19.1556          ?        ?       84.0       11.4       ?       ? 
1 1 1    4    1   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    4    1   64 o    193.3    5.0    0.0000   0.0000          ?        ?   374.1737  19.1556          ?        ?      193.3        5.0       ?       ? 
1 1 1    4    1   65 o    337.2    3.2    0.0000   0.0000          ?        ?  1137.2070  21.7097          ?        ?      337.2        3.2       ?       ? 
1 1 1    4    1   66 o    189.0    5.2    0.0000   0.0000          ?        ?   357.5721  19.7942          ?        ?      189.0        5.2       ?       ? 
1 1 1    4    1   67 o    258.4    4.1    0.0000   0.0000          ?        ?   668.5321  21.0712          ?        ?      258.4        4.1       ?       ? 
1 1 1    4    1   68 o    161.6    6.5    0.0000   0.0000          ?        ?   261.7939  21.0712          ?        ?      161.6        6.5       ?       ? 
1 1 1    4    1   69 o    293.8    3.6    0.0000   0.0000          ?        ?   863.9198  21.0712          ?        ?      293.8        3.6       ?       ? 
1 1 1    4    1   70 o    212.3    5.0    0.0000   0.0000          ?        ?   451.4348  21.0712          ?        ?      212.3        5.0       ?       ? 
1 1 1    4    1   71 o    187.2    6.0    0.0000   0.0000          ?        ?   351.1869  22.3483          ?        ?      187.2        6.0       ?       ? 
1 1 1    4    1   72 o     77.8   14.1    0.0000   0.0000          ?        ?    63.2136  21.0712          ?        ?       77.8       14.1       ?       ? 
1 1 1    4    1   73 o    181.8    6.1    0.0000   0.0000          ?        ?   331.3927  22.3483          ?        ?      181.8        6.1       ?       ? 
1 1 1    4    1   74 o    218.4    5.3    0.0000   0.0000          ?        ?   478.2527  22.9868          ?        ?      218.4        5.3       ?       ? 
1 1 1    4    1   75 o    207.3    5.5    0.0000   0.0000          ?        ?   431.0021  22.9868          ?        ?      207.3        5.5       ?       ? 
1 1 1    4    1   76 o     58.5   17.3    0.0000   0.0000          ?        ?    35.7572  21.7097          ?        ?       58.5       17.3       ?       ? 
1 1 1    4    1   77 o    136.1    8.0    0.0000   0.0000          ?        ?   186.4483  21.7097          ?        ?      136.1        8.0       ?       ? 
1 1 1    4    1   78 o    156.4    6.7    0.0000   0.0000          ?        ?   245.8308  21.0712          ?        ?      156.4        6.7       ?       ? 
1 1 1    4    1   79 f     82.5   12.8    0.0000   0.0000          ?        ?    69.5989  21.0712          ?        ?       82.5       12.8       ?       ? 
1 1 1    4    1   80 o    109.8   10.5    0.0000   0.0000          ?        ?   122.5962  22.9868          ?        ?      109.8       10.5       ?       ? 
1 1 1    4    1   81 o     71.1   14.9    0.0000   0.0000          ?        ?    54.2743  20.4327          ?        ?       71.1       14.9       ?       ? 
1 1 1    4    1   82 o    111.1    9.8    0.0000   0.0000          ?        ?   125.7888  21.7097          ?        ?      111.1        9.8       ?       ? 
1 1 1    4    2    0 o    161.0    1.8  259.2398   5.7467   259.2398   5.7467   259.2398   5.7467      161.0      1.8      161.0        1.8     0.0     0.0 
1 1 1    4    2    1 o    231.5    1.4    0.0000   0.0000          ?        ?   535.7197   6.3852          ?        ?      231.5        1.4       ?       ? 
1 1 1    4    2    2 o   1425.3    5.6    0.0000   0.0000          ?        ? 20315.2051 160.2689          ?        ?     1425.3        5.6       ?       ? 
1 1 1    4    2    3 o    261.8    1.3    0.0000   0.0000          ?        ?   685.1337   7.0237          ?        ?      261.8        1.3       ?       ? 
1 1 1    4    2    4 o    325.9    1.4    0.0000   0.0000          ?        ?  1061.8615   8.9393          ?        ?      325.9        1.4       ?       ? 
1 1 1    4    2    5 o   1213.8    4.1    0.0000   0.0000          ?        ? 14733.8867  98.3323          ?        ?     1213.8        4.1       ?       ? 
1 1 1    4    2    6 o   1304.8    4.3    0.0000   0.0000          ?        ? 17024.9023 111.1028          ?        ?     1304.8        4.3       ?       ? 
1 1 1    4    2    7 o    774.9    2.7    0.0000   0.0000          ?        ?  6005.2959  41.5039          ?        ?      774.9        2.7       ?       ? 
1 1 1    4    2    8 o    412.0    1.5    0.0000   0.0000          ?        ?  1697.1904  12.7704          ?        ?      412.0        1.5       ?       ? 
1 1 1    4    2    9 o    742.9    2.6    0.0000   0.0000          ?        ?  5518.7422  38.9498          ?        ?      742.9        2.6       ?       ? 
1 1 1    4    2   10 o   2056.9    6.6    0.0000   0.0000          ?        ? 42314.1875 270.7332          ?        ?     2056.9        6.6       ?       ? 
1 1 1    4    2   11 o    816.3    2.9    0.0000   0.0000          ?        ?  6664.2500  46.6121          ?        ?      816.3        2.9       ?       ? 
1 1 1    4    2   12 o   1942.8    6.3    0.0000   0.0000          ?        ? 37747.4844 243.2767          ?        ?     1942.8        6.3       ?       ? 
1 1 1    4    2   13 o   1483.3    4.8    0.0000   0.0000          ?        ? 22004.0938 143.0288          ?        ?     1483.3        4.8       ?       ? 
1 1 1    4    2   14 o    969.2    3.4    0.0000   0.0000          ?        ?  9393.2910  65.1292          ?        ?      969.2        3.4       ?       ? 
1 1 1    4    2   15 o   2172.9    6.9    0.0000   0.0000          ?        ? 47223.1445 302.0207          ?        ?     2172.9        6.9       ?       ? 
1 1 1    4    2   16 o   1973.1    6.4    0.0000   0.0000          ?        ? 38935.1328 250.9390          ?        ?     1973.1        6.4       ?       ? 
1 1 1    4    2   17 f    928.6    3.2    0.0000   0.0000          ?        ?  8622.5967  60.0210          ?        ?      928.6        3.2       ?       ? 
1 1 1    4    2   18 o    964.0    3.3    0.0000   0.0000          ?        ?  9293.0439  63.2136          ?        ?      964.0        3.3       ?       ? 
1 1 1    4    2   19 o    623.7    2.3    0.0000   0.0000          ?        ?  3889.8738  28.7335          ?        ?      623.7        2.3       ?       ? 
1 1 1    4    2   20 o    410.5    1.8    0.0000   0.0000          ?        ?  1685.0586  14.6860          ?        ?      410.5        1.8       ?       ? 
1 1 1    4    2   21 o    948.8    3.3    0.0000   0.0000          ?        ?  9001.8779  61.9366          ?        ?      948.8        3.3       ?       ? 
1 1 1    4    2   22 o    716.9    2.5    0.0000   0.0000          ?        ?  5139.4609  36.3957          ?        ?      716.9        2.5       ?       ? 
1 1 1    4    2   23 o    535.7    2.0    0.0000   0.0000          ?        ?  2870.1548  21.7097          ?        ?      535.7        2.0       ?       ? 
1 1 1    4    2   24 o   1086.8    3.8    0.0000   0.0000          ?        ? 11812.6504  83.0078          ?        ?     1086.8        3.8       ?       ? 
1 1 1    4    2   25 o   1190.5    4.0    0.0000   0.0000          ?        ? 14174.5410  94.5012          ?        ?     1190.5        4.0       ?       ? 
1 1 1    4    2   26 o    531.4    2.1    0.0000   0.0000          ?        ?  2823.5427  22.3483          ?        ?      531.4        2.1       ?       ? 
1 1 1    4    2   27 o    789.2    2.9    0.0000   0.0000          ?        ?  6228.1401  45.3350          ?        ?      789.2        2.9       ?       ? 
1 1 1    4    2   28 o    775.3    2.8    0.0000   0.0000          ?        ?  6010.4038  44.0580          ?        ?      775.3        2.8       ?       ? 
1 1 1    4    2   29 o   1156.9    3.9    0.0000   0.0000          ?        ? 13384.0527  91.3086          ?        ?     1156.9        3.9       ?       ? 
1 1 1    4    2   30 f   1070.2    3.7    0.0000   0.0000          ?        ? 11453.8008  79.1767          ?        ?     1070.2        3.7       ?       ? 
1 1 1    4    2   31 o    593.8    2.6    0.0000   0.0000          ?        ?  3526.5549  30.6490          ?        ?      593.8        2.6       ?       ? 
1 1 1    4    2   32 o   1257.3    5.2    0.0000   0.0000          ?        ? 15809.1562 129.6199          ?        ?     1257.3        5.2       ?       ? 
1 1 1    4    2   33 o   1241.4    4.8    0.0000   0.0000          ?        ? 15410.7197 118.7650          ?        ?     1241.4        4.8       ?       ? 
1 1 1    4    2   34 o   2269.5    8.6    0.0000   0.0000          ?        ? 51517.2031 390.1367          ?        ?     2269.5        8.6       ?       ? 
1 1 1    4    2   35 o   1003.4    3.6    0.0000   0.0000          ?        ? 10068.8477  72.7915          ?        ?     1003.4        3.6       ?       ? 
1 1 1    4    2   36 o    357.3    2.6    0.0000   0.0000          ?        ?  1276.4047  18.5171          ?        ?      357.3        2.6       ?       ? 
1 1 1    4    2   37 o   1554.4    5.4    0.0000   0.0000          ?        ? 24162.2969 166.6541          ?        ?     1554.4        5.4       ?       ? 
1 1 1    4    2   38 o   1979.2    6.4    0.0000   0.0000          ?        ? 39175.8555 252.2160          ?        ?     1979.2        6.4       ?       ? 
1 1 1    4    2   39 o    946.1    3.3    0.0000   0.0000          ?        ?  8951.4346  63.2136          ?        ?      946.1        3.3       ?       ? 
1 1 1    4    2   40 o    589.1    2.5    0.0000   0.0000          ?        ?  3470.3650  30.0105          ?        ?      589.1        2.5       ?       ? 
1 1 1    4    2   41 o   1051.0    3.6    0.0000   0.0000          ?        ? 11047.7012  76.6226          ?        ?     1051.0        3.6       ?       ? 
1 1 1    4    2   42 o    419.4    3.0    0.0000   0.0000          ?        ?  1759.1271  24.9023          ?        ?      419.4        3.0       ?       ? 
1 1 1    4    2   43 o    722.7    2.8    0.0000   0.0000          ?        ?  5222.4688  40.8654          ?        ?      722.7        2.8       ?       ? 
1 1 1    4    2   44 o    365.1    2.8    0.0000   0.0000          ?        ?  1333.2332  20.4327          ?        ?      365.1        2.8       ?       ? 
1 1 1    4    2   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    4    2   46 f   1201.0    4.2    0.0000   0.0000          ?        ? 14426.1191 100.8864          ?        ?     1201.0        4.2       ?       ? 
1 1 1    4    2   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    4    2   48 o    968.0    3.7    0.0000   0.0000          ?        ?  9370.3047  70.8759          ?        ?      968.0        3.7       ?       ? 
1 1 1    4    2   49 o    504.7    2.8    0.0000   0.0000          ?        ?  2547.0627  28.0950          ?        ?      504.7        2.8       ?       ? 
1 1 1    4    2   50 o    538.5    2.7    0.0000   0.0000          ?        ?  2899.5269  29.3720          ?        ?      538.5        2.7       ?       ? 
1 1 1    4    2   51 o    525.5    2.8    0.0000   0.0000          ?        ?  2762.2446  29.3720          ?        ?      525.5        2.8       ?       ? 
1 1 1    4    2   52 o    747.8    3.2    0.0000   0.0000          ?        ?  5593.4492  47.2506          ?        ?      747.8        3.2       ?       ? 
1 1 1    4    2   53 o   1013.0    3.8    0.0000   0.0000          ?        ? 10263.5967  75.9841          ?        ?     1013.0        3.8       ?       ? 
1 1 1    4    2   54 o    578.0    2.8    0.0000   0.0000          ?        ?  3341.3835  31.9261          ?        ?      578.0        2.8       ?       ? 
1 1 1    4    2   55 o    588.8    2.9    0.0000   0.0000          ?        ?  3467.1724  34.4802          ?        ?      588.8        2.9       ?       ? 
1 1 1    4    2   56 f    469.6    2.9    0.0000   0.0000          ?        ?  2205.4536  26.8179          ?        ?      469.6        2.9       ?       ? 
1 1 1    4    2   57 o    263.8    3.9    0.0000   0.0000          ?        ?   695.9886  20.4327          ?        ?      263.8        3.9       ?       ? 
1 1 1    4    2   58 o     42.7   16.2    0.0000   0.0000          ?        ?    12.7704  19.1556          ?        ?       42.7       16.2       ?       ? 
1 1 1    4    2   59 o    156.1    6.1    0.0000   0.0000          ?        ?   243.9153  19.1556          ?        ?      156.1        6.1       ?       ? 
1 1 1    4    2   60 o     24.1   11.8    0.0000   0.0000          ?        ?   -37.6728  19.1556          ?        ?       24.1       11.8       ?       ? 
1 1 1    4    2   61 o    255.1    4.1    0.0000   0.0000          ?        ?   651.2921  21.0712          ?        ?      255.1        4.1       ?       ? 
1 1 1    4    2   62 o     43.4   16.1    0.0000   0.0000          ?        ?    14.6860  18.5171          ?        ?       43.4       16.1       ?       ? 
1 1 1    4    2   63 o    265.3    3.9    0.0000   0.0000          ?        ?   704.2894  20.4327          ?        ?      265.3        3.9       ?       ? 
1 1 1    4    2   64 o    284.8    3.8    0.0000   0.0000          ?        ?   811.5610  21.7097          ?        ?      284.8        3.8       ?       ? 
1 1 1    4    2   65 o    409.5    2.9    0.0000   0.0000          ?        ?  1677.3964  23.6253          ?        ?      409.5        2.9       ?       ? 
1 1 1    4    2   66 o     30.7   14.1    0.0000   0.0000          ?        ?   -14.6860  19.7942          ?        ?       30.7       14.1       ?       ? 
1 1 1    4    2   67 o    231.3    4.4    0.0000   0.0000          ?        ?   535.7197  20.4327          ?        ?      231.3        4.4       ?       ? 
1 1 1    4    2   68 o     64.2   15.6    0.0000   0.0000          ?        ?    43.4195  19.7942          ?        ?       64.2       15.6       ?       ? 
1 1 1    4    2   69 o     85.0   12.0    0.0000   0.0000          ?        ?    72.7915  20.4327          ?        ?       85.0       12.0       ?       ? 
1 1 1    4    2   70 o    185.0    5.7    0.0000   0.0000          ?        ?   342.8861  21.0712          ?        ?      185.0        5.7       ?       ? 
1 1 1    4    2   71 o    189.4    5.6    0.0000   0.0000          ?        ?   359.4877  21.0712          ?        ?      189.4        5.6       ?       ? 
1 1 1    4    2   72 o    127.7    9.0    0.0000   0.0000          ?        ?   164.1001  22.9868          ?        ?      127.7        9.0       ?       ? 
1 1 1    4    2   73 o    315.1    3.6    0.0000   0.0000          ?        ?   994.1782  22.9868          ?        ?      315.1        3.6       ?       ? 
1 1 1    4    2   74 o    196.6    5.4    0.0000   0.0000          ?        ?   387.5826  21.0712          ?        ?      196.6        5.4       ?       ? 
1 1 1    4    2   75 o    117.0    9.3    0.0000   0.0000          ?        ?   137.9207  21.7097          ?        ?      117.0        9.3       ?       ? 
1 1 1    4    2   76 o    153.3    7.1    0.0000   0.0000          ?        ?   236.2530  21.7097          ?        ?      153.3        7.1       ?       ? 
1 1 1    4    2   77 o     82.3   12.8    0.0000   0.0000          ?        ?    68.9603  21.0712          ?        ?       82.3       12.8       ?       ? 
1 1 1    4    2   78 o    109.8    9.6    0.0000   0.0000          ?        ?   121.9576  21.0712          ?        ?      109.8        9.6       ?       ? 
1 1 1    4    2   79 o    179.2    5.7    0.0000   0.0000          ?        ?   322.4534  20.4327          ?        ?      179.2        5.7       ?       ? 
1 1 1    4    2   80 f    196.5    5.8    0.0000   0.0000          ?        ?   388.2211  22.9868          ?        ?      196.5        5.8       ?       ? 
1 1 1    4    2   81 o     23.4   11.7    0.0000   0.0000          ?        ?   -58.1055  22.3483          ?        ?       23.4       11.7       ?       ? 
1 1 1    4    2   82 o    129.8    8.9    0.0000   0.0000          ?        ?   171.1238  22.9868          ?        ?      129.8        8.9       ?       ? 
1 1 1    4    3    0 o   1586.4    8.9 25169.8828 282.8651 25169.8828 282.8651 25169.8828 282.8651     1586.4      8.9     1586.4        8.9     0.0     0.0 
1 1 1    4    3    1 o   1172.8    4.7    0.0000   0.0000          ?        ? 13755.0322 111.1028          ?        ?     1172.8        4.7       ?       ? 
1 1 1    4    3    2 o    681.7    3.0    0.0000   0.0000          ?        ?  4647.1602  40.2269          ?        ?      681.7        3.0       ?       ? 
1 1 1    4    3    3 o    913.5    3.4    0.0000   0.0000          ?        ?  8345.4775  61.2981          ?        ?      913.5        3.4       ?       ? 
1 1 1    4    3    4 o   1526.8    5.2    0.0000   0.0000          ?        ? 23312.4238 160.2689          ?        ?     1526.8        5.2       ?       ? 
1 1 1    4    3    5 o   1690.7    5.4    0.0000   0.0000          ?        ? 28587.2520 183.8942          ?        ?     1690.7        5.4       ?       ? 
1 1 1    4    3    6 o   1708.4    5.5    0.0000   0.0000          ?        ? 29188.1016 188.3639          ?        ?     1708.4        5.5       ?       ? 
1 1 1    4    3    7 o    836.6    2.8    0.0000   0.0000          ?        ?  6999.4736  47.2506          ?        ?      836.6        2.8       ?       ? 
1 1 1    4    3    8 f   1784.3    5.7    0.0000   0.0000          ?        ? 31838.6035 204.9654          ?        ?     1784.3        5.7       ?       ? 
1 1 1    4    3    9 o   1281.9    4.2    0.0000   0.0000          ?        ? 16432.3535 108.5487          ?        ?     1281.9        4.2       ?       ? 
1 1 1    4    3   10 o    811.1    2.8    0.0000   0.0000          ?        ?  6578.6885  45.3350          ?        ?      811.1        2.8       ?       ? 
1 1 1    4    3   11 o   1329.2    4.4    0.0000   0.0000          ?        ? 17669.1699 116.2109          ?        ?     1329.2        4.4       ?       ? 
1 1 1    4    3   12 o   2459.5    7.9    0.0000   0.0000          ?        ? 60499.2891 386.3056          ?        ?     2459.5        7.9       ?       ? 
1 1 1    4    3   13 o     70.1    3.2    0.0000   0.0000          ?        ?    49.1662   4.4697          ?        ?       70.1        3.2       ?       ? 
1 1 1    4    3   14 o   2172.5    7.1    0.0000   0.0000          ?        ? 47203.9883 309.0445          ?        ?     2172.5        7.1       ?       ? 
1 1 1    4    3   15 o    618.1    2.3    0.0000   0.0000          ?        ?  3820.9136  28.7335          ?        ?      618.1        2.3       ?       ? 
1 1 1    4    3   16 o   2327.1    7.4    0.0000   0.0000          ?        ? 54162.5977 345.4402          ?        ?     2327.1        7.4       ?       ? 
1 1 1    4    3   17 o    898.2    3.1    0.0000   0.0000          ?        ?  8068.3589  56.1899          ?        ?      898.2        3.1       ?       ? 
1 1 1    4    3   18 o    278.9    1.6    0.0000   0.0000          ?        ?   777.7194   8.9393          ?        ?      278.9        1.6       ?       ? 
1 1 1    4    3   19 o    216.3    1.6    0.0000   0.0000          ?        ?   468.0364   7.0237          ?        ?      216.3        1.6       ?       ? 
1 1 1    4    3   20 o   1370.0    4.5    0.0000   0.0000          ?        ? 18771.2598 123.8732          ?        ?     1370.0        4.5       ?       ? 
1 1 1    4    3   21 o    794.7    2.8    0.0000   0.0000          ?        ?  6315.6172  44.0580          ?        ?      794.7        2.8       ?       ? 
1 1 1    4    3   22 o    663.5    2.5    0.0000   0.0000          ?        ?  4401.9683  32.5646          ?        ?      663.5        2.5       ?       ? 
1 1 1    4    3   23 o    555.5    2.2    0.0000   0.0000          ?        ?  3085.9749  24.2638          ?        ?      555.5        2.2       ?       ? 
1 1 1    4    3   24 o    713.5    2.6    0.0000   0.0000          ?        ?  5090.2944  37.0343          ?        ?      713.5        2.6       ?       ? 
1 1 1    4    3   25 f    378.4    1.8    0.0000   0.0000          ?        ?  1431.5654  13.4090          ?        ?      378.4        1.8       ?       ? 
1 1 1    4    3   26 o    488.7    2.0    0.0000   0.0000          ?        ?  2388.0708  19.7942          ?        ?      488.7        2.0       ?       ? 
1 1 1    4    3   27 o   1049.5    3.6    0.0000   0.0000          ?        ? 11014.4980  75.9841          ?        ?     1049.5        3.6       ?       ? 
1 1 1    4    3   28 o    952.9    3.4    0.0000   0.0000          ?        ?  9079.7773  63.8522          ?        ?      952.9        3.4       ?       ? 
1 1 1    4    3   29 o   1579.6    5.2    0.0000   0.0000          ?        ? 24952.7852 164.1001          ?        ?     1579.6        5.2       ?       ? 
1 1 1    4    3   30 o   1394.4    4.6    0.0000   0.0000          ?        ? 19444.8984 128.3428          ?        ?     1394.4        4.6       ?       ? 
1 1 1    4    3   31 o    970.1    3.4    0.0000   0.0000          ?        ?  9411.8086  65.1292          ?        ?      970.1        3.4       ?       ? 
1 1 1    4    3   32 f   1563.5    5.9    0.0000   0.0000          ?        ? 24448.9922 185.1713          ?        ?     1563.5        5.9       ?       ? 
1 1 1    4    3   33 o   1317.4    4.4    0.0000   0.0000          ?        ? 17355.6562 116.8494          ?        ?     1317.4        4.4       ?       ? 
1 1 1    4    3   34 o    915.3    4.0    0.0000   0.0000          ?        ?  8378.0420  72.7915          ?        ?      915.3        4.0       ?       ? 
1 1 1    4    3   35 o    375.4    2.9    0.0000   0.0000          ?        ?  1409.2172  21.7097          ?        ?      375.4        2.9       ?       ? 
1 1 1    4    3   36 o   1894.7    7.3    0.0000   0.0000          ?        ? 35902.7930 275.2028          ?        ?     1894.7        7.3       ?       ? 
1 1 1    4    3   37 o   1494.9    5.0    0.0000   0.0000          ?        ? 22347.6172 150.6911          ?        ?     1494.9        5.0       ?       ? 
1 1 1    4    3   38 o   1023.7    3.6    0.0000   0.0000          ?        ? 10479.4170  72.7915          ?        ?     1023.7        3.6       ?       ? 
1 1 1    4    3   39 o    882.4    3.2    0.0000   0.0000          ?        ?  7786.1328  56.1899          ?        ?      882.4        3.2       ?       ? 
1 1 1    4    3   40 o    647.9    2.7    0.0000   0.0000          ?        ?  4197.6411  34.4802          ?        ?      647.9        2.7       ?       ? 
1 1 1    4    3   41 o   1139.4    4.0    0.0000   0.0000          ?        ? 12982.4219  90.6701          ?        ?     1139.4        4.0       ?       ? 
1 1 1    4    3   42 o    735.0    2.9    0.0000   0.0000          ?        ?  5403.1699  42.7809          ?        ?      735.0        2.9       ?       ? 
1 1 1    4    3   43 o    284.0    3.3    0.0000   0.0000          ?        ?   806.4528  18.5171          ?        ?      284.0        3.3       ?       ? 
1 1 1    4    3   44 o    773.0    3.1    0.0000   0.0000          ?        ?  5975.2852  47.8891          ?        ?      773.0        3.1       ?       ? 
1 1 1    4    3   45 o     89.3   11.1    0.0000   0.0000          ?        ?    79.8152  19.7942          ?        ?       89.3       11.1       ?       ? 
1 1 1    4    3   46 o    587.5    2.9    0.0000   0.0000          ?        ?  3451.2095  33.8416          ?        ?      587.5        2.9       ?       ? 
1 1 1    4    3   47 o    799.7    3.1    0.0000   0.0000          ?        ?  6396.0713  49.1662          ?        ?      799.7        3.1       ?       ? 
1 1 1    4    3   48 o    295.6    4.3    0.0000   0.0000          ?        ?   874.1360  25.5409          ?        ?      295.6        4.3       ?       ? 
1 1 1    4    3   49 o    212.5    4.7    0.0000   0.0000          ?        ?   451.4348  19.7942          ?        ?      212.5        4.7       ?       ? 
1 1 1    4    3   50 o    392.2    2.9    0.0000   0.0000          ?        ?  1538.1986  22.9868          ?        ?      392.2        2.9       ?       ? 
1 1 1    4    3   51 o    388.8    3.1    0.0000   0.0000          ?        ?  1512.0193  24.2638          ?        ?      388.8        3.1       ?       ? 
1 1 1    4    3   52 o    674.1    2.9    0.0000   0.0000          ?        ?  4544.9971  38.9498          ?        ?      674.1        2.9       ?       ? 
1 1 1    4    3   53 o    514.4    2.9    0.0000   0.0000          ?        ?  2646.0337  29.3720          ?        ?      514.4        2.9       ?       ? 
1 1 1    4    3   54 o    918.0    3.4    0.0000   0.0000          ?        ?  8428.4854  61.9366          ?        ?      918.0        3.4       ?       ? 
1 1 1    4    3   55 o    459.3    2.8    0.0000   0.0000          ?        ?  2109.6753  25.5409          ?        ?      459.3        2.8       ?       ? 
1 1 1    4    3   56 o    577.6    2.8    0.0000   0.0000          ?        ?  3336.9138  31.9261          ?        ?      577.6        2.8       ?       ? 
1 1 1    4    3   57 o    322.5    3.5    0.0000   0.0000          ?        ?  1040.1517  22.3483          ?        ?      322.5        3.5       ?       ? 
1 1 1    4    3   58 o    518.9    2.7    0.0000   0.0000          ?        ?  2693.2842  28.0950          ?        ?      518.9        2.7       ?       ? 
1 1 1    4    3   59 o    211.3    4.8    0.0000   0.0000          ?        ?   446.9651  20.4327          ?        ?      211.3        4.8       ?       ? 
1 1 1    4    3   60 o    179.1    5.2    0.0000   0.0000          ?        ?   321.1764  18.5171          ?        ?      179.1        5.2       ?       ? 
1 1 1    4    3   61 o    223.0    4.3    0.0000   0.0000          ?        ?   497.4084  19.1556          ?        ?      223.0        4.3       ?       ? 
1 1 1    4    3   62 o    237.9    4.0    0.0000   0.0000          ?        ?   566.3687  19.1556          ?        ?      237.9        4.0       ?       ? 
1 1 1    4    3   63 o    467.4    2.9    0.0000   0.0000          ?        ?  2185.6594  26.8179          ?        ?      467.4        2.9       ?       ? 
1 1 1    4    3   64 o    401.9    2.9    0.0000   0.0000          ?        ?  1616.0983  23.6253          ?        ?      401.9        2.9       ?       ? 
1 1 1    4    3   65 o    193.3    5.5    0.0000   0.0000          ?        ?   374.1737  21.0712          ?        ?      193.3        5.5       ?       ? 
1 1 1    4    3   66 o    378.0    3.1    0.0000   0.0000          ?        ?  1429.6499  23.6253          ?        ?      378.0        3.1       ?       ? 
1 1 1    4    3   67 o     44.9   16.4    0.0000   0.0000          ?        ?    16.6016  19.1556          ?        ?       44.9       16.4       ?       ? 
1 1 1    4    3   68 o    213.5    5.1    0.0000   0.0000          ?        ?   456.5430  21.7097          ?        ?      213.5        5.1       ?       ? 
1 1 1    4    3   69 o    210.0    5.2    0.0000   0.0000          ?        ?   441.8569  21.7097          ?        ?      210.0        5.2       ?       ? 
1 1 1    4    3   70 o    150.3    7.4    0.0000   0.0000          ?        ?   226.6752  22.3483          ?        ?      150.3        7.4       ?       ? 
1 1 1    4    3   71 o    112.1    9.7    0.0000   0.0000          ?        ?   126.4273  21.7097          ?        ?      112.1        9.7       ?       ? 
1 1 1    4    3   72 o     27.2   13.1    0.0000   0.0000          ?        ?   -34.4802  21.7097          ?        ?       27.2       13.1       ?       ? 
1 1 1    4    3   73 o    207.2    5.2    0.0000   0.0000          ?        ?   430.3636  21.7097          ?        ?      207.2        5.2       ?       ? 
1 1 1    4    3   74 o    114.2    9.8    0.0000   0.0000          ?        ?   131.5355  22.3483          ?        ?      114.2        9.8       ?       ? 
1 1 1    4    3   75 o    214.8    5.1    0.0000   0.0000          ?        ?   462.2897  21.7097          ?        ?      214.8        5.1       ?       ? 
1 1 1    4    3   76 o    219.4    5.1    0.0000   0.0000          ?        ?   482.7224  22.3483          ?        ?      219.4        5.1       ?       ? 
1 1 1    4    3   77 o    117.4    9.0    0.0000   0.0000          ?        ?   139.1977  21.0712          ?        ?      117.4        9.0       ?       ? 
1 1 1    4    3   78 o    100.7   10.1    0.0000   0.0000          ?        ?   102.8020  20.4327          ?        ?      100.7       10.1       ?       ? 
1 1 1    4    3   79 o    176.0    6.7    0.0000   0.0000          ?        ?   311.5985  23.6253          ?        ?      176.0        6.7       ?       ? 
1 1 1    4    3   80 o    175.5    6.0    0.0000   0.0000          ?        ?   309.6830  21.0712          ?        ?      175.5        6.0       ?       ? 
1 1 1    4    3   81 o     32.6   15.1    0.0000   0.0000          ?        ?   -18.5171  23.6253          ?        ?       32.6       15.1       ?       ? 
1 1 1    4    3   82 o     31.7   14.9    0.0000   0.0000          ?        ?   -23.6253  24.2638          ?        ?       31.7       14.9       ?       ? 
1 1 1    4    4    0 o   1965.6   17.9 38653.5469 703.6508 38653.5469 703.6508 38653.5469 703.6508     1965.6     17.9     1965.6       17.9     0.0     0.0 
1 1 1    4    4    1 o    294.8    2.1  869.0280  12.1319   869.0280  12.1319   869.0280  12.1319      294.8      2.1      294.8        2.1     0.0     0.0 
1 1 1    4    4    2 o   1181.8    6.4 13968.9375 150.6911 13968.9375 150.6911 13968.9375 150.6911     1181.8      6.4     1181.8        6.4     0.0     0.0 
1 1 1    4    4    3 o    753.7    4.5 5681.5654  67.6833  5681.5654  67.6833  5681.5654  67.6833      753.7      4.5      753.7        4.5     0.0     0.0 
1 1 1    4    4    4 o    488.7    2.7 2388.7095  26.1794  2388.7095  26.1794  2388.7095  26.1794      488.7      2.7      488.7        2.7     0.0     0.0 
1 1 1    4    4    5 o   2721.6   18.7 74111.9297 1018.4420 74111.9297 1018.4420 74111.9297 1018.4420     2721.6     18.7     2721.6       18.7     0.0     0.0 
1 1 1    4    4    6 o   1095.1    5.7 11993.9902 123.8732 11993.9902 123.8732 11993.9902 123.8732     1095.1      5.7     1095.1        5.7     0.0     0.0 
1 1 1    4    4    7 o   1103.3    5.2 12173.4150 113.6568 12173.4150 113.6568 12173.4150 113.6568     1103.3      5.2     1103.3        5.2     0.0     0.0 
1 1 1    4    4    8 o    187.0    2.6  349.9099   9.5778   349.9099   9.5778   349.9099   9.5778      187.0      2.6      187.0        2.6     0.0     0.0 
1 1 1    4    4    9 o    923.2    4.5 8523.6250  82.3693  8523.6250  82.3693  8523.6250  82.3693      923.2      4.5      923.2        4.5     0.0     0.0 
1 1 1    4    4   10 o   1681.3    7.7 28270.5449 259.2398 28270.5449 259.2398 28270.5449 259.2398     1681.3      7.7     1681.3        7.7     0.0     0.0 
1 1 1    4    4   11 o   1600.1    7.4 25607.2715 237.5300 25607.2715 237.5300 25607.2715 237.5300     1600.1      7.4     1600.1        7.4     0.0     0.0 
1 1 1    4    4   12 o    397.8    2.5 1582.8950  19.7942  1582.8950  19.7942  1582.8950  19.7942      397.8      2.5      397.8        2.5     0.0     0.0 
1 1 1    4    4   13 o   3723.4   40.8 139013.1719 3038.0859 139013.1719 3038.0859 139013.1719 3038.0859     3723.4     40.8     3723.4       40.8     0.0     0.0 
1 1 1    4    4   14 o    874.3    4.5 7645.0195  78.5382  7645.0195  78.5382  7645.0195  78.5382      874.3      4.5      874.3        4.5     0.0     0.0 
1 1 1    4    4   15 o   1149.0    5.5 13204.6270 126.4273 13204.6270 126.4273 13204.6270 126.4273     1149.0      5.5     1149.0        5.5     0.0     0.0 
1 1 1    4    4   16 o   1471.3    7.1 21649.0762 209.4351 21649.0762 209.4351 21649.0762 209.4351     1471.3      7.1     1471.3        7.1     0.0     0.0 
1 1 1    4    4   17 o    958.5    4.7 9187.6875  89.3930  9187.6875  89.3930  9187.6875  89.3930      958.5      4.7      958.5        4.7     0.0     0.0 
1 1 1    4    4   18 o   1797.3    8.2 32307.2793 296.2740 32307.2793 296.2740 32307.2793 296.2740     1797.3      8.2     1797.3        8.2     0.0     0.0 
1 1 1    4    4   19 o     46.8    8.2   23.6253   7.0237    23.6253   7.0237    23.6253   7.0237       46.8      8.2       46.8        8.2     0.0     0.0 
1 1 1    4    4   20 o    252.1    2.4  635.9675  12.1319   635.9675  12.1319   635.9675  12.1319      252.1      2.4      252.1        2.4     0.0     0.0 
1 1 1    4    4   21 o    661.0    3.6 4369.4033  47.2506  4369.4033  47.2506  4369.4033  47.2506      661.0      3.6      661.0        3.6     0.0     0.0 
1 1 1    4    4   22 o    639.1    3.4 4084.6228  44.0580  4084.6228  44.0580  4084.6228  44.0580      639.1      3.4      639.1        3.4     0.0     0.0 
1 1 1    4    4   23 o    208.6    2.4  435.4717  10.2163   435.4717  10.2163   435.4717  10.2163      208.6      2.4      208.6        2.4     0.0     0.0 
1 1 1    4    4   24 o    825.2    4.1 6810.4717  67.6833  6810.4717  67.6833  6810.4717  67.6833      825.2      4.1      825.2        4.1     0.0     0.0 
1 1 1    4    4   25 o    508.0    2.9 2580.9045  29.3720  2580.9045  29.3720  2580.9045  29.3720      508.0      2.9      508.0        2.9     0.0     0.0 
1 1 1    4    4   26 o    907.3    4.4 8233.0977  80.4537  8233.0977  80.4537  8233.0977  80.4537      907.3      4.4      907.3        4.4     0.0     0.0 
1 1 1    4    4   27 o    120.9    5.0  146.8600  12.1319   146.8600  12.1319   146.8600  12.1319      120.9      5.0      120.9        5.0     0.0     0.0 
1 1 1    4    4   28 o    799.5    4.1 6392.2397  65.7677  6392.2397  65.7677  6392.2397  65.7677      799.5      4.1      799.5        4.1     0.0     0.0 
1 1 1    4    4   29 o    251.4    3.4  632.1364  17.2401   632.1364  17.2401   632.1364  17.2401      251.4      3.4      251.4        3.4     0.0     0.0 
1 1 1    4    4   30 o   1422.4    7.0 20236.6660 197.9417 20236.6660 197.9417 20236.6660 197.9417     1422.4      7.0     1422.4        7.0     0.0     0.0 
1 1 1    4    4   31 o    741.0    4.2 5491.9243  62.5751  5491.9243  62.5751  5491.9243  62.5751      741.0      4.2      741.0        4.2     0.0     0.0 
1 1 1    4    4   32 o     37.8   23.7    8.9393  36.3957     8.9393  36.3957     8.9393  36.3957       37.8     23.7       37.8       23.7     0.0     0.0 
1 1 1    4    4   33 o     70.8   14.9   56.1899  18.5171    56.1899  18.5171    56.1899  18.5171       70.8     14.9       70.8       14.9     0.0     0.0 
1 1 1    4    4   34 o   1266.4    7.4 16041.5791 187.7254 16041.5791 187.7254 16041.5791 187.7254     1266.4      7.4     1266.4        7.4     0.0     0.0 
1 1 1    4    4   35 o     49.0   26.5   34.4802  35.7572    34.4802  35.7572    34.4802  35.7572       49.0     26.5       49.0       26.5     0.0     0.0 
1 1 1    4    4   36 o   1990.2    9.1 39615.7969 362.0418 39615.7969 362.0418 39615.7969 362.0418     1990.2      9.1     1990.2        9.1     0.0     0.0 
1 1 1    4    4   37 o    356.0    4.0 1268.1040  28.7335  1268.1040  28.7335  1268.1040  28.7335      356.0      4.0      356.0        4.0     0.0     0.0 
1 1 1    4    4   38 o    107.6   11.8  120.0421  24.9023   120.0421  24.9023   120.0421  24.9023      107.6     11.8      107.6       11.8     0.0     0.0 
1 1 1    4    4   39 o    855.7    4.4 7322.5664  75.9841  7322.5664  75.9841  7322.5664  75.9841      855.7      4.4      855.7        4.4     0.0     0.0 
1 1 1    4    4   40 o    440.1    4.6 1937.2745  40.8654  1937.2745  40.8654  1937.2745  40.8654      440.1      4.6      440.1        4.6     0.0     0.0 
1 1 1    4    4   41 o    576.5    3.8 3324.1433  44.0580  3324.1433  44.0580  3324.1433  44.0580      576.5      3.8      576.5        3.8     0.0     0.0 
1 1 1    4    4   42 f    653.3    4.3 4269.1553  56.1899  4269.1553  56.1899  4269.1553  56.1899      653.3      4.3      653.3        4.3     0.0     0.0 
1 1 1    4    4   43 o    621.1    4.2 3858.5862  52.3588  3858.5862  52.3588  3858.5862  52.3588      621.1      4.2      621.1        4.2     0.0     0.0 
1 1 1    4    4   44 o    965.6    5.1 9324.3320  98.9709  9324.3320  98.9709  9324.3320  98.9709      965.6      5.1      965.6        5.1     0.0     0.0 
1 1 1    4    4   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    4    4   46 o   1241.2    6.3 15408.8037 156.4378 15408.8037 156.4378 15408.8037 156.4378     1241.2      6.3     1241.2        6.3     0.0     0.0 
1 1 1    4    4   47 o    240.1    6.3  577.8621  30.0105   577.8621  30.0105   577.8621  30.0105      240.1      6.3      240.1        6.3     0.0     0.0 
1 1 1    4    4   48 o    682.5    4.2 4658.6538  56.8284  4658.6538  56.8284  4658.6538  56.8284      682.5      4.2      682.5        4.2     0.0     0.0 
1 1 1    4    4   49 o   1085.7    5.4 11789.0254 116.8494 11789.0254 116.8494 11789.0254 116.8494     1085.7      5.4     1085.7        5.4     0.0     0.0 
1 1 1    4    4   50 o    189.7    8.1  362.0418  30.6490   362.0418  30.6490   362.0418  30.6490      189.7      8.1      189.7        8.1     0.0     0.0 
1 1 1    4    4   51 o   1044.4    5.7 10911.6963 119.4035 10911.6963 119.4035 10911.6963 119.4035     1044.4      5.7     1044.4        5.7     0.0     0.0 
1 1 1    4    4   52 o    146.0   11.1  217.0974  31.9261   217.0974  31.9261   217.0974  31.9261      146.0     11.1      146.0       11.1     0.0     0.0 
1 1 1    4    4   53 o     89.5   20.1   91.3086  31.2876    91.3086  31.2876    91.3086  31.2876       89.5     20.1       89.5       20.1     0.0     0.0 
1 1 1    4    4   54 o    393.3    4.8 1547.7764  37.6728  1547.7764  37.6728  1547.7764  37.6728      393.3      4.8      393.3        4.8     0.0     0.0 
1 1 1    4    4   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    4    4   56 o    566.1    4.1 3206.0171  45.9736  3206.0171  45.9736  3206.0171  45.9736      566.1      4.1      566.1        4.1     0.0     0.0 
1 1 1    4    4   57 o    275.8    5.6  761.7563  30.6490   761.7563  30.6490   761.7563  30.6490      275.8      5.6      275.8        5.6     0.0     0.0 
1 1 1    4    4   58 o    361.9    4.3 1310.2463  31.2876  1310.2463  31.2876  1310.2463  31.2876      361.9      4.3      361.9        4.3     0.0     0.0 
1 1 1    4    4   59 o    268.9    5.1  724.0836  27.4564   724.0836  27.4564   724.0836  27.4564      268.9      5.1      268.9        5.1     0.0     0.0 
1 1 1    4    4   60 o     31.3   19.5    7.0237  24.2638     7.0237  24.2638     7.0237  24.2638       31.3     19.5       31.3       19.5     0.0     0.0 
1 1 1    4    4   61 o     23.3   16.3  -25.5409  27.4564   -25.5409  27.4564   -25.5409  27.4564       23.3     16.3       23.3       16.3     0.0     0.0 
1 1 1    4    4   62 o     42.6   23.7   25.5409  29.3720    25.5409  29.3720    25.5409  29.3720       42.6     23.7       42.6       23.7     0.0     0.0 
1 1 1    4    4   63 o    276.1    5.4  763.6719  30.0105   763.6719  30.0105   763.6719  30.0105      276.1      5.4      276.1        5.4     0.0     0.0 
1 1 1    4    4   64 o    201.0    7.5  406.0997  30.0105   406.0997  30.0105   406.0997  30.0105      201.0      7.5      201.0        7.5     0.0     0.0 
1 1 1    4    4   65 o    208.7    6.6  437.3873  27.4564   437.3873  27.4564   437.3873  27.4564      208.7      6.6      208.7        6.6     0.0     0.0 
1 1 1    4    4   66 o    136.8    9.7  190.2794  26.1794   190.2794  26.1794   190.2794  26.1794      136.8      9.7      136.8        9.7     0.0     0.0 
1 1 1    4    4   67 o     17.2   12.7  -79.8152  29.3720   -79.8152  29.3720   -79.8152  29.3720       17.2     12.7       17.2       12.7     0.0     0.0 
1 1 1    4    4   68 o    160.6    9.2  261.1554  29.3720   261.1554  29.3720   261.1554  29.3720      160.6      9.2      160.6        9.2     0.0     0.0 
1 1 1    4    4   69 o    306.4    5.5  940.5424  33.8416   940.5424  33.8416   940.5424  33.8416      306.4      5.5      306.4        5.5     0.0     0.0 
1 1 1    4    4   70 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    4    4   71 o     34.4   21.5    8.9393  29.3720     8.9393  29.3720     8.9393  29.3720       34.4     21.5       34.4       21.5     0.0     0.0 
1 1 1    4    4   72 o    524.9    4.1 2757.1362  42.7809  2757.1362  42.7809  2757.1362  42.7809      524.9      4.1      524.9        4.1     0.0     0.0 
1 1 1    4    4   73 o     66.0   26.2   61.2981  33.2031    61.2981  33.2031    61.2981  33.2031       66.0     26.2       66.0       26.2     0.0     0.0 
1 1 1    4    4   74 o     17.8   13.2  -83.0078  31.2876   -83.0078  31.2876   -83.0078  31.2876       17.8     13.2       17.8       13.2     0.0     0.0 
1 1 1    4    4   75 o    124.1   12.3  159.6304  30.0105   159.6304  30.0105   159.6304  30.0105      124.1     12.3      124.1       12.3     0.0     0.0 
1 1 1    4    4   76 o    121.1   12.6  152.6067  30.0105   152.6067  30.0105   152.6067  30.0105      121.1     12.6      121.1       12.6     0.0     0.0 
1 1 1    4    4   77 o     59.0   25.4   51.0817  30.6490    51.0817  30.6490    51.0817  30.6490       59.0     25.4       59.0       25.4     0.0     0.0 
1 1 1    4    4   78 o    119.3   12.3  148.1370  28.7335   148.1370  28.7335   148.1370  28.7335      119.3     12.3      119.3       12.3     0.0     0.0 
1 1 1    4    4   79 o    615.9    4.3 3798.5654  52.9973  3798.5654  52.9973  3798.5654  52.9973      615.9      4.3      615.9        4.3     0.0     0.0 
1 1 1    4    4   80 o    255.6    6.6  657.0388  33.8416   657.0388  33.8416   657.0388  33.8416      255.6      6.6      255.6        6.6     0.0     0.0 
1 1 1    4    4   81 o     14.6   11.0  -94.5012  26.8179   -94.5012  26.8179   -94.5012  26.8179       14.6     11.0       14.6       11.0     0.0     0.0 
1 1 1    4    4   82 o    145.5   10.9  217.7359  31.2876   217.7359  31.2876   217.7359  31.2876      145.5     10.9      145.5       10.9     0.0     0.0 
1 1 1    5    0    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    5    0    1 o   1291.9   10.2 16694.1484 263.0709 16694.1484 263.0709 16694.1484 263.0709     1291.9     10.2     1291.9       10.2     0.0     0.0 
1 1 1    5    0    2 o    895.5    6.1 8020.4702 108.5487  8020.4702 108.5487  8020.4702 108.5487      895.5      6.1      895.5        6.1     0.0     0.0 
1 1 1    5    0    3 o    750.2    3.7 5627.9297  56.1899  5627.9297  56.1899  5627.9297  56.1899      750.2      3.7      750.2        3.7     0.0     0.0 
1 1 1    5    0    4 o    141.6    1.8  200.4958   5.1082   200.4958   5.1082   200.4958   5.1082      141.6      1.8      141.6        1.8     0.0     0.0 
1 1 1    5    0    5 o    622.9    3.1 3880.9343  38.3113  3880.9343  38.3113  3880.9343  38.3113      622.9      3.1      622.9        3.1     0.0     0.0 
1 1 1    5    0    6 o    755.1    3.8 5701.9980  56.8284  5701.9980  56.8284  5701.9980  56.8284      755.1      3.8      755.1        3.8     0.0     0.0 
1 1 1    5    0    7 o   1073.5    5.1 11525.9541 108.5487 11525.9541 108.5487 11525.9541 108.5487     1073.5      5.1     1073.5        5.1     0.0     0.0 
1 1 1    5    0    8 o   1387.5    6.4 19253.3438 176.8705 19253.3438 176.8705 19253.3438 176.8705     1387.5      6.4     1387.5        6.4     0.0     0.0 
1 1 1    5    0    9 o    378.9    2.3 1436.0352  17.2401  1436.0352  17.2401  1436.0352  17.2401      378.9      2.3      378.9        2.3     0.0     0.0 
1 1 1    5    0   10 o    701.5    3.5 4921.0864  48.5276  4921.0864  48.5276  4921.0864  48.5276      701.5      3.5      701.5        3.5     0.0     0.0 
1 1 1    5    0   11 o    165.9    1.9  275.2028   6.3852   275.2028   6.3852   275.2028   6.3852      165.9      1.9      165.9        1.9     0.0     0.0 
1 1 1    5    0   12 o   1548.4    7.2 23979.6797 222.2055 23979.6797 222.2055 23979.6797 222.2055     1548.4      7.2     1548.4        7.2     0.0     0.0 
1 1 1    5    0   13 o   1024.4    5.1 10494.1025 105.3561 10494.1025 105.3561 10494.1025 105.3561     1024.4      5.1     1024.4        5.1     0.0     0.0 
1 1 1    5    0   14 o    655.5    3.5 4297.2505  45.9736  4297.2505  45.9736  4297.2505  45.9736      655.5      3.5      655.5        3.5     0.0     0.0 
1 1 1    5    0   15 o   2309.1   10.4 53333.1562 480.8068 53333.1562 480.8068 53333.1562 480.8068     2309.1     10.4     2309.1       10.4     0.0     0.0 
1 1 1    5    0   16 o    948.1    4.8 8990.3848  90.6701  8990.3848  90.6701  8990.3848  90.6701      948.1      4.8      948.1        4.8     0.0     0.0 
1 1 1    5    0   17 o   2113.3    9.5 44668.4180 403.5457 44668.4180 403.5457 44668.4180 403.5457     2113.3      9.5     2113.3        9.5     0.0     0.0 
1 1 1    5    0   18 o    203.8    2.4  415.6776   9.5778   415.6776   9.5778   415.6776   9.5778      203.8      2.4      203.8        2.4     0.0     0.0 
1 1 1    5    0   19 f    609.5    3.2 3714.9187  39.5883  3714.9187  39.5883  3714.9187  39.5883      609.5      3.2      609.5        3.2     0.0     0.0 
1 1 1    5    0   20 o    665.3    3.5 4426.2319  45.9736  4426.2319  45.9736  4426.2319  45.9736      665.3      3.5      665.3        3.5     0.0     0.0 
1 1 1    5    0   21 o    515.7    3.2 2660.0811  32.5646  2660.0811  32.5646  2660.0811  32.5646      515.7      3.2      515.7        3.2     0.0     0.0 
1 1 1    5    0   22 o    836.4    4.1 6995.6426  68.9603  6995.6426  68.9603  6995.6426  68.9603      836.4      4.1      836.4        4.1     0.0     0.0 
1 1 1    5    0   23 o   1431.3    6.6 20488.8828 188.3639 20488.8828 188.3639 20488.8828 188.3639     1431.3      6.6     1431.3        6.6     0.0     0.0 
1 1 1    5    0   24 o    998.2    5.1 9964.7686 101.5249  9964.7686 101.5249  9964.7686 101.5249      998.2      5.1      998.2        5.1     0.0     0.0 
1 1 1    5    0   25 o   1751.5    8.1 30686.0703 282.2266 30686.0703 282.2266 30686.0703 282.2266     1751.5      8.1     1751.5        8.1     0.0     0.0 
1 1 1    5    0   26 o    401.5    2.7 1612.2671  21.7097  1612.2671  21.7097  1612.2671  21.7097      401.5      2.7      401.5        2.7     0.0     0.0 
1 1 1    5    0   27 o   1206.1    5.9 14548.7148 143.0288 14548.7148 143.0288 14548.7148 143.0288     1206.1      5.9     1206.1        5.9     0.0     0.0 
1 1 1    5    0   28 o    903.4    4.5 8161.5830  81.0922  8161.5830  81.0922  8161.5830  81.0922      903.4      4.5      903.4        4.5     0.0     0.0 
1 1 1    5    0   29 o    237.1    3.0  562.5375  14.0475   562.5375  14.0475   562.5375  14.0475      237.1      3.0      237.1        3.0     0.0     0.0 
1 1 1    5    0   30 o    527.5    3.3 2783.3157  34.4802  2783.3157  34.4802  2783.3157  34.4802      527.5      3.3      527.5        3.3     0.0     0.0 
1 1 1    5    0   31 o     70.6   13.7   54.9129  17.2401    54.9129  17.2401    54.9129  17.2401       70.6     13.7       70.6       13.7     0.0     0.0 
1 1 1    5    0   32 o    468.6    4.4 2196.5144  41.5039  2196.5144  41.5039  2196.5144  41.5039      468.6      4.4      468.6        4.4     0.0     0.0 
1 1 1    5    0   33 o   1268.7    6.7 16097.7695 169.8468 16097.7695 169.8468 16097.7695 169.8468     1268.7      6.7     1268.7        6.7     0.0     0.0 
1 1 1    5    0   34 o   2282.1   11.9 52096.9805 544.6590 52096.9805 544.6590 52096.9805 544.6590     2282.1     11.9     2282.1       11.9     0.0     0.0 
1 1 1    5    0   35 o     17.4   12.8  -63.2136  26.8179   -63.2136  26.8179   -63.2136  26.8179       17.4     12.8       17.4       12.8     0.0     0.0 
1 1 1    5    0   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    5    0   37 o    390.1    3.5 1522.2355  27.4564  1522.2355  27.4564  1522.2355  27.4564      390.1      3.5      390.1        3.5     0.0     0.0 
1 1 1    5    0   38 o    599.4    3.6 3593.5996  43.4195  3593.5996  43.4195  3593.5996  43.4195      599.4      3.6      599.4        3.6     0.0     0.0 
1 1 1    5    0   39 o    164.7    7.0  272.6487  22.9868   272.6487  22.9868   272.6487  22.9868      164.7      7.0      164.7        7.0     0.0     0.0 
1 1 1    5    0   40 o     13.7   10.3  -80.4537  22.9868   -80.4537  22.9868   -80.4537  22.9868       13.7     10.3       13.7       10.3     0.0     0.0 
1 1 1    5    0   41 o   1680.2    8.1 28237.3398 271.3717 28237.3398 271.3717 28237.3398 271.3717     1680.2      8.1     1680.2        8.1     0.0     0.0 
1 1 1    5    0   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    5    0   43 o   1172.3    5.7 13744.1777 134.7281 13744.1777 134.7281 13744.1777 134.7281     1172.3      5.7     1172.3        5.7     0.0     0.0 
1 1 1    5    0   44 o   1549.6    7.2 24016.7148 224.1211 24016.7148 224.1211 24016.7148 224.1211     1549.6      7.2     1549.6        7.2     0.0     0.0 
1 1 1    5    0   45 o    296.9    4.7  882.4369  28.0950   882.4369  28.0950   882.4369  28.0950      296.9      4.7      296.9        4.7     0.0     0.0 
1 1 1    5    0   46 o    375.2    4.6 1408.5787  34.4802  1408.5787  34.4802  1408.5787  34.4802      375.2      4.6      375.2        4.6     0.0     0.0 
1 1 1    5    0   47 o    548.6    4.0 3010.6294  44.0580  3010.6294  44.0580  3010.6294  44.0580      548.6      4.0      548.6        4.0     0.0     0.0 
1 1 1    5    0   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    5    0   49 o    860.4    4.7 7403.6582  81.0922  7403.6582  81.0922  7403.6582  81.0922      860.4      4.7      860.4        4.7     0.0     0.0 
1 1 1    5    0   50 o    456.9    3.8 2087.9658  34.4802  2087.9658  34.4802  2087.9658  34.4802      456.9      3.8      456.9        3.8     0.0     0.0 
1 1 1    5    0   51 o     31.6   20.4    1.9156  28.7335     1.9156  28.7335     1.9156  28.7335       31.6     20.4       31.6       20.4     0.0     0.0 
1 1 1    5    0   52 o    131.3   11.1  176.2320  28.7335   176.2320  28.7335   176.2320  28.7335      131.3     11.1      131.3       11.1     0.0     0.0 
1 1 1    5    0   53 o    220.5    8.4  488.4691  37.0343   488.4691  37.0343   488.4691  37.0343      220.5      8.4      220.5        8.4     0.0     0.0 
1 1 1    5    0   54 o    176.3    8.2  312.8756  28.7335   312.8756  28.7335   312.8756  28.7335      176.3      8.2      176.3        8.2     0.0     0.0 
1 1 1    5    0   55 o    649.0    4.0 4212.9658  52.3588  4212.9658  52.3588  4212.9658  52.3588      649.0      4.0      649.0        4.0     0.0     0.0 
1 1 1    5    0   56 o    129.7    9.5  171.1238  24.2638   171.1238  24.2638   171.1238  24.2638      129.7      9.5      129.7        9.5     0.0     0.0 
1 1 1    5    0   57 o     16.3   12.1  -82.3693  28.0950   -82.3693  28.0950   -82.3693  28.0950       16.3     12.1       16.3       12.1     0.0     0.0 
1 1 1    5    0   58 o     50.2   23.2   37.0343  25.5409    37.0343  25.5409    37.0343  25.5409       50.2     23.2       50.2       23.2     0.0     0.0 
1 1 1    5    0   59 o    831.4    4.6 6914.5508  75.9841  6914.5508  75.9841  6914.5508  75.9841      831.4      4.6      831.4        4.6     0.0     0.0 
1 1 1    5    0   60 o    322.1    4.7 1038.2362  30.0105  1038.2362  30.0105  1038.2362  30.0105      322.1      4.7      322.1        4.7     0.0     0.0 
1 1 1    5    0   61 o    261.5    5.4  685.1337  28.0950   685.1337  28.0950   685.1337  28.0950      261.5      5.4      261.5        5.4     0.0     0.0 
1 1 1    5    0   62 o    233.7    6.2  547.8516  28.7335   547.8516  28.7335   547.8516  28.7335      233.7      6.2      233.7        6.2     0.0     0.0 
1 1 1    5    0   63 o     76.9   20.7   70.8759  27.4564    70.8759  27.4564    70.8759  27.4564       76.9     20.7       76.9       20.7     0.0     0.0 
1 1 1    5    0   64 o    234.6    6.1  551.6827  28.7335   551.6827  28.7335   551.6827  28.7335      234.6      6.1      234.6        6.1     0.0     0.0 
1 1 1    5    0   65 o     22.3   15.9  -30.0105  27.4564   -30.0105  27.4564   -30.0105  27.4564       22.3     15.9       22.3       15.9     0.0     0.0 
1 1 1    5    0   66 o    216.9    6.2  471.8675  26.8179   471.8675  26.8179   471.8675  26.8179      216.9      6.2      216.9        6.2     0.0     0.0 
1 1 1    5    0   67 o     28.4   18.9   -6.3852  28.0950    -6.3852  28.0950    -6.3852  28.0950       28.4     18.9       28.4       18.9     0.0     0.0 
1 1 1    5    0   68 o    439.0    4.1 1928.9739  35.7572  1928.9739  35.7572  1928.9739  35.7572      439.0      4.1      439.0        4.1     0.0     0.0 
1 1 1    5    0   69 o    244.5    6.4  599.5718  31.2876   599.5718  31.2876   599.5718  31.2876      244.5      6.4      244.5        6.4     0.0     0.0 
1 1 1    5    0   70 o    322.9    5.2 1044.6215  33.8416  1044.6215  33.8416  1044.6215  33.8416      322.9      5.2      322.9        5.2     0.0     0.0 
1 1 1    5    0   71 o    306.9    5.5  943.7350  33.8416   943.7350  33.8416   943.7350  33.8416      306.9      5.5      306.9        5.5     0.0     0.0 
1 1 1    5    0   72 o     30.0   19.8   -3.1926  29.3720    -3.1926  29.3720    -3.1926  29.3720       30.0     19.8       30.0       19.8     0.0     0.0 
1 1 1    5    0   73 o     36.2   22.2   12.7704  30.0105    12.7704  30.0105    12.7704  30.0105       36.2     22.2       36.2       22.2     0.0     0.0 
1 1 1    5    0   74 o    487.9    4.3 2382.9629  41.5039  2382.9629  41.5039  2382.9629  41.5039      487.9      4.3      487.9        4.3     0.0     0.0 
1 1 1    5    0   75 o    246.5    7.1  610.4266  35.1187   610.4266  35.1187   610.4266  35.1187      246.5      7.1      246.5        7.1     0.0     0.0 
1 1 1    5    0   76 o    240.9    6.8  582.9703  32.5646   582.9703  32.5646   582.9703  32.5646      240.9      6.8      240.9        6.8     0.0     0.0 
1 1 1    5    0   77 o     32.7   21.5   -1.2770  33.8416    -1.2770  33.8416    -1.2770  33.8416       32.7     21.5       32.7       21.5     0.0     0.0 
1 1 1    5    0   78 o     72.4   22.7   67.0448  28.7335    67.0448  28.7335    67.0448  28.7335       72.4     22.7       72.4       22.7     0.0     0.0 
1 1 1    5    0   79 o    147.6   11.8  224.1211  34.4802   224.1211  34.4802   224.1211  34.4802      147.6     11.8      147.6       11.8     0.0     0.0 
1 1 1    5    0   80 o    344.5    5.0 1189.5658  34.4802  1189.5658  34.4802  1189.5658  34.4802      344.5      5.0      344.5        5.0     0.0     0.0 
1 1 1    5    0   81 o     29.5   19.2    1.2770  26.1794     1.2770  26.1794     1.2770  26.1794       29.5     19.2       29.5       19.2     0.0     0.0 
1 1 1    5    0   82 o     59.9   25.1   52.9973  30.0105    52.9973  30.0105    52.9973  30.0105       59.9     25.1       59.9       25.1     0.0     0.0 
1 1 1    5    1    0 o    521.9    3.1 2724.5718  31.9261  2724.5718  31.9261  2724.5718  31.9261      521.9      3.1      521.9        3.1     0.0     0.0 
1 1 1    5    1    1 o   1557.9    5.8    0.0000   0.0000          ?        ? 24272.7598 180.0631          ?        ?     1557.9        5.8       ?       ? 
1 1 1    5    1    2 o    686.5    2.6    0.0000   0.0000          ?        ?  4712.2896  35.1187          ?        ?      686.5        2.6       ?       ? 
1 1 1    5    1    3 o   1292.0    4.5    0.0000   0.0000          ?        ? 16692.2324 115.5724          ?        ?     1292.0        4.5       ?       ? 
1 1 1    5    1    4 o     81.5    1.2    0.0000   0.0000          ?        ?    66.4062   1.9156          ?        ?       81.5        1.2       ?       ? 
1 1 1    5    1    5 o   1671.6    5.4    0.0000   0.0000          ?        ? 27944.2598 180.0631          ?        ?     1671.6        5.4       ?       ? 
1 1 1    5    1    6 o    597.1    2.1    0.0000   0.0000          ?        ?  3564.8662  24.9023          ?        ?      597.1        2.1       ?       ? 
1 1 1    5    1    7 f   1856.8    6.0    0.0000   0.0000          ?        ? 34481.4453 222.2055          ?        ?     1856.8        6.0       ?       ? 
1 1 1    5    1    8 o    628.6    2.3    0.0000   0.0000          ?        ?  3951.8105  28.7335          ?        ?      628.6        2.3       ?       ? 
1 1 1    5    1    9 o   1441.6    4.7    0.0000   0.0000          ?        ? 20781.9629 136.0051          ?        ?     1441.6        4.7       ?       ? 
1 1 1    5    1   10 o    715.4    2.6    0.0000   0.0000          ?        ?  5118.3892  37.0343          ?        ?      715.4        2.6       ?       ? 
1 1 1    5    1   11 o    759.2    2.6    0.0000   0.0000          ?        ?  5763.9346  40.2269          ?        ?      759.2        2.6       ?       ? 
1 1 1    5    1   12 o   2230.1    7.2    0.0000   0.0000          ?        ? 49739.5547 319.2608          ?        ?     2230.1        7.2       ?       ? 
1 1 1    5    1   13 o   1232.8    4.1    0.0000   0.0000          ?        ? 15199.3682 100.8864          ?        ?     1232.8        4.1       ?       ? 
1 1 1    5    1   14 o   1372.3    4.5    0.0000   0.0000          ?        ? 18834.4727 124.5117          ?        ?     1372.3        4.5       ?       ? 
1 1 1    5    1   15 o    200.1    1.4    0.0000   0.0000          ?        ?   400.3531   5.7467          ?        ?      200.1        1.4       ?       ? 
1 1 1    5    1   16 o   1883.5    6.1    0.0000   0.0000          ?        ? 35479.4531 229.2293          ?        ?     1883.5        6.1       ?       ? 
1 1 1    5    1   17 o    797.7    2.8    0.0000   0.0000          ?        ?  6364.1450  44.0580          ?        ?      797.7        2.8       ?       ? 
1 1 1    5    1   18 o   1225.0    4.2    0.0000   0.0000          ?        ? 15007.1738 102.1635          ?        ?     1225.0        4.2       ?       ? 
1 1 1    5    1   19 o    655.7    2.4    0.0000   0.0000          ?        ?  4299.1660  31.2876          ?        ?      655.7        2.4       ?       ? 
1 1 1    5    1   20 o   1459.2    4.7    0.0000   0.0000          ?        ? 21294.6953 138.5592          ?        ?     1459.2        4.7       ?       ? 
1 1 1    5    1   21 o   1148.2    3.8    0.0000   0.0000          ?        ? 13184.1953  88.1160          ?        ?     1148.2        3.8       ?       ? 
1 1 1    5    1   22 o    565.3    2.1    0.0000   0.0000          ?        ?  3195.1621  23.6253          ?        ?      565.3        2.1       ?       ? 
1 1 1    5    1   23 o    632.2    2.3    0.0000   0.0000          ?        ?  3996.5071  29.3720          ?        ?      632.2        2.3       ?       ? 
1 1 1    5    1   24 o   1126.3    3.8    0.0000   0.0000          ?        ? 12685.5088  84.9234          ?        ?     1126.3        3.8       ?       ? 
1 1 1    5    1   25 o    614.3    2.3    0.0000   0.0000          ?        ?  3774.3013  28.0950          ?        ?      614.3        2.3       ?       ? 
1 1 1    5    1   26 o    972.9    3.4    0.0000   0.0000          ?        ?  9466.0830  65.7677          ?        ?      972.9        3.4       ?       ? 
1 1 1    5    1   27 o    462.6    2.0    0.0000   0.0000          ?        ?  2140.3245  18.5171          ?        ?      462.6        2.0       ?       ? 
1 1 1    5    1   28 o    829.1    3.0    0.0000   0.0000          ?        ?  6874.9619  50.4432          ?        ?      829.1        3.0       ?       ? 
1 1 1    5    1   29 o    589.7    2.4    0.0000   0.0000          ?        ?  3477.3887  28.7335          ?        ?      589.7        2.4       ?       ? 
1 1 1    5    1   30 o    279.1    2.5    0.0000   0.0000          ?        ?   778.9964  14.0475          ?        ?      279.1        2.5       ?       ? 
1 1 1    5    1   31 o    595.5    2.5    0.0000   0.0000          ?        ?  3545.7104  29.3720          ?        ?      595.5        2.5       ?       ? 
1 1 1    5    1   32 o   2612.1   11.8    0.0000   0.0000          ?        ? 68262.4297 614.2578          ?        ?     2612.1       11.8       ?       ? 
1 1 1    5    1   33 o   1857.1    7.0    0.0000   0.0000          ?        ? 34491.6602 259.8783          ?        ?     1857.1        7.0       ?       ? 
1 1 1    5    1   34 o    786.3    3.5    0.0000   0.0000          ?        ?  6183.4434  54.9129          ?        ?      786.3        3.5       ?       ? 
1 1 1    5    1   35 o    444.8    2.6    0.0000   0.0000          ?        ?  1978.7784  22.9868          ?        ?      444.8        2.6       ?       ? 
1 1 1    5    1   36 o    615.8    2.6    0.0000   0.0000          ?        ?  3792.1802  31.9261          ?        ?      615.8        2.6       ?       ? 
1 1 1    5    1   37 o   1121.8    3.9    0.0000   0.0000          ?        ? 12585.2617  87.4775          ?        ?     1121.8        3.9       ?       ? 
1 1 1    5    1   38 o   1452.7    4.9    0.0000   0.0000          ?        ? 21105.6934 143.6674          ?        ?     1452.7        4.9       ?       ? 
1 1 1    5    1   39 o   1347.6    4.6    0.0000   0.0000          ?        ? 18161.4707 123.2347          ?        ?     1347.6        4.6       ?       ? 
1 1 1    5    1   40 o    228.8    3.6    0.0000   0.0000          ?        ?   523.5877  16.6016          ?        ?      228.8        3.6       ?       ? 
1 1 1    5    1   41 o    558.0    2.5    0.0000   0.0000          ?        ?  3114.0701  28.0950          ?        ?      558.0        2.5       ?       ? 
1 1 1    5    1   42 o    160.6    6.6    0.0000   0.0000          ?        ?   257.9627  21.0712          ?        ?      160.6        6.6       ?       ? 
1 1 1    5    1   43 o   1177.4    4.3    0.0000   0.0000          ?        ? 13864.2207 100.8864          ?        ?     1177.4        4.3       ?       ? 
1 1 1    5    1   44 o    495.2    2.6    0.0000   0.0000          ?        ?  2452.5615  26.1794          ?        ?      495.2        2.6       ?       ? 
1 1 1    5    1   45 o   1077.2    4.0    0.0000   0.0000          ?        ? 11603.8535  86.2004          ?        ?     1077.2        4.0       ?       ? 
1 1 1    5    1   46 o    723.6    3.0    0.0000   0.0000          ?        ?  5235.8774  42.7809          ?        ?      723.6        3.0       ?       ? 
1 1 1    5    1   47 o    750.4    3.1    0.0000   0.0000          ?        ?  5631.1226  47.2506          ?        ?      750.4        3.1       ?       ? 
1 1 1    5    1   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    5    1   49 o    979.4    3.5    0.0000   0.0000          ?        ?  9592.5107  68.3218          ?        ?      979.4        3.5       ?       ? 
1 1 1    5    1   50 o    820.2    3.5    0.0000   0.0000          ?        ?  6728.7412  57.4669          ?        ?      820.2        3.5       ?       ? 
1 1 1    5    1   51 f    583.0    3.5    0.0000   0.0000          ?        ?  3398.8506  40.8654          ?        ?      583.0        3.5       ?       ? 
1 1 1    5    1   52 o   1381.1    4.6    0.0000   0.0000          ?        ? 19078.3867 127.7043          ?        ?     1381.1        4.6       ?       ? 
1 1 1    5    1   53 f     86.6   17.2    0.0000   0.0000          ?        ?    77.8996  28.7335          ?        ?       86.6       17.2       ?       ? 
1 1 1    5    1   54 o    582.3    2.8    0.0000   0.0000          ?        ?  3391.1882  32.5646          ?        ?      582.3        2.8       ?       ? 
1 1 1    5    1   55 o    864.4    3.3    0.0000   0.0000          ?        ?  7472.6191  57.4669          ?        ?      864.4        3.3       ?       ? 
1 1 1    5    1   56 o    111.5    8.6    0.0000   0.0000          ?        ?   124.5117  19.1556          ?        ?      111.5        8.6       ?       ? 
1 1 1    5    1   57 o    615.0    2.8    0.0000   0.0000          ?        ?  3783.2407  33.8416          ?        ?      615.0        2.8       ?       ? 
1 1 1    5    1   58 o    166.6    5.7    0.0000   0.0000          ?        ?   277.7569  19.1556          ?        ?      166.6        5.7       ?       ? 
1 1 1    5    1   59 o     93.0   11.0    0.0000   0.0000          ?        ?    86.8389  20.4327          ?        ?       93.0       11.0       ?       ? 
1 1 1    5    1   60 o    503.0    2.8    0.0000   0.0000          ?        ?  2530.4612  28.0950          ?        ?      503.0        2.8       ?       ? 
1 1 1    5    1   61 o    197.1    5.3    0.0000   0.0000          ?        ?   388.8597  21.0712          ?        ?      197.1        5.3       ?       ? 
1 1 1    5    1   62 o    287.1    3.6    0.0000   0.0000          ?        ?   824.3315  20.4327          ?        ?      287.1        3.6       ?       ? 
1 1 1    5    1   63 o    327.8    3.3    0.0000   0.0000          ?        ?  1075.2704  21.7097          ?        ?      327.8        3.3       ?       ? 
1 1 1    5    1   64 o    633.6    2.8    0.0000   0.0000          ?        ?  4016.3010  35.1187          ?        ?      633.6        2.8       ?       ? 
1 1 1    5    1   65 o    313.0    3.5    0.0000   0.0000          ?        ?   980.1307  21.7097          ?        ?      313.0        3.5       ?       ? 
1 1 1    5    1   66 o    317.1    3.3    0.0000   0.0000          ?        ?  1006.3101  21.0712          ?        ?      317.1        3.3       ?       ? 
1 1 1    5    1   67 o    393.8    3.1    0.0000   0.0000          ?        ?  1551.6075  24.2638          ?        ?      393.8        3.1       ?       ? 
1 1 1    5    1   68 o    213.2    4.6    0.0000   0.0000          ?        ?   455.2659  19.7942          ?        ?      213.2        4.6       ?       ? 
1 1 1    5    1   69 o     46.4   17.2    0.0000   0.0000          ?        ?    17.2401  21.0712          ?        ?       46.4       17.2       ?       ? 
1 1 1    5    1   70 o    110.1    9.3    0.0000   0.0000          ?        ?   121.9576  20.4327          ?        ?      110.1        9.3       ?       ? 
1 1 1    5    1   71 o     86.8   12.1    0.0000   0.0000          ?        ?    75.9841  21.0712          ?        ?       86.8       12.1       ?       ? 
1 1 1    5    1   72 o     87.4   12.0    0.0000   0.0000          ?        ?    77.2611  21.0712          ?        ?       87.4       12.0       ?       ? 
1 1 1    5    1   73 o    130.7    8.6    0.0000   0.0000          ?        ?   171.7623  22.3483          ?        ?      130.7        8.6       ?       ? 
1 1 1    5    1   74 o    126.7    8.8    0.0000   0.0000          ?        ?   161.5460  22.3483          ?        ?      126.7        8.8       ?       ? 
1 1 1    5    1   75 o    163.4    6.8    0.0000   0.0000          ?        ?   268.1791  22.3483          ?        ?      163.4        6.8       ?       ? 
1 1 1    5    1   76 o    128.7    8.2    0.0000   0.0000          ?        ?   166.6541  21.0712          ?        ?      128.7        8.2       ?       ? 
1 1 1    5    1   77 o    222.7    5.2    0.0000   0.0000          ?        ?   497.4084  22.9868          ?        ?      222.7        5.2       ?       ? 
1 1 1    5    1   78 o     38.7   16.1    0.0000   0.0000          ?        ?     4.4697  20.4327          ?        ?       38.7       16.1       ?       ? 
1 1 1    5    1   79 o     50.9   17.6    0.0000   0.0000          ?        ?    24.9023  21.7097          ?        ?       50.9       17.6       ?       ? 
1 1 1    5    1   80 o     68.3   16.1    0.0000   0.0000          ?        ?    50.4432  21.7097          ?        ?       68.3       16.1       ?       ? 
1 1 1    5    1   81 o     30.3   14.1    0.0000   0.0000          ?        ?   -16.6016  20.4327          ?        ?       30.3       14.1       ?       ? 
1 1 1    5    1   82 o    159.3    6.6    0.0000   0.0000          ?        ?   256.0471  21.0712          ?        ?      159.3        6.6       ?       ? 
1 1 1    5    2    0 o    544.5    3.2 2965.2944  34.4802  2965.2944  34.4802  2965.2944  34.4802      544.5      3.2      544.5        3.2     0.0     0.0 
1 1 1    5    2    1 o   1077.2    4.0    0.0000   0.0000          ?        ? 11603.8535  86.2004          ?        ?     1077.2        4.0       ?       ? 
1 1 1    5    2    2 o    814.3    3.1    0.0000   0.0000          ?        ?  6630.4087  49.8047          ?        ?      814.3        3.1       ?       ? 
1 1 1    5    2    3 o    331.4    1.5    0.0000   0.0000          ?        ?  1098.2572  10.2163          ?        ?      331.4        1.5       ?       ? 
1 1 1    5    2    4 o   1562.6    5.0    0.0000   0.0000          ?        ? 24419.6211 156.4378          ?        ?     1562.6        5.0       ?       ? 
1 1 1    5    2    5 o    509.3    1.8    0.0000   0.0000          ?        ?  2593.6748  18.5171          ?        ?      509.3        1.8       ?       ? 
1 1 1    5    2    6 o    853.2    2.9    0.0000   0.0000          ?        ?  7279.1465  49.8047          ?        ?      853.2        2.9       ?       ? 
1 1 1    5    2    7 o    594.3    2.2    0.0000   0.0000          ?        ?  3532.3018  26.1794          ?        ?      594.3        2.2       ?       ? 
1 1 1    5    2    8 o    381.4    1.5    0.0000   0.0000          ?        ?  1454.5522  11.4934          ?        ?      381.4        1.5       ?       ? 
1 1 1    5    2    9 o    652.9    2.3    0.0000   0.0000          ?        ?  4262.7700  30.0105          ?        ?      652.9        2.3       ?       ? 
1 1 1    5    2   10 o    446.3    1.7    0.0000   0.0000          ?        ?  1991.5490  15.3245          ?        ?      446.3        1.7       ?       ? 
1 1 1    5    2   11 o   1214.0    4.0    0.0000   0.0000          ?        ? 14738.9951  97.0553          ?        ?     1214.0        4.0       ?       ? 
1 1 1    5    2   12 o    460.6    1.8    0.0000   0.0000          ?        ?  2121.8074  16.6016          ?        ?      460.6        1.8       ?       ? 
1 1 1    5    2   13 o   1854.7    6.0    0.0000   0.0000          ?        ? 34402.9062 221.5670          ?        ?     1854.7        6.0       ?       ? 
1 1 1    5    2   14 o    780.4    2.8    0.0000   0.0000          ?        ?  6090.2192  44.0580          ?        ?      780.4        2.8       ?       ? 
1 1 1    5    2   15 o   1290.3    4.4    0.0000   0.0000          ?        ? 16648.8125 112.3798          ?        ?     1290.3        4.4       ?       ? 
1 1 1    5    2   16 o   1032.6    3.6    0.0000   0.0000          ?        ? 10663.3115  73.4300          ?        ?     1032.6        3.6       ?       ? 
1 1 1    5    2   17 o   1703.7    5.5    0.0000   0.0000          ?        ? 29030.3867 187.7254          ?        ?     1703.7        5.5       ?       ? 
1 1 1    5    2   18 o    666.8    2.5    0.0000   0.0000          ?        ?  4446.6646  33.2031          ?        ?      666.8        2.5       ?       ? 
1 1 1    5    2   19 o    475.6    1.9    0.0000   0.0000          ?        ?  2262.2820  18.5171          ?        ?      475.6        1.9       ?       ? 
1 1 1    5    2   20 o   1917.2    6.2    0.0000   0.0000          ?        ? 36762.8828 236.8915          ?        ?     1917.2        6.2       ?       ? 
1 1 1    5    2   21 o    181.3    1.9    0.0000   0.0000          ?        ?   328.8386   7.0237          ?        ?      181.3        1.9       ?       ? 
1 1 1    5    2   22 o   1639.4    5.4    0.0000   0.0000          ?        ? 26879.8457 178.1475          ?        ?     1639.4        5.4       ?       ? 
1 1 1    5    2   23 o    165.3    2.1    0.0000   0.0000          ?        ?   273.2873   7.0237          ?        ?      165.3        2.1       ?       ? 
1 1 1    5    2   24 o    435.6    1.8    0.0000   0.0000          ?        ?  1897.6864  15.9630          ?        ?      435.6        1.8       ?       ? 
1 1 1    5    2   25 o    642.9    2.4    0.0000   0.0000          ?        ?  4133.7891  31.2876          ?        ?      642.9        2.4       ?       ? 
1 1 1    5    2   26 o     81.1    5.1    0.0000   0.0000          ?        ?    65.7677   8.3008          ?        ?       81.1        5.1       ?       ? 
1 1 1    5    2   27 o   1471.5    4.9    0.0000   0.0000          ?        ? 21654.8223 145.5829          ?        ?     1471.5        4.9       ?       ? 
1 1 1    5    2   28 o     93.9    4.8    0.0000   0.0000          ?        ?    88.1160   8.9393          ?        ?       93.9        4.8       ?       ? 
1 1 1    5    2   29 o    730.6    2.7    0.0000   0.0000          ?        ?  5337.4023  39.5883          ?        ?      730.6        2.7       ?       ? 
1 1 1    5    2   30 o    276.0    2.3    0.0000   0.0000          ?        ?   761.7563  12.7704          ?        ?      276.0        2.3       ?       ? 
1 1 1    5    2   31 o   1494.8    4.9    0.0000   0.0000          ?        ? 22346.9805 147.4985          ?        ?     1494.8        4.9       ?       ? 
1 1 1    5    2   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    5    2   33 o   2843.7   31.2    0.0000   0.0000          ?        ? 81110.1250 1777.0056          ?        ?     2843.7       31.2       ?       ? 
1 1 1    5    2   34 o    506.1    3.4    0.0000   0.0000          ?        ?  2561.1104  34.4802          ?        ?      506.1        3.4       ?       ? 
1 1 1    5    2   35 o   1282.4    4.5    0.0000   0.0000          ?        ? 16447.0410 115.5724          ?        ?     1282.4        4.5       ?       ? 
1 1 1    5    2   36 o    744.9    2.9    0.0000   0.0000          ?        ?  5549.3911  43.4195          ?        ?      744.9        2.9       ?       ? 
1 1 1    5    2   37 o   1334.0    4.5    0.0000   0.0000          ?        ? 17795.5977 119.4035          ?        ?     1334.0        4.5       ?       ? 
1 1 1    5    2   38 o    585.1    2.7    0.0000   0.0000          ?        ?  3423.1143  31.2876          ?        ?      585.1        2.7       ?       ? 
1 1 1    5    2   39 o   1623.0    5.4    0.0000   0.0000          ?        ? 26343.4883 173.6779          ?        ?     1623.0        5.4       ?       ? 
1 1 1    5    2   40 o   1642.9    5.4    0.0000   0.0000          ?        ? 26995.4160 176.2320          ?        ?     1642.9        5.4       ?       ? 
1 1 1    5    2   41 o    318.4    3.0    0.0000   0.0000          ?        ?  1013.9724  19.1556          ?        ?      318.4        3.0       ?       ? 
1 1 1    5    2   42 o   1132.9    3.9    0.0000   0.0000          ?        ? 12834.9229  89.3930          ?        ?     1132.9        3.9       ?       ? 
1 1 1    5    2   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    5    2   44 o   1459.4    5.0    0.0000   0.0000          ?        ? 21302.3574 144.9444          ?        ?     1459.4        5.0       ?       ? 
1 1 1    5    2   45 o    683.2    3.0    0.0000   0.0000          ?        ?  4667.5933  40.8654          ?        ?      683.2        3.0       ?       ? 
1 1 1    5    2   46 o    944.3    3.7    0.0000   0.0000          ?        ?  8917.5928  68.9603          ?        ?      944.3        3.7       ?       ? 
1 1 1    5    2   47 o    447.6    3.0    0.0000   0.0000          ?        ?  2003.6808  26.8179          ?        ?      447.6        3.0       ?       ? 
1 1 1    5    2   48 o    813.0    3.1    0.0000   0.0000          ?        ?  6610.6147  50.4432          ?        ?      813.0        3.1       ?       ? 
1 1 1    5    2   49 o    500.8    2.8    0.0000   0.0000          ?        ?  2508.1128  28.0950          ?        ?      500.8        2.8       ?       ? 
1 1 1    5    2   50 o    707.8    2.9    0.0000   0.0000          ?        ?  5009.8403  40.8654          ?        ?      707.8        2.9       ?       ? 
1 1 1    5    2   51 o    350.9    3.3    0.0000   0.0000          ?        ?  1231.7081  22.9868          ?        ?      350.9        3.3       ?       ? 
1 1 1    5    2   52 o    177.7    6.1    0.0000   0.0000          ?        ?   316.0682  21.7097          ?        ?      177.7        6.1       ?       ? 
1 1 1    5    2   53 o     54.4   21.8    0.0000   0.0000          ?        ?    14.6860  35.7572          ?        ?       54.4       21.8       ?       ? 
1 1 1    5    2   54 o    341.2    3.4    0.0000   0.0000          ?        ?  1164.6635  22.9868          ?        ?      341.2        3.4       ?       ? 
1 1 1    5    2   55 o    628.8    3.0    0.0000   0.0000          ?        ?  3955.0032  37.6728          ?        ?      628.8        3.0       ?       ? 
1 1 1    5    2   56 o    114.0    8.7    0.0000   0.0000          ?        ?   130.2584  19.7942          ?        ?      114.0        8.7       ?       ? 
1 1 1    5    2   57 o    212.9    4.6    0.0000   0.0000          ?        ?   453.3503  19.7942          ?        ?      212.9        4.6       ?       ? 
1 1 1    5    2   58 o    302.1    3.5    0.0000   0.0000          ?        ?   913.0859  21.0712          ?        ?      302.1        3.5       ?       ? 
1 1 1    5    2   59 o    137.1    7.2    0.0000   0.0000          ?        ?   188.3639  19.7942          ?        ?      137.1        7.2       ?       ? 
1 1 1    5    2   60 o    177.0    5.4    0.0000   0.0000          ?        ?   313.5141  19.1556          ?        ?      177.0        5.4       ?       ? 
1 1 1    5    2   61 o    147.9    6.7    0.0000   0.0000          ?        ?   219.0129  19.7942          ?        ?      147.9        6.7       ?       ? 
1 1 1    5    2   62 o    390.5    3.0    0.0000   0.0000          ?        ?  1525.4281  23.6253          ?        ?      390.5        3.0       ?       ? 
1 1 1    5    2   63 o    144.2    6.6    0.0000   0.0000          ?        ?   208.1580  19.1556          ?        ?      144.2        6.6       ?       ? 
1 1 1    5    2   64 o    166.2    6.0    0.0000   0.0000          ?        ?   276.4799  19.7942          ?        ?      166.2        6.0       ?       ? 
1 1 1    5    2   65 o    327.5    3.4    0.0000   0.0000          ?        ?  1073.3549  22.3483          ?        ?      327.5        3.4       ?       ? 
1 1 1    5    2   66 o    131.4    7.5    0.0000   0.0000          ?        ?   173.0394  19.7942          ?        ?      131.4        7.5       ?       ? 
1 1 1    5    2   67 o     72.6   13.7    0.0000   0.0000          ?        ?    54.9129  19.1556          ?        ?       72.6       13.7       ?       ? 
1 1 1    5    2   68 o     30.9   14.4    0.0000   0.0000          ?        ?   -19.7942  21.7097          ?        ?       30.9       14.4       ?       ? 
1 1 1    5    2   69 o    132.0    7.7    0.0000   0.0000          ?        ?   174.9549  20.4327          ?        ?      132.0        7.7       ?       ? 
1 1 1    5    2   70 o     76.2   14.4    0.0000   0.0000          ?        ?    60.6596  21.0712          ?        ?       76.2       14.4       ?       ? 
1 1 1    5    2   71 o    318.0    3.8    0.0000   0.0000          ?        ?  1012.0568  24.2638          ?        ?      318.0        3.8       ?       ? 
1 1 1    5    2   72 o     24.2   12.0    0.0000   0.0000          ?        ?   -46.6121  21.0712          ?        ?       24.2       12.0       ?       ? 
1 1 1    5    2   73 o     46.3   17.5    0.0000   0.0000          ?        ?    15.9630  22.3483          ?        ?       46.3       17.5       ?       ? 
1 1 1    5    2   74 o    393.0    3.3    0.0000   0.0000          ?        ?  1545.8608  26.1794          ?        ?      393.0        3.3       ?       ? 
1 1 1    5    2   75 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    5    2   76 o     29.2   13.8    0.0000   0.0000          ?        ?   -25.5409  21.7097          ?        ?       29.2       13.8       ?       ? 
1 1 1    5    2   77 o    198.1    5.6    0.0000   0.0000          ?        ?   393.9678  22.3483          ?        ?      198.1        5.6       ?       ? 
1 1 1    5    2   78 o    128.5    8.4    0.0000   0.0000          ?        ?   166.6541  21.7097          ?        ?      128.5        8.4       ?       ? 
1 1 1    5    2   79 o     89.6   11.4    0.0000   0.0000          ?        ?    81.7308  20.4327          ?        ?       89.6       11.4       ?       ? 
1 1 1    5    2   80 o     67.4   16.3    0.0000   0.0000          ?        ?    49.1662  21.7097          ?        ?       67.4       16.3       ?       ? 
1 1 1    5    2   81 o    237.2    5.0    0.0000   0.0000          ?        ?   565.0916  23.6253          ?        ?      237.2        5.0       ?       ? 
1 1 1    5    2   82 o     46.8   17.6    0.0000   0.0000          ?        ?    18.5171  22.3483          ?        ?       46.8       17.6       ?       ? 
1 1 1    5    3    0 o   2557.7   39.7 65588.9453 2030.4988 65588.9453 2030.4988 65588.9453 2030.4988     2557.7     39.7     2557.7       39.7     0.0     0.0 
1 1 1    5    3    1 o   1621.1    6.4    0.0000   0.0000          ?        ? 26282.8281 208.1580          ?        ?     1621.1        6.4       ?       ? 
1 1 1    5    3    2 o    570.1    2.2    0.0000   0.0000          ?        ?  3250.0752  25.5409          ?        ?      570.1        2.2       ?       ? 
1 1 1    5    3    3 o   1288.4    4.8    0.0000   0.0000          ?        ? 16600.2852 124.5117          ?        ?     1288.4        4.8       ?       ? 
1 1 1    5    3    4 o   1908.9    7.3    0.0000   0.0000          ?        ? 36442.9844 278.3954          ?        ?     1908.9        7.3       ?       ? 
1 1 1    5    3    5 o   1480.8    4.9    0.0000   0.0000          ?        ? 21928.1094 145.5829          ?        ?     1480.8        4.9       ?       ? 
1 1 1    5    3    6 o    310.3    1.4    0.0000   0.0000          ?        ?   962.8906   8.9393          ?        ?      310.3        1.4       ?       ? 
1 1 1    5    3    7 o   1968.5    6.3    0.0000   0.0000          ?        ? 38755.0703 248.3849          ?        ?     1968.5        6.3       ?       ? 
1 1 1    5    3    8 o    978.2    3.3    0.0000   0.0000          ?        ?  9568.8848  64.4907          ?        ?      978.2        3.3       ?       ? 
1 1 1    5    3    9 o   1413.5    4.7    0.0000   0.0000          ?        ? 19981.2578 131.5355          ?        ?     1413.5        4.7       ?       ? 
1 1 1    5    3   10 o    178.5    1.3    0.0000   0.0000          ?        ?   318.6223   4.4697          ?        ?      178.5        1.3       ?       ? 
1 1 1    5    3   11 o   1097.9    3.7    0.0000   0.0000          ?        ? 12053.3721  81.0922          ?        ?     1097.9        3.7       ?       ? 
1 1 1    5    3   12 f   1447.7    4.7    0.0000   0.0000          ?        ? 20960.1113 136.6436          ?        ?     1447.7        4.7       ?       ? 
1 1 1    5    3   13 o   1891.0    6.1    0.0000   0.0000          ?        ? 35762.3164 231.7833          ?        ?     1891.0        6.1       ?       ? 
1 1 1    5    3   14 o   2876.4   10.0    0.0000   0.0000          ?        ? 82759.4219 573.3925          ?        ?     2876.4       10.0       ?       ? 
1 1 1    5    3   15 o   1897.6    6.2    0.0000   0.0000          ?        ? 36013.8984 233.6989          ?        ?     1897.6        6.2       ?       ? 
1 1 1    5    3   16 o   1239.7    4.2    0.0000   0.0000          ?        ? 15369.2158 104.0790          ?        ?     1239.7        4.2       ?       ? 
1 1 1    5    3   17 o   1544.4    5.1    0.0000   0.0000          ?        ? 23855.1680 157.0763          ?        ?     1544.4        5.1       ?       ? 
1 1 1    5    3   18 f   1217.1    4.0    0.0000   0.0000          ?        ? 14813.7021  97.6938          ?        ?     1217.1        4.0       ?       ? 
1 1 1    5    3   19 o    977.6    3.3    0.0000   0.0000          ?        ?  9557.3916  64.4907          ?        ?      977.6        3.3       ?       ? 
1 1 1    5    3   20 o   1495.2    5.1    0.0000   0.0000          ?        ? 22359.1113 152.6067          ?        ?     1495.2        5.1       ?       ? 
1 1 1    5    3   21 o   1247.4    4.3    0.0000   0.0000          ?        ? 15560.1328 107.9102          ?        ?     1247.4        4.3       ?       ? 
1 1 1    5    3   22 o    541.2    2.1    0.0000   0.0000          ?        ?  2929.5371  22.3483          ?        ?      541.2        2.1       ?       ? 
1 1 1    5    3   23 o   1160.0    3.9    0.0000   0.0000          ?        ? 13456.8438  90.6701          ?        ?     1160.0        3.9       ?       ? 
1 1 1    5    3   24 o   1015.9    3.5    0.0000   0.0000          ?        ? 10321.0635  71.5144          ?        ?     1015.9        3.5       ?       ? 
1 1 1    5    3   25 o    438.8    1.9    0.0000   0.0000          ?        ?  1925.1427  16.6016          ?        ?      438.8        1.9       ?       ? 
1 1 1    5    3   26 o    667.0    2.5    0.0000   0.0000          ?        ?  4449.2188  33.2031          ?        ?      667.0        2.5       ?       ? 
1 1 1    5    3   27 o    897.8    3.1    0.0000   0.0000          ?        ?  8060.6973  55.5514          ?        ?      897.8        3.1       ?       ? 
1 1 1    5    3   28 o    989.9    3.5    0.0000   0.0000          ?        ?  9799.3906  68.3218          ?        ?      989.9        3.5       ?       ? 
1 1 1    5    3   29 o    895.1    3.1    0.0000   0.0000          ?        ?  8012.1699  56.1899          ?        ?      895.1        3.1       ?       ? 
1 1 1    5    3   30 o   1701.3    5.5    0.0000   0.0000          ?        ? 28947.3789 188.3639          ?        ?     1701.3        5.5       ?       ? 
1 1 1    5    3   31 o    637.3    2.9    0.0000   0.0000          ?        ?  4060.9976  37.0343          ?        ?      637.3        2.9       ?       ? 
1 1 1    5    3   32 o    829.0    3.4    0.0000   0.0000          ?        ?  6873.0469  55.5514          ?        ?      829.0        3.4       ?       ? 
1 1 1    5    3   33 o    460.2    2.3    0.0000   0.0000          ?        ?  2117.9763  21.0712          ?        ?      460.2        2.3       ?       ? 
1 1 1    5    3   34 o    817.1    3.6    0.0000   0.0000          ?        ?  6676.3818  58.1055          ?        ?      817.1        3.6       ?       ? 
1 1 1    5    3   35 o   2787.7    9.6    0.0000   0.0000          ?        ? 77733.6250 533.1656          ?        ?     2787.7        9.6       ?       ? 
1 1 1    5    3   36 o    655.9    2.7    0.0000   0.0000          ?        ?  4302.3584  35.1187          ?        ?      655.9        2.7       ?       ? 
1 1 1    5    3   37 o    600.4    2.7    0.0000   0.0000          ?        ?  3604.4546  31.9261          ?        ?      600.4        2.7       ?       ? 
1 1 1    5    3   38 o   1097.2    3.8    0.0000   0.0000          ?        ? 12039.3252  83.6463          ?        ?     1097.2        3.8       ?       ? 
1 1 1    5    3   39 o    134.2    7.1    0.0000   0.0000          ?        ?   180.0631  19.1556          ?        ?      134.2        7.1       ?       ? 
1 1 1    5    3   40 o   1808.8    5.9    0.0000   0.0000          ?        ? 32723.5938 211.9892          ?        ?     1808.8        5.9       ?       ? 
1 1 1    5    3   41 o   1222.6    4.2    0.0000   0.0000          ?        ? 14947.7910 103.4405          ?        ?     1222.6        4.2       ?       ? 
1 1 1    5    3   42 o    241.4    4.0    0.0000   0.0000          ?        ?   582.9703  19.1556          ?        ?      241.4        4.0       ?       ? 
1 1 1    5    3   43 o    552.9    2.6    0.0000   0.0000          ?        ?  3056.6030  28.7335          ?        ?      552.9        2.6       ?       ? 
1 1 1    5    3   44 f    138.2    6.9    0.0000   0.0000          ?        ?   190.9180  19.1556          ?        ?      138.2        6.9       ?       ? 
1 1 1    5    3   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    5    3   46 o    700.9    3.0    0.0000   0.0000          ?        ?  4912.7856  42.1424          ?        ?      700.9        3.0       ?       ? 
1 1 1    5    3   47 o    995.0    3.6    0.0000   0.0000          ?        ?  9901.5547  70.8759          ?        ?      995.0        3.6       ?       ? 
1 1 1    5    3   48 o   1447.6    4.8    0.0000   0.0000          ?        ? 20959.4727 138.5592          ?        ?     1447.6        4.8       ?       ? 
1 1 1    5    3   49 o   1428.5    4.9    0.0000   0.0000          ?        ? 20410.3438 139.1977          ?        ?     1428.5        4.9       ?       ? 
1 1 1    5    3   50 o    391.6    3.2    0.0000   0.0000          ?        ?  1533.7289  24.9023          ?        ?      391.6        3.2       ?       ? 
1 1 1    5    3   51 f   1210.4    4.2    0.0000   0.0000          ?        ? 14652.7949 102.8020          ?        ?     1210.4        4.2       ?       ? 
1 1 1    5    3   52 o    327.2    3.4    0.0000   0.0000          ?        ?  1070.8008  22.3483          ?        ?      327.2        3.4       ?       ? 
1 1 1    5    3   53 o    512.4    2.7    0.0000   0.0000          ?        ?  2626.2393  28.0950          ?        ?      512.4        2.7       ?       ? 
1 1 1    5    3   54 o   1120.3    3.9    0.0000   0.0000          ?        ? 12553.3350  88.1160          ?        ?     1120.3        3.9       ?       ? 
1 1 1    5    3   55 o    330.9    3.4    0.0000   0.0000          ?        ?  1095.0646  22.3483          ?        ?      330.9        3.4       ?       ? 
1 1 1    5    3   56 o    419.9    2.8    0.0000   0.0000          ?        ?  1763.5968  23.6253          ?        ?      419.9        2.8       ?       ? 
1 1 1    5    3   57 o    226.7    4.4    0.0000   0.0000          ?        ?   514.0099  19.7942          ?        ?      226.7        4.4       ?       ? 
1 1 1    5    3   58 o     91.7   10.4    0.0000   0.0000          ?        ?    84.2849  19.1556          ?        ?       91.7       10.4       ?       ? 
1 1 1    5    3   59 o    640.4    2.9    0.0000   0.0000          ?        ?  4101.8633  37.6728          ?        ?      640.4        2.9       ?       ? 
1 1 1    5    3   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    5    3   61 o    257.8    4.0    0.0000   0.0000          ?        ?   664.7010  20.4327          ?        ?      257.8        4.0       ?       ? 
1 1 1    5    3   62 o    564.4    2.8    0.0000   0.0000          ?        ?  3186.2229  31.2876          ?        ?      564.4        2.8       ?       ? 
1 1 1    5    3   63 f    505.9    2.7    0.0000   0.0000          ?        ?  2559.8333  27.4564          ?        ?      505.9        2.7       ?       ? 
1 1 1    5    3   64 o    101.5    9.4    0.0000   0.0000          ?        ?   103.4405  19.1556          ?        ?      101.5        9.4       ?       ? 
1 1 1    5    3   65 o    242.1    4.2    0.0000   0.0000          ?        ?   586.8014  20.4327          ?        ?      242.1        4.2       ?       ? 
1 1 1    5    3   66 o    256.4    4.0    0.0000   0.0000          ?        ?   657.6772  20.4327          ?        ?      256.4        4.0       ?       ? 
1 1 1    5    3   67 o    219.0    4.7    0.0000   0.0000          ?        ?   480.1682  20.4327          ?        ?      219.0        4.7       ?       ? 
1 1 1    5    3   68 o    249.5    4.5    0.0000   0.0000          ?        ?   623.1971  22.3483          ?        ?      249.5        4.5       ?       ? 
1 1 1    5    3   69 o    111.6    9.4    0.0000   0.0000          ?        ?   125.1502  21.0712          ?        ?      111.6        9.4       ?       ? 
1 1 1    5    3   70 o    115.2    9.1    0.0000   0.0000          ?        ?   133.4510  21.0712          ?        ?      115.2        9.1       ?       ? 
1 1 1    5    3   71 o    130.3    8.1    0.0000   0.0000          ?        ?   170.4853  21.0712          ?        ?      130.3        8.1       ?       ? 
1 1 1    5    3   72 o    282.7    4.1    0.0000   0.0000          ?        ?   800.0676  22.9868          ?        ?      282.7        4.1       ?       ? 
1 1 1    5    3   73 o    312.5    3.7    0.0000   0.0000          ?        ?   977.5767  22.9868          ?        ?      312.5        3.7       ?       ? 
1 1 1    5    3   74 o    148.3    7.5    0.0000   0.0000          ?        ?   220.9285  22.3483          ?        ?      148.3        7.5       ?       ? 
1 1 1    5    3   75 o    178.5    6.1    0.0000   0.0000          ?        ?   319.8993  21.7097          ?        ?      178.5        6.1       ?       ? 
1 1 1    5    3   76 o    122.5    8.9    0.0000   0.0000          ?        ?   151.3296  21.7097          ?        ?      122.5        8.9       ?       ? 
1 1 1    5    3   77 o     31.3   14.4    0.0000   0.0000          ?        ?   -15.9630  21.0712          ?        ?       31.3       14.4       ?       ? 
1 1 1    5    3   78 o    136.9    8.2    0.0000   0.0000          ?        ?   189.0024  22.3483          ?        ?      136.9        8.2       ?       ? 
1 1 1    5    3   79 o    167.1    6.9    0.0000   0.0000          ?        ?   280.9495  22.9868          ?        ?      167.1        6.9       ?       ? 
1 1 1    5    3   80 o    106.5   10.8    0.0000   0.0000          ?        ?   115.5724  22.9868          ?        ?      106.5       10.8       ?       ? 
1 1 1    5    3   81 o    172.1    6.3    0.0000   0.0000          ?        ?   298.1896  21.7097          ?        ?      172.1        6.3       ?       ? 
1 1 1    5    3   82 o     50.1   18.0    0.0000   0.0000          ?        ?    23.6253  22.9868          ?        ?       50.1       18.0       ?       ? 
1 1 1    5    4    0 o    319.6    2.3 1021.6346  14.6860  1021.6346  14.6860  1021.6346  14.6860      319.6      2.3      319.6        2.3     0.0     0.0 
1 1 1    5    4    1 o    889.7    3.6    0.0000   0.0000          ?        ?  7916.3916  63.8522          ?        ?      889.7        3.6       ?       ? 
1 1 1    5    4    2 o    299.9    1.5    0.0000   0.0000          ?        ?   899.6769   8.9393          ?        ?      299.9        1.5       ?       ? 
1 1 1    5    4    3 o    727.7    3.0    0.0000   0.0000          ?        ?  5295.2598  43.4195          ?        ?      727.7        3.0       ?       ? 
1 1 1    5    4    4 o   1553.5    5.4    0.0000   0.0000          ?        ? 24134.8398 166.6541          ?        ?     1553.5        5.4       ?       ? 
1 1 1    5    4    5 o    290.2    1.3    0.0000   0.0000          ?        ?   842.2100   7.6623          ?        ?      290.2        1.3       ?       ? 
1 1 1    5    4    6 o   3038.2   23.4    0.0000   0.0000          ?        ? 92433.6719 1420.7106          ?        ?     3038.2       23.4       ?       ? 
1 1 1    5    4    7 o    445.6    1.8    0.0000   0.0000          ?        ?  1985.8022  15.9630          ?        ?      445.6        1.8       ?       ? 
1 1 1    5    4    8 o   1800.7    5.8    0.0000   0.0000          ?        ? 32428.5996 210.0736          ?        ?     1800.7        5.8       ?       ? 
1 1 1    5    4    9 o    707.0    2.5    0.0000   0.0000          ?        ?  4998.3472  35.1187          ?        ?      707.0        2.5       ?       ? 
1 1 1    5    4   10 o    921.5    3.2    0.0000   0.0000          ?        ?  8491.0605  58.1055          ?        ?      921.5        3.2       ?       ? 
1 1 1    5    4   11 o    562.1    2.1    0.0000   0.0000          ?        ?  3160.0435  23.6253          ?        ?      562.1        2.1       ?       ? 
1 1 1    5    4   12 o   2168.8    7.0    0.0000   0.0000          ?        ? 47041.8008 302.6593          ?        ?     2168.8        7.0       ?       ? 
1 1 1    5    4   13 o   1638.0    5.3    0.0000   0.0000          ?        ? 26833.8711 174.9549          ?        ?     1638.0        5.3       ?       ? 
1 1 1    5    4   14 o   1539.5    5.0    0.0000   0.0000          ?        ? 23701.9219 155.1608          ?        ?     1539.5        5.0       ?       ? 
1 1 1    5    4   15 o    691.5    2.5    0.0000   0.0000          ?        ?  4781.8887  34.4802          ?        ?      691.5        2.5       ?       ? 
1 1 1    5    4   16 o    719.4    2.6    0.0000   0.0000          ?        ?  5175.8560  37.0343          ?        ?      719.4        2.6       ?       ? 
1 1 1    5    4   17 o   1487.3    4.9    0.0000   0.0000          ?        ? 22122.8594 144.9444          ?        ?     1487.3        4.9       ?       ? 
1 1 1    5    4   18 o   1254.6    4.2    0.0000   0.0000          ?        ? 15740.1973 104.7175          ?        ?     1254.6        4.2       ?       ? 
1 1 1    5    4   19 o   1511.7    4.9    0.0000   0.0000          ?        ? 22854.6055 148.1370          ?        ?     1511.7        4.9       ?       ? 
1 1 1    5    4   20 o   1186.1    4.1    0.0000   0.0000          ?        ? 14069.8242  96.4168          ?        ?     1186.1        4.1       ?       ? 
1 1 1    5    4   21 o    100.8    2.9    0.0000   0.0000          ?        ?   101.5249   5.7467          ?        ?      100.8        2.9       ?       ? 
1 1 1    5    4   22 o    116.9    2.5    0.0000   0.0000          ?        ?   136.6436   5.7467          ?        ?      116.9        2.5       ?       ? 
1 1 1    5    4   23 f    916.9    3.2    0.0000   0.0000          ?        ?  8408.0527  59.3825          ?        ?      916.9        3.2       ?       ? 
1 1 1    5    4   24 o    649.3    2.4    0.0000   0.0000          ?        ?  4216.1582  31.2876          ?        ?      649.3        2.4       ?       ? 
1 1 1    5    4   25 o    636.0    2.4    0.0000   0.0000          ?        ?  4045.0344  30.6490          ?        ?      636.0        2.4       ?       ? 
1 1 1    5    4   26 o   1383.2    4.6    0.0000   0.0000          ?        ? 19134.5781 128.3428          ?        ?     1383.2        4.6       ?       ? 
1 1 1    5    4   27 o    190.6    2.2    0.0000   0.0000          ?        ?   363.3188   8.3008          ?        ?      190.6        2.2       ?       ? 
1 1 1    5    4   28 f    427.6    2.0    0.0000   0.0000          ?        ?  1828.0873  17.2401          ?        ?      427.6        2.0       ?       ? 
1 1 1    5    4   29 o    991.7    3.4    0.0000   0.0000          ?        ?  9834.5098  67.6833          ?        ?      991.7        3.4       ?       ? 
1 1 1    5    4   30 o    463.0    2.2    0.0000   0.0000          ?        ?  2143.5171  20.4327          ?        ?      463.0        2.2       ?       ? 
1 1 1    5    4   31 o   1090.3    4.2    0.0000   0.0000          ?        ? 11887.3564  91.9471          ?        ?     1090.3        4.2       ?       ? 
1 1 1    5    4   32 o   1376.5    4.9    0.0000   0.0000          ?        ? 18950.0449 135.3666          ?        ?     1376.5        4.9       ?       ? 
1 1 1    5    4   33 o    758.5    3.1    0.0000   0.0000          ?        ?  5753.7183  46.6121          ?        ?      758.5        3.1       ?       ? 
1 1 1    5    4   34 o   1314.8    5.0    0.0000   0.0000          ?        ? 17288.6113 130.8969          ?        ?     1314.8        5.0       ?       ? 
1 1 1    5    4   35 o    675.2    2.7    0.0000   0.0000          ?        ?  4559.6826  36.3957          ?        ?      675.2        2.7       ?       ? 
1 1 1    5    4   36 o   1372.4    4.6    0.0000   0.0000          ?        ? 18836.3887 125.1502          ?        ?     1372.4        4.6       ?       ? 
1 1 1    5    4   37 o    611.0    2.7    0.0000   0.0000          ?        ?  3733.4360  32.5646          ?        ?      611.0        2.7       ?       ? 
1 1 1    5    4   38 o   1617.4    5.3    0.0000   0.0000          ?        ? 26163.4238 171.7623          ?        ?     1617.4        5.3       ?       ? 
1 1 1    5    4   39 o    669.5    2.7    0.0000   0.0000          ?        ?  4482.4219  36.3957          ?        ?      669.5        2.7       ?       ? 
1 1 1    5    4   40 o    831.4    3.1    0.0000   0.0000          ?        ?  6913.2734  51.0817          ?        ?      831.4        3.1       ?       ? 
1 1 1    5    4   41 o   1223.5    4.2    0.0000   0.0000          ?        ? 14970.1396 102.8020          ?        ?     1223.5        4.2       ?       ? 
1 1 1    5    4   42 o   1716.3    5.7    0.0000   0.0000          ?        ? 29460.7480 196.0261          ?        ?     1716.3        5.7       ?       ? 
1 1 1    5    4   43 o    174.0    5.5    0.0000   0.0000          ?        ?   302.6593  19.1556          ?        ?      174.0        5.5       ?       ? 
1 1 1    5    4   44 o    724.5    2.9    0.0000   0.0000          ?        ?  5249.9248  42.1424          ?        ?      724.5        2.9       ?       ? 
1 1 1    5    4   45 o    750.6    3.1    0.0000   0.0000          ?        ?  5634.9531  45.9736          ?        ?      750.6        3.1       ?       ? 
1 1 1    5    4   46 o    697.7    3.0    0.0000   0.0000          ?        ?  4868.7275  41.5039          ?        ?      697.7        3.0       ?       ? 
1 1 1    5    4   47 o   1116.3    3.9    0.0000   0.0000          ?        ? 12463.3037  88.1160          ?        ?     1116.3        3.9       ?       ? 
1 1 1    5    4   48 o    365.7    3.1    0.0000   0.0000          ?        ?  1337.7028  22.3483          ?        ?      365.7        3.1       ?       ? 
1 1 1    5    4   49 o    831.0    3.3    0.0000   0.0000          ?        ?  6906.8882  54.2743          ?        ?      831.0        3.3       ?       ? 
1 1 1    5    4   50 o    966.5    3.6    0.0000   0.0000          ?        ?  9342.8477  68.9603          ?        ?      966.5        3.6       ?       ? 
1 1 1    5    4   51 o    363.9    3.2    0.0000   0.0000          ?        ?  1324.2938  23.6253          ?        ?      363.9        3.2       ?       ? 
1 1 1    5    4   52 o    825.5    3.1    0.0000   0.0000          ?        ?  6814.9414  51.0817          ?        ?      825.5        3.1       ?       ? 
1 1 1    5    4   53 o    263.1    4.1    0.0000   0.0000          ?        ?   692.1575  21.7097          ?        ?      263.1        4.1       ?       ? 
1 1 1    5    4   54 o    540.3    2.7    0.0000   0.0000          ?        ?  2919.3210  29.3720          ?        ?      540.3        2.7       ?       ? 
1 1 1    5    4   55 o    321.0    3.4    0.0000   0.0000          ?        ?  1030.5739  21.7097          ?        ?      321.0        3.4       ?       ? 
1 1 1    5    4   56 o    462.6    2.8    0.0000   0.0000          ?        ?  2140.3245  26.1794          ?        ?      462.6        2.8       ?       ? 
1 1 1    5    4   57 o     23.5   11.6    0.0000   0.0000          ?        ?   -47.8891  20.4327          ?        ?       23.5       11.6       ?       ? 
1 1 1    5    4   58 o    433.4    2.8    0.0000   0.0000          ?        ?  1879.1691  24.2638          ?        ?      433.4        2.8       ?       ? 
1 1 1    5    4   59 o    210.1    4.9    0.0000   0.0000          ?        ?   441.8569  20.4327          ?        ?      210.1        4.9       ?       ? 
1 1 1    5    4   60 o    670.5    2.9    0.0000   0.0000          ?        ?  4497.1079  38.3113          ?        ?      670.5        2.9       ?       ? 
1 1 1    5    4   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    5    4   62 o    174.2    6.0    0.0000   0.0000          ?        ?   303.9363  21.0712          ?        ?      174.2        6.0       ?       ? 
1 1 1    5    4   63 o    193.7    5.1    0.0000   0.0000          ?        ?   375.4507  19.7942          ?        ?      193.7        5.1       ?       ? 
1 1 1    5    4   64 o     43.1   16.7    0.0000   0.0000          ?        ?    12.1319  20.4327          ?        ?       43.1       16.7       ?       ? 
1 1 1    5    4   65 o    284.2    3.7    0.0000   0.0000          ?        ?   808.3683  21.0712          ?        ?      284.2        3.7       ?       ? 
1 1 1    5    4   66 o    238.5    4.3    0.0000   0.0000          ?        ?   569.5613  20.4327          ?        ?      238.5        4.3       ?       ? 
1 1 1    5    4   67 o    159.8    6.2    0.0000   0.0000          ?        ?   256.0471  19.7942          ?        ?      159.8        6.2       ?       ? 
1 1 1    5    4   68 o    111.0    9.2    0.0000   0.0000          ?        ?   123.8732  20.4327          ?        ?      111.0        9.2       ?       ? 
1 1 1    5    4   69 o     52.7   17.6    0.0000   0.0000          ?        ?    26.8179  21.7097          ?        ?       52.7       17.6       ?       ? 
1 1 1    5    4   70 o    349.4    3.2    0.0000   0.0000          ?        ?  1221.4919  22.3483          ?        ?      349.4        3.2       ?       ? 
1 1 1    5    4   71 f    549.1    2.8    0.0000   0.0000          ?        ?  3016.3762  30.6490          ?        ?      549.1        2.8       ?       ? 
1 1 1    5    4   72 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    5    4   73 o    183.4    5.6    0.0000   0.0000          ?        ?   337.1394  20.4327          ?        ?      183.4        5.6       ?       ? 
1 1 1    5    4   74 o     23.9   11.8    0.0000   0.0000          ?        ?   -52.3588  21.7097          ?        ?       23.9       11.8       ?       ? 
1 1 1    5    4   75 o    229.8    4.7    0.0000   0.0000          ?        ?   529.3344  21.7097          ?        ?      229.8        4.7       ?       ? 
1 1 1    5    4   76 o    135.6    8.0    0.0000   0.0000          ?        ?   185.1713  21.7097          ?        ?      135.6        8.0       ?       ? 
1 1 1    5    4   77 o     25.4   12.4    0.0000   0.0000          ?        ?   -36.3957  20.4327          ?        ?       25.4       12.4       ?       ? 
1 1 1    5    4   78 o    144.6    7.5    0.0000   0.0000          ?        ?   210.7121  21.7097          ?        ?      144.6        7.5       ?       ? 
1 1 1    5    4   79 o     61.8   18.0    0.0000   0.0000          ?        ?    40.8654  23.6253          ?        ?       61.8       18.0       ?       ? 
1 1 1    5    4   80 o    225.9    4.5    0.0000   0.0000          ?        ?   512.0943  20.4327          ?        ?      225.9        4.5       ?       ? 
1 1 1    5    4   81 o     24.7   12.1    0.0000   0.0000          ?        ?   -39.5883  20.4327          ?        ?       24.7       12.1       ?       ? 
1 1 1    5    4   82 o     42.5   16.6    0.0000   0.0000          ?        ?    12.7704  20.4327          ?        ?       42.5       16.6       ?       ? 
1 1 1    5    5    0 o   2182.1   17.2 47632.4336 750.9014 47632.4336 750.9014 47632.4336 750.9014     2182.1     17.2     2182.1       17.2     0.0     0.0 
1 1 1    5    5    1 o    113.3    1.7  128.3428   3.8311   128.3428   3.8311   128.3428   3.8311      113.3      1.7      113.3        1.7     0.0     0.0 
1 1 1    5    5    2 o   1934.2   10.8 37420.5586 416.9547 37420.5586 416.9547 37420.5586 416.9547     1934.2     10.8     1934.2       10.8     0.0     0.0 
1 1 1    5    5    3 o   1778.5    9.9 31637.4688 353.1024 31637.4688 353.1024 31637.4688 353.1024     1778.5      9.9     1778.5        9.9     0.0     0.0 
1 1 1    5    5    4 o    788.2    4.0 6213.4536  62.5751  6213.4536  62.5751  6213.4536  62.5751      788.2      4.0      788.2        4.0     0.0     0.0 
1 1 1    5    5    5 o     71.4    2.2   51.0817   3.1926    51.0817   3.1926    51.0817   3.1926       71.4      2.2       71.4        2.2     0.0     0.0 
1 1 1    5    5    6 o    327.5    1.9 1072.7163  12.7704  1072.7163  12.7704  1072.7163  12.7704      327.5      1.9      327.5        1.9     0.0     0.0 
1 1 1    5    5    7 o   3099.8   27.7 96203.5000 1716.9846 96203.5000 1716.9846 96203.5000 1716.9846     3099.8     27.7     3099.8       27.7     0.0     0.0 
1 1 1    5    5    8 o    316.8    2.1 1003.7560  13.4090  1003.7560  13.4090  1003.7560  13.4090      316.8      2.1      316.8        2.1     0.0     0.0 
1 1 1    5    5    9 o    283.7    2.1  805.1758  12.1319   805.1758  12.1319   805.1758  12.1319      283.7      2.1      283.7        2.1     0.0     0.0 
1 1 1    5    5   10 o   1649.8    7.6 27221.4551 250.3005 27221.4551 250.3005 27221.4551 250.3005     1649.8      7.6     1649.8        7.6     0.0     0.0 
1 1 1    5    5   11 o   3522.9   31.4 124305.4688 2208.6462 124305.4688 2208.6462 124305.4688 2208.6462     3522.9     31.4     3522.9       31.4     0.0     0.0 
1 1 1    5    5   12 o   1066.5    5.1 11374.6240 107.9102 11374.6240 107.9102 11374.6240 107.9102     1066.5      5.1     1066.5        5.1     0.0     0.0 
1 1 1    5    5   13 o     57.5    5.1   33.8416   5.7467    33.8416   5.7467    33.8416   5.7467       57.5      5.1       57.5        5.1     0.0     0.0 
1 1 1    5    5   14 o    439.4    2.5 1930.8894  22.3483  1930.8894  22.3483  1930.8894  22.3483      439.4      2.5      439.4        2.5     0.0     0.0 
1 1 1    5    5   15 f   1083.1    5.2 11732.8350 112.3798 11732.8350 112.3798 11732.8350 112.3798     1083.1      5.2     1083.1        5.2     0.0     0.0 
1 1 1    5    5   16 o   1988.0    9.1 39530.2344 361.4032 39530.2344 361.4032 39530.2344 361.4032     1988.0      9.1     1988.0        9.1     0.0     0.0 
1 1 1    5    5   17 o    504.0    2.8 2540.0391  28.0950  2540.0391  28.0950  2540.0391  28.0950      504.0      2.8      504.0        2.8     0.0     0.0 
1 1 1    5    5   18 o    516.2    2.8 2665.1892  29.3720  2665.1892  29.3720  2665.1892  29.3720      516.2      2.8      516.2        2.8     0.0     0.0 
1 1 1    5    5   19 o   2327.1   10.6 54167.7031 491.0231 54167.7031 491.0231 54167.7031 491.0231     2327.1     10.6     2327.1       10.6     0.0     0.0 
1 1 1    5    5   20 o    279.6    2.4  782.1890  13.4090   782.1890  13.4090   782.1890  13.4090      279.6      2.4      279.6        2.4     0.0     0.0 
1 1 1    5    5   21 o    927.5    4.5 8603.4404  83.6463  8603.4404  83.6463  8603.4404  83.6463      927.5      4.5      927.5        4.5     0.0     0.0 
1 1 1    5    5   22 o    946.3    4.8 8956.5430  91.3086  8956.5430  91.3086  8956.5430  91.3086      946.3      4.8      946.3        4.8     0.0     0.0 
1 1 1    5    5   23 o    489.4    2.9 2395.0947  28.7335  2395.0947  28.7335  2395.0947  28.7335      489.4      2.9      489.4        2.9     0.0     0.0 
1 1 1    5    5   24 o    539.0    3.1 2905.2734  33.2031  2905.2734  33.2031  2905.2734  33.2031      539.0      3.1      539.0        3.1     0.0     0.0 
1 1 1    5    5   25 o    471.1    3.1 2220.1399  29.3720  2220.1399  29.3720  2220.1399  29.3720      471.1      3.1      471.1        3.1     0.0     0.0 
1 1 1    5    5   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    5    5   27 o    430.1    2.8 1850.4355  24.2638  1850.4355  24.2638  1850.4355  24.2638      430.1      2.8      430.1        2.8     0.0     0.0 
1 1 1    5    5   28 o   1239.8    5.9 15372.4082 145.5829 15372.4082 145.5829 15372.4082 145.5829     1239.8      5.9     1239.8        5.9     0.0     0.0 
1 1 1    5    5   29 o    774.4    4.1 5997.6338  63.8522  5997.6338  63.8522  5997.6338  63.8522      774.4      4.1      774.4        4.1     0.0     0.0 
1 1 1    5    5   30 o    912.1    4.7 8319.9365  86.2004  8319.9365  86.2004  8319.9365  86.2004      912.1      4.7      912.1        4.7     0.0     0.0 
1 1 1    5    5   31 o    420.3    3.3 1766.7894  27.4564  1766.7894  27.4564  1766.7894  27.4564      420.3      3.3      420.3        3.3     0.0     0.0 
1 1 1    5    5   32 f   3107.9   15.3 96633.2266 950.1202 96633.2266 950.1202 96633.2266 950.1202     3107.9     15.3     3107.9       15.3     0.0     0.0 
1 1 1    5    5   33 o    640.5    4.1 4103.1396  52.3588  4103.1396  52.3588  4103.1396  52.3588      640.5      4.1      640.5        4.1     0.0     0.0 
1 1 1    5    5   34 o   1736.2    8.7 30148.4375 301.3822 30148.4375 301.3822 30148.4375 301.3822     1736.2      8.7     1736.2        8.7     0.0     0.0 
1 1 1    5    5   35 o   1018.0    5.3 10363.8447 108.5487 10363.8447 108.5487 10363.8447 108.5487     1018.0      5.3     1018.0        5.3     0.0     0.0 
1 1 1    5    5   36 o   2260.1   10.3 51090.0312 464.8438 51090.0312 464.8438 51090.0312 464.8438     2260.1     10.3     2260.1       10.3     0.0     0.0 
1 1 1    5    5   37 o    620.2    3.6 3847.0928  44.6965  3847.0928  44.6965  3847.0928  44.6965      620.2      3.6      620.2        3.6     0.0     0.0 
1 1 1    5    5   38 o   1118.7    5.5 12515.6621 121.9576 12515.6621 121.9576 12515.6621 121.9576     1118.7      5.5     1118.7        5.5     0.0     0.0 
1 1 1    5    5   39 o    447.1    3.7 1999.2113  33.2031  1999.2113  33.2031  1999.2113  33.2031      447.1      3.7      447.1        3.7     0.0     0.0 
1 1 1    5    5   40 o    377.7    4.3 1427.0958  32.5646  1427.0958  32.5646  1427.0958  32.5646      377.7      4.3      377.7        4.3     0.0     0.0 
1 1 1    5    5   41 o    788.5    4.4 6217.9233  68.9603  6217.9233  68.9603  6217.9233  68.9603      788.5      4.4      788.5        4.4     0.0     0.0 
1 1 1    5    5   42 o    987.7    5.0 9757.2490  98.3323  9757.2490  98.3323  9757.2490  98.3323      987.7      5.0      987.7        5.0     0.0     0.0 
1 1 1    5    5   43 o     19.0   13.9  -58.1055  28.7335   -58.1055  28.7335   -58.1055  28.7335       19.0     13.9       19.0       13.9     0.0     0.0 
1 1 1    5    5   44 o    404.5    4.7 1637.1694  38.3113  1637.1694  38.3113  1637.1694  38.3113      404.5      4.7      404.5        4.7     0.0     0.0 
1 1 1    5    5   45 o    670.7    4.6 4499.0234  61.2981  4499.0234  61.2981  4499.0234  61.2981      670.7      4.6      670.7        4.6     0.0     0.0 
1 1 1    5    5   46 o   1477.0    7.0 21820.8379 206.2425 21820.8379 206.2425 21820.8379 206.2425     1477.0      7.0     1477.0        7.0     0.0     0.0 
1 1 1    5    5   47 o    153.7    9.2  238.8071  28.0950   238.8071  28.0950   238.8071  28.0950      153.7      9.2      153.7        9.2     0.0     0.0 
1 1 1    5    5   48 o    442.3    4.1 1957.0687  36.3957  1957.0687  36.3957  1957.0687  36.3957      442.3      4.1      442.3        4.1     0.0     0.0 
1 1 1    5    5   49 o    552.5    4.7 3054.0488  51.7203  3054.0488  51.7203  3054.0488  51.7203      552.5      4.7      552.5        4.7     0.0     0.0 
1 1 1    5    5   50 o    121.7   11.2  151.9681  26.8179   151.9681  26.8179   151.9681  26.8179      121.7     11.2      121.7       11.2     0.0     0.0 
1 1 1    5    5   51 o    610.8    3.8 3731.5205  45.9736  3731.5205  45.9736  3731.5205  45.9736      610.8      3.8      610.8        3.8     0.0     0.0 
1 1 1    5    5   52 o     44.1   23.8   28.0950  28.7335    28.0950  28.7335    28.0950  28.7335       44.1     23.8       44.1       23.8     0.0     0.0 
1 1 1    5    5   53 o    314.0    5.0  987.1545  31.2876   987.1545  31.2876   987.1545  31.2876      314.0      5.0      314.0        5.0     0.0     0.0 
1 1 1    5    5   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    5    5   55 o     14.8   11.0  -89.3930  26.1794   -89.3930  26.1794   -89.3930  26.1794       14.8     11.0       14.8       11.0     0.0     0.0 
1 1 1    5    5   56 o    513.3    3.7 2635.1787  38.3113  2635.1787  38.3113  2635.1787  38.3113      513.3      3.7      513.3        3.7     0.0     0.0 
1 1 1    5    5   57 o    444.4    4.5 1975.5858  40.2269  1975.5858  40.2269  1975.5858  40.2269      444.4      4.5      444.4        4.5     0.0     0.0 
1 1 1    5    5   58 o    480.4    4.1 2308.8943  38.9498  2308.8943  38.9498  2308.8943  38.9498      480.4      4.1      480.4        4.1     0.0     0.0 
1 1 1    5    5   59 f    107.3   13.4  120.6806  28.0950   120.6806  28.0950   120.6806  28.0950      107.3     13.4      107.3       13.4     0.0     0.0 
1 1 1    5    5   60 o     17.0   12.6  -62.5751  26.1794   -62.5751  26.1794   -62.5751  26.1794       17.0     12.6       17.0       12.6     0.0     0.0 
1 1 1    5    5   61 o    220.2    6.4  486.5535  28.0950   486.5535  28.0950   486.5535  28.0950      220.2      6.4      220.2        6.4     0.0     0.0 
1 1 1    5    5   62 o    188.9    7.6  358.8492  28.7335   358.8492  28.7335   358.8492  28.7335      188.9      7.6      188.9        7.6     0.0     0.0 
1 1 1    5    5   63 o    164.0    8.4  271.3717  27.4564   271.3717  27.4564   271.3717  27.4564      164.0      8.4      164.0        8.4     0.0     0.0 
1 1 1    5    5   64 o    177.0    7.8  315.4297  27.4564   315.4297  27.4564   315.4297  27.4564      177.0      7.8      177.0        7.8     0.0     0.0 
1 1 1    5    5   65 o    390.7    4.3 1527.3438  33.2031  1527.3438  33.2031  1527.3438  33.2031      390.7      4.3      390.7        4.3     0.0     0.0 
1 1 1    5    5   66 o    157.6    9.6  251.5775  30.0105   251.5775  30.0105   251.5775  30.0105      157.6      9.6      157.6        9.6     0.0     0.0 
1 1 1    5    5   67 o    222.3    6.6  496.1313  29.3720   496.1313  29.3720   496.1313  29.3720      222.3      6.6      222.3        6.6     0.0     0.0 
1 1 1    5    5   68 o     19.7   14.4  -57.4669  30.0105   -57.4669  30.0105   -57.4669  30.0105       19.7     14.4       19.7       14.4     0.0     0.0 
1 1 1    5    5   69 o     33.5   21.2    5.7467  30.0105     5.7467  30.0105     5.7467  30.0105       33.5     21.2       33.5       21.2     0.0     0.0 
1 1 1    5    5   70 o    101.3   15.2  107.9102  29.3720   107.9102  29.3720   107.9102  29.3720      101.3     15.2      101.3       15.2     0.0     0.0 
1 1 1    5    5   71 o    413.8    4.5 1713.7920  37.0343  1713.7920  37.0343  1713.7920  37.0343      413.8      4.5      413.8        4.5     0.0     0.0 
1 1 1    5    5   72 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    5    5   73 o    401.0    4.5 1609.7130  36.3957  1609.7130  36.3957  1609.7130  36.3957      401.0      4.5      401.0        4.5     0.0     0.0 
1 1 1    5    5   74 o    387.4    4.6 1503.0798  35.7572  1503.0798  35.7572  1503.0798  35.7572      387.4      4.6      387.4        4.6     0.0     0.0 
1 1 1    5    5   75 o    160.0    9.7  259.8783  30.6490   259.8783  30.6490   259.8783  30.6490      160.0      9.7      160.0        9.7     0.0     0.0 
1 1 1    5    5   76 o    135.5   11.0  188.3639  29.3720   188.3639  29.3720   188.3639  29.3720      135.5     11.0      135.5       11.0     0.0     0.0 
1 1 1    5    5   77 o    134.3   11.6  185.8098  30.6490   185.8098  30.6490   185.8098  30.6490      134.3     11.6      134.3       11.6     0.0     0.0 
1 1 1    5    5   78 o    210.4    7.0  445.6881  29.3720   445.6881  29.3720   445.6881  29.3720      210.4      7.0      210.4        7.0     0.0     0.0 
1 1 1    5    5   79 o     19.4   14.3  -68.9603  31.9261   -68.9603  31.9261   -68.9603  31.9261       19.4     14.3       19.4       14.3     0.0     0.0 
1 1 1    5    5   80 o     67.4   26.7   65.1292  34.4802    65.1292  34.4802    65.1292  34.4802       67.4     26.7       67.4       26.7     0.0     0.0 
1 1 1    5    5   81 o    156.4   10.3  250.3005  31.9261   250.3005  31.9261   250.3005  31.9261      156.4     10.3      156.4       10.3     0.0     0.0 
1 1 1    5    5   82 o     22.3   16.1  -54.2743  34.4802   -54.2743  34.4802   -54.2743  34.4802       22.3     16.1       22.3       16.1     0.0     0.0 
1 1 1    6    0    0 o     49.1    5.3   24.9023   5.1082    24.9023   5.1082    24.9023   5.1082       49.1      5.3       49.1        5.3     0.0     0.0 
1 1 1    6    0    1 o    814.4    4.2 6633.6016  68.9603  6633.6016  68.9603  6633.6016  68.9603      814.4      4.2      814.4        4.2     0.0     0.0 
1 1 1    6    0    2 o   1745.8    8.6 30481.7441 301.3822 30481.7441 301.3822 30481.7441 301.3822     1745.8      8.6     1745.8        8.6     0.0     0.0 
1 1 1    6    0    3 o   1527.0    6.9 23320.7266 211.9892 23320.7266 211.9892 23320.7266 211.9892     1527.0      6.9     1527.0        6.9     0.0     0.0 
1 1 1    6    0    4 o     41.9    3.1   17.8786   2.5541    17.8786   2.5541    17.8786   2.5541       41.9      3.1       41.9        3.1     0.0     0.0 
1 1 1    6    0    5 o   1130.1    5.3 12771.7090 119.4035 12771.7090 119.4035 12771.7090 119.4035     1130.1      5.3     1130.1        5.3     0.0     0.0 
1 1 1    6    0    6 o     78.5    3.3   61.9366   5.1082    61.9366   5.1082    61.9366   5.1082       78.5      3.3       78.5        3.3     0.0     0.0 
1 1 1    6    0    7 o    196.3    2.3  385.6671   8.9393   385.6671   8.9393   385.6671   8.9393      196.3      2.3      196.3        2.3     0.0     0.0 
1 1 1    6    0    8 o    603.6    3.1 3644.0430  37.6728  3644.0430  37.6728  3644.0430  37.6728      603.6      3.1      603.6        3.1     0.0     0.0 
1 1 1    6    0    9 o    798.1    4.1 6369.8916  65.1292  6369.8916  65.1292  6369.8916  65.1292      798.1      4.1      798.1        4.1     0.0     0.0 
1 1 1    6    0   10 o    408.1    2.3 1665.9028  19.1556  1665.9028  19.1556  1665.9028  19.1556      408.1      2.3      408.1        2.3     0.0     0.0 
1 1 1    6    0   11 o    569.4    3.4 3243.0513  38.3113  3243.0513  38.3113  3243.0513  38.3113      569.4      3.4      569.4        3.4     0.0     0.0 
1 1 1    6    0   12 o   1001.7    4.8 10035.0059  96.4168 10035.0059  96.4168 10035.0059  96.4168     1001.7      4.8     1001.7        4.8     0.0     0.0 
1 1 1    6    0   13 o   1593.0    7.3 25378.6816 233.0604 25378.6816 233.0604 25378.6816 233.0604     1593.0      7.3     1593.0        7.3     0.0     0.0 
1 1 1    6    0   14 o    841.3    4.1 7079.2891  68.9603  7079.2891  68.9603  7079.2891  68.9603      841.3      4.1      841.3        4.1     0.0     0.0 
1 1 1    6    0   15 o    762.3    3.9 5811.1851  58.7440  5811.1851  58.7440  5811.1851  58.7440      762.3      3.9      762.3        3.9     0.0     0.0 
1 1 1    6    0   16 o   1319.6    6.2 17415.0391 162.8230 17415.0391 162.8230 17415.0391 162.8230     1319.6      6.2     1319.6        6.2     0.0     0.0 
1 1 1    6    0   17 o    555.9    2.9 3091.0833  32.5646  3091.0833  32.5646  3091.0833  32.5646      555.9      2.9      555.9        2.9     0.0     0.0 
1 1 1    6    0   18 o    712.9    3.7 5083.2705  52.9973  5083.2705  52.9973  5083.2705  52.9973      712.9      3.7      712.9        3.7     0.0     0.0 
1 1 1    6    0   19 o    776.7    3.9 6033.3911  60.0210  6033.3911  60.0210  6033.3911  60.0210      776.7      3.9      776.7        3.9     0.0     0.0 
1 1 1    6    0   20 o    575.2    3.2 3309.4575  36.3957  3309.4575  36.3957  3309.4575  36.3957      575.2      3.2      575.2        3.2     0.0     0.0 
1 1 1    6    0   21 o    958.4    4.6 9187.0498  88.7545  9187.0498  88.7545  9187.0498  88.7545      958.4      4.6      958.4        4.6     0.0     0.0 
1 1 1    6    0   22 o    648.0    3.3 4198.9180  42.7809  4198.9180  42.7809  4198.9180  42.7809      648.0      3.3      648.0        3.3     0.0     0.0 
1 1 1    6    0   23 o    652.8    3.3 4262.1318  43.4195  4262.1318  43.4195  4262.1318  43.4195      652.8      3.3      652.8        3.3     0.0     0.0 
1 1 1    6    0   24 o    273.6    2.5  748.9859  13.4090   748.9859  13.4090   748.9859  13.4090      273.6      2.5      273.6        2.5     0.0     0.0 
1 1 1    6    0   25 o   1467.4    6.8 21536.0586 199.2188 21536.0586 199.2188 21536.0586 199.2188     1467.4      6.8     1467.4        6.8     0.0     0.0 
1 1 1    6    0   26 o    563.7    3.2 3177.9221  36.3957  3177.9221  36.3957  3177.9221  36.3957      563.7      3.2      563.7        3.2     0.0     0.0 
1 1 1    6    0   27 o    216.0    3.0  466.7593  12.7704   466.7593  12.7704   466.7593  12.7704      216.0      3.0      216.0        3.0     0.0     0.0 
1 1 1    6    0   28 o    226.9    3.1  515.2869  14.0475   515.2869  14.0475   515.2869  14.0475      226.9      3.1      226.9        3.1     0.0     0.0 
1 1 1    6    0   29 o   1470.6    7.2 21630.5586 211.9892 21630.5586 211.9892 21630.5586 211.9892     1470.6      7.2     1470.6        7.2     0.0     0.0 
1 1 1    6    0   30 o    499.4    3.5 2494.7041  35.1187  2494.7041  35.1187  2494.7041  35.1187      499.4      3.5      499.4        3.5     0.0     0.0 
1 1 1    6    0   31 f    631.8    3.5 3992.6755  44.0580  3992.6755  44.0580  3992.6755  44.0580      631.8      3.5      631.8        3.5     0.0     0.0 
1 1 1    6    0   32 o   1258.3    6.7 15835.9756 169.2082 15835.9756 169.2082 15835.9756 169.2082     1258.3      6.7     1258.3        6.7     0.0     0.0 
1 1 1    6    0   33 o     15.8   11.6  -43.4195  20.4327   -43.4195  20.4327   -43.4195  20.4327       15.8     11.6       15.8       11.6     0.0     0.0 
1 1 1    6    0   34 o   1695.8    9.5 28763.4844 321.8149 28763.4844 321.8149 28763.4844 321.8149     1695.8      9.5     1695.8        9.5     0.0     0.0 
1 1 1    6    0   35 o    396.3    3.6 1570.7632  28.7335  1570.7632  28.7335  1570.7632  28.7335      396.3      3.6      396.3        3.6     0.0     0.0 
1 1 1    6    0   36 o    564.8    3.6 3190.0542  40.8654  3190.0542  40.8654  3190.0542  40.8654      564.8      3.6      564.8        3.6     0.0     0.0 
1 1 1    6    0   37 o    918.1    4.6 8429.7617  84.9234  8429.7617  84.9234  8429.7617  84.9234      918.1      4.6      918.1        4.6     0.0     0.0 
1 1 1    6    0   38 o   1582.2    7.4 25038.3496 233.0604 25038.3496 233.0604 25038.3496 233.0604     1582.2      7.4     1582.2        7.4     0.0     0.0 
1 1 1    6    0   39 o     50.2   22.4   36.3957  23.6253    36.3957  23.6253    36.3957  23.6253       50.2     22.4       50.2       22.4     0.0     0.0 
1 1 1    6    0   40 o     19.0   13.6  -28.7335  21.7097   -28.7335  21.7097   -28.7335  21.7097       19.0     13.6       19.0       13.6     0.0     0.0 
1 1 1    6    0   41 o    327.8    4.4 1075.2704  28.7335  1075.2704  28.7335  1075.2704  28.7335      327.8      4.4      327.8        4.4     0.0     0.0 
1 1 1    6    0   42 o    562.7    4.3 3166.4287  47.8891  3166.4287  47.8891  3166.4287  47.8891      562.7      4.3      562.7        4.3     0.0     0.0 
1 1 1    6    0   43 o    945.2    4.9 8936.1104  93.2242  8936.1104  93.2242  8936.1104  93.2242      945.2      4.9      945.2        4.9     0.0     0.0 
1 1 1    6    0   44 o    628.4    4.0 3949.8945  49.8047  3949.8945  49.8047  3949.8945  49.8047      628.4      4.0      628.4        4.0     0.0     0.0 
1 1 1    6    0   45 o    826.5    4.5 6831.5430  74.0685  6831.5430  74.0685  6831.5430  74.0685      826.5      4.5      826.5        4.5     0.0     0.0 
1 1 1    6    0   46 o   1649.5    8.1 27215.0703 268.1791 27215.0703 268.1791 27215.0703 268.1791     1649.5      8.1     1649.5        8.1     0.0     0.0 
1 1 1    6    0   47 o     21.0   15.5  -80.4537  37.0343   -80.4537  37.0343   -80.4537  37.0343       21.0     15.5       21.0       15.5     0.0     0.0 
1 1 1    6    0   48 o    752.3    5.1 5661.1328  76.6226  5661.1328  76.6226  5661.1328  76.6226      752.3      5.1      752.3        5.1     0.0     0.0 
1 1 1    6    0   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    6    0   50 o    924.6    4.8 8550.4434  89.3930  8550.4434  89.3930  8550.4434  89.3930      924.6      4.8      924.6        4.8     0.0     0.0 
1 1 1    6    0   51 o   1526.3    7.4 23303.4863 227.3137 23303.4863 227.3137 23303.4863 227.3137     1526.3      7.4     1526.3        7.4     0.0     0.0 
1 1 1    6    0   52 o    192.8   10.8  375.4507  41.5039   375.4507  41.5039   375.4507  41.5039      192.8     10.8      192.8       10.8     0.0     0.0 
1 1 1    6    0   53 o    138.1   13.2  196.0261  35.7572   196.0261  35.7572   196.0261  35.7572      138.1     13.2      138.1       13.2     0.0     0.0 
1 1 1    6    0   54 o    363.3    4.8 1321.1012  35.1187  1321.1012  35.1187  1321.1012  35.1187      363.3      4.8      363.3        4.8     0.0     0.0 
1 1 1    6    0   55 o    555.1    4.0 3082.7822  44.0580  3082.7822  44.0580  3082.7822  44.0580      555.1      4.0      555.1        4.0     0.0     0.0 
1 1 1    6    0   56 o    468.8    4.4 2199.0684  41.5039  2199.0684  41.5039  2199.0684  41.5039      468.8      4.4      468.8        4.4     0.0     0.0 
1 1 1    6    0   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    6    0   58 o    723.5    4.3 5235.8774  61.9366  5235.8774  61.9366  5235.8774  61.9366      723.5      4.3      723.5        4.3     0.0     0.0 
1 1 1    6    0   59 o    145.2   10.7  214.5433  30.6490   214.5433  30.6490   214.5433  30.6490      145.2     10.7      145.2       10.7     0.0     0.0 
1 1 1    6    0   60 o    209.4    6.6  439.9414  27.4564   439.9414  27.4564   439.9414  27.4564      209.4      6.6      209.4        6.6     0.0     0.0 
1 1 1    6    0   61 o     23.4   16.5  -26.8179  28.0950   -26.8179  28.0950   -26.8179  28.0950       23.4     16.5       23.4       16.5     0.0     0.0 
1 1 1    6    0   62 o    298.6    5.7  893.2917  33.8416   893.2917  33.8416   893.2917  33.8416      298.6      5.7      298.6        5.7     0.0     0.0 
1 1 1    6    0   63 o     27.7   18.5   -6.3852  26.8179    -6.3852  26.8179    -6.3852  26.8179       27.7     18.5       27.7       18.5     0.0     0.0 
1 1 1    6    0   64 o    168.2    8.2  285.4192  27.4564   285.4192  27.4564   285.4192  27.4564      168.2      8.2      168.2        8.2     0.0     0.0 
1 1 1    6    0   65 o    212.5    6.9  453.3503  29.3720   453.3503  29.3720   453.3503  29.3720      212.5      6.9      212.5        6.9     0.0     0.0 
1 1 1    6    0   66 o    132.4   11.0  179.4246  28.7335   179.4246  28.7335   179.4246  28.7335      132.4     11.0      132.4       11.0     0.0     0.0 
1 1 1    6    0   67 o    139.1   10.4  197.3032  28.7335   197.3032  28.7335   197.3032  28.7335      139.1     10.4      139.1       10.4     0.0     0.0 
1 1 1    6    0   68 o     77.1   22.4   73.4300  30.0105    73.4300  30.0105    73.4300  30.0105       77.1     22.4       77.1       22.4     0.0     0.0 
1 1 1    6    0   69 o     15.8   11.8  -93.2242  28.7335   -93.2242  28.7335   -93.2242  28.7335       15.8     11.8       15.8       11.8     0.0     0.0 
1 1 1    6    0   70 o    264.6    5.8  701.7353  30.6490   701.7353  30.6490   701.7353  30.6490      264.6      5.8      264.6        5.8     0.0     0.0 
1 1 1    6    0   71 o    152.1   10.6  235.6145  31.9261   235.6145  31.9261   235.6145  31.9261      152.1     10.6      152.1       10.6     0.0     0.0 
1 1 1    6    0   72 o    386.0    4.6 1491.5865  35.1187  1491.5865  35.1187  1491.5865  35.1187      386.0      4.6      386.0        4.6     0.0     0.0 
1 1 1    6    0   73 o    239.2    7.0  574.6694  33.2031   574.6694  33.2031   574.6694  33.2031      239.2      7.0      239.2        7.0     0.0     0.0 
1 1 1    6    0   74 o    381.5    4.8 1457.7449  36.3957  1457.7449  36.3957  1457.7449  36.3957      381.5      4.8      381.5        4.8     0.0     0.0 
1 1 1    6    0   75 o    154.4   10.2  242.6382  31.2876   242.6382  31.2876   242.6382  31.2876      154.4     10.2      154.4       10.2     0.0     0.0 
1 1 1    6    0   76 o     53.4   26.1   43.4195  32.5646    43.4195  32.5646    43.4195  32.5646       53.4     26.1       53.4       26.1     0.0     0.0 
1 1 1    6    0   77 o     95.0   17.0   98.9709  29.3720    98.9709  29.3720    98.9709  29.3720       95.0     17.0       95.0       17.0     0.0     0.0 
1 1 1    6    0   78 o    250.4    6.0  629.5823  30.0105   629.5823  30.0105   629.5823  30.0105      250.4      6.0      250.4        6.0     0.0     0.0 
1 1 1    6    0   79 o    135.1   11.3  187.7254  30.0105   187.7254  30.0105   187.7254  30.0105      135.1     11.3      135.1       11.3     0.0     0.0 
1 1 1    6    0   80 o    155.8   10.8  248.3849  33.2031   248.3849  33.2031   248.3849  33.2031      155.8     10.8      155.8       10.8     0.0     0.0 
1 1 1    6    0   81 o     47.5   24.5   35.1187  29.3720    35.1187  29.3720    35.1187  29.3720       47.5     24.5       47.5       24.5     0.0     0.0 
1 1 1    6    0   82 o     31.5   20.7    0.0000  31.2876     0.0000  31.2876     0.0000  31.2876       31.5     20.7       31.5       20.7     0.0     0.0 
1 1 1    6    1    0 o    667.3    3.6 4453.0498  48.5276  4453.0498  48.5276  4453.0498  48.5276      667.3      3.6      667.3        3.6     0.0     0.0 
1 1 1    6    1    1 o     82.7    1.2    0.0000   0.0000          ?        ?    68.3218   1.9156          ?        ?       82.7        1.2       ?       ? 
1 1 1    6    1    2 o   1110.5    3.9    0.0000   0.0000          ?        ? 12331.7686  86.2004          ?        ?     1110.5        3.9       ?       ? 
1 1 1    6    1    3 o    923.7    3.1    0.0000   0.0000          ?        ?  8532.5645  58.1055          ?        ?      923.7        3.1       ?       ? 
1 1 1    6    1    4 o    962.4    3.2    0.0000   0.0000          ?        ?  9262.3945  61.2981          ?        ?      962.4        3.2       ?       ? 
1 1 1    6    1    5 o    741.8    2.5    0.0000   0.0000          ?        ?  5502.7793  37.6728          ?        ?      741.8        2.5       ?       ? 
1 1 1    6    1    6 o    627.5    2.2    0.0000   0.0000          ?        ?  3937.1243  27.4564          ?        ?      627.5        2.2       ?       ? 
1 1 1    6    1    7 o   1998.4    6.4    0.0000   0.0000          ?        ? 39939.5273 256.0471          ?        ?     1998.4        6.4       ?       ? 
1 1 1    6    1    8 o   1082.4    3.7    0.0000   0.0000          ?        ? 11716.8721  79.8152          ?        ?     1082.4        3.7       ?       ? 
1 1 1    6    1    9 o   1481.2    4.8    0.0000   0.0000          ?        ? 21940.2422 142.3903          ?        ?     1481.2        4.8       ?       ? 
1 1 1    6    1   10 o   1725.9    5.7    0.0000   0.0000          ?        ? 29788.3125 196.6647          ?        ?     1725.9        5.7       ?       ? 
1 1 1    6    1   11 o   1650.2    5.4    0.0000   0.0000          ?        ? 27232.9473 176.8705          ?        ?     1650.2        5.4       ?       ? 
1 1 1    6    1   12 o   1663.1    5.4    0.0000   0.0000          ?        ? 27662.6719 179.4246          ?        ?     1663.1        5.4       ?       ? 
1 1 1    6    1   13 o   2101.0    6.7    0.0000   0.0000          ?        ? 44147.3867 283.5036          ?        ?     2101.0        6.7       ?       ? 
1 1 1    6    1   14 o    981.4    3.3    0.0000   0.0000          ?        ?  9631.4600  65.1292          ?        ?      981.4        3.3       ?       ? 
1 1 1    6    1   15 o   2162.7    7.1    0.0000   0.0000          ?        ? 46780.6484 306.4904          ?        ?     2162.7        7.1       ?       ? 
1 1 1    6    1   16 o   1256.7    4.2    0.0000   0.0000          ?        ? 15792.5557 104.7175          ?        ?     1256.7        4.2       ?       ? 
1 1 1    6    1   17 o   1176.3    3.9    0.0000   0.0000          ?        ? 13836.7637  91.9471          ?        ?     1176.3        3.9       ?       ? 
1 1 1    6    1   18 o    517.5    2.0    0.0000   0.0000          ?        ?  2678.5981  21.0712          ?        ?      517.5        2.0       ?       ? 
1 1 1    6    1   19 o   1594.9    5.2    0.0000   0.0000          ?        ? 25440.6172 164.7386          ?        ?     1594.9        5.2       ?       ? 
1 1 1    6    1   20 o   1805.4    6.0    0.0000   0.0000          ?        ? 32599.0820 215.1818          ?        ?     1805.4        6.0       ?       ? 
1 1 1    6    1   21 o   1026.5    3.5    0.0000   0.0000          ?        ? 10538.1611  72.1529          ?        ?     1026.5        3.5       ?       ? 
1 1 1    6    1   22 o    159.4    2.4    0.0000   0.0000          ?        ?   254.1316   7.6623          ?        ?      159.4        2.4       ?       ? 
1 1 1    6    1   23 o   1081.0    3.6    0.0000   0.0000          ?        ? 11686.8613  78.5382          ?        ?     1081.0        3.6       ?       ? 
1 1 1    6    1   24 o   1036.2    3.5    0.0000   0.0000          ?        ? 10738.0176  72.7915          ?        ?     1036.2        3.5       ?       ? 
1 1 1    6    1   25 o    107.8    3.3    0.0000   0.0000          ?        ?   116.2109   7.0237          ?        ?      107.8        3.3       ?       ? 
1 1 1    6    1   26 o    428.2    1.9    0.0000   0.0000          ?        ?  1833.1957  16.6016          ?        ?      428.2        1.9       ?       ? 
1 1 1    6    1   27 o    946.8    3.3    0.0000   0.0000          ?        ?  8964.8438  62.5751          ?        ?      946.8        3.3       ?       ? 
1 1 1    6    1   28 o    982.8    3.4    0.0000   0.0000          ?        ?  9658.9160  67.0448          ?        ?      982.8        3.4       ?       ? 
1 1 1    6    1   29 o    685.7    2.6    0.0000   0.0000          ?        ?  4702.0732  35.1187          ?        ?      685.7        2.6       ?       ? 
1 1 1    6    1   30 o   1314.0    4.3    0.0000   0.0000          ?        ? 17266.2637 114.2954          ?        ?     1314.0        4.3       ?       ? 
1 1 1    6    1   31 o    258.7    2.5    0.0000   0.0000          ?        ?   669.1707  12.7704          ?        ?      258.7        2.5       ?       ? 
1 1 1    6    1   32 o    464.9    2.9    0.0000   0.0000          ?        ?  2161.3958  26.8179          ?        ?      464.9        2.9       ?       ? 
1 1 1    6    1   33 o    550.8    2.3    0.0000   0.0000          ?        ?  3034.2549  24.9023          ?        ?      550.8        2.3       ?       ? 
1 1 1    6    1   34 o    439.1    2.9    0.0000   0.0000          ?        ?  1928.3353  25.5409          ?        ?      439.1        2.9       ?       ? 
1 1 1    6    1   35 o    540.2    2.5    0.0000   0.0000          ?        ?  2918.6824  27.4564          ?        ?      540.2        2.5       ?       ? 
1 1 1    6    1   36 o    970.2    3.3    0.0000   0.0000          ?        ?  9413.0859  64.4907          ?        ?      970.2        3.3       ?       ? 
1 1 1    6    1   37 o   1280.4    4.3    0.0000   0.0000          ?        ? 16395.3203 109.1872          ?        ?     1280.4        4.3       ?       ? 
1 1 1    6    1   38 o    232.6    3.8    0.0000   0.0000          ?        ?   540.8278  17.8786          ?        ?      232.6        3.8       ?       ? 
1 1 1    6    1   39 o   1068.7    3.6    0.0000   0.0000          ?        ? 11421.8750  77.8996          ?        ?     1068.7        3.6       ?       ? 
1 1 1    6    1   40 o    620.1    2.7    0.0000   0.0000          ?        ?  3845.1772  33.2031          ?        ?      620.1        2.7       ?       ? 
1 1 1    6    1   41 o    879.6    3.2    0.0000   0.0000          ?        ?  7736.9663  56.8284          ?        ?      879.6        3.2       ?       ? 
1 1 1    6    1   42 o    193.9    4.8    0.0000   0.0000          ?        ?   376.0892  18.5171          ?        ?      193.9        4.8       ?       ? 
1 1 1    6    1   43 o    567.2    2.6    0.0000   0.0000          ?        ?  3217.5105  29.3720          ?        ?      567.2        2.6       ?       ? 
1 1 1    6    1   44 o   1263.3    4.3    0.0000   0.0000          ?        ? 15961.1250 108.5487          ?        ?     1263.3        4.3       ?       ? 
1 1 1    6    1   45 f    588.3    3.0    0.0000   0.0000          ?        ?  3461.4255  35.1187          ?        ?      588.3        3.0       ?       ? 
1 1 1    6    1   46 o    723.9    3.0    0.0000   0.0000          ?        ?  5240.3472  43.4195          ?        ?      723.9        3.0       ?       ? 
1 1 1    6    1   47 o    298.2    3.4    0.0000   0.0000          ?        ?   889.4606  20.4327          ?        ?      298.2        3.4       ?       ? 
1 1 1    6    1   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    6    1   49 o    684.6    2.9    0.0000   0.0000          ?        ?  4686.7485  39.5883          ?        ?      684.6        2.9       ?       ? 
1 1 1    6    1   50 o    560.5    3.1    0.0000   0.0000          ?        ?  3142.1650  34.4802          ?        ?      560.5        3.1       ?       ? 
1 1 1    6    1   51 o    612.0    2.9    0.0000   0.0000          ?        ?  3745.5676  35.1187          ?        ?      612.0        2.9       ?       ? 
1 1 1    6    1   52 o    815.5    3.2    0.0000   0.0000          ?        ?  6650.8413  51.7203          ?        ?      815.5        3.2       ?       ? 
1 1 1    6    1   53 f   1424.2    4.7    0.0000   0.0000          ?        ? 20289.0254 134.7281          ?        ?     1424.2        4.7       ?       ? 
1 1 1    6    1   54 o    749.3    2.9    0.0000   0.0000          ?        ?  5615.7979  44.0580          ?        ?      749.3        2.9       ?       ? 
1 1 1    6    1   55 o    613.9    2.8    0.0000   0.0000          ?        ?  3769.8318  34.4802          ?        ?      613.9        2.8       ?       ? 
1 1 1    6    1   56 o    322.1    3.4    0.0000   0.0000          ?        ?  1037.5977  21.7097          ?        ?      322.1        3.4       ?       ? 
1 1 1    6    1   57 o    259.0    3.9    0.0000   0.0000          ?        ?   671.0862  20.4327          ?        ?      259.0        3.9       ?       ? 
1 1 1    6    1   58 o     44.3   16.6    0.0000   0.0000          ?        ?    14.6860  19.7942          ?        ?       44.3       16.6       ?       ? 
1 1 1    6    1   59 o    416.2    2.8    0.0000   0.0000          ?        ?  1732.3091  23.6253          ?        ?      416.2        2.8       ?       ? 
1 1 1    6    1   60 o    637.3    2.9    0.0000   0.0000          ?        ?  4062.9131  37.0343          ?        ?      637.3        2.9       ?       ? 
1 1 1    6    1   61 o    516.5    2.8    0.0000   0.0000          ?        ?  2668.3818  28.7335          ?        ?      516.5        2.8       ?       ? 
1 1 1    6    1   62 o    579.8    2.8    0.0000   0.0000          ?        ?  3363.0935  31.9261          ?        ?      579.8        2.8       ?       ? 
1 1 1    6    1   63 o    325.3    3.3    0.0000   0.0000          ?        ?  1058.6688  21.7097          ?        ?      325.3        3.3       ?       ? 
1 1 1    6    1   64 o    439.2    2.9    0.0000   0.0000          ?        ?  1929.6124  25.5409          ?        ?      439.2        2.9       ?       ? 
1 1 1    6    1   65 o    158.3    6.3    0.0000   0.0000          ?        ?   250.9390  19.7942          ?        ?      158.3        6.3       ?       ? 
1 1 1    6    1   66 o    424.6    2.9    0.0000   0.0000          ?        ?  1803.8236  24.9023          ?        ?      424.6        2.9       ?       ? 
1 1 1    6    1   67 o    208.1    4.9    0.0000   0.0000          ?        ?   433.5562  20.4327          ?        ?      208.1        4.9       ?       ? 
1 1 1    6    1   68 o     68.8   15.3    0.0000   0.0000          ?        ?    49.8047  20.4327          ?        ?       68.8       15.3       ?       ? 
1 1 1    6    1   69 o     33.4   15.0    0.0000   0.0000          ?        ?   -10.2163  21.0712          ?        ?       33.4       15.0       ?       ? 
1 1 1    6    1   70 o    120.1    8.5    0.0000   0.0000          ?        ?   144.9444  20.4327          ?        ?      120.1        8.5       ?       ? 
1 1 1    6    1   71 o     41.0   16.6    0.0000   0.0000          ?        ?     7.6623  21.0712          ?        ?       41.0       16.6       ?       ? 
1 1 1    6    1   72 o    329.3    3.7    0.0000   0.0000          ?        ?  1085.4868  24.2638          ?        ?      329.3        3.7       ?       ? 
1 1 1    6    1   73 o    273.1    4.1    0.0000   0.0000          ?        ?   747.0703  22.3483          ?        ?      273.1        4.1       ?       ? 
1 1 1    6    1   74 o    276.0    4.3    0.0000   0.0000          ?        ?   763.0333  23.6253          ?        ?      276.0        4.3       ?       ? 
1 1 1    6    1   75 o     24.8   12.2    0.0000   0.0000          ?        ?   -46.6121  21.7097          ?        ?       24.8       12.2       ?       ? 
1 1 1    6    1   76 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    6    1   77 o    240.6    4.8    0.0000   0.0000          ?        ?   580.4161  22.9868          ?        ?      240.6        4.8       ?       ? 
1 1 1    6    1   78 o    100.0   10.9    0.0000   0.0000          ?        ?   101.5249  21.7097          ?        ?      100.0       10.9       ?       ? 
1 1 1    6    1   79 o    141.5    7.4    0.0000   0.0000          ?        ?   201.7728  21.0712          ?        ?      141.5        7.4       ?       ? 
1 1 1    6    1   80 o    148.6    7.7    0.0000   0.0000          ?        ?   222.8441  22.9868          ?        ?      148.6        7.7       ?       ? 
1 1 1    6    1   81 o    208.4    5.4    0.0000   0.0000          ?        ?   436.7488  22.3483          ?        ?      208.4        5.4       ?       ? 
1 1 1    6    1   82 o    140.2    8.0    0.0000   0.0000          ?        ?   199.2188  22.3483          ?        ?      140.2        8.0       ?       ? 
1 1 1    6    2    0 o    994.5    5.4 9891.3379 107.9102  9891.3379 107.9102  9891.3379 107.9102      994.5      5.4      994.5        5.4     0.0     0.0 
1 1 1    6    2    1 o    447.1    1.9    0.0000   0.0000          ?        ?  1999.2113  16.6016          ?        ?      447.1        1.9       ?       ? 
1 1 1    6    2    2 o   1726.7    6.6    0.0000   0.0000          ?        ? 29818.3203 227.9522          ?        ?     1726.7        6.6       ?       ? 
1 1 1    6    2    3 o   1701.7    6.2    0.0000   0.0000          ?        ? 28961.4258 209.4351          ?        ?     1701.7        6.2       ?       ? 
1 1 1    6    2    4 o    581.3    2.1    0.0000   0.0000          ?        ?  3379.6948  24.9023          ?        ?      581.3        2.1       ?       ? 
1 1 1    6    2    5 o    961.7    3.2    0.0000   0.0000          ?        ?  9248.9854  61.9366          ?        ?      961.7        3.2       ?       ? 
1 1 1    6    2    6 o    414.7    1.7    0.0000   0.0000          ?        ?  1719.5387  14.0475          ?        ?      414.7        1.7       ?       ? 
1 1 1    6    2    7 o    286.3    1.2    0.0000   0.0000          ?        ?   819.8618   7.0237          ?        ?      286.3        1.2       ?       ? 
1 1 1    6    2    8 o    734.8    2.6    0.0000   0.0000          ?        ?  5399.9775  37.6728          ?        ?      734.8        2.6       ?       ? 
1 1 1    6    2    9 o   1144.2    3.9    0.0000   0.0000          ?        ? 13092.8857  88.7545          ?        ?     1144.2        3.9       ?       ? 
1 1 1    6    2   10 o   1143.7    3.8    0.0000   0.0000          ?        ? 13081.3926  86.8389          ?        ?     1143.7        3.8       ?       ? 
1 1 1    6    2   11 o   1925.5    6.2    0.0000   0.0000          ?        ? 37080.2305 240.0841          ?        ?     1925.5        6.2       ?       ? 
1 1 1    6    2   12 o   1117.5    3.8    0.0000   0.0000          ?        ? 12489.4834  84.9234          ?        ?     1117.5        3.8       ?       ? 
1 1 1    6    2   13 o   1003.0    3.4    0.0000   0.0000          ?        ? 10060.5469  68.3218          ?        ?     1003.0        3.4       ?       ? 
1 1 1    6    2   14 o    784.2    2.7    0.0000   0.0000          ?        ?  6150.2402  42.7809          ?        ?      784.2        2.7       ?       ? 
1 1 1    6    2   15 o    905.2    3.1    0.0000   0.0000          ?        ?  8194.1484  56.8284          ?        ?      905.2        3.1       ?       ? 
1 1 1    6    2   16 o    952.7    3.3    0.0000   0.0000          ?        ?  9075.9463  62.5751          ?        ?      952.7        3.3       ?       ? 
1 1 1    6    2   17 o   2512.1    8.2    0.0000   0.0000          ?        ? 63121.0547 409.9309          ?        ?     2512.1        8.2       ?       ? 
1 1 1    6    2   18 o    636.9    2.4    0.0000   0.0000          ?        ?  4055.8894  30.6490          ?        ?      636.9        2.4       ?       ? 
1 1 1    6    2   19 o   1404.7    4.7    0.0000   0.0000          ?        ? 19733.5117 132.8125          ?        ?     1404.7        4.7       ?       ? 
1 1 1    6    2   20 o   1011.2    3.6    0.0000   0.0000          ?        ? 10226.5625  72.7915          ?        ?     1011.2        3.6       ?       ? 
1 1 1    6    2   21 o    670.2    2.6    0.0000   0.0000          ?        ?  4491.9995  34.4802          ?        ?      670.2        2.6       ?       ? 
1 1 1    6    2   22 o   1157.0    3.9    0.0000   0.0000          ?        ? 13387.8828  89.3930          ?        ?     1157.0        3.9       ?       ? 
1 1 1    6    2   23 o    847.9    2.9    0.0000   0.0000          ?        ?  7190.3921  49.8047          ?        ?      847.9        2.9       ?       ? 
1 1 1    6    2   24 o   1174.1    3.9    0.0000   0.0000          ?        ? 13786.9590  91.9471          ?        ?     1174.1        3.9       ?       ? 
1 1 1    6    2   25 o    667.7    2.5    0.0000   0.0000          ?        ?  4458.7964  33.8416          ?        ?      667.7        2.5       ?       ? 
1 1 1    6    2   26 o   1120.2    3.8    0.0000   0.0000          ?        ? 12549.5039  84.2849          ?        ?     1120.2        3.8       ?       ? 
1 1 1    6    2   27 o    875.2    3.1    0.0000   0.0000          ?        ?  7660.3438  53.6358          ?        ?      875.2        3.1       ?       ? 
1 1 1    6    2   28 o   1411.1    4.7    0.0000   0.0000          ?        ? 19912.9355 132.1740          ?        ?     1411.1        4.7       ?       ? 
1 1 1    6    2   29 o    723.2    2.7    0.0000   0.0000          ?        ?  5230.1304  38.9498          ?        ?      723.2        2.7       ?       ? 
1 1 1    6    2   30 o   1281.2    4.3    0.0000   0.0000          ?        ? 16416.3906 109.1872          ?        ?     1281.2        4.3       ?       ? 
1 1 1    6    2   31 o    531.2    2.5    0.0000   0.0000          ?        ?  2821.6270  26.1794          ?        ?      531.2        2.5       ?       ? 
1 1 1    6    2   32 o    931.3    3.6    0.0000   0.0000          ?        ?  8673.6777  67.0448          ?        ?      931.3        3.6       ?       ? 
1 1 1    6    2   33 o   2193.3    7.2    0.0000   0.0000          ?        ? 48111.3281 315.4297          ?        ?     2193.3        7.2       ?       ? 
1 1 1    6    2   34 o    572.7    2.8    0.0000   0.0000          ?        ?  3280.0857  32.5646          ?        ?      572.7        2.8       ?       ? 
1 1 1    6    2   35 o    757.6    3.0    0.0000   0.0000          ?        ?  5739.6709  45.9736          ?        ?      757.6        3.0       ?       ? 
1 1 1    6    2   36 o   2770.3   10.1    0.0000   0.0000          ?        ? 76772.0156 561.2605          ?        ?     2770.3       10.1       ?       ? 
1 1 1    6    2   37 o    697.6    2.7    0.0000   0.0000          ?        ?  4866.1733  37.6728          ?        ?      697.6        2.7       ?       ? 
1 1 1    6    2   38 o   1322.3    4.5    0.0000   0.0000          ?        ? 17485.9141 118.1265          ?        ?     1322.3        4.5       ?       ? 
1 1 1    6    2   39 o    739.0    2.8    0.0000   0.0000          ?        ?  5460.6372  41.5039          ?        ?      739.0        2.8       ?       ? 
1 1 1    6    2   40 o   1029.8    3.6    0.0000   0.0000          ?        ? 10605.8438  74.0685          ?        ?     1029.8        3.6       ?       ? 
1 1 1    6    2   41 f   1431.7    4.9    0.0000   0.0000          ?        ? 20499.7363 139.1977          ?        ?     1431.7        4.9       ?       ? 
1 1 1    6    2   42 o   1295.4    4.4    0.0000   0.0000          ?        ? 16781.6250 113.6568          ?        ?     1295.4        4.4       ?       ? 
1 1 1    6    2   43 o   1934.5    6.3    0.0000   0.0000          ?        ? 37428.8594 243.9153          ?        ?     1934.5        6.3       ?       ? 
1 1 1    6    2   44 o    619.5    2.8    0.0000   0.0000          ?        ?  3838.1533  34.4802          ?        ?      619.5        2.8       ?       ? 
1 1 1    6    2   45 o    516.8    3.1    0.0000   0.0000          ?        ?  2670.9358  31.9261          ?        ?      516.8        3.1       ?       ? 
1 1 1    6    2   46 o   1352.6    4.6    0.0000   0.0000          ?        ? 18298.7539 123.2347          ?        ?     1352.6        4.6       ?       ? 
1 1 1    6    2   47 o    501.1    3.2    0.0000   0.0000          ?        ?  2511.3054  31.9261          ?        ?      501.1        3.2       ?       ? 
1 1 1    6    2   48 o    721.4    2.9    0.0000   0.0000          ?        ?  5203.9512  42.1424          ?        ?      721.4        2.9       ?       ? 
1 1 1    6    2   49 o    413.4    2.9    0.0000   0.0000          ?        ?  1709.3225  23.6253          ?        ?      413.4        2.9       ?       ? 
1 1 1    6    2   50 o    135.3    7.1    0.0000   0.0000          ?        ?   183.2557  19.1556          ?        ?      135.3        7.1       ?       ? 
1 1 1    6    2   51 o    111.5    9.2    0.0000   0.0000          ?        ?   124.5117  20.4327          ?        ?      111.5        9.2       ?       ? 
1 1 1    6    2   52 f    803.0    3.1    0.0000   0.0000          ?        ?  6449.0684  49.8047          ?        ?      803.0        3.1       ?       ? 
1 1 1    6    2   53 o    215.3    5.2    0.0000   0.0000          ?        ?   463.5667  22.3483          ?        ?      215.3        5.2       ?       ? 
1 1 1    6    2   54 o    445.9    3.0    0.0000   0.0000          ?        ?  1988.3563  26.8179          ?        ?      445.9        3.0       ?       ? 
1 1 1    6    2   55 o    166.8    5.9    0.0000   0.0000          ?        ?   278.3954  19.7942          ?        ?      166.8        5.9       ?       ? 
1 1 1    6    2   56 o    462.9    2.8    0.0000   0.0000          ?        ?  2142.8787  25.5409          ?        ?      462.9        2.8       ?       ? 
1 1 1    6    2   57 o     21.8   10.9    0.0000   0.0000          ?        ?   -50.4432  19.1556          ?        ?       21.8       10.9       ?       ? 
1 1 1    6    2   58 o    349.8    3.3    0.0000   0.0000          ?        ?  1224.0459  22.9868          ?        ?      349.8        3.3       ?       ? 
1 1 1    6    2   59 o    376.5    2.9    0.0000   0.0000          ?        ?  1418.1566  21.7097          ?        ?      376.5        2.9       ?       ? 
1 1 1    6    2   60 o    328.4    3.3    0.0000   0.0000          ?        ?  1079.1016  21.7097          ?        ?      328.4        3.3       ?       ? 
1 1 1    6    2   61 o    196.3    5.0    0.0000   0.0000          ?        ?   385.6671  19.7942          ?        ?      196.3        5.0       ?       ? 
1 1 1    6    2   62 o    315.3    3.3    0.0000   0.0000          ?        ?   994.8167  21.0712          ?        ?      315.3        3.3       ?       ? 
1 1 1    6    2   63 o    179.8    5.1    0.0000   0.0000          ?        ?   323.7305  18.5171          ?        ?      179.8        5.1       ?       ? 
1 1 1    6    2   64 o    115.1    8.0    0.0000   0.0000          ?        ?   132.8125  18.5171          ?        ?      115.1        8.0       ?       ? 
1 1 1    6    2   65 o    204.2    4.8    0.0000   0.0000          ?        ?   417.5931  19.7942          ?        ?      204.2        4.8       ?       ? 
1 1 1    6    2   66 o    280.6    3.8    0.0000   0.0000          ?        ?   787.9357  21.0712          ?        ?      280.6        3.8       ?       ? 
1 1 1    6    2   67 o    199.6    5.1    0.0000   0.0000          ?        ?   399.0760  20.4327          ?        ?      199.6        5.1       ?       ? 
1 1 1    6    2   68 o    175.4    6.0    0.0000   0.0000          ?        ?   308.4059  21.0712          ?        ?      175.4        6.0       ?       ? 
1 1 1    6    2   69 o    240.5    4.2    0.0000   0.0000          ?        ?   579.1391  20.4327          ?        ?      240.5        4.2       ?       ? 
1 1 1    6    2   70 o     64.1   16.4    0.0000   0.0000          ?        ?    43.4195  21.0712          ?        ?       64.1       16.4       ?       ? 
1 1 1    6    2   71 o    240.9    4.8    0.0000   0.0000          ?        ?   581.0547  22.9868          ?        ?      240.9        4.8       ?       ? 
1 1 1    6    2   72 o    475.9    2.8    0.0000   0.0000          ?        ?  2266.1133  26.8179          ?        ?      475.9        2.8       ?       ? 
1 1 1    6    2   73 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    6    2   74 o    342.4    3.4    0.0000   0.0000          ?        ?  1173.6028  23.6253          ?        ?      342.4        3.4       ?       ? 
1 1 1    6    2   75 o     28.3   13.5    0.0000   0.0000          ?        ?   -26.8179  21.0712          ?        ?       28.3       13.5       ?       ? 
1 1 1    6    2   76 o    137.0    8.2    0.0000   0.0000          ?        ?   189.0024  22.3483          ?        ?      137.0        8.2       ?       ? 
1 1 1    6    2   77 o     34.5   15.4    0.0000   0.0000          ?        ?    -8.3008  21.7097          ?        ?       34.5       15.4       ?       ? 
1 1 1    6    2   78 o    358.0    3.3    0.0000   0.0000          ?        ?  1283.4285  23.6253          ?        ?      358.0        3.3       ?       ? 
1 1 1    6    2   79 o     52.5   17.0    0.0000   0.0000          ?        ?    28.0950  20.4327          ?        ?       52.5       17.0       ?       ? 
1 1 1    6    2   80 o     62.9   16.9    0.0000   0.0000          ?        ?    42.7809  21.7097          ?        ?       62.9       16.9       ?       ? 
1 1 1    6    2   81 o    144.2    8.4    0.0000   0.0000          ?        ?   210.7121  24.2638          ?        ?      144.2        8.4       ?       ? 
1 1 1    6    2   82 o    133.6    7.9    0.0000   0.0000          ?        ?   180.7016  21.0712          ?        ?      133.6        7.9       ?       ? 
1 1 1    6    3    0 o    775.8    4.4 6019.3433  68.3218  6019.3433  68.3218  6019.3433  68.3218      775.8      4.4      775.8        4.4     0.0     0.0 
1 1 1    6    3    1 o    597.8    2.4    0.0000   0.0000          ?        ?  3573.1667  28.7335          ?        ?      597.8        2.4       ?       ? 
1 1 1    6    3    2 o   1082.4    4.0    0.0000   0.0000          ?        ? 11715.5947  87.4775          ?        ?     1082.4        4.0       ?       ? 
1 1 1    6    3    3 o   1822.9    6.9    0.0000   0.0000          ?        ? 33234.4102 252.2160          ?        ?     1822.9        6.9       ?       ? 
1 1 1    6    3    4 o    551.1    2.0    0.0000   0.0000          ?        ?  3037.4475  21.7097          ?        ?      551.1        2.0       ?       ? 
1 1 1    6    3    5 f   1874.1    6.1    0.0000   0.0000          ?        ? 35125.0742 230.5063          ?        ?     1874.1        6.1       ?       ? 
1 1 1    6    3    6 f   1738.4    5.6    0.0000   0.0000          ?        ? 30224.4219 194.7491          ?        ?     1738.4        5.6       ?       ? 
1 1 1    6    3    7 o   1015.3    3.4    0.0000   0.0000          ?        ? 10308.9316  68.9603          ?        ?     1015.3        3.4       ?       ? 
1 1 1    6    3    8 o   1573.4    5.3    0.0000   0.0000          ?        ? 24758.6758 167.9312          ?        ?     1573.4        5.3       ?       ? 
1 1 1    6    3    9 o   2093.7    6.7    0.0000   0.0000          ?        ? 43842.1719 280.3110          ?        ?     2093.7        6.7       ?       ? 
1 1 1    6    3   10 o   2061.2    6.6    0.0000   0.0000          ?        ? 42488.5078 272.6487          ?        ?     2061.2        6.6       ?       ? 
1 1 1    6    3   11 o   1369.1    4.5    0.0000   0.0000          ?        ? 18745.0781 123.2347          ?        ?     1369.1        4.5       ?       ? 
1 1 1    6    3   12 f   2457.0    7.8    0.0000   0.0000          ?        ? 60377.3281 385.0285          ?        ?     2457.0        7.8       ?       ? 
1 1 1    6    3   13 o   2151.6    6.9    0.0000   0.0000          ?        ? 46301.1172 296.2740          ?        ?     2151.6        6.9       ?       ? 
1 1 1    6    3   14 o    863.8    3.0    0.0000   0.0000          ?        ?  7461.7637  51.7203          ?        ?      863.8        3.0       ?       ? 
1 1 1    6    3   15 o    476.1    1.9    0.0000   0.0000          ?        ?  2266.7517  17.8786          ?        ?      476.1        1.9       ?       ? 
1 1 1    6    3   16 f   1522.4    5.0    0.0000   0.0000          ?        ? 23177.6953 151.3296          ?        ?     1522.4        5.0       ?       ? 
1 1 1    6    3   17 o    971.8    3.4    0.0000   0.0000          ?        ?  9444.3730  65.1292          ?        ?      971.8        3.4       ?       ? 
1 1 1    6    3   18 o    462.1    2.1    0.0000   0.0000          ?        ?  2135.8547  19.1556          ?        ?      462.1        2.1       ?       ? 
1 1 1    6    3   19 o    526.7    2.2    0.0000   0.0000          ?        ?  2774.3765  22.9868          ?        ?      526.7        2.2       ?       ? 
1 1 1    6    3   20 o    877.9    3.1    0.0000   0.0000          ?        ?  7706.9561  54.2743          ?        ?      877.9        3.1       ?       ? 
1 1 1    6    3   21 o    624.0    2.3    0.0000   0.0000          ?        ?  3893.7048  28.7335          ?        ?      624.0        2.3       ?       ? 
1 1 1    6    3   22 o    486.6    2.1    0.0000   0.0000          ?        ?  2367.6382  20.4327          ?        ?      486.6        2.1       ?       ? 
1 1 1    6    3   23 o    896.0    3.3    0.0000   0.0000          ?        ?  8029.4097  58.7440          ?        ?      896.0        3.3       ?       ? 
1 1 1    6    3   24 o    494.4    2.1    0.0000   0.0000          ?        ?  2444.2607  20.4327          ?        ?      494.4        2.1       ?       ? 
1 1 1    6    3   25 o    463.1    2.1    0.0000   0.0000          ?        ?  2144.7942  19.1556          ?        ?      463.1        2.1       ?       ? 
1 1 1    6    3   26 o    522.6    2.1    0.0000   0.0000          ?        ?  2731.5955  21.7097          ?        ?      522.6        2.1       ?       ? 
1 1 1    6    3   27 o    506.5    2.1    0.0000   0.0000          ?        ?  2565.5798  21.7097          ?        ?      506.5        2.1       ?       ? 
1 1 1    6    3   28 o    783.9    2.9    0.0000   0.0000          ?        ?  6144.4937  45.9736          ?        ?      783.9        2.9       ?       ? 
1 1 1    6    3   29 o    158.6    3.0    0.0000   0.0000          ?        ?   251.5775   9.5778          ?        ?      158.6        3.0       ?       ? 
1 1 1    6    3   30 o    251.0    2.3    0.0000   0.0000          ?        ?   630.2208  11.4934          ?        ?      251.0        2.3       ?       ? 
1 1 1    6    3   31 o    353.6    2.5    0.0000   0.0000          ?        ?  1250.2253  17.8786          ?        ?      353.6        2.5       ?       ? 
1 1 1    6    3   32 o   1580.2    5.5    0.0000   0.0000          ?        ? 24971.9414 174.9549          ?        ?     1580.2        5.5       ?       ? 
1 1 1    6    3   33 o   1449.0    5.1    0.0000   0.0000          ?        ? 20996.5078 148.1370          ?        ?     1449.0        5.1       ?       ? 
1 1 1    6    3   34 f    733.1    3.0    0.0000   0.0000          ?        ?  5375.0752  43.4195          ?        ?      733.1        3.0       ?       ? 
1 1 1    6    3   35 o   1426.8    5.0    0.0000   0.0000          ?        ? 20359.2617 141.7518          ?        ?     1426.8        5.0       ?       ? 
1 1 1    6    3   36 o    442.7    2.4    0.0000   0.0000          ?        ?  1959.6228  21.0712          ?        ?      442.7        2.4       ?       ? 
1 1 1    6    3   37 o    243.5    3.3    0.0000   0.0000          ?        ?   593.1866  15.9630          ?        ?      243.5        3.3       ?       ? 
1 1 1    6    3   38 o    724.1    2.8    0.0000   0.0000          ?        ?  5242.9009  40.2269          ?        ?      724.1        2.8       ?       ? 
1 1 1    6    3   39 o    250.4    3.7    0.0000   0.0000          ?        ?   627.0282  18.5171          ?        ?      250.4        3.7       ?       ? 
1 1 1    6    3   40 o   1168.3    4.0    0.0000   0.0000          ?        ? 13649.0391  93.2242          ?        ?     1168.3        4.0       ?       ? 
1 1 1    6    3   41 o    129.6    7.6    0.0000   0.0000          ?        ?   167.9312  19.7942          ?        ?      129.6        7.6       ?       ? 
1 1 1    6    3   42 o   1072.8    3.7    0.0000   0.0000          ?        ? 11510.6289  79.8152          ?        ?     1072.8        3.7       ?       ? 
1 1 1    6    3   43 o    871.6    3.2    0.0000   0.0000          ?        ?  7596.4917  55.5514          ?        ?      871.6        3.2       ?       ? 
1 1 1    6    3   44 o    167.4    5.9    0.0000   0.0000          ?        ?   280.3110  19.7942          ?        ?      167.4        5.9       ?       ? 
1 1 1    6    3   45 o   1102.0    3.8    0.0000   0.0000          ?        ? 12144.6816  84.2849          ?        ?     1102.0        3.8       ?       ? 
1 1 1    6    3   46 o    432.1    3.0    0.0000   0.0000          ?        ?  1867.0372  25.5409          ?        ?      432.1        3.0       ?       ? 
1 1 1    6    3   47 o    442.7    2.8    0.0000   0.0000          ?        ?  1959.6228  24.9023          ?        ?      442.7        2.8       ?       ? 
1 1 1    6    3   48 o    825.8    3.2    0.0000   0.0000          ?        ?  6820.0493  52.3588          ?        ?      825.8        3.2       ?       ? 
1 1 1    6    3   49 o    352.8    3.3    0.0000   0.0000          ?        ?  1244.4786  23.6253          ?        ?      352.8        3.3       ?       ? 
1 1 1    6    3   50 o   1318.2    4.5    0.0000   0.0000          ?        ? 17380.5586 117.4880          ?        ?     1318.2        4.5       ?       ? 
1 1 1    6    3   51 o    393.2    2.9    0.0000   0.0000          ?        ?  1546.4994  22.9868          ?        ?      393.2        2.9       ?       ? 
1 1 1    6    3   52 o    214.2    4.8    0.0000   0.0000          ?        ?   459.0970  20.4327          ?        ?      214.2        4.8       ?       ? 
1 1 1    6    3   53 o     20.0   10.1    0.0000   0.0000          ?        ?   -63.8522  19.1556          ?        ?       20.0       10.1       ?       ? 
1 1 1    6    3   54 o    301.3    3.5    0.0000   0.0000          ?        ?   907.9777  21.0712          ?        ?      301.3        3.5       ?       ? 
1 1 1    6    3   55 o    529.0    2.7    0.0000   0.0000          ?        ?  2799.2788  28.7335          ?        ?      529.0        2.7       ?       ? 
1 1 1    6    3   56 o    336.6    3.2    0.0000   0.0000          ?        ?  1133.3759  21.7097          ?        ?      336.6        3.2       ?       ? 
1 1 1    6    3   57 o    285.7    3.8    0.0000   0.0000          ?        ?   816.6692  21.7097          ?        ?      285.7        3.8       ?       ? 
1 1 1    6    3   58 o    383.3    3.0    0.0000   0.0000          ?        ?  1469.2383  22.9868          ?        ?      383.3        3.0       ?       ? 
1 1 1    6    3   59 o    588.8    3.0    0.0000   0.0000          ?        ?  3467.8108  35.7572          ?        ?      588.8        3.0       ?       ? 
1 1 1    6    3   60 o    213.9    4.8    0.0000   0.0000          ?        ?   457.8200  20.4327          ?        ?      213.9        4.8       ?       ? 
1 1 1    6    3   61 o    176.3    5.6    0.0000   0.0000          ?        ?   310.9600  19.7942          ?        ?      176.3        5.6       ?       ? 
1 1 1    6    3   62 o    358.4    3.1    0.0000   0.0000          ?        ?  1284.7054  22.3483          ?        ?      358.4        3.1       ?       ? 
1 1 1    6    3   63 o    196.0    5.1    0.0000   0.0000          ?        ?   384.3900  19.7942          ?        ?      196.0        5.1       ?       ? 
1 1 1    6    3   64 o    160.3    6.2    0.0000   0.0000          ?        ?   257.3242  19.7942          ?        ?      160.3        6.2       ?       ? 
1 1 1    6    3   65 o     84.3   11.7    0.0000   0.0000          ?        ?    71.5144  19.7942          ?        ?       84.3       11.7       ?       ? 
1 1 1    6    3   66 o    114.7    8.9    0.0000   0.0000          ?        ?   132.1740  20.4327          ?        ?      114.7        8.9       ?       ? 
1 1 1    6    3   67 o    215.2    4.9    0.0000   0.0000          ?        ?   463.5667  21.0712          ?        ?      215.2        4.9       ?       ? 
1 1 1    6    3   68 o    273.2    4.1    0.0000   0.0000          ?        ?   747.0703  22.3483          ?        ?      273.2        4.1       ?       ? 
1 1 1    6    3   69 o    121.7    8.4    0.0000   0.0000          ?        ?   148.7755  20.4327          ?        ?      121.7        8.4       ?       ? 
1 1 1    6    3   70 o    371.7    3.1    0.0000   0.0000          ?        ?  1382.3993  22.9868          ?        ?      371.7        3.1       ?       ? 
1 1 1    6    3   71 f    244.4    4.4    0.0000   0.0000          ?        ?   598.2947  21.7097          ?        ?      244.4        4.4       ?       ? 
1 1 1    6    3   72 o    173.5    6.4    0.0000   0.0000          ?        ?   302.0207  22.3483          ?        ?      173.5        6.4       ?       ? 
1 1 1    6    3   73 o    246.6    4.7    0.0000   0.0000          ?        ?   609.1497  22.9868          ?        ?      246.6        4.7       ?       ? 
1 1 1    6    3   74 o    224.2    5.0    0.0000   0.0000          ?        ?   503.7936  22.3483          ?        ?      224.2        5.0       ?       ? 
1 1 1    6    3   75 o    138.2    8.1    0.0000   0.0000          ?        ?   192.1950  22.3483          ?        ?      138.2        8.1       ?       ? 
1 1 1    6    3   76 o    192.6    5.6    0.0000   0.0000          ?        ?   372.2581  21.7097          ?        ?      192.6        5.6       ?       ? 
1 1 1    6    3   77 o     62.4   17.3    0.0000   0.0000          ?        ?    41.5039  22.3483          ?        ?       62.4       17.3       ?       ? 
1 1 1    6    3   78 o     99.7   10.6    0.0000   0.0000          ?        ?   100.8864  21.0712          ?        ?       99.7       10.6       ?       ? 
1 1 1    6    3   79 o    138.0    8.3    0.0000   0.0000          ?        ?   192.1950  22.9868          ?        ?      138.0        8.3       ?       ? 
1 1 1    6    3   80 o    210.5    5.2    0.0000   0.0000          ?        ?   445.0496  21.7097          ?        ?      210.5        5.2       ?       ? 
1 1 1    6    3   81 o    134.6    7.8    0.0000   0.0000          ?        ?   183.2557  21.0712          ?        ?      134.6        7.8       ?       ? 
1 1 1    6    3   82 o    157.9    6.7    0.0000   0.0000          ?        ?   251.5775  21.0712          ?        ?      157.9        6.7       ?       ? 
1 1 1    6    4    0 o    526.2    3.2 2769.2683  33.8416  2769.2683  33.8416  2769.2683  33.8416      526.2      3.2      526.2        3.2     0.0     0.0 
1 1 1    6    4    1 o    488.2    2.0    0.0000   0.0000          ?        ?  2382.9629  19.7942          ?        ?      488.2        2.0       ?       ? 
1 1 1    6    4    2 o    545.6    2.2    0.0000   0.0000          ?        ?  2976.7878  23.6253          ?        ?      545.6        2.2       ?       ? 
1 1 1    6    4    3 o   1597.9    6.3    0.0000   0.0000          ?        ? 25536.3965 202.4114          ?        ?     1597.9        6.3       ?       ? 
1 1 1    6    4    4 o   1171.7    3.9    0.0000   0.0000          ?        ? 13729.4922  91.9471          ?        ?     1171.7        3.9       ?       ? 
1 1 1    6    4    5 o   1402.1    4.6    0.0000   0.0000          ?        ? 19660.0801 130.2584          ?        ?     1402.1        4.6       ?       ? 
1 1 1    6    4    6 f    648.5    2.3    0.0000   0.0000          ?        ?  4205.9419  30.0105          ?        ?      648.5        2.3       ?       ? 
1 1 1    6    4    7 o    736.7    2.6    0.0000   0.0000          ?        ?  5428.0723  38.3113          ?        ?      736.7        2.6       ?       ? 
1 1 1    6    4    8 o   1010.9    3.4    0.0000   0.0000          ?        ? 10218.9004  68.9603          ?        ?     1010.9        3.4       ?       ? 
1 1 1    6    4    9 o   1506.8    4.9    0.0000   0.0000          ?        ? 22706.4688 148.7755          ?        ?     1506.8        4.9       ?       ? 
1 1 1    6    4   10 o    881.1    3.0    0.0000   0.0000          ?        ?  7764.4229  52.9973          ?        ?      881.1        3.0       ?       ? 
1 1 1    6    4   11 o    350.2    1.5    0.0000   0.0000          ?        ?  1226.6001  10.8549          ?        ?      350.2        1.5       ?       ? 
1 1 1    6    4   12 o   1917.4    6.2    0.0000   0.0000          ?        ? 36766.7148 237.5300          ?        ?     1917.4        6.2       ?       ? 
1 1 1    6    4   13 o   1473.3    4.8    0.0000   0.0000          ?        ? 21707.1816 141.1133          ?        ?     1473.3        4.8       ?       ? 
1 1 1    6    4   14 o   1884.1    6.1    0.0000   0.0000          ?        ? 35500.5234 229.8678          ?        ?     1884.1        6.1       ?       ? 
1 1 1    6    4   15 f   1038.1    3.5    0.0000   0.0000          ?        ? 10776.3291  72.7915          ?        ?     1038.1        3.5       ?       ? 
1 1 1    6    4   16 o    589.5    2.2    0.0000   0.0000          ?        ?  3475.4731  25.5409          ?        ?      589.5        2.2       ?       ? 
1 1 1    6    4   17 o    365.5    1.7    0.0000   0.0000          ?        ?  1335.7872  12.1319          ?        ?      365.5        1.7       ?       ? 
1 1 1    6    4   18 o    228.3    1.7    0.0000   0.0000          ?        ?   521.0336   7.6623          ?        ?      228.3        1.7       ?       ? 
1 1 1    6    4   19 o   1562.4    5.1    0.0000   0.0000          ?        ? 24411.9590 158.3534          ?        ?     1562.4        5.1       ?       ? 
1 1 1    6    4   20 o    787.4    2.8    0.0000   0.0000          ?        ?  6200.6836  43.4195          ?        ?      787.4        2.8       ?       ? 
1 1 1    6    4   21 o   1817.9    5.9    0.0000   0.0000          ?        ? 33053.7109 213.9047          ?        ?     1817.9        5.9       ?       ? 
1 1 1    6    4   22 o    501.8    2.2    0.0000   0.0000          ?        ?  2518.3293  22.3483          ?        ?      501.8        2.2       ?       ? 
1 1 1    6    4   23 o    644.3    2.4    0.0000   0.0000          ?        ?  4151.6675  30.6490          ?        ?      644.3        2.4       ?       ? 
1 1 1    6    4   24 o    241.4    1.7    0.0000   0.0000          ?        ?   582.9703   8.3008          ?        ?      241.4        1.7       ?       ? 
1 1 1    6    4   25 o    827.9    3.1    0.0000   0.0000          ?        ?  6853.8911  51.0817          ?        ?      827.9        3.1       ?       ? 
1 1 1    6    4   26 o    936.8    3.2    0.0000   0.0000          ?        ?  8775.8418  60.6596          ?        ?      936.8        3.2       ?       ? 
1 1 1    6    4   27 o    806.7    3.0    0.0000   0.0000          ?        ?  6508.4507  47.8891          ?        ?      806.7        3.0       ?       ? 
1 1 1    6    4   28 o    247.6    2.2    0.0000   0.0000          ?        ?   612.9808  10.8549          ?        ?      247.6        2.2       ?       ? 
1 1 1    6    4   29 o    415.1    2.0    0.0000   0.0000          ?        ?  1722.7313  16.6016          ?        ?      415.1        2.0       ?       ? 
1 1 1    6    4   30 o   1303.3    4.4    0.0000   0.0000          ?        ? 16987.2285 115.5724          ?        ?     1303.3        4.4       ?       ? 
1 1 1    6    4   31 o   1019.5    4.0    0.0000   0.0000          ?        ? 10394.4941  81.0922          ?        ?     1019.5        4.0       ?       ? 
1 1 1    6    4   32 o    510.9    2.7    0.0000   0.0000          ?        ?  2610.2764  27.4564          ?        ?      510.9        2.7       ?       ? 
1 1 1    6    4   33 o    957.4    3.9    0.0000   0.0000          ?        ?  9165.9775  75.3456          ?        ?      957.4        3.9       ?       ? 
1 1 1    6    4   34 o    631.3    2.8    0.0000   0.0000          ?        ?  3985.0134  35.7572          ?        ?      631.3        2.8       ?       ? 
1 1 1    6    4   35 o   1251.6    4.4    0.0000   0.0000          ?        ? 15665.4893 109.8257          ?        ?     1251.6        4.4       ?       ? 
1 1 1    6    4   36 o    695.7    2.7    0.0000   0.0000          ?        ?  4839.9941  37.0343          ?        ?      695.7        2.7       ?       ? 
1 1 1    6    4   37 o   1662.6    5.6    0.0000   0.0000          ?        ? 27646.0723 185.8098          ?        ?     1662.6        5.6       ?       ? 
1 1 1    6    4   38 o    519.5    2.8    0.0000   0.0000          ?        ?  2698.3923  29.3720          ?        ?      519.5        2.8       ?       ? 
1 1 1    6    4   39 o    983.7    3.5    0.0000   0.0000          ?        ?  9677.4336  68.3218          ?        ?      983.7        3.5       ?       ? 
1 1 1    6    4   40 o    928.6    3.5    0.0000   0.0000          ?        ?  8623.8730  65.1292          ?        ?      928.6        3.5       ?       ? 
1 1 1    6    4   41 o    518.7    2.6    0.0000   0.0000          ?        ?  2690.0916  27.4564          ?        ?      518.7        2.6       ?       ? 
1 1 1    6    4   42 o    354.8    2.8    0.0000   0.0000          ?        ?  1258.5261  19.7942          ?        ?      354.8        2.8       ?       ? 
1 1 1    6    4   43 o    315.2    2.9    0.0000   0.0000          ?        ?   993.5397  18.5171          ?        ?      315.2        2.9       ?       ? 
1 1 1    6    4   44 o    674.2    2.8    0.0000   0.0000          ?        ?  4544.9971  37.6728          ?        ?      674.2        2.8       ?       ? 
1 1 1    6    4   45 o    715.2    2.9    0.0000   0.0000          ?        ?  5115.1968  40.8654          ?        ?      715.2        2.9       ?       ? 
1 1 1    6    4   46 o    613.8    2.8    0.0000   0.0000          ?        ?  3767.2776  33.8416          ?        ?      613.8        2.8       ?       ? 
1 1 1    6    4   47 o    877.5    3.3    0.0000   0.0000          ?        ?  7699.9326  58.1055          ?        ?      877.5        3.3       ?       ? 
1 1 1    6    4   48 f    615.9    2.7    0.0000   0.0000          ?        ?  3794.0957  33.2031          ?        ?      615.9        2.7       ?       ? 
1 1 1    6    4   49 o    405.9    2.8    0.0000   0.0000          ?        ?  1648.0244  22.9868          ?        ?      405.9        2.8       ?       ? 
1 1 1    6    4   50 f    752.8    3.1    0.0000   0.0000          ?        ?  5668.1567  45.9736          ?        ?      752.8        3.1       ?       ? 
1 1 1    6    4   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    6    4   52 o    420.2    2.9    0.0000   0.0000          ?        ?  1766.1509  24.2638          ?        ?      420.2        2.9       ?       ? 
1 1 1    6    4   53 o    317.2    3.3    0.0000   0.0000          ?        ?  1006.3101  21.0712          ?        ?      317.2        3.3       ?       ? 
1 1 1    6    4   54 o    311.8    3.4    0.0000   0.0000          ?        ?   972.4684  21.0712          ?        ?      311.8        3.4       ?       ? 
1 1 1    6    4   55 o    694.0    3.1    0.0000   0.0000          ?        ?  4817.0073  43.4195          ?        ?      694.0        3.1       ?       ? 
1 1 1    6    4   56 o    104.1    8.9    0.0000   0.0000          ?        ?   108.5487  18.5171          ?        ?      104.1        8.9       ?       ? 
1 1 1    6    4   57 o   1037.0    3.6    0.0000   0.0000          ?        ? 10756.5352  75.3456          ?        ?     1037.0        3.6       ?       ? 
1 1 1    6    4   58 o    125.2    7.6    0.0000   0.0000          ?        ?   157.0763  19.1556          ?        ?      125.2        7.6       ?       ? 
1 1 1    6    4   59 o    253.4    3.9    0.0000   0.0000          ?        ?   642.3527  19.7942          ?        ?      253.4        3.9       ?       ? 
1 1 1    6    4   60 o    418.7    3.0    0.0000   0.0000          ?        ?  1753.3804  24.9023          ?        ?      418.7        3.0       ?       ? 
1 1 1    6    4   61 o    305.4    3.6    0.0000   0.0000          ?        ?   932.8801  21.7097          ?        ?      305.4        3.6       ?       ? 
1 1 1    6    4   62 o    427.8    2.9    0.0000   0.0000          ?        ?  1830.6416  24.9023          ?        ?      427.8        2.9       ?       ? 
1 1 1    6    4   63 o    310.3    3.5    0.0000   0.0000          ?        ?   963.5291  21.7097          ?        ?      310.3        3.5       ?       ? 
1 1 1    6    4   64 o    146.1    6.6    0.0000   0.0000          ?        ?   213.9047  19.1556          ?        ?      146.1        6.6       ?       ? 
1 1 1    6    4   65 o    463.8    2.8    0.0000   0.0000          ?        ?  2151.8179  26.1794          ?        ?      463.8        2.8       ?       ? 
1 1 1    6    4   66 o    512.5    2.7    0.0000   0.0000          ?        ?  2627.5166  28.0950          ?        ?      512.5        2.7       ?       ? 
1 1 1    6    4   67 o    372.2    3.1    0.0000   0.0000          ?        ?  1386.2305  22.9868          ?        ?      372.2        3.1       ?       ? 
1 1 1    6    4   68 o     38.3   16.1    0.0000   0.0000          ?        ?     1.9156  21.0712          ?        ?       38.3       16.1       ?       ? 
1 1 1    6    4   69 o    439.2    3.0    0.0000   0.0000          ?        ?  1930.2509  26.1794          ?        ?      439.2        3.0       ?       ? 
1 1 1    6    4   70 o     68.7   15.7    0.0000   0.0000          ?        ?    49.8047  21.0712          ?        ?       68.7       15.7       ?       ? 
1 1 1    6    4   71 o    349.0    3.3    0.0000   0.0000          ?        ?  1218.9377  22.9868          ?        ?      349.0        3.3       ?       ? 
1 1 1    6    4   72 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    6    4   73 o    193.4    5.6    0.0000   0.0000          ?        ?   374.8122  21.7097          ?        ?      193.4        5.6       ?       ? 
1 1 1    6    4   74 f    200.1    5.7    0.0000   0.0000          ?        ?   401.6301  22.9868          ?        ?      200.1        5.7       ?       ? 
1 1 1    6    4   75 o     28.5   13.6    0.0000   0.0000          ?        ?   -28.7335  21.7097          ?        ?       28.5       13.6       ?       ? 
1 1 1    6    4   76 o    140.7    7.7    0.0000   0.0000          ?        ?   199.2188  21.7097          ?        ?      140.7        7.7       ?       ? 
1 1 1    6    4   77 o     35.8   15.5    0.0000   0.0000          ?        ?    -1.9156  20.4327          ?        ?       35.8       15.5       ?       ? 
1 1 1    6    4   78 o    174.4    6.6    0.0000   0.0000          ?        ?   305.8519  22.9868          ?        ?      174.4        6.6       ?       ? 
1 1 1    6    4   79 o    174.6    6.0    0.0000   0.0000          ?        ?   306.4904  21.0712          ?        ?      174.6        6.0       ?       ? 
1 1 1    6    4   80 o    115.3    8.9    0.0000   0.0000          ?        ?   134.7281  20.4327          ?        ?      115.3        8.9       ?       ? 
1 1 1    6    4   81 o     24.5   12.0    0.0000   0.0000          ?        ?   -44.0580  21.0712          ?        ?       24.5       12.0       ?       ? 
1 1 1    6    4   82 o     34.7   15.6    0.0000   0.0000          ?        ?    -9.5778  22.9868          ?        ?       34.7       15.6       ?       ? 
1 1 1    6    5    0 o     73.4    3.9   54.2743   5.7467    54.2743   5.7467    54.2743   5.7467       73.4      3.9       73.4        3.9     0.0     0.0 
1 1 1    6    5    1 o    145.4    1.3    0.0000   0.0000          ?        ?   211.3506   3.8311          ?        ?      145.4        1.3       ?       ? 
1 1 1    6    5    2 o   1415.5    5.7    0.0000   0.0000          ?        ? 20038.0859 162.1845          ?        ?     1415.5        5.7       ?       ? 
1 1 1    6    5    3 o   1238.4    4.7    0.0000   0.0000          ?        ? 15337.2891 117.4880          ?        ?     1238.4        4.7       ?       ? 
1 1 1    6    5    4 o   1671.6    5.6    0.0000   0.0000          ?        ? 27944.2598 187.7254          ?        ?     1671.6        5.6       ?       ? 
1 1 1    6    5    5 o   1368.4    4.5    0.0000   0.0000          ?        ? 18727.1992 121.9576          ?        ?     1368.4        4.5       ?       ? 
1 1 1    6    5    6 o   1411.7    4.6    0.0000   0.0000          ?        ? 19930.1758 129.6199          ?        ?     1411.7        4.6       ?       ? 
1 1 1    6    5    7 o    723.7    2.6    0.0000   0.0000          ?        ?  5237.1543  37.0343          ?        ?      723.7        2.6       ?       ? 
1 1 1    6    5    8 o     80.3    2.0    0.0000   0.0000          ?        ?    64.4907   3.1926          ?        ?       80.3        2.0       ?       ? 
1 1 1    6    5    9 o    671.2    2.4    0.0000   0.0000          ?        ?  4505.4082  31.9261          ?        ?      671.2        2.4       ?       ? 
1 1 1    6    5   10 o    715.6    2.5    0.0000   0.0000          ?        ?  5121.5820  36.3957          ?        ?      715.6        2.5       ?       ? 
1 1 1    6    5   11 o    526.7    1.9    0.0000   0.0000          ?        ?  2773.7378  20.4327          ?        ?      526.7        1.9       ?       ? 
1 1 1    6    5   12 o   2091.4    6.7    0.0000   0.0000          ?        ? 43743.2031 280.3110          ?        ?     2091.4        6.7       ?       ? 
1 1 1    6    5   13 o   1284.2    4.3    0.0000   0.0000          ?        ? 16491.7363 109.1872          ?        ?     1284.2        4.3       ?       ? 
1 1 1    6    5   14 o    706.2    2.5    0.0000   0.0000          ?        ?  4986.8540  35.7572          ?        ?      706.2        2.5       ?       ? 
1 1 1    6    5   15 o    858.2    3.1    0.0000   0.0000          ?        ?  7365.9854  52.3588          ?        ?      858.2        3.1       ?       ? 
1 1 1    6    5   16 o    952.5    3.3    0.0000   0.0000          ?        ?  9073.3926  61.9366          ?        ?      952.5        3.3       ?       ? 
1 1 1    6    5   17 o    518.0    2.0    0.0000   0.0000          ?        ?  2683.7063  20.4327          ?        ?      518.0        2.0       ?       ? 
1 1 1    6    5   18 o    714.7    2.5    0.0000   0.0000          ?        ?  5107.5347  36.3957          ?        ?      714.7        2.5       ?       ? 
1 1 1    6    5   19 o    613.9    2.3    0.0000   0.0000          ?        ?  3769.1931  28.7335          ?        ?      613.9        2.3       ?       ? 
1 1 1    6    5   20 o    612.5    2.6    0.0000   0.0000          ?        ?  3751.3145  31.2876          ?        ?      612.5        2.6       ?       ? 
1 1 1    6    5   21 f    821.1    2.9    0.0000   0.0000          ?        ?  6742.7886  47.2506          ?        ?      821.1        2.9       ?       ? 
1 1 1    6    5   22 o    156.6    2.4    0.0000   0.0000          ?        ?   245.1923   7.6623          ?        ?      156.6        2.4       ?       ? 
1 1 1    6    5   23 o   1372.8    4.5    0.0000   0.0000          ?        ? 18847.8809 123.8732          ?        ?     1372.8        4.5       ?       ? 
1 1 1    6    5   24 o    397.0    2.0    0.0000   0.0000          ?        ?  1576.5099  15.9630          ?        ?      397.0        2.0       ?       ? 
1 1 1    6    5   25 o   1675.9    5.6    0.0000   0.0000          ?        ? 28091.1191 187.7254          ?        ?     1675.9        5.6       ?       ? 
1 1 1    6    5   26 o    824.4    2.9    0.0000   0.0000          ?        ?  6797.0625  48.5276          ?        ?      824.4        2.9       ?       ? 
1 1 1    6    5   27 o   1152.5    4.0    0.0000   0.0000          ?        ? 13284.4424  91.9471          ?        ?     1152.5        4.0       ?       ? 
1 1 1    6    5   28 o    965.1    3.4    0.0000   0.0000          ?        ?  9314.1143  65.1292          ?        ?      965.1        3.4       ?       ? 
1 1 1    6    5   29 o   1497.6    5.0    0.0000   0.0000          ?        ? 22429.3496 148.7755          ?        ?     1497.6        5.0       ?       ? 
1 1 1    6    5   30 o    755.5    3.0    0.0000   0.0000          ?        ?  5707.7451  45.9736          ?        ?      755.5        3.0       ?       ? 
1 1 1    6    5   31 o    957.7    3.6    0.0000   0.0000          ?        ?  9173.0020  69.5989          ?        ?      957.7        3.6       ?       ? 
1 1 1    6    5   32 o    316.3    2.5    0.0000   0.0000          ?        ?  1000.5634  15.9630          ?        ?      316.3        2.5       ?       ? 
1 1 1    6    5   33 o    701.5    3.3    0.0000   0.0000          ?        ?  4921.0864  46.6121          ?        ?      701.5        3.3       ?       ? 
1 1 1    6    5   34 o    916.8    3.6    0.0000   0.0000          ?        ?  8406.1377  65.1292          ?        ?      916.8        3.6       ?       ? 
1 1 1    6    5   35 o    839.9    3.3    0.0000   0.0000          ?        ?  7053.7480  55.5514          ?        ?      839.9        3.3       ?       ? 
1 1 1    6    5   36 o    996.4    3.6    0.0000   0.0000          ?        ?  9927.7344  71.5144          ?        ?      996.4        3.6       ?       ? 
1 1 1    6    5   37 o    396.4    2.4    0.0000   0.0000          ?        ?  1571.4017  19.1556          ?        ?      396.4        2.4       ?       ? 
1 1 1    6    5   38 o    876.2    3.2    0.0000   0.0000          ?        ?  7677.5840  56.1899          ?        ?      876.2        3.2       ?       ? 
1 1 1    6    5   39 o   1066.8    3.8    0.0000   0.0000          ?        ? 11380.3711  80.4537          ?        ?     1066.8        3.8       ?       ? 
1 1 1    6    5   40 o    466.3    2.5    0.0000   0.0000          ?        ?  2174.8047  23.6253          ?        ?      466.3        2.5       ?       ? 
1 1 1    6    5   41 o    253.7    3.8    0.0000   0.0000          ?        ?   643.6298  19.1556          ?        ?      253.7        3.8       ?       ? 
1 1 1    6    5   42 o   1662.5    5.7    0.0000   0.0000          ?        ? 27642.2402 189.0024          ?        ?     1662.5        5.7       ?       ? 
1 1 1    6    5   43 o    924.8    3.4    0.0000   0.0000          ?        ?  8552.3584  63.2136          ?        ?      924.8        3.4       ?       ? 
1 1 1    6    5   44 o    401.7    2.9    0.0000   0.0000          ?        ?  1613.5442  22.9868          ?        ?      401.7        2.9       ?       ? 
1 1 1    6    5   45 o    488.6    2.6    0.0000   0.0000          ?        ?  2387.4324  25.5409          ?        ?      488.6        2.6       ?       ? 
1 1 1    6    5   46 o    378.2    3.0    0.0000   0.0000          ?        ?  1430.2885  22.3483          ?        ?      378.2        3.0       ?       ? 
1 1 1    6    5   47 o    728.0    2.9    0.0000   0.0000          ?        ?  5300.3677  42.1424          ?        ?      728.0        2.9       ?       ? 
1 1 1    6    5   48 f    532.8    2.6    0.0000   0.0000          ?        ?  2838.8672  27.4564          ?        ?      532.8        2.6       ?       ? 
1 1 1    6    5   49 o    527.3    2.7    0.0000   0.0000          ?        ?  2780.7617  28.0950          ?        ?      527.3        2.7       ?       ? 
1 1 1    6    5   50 o     82.2   11.3    0.0000   0.0000          ?        ?    67.6833  18.5171          ?        ?       82.2       11.3       ?       ? 
1 1 1    6    5   51 o    312.4    3.2    0.0000   0.0000          ?        ?   976.2995  19.7942          ?        ?      312.4        3.2       ?       ? 
1 1 1    6    5   52 o    754.9    3.0    0.0000   0.0000          ?        ?  5698.8057  44.6965          ?        ?      754.9        3.0       ?       ? 
1 1 1    6    5   53 o    771.7    3.0    0.0000   0.0000          ?        ?  5956.1299  46.6121          ?        ?      771.7        3.0       ?       ? 
1 1 1    6    5   54 o    244.4    4.7    0.0000   0.0000          ?        ?   597.6562  22.9868          ?        ?      244.4        4.7       ?       ? 
1 1 1    6    5   55 o    455.6    2.9    0.0000   0.0000          ?        ?  2075.8337  26.8179          ?        ?      455.6        2.9       ?       ? 
1 1 1    6    5   56 o    467.8    2.7    0.0000   0.0000          ?        ?  2188.8521  24.9023          ?        ?      467.8        2.7       ?       ? 
1 1 1    6    5   57 o    430.2    3.0    0.0000   0.0000          ?        ?  1851.0741  25.5409          ?        ?      430.2        3.0       ?       ? 
1 1 1    6    5   58 o    555.9    2.8    0.0000   0.0000          ?        ?  3091.0833  31.2876          ?        ?      555.9        2.8       ?       ? 
1 1 1    6    5   59 o    519.7    3.2    0.0000   0.0000          ?        ?  2701.5850  33.2031          ?        ?      519.7        3.2       ?       ? 
1 1 1    6    5   60 o    314.3    3.4    0.0000   0.0000          ?        ?   988.4315  21.0712          ?        ?      314.3        3.4       ?       ? 
1 1 1    6    5   61 o    567.7    2.7    0.0000   0.0000          ?        ?  3223.8958  30.6490          ?        ?      567.7        2.7       ?       ? 
1 1 1    6    5   62 o    348.0    3.1    0.0000   0.0000          ?        ?  1211.2755  21.7097          ?        ?      348.0        3.1       ?       ? 
1 1 1    6    5   63 o    357.5    3.1    0.0000   0.0000          ?        ?  1278.3203  22.3483          ?        ?      357.5        3.1       ?       ? 
1 1 1    6    5   64 o    359.6    3.2    0.0000   0.0000          ?        ?  1293.6449  22.9868          ?        ?      359.6        3.2       ?       ? 
1 1 1    6    5   65 o    307.1    3.5    0.0000   0.0000          ?        ?   943.7350  21.7097          ?        ?      307.1        3.5       ?       ? 
1 1 1    6    5   66 o    210.1    4.9    0.0000   0.0000          ?        ?   441.8569  20.4327          ?        ?      210.1        4.9       ?       ? 
1 1 1    6    5   67 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    6    5   68 o    106.0    9.6    0.0000   0.0000          ?        ?   113.0183  20.4327          ?        ?      106.0        9.6       ?       ? 
1 1 1    6    5   69 o    215.5    4.7    0.0000   0.0000          ?        ?   464.8438  20.4327          ?        ?      215.5        4.7       ?       ? 
1 1 1    6    5   70 o    160.4    6.2    0.0000   0.0000          ?        ?   257.9627  19.7942          ?        ?      160.4        6.2       ?       ? 
1 1 1    6    5   71 f    208.0    5.4    0.0000   0.0000          ?        ?   433.5562  22.3483          ?        ?      208.0        5.4       ?       ? 
1 1 1    6    5   72 o     26.4   12.8    0.0000   0.0000          ?        ?   -38.3113  21.7097          ?        ?       26.4       12.8       ?       ? 
1 1 1    6    5   73 o     31.6   14.6    0.0000   0.0000          ?        ?   -17.2401  21.7097          ?        ?       31.6       14.6       ?       ? 
1 1 1    6    5   74 o    196.9    5.7    0.0000   0.0000          ?        ?   388.8597  22.3483          ?        ?      196.9        5.7       ?       ? 
1 1 1    6    5   75 o    237.2    4.6    0.0000   0.0000          ?        ?   563.8146  21.7097          ?        ?      237.2        4.6       ?       ? 
1 1 1    6    5   76 o    154.3    7.2    0.0000   0.0000          ?        ?   239.4456  22.3483          ?        ?      154.3        7.2       ?       ? 
1 1 1    6    5   77 o    190.9    5.7    0.0000   0.0000          ?        ?   365.8729  21.7097          ?        ?      190.9        5.7       ?       ? 
1 1 1    6    5   78 o     88.8   12.2    0.0000   0.0000          ?        ?    80.4537  21.7097          ?        ?       88.8       12.2       ?       ? 
1 1 1    6    5   79 o     83.3   12.3    0.0000   0.0000          ?        ?    70.8759  20.4327          ?        ?       83.3       12.3       ?       ? 
1 1 1    6    5   80 o     25.1   12.4    0.0000   0.0000          ?        ?   -51.0817  22.9868          ?        ?       25.1       12.4       ?       ? 
1 1 1    6    5   81 o     56.7   16.8    0.0000   0.0000          ?        ?    34.4802  20.4327          ?        ?       56.7       16.8       ?       ? 
1 1 1    6    6    0 o   1572.6   12.7 24739.5195 399.0760 24739.5195 399.0760 24739.5195 399.0760     1572.6     12.7     1572.6       12.7     0.0     0.0 
1 1 1    6    6    1 o    595.8    3.8 3550.1802  45.3350  3550.1802  45.3350  3550.1802  45.3350      595.8      3.8      595.8        3.8     0.0     0.0 
1 1 1    6    6    2 o    642.3    3.5 4125.4883  44.6965  4125.4883  44.6965  4125.4883  44.6965      642.3      3.5      642.3        3.5     0.0     0.0 
1 1 1    6    6    3 o    235.7    1.9  555.5138   8.9393   555.5138   8.9393   555.5138   8.9393      235.7      1.9      235.7        1.9     0.0     0.0 
1 1 1    6    6    4 o    601.8    3.5 3622.3330  42.1424  3622.3330  42.1424  3622.3330  42.1424      601.8      3.5      601.8        3.5     0.0     0.0 
1 1 1    6    6    5 o   1081.9    5.3 11705.3779 115.5724 11705.3779 115.5724 11705.3779 115.5724     1081.9      5.3     1081.9        5.3     0.0     0.0 
1 1 1    6    6    6 o    682.9    3.4 4663.7622  46.6121  4663.7622  46.6121  4663.7622  46.6121      682.9      3.4      682.9        3.4     0.0     0.0 
1 1 1    6    6    7 o   1658.5    7.6 27511.3438 250.9390 27511.3438 250.9390 27511.3438 250.9390     1658.5      7.6     1658.5        7.6     0.0     0.0 
1 1 1    6    6    8 o    445.4    2.7 1983.8867  23.6253  1983.8867  23.6253  1983.8867  23.6253      445.4      2.7      445.4        2.7     0.0     0.0 
1 1 1    6    6    9 o   2031.5    9.3 41279.1445 377.3663 41279.1445 377.3663 41279.1445 377.3663     2031.5      9.3     2031.5        9.3     0.0     0.0 
1 1 1    6    6   10 o   1237.1    5.8 15306.0029 143.0288 15306.0029 143.0288 15306.0029 143.0288     1237.1      5.8     1237.1        5.8     0.0     0.0 
1 1 1    6    6   11 o    855.9    4.1 7325.7588  70.8759  7325.7588  70.8759  7325.7588  70.8759      855.9      4.1      855.9        4.1     0.0     0.0 
1 1 1    6    6   12 f    173.8    2.0  302.0207   7.0237   302.0207   7.0237   302.0207   7.0237      173.8      2.0      173.8        2.0     0.0     0.0 
1 1 1    6    6   13 o   1109.7    5.2 12315.1660 116.2109 12315.1660 116.2109 12315.1660 116.2109     1109.7      5.2     1109.7        5.2     0.0     0.0 
1 1 1    6    6   14 o   1174.8    5.6 13804.1982 130.8969 13804.1982 130.8969 13804.1982 130.8969     1174.8      5.6     1174.8        5.6     0.0     0.0 
1 1 1    6    6   15 o   1404.9    6.5 19739.2578 183.2557 19739.2578 183.2557 19739.2578 183.2557     1404.9      6.5     1404.9        6.5     0.0     0.0 
1 1 1    6    6   16 o   1602.4    7.4 25681.3398 235.6145 25681.3398 235.6145 25681.3398 235.6145     1602.4      7.4     1602.4        7.4     0.0     0.0 
1 1 1    6    6   17 o   1243.5    5.9 15465.6328 145.5829 15465.6328 145.5829 15465.6328 145.5829     1243.5      5.9     1243.5        5.9     0.0     0.0 
1 1 1    6    6   18 o      9.7    7.0  -10.2163   6.3852   -10.2163   6.3852   -10.2163   6.3852        9.7      7.0        9.7        7.0     0.0     0.0 
1 1 1    6    6   19 o    429.0    2.6 1840.8578  22.3483  1840.8578  22.3483  1840.8578  22.3483      429.0      2.6      429.0        2.6     0.0     0.0 
1 1 1    6    6   20 o    448.9    2.8 2015.8129  24.9023  2015.8129  24.9023  2015.8129  24.9023      448.9      2.8      448.9        2.8     0.0     0.0 
1 1 1    6    6   21 o    264.5    2.3  699.8197  12.1319   699.8197  12.1319   699.8197  12.1319      264.5      2.3      264.5        2.3     0.0     0.0 
1 1 1    6    6   22 o   2042.4    9.3 41724.1953 380.5589 41724.1953 380.5589 41724.1953 380.5589     2042.4      9.3     2042.4        9.3     0.0     0.0 
1 1 1    6    6   23 o    731.4    3.8 5350.8110  55.5514  5350.8110  55.5514  5350.8110  55.5514      731.4      3.8      731.4        3.8     0.0     0.0 
1 1 1    6    6   24 o    991.4    4.8 9830.6787  95.7782  9830.6787  95.7782  9830.6787  95.7782      991.4      4.8      991.4        4.8     0.0     0.0 
1 1 1    6    6   25 o    628.7    3.4 3953.0872  42.7809  3953.0872  42.7809  3953.0872  42.7809      628.7      3.4      628.7        3.4     0.0     0.0 
1 1 1    6    6   26 o    743.3    4.1 5525.1274  60.6596  5525.1274  60.6596  5525.1274  60.6596      743.3      4.1      743.3        4.1     0.0     0.0 
1 1 1    6    6   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    6    6   28 o   1225.5    5.8 15019.9443 143.0288 15019.9443 143.0288 15019.9443 143.0288     1225.5      5.8     1225.5        5.8     0.0     0.0 
1 1 1    6    6   29 o   1110.7    5.7 12338.7920 126.4273 12338.7920 126.4273 12338.7920 126.4273     1110.7      5.7     1110.7        5.7     0.0     0.0 
1 1 1    6    6   30 o   1118.8    6.3 12519.4932 141.1133 12519.4932 141.1133 12519.4932 141.1133     1118.8      6.3     1118.8        6.3     0.0     0.0 
1 1 1    6    6   31 o   1446.3    7.3 20921.1602 211.3506 20921.1602 211.3506 20921.1602 211.3506     1446.3      7.3     1446.3        7.3     0.0     0.0 
1 1 1    6    6   32 o    787.5    4.5 6201.9604  70.8759  6201.9604  70.8759  6201.9604  70.8759      787.5      4.5      787.5        4.5     0.0     0.0 
1 1 1    6    6   33 o   2172.5   12.2 47210.3750 528.0574 47210.3750 528.0574 47210.3750 528.0574     2172.5     12.2     2172.5       12.2     0.0     0.0 
1 1 1    6    6   34 o   1252.6    6.4 15691.0303 159.6304 15691.0303 159.6304 15691.0303 159.6304     1252.6      6.4     1252.6        6.4     0.0     0.0 
1 1 1    6    6   35 o    199.5    6.3  399.0760  24.9023   399.0760  24.9023   399.0760  24.9023      199.5      6.3      199.5        6.3     0.0     0.0 
1 1 1    6    6   36 o    256.3    4.7  657.6772  24.2638   657.6772  24.2638   657.6772  24.2638      256.3      4.7      256.3        4.7     0.0     0.0 
1 1 1    6    6   37 o   1426.4    6.7 20349.6836 191.5565 20349.6836 191.5565 20349.6836 191.5565     1426.4      6.7     1426.4        6.7     0.0     0.0 
1 1 1    6    6   38 o    603.3    4.0 3640.2117  47.8891  3640.2117  47.8891  3640.2117  47.8891      603.3      4.0      603.3        4.0     0.0     0.0 
1 1 1    6    6   39 o     20.5   15.0  -66.4062  33.2031   -66.4062  33.2031   -66.4062  33.2031       20.5     15.0       20.5       15.0     0.0     0.0 
1 1 1    6    6   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    6    6   41 o   1379.6    6.5 19036.2461 180.0631 19036.2461 180.0631 19036.2461 180.0631     1379.6      6.5     1379.6        6.5     0.0     0.0 
1 1 1    6    6   42 f   1041.1    5.4 10840.8203 112.3798 10840.8203 112.3798 10840.8203 112.3798     1041.1      5.4     1041.1        5.4     0.0     0.0 
1 1 1    6    6   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    6    6   44 o     18.7   13.5  -37.6728  23.6253   -37.6728  23.6253   -37.6728  23.6253       18.7     13.5       18.7       13.5     0.0     0.0 
1 1 1    6    6   45 o    408.5    3.9 1669.0955  31.9261  1669.0955  31.9261  1669.0955  31.9261      408.5      3.9      408.5        3.9     0.0     0.0 
1 1 1    6    6   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    6    6   47 o    552.3    3.9 3050.8562  43.4195  3050.8562  43.4195  3050.8562  43.4195      552.3      3.9      552.3        3.9     0.0     0.0 
1 1 1    6    6   48 o    280.0    4.8  784.7431  26.8179   784.7431  26.8179   784.7431  26.8179      280.0      4.8      280.0        4.8     0.0     0.0 
1 1 1    6    6   49 o    526.2    4.1 2769.9067  43.4195  2769.9067  43.4195  2769.9067  43.4195      526.2      4.1      526.2        4.1     0.0     0.0 
1 1 1    6    6   50 o    245.7    5.5  604.6799  26.8179   604.6799  26.8179   604.6799  26.8179      245.7      5.5      245.7        5.5     0.0     0.0 
1 1 1    6    6   51 o    162.6    8.7  266.9020  28.0950   266.9020  28.0950   266.9020  28.0950      162.6      8.7      162.6        8.7     0.0     0.0 
1 1 1    6    6   52 o    362.9    4.0 1317.2701  28.7335  1317.2701  28.7335  1317.2701  28.7335      362.9      4.0      362.9        4.0     0.0     0.0 
1 1 1    6    6   53 o    174.0    8.5  305.2133  29.3720   305.2133  29.3720   305.2133  29.3720      174.0      8.5      174.0        8.5     0.0     0.0 
1 1 1    6    6   54 o    414.1    4.1 1715.7076  33.8416  1715.7076  33.8416  1715.7076  33.8416      414.1      4.1      414.1        4.1     0.0     0.0 
1 1 1    6    6   55 o    322.6    5.1 1041.4288  32.5646  1041.4288  32.5646  1041.4288  32.5646      322.6      5.1      322.6        5.1     0.0     0.0 
1 1 1    6    6   56 o    313.1    5.2  981.4077  32.5646   981.4077  32.5646   981.4077  32.5646      313.1      5.2      313.1        5.2     0.0     0.0 
1 1 1    6    6   57 o    306.5    5.5  940.5424  33.8416   940.5424  33.8416   940.5424  33.8416      306.5      5.5      306.5        5.5     0.0     0.0 
1 1 1    6    6   58 o     90.4   18.3   91.3086  29.3720    91.3086  29.3720    91.3086  29.3720       90.4     18.3       90.4       18.3     0.0     0.0 
1 1 1    6    6   59 o     33.6   21.3    5.7467  30.0105     5.7467  30.0105     5.7467  30.0105       33.6     21.3       33.6       21.3     0.0     0.0 
1 1 1    6    6   60 o    282.3    5.0  798.1520  28.0950   798.1520  28.0950   798.1520  28.0950      282.3      5.0      282.3        5.0     0.0     0.0 
1 1 1    6    6   61 o    109.8   12.8  125.7888  27.4564   125.7888  27.4564   125.7888  27.4564      109.8     12.8      109.8       12.8     0.0     0.0 
1 1 1    6    6   62 o    151.1    8.9  231.1448  26.8179   231.1448  26.8179   231.1448  26.8179      151.1      8.9      151.1        8.9     0.0     0.0 
1 1 1    6    6   63 o     27.7   18.6   -8.9393  28.0950    -8.9393  28.0950    -8.9393  28.0950       27.7     18.6       27.7       18.6     0.0     0.0 
1 1 1    6    6   64 o    141.1   10.1  202.4114  28.0950   202.4114  28.0950   202.4114  28.0950      141.1     10.1      141.1       10.1     0.0     0.0 
1 1 1    6    6   65 o    437.5    3.7 1914.9263  32.5646  1914.9263  32.5646  1914.9263  32.5646      437.5      3.7      437.5        3.7     0.0     0.0 
1 1 1    6    6   66 o    482.2    3.9 2326.7727  37.6728  2326.7727  37.6728  2326.7727  37.6728      482.2      3.9      482.2        3.9     0.0     0.0 
1 1 1    6    6   67 o    231.8    6.9  539.5508  31.9261   539.5508  31.9261   539.5508  31.9261      231.8      6.9      231.8        6.9     0.0     0.0 
1 1 1    6    6   68 o    160.7    8.6  261.1554  27.4564   261.1554  27.4564   261.1554  27.4564      160.7      8.6      160.7        8.6     0.0     0.0 
1 1 1    6    6   69 o     51.7   25.5   40.2269  31.2876    40.2269  31.2876    40.2269  31.2876       51.7     25.5       51.7       25.5     0.0     0.0 
1 1 1    6    6   70 o    306.3    5.5  939.9038  33.8416   939.9038  33.8416   939.9038  33.8416      306.3      5.5      306.3        5.5     0.0     0.0 
1 1 1    6    6   71 o     34.2   21.6    7.0237  30.6490     7.0237  30.6490     7.0237  30.6490       34.2     21.6       34.2       21.6     0.0     0.0 
1 1 1    6    6   72 o     40.6   23.2   22.3483  29.3720    22.3483  29.3720    22.3483  29.3720       40.6     23.2       40.6       23.2     0.0     0.0 
1 1 1    6    6   73 f     74.7   23.8   71.5144  31.2876    71.5144  31.2876    71.5144  31.2876       74.7     23.8       74.7       23.8     0.0     0.0 
1 1 1    6    6   74 o    300.2    5.5  903.5081  33.2031   903.5081  33.2031   903.5081  33.2031      300.2      5.5      300.2        5.5     0.0     0.0 
1 1 1    6    6   75 o     20.9   15.4  -76.6226  36.3957   -76.6226  36.3957   -76.6226  36.3957       20.9     15.4       20.9       15.4     0.0     0.0 
1 1 1    6    6   76 o    327.9    5.5 1077.8246  35.7572  1077.8246  35.7572  1077.8246  35.7572      327.9      5.5      327.9        5.5     0.0     0.0 
1 1 1    6    6   77 o    221.9    7.2  495.4928  31.9261   495.4928  31.9261   495.4928  31.9261      221.9      7.2      221.9        7.2     0.0     0.0 
1 1 1    6    6   78 o     26.5   17.8   -8.3008  26.1794    -8.3008  26.1794    -8.3008  26.1794       26.5     17.8       26.5       17.8     0.0     0.0 
1 1 1    6    6   79 o     39.8   23.5   20.4327  31.2876    20.4327  31.2876    20.4327  31.2876       39.8     23.5       39.8       23.5     0.0     0.0 
1 1 1    6    6   80 o    129.8   12.3  174.9549  31.2876   174.9549  31.2876   174.9549  31.2876      129.8     12.3      129.8       12.3     0.0     0.0 
1 1 1    6    6   81 o    169.1    9.5  291.1659  31.9261   291.1659  31.9261   291.1659  31.9261      169.1      9.5      169.1        9.5     0.0     0.0 
1 1 1    7    0    0 o    272.3    2.8  741.9621  15.3245   741.9621  15.3245   741.9621  15.3245      272.3      2.8      272.3        2.8     0.0     0.0 
1 1 1    7    0    1 o    984.8    4.8 9699.1436  95.1397  9699.1436  95.1397  9699.1436  95.1397      984.8      4.8      984.8        4.8     0.0     0.0 
1 1 1    7    0    2 o    526.6    2.7 2773.0994  28.0950  2773.0994  28.0950  2773.0994  28.0950      526.6      2.7      526.6        2.7     0.0     0.0 
1 1 1    7    0    3 o    629.3    3.1 3960.7495  38.9498  3960.7495  38.9498  3960.7495  38.9498      629.3      3.1      629.3        3.1     0.0     0.0 
1 1 1    7    0    4 o   1559.2    7.1 24314.2637 222.8441 24314.2637 222.8441 24314.2637 222.8441     1559.2      7.1     1559.2        7.1     0.0     0.0 
1 1 1    7    0    5 f   1429.3    6.6 20430.1387 187.7254 20430.1387 187.7254 20430.1387 187.7254     1429.3      6.6     1429.3        6.6     0.0     0.0 
1 1 1    7    0    6 o    158.0    2.2  249.6619   7.0237   249.6619   7.0237   249.6619   7.0237      158.0      2.2      158.0        2.2     0.0     0.0 
1 1 1    7    0    7 o    749.9    3.7 5624.7373  54.9129  5624.7373  54.9129  5624.7373  54.9129      749.9      3.7      749.9        3.7     0.0     0.0 
1 1 1    7    0    8 o   1448.3    6.7 20979.2676 192.8335 20979.2676 192.8335 20979.2676 192.8335     1448.3      6.7     1448.3        6.7     0.0     0.0 
1 1 1    7    0    9 o    148.1    2.6  219.6514   7.6623   219.6514   7.6623   219.6514   7.6623      148.1      2.6      148.1        2.6     0.0     0.0 
1 1 1    7    0   10 o     67.0    3.8   45.3350   5.1082    45.3350   5.1082    45.3350   5.1082       67.0      3.8       67.0        3.8     0.0     0.0 
1 1 1    7    0   11 o    413.6    2.4 1710.5994  19.7942  1710.5994  19.7942  1710.5994  19.7942      413.6      2.4      413.6        2.4     0.0     0.0 
1 1 1    7    0   12 o   2868.9   14.1 82334.1719 807.0914 82334.1719 807.0914 82334.1719 807.0914     2868.9     14.1     2868.9       14.1     0.0     0.0 
1 1 1    7    0   13 o    831.6    4.5 6917.1050  74.0685  6917.1050  74.0685  6917.1050  74.0685      831.6      4.5      831.6        4.5     0.0     0.0 
1 1 1    7    0   14 o    660.3    3.5 4359.8257  45.9736  4359.8257  45.9736  4359.8257  45.9736      660.3      3.5      660.3        3.5     0.0     0.0 
1 1 1    7    0   15 o    615.6    3.2 3790.2642  39.5883  3790.2642  39.5883  3790.2642  39.5883      615.6      3.2      615.6        3.2     0.0     0.0 
1 1 1    7    0   16 o      9.2    6.7  -12.1319   6.3852   -12.1319   6.3852   -12.1319   6.3852        9.2      6.7        9.2        6.7     0.0     0.0 
1 1 1    7    0   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    0   18 o   1313.3    6.1 17249.0234 160.9075 17249.0234 160.9075 17249.0234 160.9075     1313.3      6.1     1313.3        6.1     0.0     0.0 
1 1 1    7    0   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    0   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    0   21 o    582.1    3.1 3388.6343  35.7572  3388.6343  35.7572  3388.6343  35.7572      582.1      3.1      582.1        3.1     0.0     0.0 
1 1 1    7    0   22 o    815.9    4.1 6657.8647  66.4062  6657.8647  66.4062  6657.8647  66.4062      815.9      4.1      815.9        4.1     0.0     0.0 
1 1 1    7    0   23 o    837.3    4.3 7011.6060  72.7915  7011.6060  72.7915  7011.6060  72.7915      837.3      4.3      837.3        4.3     0.0     0.0 
1 1 1    7    0   24 o   1469.7    6.8 21605.0176 199.2188 21605.0176 199.2188 21605.0176 199.2188     1469.7      6.8     1469.7        6.8     0.0     0.0 
1 1 1    7    0   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    0   26 o   1460.3    6.8 21327.2617 199.2188 21327.2617 199.2188 21327.2617 199.2188     1460.3      6.8     1460.3        6.8     0.0     0.0 
1 1 1    7    0   27 o    414.1    2.9 1715.0691  23.6253  1715.0691  23.6253  1715.0691  23.6253      414.1      2.9      414.1        2.9     0.0     0.0 
1 1 1    7    0   28 f    696.9    3.8 4857.8726  52.3588  4857.8726  52.3588  4857.8726  52.3588      696.9      3.8      696.9        3.8     0.0     0.0 
1 1 1    7    0   29 o   1340.4    6.4 17969.9141 170.4853 17969.9141 170.4853 17969.9141 170.4853     1340.4      6.4     1340.4        6.4     0.0     0.0 
1 1 1    7    0   30 o    166.3    4.6  277.1184  15.3245   277.1184  15.3245   277.1184  15.3245      166.3      4.6      166.3        4.6     0.0     0.0 
1 1 1    7    0   31 f   1688.5    8.5 28515.7363 287.9732 28515.7363 287.9732 28515.7363 287.9732     1688.5      8.5     1688.5        8.5     0.0     0.0 
1 1 1    7    0   32 o   1376.0    6.8 18936.6348 187.0868 18936.6348 187.0868 18936.6348 187.0868     1376.0      6.8     1376.0        6.8     0.0     0.0 
1 1 1    7    0   33 o   1523.1    7.1 23201.9609 215.1818 23201.9609 215.1818 23201.9609 215.1818     1523.1      7.1     1523.1        7.1     0.0     0.0 
1 1 1    7    0   34 o    940.4    5.1 8845.4404  96.4168  8845.4404  96.4168  8845.4404  96.4168      940.4      5.1      940.4        5.1     0.0     0.0 
1 1 1    7    0   35 o    665.9    3.7 4434.5327  49.1662  4434.5327  49.1662  4434.5327  49.1662      665.9      3.7      665.9        3.7     0.0     0.0 
1 1 1    7    0   36 o    243.7    4.3  594.4636  21.0712   594.4636  21.0712   594.4636  21.0712      243.7      4.3      243.7        4.3     0.0     0.0 
1 1 1    7    0   37 o    901.8    4.7 8133.4888  84.9234  8133.4888  84.9234  8133.4888  84.9234      901.8      4.7      901.8        4.7     0.0     0.0 
1 1 1    7    0   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    0   39 o    508.1    3.5 2582.1814  35.1187  2582.1814  35.1187  2582.1814  35.1187      508.1      3.5      508.1        3.5     0.0     0.0 
1 1 1    7    0   40 o   1057.9    5.4 11193.9229 113.6568 11193.9229 113.6568 11193.9229 113.6568     1057.9      5.4     1057.9        5.4     0.0     0.0 
1 1 1    7    0   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    0   42 o    694.3    4.0 4821.4766  54.9129  4821.4766  54.9129  4821.4766  54.9129      694.3      4.0      694.3        4.0     0.0     0.0 
1 1 1    7    0   43 o   1411.7    6.7 19932.0918 190.2794 19932.0918 190.2794 19932.0918 190.2794     1411.7      6.7     1411.7        6.7     0.0     0.0 
1 1 1    7    0   44 o    252.8    6.3  640.4372  31.9261   640.4372  31.9261   640.4372  31.9261      252.8      6.3      252.8        6.3     0.0     0.0 
1 1 1    7    0   45 o   1286.6    6.4 16556.2266 164.7386 16556.2266 164.7386 16556.2266 164.7386     1286.6      6.4     1286.6        6.4     0.0     0.0 
1 1 1    7    0   46 f     43.0   22.8   26.8179  26.1794    26.8179  26.1794    26.8179  26.1794       43.0     22.8       43.0       22.8     0.0     0.0 
1 1 1    7    0   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    0   48 o    392.1    3.8 1538.1986  30.0105  1538.1986  30.0105  1538.1986  30.0105      392.1      3.8      392.1        3.8     0.0     0.0 
1 1 1    7    0   49 o    900.4    4.8 8109.2246  85.5619  8109.2246  85.5619  8109.2246  85.5619      900.4      4.8      900.4        4.8     0.0     0.0 
1 1 1    7    0   50 o   1272.9    6.2 16206.9561 157.0763 16206.9561 157.0763 16206.9561 157.0763     1272.9      6.2     1272.9        6.2     0.0     0.0 
1 1 1    7    0   51 o   1098.6    5.4 12071.2510 119.4035 12071.2510 119.4035 12071.2510 119.4035     1098.6      5.4     1098.6        5.4     0.0     0.0 
1 1 1    7    0   52 o    493.8    5.0 2439.1526  49.1662  2439.1526  49.1662  2439.1526  49.1662      493.8      5.0      493.8        5.0     0.0     0.0 
1 1 1    7    0   53 o    286.3    7.4  821.7773  42.1424   821.7773  42.1424   821.7773  42.1424      286.3      7.4      286.3        7.4     0.0     0.0 
1 1 1    7    0   54 o    698.5    4.1 4879.5825  56.8284  4879.5825  56.8284  4879.5825  56.8284      698.5      4.1      698.5        4.1     0.0     0.0 
1 1 1    7    0   55 o     18.9   13.9  -65.7677  30.0105   -65.7677  30.0105   -65.7677  30.0105       18.9     13.9       18.9       13.9     0.0     0.0 
1 1 1    7    0   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    0   57 o    142.4   10.2  206.2425  28.7335   206.2425  28.7335   206.2425  28.7335      142.4     10.2      142.4       10.2     0.0     0.0 
1 1 1    7    0   58 o    165.4    8.1  275.8413  26.8179   275.8413  26.8179   275.8413  26.8179      165.4      8.1      165.4        8.1     0.0     0.0 
1 1 1    7    0   59 o    470.1    3.8 2210.5620  35.7572  2210.5620  35.7572  2210.5620  35.7572      470.1      3.8      470.1        3.8     0.0     0.0 
1 1 1    7    0   60 o     16.5   12.3  -84.2849  28.7335   -84.2849  28.7335   -84.2849  28.7335       16.5     12.3       16.5       12.3     0.0     0.0 
1 1 1    7    0   61 o    274.8    5.6  756.6481  30.6490   756.6481  30.6490   756.6481  30.6490      274.8      5.6      274.8        5.6     0.0     0.0 
1 1 1    7    0   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    0   63 f    498.9    4.0 2490.2344  39.5883  2490.2344  39.5883  2490.2344  39.5883      498.9      4.0      498.9        4.0     0.0     0.0 
1 1 1    7    0   64 o    279.3    5.5  781.5505  30.6490   781.5505  30.6490   781.5505  30.6490      279.3      5.5      279.3        5.5     0.0     0.0 
1 1 1    7    0   65 o    132.4   10.0  178.7861  26.1794   178.7861  26.1794   178.7861  26.1794      132.4     10.0      132.4       10.0     0.0     0.0 
1 1 1    7    0   66 o    239.9    6.1  577.2236  29.3720   577.2236  29.3720   577.2236  29.3720      239.9      6.1      239.9        6.1     0.0     0.0 
1 1 1    7    0   67 o    367.5    4.7 1351.7502  34.4802  1351.7502  34.4802  1351.7502  34.4802      367.5      4.7      367.5        4.7     0.0     0.0 
1 1 1    7    0   68 o    307.1    5.0  944.3735  30.6490   944.3735  30.6490   944.3735  30.6490      307.1      5.0      307.1        5.0     0.0     0.0 
1 1 1    7    0   69 o    239.4    6.1  574.6694  29.3720   574.6694  29.3720   574.6694  29.3720      239.4      6.1      239.4        6.1     0.0     0.0 
1 1 1    7    0   70 o     20.1   14.6  -51.7203  29.3720   -51.7203  29.3720   -51.7203  29.3720       20.1     14.6       20.1       14.6     0.0     0.0 
1 1 1    7    0   71 o    266.9    6.0  714.5057  31.9261   714.5057  31.9261   714.5057  31.9261      266.9      6.0      266.9        6.0     0.0     0.0 
1 1 1    7    0   72 o    426.0    4.0 1815.9554  34.4802  1815.9554  34.4802  1815.9554  34.4802      426.0      4.0      426.0        4.0     0.0     0.0 
1 1 1    7    0   73 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    0   74 o     91.8   18.9   95.1397  30.6490    95.1397  30.6490    95.1397  30.6490       91.8     18.9       91.8       18.9     0.0     0.0 
1 1 1    7    0   75 o    305.5    5.9  936.0728  35.7572   936.0728  35.7572   936.0728  35.7572      305.5      5.9      305.5        5.9     0.0     0.0 
1 1 1    7    0   76 o     16.7   12.5  -97.6938  31.2876   -97.6938  31.2876   -97.6938  31.2876       16.7     12.5       16.7       12.5     0.0     0.0 
1 1 1    7    0   77 o    226.0    7.4  514.0099  33.2031   514.0099  33.2031   514.0099  33.2031      226.0      7.4      226.0        7.4     0.0     0.0 
1 1 1    7    0   78 o    133.1   12.2  183.2557  31.9261   183.2557  31.9261   183.2557  31.9261      133.1     12.2      133.1       12.2     0.0     0.0 
1 1 1    7    0   79 o    288.0    5.7  831.9937  32.5646   831.9937  32.5646   831.9937  32.5646      288.0      5.7      288.0        5.7     0.0     0.0 
1 1 1    7    0   80 o     54.7   24.9   45.3350  29.3720    45.3350  29.3720    45.3350  29.3720       54.7     24.9       54.7       24.9     0.0     0.0 
1 1 1    7    0   81 o     66.0   23.0   58.7440  27.4564    58.7440  27.4564    58.7440  27.4564       66.0     23.0       66.0       23.0     0.0     0.0 
1 1 1    7    0   82 o    260.1    7.0  681.3026  36.3957   681.3026  36.3957   681.3026  36.3957      260.1      7.0      260.1        7.0     0.0     0.0 
1 1 1    7    1    0 o    272.3    1.8  741.3236   9.5778   741.3236   9.5778   741.3236   9.5778      272.3      1.8      272.3        1.8     0.0     0.0 
1 1 1    7    1    1 o    817.2    2.9    0.0000   0.0000          ?        ?  6678.2979  47.8891          ?        ?      817.2        2.9       ?       ? 
1 1 1    7    1    2 o   1199.4    4.1    0.0000   0.0000          ?        ? 14385.2529  98.3323          ?        ?     1199.4        4.1       ?       ? 
1 1 1    7    1    3 o    550.9    2.0    0.0000   0.0000          ?        ?  3034.8933  21.7097          ?        ?      550.9        2.0       ?       ? 
1 1 1    7    1    4 o   1510.3    4.9    0.0000   0.0000          ?        ? 22811.1855 147.4985          ?        ?     1510.3        4.9       ?       ? 
1 1 1    7    1    5 o    816.1    2.8    0.0000   0.0000          ?        ?  6659.7808  45.3350          ?        ?      816.1        2.8       ?       ? 
1 1 1    7    1    6 o   1401.1    4.6    0.0000   0.0000          ?        ? 19632.6250 127.7043          ?        ?     1401.1        4.6       ?       ? 
1 1 1    7    1    7 o    663.8    2.3    0.0000   0.0000          ?        ?  4405.7993  30.6490          ?        ?      663.8        2.3       ?       ? 
1 1 1    7    1    8 f   1835.2    5.9    0.0000   0.0000          ?        ? 33683.2930 216.4588          ?        ?     1835.2        5.9       ?       ? 
1 1 1    7    1    9 o   1204.6    4.1    0.0000   0.0000          ?        ? 14512.3203  98.3323          ?        ?     1204.6        4.1       ?       ? 
1 1 1    7    1   10 o   2133.8    6.8    0.0000   0.0000          ?        ? 45535.5312 291.1659          ?        ?     2133.8        6.8       ?       ? 
1 1 1    7    1   11 o    812.4    2.8    0.0000   0.0000          ?        ?  6599.7593  45.9736          ?        ?      812.4        2.8       ?       ? 
1 1 1    7    1   12 o   1403.5    4.7    0.0000   0.0000          ?        ? 19699.6680 132.1740          ?        ?     1403.5        4.7       ?       ? 
1 1 1    7    1   13 o   1248.7    4.1    0.0000   0.0000          ?        ? 15592.0586 103.4405          ?        ?     1248.7        4.1       ?       ? 
1 1 1    7    1   14 o    400.7    1.8    0.0000   0.0000          ?        ?  1605.8818  14.0475          ?        ?      400.7        1.8       ?       ? 
1 1 1    7    1   15 f    974.0    3.3    0.0000   0.0000          ?        ?  9487.7930  64.4907          ?        ?      974.0        3.3       ?       ? 
1 1 1    7    1   16 o    637.0    2.6    0.0000   0.0000          ?        ?  4057.8049  33.2031          ?        ?      637.0        2.6       ?       ? 
1 1 1    7    1   17 o   1856.6    6.1    0.0000   0.0000          ?        ? 34473.7812 226.6752          ?        ?     1856.6        6.1       ?       ? 
1 1 1    7    1   18 o    461.0    1.9    0.0000   0.0000          ?        ?  2125.0000  17.2401          ?        ?      461.0        1.9       ?       ? 
1 1 1    7    1   19 o   1016.9    3.5    0.0000   0.0000          ?        ? 10340.8574  70.8759          ?        ?     1016.9        3.5       ?       ? 
1 1 1    7    1   20 o    605.4    2.3    0.0000   0.0000          ?        ?  3665.7524  28.0950          ?        ?      605.4        2.3       ?       ? 
1 1 1    7    1   21 o    998.2    3.5    0.0000   0.0000          ?        ?  9965.4062  69.5989          ?        ?      998.2        3.5       ?       ? 
1 1 1    7    1   22 o   2235.6    7.1    0.0000   0.0000          ?        ? 49991.1367 319.2608          ?        ?     2235.6        7.1       ?       ? 
1 1 1    7    1   23 o    548.9    2.2    0.0000   0.0000          ?        ?  3013.1836  24.2638          ?        ?      548.9        2.2       ?       ? 
1 1 1    7    1   24 o    850.8    3.0    0.0000   0.0000          ?        ?  7238.9194  50.4432          ?        ?      850.8        3.0       ?       ? 
1 1 1    7    1   25 o    724.9    2.6    0.0000   0.0000          ?        ?  5255.6714  38.3113          ?        ?      724.9        2.6       ?       ? 
1 1 1    7    1   26 o    907.1    3.2    0.0000   0.0000          ?        ?  8229.2666  58.7440          ?        ?      907.1        3.2       ?       ? 
1 1 1    7    1   27 o    848.6    3.2    0.0000   0.0000          ?        ?  7201.8857  53.6358          ?        ?      848.6        3.2       ?       ? 
1 1 1    7    1   28 o    797.6    2.8    0.0000   0.0000          ?        ?  6361.5908  45.3350          ?        ?      797.6        2.8       ?       ? 
1 1 1    7    1   29 o   1072.5    3.8    0.0000   0.0000          ?        ? 11503.6055  80.4537          ?        ?     1072.5        3.8       ?       ? 
1 1 1    7    1   30 o    971.0    3.4    0.0000   0.0000          ?        ?  9429.6875  65.7677          ?        ?      971.0        3.4       ?       ? 
1 1 1    7    1   31 o    632.5    2.8    0.0000   0.0000          ?        ?  4000.3379  35.7572          ?        ?      632.5        2.8       ?       ? 
1 1 1    7    1   32 o   1682.1    5.9    0.0000   0.0000          ?        ? 28296.0859 198.5802          ?        ?     1682.1        5.9       ?       ? 
1 1 1    7    1   33 o   1083.7    3.8    0.0000   0.0000          ?        ? 11744.3281  81.7308          ?        ?     1083.7        3.8       ?       ? 
1 1 1    7    1   34 o    660.8    2.8    0.0000   0.0000          ?        ?  4366.2109  37.0343          ?        ?      660.8        2.8       ?       ? 
1 1 1    7    1   35 o   1157.7    4.5    0.0000   0.0000          ?        ? 13402.5693 104.0790          ?        ?     1157.7        4.5       ?       ? 
1 1 1    7    1   36 o   1405.6    4.7    0.0000   0.0000          ?        ? 19759.0508 132.1740          ?        ?     1405.6        4.7       ?       ? 
1 1 1    7    1   37 o   1533.6    5.1    0.0000   0.0000          ?        ? 23519.9434 155.1608          ?        ?     1533.6        5.1       ?       ? 
1 1 1    7    1   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    1   39 o   1443.1    5.0    0.0000   0.0000          ?        ? 20827.9355 144.9444          ?        ?     1443.1        5.0       ?       ? 
1 1 1    7    1   40 o    866.6    3.1    0.0000   0.0000          ?        ?  7510.9302  54.2743          ?        ?      866.6        3.1       ?       ? 
1 1 1    7    1   41 o   1172.6    4.1    0.0000   0.0000          ?        ? 13749.9238  97.0553          ?        ?     1172.6        4.1       ?       ? 
1 1 1    7    1   42 o    121.7    8.4    0.0000   0.0000          ?        ?   148.1370  20.4327          ?        ?      121.7        8.4       ?       ? 
1 1 1    7    1   43 o    632.3    2.7    0.0000   0.0000          ?        ?  3997.7837  34.4802          ?        ?      632.3        2.7       ?       ? 
1 1 1    7    1   44 o   1039.3    3.7    0.0000   0.0000          ?        ? 10802.5088  77.8996          ?        ?     1039.3        3.7       ?       ? 
1 1 1    7    1   45 o     33.6   14.9    0.0000   0.0000          ?        ?    -7.0237  19.7942          ?        ?       33.6       14.9       ?       ? 
1 1 1    7    1   46 o    810.0    3.1    0.0000   0.0000          ?        ?  6561.4482  50.4432          ?        ?      810.0        3.1       ?       ? 
1 1 1    7    1   47 o    457.4    2.6    0.0000   0.0000          ?        ?  2091.7969  23.6253          ?        ?      457.4        2.6       ?       ? 
1 1 1    7    1   48 o    846.6    3.2    0.0000   0.0000          ?        ?  7167.4053  54.9129          ?        ?      846.6        3.2       ?       ? 
1 1 1    7    1   49 o    592.8    3.4    0.0000   0.0000          ?        ?  3515.0615  40.2269          ?        ?      592.8        3.4       ?       ? 
1 1 1    7    1   50 o    590.2    3.0    0.0000   0.0000          ?        ?  3483.1355  35.7572          ?        ?      590.2        3.0       ?       ? 
1 1 1    7    1   51 o     81.8   12.9    0.0000   0.0000          ?        ?    67.0448  21.0712          ?        ?       81.8       12.9       ?       ? 
1 1 1    7    1   52 o    644.9    2.9    0.0000   0.0000          ?        ?  4159.3301  37.0343          ?        ?      644.9        2.9       ?       ? 
1 1 1    7    1   53 o     29.2   14.1    0.0000   0.0000          ?        ?   -37.0343  24.2638          ?        ?       29.2       14.1       ?       ? 
1 1 1    7    1   54 o    616.8    2.6    0.0000   0.0000          ?        ?  3804.3118  32.5646          ?        ?      616.8        2.6       ?       ? 
1 1 1    7    1   55 o    427.8    2.8    0.0000   0.0000          ?        ?  1830.0031  24.2638          ?        ?      427.8        2.8       ?       ? 
1 1 1    7    1   56 f    436.1    2.9    0.0000   0.0000          ?        ?  1902.1559  25.5409          ?        ?      436.1        2.9       ?       ? 
1 1 1    7    1   57 o    372.8    2.9    0.0000   0.0000          ?        ?  1390.0615  21.7097          ?        ?      372.8        2.9       ?       ? 
1 1 1    7    1   58 o    221.1    4.5    0.0000   0.0000          ?        ?   489.1075  19.7942          ?        ?      221.1        4.5       ?       ? 
1 1 1    7    1   59 o    334.5    3.2    0.0000   0.0000          ?        ?  1119.3285  21.7097          ?        ?      334.5        3.2       ?       ? 
1 1 1    7    1   60 o    106.8    9.3    0.0000   0.0000          ?        ?   114.2954  19.7942          ?        ?      106.8        9.3       ?       ? 
1 1 1    7    1   61 o    182.5    5.4    0.0000   0.0000          ?        ?   333.3083  19.7942          ?        ?      182.5        5.4       ?       ? 
1 1 1    7    1   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    1   63 o    496.1    2.8    0.0000   0.0000          ?        ?  2461.5010  28.0950          ?        ?      496.1        2.8       ?       ? 
1 1 1    7    1   64 o    657.6    3.0    0.0000   0.0000          ?        ?  4325.3457  38.9498          ?        ?      657.6        3.0       ?       ? 
1 1 1    7    1   65 o     42.3   16.9    0.0000   0.0000          ?        ?     8.9393  21.7097          ?        ?       42.3       16.9       ?       ? 
1 1 1    7    1   66 o    340.9    3.4    0.0000   0.0000          ?        ?  1162.7479  22.9868          ?        ?      340.9        3.4       ?       ? 
1 1 1    7    1   67 o     90.8   10.9    0.0000   0.0000          ?        ?    83.0078  19.7942          ?        ?       90.8       10.9       ?       ? 
1 1 1    7    1   68 o     20.4   10.3    0.0000   0.0000          ?        ?   -64.4907  19.7942          ?        ?       20.4       10.3       ?       ? 
1 1 1    7    1   69 o    247.3    4.1    0.0000   0.0000          ?        ?   612.3422  20.4327          ?        ?      247.3        4.1       ?       ? 
1 1 1    7    1   70 o     22.6   11.3    0.0000   0.0000          ?        ?   -61.2981  21.7097          ?        ?       22.6       11.3       ?       ? 
1 1 1    7    1   71 o    316.1    3.7    0.0000   0.0000          ?        ?   999.9249  23.6253          ?        ?      316.1        3.7       ?       ? 
1 1 1    7    1   72 o    230.7    4.8    0.0000   0.0000          ?        ?   533.1656  22.3483          ?        ?      230.7        4.8       ?       ? 
1 1 1    7    1   73 o     46.3   16.9    0.0000   0.0000          ?        ?    17.8786  20.4327          ?        ?       46.3       16.9       ?       ? 
1 1 1    7    1   74 o    179.3    6.2    0.0000   0.0000          ?        ?   322.4534  22.3483          ?        ?      179.3        6.2       ?       ? 
1 1 1    7    1   75 o    119.3    9.6    0.0000   0.0000          ?        ?   143.6674  22.9868          ?        ?      119.3        9.6       ?       ? 
1 1 1    7    1   76 o     28.1   13.4    0.0000   0.0000          ?        ?   -27.4564  21.0712          ?        ?       28.1       13.4       ?       ? 
1 1 1    7    1   77 o     67.4   15.9    0.0000   0.0000          ?        ?    48.5276  21.0712          ?        ?       67.4       15.9       ?       ? 
1 1 1    7    1   78 o    180.4    6.2    0.0000   0.0000          ?        ?   326.9231  22.3483          ?        ?      180.4        6.2       ?       ? 
1 1 1    7    1   79 o     50.8   16.5    0.0000   0.0000          ?        ?    26.1794  19.1556          ?        ?       50.8       16.5       ?       ? 
1 1 1    7    1   80 o     23.5   11.6    0.0000   0.0000          ?        ?   -46.6121  20.4327          ?        ?       23.5       11.6       ?       ? 
1 1 1    7    1   81 o    168.5    6.4    0.0000   0.0000          ?        ?   286.0577  21.7097          ?        ?      168.5        6.4       ?       ? 
1 1 1    7    1   82 o     50.7   18.2    0.0000   0.0000          ?        ?    24.2638  23.6253          ?        ?       50.7       18.2       ?       ? 
1 1 1    7    2    0 o    690.6    3.7 4770.3950  51.7203  4770.3950  51.7203  4770.3950  51.7203      690.6      3.7      690.6        3.7     0.0     0.0 
1 1 1    7    2    1 o    478.7    1.9    0.0000   0.0000          ?        ?  2291.6541  18.5171          ?        ?      478.7        1.9       ?       ? 
1 1 1    7    2    2 o    785.4    2.9    0.0000   0.0000          ?        ?  6168.7573  45.3350          ?        ?      785.4        2.9       ?       ? 
1 1 1    7    2    3 o    811.6    2.8    0.0000   0.0000          ?        ?  6586.9888  45.9736          ?        ?      811.6        2.8       ?       ? 
1 1 1    7    2    4 o   1517.4    4.9    0.0000   0.0000          ?        ? 23025.0898 148.7755          ?        ?     1517.4        4.9       ?       ? 
1 1 1    7    2    5 o   1304.7    4.3    0.0000   0.0000          ?        ? 17023.6250 111.1028          ?        ?     1304.7        4.3       ?       ? 
1 1 1    7    2    6 o   2343.7    8.8    0.0000   0.0000          ?        ? 54942.2305 412.4850          ?        ?     2343.7        8.8       ?       ? 
1 1 1    7    2    7 o    288.7    1.3    0.0000   0.0000          ?        ?   833.2708   7.6623          ?        ?      288.7        1.3       ?       ? 
1 1 1    7    2    8 o    902.9    3.1    0.0000   0.0000          ?        ?  8152.0054  56.8284          ?        ?      902.9        3.1       ?       ? 
1 1 1    7    2    9 o     47.3    3.4    0.0000   0.0000          ?        ?    22.3483   3.1926          ?        ?       47.3        3.4       ?       ? 
1 1 1    7    2   10 o   2124.7    6.8    0.0000   0.0000          ?        ? 45150.5039 289.8888          ?        ?     2124.7        6.8       ?       ? 
1 1 1    7    2   11 o   1609.3    5.3    0.0000   0.0000          ?        ? 25899.0762 171.1238          ?        ?     1609.3        5.3       ?       ? 
1 1 1    7    2   12 o   1719.7    5.6    0.0000   0.0000          ?        ? 29576.3223 191.5565          ?        ?     1719.7        5.6       ?       ? 
1 1 1    7    2   13 o   2270.5    7.2    0.0000   0.0000          ?        ? 51560.6211 328.8386          ?        ?     2270.5        7.2       ?       ? 
1 1 1    7    2   14 o   1040.5    3.5    0.0000   0.0000          ?        ? 10826.7725  73.4300          ?        ?     1040.5        3.5       ?       ? 
1 1 1    7    2   15 o    894.8    3.1    0.0000   0.0000          ?        ?  8006.4229  54.9129          ?        ?      894.8        3.1       ?       ? 
1 1 1    7    2   16 o   1979.1    6.5    0.0000   0.0000          ?        ? 39175.2148 257.9627          ?        ?     1979.1        6.5       ?       ? 
1 1 1    7    2   17 o    886.3    3.1    0.0000   0.0000          ?        ?  7856.3701  54.2743          ?        ?      886.3        3.1       ?       ? 
1 1 1    7    2   18 o   2092.7    6.7    0.0000   0.0000          ?        ? 43802.5820 282.2266          ?        ?     2092.7        6.7       ?       ? 
1 1 1    7    2   19 o   1224.2    4.1    0.0000   0.0000          ?        ? 14987.3789 101.5249          ?        ?     1224.2        4.1       ?       ? 
1 1 1    7    2   20 o    876.3    3.0    0.0000   0.0000          ?        ?  7680.1387  52.9973          ?        ?      876.3        3.0       ?       ? 
1 1 1    7    2   21 o   1545.1    5.2    0.0000   0.0000          ?        ? 23877.5156 160.2689          ?        ?     1545.1        5.2       ?       ? 
1 1 1    7    2   22 o   2156.3    7.0    0.0000   0.0000          ?        ? 46509.2773 303.9363          ?        ?     2156.3        7.0       ?       ? 
1 1 1    7    2   23 o    393.5    1.8    0.0000   0.0000          ?        ?  1548.4149  14.0475          ?        ?      393.5        1.8       ?       ? 
1 1 1    7    2   24 o    306.7    1.7    0.0000   0.0000          ?        ?   940.5424  10.2163          ?        ?      306.7        1.7       ?       ? 
1 1 1    7    2   25 o     57.6    6.6    0.0000   0.0000          ?        ?    33.2031   7.6623          ?        ?       57.6        6.6       ?       ? 
1 1 1    7    2   26 o    996.1    3.5    0.0000   0.0000          ?        ?  9923.2646  70.2374          ?        ?      996.1        3.5       ?       ? 
1 1 1    7    2   27 o   1944.2    6.3    0.0000   0.0000          ?        ? 37806.8672 244.5538          ?        ?     1944.2        6.3       ?       ? 
1 1 1    7    2   28 o    881.0    3.3    0.0000   0.0000          ?        ?  7761.8687  57.4669          ?        ?      881.0        3.3       ?       ? 
1 1 1    7    2   29 f   1329.6    4.6    0.0000   0.0000          ?        ? 17678.7480 121.3191          ?        ?     1329.6        4.6       ?       ? 
1 1 1    7    2   30 o   1258.8    4.3    0.0000   0.0000          ?        ? 15847.4678 108.5487          ?        ?     1258.8        4.3       ?       ? 
1 1 1    7    2   31 o   1390.2    4.9    0.0000   0.0000          ?        ? 19328.6895 136.6436          ?        ?     1390.2        4.9       ?       ? 
1 1 1    7    2   32 o   1047.8    3.8    0.0000   0.0000          ?        ? 10980.0176  80.4537          ?        ?     1047.8        3.8       ?       ? 
1 1 1    7    2   33 o    383.1    2.5    0.0000   0.0000          ?        ?  1467.3228  19.1556          ?        ?      383.1        2.5       ?       ? 
1 1 1    7    2   34 o   1281.4    4.7    0.0000   0.0000          ?        ? 16421.5000 120.0421          ?        ?     1281.4        4.7       ?       ? 
1 1 1    7    2   35 o    693.8    2.8    0.0000   0.0000          ?        ?  4813.8149  38.9498          ?        ?      693.8        2.8       ?       ? 
1 1 1    7    2   36 o   1166.8    4.0    0.0000   0.0000          ?        ? 13613.9199  93.8627          ?        ?     1166.8        4.0       ?       ? 
1 1 1    7    2   37 o    892.0    3.2    0.0000   0.0000          ?        ?  7957.2563  56.8284          ?        ?      892.0        3.2       ?       ? 
1 1 1    7    2   38 o    550.0    2.6    0.0000   0.0000          ?        ?  3024.6770  28.0950          ?        ?      550.0        2.6       ?       ? 
1 1 1    7    2   39 o   1244.2    4.2    0.0000   0.0000          ?        ? 15481.5957 104.7175          ?        ?     1244.2        4.2       ?       ? 
1 1 1    7    2   40 o     67.6   13.2    0.0000   0.0000          ?        ?    47.2506  17.2401          ?        ?       67.6       13.2       ?       ? 
1 1 1    7    2   41 o    661.6    2.7    0.0000   0.0000          ?        ?  4377.7041  35.7572          ?        ?      661.6        2.7       ?       ? 
1 1 1    7    2   42 o    882.7    3.2    0.0000   0.0000          ?        ?  7792.5181  56.8284          ?        ?      882.7        3.2       ?       ? 
1 1 1    7    2   43 o    576.3    2.7    0.0000   0.0000          ?        ?  3321.5896  31.2876          ?        ?      576.3        2.7       ?       ? 
1 1 1    7    2   44 o   1456.6    4.8    0.0000   0.0000          ?        ? 21218.7129 141.1133          ?        ?     1456.6        4.8       ?       ? 
1 1 1    7    2   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    2   46 o    537.7    2.6    0.0000   0.0000          ?        ?  2891.2258  28.0950          ?        ?      537.7        2.6       ?       ? 
1 1 1    7    2   47 o    593.5    3.1    0.0000   0.0000          ?        ?  3522.0852  37.0343          ?        ?      593.5        3.1       ?       ? 
1 1 1    7    2   48 o    604.3    2.8    0.0000   0.0000          ?        ?  3652.3438  33.8416          ?        ?      604.3        2.8       ?       ? 
1 1 1    7    2   49 o    758.5    3.0    0.0000   0.0000          ?        ?  5753.7183  45.3350          ?        ?      758.5        3.0       ?       ? 
1 1 1    7    2   50 o    194.9    5.1    0.0000   0.0000          ?        ?   379.9204  19.7942          ?        ?      194.9        5.1       ?       ? 
1 1 1    7    2   51 o    197.2    5.8    0.0000   0.0000          ?        ?   388.8597  22.9868          ?        ?      197.2        5.8       ?       ? 
1 1 1    7    2   52 o    672.5    2.8    0.0000   0.0000          ?        ?  4522.6484  37.6728          ?        ?      672.5        2.8       ?       ? 
1 1 1    7    2   53 o    319.1    3.4    0.0000   0.0000          ?        ?  1018.4420  21.7097          ?        ?      319.1        3.4       ?       ? 
1 1 1    7    2   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    2   55 o    126.0    7.9    0.0000   0.0000          ?        ?   158.9919  19.7942          ?        ?      126.0        7.9       ?       ? 
1 1 1    7    2   56 o    210.3    4.6    0.0000   0.0000          ?        ?   442.4955  19.1556          ?        ?      210.3        4.6       ?       ? 
1 1 1    7    2   57 o     22.3   11.0    0.0000   0.0000          ?        ?   -40.2269  17.8786          ?        ?       22.3       11.0       ?       ? 
1 1 1    7    2   58 o    316.6    3.1    0.0000   0.0000          ?        ?  1002.4789  19.7942          ?        ?      316.6        3.1       ?       ? 
1 1 1    7    2   59 o    422.4    2.8    0.0000   0.0000          ?        ?  1784.6680  23.6253          ?        ?      422.4        2.8       ?       ? 
1 1 1    7    2   60 o    203.8    5.0    0.0000   0.0000          ?        ?   415.6776  20.4327          ?        ?      203.8        5.0       ?       ? 
1 1 1    7    2   61 o    200.7    4.6    0.0000   0.0000          ?        ?   402.9071  18.5171          ?        ?      200.7        4.6       ?       ? 
1 1 1    7    2   62 o     63.9   16.0    0.0000   0.0000          ?        ?    42.7809  20.4327          ?        ?       63.9       16.0       ?       ? 
1 1 1    7    2   63 o    153.4    6.5    0.0000   0.0000          ?        ?   235.6145  19.7942          ?        ?      153.4        6.5       ?       ? 
1 1 1    7    2   64 o    218.0    4.7    0.0000   0.0000          ?        ?   475.6986  20.4327          ?        ?      218.0        4.7       ?       ? 
1 1 1    7    2   65 o    535.0    2.8    0.0000   0.0000          ?        ?  2863.1309  30.0105          ?        ?      535.0        2.8       ?       ? 
1 1 1    7    2   66 o     21.6   10.9    0.0000   0.0000          ?        ?   -64.4907  21.0712          ?        ?       21.6       10.9       ?       ? 
1 1 1    7    2   67 o    284.4    3.7    0.0000   0.0000          ?        ?   809.6454  21.0712          ?        ?      284.4        3.7       ?       ? 
1 1 1    7    2   68 o    213.2    4.9    0.0000   0.0000          ?        ?   455.2659  21.0712          ?        ?      213.2        4.9       ?       ? 
1 1 1    7    2   69 o    268.4    4.2    0.0000   0.0000          ?        ?   720.8909  22.3483          ?        ?      268.4        4.2       ?       ? 
1 1 1    7    2   70 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    2   71 o    211.5    5.1    0.0000   0.0000          ?        ?   448.2422  21.7097          ?        ?      211.5        5.1       ?       ? 
1 1 1    7    2   72 o     39.1   16.3    0.0000   0.0000          ?        ?     3.8311  21.0712          ?        ?       39.1       16.3       ?       ? 
1 1 1    7    2   73 o     23.1   11.5    0.0000   0.0000          ?        ?   -53.6358  21.0712          ?        ?       23.1       11.5       ?       ? 
1 1 1    7    2   74 o    115.6    9.4    0.0000   0.0000          ?        ?   134.7281  21.7097          ?        ?      115.6        9.4       ?       ? 
1 1 1    7    2   75 o     24.8   12.3    0.0000   0.0000          ?        ?   -49.8047  22.3483          ?        ?       24.8       12.3       ?       ? 
1 1 1    7    2   76 f     28.1   13.4    0.0000   0.0000          ?        ?   -24.9023  20.4327          ?        ?       28.1       13.4       ?       ? 
1 1 1    7    2   77 o    218.9    5.4    0.0000   0.0000          ?        ?   480.8068  23.6253          ?        ?      218.9        5.4       ?       ? 
1 1 1    7    2   78 o    167.9    6.7    0.0000   0.0000          ?        ?   283.5036  22.3483          ?        ?      167.9        6.7       ?       ? 
1 1 1    7    2   79 o     76.0   14.4    0.0000   0.0000          ?        ?    61.2981  21.0712          ?        ?       76.0       14.4       ?       ? 
1 1 1    7    2   80 o     47.9   17.5    0.0000   0.0000          ?        ?    20.4327  21.7097          ?        ?       47.9       17.5       ?       ? 
1 1 1    7    2   81 o    122.7    8.6    0.0000   0.0000          ?        ?   152.6067  21.0712          ?        ?      122.7        8.6       ?       ? 
1 1 1    7    2   82 o     58.8   16.3    0.0000   0.0000          ?        ?    37.6728  19.7942          ?        ?       58.8       16.3       ?       ? 
1 1 1    7    3    0 o    463.9    2.8 2152.4565  25.5409  2152.4565  25.5409  2152.4565  25.5409      463.9      2.8      463.9        2.8     0.0     0.0 
1 1 1    7    3    1 o   1596.9    6.2    0.0000   0.0000          ?        ? 25504.4688 196.6647          ?        ?     1596.9        6.2       ?       ? 
1 1 1    7    3    2 o    601.8    2.4    0.0000   0.0000          ?        ?  3621.6948  29.3720          ?        ?      601.8        2.4       ?       ? 
1 1 1    7    3    3 o   1320.7    4.7    0.0000   0.0000          ?        ? 17443.7715 125.1502          ?        ?     1320.7        4.7       ?       ? 
1 1 1    7    3    4 o   2281.9    8.9    0.0000   0.0000          ?        ? 52079.1016 406.7383          ?        ?     2281.9        8.9       ?       ? 
1 1 1    7    3    5 o    434.0    1.7    0.0000   0.0000          ?        ?  1883.6388  14.6860          ?        ?      434.0        1.7       ?       ? 
1 1 1    7    3    6 o   1057.7    3.5    0.0000   0.0000          ?        ? 11188.1758  74.7070          ?        ?     1057.7        3.5       ?       ? 
1 1 1    7    3    7 o   1429.8    4.8    0.0000   0.0000          ?        ? 20443.5469 136.0051          ?        ?     1429.8        4.8       ?       ? 
1 1 1    7    3    8 o   2210.8    7.2    0.0000   0.0000          ?        ? 48883.9375 318.6223          ?        ?     2210.8        7.2       ?       ? 
1 1 1    7    3    9 o   1551.7    5.1    0.0000   0.0000          ?        ? 24079.2891 157.0763          ?        ?     1551.7        5.1       ?       ? 
1 1 1    7    3   10 o   1772.6    5.9    0.0000   0.0000          ?        ? 31422.9277 207.5195          ?        ?     1772.6        5.9       ?       ? 
1 1 1    7    3   11 o   1281.0    4.3    0.0000   0.0000          ?        ? 16409.3672 110.4642          ?        ?     1281.0        4.3       ?       ? 
1 1 1    7    3   12 o    987.3    3.4    0.0000   0.0000          ?        ?  9748.3096  66.4062          ?        ?      987.3        3.4       ?       ? 
1 1 1    7    3   13 f   1009.1    3.4    0.0000   0.0000          ?        ? 10182.5039  68.9603          ?        ?     1009.1        3.4       ?       ? 
1 1 1    7    3   14 o    661.5    2.4    0.0000   0.0000          ?        ?  4375.7886  31.2876          ?        ?      661.5        2.4       ?       ? 
1 1 1    7    3   15 o    233.5    1.4    0.0000   0.0000          ?        ?   545.2975   6.3852          ?        ?      233.5        1.4       ?       ? 
1 1 1    7    3   16 o    124.8    2.0    0.0000   0.0000          ?        ?   155.7993   5.1082          ?        ?      124.8        2.0       ?       ? 
1 1 1    7    3   17 o    670.2    2.5    0.0000   0.0000          ?        ?  4491.3613  33.8416          ?        ?      670.2        2.5       ?       ? 
1 1 1    7    3   18 o    426.4    1.8    0.0000   0.0000          ?        ?  1817.8711  15.3245          ?        ?      426.4        1.8       ?       ? 
1 1 1    7    3   19 o   1620.6    5.4    0.0000   0.0000          ?        ? 26267.5020 174.3164          ?        ?     1620.6        5.4       ?       ? 
1 1 1    7    3   20 o    279.9    1.7    0.0000   0.0000          ?        ?   783.4660   9.5778          ?        ?      279.9        1.7       ?       ? 
1 1 1    7    3   21 o   1339.5    4.4    0.0000   0.0000          ?        ? 17944.3730 118.7650          ?        ?     1339.5        4.4       ?       ? 
1 1 1    7    3   22 o   1260.2    4.2    0.0000   0.0000          ?        ? 15882.5859 105.9946          ?        ?     1260.2        4.2       ?       ? 
1 1 1    7    3   23 o    414.1    1.9    0.0000   0.0000          ?        ?  1714.4305  15.9630          ?        ?      414.1        1.9       ?       ? 
1 1 1    7    3   24 o    828.1    2.9    0.0000   0.0000          ?        ?  6857.0840  48.5276          ?        ?      828.1        2.9       ?       ? 
1 1 1    7    3   25 o   1151.6    3.9    0.0000   0.0000          ?        ? 13262.7334  90.0316          ?        ?     1151.6        3.9       ?       ? 
1 1 1    7    3   26 o   1195.9    4.1    0.0000   0.0000          ?        ? 14303.5234  98.3323          ?        ?     1195.9        4.1       ?       ? 
1 1 1    7    3   27 o   1058.2    3.6    0.0000   0.0000          ?        ? 11199.0312  76.6226          ?        ?     1058.2        3.6       ?       ? 
1 1 1    7    3   28 o    706.8    2.7    0.0000   0.0000          ?        ?  4996.4316  37.6728          ?        ?      706.8        2.7       ?       ? 
1 1 1    7    3   29 o   1414.8    4.7    0.0000   0.0000          ?        ? 20019.5684 132.8125          ?        ?     1414.8        4.7       ?       ? 
1 1 1    7    3   30 o    962.6    3.4    0.0000   0.0000          ?        ?  9266.8643  65.1292          ?        ?      962.6        3.4       ?       ? 
1 1 1    7    3   31 f    864.7    3.6    0.0000   0.0000          ?        ?  7477.7266  61.9366          ?        ?      864.7        3.6       ?       ? 
1 1 1    7    3   32 o    932.1    3.4    0.0000   0.0000          ?        ?  8689.0029  63.2136          ?        ?      932.1        3.4       ?       ? 
1 1 1    7    3   33 o   1675.5    6.2    0.0000   0.0000          ?        ? 28076.4355 206.8810          ?        ?     1675.5        6.2       ?       ? 
1 1 1    7    3   34 o    914.4    3.6    0.0000   0.0000          ?        ?  8361.4404  66.4062          ?        ?      914.4        3.6       ?       ? 
1 1 1    7    3   35 o   1558.1    5.3    0.0000   0.0000          ?        ? 24277.8691 166.6541          ?        ?     1558.1        5.3       ?       ? 
1 1 1    7    3   36 o    343.4    2.9    0.0000   0.0000          ?        ?  1179.3494  19.7942          ?        ?      343.4        2.9       ?       ? 
1 1 1    7    3   37 o   1361.5    4.6    0.0000   0.0000          ?        ? 18536.9219 125.7888          ?        ?     1361.5        4.6       ?       ? 
1 1 1    7    3   38 o    821.5    3.1    0.0000   0.0000          ?        ?  6748.5352  51.0817          ?        ?      821.5        3.1       ?       ? 
1 1 1    7    3   39 o   1195.8    4.1    0.0000   0.0000          ?        ? 14300.9688  97.0553          ?        ?     1195.8        4.1       ?       ? 
1 1 1    7    3   40 o    615.7    2.9    0.0000   0.0000          ?        ?  3790.9031  35.1187          ?        ?      615.7        2.9       ?       ? 
1 1 1    7    3   41 o    538.3    2.7    0.0000   0.0000          ?        ?  2898.2495  29.3720          ?        ?      538.3        2.7       ?       ? 
1 1 1    7    3   42 o    683.8    2.7    0.0000   0.0000          ?        ?  4675.8936  37.0343          ?        ?      683.8        2.7       ?       ? 
1 1 1    7    3   43 o    564.5    2.8    0.0000   0.0000          ?        ?  3186.2229  31.2876          ?        ?      564.5        2.8       ?       ? 
1 1 1    7    3   44 o    175.6    5.1    0.0000   0.0000          ?        ?   308.4059  17.8786          ?        ?      175.6        5.1       ?       ? 
1 1 1    7    3   45 o    555.4    2.8    0.0000   0.0000          ?        ?  3084.6980  31.2876          ?        ?      555.4        2.8       ?       ? 
1 1 1    7    3   46 o    995.9    3.5    0.0000   0.0000          ?        ?  9918.7949  70.2374          ?        ?      995.9        3.5       ?       ? 
1 1 1    7    3   47 o    876.6    3.3    0.0000   0.0000          ?        ?  7685.2461  58.1055          ?        ?      876.6        3.3       ?       ? 
1 1 1    7    3   48 o    507.6    2.6    0.0000   0.0000          ?        ?  2576.4348  26.8179          ?        ?      507.6        2.6       ?       ? 
1 1 1    7    3   49 o    320.9    3.3    0.0000   0.0000          ?        ?  1029.9354  21.0712          ?        ?      320.9        3.3       ?       ? 
1 1 1    7    3   50 o    734.9    2.9    0.0000   0.0000          ?        ?  5401.8931  42.7809          ?        ?      734.9        2.9       ?       ? 
1 1 1    7    3   51 o    537.7    2.7    0.0000   0.0000          ?        ?  2891.2258  28.7335          ?        ?      537.7        2.7       ?       ? 
1 1 1    7    3   52 o    378.1    3.0    0.0000   0.0000          ?        ?  1429.6499  22.9868          ?        ?      378.1        3.0       ?       ? 
1 1 1    7    3   53 o    226.1    4.2    0.0000   0.0000          ?        ?   511.4558  19.1556          ?        ?      226.1        4.2       ?       ? 
1 1 1    7    3   54 o    450.9    2.8    0.0000   0.0000          ?        ?  2033.6914  24.9023          ?        ?      450.9        2.8       ?       ? 
1 1 1    7    3   55 o    414.7    2.8    0.0000   0.0000          ?        ?  1720.1772  23.6253          ?        ?      414.7        2.8       ?       ? 
1 1 1    7    3   56 o    442.9    2.8    0.0000   0.0000          ?        ?  1962.1769  24.9023          ?        ?      442.9        2.8       ?       ? 
1 1 1    7    3   57 o    201.1    4.9    0.0000   0.0000          ?        ?   404.8227  19.7942          ?        ?      201.1        4.9       ?       ? 
1 1 1    7    3   58 o    108.3    9.7    0.0000   0.0000          ?        ?   117.4880  21.0712          ?        ?      108.3        9.7       ?       ? 
1 1 1    7    3   59 f    374.7    3.2    0.0000   0.0000          ?        ?  1404.1090  24.2638          ?        ?      374.7        3.2       ?       ? 
1 1 1    7    3   60 o    412.3    2.8    0.0000   0.0000          ?        ?  1700.3831  22.9868          ?        ?      412.3        2.8       ?       ? 
1 1 1    7    3   61 o     63.4   15.3    0.0000   0.0000          ?        ?    42.1424  19.1556          ?        ?       63.4       15.3       ?       ? 
1 1 1    7    3   62 o    181.6    5.8    0.0000   0.0000          ?        ?   330.1157  21.0712          ?        ?      181.6        5.8       ?       ? 
1 1 1    7    3   63 o    452.3    3.0    0.0000   0.0000          ?        ?  2046.4618  26.8179          ?        ?      452.3        3.0       ?       ? 
1 1 1    7    3   64 o    282.8    4.0    0.0000   0.0000          ?        ?   800.0676  22.3483          ?        ?      282.8        4.0       ?       ? 
1 1 1    7    3   65 o    260.8    4.0    0.0000   0.0000          ?        ?   680.6641  21.0712          ?        ?      260.8        4.0       ?       ? 
1 1 1    7    3   66 o    333.0    3.5    0.0000   0.0000          ?        ?  1109.7506  22.9868          ?        ?      333.0        3.5       ?       ? 
1 1 1    7    3   67 o    128.6    7.9    0.0000   0.0000          ?        ?   166.0156  20.4327          ?        ?      128.6        7.9       ?       ? 
1 1 1    7    3   68 o    179.4    5.7    0.0000   0.0000          ?        ?   322.4534  20.4327          ?        ?      179.4        5.7       ?       ? 
1 1 1    7    3   69 o     97.5   10.8    0.0000   0.0000          ?        ?    95.7782  21.0712          ?        ?       97.5       10.8       ?       ? 
1 1 1    7    3   70 f    204.8    5.0    0.0000   0.0000          ?        ?   420.1472  20.4327          ?        ?      204.8        5.0       ?       ? 
1 1 1    7    3   71 o    105.0   10.3    0.0000   0.0000          ?        ?   111.1028  21.7097          ?        ?      105.0       10.3       ?       ? 
1 1 1    7    3   72 o    192.7    5.3    0.0000   0.0000          ?        ?   372.2581  20.4327          ?        ?      192.7        5.3       ?       ? 
1 1 1    7    3   73 f     89.5   12.1    0.0000   0.0000          ?        ?    81.0922  21.7097          ?        ?       89.5       12.1       ?       ? 
1 1 1    7    3   74 o    195.7    6.0    0.0000   0.0000          ?        ?   384.3900  23.6253          ?        ?      195.7        6.0       ?       ? 
1 1 1    7    3   75 o     47.6   17.4    0.0000   0.0000          ?        ?    19.1556  21.7097          ?        ?       47.6       17.4       ?       ? 
1 1 1    7    3   76 o     92.9   11.3    0.0000   0.0000          ?        ?    87.4775  21.0712          ?        ?       92.9       11.3       ?       ? 
1 1 1    7    3   77 o    205.4    5.1    0.0000   0.0000          ?        ?   423.3398  21.0712          ?        ?      205.4        5.1       ?       ? 
1 1 1    7    3   78 f    158.3    7.3    0.0000   0.0000          ?        ?   252.2160  22.9868          ?        ?      158.3        7.3       ?       ? 
1 1 1    7    3   79 o     77.1   14.6    0.0000   0.0000          ?        ?    63.2136  21.7097          ?        ?       77.1       14.6       ?       ? 
1 1 1    7    3   80 o    143.5    8.0    0.0000   0.0000          ?        ?   208.1580  22.9868          ?        ?      143.5        8.0       ?       ? 
1 1 1    7    3   81 o    166.0    6.3    0.0000   0.0000          ?        ?   277.7569  21.0712          ?        ?      166.0        6.3       ?       ? 
1 1 1    7    3   82 o     63.4   16.1    0.0000   0.0000          ?        ?    44.0580  20.4327          ?        ?       63.4       16.1       ?       ? 
1 1 1    7    4    0 o   1973.3   11.1 38948.5391 438.6643 38948.5391 438.6643 38948.5391 438.6643     1973.3     11.1     1973.3       11.1     0.0     0.0 
1 1 1    7    4    1 f   1251.2    4.8    0.0000   0.0000          ?        ? 15655.9111 119.4035          ?        ?     1251.2        4.8       ?       ? 
1 1 1    7    4    2 o    965.3    3.8    0.0000   0.0000          ?        ?  9319.2227  72.7915          ?        ?      965.3        3.8       ?       ? 
1 1 1    7    4    3 o   1436.9    5.2    0.0000   0.0000          ?        ? 20647.2363 148.1370          ?        ?     1436.9        5.2       ?       ? 
1 1 1    7    4    4 o    732.4    2.7    0.0000   0.0000          ?        ?  5364.2202  38.9498          ?        ?      732.4        2.7       ?       ? 
1 1 1    7    4    5 o   1111.8    4.0    0.0000   0.0000          ?        ? 12361.7783  89.3930          ?        ?     1111.8        4.0       ?       ? 
1 1 1    7    4    6 o   1264.8    4.3    0.0000   0.0000          ?        ? 15998.1592 107.9102          ?        ?     1264.8        4.3       ?       ? 
1 1 1    7    4    7 o   1188.8    4.1    0.0000   0.0000          ?        ? 14133.0371  96.4168          ?        ?     1188.8        4.1       ?       ? 
1 1 1    7    4    8 o   1223.5    4.1    0.0000   0.0000          ?        ? 14971.4160 100.8864          ?        ?     1223.5        4.1       ?       ? 
1 1 1    7    4    9 o   1658.0    5.5    0.0000   0.0000          ?        ? 27490.9102 181.3401          ?        ?     1658.0        5.5       ?       ? 
1 1 1    7    4   10 o   1125.0    3.8    0.0000   0.0000          ?        ? 12656.1367  84.9234          ?        ?     1125.0        3.8       ?       ? 
1 1 1    7    4   11 o    712.8    2.6    0.0000   0.0000          ?        ?  5081.3550  36.3957          ?        ?      712.8        2.6       ?       ? 
1 1 1    7    4   12 o    810.2    2.8    0.0000   0.0000          ?        ?  6564.6406  45.9736          ?        ?      810.2        2.8       ?       ? 
1 1 1    7    4   13 o    693.2    2.5    0.0000   0.0000          ?        ?  4805.5137  35.1187          ?        ?      693.2        2.5       ?       ? 
1 1 1    7    4   14 o   1007.6    3.4    0.0000   0.0000          ?        ? 10153.7705  68.3218          ?        ?     1007.6        3.4       ?       ? 
1 1 1    7    4   15 o   1140.3    3.8    0.0000   0.0000          ?        ? 13002.8545  86.8389          ?        ?     1140.3        3.8       ?       ? 
1 1 1    7    4   16 o    198.0    1.6    0.0000   0.0000          ?        ?   392.0523   6.3852          ?        ?      198.0        1.6       ?       ? 
1 1 1    7    4   17 o    826.4    2.9    0.0000   0.0000          ?        ?  6829.6270  47.2506          ?        ?      826.4        2.9       ?       ? 
1 1 1    7    4   18 o    951.0    3.3    0.0000   0.0000          ?        ?  9045.2969  61.9366          ?        ?      951.0        3.3       ?       ? 
1 1 1    7    4   19 o    891.9    3.1    0.0000   0.0000          ?        ?  7955.9795  56.1899          ?        ?      891.9        3.1       ?       ? 
1 1 1    7    4   20 o    855.8    2.9    0.0000   0.0000          ?        ?  7323.8433  50.4432          ?        ?      855.8        2.9       ?       ? 
1 1 1    7    4   21 o    663.6    2.5    0.0000   0.0000          ?        ?  4403.2451  33.2031          ?        ?      663.6        2.5       ?       ? 
1 1 1    7    4   22 o   1846.1    6.0    0.0000   0.0000          ?        ? 34087.4766 220.9285          ?        ?     1846.1        6.0       ?       ? 
1 1 1    7    4   23 o    666.4    2.5    0.0000   0.0000          ?        ?  4440.9180  33.8416          ?        ?      666.4        2.5       ?       ? 
1 1 1    7    4   24 o    915.3    3.2    0.0000   0.0000          ?        ?  8377.4033  58.7440          ?        ?      915.3        3.2       ?       ? 
1 1 1    7    4   25 o    515.6    2.2    0.0000   0.0000          ?        ?  2658.8040  22.3483          ?        ?      515.6        2.2       ?       ? 
1 1 1    7    4   26 o    958.8    3.3    0.0000   0.0000          ?        ?  9192.7959  63.8522          ?        ?      958.8        3.3       ?       ? 
1 1 1    7    4   27 o   1619.4    5.4    0.0000   0.0000          ?        ? 26228.5547 175.5934          ?        ?     1619.4        5.4       ?       ? 
1 1 1    7    4   28 o    548.9    2.3    0.0000   0.0000          ?        ?  3013.1836  25.5409          ?        ?      548.9        2.3       ?       ? 
1 1 1    7    4   29 o   1968.5    6.4    0.0000   0.0000          ?        ? 38756.9844 250.9390          ?        ?     1968.5        6.4       ?       ? 
1 1 1    7    4   30 o    766.6    2.9    0.0000   0.0000          ?        ?  5876.3145  44.6965          ?        ?      766.6        2.9       ?       ? 
1 1 1    7    4   31 o   1328.1    4.8    0.0000   0.0000          ?        ? 17639.7988 126.4273          ?        ?     1328.1        4.8       ?       ? 
1 1 1    7    4   32 o    722.8    2.7    0.0000   0.0000          ?        ?  5225.0225  39.5883          ?        ?      722.8        2.7       ?       ? 
1 1 1    7    4   33 o    256.9    3.7    0.0000   0.0000          ?        ?   660.2314  19.1556          ?        ?      256.9        3.7       ?       ? 
1 1 1    7    4   34 o    234.7    3.3    0.0000   0.0000          ?        ?   551.0442  15.3245          ?        ?      234.7        3.3       ?       ? 
1 1 1    7    4   35 o   1266.7    4.6    0.0000   0.0000          ?        ? 16046.6875 116.2109          ?        ?     1266.7        4.6       ?       ? 
1 1 1    7    4   36 o   1214.4    4.1    0.0000   0.0000          ?        ? 14747.2959  98.9709          ?        ?     1214.4        4.1       ?       ? 
1 1 1    7    4   37 o    867.9    3.2    0.0000   0.0000          ?        ?  7532.0010  55.5514          ?        ?      867.9        3.2       ?       ? 
1 1 1    7    4   38 o    146.7    6.1    0.0000   0.0000          ?        ?   215.1818  17.8786          ?        ?      146.7        6.1       ?       ? 
1 1 1    7    4   39 o    624.7    2.9    0.0000   0.0000          ?        ?  3902.6443  36.3957          ?        ?      624.7        2.9       ?       ? 
1 1 1    7    4   40 o   1343.3    4.5    0.0000   0.0000          ?        ? 18046.5371 120.6806          ?        ?     1343.3        4.5       ?       ? 
1 1 1    7    4   41 f    962.3    3.4    0.0000   0.0000          ?        ?  9259.8398  65.7677          ?        ?      962.3        3.4       ?       ? 
1 1 1    7    4   42 o    533.0    2.6    0.0000   0.0000          ?        ?  2841.4211  27.4564          ?        ?      533.0        2.6       ?       ? 
1 1 1    7    4   43 o    786.2    3.0    0.0000   0.0000          ?        ?  6182.1665  47.2506          ?        ?      786.2        3.0       ?       ? 
1 1 1    7    4   44 o    760.4    2.9    0.0000   0.0000          ?        ?  5783.0903  44.6965          ?        ?      760.4        2.9       ?       ? 
1 1 1    7    4   45 o    663.0    2.8    0.0000   0.0000          ?        ?  4395.5830  37.0343          ?        ?      663.0        2.8       ?       ? 
1 1 1    7    4   46 f    681.7    2.9    0.0000   0.0000          ?        ?  4647.1602  39.5883          ?        ?      681.7        2.9       ?       ? 
1 1 1    7    4   47 o    455.5    2.7    0.0000   0.0000          ?        ?  2074.5566  24.9023          ?        ?      455.5        2.7       ?       ? 
1 1 1    7    4   48 o   1082.1    3.8    0.0000   0.0000          ?        ? 11711.1250  81.7308          ?        ?     1082.1        3.8       ?       ? 
1 1 1    7    4   49 f    325.9    3.2    0.0000   0.0000          ?        ?  1062.5000  21.0712          ?        ?      325.9        3.2       ?       ? 
1 1 1    7    4   50 o    594.9    3.0    0.0000   0.0000          ?        ?  3539.9641  35.1187          ?        ?      594.9        3.0       ?       ? 
1 1 1    7    4   51 o    815.2    3.1    0.0000   0.0000          ?        ?  6646.3716  49.8047          ?        ?      815.2        3.1       ?       ? 
1 1 1    7    4   52 o    845.6    3.3    0.0000   0.0000          ?        ?  7152.0806  55.5514          ?        ?      845.6        3.3       ?       ? 
1 1 1    7    4   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    4   54 o    501.4    2.6    0.0000   0.0000          ?        ?  2513.8596  26.1794          ?        ?      501.4        2.6       ?       ? 
1 1 1    7    4   55 o    402.6    3.2    0.0000   0.0000          ?        ?  1621.2064  25.5409          ?        ?      402.6        3.2       ?       ? 
1 1 1    7    4   56 o    319.5    3.4    0.0000   0.0000          ?        ?  1020.9960  21.7097          ?        ?      319.5        3.4       ?       ? 
1 1 1    7    4   57 o    713.1    3.1    0.0000   0.0000          ?        ?  5085.8247  44.0580          ?        ?      713.1        3.1       ?       ? 
1 1 1    7    4   58 o    133.6    7.4    0.0000   0.0000          ?        ?   178.7861  19.7942          ?        ?      133.6        7.4       ?       ? 
1 1 1    7    4   59 o    515.6    2.7    0.0000   0.0000          ?        ?  2658.8040  28.0950          ?        ?      515.6        2.7       ?       ? 
1 1 1    7    4   60 o    440.5    2.8    0.0000   0.0000          ?        ?  1941.1057  24.9023          ?        ?      440.5        2.8       ?       ? 
1 1 1    7    4   61 o    236.2    4.5    0.0000   0.0000          ?        ?   558.0679  21.0712          ?        ?      236.2        4.5       ?       ? 
1 1 1    7    4   62 o     38.9   15.9    0.0000   0.0000          ?        ?     5.1082  19.7942          ?        ?       38.9       15.9       ?       ? 
1 1 1    7    4   63 o    357.5    3.2    0.0000   0.0000          ?        ?  1278.3203  22.9868          ?        ?      357.5        3.2       ?       ? 
1 1 1    7    4   64 o     93.6   10.6    0.0000   0.0000          ?        ?    88.1160  19.7942          ?        ?       93.6       10.6       ?       ? 
1 1 1    7    4   65 o    279.4    3.8    0.0000   0.0000          ?        ?   780.9120  21.0712          ?        ?      279.4        3.8       ?       ? 
1 1 1    7    4   66 o    429.9    2.8    0.0000   0.0000          ?        ?  1848.5201  24.2638          ?        ?      429.9        2.8       ?       ? 
1 1 1    7    4   67 o    323.5    3.5    0.0000   0.0000          ?        ?  1047.1754  22.3483          ?        ?      323.5        3.5       ?       ? 
1 1 1    7    4   68 o    102.0   10.0    0.0000   0.0000          ?        ?   104.7175  20.4327          ?        ?      102.0       10.0       ?       ? 
1 1 1    7    4   69 o    341.6    3.1    0.0000   0.0000          ?        ?  1167.8560  21.0712          ?        ?      341.6        3.1       ?       ? 
1 1 1    7    4   70 o    185.3    5.7    0.0000   0.0000          ?        ?   344.1632  21.0712          ?        ?      185.3        5.7       ?       ? 
1 1 1    7    4   71 f    156.1    7.4    0.0000   0.0000          ?        ?   244.5538  22.9868          ?        ?      156.1        7.4       ?       ? 
1 1 1    7    4   72 o    386.8    3.1    0.0000   0.0000          ?        ?  1497.3333  24.2638          ?        ?      386.8        3.1       ?       ? 
1 1 1    7    4   73 o    216.2    5.3    0.0000   0.0000          ?        ?   468.6749  22.9868          ?        ?      216.2        5.3       ?       ? 
1 1 1    7    4   74 o    419.5    3.2    0.0000   0.0000          ?        ?  1761.0426  26.8179          ?        ?      419.5        3.2       ?       ? 
1 1 1    7    4   75 o     65.2   16.6    0.0000   0.0000          ?        ?    45.3350  21.7097          ?        ?       65.2       16.6       ?       ? 
1 1 1    7    4   76 o    184.8    5.9    0.0000   0.0000          ?        ?   342.8861  21.7097          ?        ?      184.8        5.9       ?       ? 
1 1 1    7    4   77 o     53.3   17.8    0.0000   0.0000          ?        ?    28.0950  22.3483          ?        ?       53.3       17.8       ?       ? 
1 1 1    7    4   78 o     93.8   11.2    0.0000   0.0000          ?        ?    89.3930  21.0712          ?        ?       93.8       11.2       ?       ? 
1 1 1    7    4   79 f     42.6   16.8    0.0000   0.0000          ?        ?    11.4934  21.0712          ?        ?       42.6       16.8       ?       ? 
1 1 1    7    4   80 o    125.5    8.9    0.0000   0.0000          ?        ?   159.6304  22.3483          ?        ?      125.5        8.9       ?       ? 
1 1 1    7    4   81 f     77.8   14.1    0.0000   0.0000          ?        ?    64.4907  21.0712          ?        ?       77.8       14.1       ?       ? 
1 1 1    7    5    0 o   1198.6    6.5 14368.6523 156.4378 14368.6523 156.4378 14368.6523 156.4378     1198.6      6.5     1198.6        6.5     0.0     0.0 
1 1 1    7    5    1 o   1123.8    4.3    0.0000   0.0000          ?        ? 12630.5957  97.6938          ?        ?     1123.8        4.3       ?       ? 
1 1 1    7    5    2 o   1203.5    4.6    0.0000   0.0000          ?        ? 14484.2236 111.1028          ?        ?     1203.5        4.6       ?       ? 
1 1 1    7    5    3 f   1786.7    6.7    0.0000   0.0000          ?        ? 31926.7207 238.8071          ?        ?     1786.7        6.7       ?       ? 
1 1 1    7    5    4 o    504.4    2.1    0.0000   0.0000          ?        ?  2543.8701  21.0712          ?        ?      504.4        2.1       ?       ? 
1 1 1    7    5    5 o   1452.9    4.7    0.0000   0.0000          ?        ? 21111.4414 137.9207          ?        ?     1452.9        4.7       ?       ? 
1 1 1    7    5    6 o   1654.7    5.3    0.0000   0.0000          ?        ? 27381.0859 176.8705          ?        ?     1654.7        5.3       ?       ? 
1 1 1    7    5    7 o    584.0    2.1    0.0000   0.0000          ?        ?  3410.9827  24.9023          ?        ?      584.0        2.1       ?       ? 
1 1 1    7    5    8 o   1401.5    4.7    0.0000   0.0000          ?        ? 19642.2012 132.1740          ?        ?     1401.5        4.7       ?       ? 
1 1 1    7    5    9 o    885.0    3.0    0.0000   0.0000          ?        ?  7832.7446  52.9973          ?        ?      885.0        3.0       ?       ? 
1 1 1    7    5   10 o   1391.9    4.5    0.0000   0.0000          ?        ? 19374.6621 126.4273          ?        ?     1391.9        4.5       ?       ? 
1 1 1    7    5   11 o   1516.8    5.0    0.0000   0.0000          ?        ? 23007.2109 150.6911          ?        ?     1516.8        5.0       ?       ? 
1 1 1    7    5   12 o    468.9    1.8    0.0000   0.0000          ?        ?  2199.0684  17.2401          ?        ?      468.9        1.8       ?       ? 
1 1 1    7    5   13 o    171.6    1.7    0.0000   0.0000          ?        ?   294.3585   5.7467          ?        ?      171.6        1.7       ?       ? 
1 1 1    7    5   14 o   2482.5    7.9    0.0000   0.0000          ?        ? 61642.8789 392.6908          ?        ?     2482.5        7.9       ?       ? 
1 1 1    7    5   15 o    919.8    3.2    0.0000   0.0000          ?        ?  8460.4111  58.1055          ?        ?      919.8        3.2       ?       ? 
1 1 1    7    5   16 o   1569.6    5.1    0.0000   0.0000          ?        ? 24639.2734 160.2689          ?        ?     1569.6        5.1       ?       ? 
1 1 1    7    5   17 o    322.0    1.6    0.0000   0.0000          ?        ?  1036.9591  10.2163          ?        ?      322.0        1.6       ?       ? 
1 1 1    7    5   18 o    999.8    3.6    0.0000   0.0000          ?        ?  9997.3330  72.1529          ?        ?      999.8        3.6       ?       ? 
1 1 1    7    5   19 o    635.7    2.3    0.0000   0.0000          ?        ?  4041.2036  29.3720          ?        ?      635.7        2.3       ?       ? 
1 1 1    7    5   20 o    387.3    1.7    0.0000   0.0000          ?        ?  1499.8872  13.4090          ?        ?      387.3        1.7       ?       ? 
1 1 1    7    5   21 f    899.3    3.2    0.0000   0.0000          ?        ?  8087.5146  58.1055          ?        ?      899.3        3.2       ?       ? 
1 1 1    7    5   22 o   1445.8    4.8    0.0000   0.0000          ?        ? 20904.5586 137.9207          ?        ?     1445.8        4.8       ?       ? 
1 1 1    7    5   23 o   1297.2    4.4    0.0000   0.0000          ?        ? 16828.2383 113.0183          ?        ?     1297.2        4.4       ?       ? 
1 1 1    7    5   24 o    382.9    1.9    0.0000   0.0000          ?        ?  1466.0457  14.6860          ?        ?      382.9        1.9       ?       ? 
1 1 1    7    5   25 o    750.3    2.9    0.0000   0.0000          ?        ?  5629.8452  42.7809          ?        ?      750.3        2.9       ?       ? 
1 1 1    7    5   26 o   1491.0    4.9    0.0000   0.0000          ?        ? 22232.6836 146.2215          ?        ?     1491.0        4.9       ?       ? 
1 1 1    7    5   27 o    374.3    2.0    0.0000   0.0000          ?        ?  1400.9164  15.3245          ?        ?      374.3        2.0       ?       ? 
1 1 1    7    5   28 o    328.8    2.0    0.0000   0.0000          ?        ?  1081.0171  13.4090          ?        ?      328.8        2.0       ?       ? 
1 1 1    7    5   29 o    384.6    2.3    0.0000   0.0000          ?        ?  1479.4546  17.8786          ?        ?      384.6        2.3       ?       ? 
1 1 1    7    5   30 o   2383.9    8.6    0.0000   0.0000          ?        ? 56845.6680 409.9309          ?        ?     2383.9        8.6       ?       ? 
1 1 1    7    5   31 o   1000.0    3.6    0.0000   0.0000          ?        ?  9999.8867  72.7915          ?        ?     1000.0        3.6       ?       ? 
1 1 1    7    5   32 o    512.9    2.6    0.0000   0.0000          ?        ?  2630.7090  26.8179          ?        ?      512.9        2.6       ?       ? 
1 1 1    7    5   33 o   1888.4    6.9    0.0000   0.0000          ?        ? 35663.9844 259.2398          ?        ?     1888.4        6.9       ?       ? 
1 1 1    7    5   34 o    793.0    3.2    0.0000   0.0000          ?        ?  6288.1611  50.4432          ?        ?      793.0        3.2       ?       ? 
1 1 1    7    5   35 o   1059.6    3.8    0.0000   0.0000          ?        ? 11228.4023  80.4537          ?        ?     1059.6        3.8       ?       ? 
1 1 1    7    5   36 o    757.6    3.2    0.0000   0.0000          ?        ?  5739.0322  47.8891          ?        ?      757.6        3.2       ?       ? 
1 1 1    7    5   37 o    823.5    3.2    0.0000   0.0000          ?        ?  6782.3765  52.9973          ?        ?      823.5        3.2       ?       ? 
1 1 1    7    5   38 o   1429.7    4.9    0.0000   0.0000          ?        ? 20442.2695 139.8362          ?        ?     1429.7        4.9       ?       ? 
1 1 1    7    5   39 o   1686.4    5.6    0.0000   0.0000          ?        ? 28443.5859 190.2794          ?        ?     1686.4        5.6       ?       ? 
1 1 1    7    5   40 o   1146.6    4.1    0.0000   0.0000          ?        ? 13147.7998  93.2242          ?        ?     1146.6        4.1       ?       ? 
1 1 1    7    5   41 o    378.9    2.8    0.0000   0.0000          ?        ?  1436.0352  21.0712          ?        ?      378.9        2.8       ?       ? 
1 1 1    7    5   42 o    276.6    3.2    0.0000   0.0000          ?        ?   764.9489  17.8786          ?        ?      276.6        3.2       ?       ? 
1 1 1    7    5   43 o    363.6    3.0    0.0000   0.0000          ?        ?  1322.3783  21.7097          ?        ?      363.6        3.0       ?       ? 
1 1 1    7    5   44 o    418.9    2.8    0.0000   0.0000          ?        ?  1754.6573  23.6253          ?        ?      418.9        2.8       ?       ? 
1 1 1    7    5   45 o    329.7    3.3    0.0000   0.0000          ?        ?  1087.4023  21.7097          ?        ?      329.7        3.3       ?       ? 
1 1 1    7    5   46 o   1090.1    3.8    0.0000   0.0000          ?        ? 11884.1641  83.0078          ?        ?     1090.1        3.8       ?       ? 
1 1 1    7    5   47 o    919.4    3.4    0.0000   0.0000          ?        ?  8453.3877  62.5751          ?        ?      919.4        3.4       ?       ? 
1 1 1    7    5   48 o    124.3    7.7    0.0000   0.0000          ?        ?   154.5222  19.1556          ?        ?      124.3        7.7       ?       ? 
1 1 1    7    5   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    5   50 o    311.3    3.6    0.0000   0.0000          ?        ?   969.2759  22.3483          ?        ?      311.3        3.6       ?       ? 
1 1 1    7    5   51 o    420.8    2.7    0.0000   0.0000          ?        ?  1770.6204  22.9868          ?        ?      420.8        2.7       ?       ? 
1 1 1    7    5   52 o    413.0    2.9    0.0000   0.0000          ?        ?  1705.4913  23.6253          ?        ?      413.0        2.9       ?       ? 
1 1 1    7    5   53 o    409.8    3.0    0.0000   0.0000          ?        ?  1679.9504  24.9023          ?        ?      409.8        3.0       ?       ? 
1 1 1    7    5   54 o    476.6    3.1    0.0000   0.0000          ?        ?  2271.8599  30.0105          ?        ?      476.6        3.1       ?       ? 
1 1 1    7    5   55 o    356.2    3.3    0.0000   0.0000          ?        ?  1269.3810  23.6253          ?        ?      356.2        3.3       ?       ? 
1 1 1    7    5   56 o    881.9    3.4    0.0000   0.0000          ?        ?  7779.7476  59.3825          ?        ?      881.9        3.4       ?       ? 
1 1 1    7    5   57 o    513.9    2.7    0.0000   0.0000          ?        ?  2640.9255  28.0950          ?        ?      513.9        2.7       ?       ? 
1 1 1    7    5   58 o    606.6    2.7    0.0000   0.0000          ?        ?  3680.4387  33.2031          ?        ?      606.6        2.7       ?       ? 
1 1 1    7    5   59 o    156.3    6.5    0.0000   0.0000          ?        ?   244.5538  20.4327          ?        ?      156.3        6.5       ?       ? 
1 1 1    7    5   60 f     96.7    9.9    0.0000   0.0000          ?        ?    93.8627  19.1556          ?        ?       96.7        9.9       ?       ? 
1 1 1    7    5   61 o    231.9    4.4    0.0000   0.0000          ?        ?   538.2737  20.4327          ?        ?      231.9        4.4       ?       ? 
1 1 1    7    5   62 o    409.8    2.9    0.0000   0.0000          ?        ?  1679.9504  23.6253          ?        ?      409.8        2.9       ?       ? 
1 1 1    7    5   63 o    109.7    9.0    0.0000   0.0000          ?        ?   120.6806  19.7942          ?        ?      109.7        9.0       ?       ? 
1 1 1    7    5   64 o    501.4    2.8    0.0000   0.0000          ?        ?  2514.4980  28.0950          ?        ?      501.4        2.8       ?       ? 
1 1 1    7    5   65 o    332.3    3.4    0.0000   0.0000          ?        ?  1104.6425  22.3483          ?        ?      332.3        3.4       ?       ? 
1 1 1    7    5   66 o    420.2    3.0    0.0000   0.0000          ?        ?  1766.7894  24.9023          ?        ?      420.2        3.0       ?       ? 
1 1 1    7    5   67 o    205.9    5.0    0.0000   0.0000          ?        ?   424.6169  20.4327          ?        ?      205.9        5.0       ?       ? 
1 1 1    7    5   68 o    190.6    5.2    0.0000   0.0000          ?        ?   363.9573  19.7942          ?        ?      190.6        5.2       ?       ? 
1 1 1    7    5   69 o    256.2    4.1    0.0000   0.0000          ?        ?   657.0388  21.0712          ?        ?      256.2        4.1       ?       ? 
1 1 1    7    5   70 o    105.4   10.0    0.0000   0.0000          ?        ?   111.7413  21.0712          ?        ?      105.4       10.0       ?       ? 
1 1 1    7    5   71 o     95.2   10.7    0.0000   0.0000          ?        ?    91.3086  20.4327          ?        ?       95.2       10.7       ?       ? 
1 1 1    7    5   72 o     92.4   11.8    0.0000   0.0000          ?        ?    86.2004  21.7097          ?        ?       92.4       11.8       ?       ? 
1 1 1    7    5   73 o     24.9   12.3    0.0000   0.0000          ?        ?   -45.9736  21.7097          ?        ?       24.9       12.3       ?       ? 
1 1 1    7    5   74 o    326.1    3.6    0.0000   0.0000          ?        ?  1064.4155  23.6253          ?        ?      326.1        3.6       ?       ? 
1 1 1    7    5   75 o     32.0   14.5    0.0000   0.0000          ?        ?   -12.1319  20.4327          ?        ?       32.0       14.5       ?       ? 
1 1 1    7    5   76 o    187.1    6.5    0.0000   0.0000          ?        ?   351.8254  24.2638          ?        ?      187.1        6.5       ?       ? 
1 1 1    7    5   77 o    120.6    8.7    0.0000   0.0000          ?        ?   146.8600  21.0712          ?        ?      120.6        8.7       ?       ? 
1 1 1    7    5   78 o    201.3    5.1    0.0000   0.0000          ?        ?   406.7383  20.4327          ?        ?      201.3        5.1       ?       ? 
1 1 1    7    5   79 o     38.6   16.7    0.0000   0.0000          ?        ?    -1.2770  23.6253          ?        ?       38.6       16.7       ?       ? 
1 1 1    7    5   80 o    115.3    8.6    0.0000   0.0000          ?        ?   134.7281  19.7942          ?        ?      115.3        8.6       ?       ? 
1 1 1    7    5   81 o     60.5   18.1    0.0000   0.0000          ?        ?    39.5883  23.6253          ?        ?       60.5       18.1       ?       ? 
1 1 1    7    6    0 o    819.8    4.8 6721.0786  77.8996  6721.0786  77.8996  6721.0786  77.8996      819.8      4.8      819.8        4.8     0.0     0.0 
1 1 1    7    6    1 o   1110.6    4.3    0.0000   0.0000          ?        ? 12334.9609  96.4168          ?        ?     1110.6        4.3       ?       ? 
1 1 1    7    6    2 o    715.4    2.8    0.0000   0.0000          ?        ?  5117.7510  39.5883          ?        ?      715.4        2.8       ?       ? 
1 1 1    7    6    3 o   1719.3    6.8    0.0000   0.0000          ?        ? 29564.1914 234.9760          ?        ?     1719.3        6.8       ?       ? 
1 1 1    7    6    4 o   1200.7    4.0    0.0000   0.0000          ?        ? 14416.5420  97.0553          ?        ?     1200.7        4.0       ?       ? 
1 1 1    7    6    5 o   1349.5    4.5    0.0000   0.0000          ?        ? 18212.5527 121.9576          ?        ?     1349.5        4.5       ?       ? 
1 1 1    7    6    6 o    889.7    3.1    0.0000   0.0000          ?        ?  7915.7524  54.2743          ?        ?      889.7        3.1       ?       ? 
1 1 1    7    6    7 o    187.4    1.2    0.0000   0.0000          ?        ?   351.1869   4.4697          ?        ?      187.4        1.2       ?       ? 
1 1 1    7    6    8 o   1139.2    3.8    0.0000   0.0000          ?        ? 12977.9521  86.2004          ?        ?     1139.2        3.8       ?       ? 
1 1 1    7    6    9 o   1755.1    5.7    0.0000   0.0000          ?        ? 30807.3906 199.2188          ?        ?     1755.1        5.7       ?       ? 
1 1 1    7    6   10 f    164.2    1.4    0.0000   0.0000          ?        ?   269.4561   4.4697          ?        ?      164.2        1.4       ?       ? 
1 1 1    7    6   11 o   2540.0    8.1    0.0000   0.0000          ?        ? 64526.4375 411.2079          ?        ?     2540.0        8.1       ?       ? 
1 1 1    7    6   12 o    342.2    1.5    0.0000   0.0000          ?        ?  1171.0486  10.2163          ?        ?      342.2        1.5       ?       ? 
1 1 1    7    6   13 o   1262.8    4.2    0.0000   0.0000          ?        ? 15947.7168 105.9946          ?        ?     1262.8        4.2       ?       ? 
1 1 1    7    6   14 o    309.0    1.4    0.0000   0.0000          ?        ?   954.5898   8.9393          ?        ?      309.0        1.4       ?       ? 
1 1 1    7    6   15 o    386.1    1.7    0.0000   0.0000          ?        ?  1490.9480  12.7704          ?        ?      386.1        1.7       ?       ? 
1 1 1    7    6   16 o   1252.6    4.2    0.0000   0.0000          ?        ? 15691.0303 104.0790          ?        ?     1252.6        4.2       ?       ? 
1 1 1    7    6   17 o    177.2    1.8    0.0000   0.0000          ?        ?   314.1526   6.3852          ?        ?      177.2        1.8       ?       ? 
1 1 1    7    6   18 o    631.3    2.3    0.0000   0.0000          ?        ?  3985.0134  29.3720          ?        ?      631.3        2.3       ?       ? 
1 1 1    7    6   19 o    191.9    1.7    0.0000   0.0000          ?        ?   368.4270   6.3852          ?        ?      191.9        1.7       ?       ? 
1 1 1    7    6   20 o    668.1    2.5    0.0000   0.0000          ?        ?  4463.9043  33.2031          ?        ?      668.1        2.5       ?       ? 
1 1 1    7    6   21 o    363.5    1.7    0.0000   0.0000          ?        ?  1321.1012  12.1319          ?        ?      363.5        1.7       ?       ? 
1 1 1    7    6   22 o   1230.8    4.1    0.0000   0.0000          ?        ? 15149.5645 101.5249          ?        ?     1230.8        4.1       ?       ? 
1 1 1    7    6   23 o   1015.3    3.5    0.0000   0.0000          ?        ? 10308.2930  70.2374          ?        ?     1015.3        3.5       ?       ? 
1 1 1    7    6   24 f    206.5    2.2    0.0000   0.0000          ?        ?   426.5325   8.9393          ?        ?      206.5        2.2       ?       ? 
1 1 1    7    6   25 o    924.4    3.2    0.0000   0.0000          ?        ?  8544.6963  60.0210          ?        ?      924.4        3.2       ?       ? 
1 1 1    7    6   26 o    832.2    3.1    0.0000   0.0000          ?        ?  6926.0439  51.0817          ?        ?      832.2        3.1       ?       ? 
1 1 1    7    6   27 o    966.8    3.4    0.0000   0.0000          ?        ?  9347.9570  65.7677          ?        ?      966.8        3.4       ?       ? 
1 1 1    7    6   28 o   1781.8    5.8    0.0000   0.0000          ?        ? 31753.6797 206.8810          ?        ?     1781.8        5.8       ?       ? 
1 1 1    7    6   29 o   1474.2    4.9    0.0000   0.0000          ?        ? 21733.3594 144.9444          ?        ?     1474.2        4.9       ?       ? 
1 1 1    7    6   30 o    317.9    2.6    0.0000   0.0000          ?        ?  1010.7797  16.6016          ?        ?      317.9        2.6       ?       ? 
1 1 1    7    6   31 o    898.7    3.3    0.0000   0.0000          ?        ?  8076.6602  58.7440          ?        ?      898.7        3.3       ?       ? 
1 1 1    7    6   32 o   2345.5    8.4    0.0000   0.0000          ?        ? 55023.3242 395.8834          ?        ?     2345.5        8.4       ?       ? 
1 1 1    7    6   33 o    873.1    3.5    0.0000   0.0000          ?        ?  7622.6714  60.6596          ?        ?      873.1        3.5       ?       ? 
1 1 1    7    6   34 o    897.8    3.5    0.0000   0.0000          ?        ?  8060.0586  63.2136          ?        ?      897.8        3.5       ?       ? 
1 1 1    7    6   35 o    608.8    2.7    0.0000   0.0000          ?        ?  3705.9797  32.5646          ?        ?      608.8        2.7       ?       ? 
1 1 1    7    6   36 o    685.8    2.7    0.0000   0.0000          ?        ?  4703.9888  37.0343          ?        ?      685.8        2.7       ?       ? 
1 1 1    7    6   37 o   1299.5    4.5    0.0000   0.0000          ?        ? 16888.2578 116.2109          ?        ?     1299.5        4.5       ?       ? 
1 1 1    7    6   38 o    151.4    5.7    0.0000   0.0000          ?        ?   229.2293  17.2401          ?        ?      151.4        5.7       ?       ? 
1 1 1    7    6   39 o   1090.8    3.9    0.0000   0.0000          ?        ? 11899.4893  84.2849          ?        ?     1090.8        3.9       ?       ? 
1 1 1    7    6   40 o    376.7    2.8    0.0000   0.0000          ?        ?  1418.7950  21.0712          ?        ?      376.7        2.8       ?       ? 
1 1 1    7    6   41 o   1388.5    4.7    0.0000   0.0000          ?        ? 19280.1602 130.8969          ?        ?     1388.5        4.7       ?       ? 
1 1 1    7    6   42 o   1207.2    4.2    0.0000   0.0000          ?        ? 14574.8955 101.5249          ?        ?     1207.2        4.2       ?       ? 
1 1 1    7    6   43 o    810.8    3.1    0.0000   0.0000          ?        ?  6574.2188  49.8047          ?        ?      810.8        3.1       ?       ? 
1 1 1    7    6   44 o    326.5    3.0    0.0000   0.0000          ?        ?  1066.3312  19.7942          ?        ?      326.5        3.0       ?       ? 
1 1 1    7    6   45 o    663.5    2.8    0.0000   0.0000          ?        ?  4402.6064  37.6728          ?        ?      663.5        2.8       ?       ? 
1 1 1    7    6   46 o    228.8    4.5    0.0000   0.0000          ?        ?   523.5877  20.4327          ?        ?      228.8        4.5       ?       ? 
1 1 1    7    6   47 o     31.4   14.3    0.0000   0.0000          ?        ?   -12.7704  19.7942          ?        ?       31.4       14.3       ?       ? 
1 1 1    7    6   48 o    508.6    3.0    0.0000   0.0000          ?        ?  2587.2898  30.6490          ?        ?      508.6        3.0       ?       ? 
1 1 1    7    6   49 o    396.9    3.1    0.0000   0.0000          ?        ?  1575.2328  24.2638          ?        ?      396.9        3.1       ?       ? 
1 1 1    7    6   50 o    137.4    7.7    0.0000   0.0000          ?        ?   189.0024  21.0712          ?        ?      137.4        7.7       ?       ? 
1 1 1    7    6   51 o    809.3    3.2    0.0000   0.0000          ?        ?  6550.5938  51.0817          ?        ?      809.3        3.2       ?       ? 
1 1 1    7    6   52 f    821.1    3.1    0.0000   0.0000          ?        ?  6743.4268  51.0817          ?        ?      821.1        3.1       ?       ? 
1 1 1    7    6   53 f    303.4    3.6    0.0000   0.0000          ?        ?   920.7482  21.7097          ?        ?      303.4        3.6       ?       ? 
1 1 1    7    6   54 o    413.8    3.1    0.0000   0.0000          ?        ?  1712.5151  25.5409          ?        ?      413.8        3.1       ?       ? 
1 1 1    7    6   55 o    512.7    2.9    0.0000   0.0000          ?        ?  2628.7937  30.0105          ?        ?      512.7        2.9       ?       ? 
1 1 1    7    6   56 o    956.5    3.4    0.0000   0.0000          ?        ?  9151.2920  65.7677          ?        ?      956.5        3.4       ?       ? 
1 1 1    7    6   57 o    129.5    7.9    0.0000   0.0000          ?        ?   167.9312  20.4327          ?        ?      129.5        7.9       ?       ? 
1 1 1    7    6   58 o    494.9    2.8    0.0000   0.0000          ?        ?  2449.3689  27.4564          ?        ?      494.9        2.8       ?       ? 
1 1 1    7    6   59 o    166.6    5.7    0.0000   0.0000          ?        ?   277.7569  19.1556          ?        ?      166.6        5.7       ?       ? 
1 1 1    7    6   60 o     65.3   15.0    0.0000   0.0000          ?        ?    44.6965  19.1556          ?        ?       65.3       15.0       ?       ? 
1 1 1    7    6   61 o    137.4    7.0    0.0000   0.0000          ?        ?   189.0024  19.1556          ?        ?      137.4        7.0       ?       ? 
1 1 1    7    6   62 o     19.6    9.9    0.0000   0.0000          ?        ?   -66.4062  19.1556          ?        ?       19.6        9.9       ?       ? 
1 1 1    7    6   63 o    167.7    6.1    0.0000   0.0000          ?        ?   281.5880  20.4327          ?        ?      167.7        6.1       ?       ? 
1 1 1    7    6   64 o    264.7    4.0    0.0000   0.0000          ?        ?   701.0967  21.0712          ?        ?      264.7        4.0       ?       ? 
1 1 1    7    6   65 o    341.8    3.4    0.0000   0.0000          ?        ?  1169.1332  22.9868          ?        ?      341.8        3.4       ?       ? 
1 1 1    7    6   66 o    172.5    6.3    0.0000   0.0000          ?        ?   298.1896  21.7097          ?        ?      172.5        6.3       ?       ? 
1 1 1    7    6   67 o    225.3    4.7    0.0000   0.0000          ?        ?   508.2632  21.0712          ?        ?      225.3        4.7       ?       ? 
1 1 1    7    6   68 o    222.6    4.7    0.0000   0.0000          ?        ?   496.1313  21.0712          ?        ?      222.6        4.7       ?       ? 
1 1 1    7    6   69 o    159.8    6.8    0.0000   0.0000          ?        ?   256.0471  21.7097          ?        ?      159.8        6.8       ?       ? 
1 1 1    7    6   70 o    267.3    4.3    0.0000   0.0000          ?        ?   715.1442  22.9868          ?        ?      267.3        4.3       ?       ? 
1 1 1    7    6   71 o    308.5    3.7    0.0000   0.0000          ?        ?   952.6743  22.9868          ?        ?      308.5        3.7       ?       ? 
1 1 1    7    6   72 o    264.1    4.4    0.0000   0.0000          ?        ?   698.5427  22.9868          ?        ?      264.1        4.4       ?       ? 
1 1 1    7    6   73 o     38.4   16.3    0.0000   0.0000          ?        ?     1.2770  21.7097          ?        ?       38.4       16.3       ?       ? 
1 1 1    7    6   74 o     73.3   15.3    0.0000   0.0000          ?        ?    56.8284  21.7097          ?        ?       73.3       15.3       ?       ? 
1 1 1    7    6   75 o     92.2   12.1    0.0000   0.0000          ?        ?    86.2004  22.3483          ?        ?       92.2       12.1       ?       ? 
1 1 1    7    6   76 o     42.2   16.9    0.0000   0.0000          ?        ?     9.5778  21.7097          ?        ?       42.2       16.9       ?       ? 
1 1 1    7    6   77 o     28.1   13.4    0.0000   0.0000          ?        ?   -24.9023  20.4327          ?        ?       28.1       13.4       ?       ? 
1 1 1    7    6   78 o    127.7    8.8    0.0000   0.0000          ?        ?   164.7386  22.3483          ?        ?      127.7        8.8       ?       ? 
1 1 1    7    6   79 o     67.1   15.9    0.0000   0.0000          ?        ?    48.5276  21.0712          ?        ?       67.1       15.9       ?       ? 
1 1 1    7    6   80 o     69.5   15.9    0.0000   0.0000          ?        ?    52.3588  21.7097          ?        ?       69.5       15.9       ?       ? 
1 1 1    7    6   81 o    209.6    5.3    0.0000   0.0000          ?        ?   441.8569  22.3483          ?        ?      209.6        5.3       ?       ? 
1 1 1    7    7    0 o    924.3    8.0 8545.9736 148.7755  8545.9736 148.7755  8545.9736 148.7755      924.3      8.0      924.3        8.0     0.0     0.0 
1 1 1    7    7    1 o   2672.1   14.8 71430.7812 793.0438 71430.7812 793.0438 71430.7812 793.0438     2672.1     14.8     2672.1       14.8     0.0     0.0 
1 1 1    7    7    2 o   1414.4    7.3 20008.7148 205.6040 20008.7148 205.6040 20008.7148 205.6040     1414.4      7.3     1414.4        7.3     0.0     0.0 
1 1 1    7    7    3 o   2310.5   12.9 53401.4766 594.4636 53401.4766 594.4636 53401.4766 594.4636     2310.5     12.9     2310.5       12.9     0.0     0.0 
1 1 1    7    7    4 o    233.1    1.8  543.3819   8.3008   543.3819   8.3008   543.3819   8.3008      233.1      1.8      233.1        1.8     0.0     0.0 
1 1 1    7    7    5 o    894.0    4.7 7993.6523  84.9234  7993.6523  84.9234  7993.6523  84.9234      894.0      4.7      894.0        4.7     0.0     0.0 
1 1 1    7    7    6 o    332.3    2.1 1104.6425  14.0475  1104.6425  14.0475  1104.6425  14.0475      332.3      2.1      332.3        2.1     0.0     0.0 
1 1 1    7    7    7 o   1771.6    8.1 31391.6367 286.0577 31391.6367 286.0577 31391.6367 286.0577     1771.6      8.1     1771.6        8.1     0.0     0.0 
1 1 1    7    7    8 o    498.8    2.8 2488.3188  27.4564  2488.3188  27.4564  2488.3188  27.4564      498.8      2.8      498.8        2.8     0.0     0.0 
1 1 1    7    7    9 o   1259.0    5.9 15852.5762 148.7755 15852.5762 148.7755 15852.5762 148.7755     1259.0      5.9     1259.0        5.9     0.0     0.0 
1 1 1    7    7   10 o    821.8    4.0 6754.2822  66.4062  6754.2822  66.4062  6754.2822  66.4062      821.8      4.0      821.8        4.0     0.0     0.0 
1 1 1    7    7   11 o   1811.3    8.3 32814.2656 300.7437 32814.2656 300.7437 32814.2656 300.7437     1811.3      8.3     1811.3        8.3     0.0     0.0 
1 1 1    7    7   12 o     45.9    6.4   21.7097   5.7467    21.7097   5.7467    21.7097   5.7467       45.9      6.4       45.9        6.4     0.0     0.0 
1 1 1    7    7   13 o    399.0    2.7 1592.4729  21.7097  1592.4729  21.7097  1592.4729  21.7097      399.0      2.7      399.0        2.7     0.0     0.0 
1 1 1    7    7   14 o    645.8    3.3 4171.4619  42.7809  4171.4619  42.7809  4171.4619  42.7809      645.8      3.3      645.8        3.3     0.0     0.0 
1 1 1    7    7   15 o    486.2    2.8 2363.8071  26.8179  2363.8071  26.8179  2363.8071  26.8179      486.2      2.8      486.2        2.8     0.0     0.0 
1 1 1    7    7   16 o    826.3    4.1 6828.3506  68.3218  6828.3506  68.3218  6828.3506  68.3218      826.3      4.1      826.3        4.1     0.0     0.0 
1 1 1    7    7   17 o    726.4    3.9 5277.3813  56.1899  5277.3813  56.1899  5277.3813  56.1899      726.4      3.9      726.4        3.9     0.0     0.0 
1 1 1    7    7   18 o    475.0    2.8 2256.5354  26.8179  2256.5354  26.8179  2256.5354  26.8179      475.0      2.8      475.0        2.8     0.0     0.0 
1 1 1    7    7   19 o   2170.0    9.9 47103.7422 429.0865 47103.7422 429.0865 47103.7422 429.0865     2170.0      9.9     2170.0        9.9     0.0     0.0 
1 1 1    7    7   20 o   1202.8    5.7 14470.1768 136.0051 14470.1768 136.0051 14470.1768 136.0051     1202.8      5.7     1202.8        5.7     0.0     0.0 
1 1 1    7    7   21 o    842.8    4.2 7104.1914  71.5144  7104.1914  71.5144  7104.1914  71.5144      842.8      4.2      842.8        4.2     0.0     0.0 
1 1 1    7    7   22 o    174.4    2.9  304.5748  10.2163   304.5748  10.2163   304.5748  10.2163      174.4      2.9      174.4        2.9     0.0     0.0 
1 1 1    7    7   23 o   1601.1    7.4 25640.4746 237.5300 25640.4746 237.5300 25640.4746 237.5300     1601.1      7.4     1601.1        7.4     0.0     0.0 
1 1 1    7    7   24 o    450.9    2.8 2033.0529  24.9023  2033.0529  24.9023  2033.0529  24.9023      450.9      2.8      450.9        2.8     0.0     0.0 
1 1 1    7    7   25 o     74.0    8.4   56.8284  12.1319    56.8284  12.1319    56.8284  12.1319       74.0      8.4       74.0        8.4     0.0     0.0 
1 1 1    7    7   26 o   2707.0   15.0 73316.9688 811.5610 73316.9688 811.5610 73316.9688 811.5610     2707.0     15.0     2707.0       15.0     0.0     0.0 
1 1 1    7    7   27 o   2009.2   11.3 40381.3867 452.0733 40381.3867 452.0733 40381.3867 452.0733     2009.2     11.3     2009.2       11.3     0.0     0.0 
1 1 1    7    7   28 o   1875.3    8.6 35173.6016 322.4534 35173.6016 322.4534 35173.6016 322.4534     1875.3      8.6     1875.3        8.6     0.0     0.0 
1 1 1    7    7   29 f    775.2    4.3 6009.7656  66.4062  6009.7656  66.4062  6009.7656  66.4062      775.2      4.3      775.2        4.3     0.0     0.0 
1 1 1    7    7   30 o    207.5    4.3  431.0021  17.8786   431.0021  17.8786   431.0021  17.8786      207.5      4.3      207.5        4.3     0.0     0.0 
1 1 1    7    7   31 o    232.5    4.0  540.8278  18.5171   540.8278  18.5171   540.8278  18.5171      232.5      4.0      232.5        4.0     0.0     0.0 
1 1 1    7    7   32 o    888.0    4.9 7885.7422  86.8389  7885.7422  86.8389  7885.7422  86.8389      888.0      4.9      888.0        4.9     0.0     0.0 
1 1 1    7    7   33 o     75.0   18.7   65.7677  24.2638    65.7677  24.2638    65.7677  24.2638       75.0     18.7       75.0       18.7     0.0     0.0 
1 1 1    7    7   34 o    556.3    3.8 3094.9143  42.1424  3094.9143  42.1424  3094.9143  42.1424      556.3      3.8      556.3        3.8     0.0     0.0 
1 1 1    7    7   35 o    384.0    3.8 1474.9850  29.3720  1474.9850  29.3720  1474.9850  29.3720      384.0      3.8      384.0        3.8     0.0     0.0 
1 1 1    7    7   36 o    589.3    3.6 3472.9192  42.7809  3472.9192  42.7809  3472.9192  42.7809      589.3      3.6      589.3        3.6     0.0     0.0 
1 1 1    7    7   37 o    389.4    3.8 1517.1274  29.3720  1517.1274  29.3720  1517.1274  29.3720      389.4      3.8      389.4        3.8     0.0     0.0 
1 1 1    7    7   38 o    909.2    4.6 8267.5781  84.2849  8267.5781  84.2849  8267.5781  84.2849      909.2      4.6      909.2        4.6     0.0     0.0 
1 1 1    7    7   39 o   1465.9    6.9 21491.3613 202.4114 21491.3613 202.4114 21491.3613 202.4114     1465.9      6.9     1465.9        6.9     0.0     0.0 
1 1 1    7    7   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    7   41 o    255.4    4.8  653.2076  24.2638   653.2076  24.2638   653.2076  24.2638      255.4      4.8      255.4        4.8     0.0     0.0 
1 1 1    7    7   42 o   1021.6    5.4 10438.5518 111.1028 10438.5518 111.1028 10438.5518 111.1028     1021.6      5.4     1021.6        5.4     0.0     0.0 
1 1 1    7    7   43 o    317.6    4.9 1009.5027  31.2876  1009.5027  31.2876  1009.5027  31.2876      317.6      4.9      317.6        4.9     0.0     0.0 
1 1 1    7    7   44 o   1603.4    7.5 25713.9043 241.9997 25713.9043 241.9997 25713.9043 241.9997     1603.4      7.5     1603.4        7.5     0.0     0.0 
1 1 1    7    7   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    7   46 o    682.3    4.0 4656.7383  54.2743  4656.7383  54.2743  4656.7383  54.2743      682.3      4.0      682.3        4.0     0.0     0.0 
1 1 1    7    7   47 o   1387.7    6.6 19262.2812 184.5327 19262.2812 184.5327 19262.2812 184.5327     1387.7      6.6     1387.7        6.6     0.0     0.0 
1 1 1    7    7   48 o    119.5   11.7  146.8600  27.4564   146.8600  27.4564   146.8600  27.4564      119.5     11.7      119.5       11.7     0.0     0.0 
1 1 1    7    7   49 o   1550.4    7.3 24046.0859 227.3137 24046.0859 227.3137 24046.0859 227.3137     1550.4      7.3     1550.4        7.3     0.0     0.0 
1 1 1    7    7   50 o    829.8    4.5 6887.0942  75.3456  6887.0942  75.3456  6887.0942  75.3456      829.8      4.5      829.8        4.5     0.0     0.0 
1 1 1    7    7   51 o    940.0    5.1 8838.4160  95.7782  8838.4160  95.7782  8838.4160  95.7782      940.0      5.1      940.0        5.1     0.0     0.0 
1 1 1    7    7   52 o     31.8   20.5    2.5541  28.7335     2.5541  28.7335     2.5541  28.7335       31.8     20.5       31.8       20.5     0.0     0.0 
1 1 1    7    7   53 o    582.5    3.8 3393.7424  44.6965  3393.7424  44.6965  3393.7424  44.6965      582.5      3.8      582.5        3.8     0.0     0.0 
1 1 1    7    7   54 o    103.0   12.8  107.2716  26.8179   107.2716  26.8179   107.2716  26.8179      103.0     12.8      103.0       12.8     0.0     0.0 
1 1 1    7    7   55 o    335.2    4.7 1124.4366  31.2876  1124.4366  31.2876  1124.4366  31.2876      335.2      4.7      335.2        4.7     0.0     0.0 
1 1 1    7    7   56 o    728.1    4.3 5303.5605  61.9366  5303.5605  61.9366  5303.5605  61.9366      728.1      4.3      728.1        4.3     0.0     0.0 
1 1 1    7    7   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    7   58 o    642.1    4.4 4124.2114  56.1899  4124.2114  56.1899  4124.2114  56.1899      642.1      4.4      642.1        4.4     0.0     0.0 
1 1 1    7    7   59 o     22.6   16.2  -42.1424  31.2876   -42.1424  31.2876   -42.1424  31.2876       22.6     16.2       22.6       16.2     0.0     0.0 
1 1 1    7    7   60 o    245.4    5.7  603.4030  28.0950   603.4030  28.0950   603.4030  28.0950      245.4      5.7      245.4        5.7     0.0     0.0 
1 1 1    7    7   61 o    319.1    5.0 1019.7190  31.9261  1019.7190  31.9261  1019.7190  31.9261      319.1      5.0      319.1        5.0     0.0     0.0 
1 1 1    7    7   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    7    7   63 o    471.1    4.0 2220.7781  37.6728  2220.7781  37.6728  2220.7781  37.6728      471.1      4.0      471.1        4.0     0.0     0.0 
1 1 1    7    7   64 o     19.2   14.1  -62.5751  30.0105   -62.5751  30.0105   -62.5751  30.0105       19.2     14.1       19.2       14.1     0.0     0.0 
1 1 1    7    7   65 o     17.7   13.1  -70.2374  28.7335   -70.2374  28.7335   -70.2374  28.7335       17.7     13.1       17.7       13.1     0.0     0.0 
1 1 1    7    7   66 o     40.7   23.3   22.3483  29.3720    22.3483  29.3720    22.3483  29.3720       40.7     23.3       40.7       23.3     0.0     0.0 
1 1 1    7    7   67 o     27.4   18.7  -14.0475  30.0105   -14.0475  30.0105   -14.0475  30.0105       27.4     18.7       27.4       18.7     0.0     0.0 
1 1 1    7    7   68 o     20.4   14.8  -52.3588  30.0105   -52.3588  30.0105   -52.3588  30.0105       20.4     14.8       20.4       14.8     0.0     0.0 
1 1 1    7    7   69 o     22.7   16.3  -43.4195  31.9261   -43.4195  31.9261   -43.4195  31.9261       22.7     16.3       22.7       16.3     0.0     0.0 
1 1 1    7    7   70 o     27.8   19.1  -17.8786  32.5646   -17.8786  32.5646   -17.8786  32.5646       27.8     19.1       27.8       19.1     0.0     0.0 
1 1 1    7    7   71 o    131.1   12.6  177.5090  32.5646   177.5090  32.5646   177.5090  32.5646      131.1     12.6      131.1       12.6     0.0     0.0 
1 1 1    7    7   72 o    133.2   12.7  183.2557  33.2031   183.2557  33.2031   183.2557  33.2031      133.2     12.7      133.2       12.7     0.0     0.0 
1 1 1    7    7   73 o     16.5   12.3 -109.1872  32.5646  -109.1872  32.5646  -109.1872  32.5646       16.5     12.3       16.5       12.3     0.0     0.0 
1 1 1    7    7   74 o    345.5    5.5 1195.9510  37.6728  1195.9510  37.6728  1195.9510  37.6728      345.5      5.5      345.5        5.5     0.0     0.0 
1 1 1    7    7   75 o    133.8   13.4  185.8098  35.1187   185.8098  35.1187   185.8098  35.1187      133.8     13.4      133.8       13.4     0.0     0.0 
1 1 1    7    7   76 o    341.6    5.3 1169.7716  36.3957  1169.7716  36.3957  1169.7716  36.3957      341.6      5.3      341.6        5.3     0.0     0.0 
1 1 1    7    7   77 o     99.1   19.1  109.8257  33.8416   109.8257  33.8416   109.8257  33.8416       99.1     19.1       99.1       19.1     0.0     0.0 
1 1 1    7    7   78 o     47.4   24.6   34.4802  30.0105    34.4802  30.0105    34.4802  30.0105       47.4     24.6       47.4       24.6     0.0     0.0 
1 1 1    7    7   79 o     75.5   21.0   70.2374  27.4564    70.2374  27.4564    70.2374  27.4564       75.5     21.0       75.5       21.0     0.0     0.0 
1 1 1    7    7   80 o     21.9   15.8  -42.7809  30.6490   -42.7809  30.6490   -42.7809  30.6490       21.9     15.8       21.9       15.8     0.0     0.0 
1 1 1    7    7   81 o    336.1    5.0 1133.3759  33.8416  1133.3759  33.8416  1133.3759  33.8416      336.1      5.0      336.1        5.0     0.0     0.0 
1 1 1    8    0    0 o   1586.9   10.3 25186.4863 326.9231 25186.4863 326.9231 25186.4863 326.9231     1586.9     10.3     1586.9       10.3     0.0     0.0 
1 1 1    8    0    1 o   1366.4    6.3 18671.6484 172.4008 18671.6484 172.4008 18671.6484 172.4008     1366.4      6.3     1366.4        6.3     0.0     0.0 
1 1 1    8    0    2 o   1213.9    5.6 14737.0791 136.6436 14737.0791 136.6436 14737.0791 136.6436     1213.9      5.6     1213.9        5.6     0.0     0.0 
1 1 1    8    0    3 o   2051.3    9.6 42086.2383 394.6064 42086.2383 394.6064 42086.2383 394.6064     2051.3      9.6     2051.3        9.6     0.0     0.0 
1 1 1    8    0    4 o    718.1    3.5 5156.7007  50.4432  5156.7007  50.4432  5156.7007  50.4432      718.1      3.5      718.1        3.5     0.0     0.0 
1 1 1    8    0    5 o   1367.7    6.3 18707.4062 172.4008 18707.4062 172.4008 18707.4062 172.4008     1367.7      6.3     1367.7        6.3     0.0     0.0 
1 1 1    8    0    6 o   1727.1    7.9 29832.3691 273.2873 29832.3691 273.2873 29832.3691 273.2873     1727.1      7.9     1727.1        7.9     0.0     0.0 
1 1 1    8    0    7 o   2171.3    9.8 47152.2695 425.2554 47152.2695 425.2554 47152.2695 425.2554     2171.3      9.8     2171.3        9.8     0.0     0.0 
1 1 1    8    0    8 o   1126.0    5.3 12680.4014 119.4035 12680.4014 119.4035 12680.4014 119.4035     1126.0      5.3     1126.0        5.3     0.0     0.0 
1 1 1    8    0    9 o    712.9    3.5 5083.2705  50.4432  5083.2705  50.4432  5083.2705  50.4432      712.9      3.5      712.9        3.5     0.0     0.0 
1 1 1    8    0   10 o   2878.9   20.0 82935.0156 1149.9775 82935.0156 1149.9775 82935.0156 1149.9775     2878.9     20.0     2878.9       20.0     0.0     0.0 
1 1 1    8    0   11 o   1518.0    7.0 23046.1621 212.6277 23046.1621 212.6277 23046.1621 212.6277     1518.0      7.0     1518.0        7.0     0.0     0.0 
1 1 1    8    0   12 o   2798.9   12.6 78359.3750 704.9279 78359.3750 704.9279 78359.3750 704.9279     2798.9     12.6     2798.9       12.6     0.0     0.0 
1 1 1    8    0   13 o   1527.9    7.0 23346.9043 214.5433 23346.9043 214.5433 23346.9043 214.5433     1527.9      7.0     1527.9        7.0     0.0     0.0 
1 1 1    8    0   14 o   1775.1    8.1 31516.1484 289.2503 31516.1484 289.2503 31516.1484 289.2503     1775.1      8.1     1775.1        8.1     0.0     0.0 
1 1 1    8    0   15 o   1010.8    5.0 10217.6230 101.5249 10217.6230 101.5249 10217.6230 101.5249     1010.8      5.0     1010.8        5.0     0.0     0.0 
1 1 1    8    0   16 o   1005.0    5.3 10102.0508 105.9946 10102.0508 105.9946 10102.0508 105.9946     1005.0      5.3     1005.0        5.3     0.0     0.0 
1 1 1    8    0   17 o    526.1    2.9 2767.9912  30.0105  2767.9912  30.0105  2767.9912  30.0105      526.1      2.9      526.1        2.9     0.0     0.0 
1 1 1    8    0   18 o   2021.9    9.2 40889.0117 370.3425 40889.0117 370.3425 40889.0117 370.3425     2021.9      9.2     2021.9        9.2     0.0     0.0 
1 1 1    8    0   19 o    843.4    4.1 7114.4077  68.9603  7114.4077  68.9603  7114.4077  68.9603      843.4      4.1      843.4        4.1     0.0     0.0 
1 1 1    8    0   20 o    498.4    3.0 2484.4878  30.0105  2484.4878  30.0105  2484.4878  30.0105      498.4      3.0      498.4        3.0     0.0     0.0 
1 1 1    8    0   21 f    611.6    3.2 3740.4597  39.5883  3740.4597  39.5883  3740.4597  39.5883      611.6      3.2      611.6        3.2     0.0     0.0 
1 1 1    8    0   22 o    816.5    4.1 6666.8042  66.4062  6666.8042  66.4062  6666.8042  66.4062      816.5      4.1      816.5        4.1     0.0     0.0 
1 1 1    8    0   23 o   1927.9    8.8 37177.9219 340.3320 37177.9219 340.3320 37177.9219 340.3320     1927.9      8.8     1927.9        8.8     0.0     0.0 
1 1 1    8    0   24 o   1428.1    6.6 20396.9336 189.6409 20396.9336 189.6409 20396.9336 189.6409     1428.1      6.6     1428.1        6.6     0.0     0.0 
1 1 1    8    0   25 o   1915.0    8.7 36683.0664 333.3083 36683.0664 333.3083 36683.0664 333.3083     1915.0      8.7     1915.0        8.7     0.0     0.0 
1 1 1    8    0   26 o   1118.9    5.4 12522.0479 120.0421 12522.0479 120.0421 12522.0479 120.0421     1118.9      5.4     1118.9        5.4     0.0     0.0 
1 1 1    8    0   27 o   1265.9    6.0 16028.1699 150.6911 16028.1699 150.6911 16028.1699 150.6911     1265.9      6.0     1265.9        6.0     0.0     0.0 
1 1 1    8    0   28 o    263.9    3.1  696.6271  16.6016   696.6271  16.6016   696.6271  16.6016      263.9      3.1      263.9        3.1     0.0     0.0 
1 1 1    8    0   29 o    791.8    4.2 6269.6440  66.4062  6269.6440  66.4062  6269.6440  66.4062      791.8      4.2      791.8        4.2     0.0     0.0 
1 1 1    8    0   30 o    243.7    3.3  594.4636  15.9630   594.4636  15.9630   594.4636  15.9630      243.7      3.3      243.7        3.3     0.0     0.0 
1 1 1    8    0   31 o   1587.3    8.0 25200.5332 254.1316 25200.5332 254.1316 25200.5332 254.1316     1587.3      8.0     1587.3        8.0     0.0     0.0 
1 1 1    8    0   32 o   2014.2    9.6 40579.9648 386.9441 40579.9648 386.9441 40579.9648 386.9441     2014.2      9.6     2014.2        9.6     0.0     0.0 
1 1 1    8    0   33 o   1464.1    7.7 21439.0020 225.3981 21439.0020 225.3981 21439.0020 225.3981     1464.1      7.7     1464.1        7.7     0.0     0.0 
1 1 1    8    0   34 o    757.1    4.6 5733.2856  68.9603  5733.2856  68.9603  5733.2856  68.9603      757.1      4.6      757.1        4.6     0.0     0.0 
1 1 1    8    0   35 o   1281.6    6.4 16427.2461 164.1001 16427.2461 164.1001 16427.2461 164.1001     1281.6      6.4     1281.6        6.4     0.0     0.0 
1 1 1    8    0   36 o    380.4    3.5 1447.5286  26.8179  1447.5286  26.8179  1447.5286  26.8179      380.4      3.5      380.4        3.5     0.0     0.0 
1 1 1    8    0   37 o     14.2   10.6  -82.3693  24.2638   -82.3693  24.2638   -82.3693  24.2638       14.2     10.6       14.2       10.6     0.0     0.0 
1 1 1    8    0   38 o    957.9    5.0 9176.1943  95.7782  9176.1943  95.7782  9176.1943  95.7782      957.9      5.0      957.9        5.0     0.0     0.0 
1 1 1    8    0   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    0   40 o    423.1    3.6 1790.4146  30.6490  1790.4146  30.6490  1790.4146  30.6490      423.1      3.6      423.1        3.6     0.0     0.0 
1 1 1    8    0   41 o    629.4    3.7 3962.0266  45.9736  3962.0266  45.9736  3962.0266  45.9736      629.4      3.7      629.4        3.7     0.0     0.0 
1 1 1    8    0   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    0   43 o   1377.0    6.5 18964.0918 178.7861 18964.0918 178.7861 18964.0918 178.7861     1377.0      6.5     1377.0        6.5     0.0     0.0 
1 1 1    8    0   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    0   45 o    183.2    7.0  337.1394  25.5409   337.1394  25.5409   337.1394  25.5409      183.2      7.0      183.2        7.0     0.0     0.0 
1 1 1    8    0   46 o    484.2    3.7 2344.6516  35.7572  2344.6516  35.7572  2344.6516  35.7572      484.2      3.7      484.2        3.7     0.0     0.0 
1 1 1    8    0   47 o    510.3    5.4 2605.1682  54.9129  2605.1682  54.9129  2605.1682  54.9129      510.3      5.4      510.3        5.4     0.0     0.0 
1 1 1    8    0   48 o   1285.7    6.2 16533.8789 159.6304 16533.8789 159.6304 16533.8789 159.6304     1285.7      6.2     1285.7        6.2     0.0     0.0 
1 1 1    8    0   49 o    766.1    4.3 5869.9292  66.4062  5869.9292  66.4062  5869.9292  66.4062      766.1      4.3      766.1        4.3     0.0     0.0 
1 1 1    8    0   50 o    404.5    4.0 1637.1694  32.5646  1637.1694  32.5646  1637.1694  32.5646      404.5      4.0      404.5        4.0     0.0     0.0 
1 1 1    8    0   51 o   1039.6    5.2 10809.5332 108.5487 10809.5332 108.5487 10809.5332 108.5487     1039.6      5.2     1039.6        5.2     0.0     0.0 
1 1 1    8    0   52 o    415.4    4.4 1726.5625  36.3957  1726.5625  36.3957  1726.5625  36.3957      415.4      4.4      415.4        4.4     0.0     0.0 
1 1 1    8    0   53 o     20.8   15.1  -54.9129  31.2876   -54.9129  31.2876   -54.9129  31.2876       20.8     15.1       20.8       15.1     0.0     0.0 
1 1 1    8    0   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    0   55 o    927.3    5.0 8601.5244  93.2242  8601.5244  93.2242  8601.5244  93.2242      927.3      5.0      927.3        5.0     0.0     0.0 
1 1 1    8    0   56 o     16.1   12.0 -102.8020  30.6490  -102.8020  30.6490  -102.8020  30.6490       16.1     12.0       16.1       12.0     0.0     0.0 
1 1 1    8    0   57 o    227.5    6.6  519.1181  30.0105   519.1181  30.0105   519.1181  30.0105      227.5      6.6      227.5        6.6     0.0     0.0 
1 1 1    8    0   58 f     17.1   12.6  -65.7677  26.8179   -65.7677  26.8179   -65.7677  26.8179       17.1     12.6       17.1       12.6     0.0     0.0 
1 1 1    8    0   59 o    316.3    4.6 1001.2019  29.3720  1001.2019  29.3720  1001.2019  29.3720      316.3      4.6      316.3        4.6     0.0     0.0 
1 1 1    8    0   60 o    157.6    9.6  251.5775  30.0105   251.5775  30.0105   251.5775  30.0105      157.6      9.6      157.6        9.6     0.0     0.0 
1 1 1    8    0   61 o    664.4    4.4 4416.0156  58.1055  4416.0156  58.1055  4416.0156  58.1055      664.4      4.4      664.4        4.4     0.0     0.0 
1 1 1    8    0   62 o    473.5    4.2 2243.1265  40.2269  2243.1265  40.2269  2243.1265  40.2269      473.5      4.2      473.5        4.2     0.0     0.0 
1 1 1    8    0   63 o    369.1    4.9 1363.8822  36.3957  1363.8822  36.3957  1363.8822  36.3957      369.1      4.9      369.1        4.9     0.0     0.0 
1 1 1    8    0   64 o     51.8   25.7   40.2269  31.9261    40.2269  31.9261    40.2269  31.9261       51.8     25.7       51.8       25.7     0.0     0.0 
1 1 1    8    0   65 f    501.2    4.1 2513.2212  41.5039  2513.2212  41.5039  2513.2212  41.5039      501.2      4.1      501.2        4.1     0.0     0.0 
1 1 1    8    0   66 o     47.5   24.2   33.8416  28.7335    33.8416  28.7335    33.8416  28.7335       47.5     24.2       47.5       24.2     0.0     0.0 
1 1 1    8    0   67 o    427.7    4.1 1830.6416  35.1187  1830.6416  35.1187  1830.6416  35.1187      427.7      4.1      427.7        4.1     0.0     0.0 
1 1 1    8    0   68 o    295.9    5.2  877.3287  30.6490   877.3287  30.6490   877.3287  30.6490      295.9      5.2      295.9        5.2     0.0     0.0 
1 1 1    8    0   69 o    208.1    7.4  435.4717  30.6490   435.4717  30.6490   435.4717  30.6490      208.1      7.4      208.1        7.4     0.0     0.0 
1 1 1    8    0   70 o     52.3   24.6   40.8654  28.7335    40.8654  28.7335    40.8654  28.7335       52.3     24.6       52.3       24.6     0.0     0.0 
1 1 1    8    0   71 o     86.9   20.8   88.1160  31.2876    88.1160  31.2876    88.1160  31.2876       86.9     20.8       86.9       20.8     0.0     0.0 
1 1 1    8    0   72 o     21.0   15.2  -42.1424  28.7335   -42.1424  28.7335   -42.1424  28.7335       21.0     15.2       21.0       15.2     0.0     0.0 
1 1 1    8    0   73 o    372.9    4.7 1392.6157  35.1187  1392.6157  35.1187  1392.6157  35.1187      372.9      4.7      372.9        4.7     0.0     0.0 
1 1 1    8    0   74 o     26.3   18.3  -21.0712  31.2876   -21.0712  31.2876   -21.0712  31.2876       26.3     18.3       26.3       18.3     0.0     0.0 
1 1 1    8    0   75 o    180.7    9.1  330.1157  32.5646   330.1157  32.5646   330.1157  32.5646      180.7      9.1      180.7        9.1     0.0     0.0 
1 1 1    8    0   76 o    270.6    5.8  734.2999  31.2876   734.2999  31.2876   734.2999  31.2876      270.6      5.8      270.6        5.8     0.0     0.0 
1 1 1    8    0   77 o     26.2   18.2  -24.9023  32.5646   -24.9023  32.5646   -24.9023  32.5646       26.2     18.2       26.2       18.2     0.0     0.0 
1 1 1    8    0   78 o    118.0   12.1  144.9444  28.0950   144.9444  28.0950   144.9444  28.0950      118.0     12.1      118.0       12.1     0.0     0.0 
1 1 1    8    0   79 o    160.0    9.9  260.5168  31.2876   260.5168  31.2876   260.5168  31.2876      160.0      9.9      160.0        9.9     0.0     0.0 
1 1 1    8    0   80 o    100.6   13.0  104.0790  26.1794   104.0790  26.1794   104.0790  26.1794      100.6     13.0      100.6       13.0     0.0     0.0 
1 1 1    8    0   81 o    108.3   15.5  123.8732  32.5646   123.8732  32.5646   123.8732  32.5646      108.3     15.5      108.3       15.5     0.0     0.0 
1 1 1    8    0   82 o     21.4   15.5  -51.0817  31.9261   -51.0817  31.9261   -51.0817  31.9261       21.4     15.5       21.4       15.5     0.0     0.0 
1 1 1    8    1    0 o    305.6    2.0  934.1572  12.1319   934.1572  12.1319   934.1572  12.1319      305.6      2.0      305.6        2.0     0.0     0.0 
1 1 1    8    1    1 o    855.6    3.1    0.0000   0.0000          ?        ?  7320.6504  52.3588          ?        ?      855.6        3.1       ?       ? 
1 1 1    8    1    2 o    927.9    3.1    0.0000   0.0000          ?        ?  8609.8262  57.4669          ?        ?      927.9        3.1       ?       ? 
1 1 1    8    1    3 o   1014.4    3.5    0.0000   0.0000          ?        ? 10289.7764  70.2374          ?        ?     1014.4        3.5       ?       ? 
1 1 1    8    1    4 o    761.3    2.6    0.0000   0.0000          ?        ?  5795.2222  39.5883          ?        ?      761.3        2.6       ?       ? 
1 1 1    8    1    5 o   1500.4    4.9    0.0000   0.0000          ?        ? 22514.2734 146.2215          ?        ?     1500.4        4.9       ?       ? 
1 1 1    8    1    6 o   1189.9    3.9    0.0000   0.0000          ?        ? 14158.5781  93.2242          ?        ?     1189.9        3.9       ?       ? 
1 1 1    8    1    7 o   1213.1    4.0    0.0000   0.0000          ?        ? 14716.6465  97.0553          ?        ?     1213.1        4.0       ?       ? 
1 1 1    8    1    8 o   2565.5    9.1    0.0000   0.0000          ?        ? 65830.9453 468.6749          ?        ?     2565.5        9.1       ?       ? 
1 1 1    8    1    9 o   1226.4    4.1    0.0000   0.0000          ?        ? 15041.6533  99.6094          ?        ?     1226.4        4.1       ?       ? 
1 1 1    8    1   10 o   1024.1    3.5    0.0000   0.0000          ?        ? 10488.9941  70.8759          ?        ?     1024.1        3.5       ?       ? 
1 1 1    8    1   11 o    246.0    1.3    0.0000   0.0000          ?        ?   605.3185   6.3852          ?        ?      246.0        1.3       ?       ? 
1 1 1    8    1   12 o   2344.8    7.5    0.0000   0.0000          ?        ? 54990.1172 350.5484          ?        ?     2344.8        7.5       ?       ? 
1 1 1    8    1   13 o   2491.5    7.9    0.0000   0.0000          ?        ? 62088.5664 395.2449          ?        ?     2491.5        7.9       ?       ? 
1 1 1    8    1   14 o   1205.2    4.1    0.0000   0.0000          ?        ? 14526.3672  98.9709          ?        ?     1205.2        4.1       ?       ? 
1 1 1    8    1   15 o    641.3    2.4    0.0000   0.0000          ?        ?  4112.7178  30.6490          ?        ?      641.3        2.4       ?       ? 
1 1 1    8    1   16 o   1079.3    3.6    0.0000   0.0000          ?        ? 11648.5508  77.8996          ?        ?     1079.3        3.6       ?       ? 
1 1 1    8    1   17 o    329.1    1.6    0.0000   0.0000          ?        ?  1082.9327  10.2163          ?        ?      329.1        1.6       ?       ? 
1 1 1    8    1   18 f    435.4    1.9    0.0000   0.0000          ?        ?  1895.7706  16.6016          ?        ?      435.4        1.9       ?       ? 
1 1 1    8    1   19 o   1981.0    6.4    0.0000   0.0000          ?        ? 39248.6445 252.8546          ?        ?     1981.0        6.4       ?       ? 
1 1 1    8    1   20 o   1246.4    4.4    0.0000   0.0000          ?        ? 15535.2314 108.5487          ?        ?     1246.4        4.4       ?       ? 
1 1 1    8    1   21 o    944.8    3.3    0.0000   0.0000          ?        ?  8927.8086  61.9366          ?        ?      944.8        3.3       ?       ? 
1 1 1    8    1   22 o    387.1    1.8    0.0000   0.0000          ?        ?  1498.6102  14.0475          ?        ?      387.1        1.8       ?       ? 
1 1 1    8    1   23 o    486.8    2.0    0.0000   0.0000          ?        ?  2369.5537  19.7942          ?        ?      486.8        2.0       ?       ? 
1 1 1    8    1   24 o    727.7    2.7    0.0000   0.0000          ?        ?  5295.2598  38.9498          ?        ?      727.7        2.7       ?       ? 
1 1 1    8    1   25 o     80.3    4.4    0.0000   0.0000          ?        ?    64.4907   7.0237          ?        ?       80.3        4.4       ?       ? 
1 1 1    8    1   26 o    899.4    3.2    0.0000   0.0000          ?        ?  8089.4307  56.8284          ?        ?      899.4        3.2       ?       ? 
1 1 1    8    1   27 o    660.2    2.5    0.0000   0.0000          ?        ?  4359.1870  32.5646          ?        ?      660.2        2.5       ?       ? 
1 1 1    8    1   28 o    756.2    2.7    0.0000   0.0000          ?        ?  5718.5996  41.5039          ?        ?      756.2        2.7       ?       ? 
1 1 1    8    1   29 o    106.3    5.1    0.0000   0.0000          ?        ?   113.0183  10.8549          ?        ?      106.3        5.1       ?       ? 
1 1 1    8    1   30 o   1087.1    3.9    0.0000   0.0000          ?        ? 11818.3965  84.9234          ?        ?     1087.1        3.9       ?       ? 
1 1 1    8    1   31 o   1194.1    4.2    0.0000   0.0000          ?        ? 14258.8271 100.8864          ?        ?     1194.1        4.2       ?       ? 
1 1 1    8    1   32 o    583.4    2.5    0.0000   0.0000          ?        ?  3403.3203  29.3720          ?        ?      583.4        2.5       ?       ? 
1 1 1    8    1   33 o    216.5    3.4    0.0000   0.0000          ?        ?   468.6749  14.6860          ?        ?      216.5        3.4       ?       ? 
1 1 1    8    1   34 o    667.2    2.8    0.0000   0.0000          ?        ?  4451.1343  37.0343          ?        ?      667.2        2.8       ?       ? 
1 1 1    8    1   35 o    515.7    2.4    0.0000   0.0000          ?        ?  2659.4426  24.9023          ?        ?      515.7        2.4       ?       ? 
1 1 1    8    1   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    1   37 o    735.7    2.9    0.0000   0.0000          ?        ?  5412.1094  42.7809          ?        ?      735.7        2.9       ?       ? 
1 1 1    8    1   38 o    676.0    2.6    0.0000   0.0000          ?        ?  4570.5376  35.7572          ?        ?      676.0        2.6       ?       ? 
1 1 1    8    1   39 o    504.7    2.7    0.0000   0.0000          ?        ?  2547.0627  26.8179          ?        ?      504.7        2.7       ?       ? 
1 1 1    8    1   40 o   1000.0    3.6    0.0000   0.0000          ?        ? 10000.5254  72.1529          ?        ?     1000.0        3.6       ?       ? 
1 1 1    8    1   41 o    548.4    2.7    0.0000   0.0000          ?        ?  3007.4368  30.0105          ?        ?      548.4        2.7       ?       ? 
1 1 1    8    1   42 o   1487.3    4.9    0.0000   0.0000          ?        ? 22122.2207 146.8600          ?        ?     1487.3        4.9       ?       ? 
1 1 1    8    1   43 o    400.3    3.0    0.0000   0.0000          ?        ?  1602.6893  23.6253          ?        ?      400.3        3.0       ?       ? 
1 1 1    8    1   44 o    244.9    3.8    0.0000   0.0000          ?        ?   599.5718  18.5171          ?        ?      244.9        3.8       ?       ? 
1 1 1    8    1   45 o    372.1    3.0    0.0000   0.0000          ?        ?  1384.9534  22.3483          ?        ?      372.1        3.0       ?       ? 
1 1 1    8    1   46 o   1308.1    4.4    0.0000   0.0000          ?        ? 17113.6562 115.5724          ?        ?     1308.1        4.4       ?       ? 
1 1 1    8    1   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    1   48 o    527.6    2.6    0.0000   0.0000          ?        ?  2783.9543  27.4564          ?        ?      527.6        2.6       ?       ? 
1 1 1    8    1   49 o    503.0    2.6    0.0000   0.0000          ?        ?  2529.8228  26.1794          ?        ?      503.0        2.6       ?       ? 
1 1 1    8    1   50 o    837.0    3.2    0.0000   0.0000          ?        ?  7007.1367  54.2743          ?        ?      837.0        3.2       ?       ? 
1 1 1    8    1   51 o    259.6    3.9    0.0000   0.0000          ?        ?   674.2788  20.4327          ?        ?      259.6        3.9       ?       ? 
1 1 1    8    1   52 o    464.3    2.7    0.0000   0.0000          ?        ?  2155.6492  24.9023          ?        ?      464.3        2.7       ?       ? 
1 1 1    8    1   53 o    801.5    3.1    0.0000   0.0000          ?        ?  6424.8047  49.8047          ?        ?      801.5        3.1       ?       ? 
1 1 1    8    1   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    1   55 o    188.5    5.6    0.0000   0.0000          ?        ?   355.6566  21.0712          ?        ?      188.5        5.6       ?       ? 
1 1 1    8    1   56 f    415.5    2.8    0.0000   0.0000          ?        ?  1726.5625  22.9868          ?        ?      415.5        2.8       ?       ? 
1 1 1    8    1   57 o    276.9    3.7    0.0000   0.0000          ?        ?   766.8644  20.4327          ?        ?      276.9        3.7       ?       ? 
1 1 1    8    1   58 o    381.3    2.9    0.0000   0.0000          ?        ?  1453.9137  22.3483          ?        ?      381.3        2.9       ?       ? 
1 1 1    8    1   59 o    603.8    2.9    0.0000   0.0000          ?        ?  3646.5969  34.4802          ?        ?      603.8        2.9       ?       ? 
1 1 1    8    1   60 o    767.2    3.1    0.0000   0.0000          ?        ?  5887.1694  47.2506          ?        ?      767.2        3.1       ?       ? 
1 1 1    8    1   61 o    426.2    2.8    0.0000   0.0000          ?        ?  1816.5940  24.2638          ?        ?      426.2        2.8       ?       ? 
1 1 1    8    1   62 o    110.8   10.1    0.0000   0.0000          ?        ?   123.2347  22.3483          ?        ?      110.8       10.1       ?       ? 
1 1 1    8    1   63 o    366.6    3.1    0.0000   0.0000          ?        ?  1344.7266  22.9868          ?        ?      366.6        3.1       ?       ? 
1 1 1    8    1   64 o    346.2    3.1    0.0000   0.0000          ?        ?  1199.1437  21.7097          ?        ?      346.2        3.1       ?       ? 
1 1 1    8    1   65 o    437.4    2.9    0.0000   0.0000          ?        ?  1913.6494  25.5409          ?        ?      437.4        2.9       ?       ? 
1 1 1    8    1   66 o    302.3    3.8    0.0000   0.0000          ?        ?   914.3630  22.9868          ?        ?      302.3        3.8       ?       ? 
1 1 1    8    1   67 o    475.9    2.8    0.0000   0.0000          ?        ?  2265.4746  26.1794          ?        ?      475.9        2.8       ?       ? 
1 1 1    8    1   68 o     90.1   11.3    0.0000   0.0000          ?        ?    81.7308  20.4327          ?        ?       90.1       11.3       ?       ? 
1 1 1    8    1   69 o    667.1    2.8    0.0000   0.0000          ?        ?  4451.7729  37.6728          ?        ?      667.1        2.8       ?       ? 
1 1 1    8    1   70 o    159.6    7.0    0.0000   0.0000          ?        ?   255.4086  22.3483          ?        ?      159.6        7.0       ?       ? 
1 1 1    8    1   71 o    253.0    4.4    0.0000   0.0000          ?        ?   641.0757  22.3483          ?        ?      253.0        4.4       ?       ? 
1 1 1    8    1   72 o    187.0    5.8    0.0000   0.0000          ?        ?   350.5484  21.7097          ?        ?      187.0        5.8       ?       ? 
1 1 1    8    1   73 o    233.0    4.8    0.0000   0.0000          ?        ?   544.0204  22.3483          ?        ?      233.0        4.8       ?       ? 
1 1 1    8    1   74 o    341.2    3.5    0.0000   0.0000          ?        ?  1165.3020  23.6253          ?        ?      341.2        3.5       ?       ? 
1 1 1    8    1   75 o    204.7    5.6    0.0000   0.0000          ?        ?   420.1472  22.9868          ?        ?      204.7        5.6       ?       ? 
1 1 1    8    1   76 o     37.8   15.9    0.0000   0.0000          ?        ?     2.5541  20.4327          ?        ?       37.8       15.9       ?       ? 
1 1 1    8    1   77 o    150.7    7.6    0.0000   0.0000          ?        ?   228.5907  22.9868          ?        ?      150.7        7.6       ?       ? 
1 1 1    8    1   78 o     37.7   16.3    0.0000   0.0000          ?        ?    -1.2770  22.3483          ?        ?       37.7       16.3       ?       ? 
1 1 1    8    1   79 o    253.3    4.4    0.0000   0.0000          ?        ?   643.6298  22.3483          ?        ?      253.3        4.4       ?       ? 
1 1 1    8    1   80 o    106.1    9.9    0.0000   0.0000          ?        ?   114.2954  21.0712          ?        ?      106.1        9.9       ?       ? 
1 1 1    8    1   81 o    213.3    5.2    0.0000   0.0000          ?        ?   457.1815  22.3483          ?        ?      213.3        5.2       ?       ? 
1 1 1    8    1   82 o     96.2   11.6    0.0000   0.0000          ?        ?    95.1397  22.3483          ?        ?       96.2       11.6       ?       ? 
1 1 1    8    2    0 o   1532.4    7.8 23485.4648 238.8071 23485.4648 238.8071 23485.4648 238.8071     1532.4      7.8     1532.4        7.8     0.0     0.0 
1 1 1    8    2    1 o    312.7    1.4    0.0000   0.0000          ?        ?   977.5767   8.9393          ?        ?      312.7        1.4       ?       ? 
1 1 1    8    2    2 o    743.5    2.6    0.0000   0.0000          ?        ?  5528.3203  38.9498          ?        ?      743.5        2.6       ?       ? 
1 1 1    8    2    3 o    631.8    2.2    0.0000   0.0000          ?        ?  3992.0374  28.0950          ?        ?      631.8        2.2       ?       ? 
1 1 1    8    2    4 o   1359.9    4.4    0.0000   0.0000          ?        ? 18494.1406 120.0421          ?        ?     1359.9        4.4       ?       ? 
1 1 1    8    2    5 o   1241.7    4.1    0.0000   0.0000          ?        ? 15418.3818 102.1635          ?        ?     1241.7        4.1       ?       ? 
1 1 1    8    2    6 o   1183.2    3.9    0.0000   0.0000          ?        ? 13999.5869  91.9471          ?        ?     1183.2        3.9       ?       ? 
1 1 1    8    2    7 o    556.8    2.0    0.0000   0.0000          ?        ?  3100.0225  22.3483          ?        ?      556.8        2.0       ?       ? 
1 1 1    8    2    8 o    301.0    1.4    0.0000   0.0000          ?        ?   906.0621   8.3008          ?        ?      301.0        1.4       ?       ? 
1 1 1    8    2    9 o   1041.4    3.5    0.0000   0.0000          ?        ? 10845.2900  73.4300          ?        ?     1041.4        3.5       ?       ? 
1 1 1    8    2   10 o   1535.2    5.0    0.0000   0.0000          ?        ? 23569.7500 154.5222          ?        ?     1535.2        5.0       ?       ? 
1 1 1    8    2   11 o   1661.3    5.4    0.0000   0.0000          ?        ? 27602.0117 178.7861          ?        ?     1661.3        5.4       ?       ? 
1 1 1    8    2   12 o    410.0    1.7    0.0000   0.0000          ?        ?  1681.2274  14.0475          ?        ?      410.0        1.7       ?       ? 
1 1 1    8    2   13 o   1470.4    4.9    0.0000   0.0000          ?        ? 21623.5352 144.3059          ?        ?     1470.4        4.9       ?       ? 
1 1 1    8    2   14 o   1062.0    3.6    0.0000   0.0000          ?        ? 11278.8457  77.2611          ?        ?     1062.0        3.6       ?       ? 
1 1 1    8    2   15 o    897.2    3.1    0.0000   0.0000          ?        ?  8049.2036  55.5514          ?        ?      897.2        3.1       ?       ? 
1 1 1    8    2   16 o     67.8    3.3    0.0000   0.0000          ?        ?    45.9736   4.4697          ?        ?       67.8        3.3       ?       ? 
1 1 1    8    2   17 o   1863.6    6.0    0.0000   0.0000          ?        ? 34735.5781 224.1211          ?        ?     1863.6        6.0       ?       ? 
1 1 1    8    2   18 o    541.4    2.1    0.0000   0.0000          ?        ?  2931.4529  22.3483          ?        ?      541.4        2.1       ?       ? 
1 1 1    8    2   19 o    925.8    3.2    0.0000   0.0000          ?        ?  8571.5146  58.7440          ?        ?      925.8        3.2       ?       ? 
1 1 1    8    2   20 o    685.7    2.5    0.0000   0.0000          ?        ?  4702.0732  34.4802          ?        ?      685.7        2.5       ?       ? 
1 1 1    8    2   21 o    520.4    2.1    0.0000   0.0000          ?        ?  2707.9702  21.7097          ?        ?      520.4        2.1       ?       ? 
1 1 1    8    2   22 o   1159.9    3.9    0.0000   0.0000          ?        ? 13455.5664  90.0316          ?        ?     1159.9        3.9       ?       ? 
1 1 1    8    2   23 o    287.0    1.7    0.0000   0.0000          ?        ?   823.6929   9.5778          ?        ?      287.0        1.7       ?       ? 
1 1 1    8    2   24 o    449.8    2.0    0.0000   0.0000          ?        ?  2023.4750  17.8786          ?        ?      449.8        2.0       ?       ? 
1 1 1    8    2   25 o   1014.7    3.5    0.0000   0.0000          ?        ? 10296.7998  71.5144          ?        ?     1014.7        3.5       ?       ? 
1 1 1    8    2   26 o    645.5    2.5    0.0000   0.0000          ?        ?  4166.9922  31.9261          ?        ?      645.5        2.5       ?       ? 
1 1 1    8    2   27 o    962.4    3.4    0.0000   0.0000          ?        ?  9262.3945  65.7677          ?        ?      962.4        3.4       ?       ? 
1 1 1    8    2   28 o    287.1    2.2    0.0000   0.0000          ?        ?   824.3315  12.7704          ?        ?      287.1        2.2       ?       ? 
1 1 1    8    2   29 o   1240.0    4.1    0.0000   0.0000          ?        ? 15376.8779 102.1635          ?        ?     1240.0        4.1       ?       ? 
1 1 1    8    2   30 o   1108.2    3.9    0.0000   0.0000          ?        ? 12281.3252  85.5619          ?        ?     1108.2        3.9       ?       ? 
1 1 1    8    2   31 o    264.4    2.7    0.0000   0.0000          ?        ?   699.1812  14.0475          ?        ?      264.4        2.7       ?       ? 
1 1 1    8    2   32 o    706.1    2.8    0.0000   0.0000          ?        ?  4985.5767  40.2269          ?        ?      706.1        2.8       ?       ? 
1 1 1    8    2   33 o    740.9    3.3    0.0000   0.0000          ?        ?  5490.0088  48.5276          ?        ?      740.9        3.3       ?       ? 
1 1 1    8    2   34 o    508.9    2.5    0.0000   0.0000          ?        ?  2589.8438  25.5409          ?        ?      508.9        2.5       ?       ? 
1 1 1    8    2   35 o    529.3    2.5    0.0000   0.0000          ?        ?  2801.1943  26.1794          ?        ?      529.3        2.5       ?       ? 
1 1 1    8    2   36 o   1004.7    3.6    0.0000   0.0000          ?        ? 10093.7500  71.5144          ?        ?     1004.7        3.6       ?       ? 
1 1 1    8    2   37 o    793.9    3.1    0.0000   0.0000          ?        ?  6302.2085  48.5276          ?        ?      793.9        3.1       ?       ? 
1 1 1    8    2   38 o   1313.9    4.5    0.0000   0.0000          ?        ? 17263.7090 118.1265          ?        ?     1313.9        4.5       ?       ? 
1 1 1    8    2   39 o    699.7    2.8    0.0000   0.0000          ?        ?  4896.1836  38.9498          ?        ?      699.7        2.8       ?       ? 
1 1 1    8    2   40 o   1265.7    4.3    0.0000   0.0000          ?        ? 16020.5078 107.9102          ?        ?     1265.7        4.3       ?       ? 
1 1 1    8    2   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    2   42 o    799.2    3.2    0.0000   0.0000          ?        ?  6387.1318  51.7203          ?        ?      799.2        3.2       ?       ? 
1 1 1    8    2   43 o    439.7    2.7    0.0000   0.0000          ?        ?  1933.4434  23.6253          ?        ?      439.7        2.7       ?       ? 
1 1 1    8    2   44 o    142.7    6.3    0.0000   0.0000          ?        ?   203.6884  17.8786          ?        ?      142.7        6.3       ?       ? 
1 1 1    8    2   45 o     87.5   10.6    0.0000   0.0000          ?        ?    76.6226  18.5171          ?        ?       87.5       10.6       ?       ? 
1 1 1    8    2   46 f    443.6    2.9    0.0000   0.0000          ?        ?  1967.9237  25.5409          ?        ?      443.6        2.9       ?       ? 
1 1 1    8    2   47 o    516.3    2.7    0.0000   0.0000          ?        ?  2665.8279  28.0950          ?        ?      516.3        2.7       ?       ? 
1 1 1    8    2   48 o    513.9    2.7    0.0000   0.0000          ?        ?  2641.5640  27.4564          ?        ?      513.9        2.7       ?       ? 
1 1 1    8    2   49 o    207.9    4.6    0.0000   0.0000          ?        ?   432.2791  19.1556          ?        ?      207.9        4.6       ?       ? 
1 1 1    8    2   50 o     36.6   15.2    0.0000   0.0000          ?        ?     2.5541  18.5171          ?        ?       36.6       15.2       ?       ? 
1 1 1    8    2   51 o    385.1    3.2    0.0000   0.0000          ?        ?  1483.2858  24.2638          ?        ?      385.1        3.2       ?       ? 
1 1 1    8    2   52 o    102.6    9.6    0.0000   0.0000          ?        ?   105.3561  19.7942          ?        ?      102.6        9.6       ?       ? 
1 1 1    8    2   53 o    767.4    3.0    0.0000   0.0000          ?        ?  5890.3618  46.6121          ?        ?      767.4        3.0       ?       ? 
1 1 1    8    2   54 o    465.4    2.7    0.0000   0.0000          ?        ?  2166.5039  25.5409          ?        ?      465.4        2.7       ?       ? 
1 1 1    8    2   55 o    268.1    3.8    0.0000   0.0000          ?        ?   718.9753  20.4327          ?        ?      268.1        3.8       ?       ? 
1 1 1    8    2   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    2   57 o    394.5    2.9    0.0000   0.0000          ?        ?  1556.7157  22.9868          ?        ?      394.5        2.9       ?       ? 
1 1 1    8    2   58 o    300.6    3.6    0.0000   0.0000          ?        ?   904.1467  21.7097          ?        ?      300.6        3.6       ?       ? 
1 1 1    8    2   59 o     38.2   16.0    0.0000   0.0000          ?        ?     2.5541  20.4327          ?        ?       38.2       16.0       ?       ? 
1 1 1    8    2   60 o     43.5   16.5    0.0000   0.0000          ?        ?    13.4090  19.7942          ?        ?       43.5       16.5       ?       ? 
1 1 1    8    2   61 o    646.5    2.8    0.0000   0.0000          ?        ?  4180.4014  36.3957          ?        ?      646.5        2.8       ?       ? 
1 1 1    8    2   62 o    490.8    2.7    0.0000   0.0000          ?        ?  2409.1421  26.1794          ?        ?      490.8        2.7       ?       ? 
1 1 1    8    2   63 f    348.3    3.1    0.0000   0.0000          ?        ?  1213.8297  21.7097          ?        ?      348.3        3.1       ?       ? 
1 1 1    8    2   64 o    335.6    3.4    0.0000   0.0000          ?        ?  1126.9907  22.9868          ?        ?      335.6        3.4       ?       ? 
1 1 1    8    2   65 o    140.5    7.5    0.0000   0.0000          ?        ?   197.9417  21.0712          ?        ?      140.5        7.5       ?       ? 
1 1 1    8    2   66 o     70.2   14.6    0.0000   0.0000          ?        ?    51.7203  19.7942          ?        ?       70.2       14.6       ?       ? 
1 1 1    8    2   67 o    370.6    3.1    0.0000   0.0000          ?        ?  1374.0985  22.9868          ?        ?      370.6        3.1       ?       ? 
1 1 1    8    2   68 o    260.6    4.3    0.0000   0.0000          ?        ?   680.0255  22.3483          ?        ?      260.6        4.3       ?       ? 
1 1 1    8    2   69 o    359.5    3.3    0.0000   0.0000          ?        ?  1293.0063  23.6253          ?        ?      359.5        3.3       ?       ? 
1 1 1    8    2   70 o    172.9    5.9    0.0000   0.0000          ?        ?   299.4666  20.4327          ?        ?      172.9        5.9       ?       ? 
1 1 1    8    2   71 o    303.3    3.9    0.0000   0.0000          ?        ?   920.7482  23.6253          ?        ?      303.3        3.9       ?       ? 
1 1 1    8    2   72 o     69.1   15.2    0.0000   0.0000          ?        ?    50.4432  20.4327          ?        ?       69.1       15.2       ?       ? 
1 1 1    8    2   73 o    249.7    4.2    0.0000   0.0000          ?        ?   624.4742  21.0712          ?        ?      249.7        4.2       ?       ? 
1 1 1    8    2   74 o    154.6    7.2    0.0000   0.0000          ?        ?   240.0841  22.3483          ?        ?      154.6        7.2       ?       ? 
1 1 1    8    2   75 o     32.6   14.9    0.0000   0.0000          ?        ?   -14.0475  21.7097          ?        ?       32.6       14.9       ?       ? 
1 1 1    8    2   76 o     40.6   16.8    0.0000   0.0000          ?        ?     5.1082  22.3483          ?        ?       40.6       16.8       ?       ? 
1 1 1    8    2   77 o     72.5   14.2    0.0000   0.0000          ?        ?    55.5514  19.7942          ?        ?       72.5       14.2       ?       ? 
1 1 1    8    2   78 o    165.0    6.8    0.0000   0.0000          ?        ?   273.9258  22.3483          ?        ?      165.0        6.8       ?       ? 
1 1 1    8    2   79 o     34.8   15.5    0.0000   0.0000          ?        ?    -7.0237  21.7097          ?        ?       34.8       15.5       ?       ? 
1 1 1    8    2   80 o     53.3   17.8    0.0000   0.0000          ?        ?    28.7335  22.3483          ?        ?       53.3       17.8       ?       ? 
1 1 1    8    2   81 o     61.8   15.9    0.0000   0.0000          ?        ?    41.5039  19.7942          ?        ?       61.8       15.9       ?       ? 
1 1 1    8    2   82 o     70.5   15.8    0.0000   0.0000          ?        ?    54.2743  21.7097          ?        ?       70.5       15.8       ?       ? 
1 1 1    8    3    0 o    858.7    4.6 7374.9248  78.5382  7374.9248  78.5382  7374.9248  78.5382      858.7      4.6      858.7        4.6     0.0     0.0 
1 1 1    8    3    1 o    426.9    1.7    0.0000   0.0000          ?        ?  1822.3407  14.6860          ?        ?      426.9        1.7       ?       ? 
1 1 1    8    3    2 o    275.4    1.4    0.0000   0.0000          ?        ?   758.5637   7.6623          ?        ?      275.4        1.4       ?       ? 
1 1 1    8    3    3 o    496.7    1.9    0.0000   0.0000          ?        ?  2467.2476  19.1556          ?        ?      496.7        1.9       ?       ? 
1 1 1    8    3    4 o   1429.9    4.7    0.0000   0.0000          ?        ? 20448.6543 133.4510          ?        ?     1429.9        4.7       ?       ? 
1 1 1    8    3    5 o   1442.6    4.7    0.0000   0.0000          ?        ? 20812.6133 136.0051          ?        ?     1442.6        4.7       ?       ? 
1 1 1    8    3    6 o    829.8    2.9    0.0000   0.0000          ?        ?  6886.4556  47.8891          ?        ?      829.8        2.9       ?       ? 
1 1 1    8    3    7 o   1583.3    5.1    0.0000   0.0000          ?        ? 25069.6367 162.8230          ?        ?     1583.3        5.1       ?       ? 
1 1 1    8    3    8 o   1308.1    4.5    0.0000   0.0000          ?        ? 17111.1035 118.1265          ?        ?     1308.1        4.5       ?       ? 
1 1 1    8    3    9 o   1321.3    4.3    0.0000   0.0000          ?        ? 17458.4570 114.9339          ?        ?     1321.3        4.3       ?       ? 
1 1 1    8    3   10 o   1879.1    6.0    0.0000   0.0000          ?        ? 35312.8008 227.3137          ?        ?     1879.1        6.0       ?       ? 
1 1 1    8    3   11 o   1079.4    3.6    0.0000   0.0000          ?        ? 11650.4658  77.8996          ?        ?     1079.4        3.6       ?       ? 
1 1 1    8    3   12 o   1651.9    5.5    0.0000   0.0000          ?        ? 27291.0527 181.3401          ?        ?     1651.9        5.5       ?       ? 
1 1 1    8    3   13 o   1352.7    4.5    0.0000   0.0000          ?        ? 18299.3906 120.6806          ?        ?     1352.7        4.5       ?       ? 
1 1 1    8    3   14 o   2265.4    7.2    0.0000   0.0000          ?        ? 51326.9219 326.9231          ?        ?     2265.4        7.2       ?       ? 
1 1 1    8    3   15 o   1122.3    3.8    0.0000   0.0000          ?        ? 12595.4775  84.2849          ?        ?     1122.3        3.8       ?       ? 
1 1 1    8    3   16 o    571.8    2.4    0.0000   0.0000          ?        ?  3269.2307  27.4564          ?        ?      571.8        2.4       ?       ? 
1 1 1    8    3   17 f    361.4    1.9    0.0000   0.0000          ?        ?  1305.7767  14.0475          ?        ?      361.4        1.9       ?       ? 
1 1 1    8    3   18 o   1250.5    4.2    0.0000   0.0000          ?        ? 15637.3945 105.9946          ?        ?     1250.5        4.2       ?       ? 
1 1 1    8    3   19 o   1150.5    4.0    0.0000   0.0000          ?        ? 13236.5537  91.3086          ?        ?     1150.5        4.0       ?       ? 
1 1 1    8    3   20 o    615.8    2.3    0.0000   0.0000          ?        ?  3792.1802  28.0950          ?        ?      615.8        2.3       ?       ? 
1 1 1    8    3   21 o    501.6    2.0    0.0000   0.0000          ?        ?  2515.7751  20.4327          ?        ?      501.6        2.0       ?       ? 
1 1 1    8    3   22 o    240.9    1.7    0.0000   0.0000          ?        ?   580.4161   8.3008          ?        ?      240.9        1.7       ?       ? 
1 1 1    8    3   23 o    467.1    2.1    0.0000   0.0000          ?        ?  2181.8284  19.7942          ?        ?      467.1        2.1       ?       ? 
1 1 1    8    3   24 o    932.4    3.2    0.0000   0.0000          ?        ?  8694.7490  60.0210          ?        ?      932.4        3.2       ?       ? 
1 1 1    8    3   25 o    947.8    3.3    0.0000   0.0000          ?        ?  8983.3613  62.5751          ?        ?      947.8        3.3       ?       ? 
1 1 1    8    3   26 o    321.4    1.8    0.0000   0.0000          ?        ?  1033.1281  11.4934          ?        ?      321.4        1.8       ?       ? 
1 1 1    8    3   27 f     47.2    8.4    0.0000   0.0000          ?        ?    22.9868   7.6623          ?        ?       47.2        8.4       ?       ? 
1 1 1    8    3   28 o    408.5    2.1    0.0000   0.0000          ?        ?  1669.0955  17.2401          ?        ?      408.5        2.1       ?       ? 
1 1 1    8    3   29 o    461.9    2.1    0.0000   0.0000          ?        ?  2133.9395  19.7942          ?        ?      461.9        2.1       ?       ? 
1 1 1    8    3   30 o    559.9    2.5    0.0000   0.0000          ?        ?  3135.1411  28.0950          ?        ?      559.9        2.5       ?       ? 
1 1 1    8    3   31 o   1062.8    3.8    0.0000   0.0000          ?        ? 11295.4473  81.0922          ?        ?     1062.8        3.8       ?       ? 
1 1 1    8    3   32 o   1311.8    4.5    0.0000   0.0000          ?        ? 17208.1582 117.4880          ?        ?     1311.8        4.5       ?       ? 
1 1 1    8    3   33 o   1252.0    4.6    0.0000   0.0000          ?        ? 15675.7061 115.5724          ?        ?     1252.0        4.6       ?       ? 
1 1 1    8    3   34 o    793.2    3.3    0.0000   0.0000          ?        ?  6291.9922  51.7203          ?        ?      793.2        3.3       ?       ? 
1 1 1    8    3   35 o   1352.5    4.8    0.0000   0.0000          ?        ? 18294.9219 129.6199          ?        ?     1352.5        4.8       ?       ? 
1 1 1    8    3   36 o   1100.8    3.8    0.0000   0.0000          ?        ? 12117.2246  83.6463          ?        ?     1100.8        3.8       ?       ? 
1 1 1    8    3   37 o    309.5    2.9    0.0000   0.0000          ?        ?   957.7824  17.8786          ?        ?      309.5        2.9       ?       ? 
1 1 1    8    3   38 o    470.9    2.6    0.0000   0.0000          ?        ?  2217.5854  24.9023          ?        ?      470.9        2.6       ?       ? 
1 1 1    8    3   39 o   1025.9    3.6    0.0000   0.0000          ?        ? 10524.7520  74.0685          ?        ?     1025.9        3.6       ?       ? 
1 1 1    8    3   40 o    116.6    8.2    0.0000   0.0000          ?        ?   136.0051  19.1556          ?        ?      116.6        8.2       ?       ? 
1 1 1    8    3   41 o   1432.3    5.0    0.0000   0.0000          ?        ? 20518.2539 143.0288          ?        ?     1432.3        5.0       ?       ? 
1 1 1    8    3   42 o    429.6    2.9    0.0000   0.0000          ?        ?  1845.9661  24.9023          ?        ?      429.6        2.9       ?       ? 
1 1 1    8    3   43 o    461.5    2.8    0.0000   0.0000          ?        ?  2129.4697  25.5409          ?        ?      461.5        2.8       ?       ? 
1 1 1    8    3   44 o    583.0    2.6    0.0000   0.0000          ?        ?  3399.4893  30.0105          ?        ?      583.0        2.6       ?       ? 
1 1 1    8    3   45 o    418.0    3.1    0.0000   0.0000          ?        ?  1746.9952  25.5409          ?        ?      418.0        3.1       ?       ? 
1 1 1    8    3   46 o    225.1    4.4    0.0000   0.0000          ?        ?   506.9862  19.7942          ?        ?      225.1        4.4       ?       ? 
1 1 1    8    3   47 o    210.8    4.5    0.0000   0.0000          ?        ?   444.4110  19.1556          ?        ?      210.8        4.5       ?       ? 
1 1 1    8    3   48 o    270.4    3.5    0.0000   0.0000          ?        ?   731.1072  19.1556          ?        ?      270.4        3.5       ?       ? 
1 1 1    8    3   49 o    651.4    2.8    0.0000   0.0000          ?        ?  4243.6147  36.3957          ?        ?      651.4        2.8       ?       ? 
1 1 1    8    3   50 o    412.8    2.9    0.0000   0.0000          ?        ?  1704.2142  23.6253          ?        ?      412.8        2.9       ?       ? 
1 1 1    8    3   51 o    198.5    5.0    0.0000   0.0000          ?        ?   393.9678  19.7942          ?        ?      198.5        5.0       ?       ? 
1 1 1    8    3   52 o    514.9    2.7    0.0000   0.0000          ?        ?  2651.1418  27.4564          ?        ?      514.9        2.7       ?       ? 
1 1 1    8    3   53 o    683.0    2.9    0.0000   0.0000          ?        ?  4665.6777  39.5883          ?        ?      683.0        2.9       ?       ? 
1 1 1    8    3   54 o    112.4    8.8    0.0000   0.0000          ?        ?   126.4273  19.7942          ?        ?      112.4        8.8       ?       ? 
1 1 1    8    3   55 o     64.5   15.9    0.0000   0.0000          ?        ?    43.4195  20.4327          ?        ?       64.5       15.9       ?       ? 
1 1 1    8    3   56 o    333.3    3.2    0.0000   0.0000          ?        ?  1111.0276  21.0712          ?        ?      333.3        3.2       ?       ? 
1 1 1    8    3   57 o    228.3    4.3    0.0000   0.0000          ?        ?   521.6721  19.7942          ?        ?      228.3        4.3       ?       ? 
1 1 1    8    3   58 o    126.7    7.8    0.0000   0.0000          ?        ?   160.9075  19.7942          ?        ?      126.7        7.8       ?       ? 
1 1 1    8    3   59 o    331.8    3.5    0.0000   0.0000          ?        ?  1101.4498  22.9868          ?        ?      331.8        3.5       ?       ? 
1 1 1    8    3   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    3   61 o     39.4   16.2    0.0000   0.0000          ?        ?     5.1082  20.4327          ?        ?       39.4       16.2       ?       ? 
1 1 1    8    3   62 o     27.7   13.2    0.0000   0.0000          ?        ?   -24.9023  19.7942          ?        ?       27.7       13.2       ?       ? 
1 1 1    8    3   63 o     22.8   11.3    0.0000   0.0000          ?        ?   -47.8891  19.7942          ?        ?       22.8       11.3       ?       ? 
1 1 1    8    3   64 o    348.2    3.1    0.0000   0.0000          ?        ?  1213.1910  21.7097          ?        ?      348.2        3.1       ?       ? 
1 1 1    8    3   65 o    382.9    3.0    0.0000   0.0000          ?        ?  1466.6842  22.9868          ?        ?      382.9        3.0       ?       ? 
1 1 1    8    3   66 o     23.3   11.5    0.0000   0.0000          ?        ?   -41.5039  19.1556          ?        ?       23.3       11.5       ?       ? 
1 1 1    8    3   67 o    101.1    9.5    0.0000   0.0000          ?        ?   102.8020  19.1556          ?        ?      101.1        9.5       ?       ? 
1 1 1    8    3   68 o    132.5    7.7    0.0000   0.0000          ?        ?   176.2320  20.4327          ?        ?      132.5        7.7       ?       ? 
1 1 1    8    3   69 o    338.3    3.3    0.0000   0.0000          ?        ?  1145.5078  22.3483          ?        ?      338.3        3.3       ?       ? 
1 1 1    8    3   70 o    284.1    4.0    0.0000   0.0000          ?        ?   807.7299  22.9868          ?        ?      284.1        4.0       ?       ? 
1 1 1    8    3   71 o    212.9    5.2    0.0000   0.0000          ?        ?   453.9889  22.3483          ?        ?      212.9        5.2       ?       ? 
1 1 1    8    3   72 o    232.8    4.7    0.0000   0.0000          ?        ?   542.7434  21.7097          ?        ?      232.8        4.7       ?       ? 
1 1 1    8    3   73 o     31.8   14.6    0.0000   0.0000          ?        ?   -14.6860  21.0712          ?        ?       31.8       14.6       ?       ? 
1 1 1    8    3   74 o    113.6   10.1    0.0000   0.0000          ?        ?   130.2584  22.9868          ?        ?      113.6       10.1       ?       ? 
1 1 1    8    3   75 o    130.6    8.3    0.0000   0.0000          ?        ?   171.7623  21.7097          ?        ?      130.6        8.3       ?       ? 
1 1 1    8    3   76 o     41.9   16.9    0.0000   0.0000          ?        ?     8.9393  21.7097          ?        ?       41.9       16.9       ?       ? 
1 1 1    8    3   77 o     31.7   14.6    0.0000   0.0000          ?        ?   -16.6016  21.7097          ?        ?       31.7       14.6       ?       ? 
1 1 1    8    3   78 o    251.0    4.5    0.0000   0.0000          ?        ?   631.4979  22.3483          ?        ?      251.0        4.5       ?       ? 
1 1 1    8    3   79 o     57.9   16.7    0.0000   0.0000          ?        ?    35.7572  20.4327          ?        ?       57.9       16.7       ?       ? 
1 1 1    8    3   80 o    213.6    5.1    0.0000   0.0000          ?        ?   458.4586  21.7097          ?        ?      213.6        5.1       ?       ? 
1 1 1    8    3   81 o    165.9    6.7    0.0000   0.0000          ?        ?   277.7569  22.3483          ?        ?      165.9        6.7       ?       ? 
1 1 1    8    4    0 o    731.1    4.6 5346.3413  67.0448  5346.3413  67.0448  5346.3413  67.0448      731.1      4.6      731.1        4.6     0.0     0.0 
1 1 1    8    4    1 o    644.1    2.6    0.0000   0.0000          ?        ?  4149.1133  33.2031          ?        ?      644.1        2.6       ?       ? 
1 1 1    8    4    2 f    919.4    3.4    0.0000   0.0000          ?        ?  8453.3877  62.5751          ?        ?      919.4        3.4       ?       ? 
1 1 1    8    4    3 o   1355.8    4.7    0.0000   0.0000          ?        ? 18383.0371 128.3428          ?        ?     1355.8        4.7       ?       ? 
1 1 1    8    4    4 o    136.8    1.2    0.0000   0.0000          ?        ?   187.0868   3.1926          ?        ?      136.8        1.2       ?       ? 
1 1 1    8    4    5 o   2026.9    7.1    0.0000   0.0000          ?        ? 41088.2266 288.6118          ?        ?     2026.9        7.1       ?       ? 
1 1 1    8    4    6 o   2147.9    7.3    0.0000   0.0000          ?        ? 46143.4062 314.7912          ?        ?     2147.9        7.3       ?       ? 
1 1 1    8    4    7 o    340.2    1.4    0.0000   0.0000          ?        ?  1157.6398   9.5778          ?        ?      340.2        1.4       ?       ? 
1 1 1    8    4    8 o    446.5    1.8    0.0000   0.0000          ?        ?  1993.4646  15.9630          ?        ?      446.5        1.8       ?       ? 
1 1 1    8    4    9 o   1211.7    4.1    0.0000   0.0000          ?        ? 14682.8047  99.6094          ?        ?     1211.7        4.1       ?       ? 
1 1 1    8    4   10 o    914.8    3.1    0.0000   0.0000          ?        ?  8369.1025  56.8284          ?        ?      914.8        3.1       ?       ? 
1 1 1    8    4   11 o    674.2    2.5    0.0000   0.0000          ?        ?  4545.6357  33.2031          ?        ?      674.2        2.5       ?       ? 
1 1 1    8    4   12 o    943.4    3.2    0.0000   0.0000          ?        ?  8900.9912  60.6596          ?        ?      943.4        3.2       ?       ? 
1 1 1    8    4   13 o   1443.1    4.8    0.0000   0.0000          ?        ? 20826.0215 137.2822          ?        ?     1443.1        4.8       ?       ? 
1 1 1    8    4   14 f   1508.9    5.0    0.0000   0.0000          ?        ? 22770.3203 149.4141          ?        ?     1508.9        5.0       ?       ? 
1 1 1    8    4   15 o    918.6    3.2    0.0000   0.0000          ?        ?  8438.0635  58.1055          ?        ?      918.6        3.2       ?       ? 
1 1 1    8    4   16 o   1023.4    3.5    0.0000   0.0000          ?        ? 10473.0312  70.8759          ?        ?     1023.4        3.5       ?       ? 
1 1 1    8    4   17 o    897.9    3.1    0.0000   0.0000          ?        ?  8062.6123  56.1899          ?        ?      897.9        3.1       ?       ? 
1 1 1    8    4   18 o    843.9    3.0    0.0000   0.0000          ?        ?  7122.0703  49.8047          ?        ?      843.9        3.0       ?       ? 
1 1 1    8    4   19 o    473.1    1.9    0.0000   0.0000          ?        ?  2238.6570  17.8786          ?        ?      473.1        1.9       ?       ? 
1 1 1    8    4   20 o    340.5    1.7    0.0000   0.0000          ?        ?  1159.5553  11.4934          ?        ?      340.5        1.7       ?       ? 
1 1 1    8    4   21 o    671.2    2.4    0.0000   0.0000          ?        ?  4504.7700  32.5646          ?        ?      671.2        2.4       ?       ? 
1 1 1    8    4   22 o    901.2    3.1    0.0000   0.0000          ?        ?  8121.9951  56.1899          ?        ?      901.2        3.1       ?       ? 
1 1 1    8    4   23 o   1289.8    4.4    0.0000   0.0000          ?        ? 16637.9570 113.6568          ?        ?     1289.8        4.4       ?       ? 
1 1 1    8    4   24 o    884.6    3.1    0.0000   0.0000          ?        ?  7825.0825  54.9129          ?        ?      884.6        3.1       ?       ? 
1 1 1    8    4   25 o    444.0    1.9    0.0000   0.0000          ?        ?  1971.7548  17.2401          ?        ?      444.0        1.9       ?       ? 
1 1 1    8    4   26 o    581.1    2.3    0.0000   0.0000          ?        ?  3377.1411  26.8179          ?        ?      581.1        2.3       ?       ? 
1 1 1    8    4   27 o    551.1    2.2    0.0000   0.0000          ?        ?  3037.4475  24.2638          ?        ?      551.1        2.2       ?       ? 
1 1 1    8    4   28 o    573.2    2.3    0.0000   0.0000          ?        ?  3285.1938  26.1794          ?        ?      573.2        2.3       ?       ? 
1 1 1    8    4   29 o   1059.9    3.6    0.0000   0.0000          ?        ? 11234.1494  77.2611          ?        ?     1059.9        3.6       ?       ? 
1 1 1    8    4   30 o   1514.8    5.5    0.0000   0.0000          ?        ? 22948.4668 166.0156          ?        ?     1514.8        5.5       ?       ? 
1 1 1    8    4   31 o   1223.5    4.2    0.0000   0.0000          ?        ? 14971.4160 103.4405          ?        ?     1223.5        4.2       ?       ? 
1 1 1    8    4   32 o   1466.3    5.4    0.0000   0.0000          ?        ? 21503.4922 159.6304          ?        ?     1466.3        5.4       ?       ? 
1 1 1    8    4   33 o   1295.9    4.8    0.0000   0.0000          ?        ? 16795.0352 125.1502          ?        ?     1295.9        4.8       ?       ? 
1 1 1    8    4   34 o   1651.7    5.9    0.0000   0.0000          ?        ? 27283.3906 195.3876          ?        ?     1651.7        5.9       ?       ? 
1 1 1    8    4   35 o   1242.7    4.6    0.0000   0.0000          ?        ? 15444.5615 115.5724          ?        ?     1242.7        4.6       ?       ? 
1 1 1    8    4   36 o    536.9    2.4    0.0000   0.0000          ?        ?  2882.2866  25.5409          ?        ?      536.9        2.4       ?       ? 
1 1 1    8    4   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    4   38 o    655.8    2.7    0.0000   0.0000          ?        ?  4301.0815  35.1187          ?        ?      655.8        2.7       ?       ? 
1 1 1    8    4   39 o   1096.6    3.8    0.0000   0.0000          ?        ? 12025.2783  82.3693          ?        ?     1096.6        3.8       ?       ? 
1 1 1    8    4   40 o    718.8    3.0    0.0000   0.0000          ?        ?  5167.5557  42.7809          ?        ?      718.8        3.0       ?       ? 
1 1 1    8    4   41 o    841.8    3.3    0.0000   0.0000          ?        ?  7086.3135  55.5514          ?        ?      841.8        3.3       ?       ? 
1 1 1    8    4   42 o    771.7    3.1    0.0000   0.0000          ?        ?  5954.8525  47.8891          ?        ?      771.7        3.1       ?       ? 
1 1 1    8    4   43 o    765.6    3.0    0.0000   0.0000          ?        ?  5861.6284  45.9736          ?        ?      765.6        3.0       ?       ? 
1 1 1    8    4   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    4   45 o    592.5    2.8    0.0000   0.0000          ?        ?  3511.2305  33.2031          ?        ?      592.5        2.8       ?       ? 
1 1 1    8    4   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    4   47 o    578.4    2.8    0.0000   0.0000          ?        ?  3345.2148  31.9261          ?        ?      578.4        2.8       ?       ? 
1 1 1    8    4   48 o    360.4    3.0    0.0000   0.0000          ?        ?  1298.7529  21.7097          ?        ?      360.4        3.0       ?       ? 
1 1 1    8    4   49 o    728.0    3.2    0.0000   0.0000          ?        ?  5301.0068  46.6121          ?        ?      728.0        3.2       ?       ? 
1 1 1    8    4   50 o    647.6    2.9    0.0000   0.0000          ?        ?  4193.8101  37.0343          ?        ?      647.6        2.9       ?       ? 
1 1 1    8    4   51 o    527.5    2.8    0.0000   0.0000          ?        ?  2782.6772  29.3720          ?        ?      527.5        2.8       ?       ? 
1 1 1    8    4   52 o    619.4    2.8    0.0000   0.0000          ?        ?  3837.5149  34.4802          ?        ?      619.4        2.8       ?       ? 
1 1 1    8    4   53 o    454.5    2.9    0.0000   0.0000          ?        ?  2066.2561  26.1794          ?        ?      454.5        2.9       ?       ? 
1 1 1    8    4   54 f    329.0    3.2    0.0000   0.0000          ?        ?  1082.2942  21.0712          ?        ?      329.0        3.2       ?       ? 
1 1 1    8    4   55 f    231.1    4.3    0.0000   0.0000          ?        ?   534.4426  19.7942          ?        ?      231.1        4.3       ?       ? 
1 1 1    8    4   56 o    431.2    3.0    0.0000   0.0000          ?        ?  1859.3750  25.5409          ?        ?      431.2        3.0       ?       ? 
1 1 1    8    4   57 o    396.4    3.1    0.0000   0.0000          ?        ?  1571.4017  24.9023          ?        ?      396.4        3.1       ?       ? 
1 1 1    8    4   58 o    294.7    3.6    0.0000   0.0000          ?        ?   869.0280  21.0712          ?        ?      294.7        3.6       ?       ? 
1 1 1    8    4   59 o    138.8    7.1    0.0000   0.0000          ?        ?   192.8335  19.7942          ?        ?      138.8        7.1       ?       ? 
1 1 1    8    4   60 f    342.1    3.3    0.0000   0.0000          ?        ?  1170.4102  22.3483          ?        ?      342.1        3.3       ?       ? 
1 1 1    8    4   61 o    613.9    2.8    0.0000   0.0000          ?        ?  3769.8318  33.8416          ?        ?      613.9        2.8       ?       ? 
1 1 1    8    4   62 o    428.8    2.8    0.0000   0.0000          ?        ?  1838.9423  24.2638          ?        ?      428.8        2.8       ?       ? 
1 1 1    8    4   63 o    343.3    3.3    0.0000   0.0000          ?        ?  1178.7109  22.3483          ?        ?      343.3        3.3       ?       ? 
1 1 1    8    4   64 o    501.2    2.7    0.0000   0.0000          ?        ?  2513.2212  27.4564          ?        ?      501.2        2.7       ?       ? 
1 1 1    8    4   65 o     29.5   13.8    0.0000   0.0000          ?        ?   -20.4327  20.4327          ?        ?       29.5       13.8       ?       ? 
1 1 1    8    4   66 o    273.9    3.7    0.0000   0.0000          ?        ?   750.9014  20.4327          ?        ?      273.9        3.7       ?       ? 
1 1 1    8    4   67 o     61.8   16.3    0.0000   0.0000          ?        ?    40.2269  20.4327          ?        ?       61.8       16.3       ?       ? 
1 1 1    8    4   68 o    209.1    5.0    0.0000   0.0000          ?        ?   438.0258  21.0712          ?        ?      209.1        5.0       ?       ? 
1 1 1    8    4   69 o    225.9    4.8    0.0000   0.0000          ?        ?   510.8173  21.7097          ?        ?      225.9        4.8       ?       ? 
1 1 1    8    4   70 o    136.0    7.7    0.0000   0.0000          ?        ?   185.8098  21.0712          ?        ?      136.0        7.7       ?       ? 
1 1 1    8    4   71 o    453.3    2.9    0.0000   0.0000          ?        ?  2056.0396  26.1794          ?        ?      453.3        2.9       ?       ? 
1 1 1    8    4   72 o    395.0    3.2    0.0000   0.0000          ?        ?  1561.8240  25.5409          ?        ?      395.0        3.2       ?       ? 
1 1 1    8    4   73 o    236.2    4.6    0.0000   0.0000          ?        ?   558.7064  21.7097          ?        ?      236.2        4.6       ?       ? 
1 1 1    8    4   74 o    198.7    5.3    0.0000   0.0000          ?        ?   395.8834  21.0712          ?        ?      198.7        5.3       ?       ? 
1 1 1    8    4   75 o     71.5   15.6    0.0000   0.0000          ?        ?    54.2743  21.7097          ?        ?       71.5       15.6       ?       ? 
1 1 1    8    4   76 o    108.4   10.0    0.0000   0.0000          ?        ?   118.7650  21.7097          ?        ?      108.4       10.0       ?       ? 
1 1 1    8    4   77 o     21.8   11.1    0.0000   0.0000          ?        ?   -90.0316  24.9023          ?        ?       21.8       11.1       ?       ? 
1 1 1    8    4   78 o    100.1   10.2    0.0000   0.0000          ?        ?   101.5249  20.4327          ?        ?      100.1       10.2       ?       ? 
1 1 1    8    4   79 o     42.9   16.8    0.0000   0.0000          ?        ?    12.1319  21.0712          ?        ?       42.9       16.8       ?       ? 
1 1 1    8    4   80 o     86.4   12.2    0.0000   0.0000          ?        ?    76.6226  21.0712          ?        ?       86.4       12.2       ?       ? 
1 1 1    8    4   81 o    145.4    7.9    0.0000   0.0000          ?        ?   213.9047  22.9868          ?        ?      145.4        7.9       ?       ? 
1 1 1    8    5    0 o    313.7    2.4  983.9619  15.3245   983.9619  15.3245   983.9619  15.3245      313.7      2.4      313.7        2.4     0.0     0.0 
1 1 1    8    5    1 o    311.4    1.5    0.0000   0.0000          ?        ?   969.9143   9.5778          ?        ?      311.4        1.5       ?       ? 
1 1 1    8    5    2 o   1239.3    4.5    0.0000   0.0000          ?        ? 15358.3613 111.1028          ?        ?     1239.3        4.5       ?       ? 
1 1 1    8    5    3 o    277.5    1.5    0.0000   0.0000          ?        ?   770.0571   8.3008          ?        ?      277.5        1.5       ?       ? 
1 1 1    8    5    4 o    758.0    2.7    0.0000   0.0000          ?        ?  5746.0562  40.8654          ?        ?      758.0        2.7       ?       ? 
1 1 1    8    5    5 o    802.1    2.7    0.0000   0.0000          ?        ?  6434.3823  44.0580          ?        ?      802.1        2.7       ?       ? 
1 1 1    8    5    6 o    883.1    3.1    0.0000   0.0000          ?        ?  7798.9033  54.9129          ?        ?      883.1        3.1       ?       ? 
1 1 1    8    5    7 o    728.2    2.5    0.0000   0.0000          ?        ?  5302.9219  37.0343          ?        ?      728.2        2.5       ?       ? 
1 1 1    8    5    8 o   1249.7    4.1    0.0000   0.0000          ?        ? 15617.5996 103.4405          ?        ?     1249.7        4.1       ?       ? 
1 1 1    8    5    9 o   1296.9    4.3    0.0000   0.0000          ?        ? 16819.2988 111.1028          ?        ?     1296.9        4.3       ?       ? 
1 1 1    8    5   10 o    715.3    2.6    0.0000   0.0000          ?        ?  5117.1123  37.0343          ?        ?      715.3        2.6       ?       ? 
1 1 1    8    5   11 o    331.3    1.4    0.0000   0.0000          ?        ?  1097.6187   9.5778          ?        ?      331.3        1.4       ?       ? 
1 1 1    8    5   12 o    994.3    3.4    0.0000   0.0000          ?        ?  9886.2305  67.0448          ?        ?      994.3        3.4       ?       ? 
1 1 1    8    5   13 o   1723.5    5.6    0.0000   0.0000          ?        ? 29709.1328 192.8335          ?        ?     1723.5        5.6       ?       ? 
1 1 1    8    5   14 o    545.7    2.5    0.0000   0.0000          ?        ?  2977.4263  26.8179          ?        ?      545.7        2.5       ?       ? 
1 1 1    8    5   15 o   1828.7    5.9    0.0000   0.0000          ?        ? 33445.7617 215.8203          ?        ?     1828.7        5.9       ?       ? 
1 1 1    8    5   16 f   1163.4    3.9    0.0000   0.0000          ?        ? 13536.6582  90.6701          ?        ?     1163.4        3.9       ?       ? 
1 1 1    8    5   17 o    359.0    1.6    0.0000   0.0000          ?        ?  1288.5366  11.4934          ?        ?      359.0        1.6       ?       ? 
1 1 1    8    5   18 o    613.3    2.3    0.0000   0.0000          ?        ?  3761.5308  28.0950          ?        ?      613.3        2.3       ?       ? 
1 1 1    8    5   19 o    695.2    2.5    0.0000   0.0000          ?        ?  4833.6089  35.1187          ?        ?      695.2        2.5       ?       ? 
1 1 1    8    5   20 o    632.7    2.4    0.0000   0.0000          ?        ?  4002.8923  30.0105          ?        ?      632.7        2.4       ?       ? 
1 1 1    8    5   21 o    443.1    1.9    0.0000   0.0000          ?        ?  1963.4540  16.6016          ?        ?      443.1        1.9       ?       ? 
1 1 1    8    5   22 o    724.9    2.7    0.0000   0.0000          ?        ?  5254.3945  38.9498          ?        ?      724.9        2.7       ?       ? 
1 1 1    8    5   23 o    990.9    3.5    0.0000   0.0000          ?        ?  9819.1855  68.9603          ?        ?      990.9        3.5       ?       ? 
1 1 1    8    5   24 o   1323.0    4.4    0.0000   0.0000          ?        ? 17504.4316 116.2109          ?        ?     1323.0        4.4       ?       ? 
1 1 1    8    5   25 o   1436.6    4.8    0.0000   0.0000          ?        ? 20640.2109 137.2822          ?        ?     1436.6        4.8       ?       ? 
1 1 1    8    5   26 o    486.4    2.1    0.0000   0.0000          ?        ?  2366.3611  20.4327          ?        ?      486.4        2.1       ?       ? 
1 1 1    8    5   27 o   1008.8    3.5    0.0000   0.0000          ?        ? 10176.7578  70.2374          ?        ?     1008.8        3.5       ?       ? 
1 1 1    8    5   28 o    900.5    3.4    0.0000   0.0000          ?        ?  8109.2246  61.2981          ?        ?      900.5        3.4       ?       ? 
1 1 1    8    5   29 o   1768.1    5.9    0.0000   0.0000          ?        ? 31266.4902 208.7966          ?        ?     1768.1        5.9       ?       ? 
1 1 1    8    5   30 o    574.7    2.6    0.0000   0.0000          ?        ?  3303.0723  29.3720          ?        ?      574.7        2.6       ?       ? 
1 1 1    8    5   31 o    752.3    3.0    0.0000   0.0000          ?        ?  5659.2173  44.6965          ?        ?      752.3        3.0       ?       ? 
1 1 1    8    5   32 o   1693.5    6.2    0.0000   0.0000          ?        ? 28684.3066 210.0736          ?        ?     1693.5        6.2       ?       ? 
1 1 1    8    5   33 o   1103.8    4.4    0.0000   0.0000          ?        ? 12184.9082  96.4168          ?        ?     1103.8        4.4       ?       ? 
1 1 1    8    5   34 o    505.6    2.5    0.0000   0.0000          ?        ?  2556.0020  24.9023          ?        ?      505.6        2.5       ?       ? 
1 1 1    8    5   35 o   1533.2    5.3    0.0000   0.0000          ?        ? 23510.3672 161.5460          ?        ?     1533.2        5.3       ?       ? 
1 1 1    8    5   36 o    750.4    2.9    0.0000   0.0000          ?        ?  5630.4834  43.4195          ?        ?      750.4        2.9       ?       ? 
1 1 1    8    5   37 o    513.1    2.4    0.0000   0.0000          ?        ?  2632.6245  24.9023          ?        ?      513.1        2.4       ?       ? 
1 1 1    8    5   38 o    273.4    3.3    0.0000   0.0000          ?        ?   747.7088  17.8786          ?        ?      273.4        3.3       ?       ? 
1 1 1    8    5   39 o    756.5    2.9    0.0000   0.0000          ?        ?  5723.0693  43.4195          ?        ?      756.5        2.9       ?       ? 
1 1 1    8    5   40 o    227.3    3.8    0.0000   0.0000          ?        ?   516.5640  17.2401          ?        ?      227.3        3.8       ?       ? 
1 1 1    8    5   41 f   1221.5    4.4    0.0000   0.0000          ?        ? 14920.9736 107.2716          ?        ?     1221.5        4.4       ?       ? 
1 1 1    8    5   42 o    707.2    3.0    0.0000   0.0000          ?        ?  5002.1787  42.1424          ?        ?      707.2        3.0       ?       ? 
1 1 1    8    5   43 o    155.6    5.7    0.0000   0.0000          ?        ?   241.9997  17.8786          ?        ?      155.6        5.7       ?       ? 
1 1 1    8    5   44 o    243.9    3.5    0.0000   0.0000          ?        ?   595.1021  17.2401          ?        ?      243.9        3.5       ?       ? 
1 1 1    8    5   45 o    775.4    3.2    0.0000   0.0000          ?        ?  6012.3193  49.1662          ?        ?      775.4        3.2       ?       ? 
1 1 1    8    5   46 o    270.1    3.5    0.0000   0.0000          ?        ?   729.8303  19.1556          ?        ?      270.1        3.5       ?       ? 
1 1 1    8    5   47 o    372.6    3.1    0.0000   0.0000          ?        ?  1388.1460  22.9868          ?        ?      372.6        3.1       ?       ? 
1 1 1    8    5   48 o    481.5    2.8    0.0000   0.0000          ?        ?  2318.4722  26.8179          ?        ?      481.5        2.8       ?       ? 
1 1 1    8    5   49 o    172.8    5.9    0.0000   0.0000          ?        ?   298.8281  20.4327          ?        ?      172.8        5.9       ?       ? 
1 1 1    8    5   50 o    530.0    2.7    0.0000   0.0000          ?        ?  2809.4951  28.7335          ?        ?      530.0        2.7       ?       ? 
1 1 1    8    5   51 o     48.2   17.2    0.0000   0.0000          ?        ?    19.7942  21.0712          ?        ?       48.2       17.2       ?       ? 
1 1 1    8    5   52 o    241.3    4.5    0.0000   0.0000          ?        ?   582.3317  21.7097          ?        ?      241.3        4.5       ?       ? 
1 1 1    8    5   53 o    636.9    2.9    0.0000   0.0000          ?        ?  4057.1665  36.3957          ?        ?      636.9        2.9       ?       ? 
1 1 1    8    5   54 o    289.0    3.6    0.0000   0.0000          ?        ?   835.1863  21.0712          ?        ?      289.0        3.6       ?       ? 
1 1 1    8    5   55 o    571.8    2.8    0.0000   0.0000          ?        ?  3269.8691  31.9261          ?        ?      571.8        2.8       ?       ? 
1 1 1    8    5   56 o    860.2    3.3    0.0000   0.0000          ?        ?  7401.7422  56.1899          ?        ?      860.2        3.3       ?       ? 
1 1 1    8    5   57 o    526.0    2.9    0.0000   0.0000          ?        ?  2767.3528  30.6490          ?        ?      526.0        2.9       ?       ? 
1 1 1    8    5   58 o    544.1    2.9    0.0000   0.0000          ?        ?  2961.4631  31.9261          ?        ?      544.1        2.9       ?       ? 
1 1 1    8    5   59 o    562.9    2.7    0.0000   0.0000          ?        ?  3168.9827  30.0105          ?        ?      562.9        2.7       ?       ? 
1 1 1    8    5   60 o    235.6    4.1    0.0000   0.0000          ?        ?   555.5138  19.1556          ?        ?      235.6        4.1       ?       ? 
1 1 1    8    5   61 o    475.2    2.7    0.0000   0.0000          ?        ?  2259.0894  25.5409          ?        ?      475.2        2.7       ?       ? 
1 1 1    8    5   62 o    266.6    4.0    0.0000   0.0000          ?        ?   711.3131  21.0712          ?        ?      266.6        4.0       ?       ? 
1 1 1    8    5   63 o     93.3   10.3    0.0000   0.0000          ?        ?    87.4775  19.1556          ?        ?       93.3       10.3       ?       ? 
1 1 1    8    5   64 o    150.0    7.0    0.0000   0.0000          ?        ?   225.3981  21.0712          ?        ?      150.0        7.0       ?       ? 
1 1 1    8    5   65 o    566.3    2.8    0.0000   0.0000          ?        ?  3208.5713  31.2876          ?        ?      566.3        2.8       ?       ? 
1 1 1    8    5   66 o     42.2   16.9    0.0000   0.0000          ?        ?     8.9393  21.7097          ?        ?       42.2       16.9       ?       ? 
1 1 1    8    5   67 o    412.0    3.0    0.0000   0.0000          ?        ?  1698.4675  24.9023          ?        ?      412.0        3.0       ?       ? 
1 1 1    8    5   68 o    232.6    4.5    0.0000   0.0000          ?        ?   541.4664  21.0712          ?        ?      232.6        4.5       ?       ? 
1 1 1    8    5   69 o    307.0    3.8    0.0000   0.0000          ?        ?   943.0964  23.6253          ?        ?      307.0        3.8       ?       ? 
1 1 1    8    5   70 o    137.4    8.1    0.0000   0.0000          ?        ?   189.6409  22.3483          ?        ?      137.4        8.1       ?       ? 
1 1 1    8    5   71 o     25.8   12.7    0.0000   0.0000          ?        ?   -44.6965  22.3483          ?        ?       25.8       12.7       ?       ? 
1 1 1    8    5   72 o    426.4    3.0    0.0000   0.0000          ?        ?  1819.7866  25.5409          ?        ?      426.4        3.0       ?       ? 
1 1 1    8    5   73 o    119.1    9.6    0.0000   0.0000          ?        ?   143.0288  22.9868          ?        ?      119.1        9.6       ?       ? 
1 1 1    8    5   74 o    108.1   10.6    0.0000   0.0000          ?        ?   118.1265  22.9868          ?        ?      108.1       10.6       ?       ? 
1 1 1    8    5   75 o    489.0    3.0    0.0000   0.0000          ?        ?  2393.1790  29.3720          ?        ?      489.0        3.0       ?       ? 
1 1 1    8    5   76 o    161.8    6.5    0.0000   0.0000          ?        ?   263.0709  21.0712          ?        ?      161.8        6.5       ?       ? 
1 1 1    8    5   77 o     27.8   13.4    0.0000   0.0000          ?        ?   -33.8416  22.3483          ?        ?       27.8       13.4       ?       ? 
1 1 1    8    5   78 o    169.7    6.8    0.0000   0.0000          ?        ?   289.8888  22.9868          ?        ?      169.7        6.8       ?       ? 
1 1 1    8    5   79 o     24.7   12.1    0.0000   0.0000          ?        ?   -36.3957  19.7942          ?        ?       24.7       12.1       ?       ? 
1 1 1    8    5   80 o    100.7   10.8    0.0000   0.0000          ?        ?   103.4405  21.7097          ?        ?      100.7       10.8       ?       ? 
1 1 1    8    5   81 o    210.1    5.3    0.0000   0.0000          ?        ?   443.7725  22.3483          ?        ?      210.1        5.3       ?       ? 
1 1 1    8    6    0 o    539.0    3.3 2905.2734  35.7572  2905.2734  35.7572  2905.2734  35.7572      539.0      3.3      539.0        3.3     0.0     0.0 
1 1 1    8    6    1 o    461.2    2.1    0.0000   0.0000          ?        ?  2126.9155  19.7942          ?        ?      461.2        2.1       ?       ? 
1 1 1    8    6    2 o    938.7    3.6    0.0000   0.0000          ?        ?  8812.2363  67.6833          ?        ?      938.7        3.6       ?       ? 
1 1 1    8    6    3 o   1248.3    4.7    0.0000   0.0000          ?        ? 15584.3975 116.8494          ?        ?     1248.3        4.7       ?       ? 
1 1 1    8    6    4 o    389.5    1.6    0.0000   0.0000          ?        ?  1517.1274  12.7704          ?        ?      389.5        1.6       ?       ? 
1 1 1    8    6    5 o   1441.4    4.7    0.0000   0.0000          ?        ? 20776.2168 136.0051          ?        ?     1441.4        4.7       ?       ? 
1 1 1    8    6    6 o   1126.5    3.8    0.0000   0.0000          ?        ? 12689.9785  86.2004          ?        ?     1126.5        3.8       ?       ? 
1 1 1    8    6    7 o    641.1    2.3    0.0000   0.0000          ?        ?  4109.5249  29.3720          ?        ?      641.1        2.3       ?       ? 
1 1 1    8    6    8 f    712.1    2.6    0.0000   0.0000          ?        ?  5070.5000  36.3957          ?        ?      712.1        2.6       ?       ? 
1 1 1    8    6    9 o    214.3    1.5    0.0000   0.0000          ?        ?   459.0970   6.3852          ?        ?      214.3        1.5       ?       ? 
1 1 1    8    6   10 o    230.8    1.4    0.0000   0.0000          ?        ?   532.5270   6.3852          ?        ?      230.8        1.4       ?       ? 
1 1 1    8    6   11 o    728.6    2.6    0.0000   0.0000          ?        ?  5308.6689  37.6728          ?        ?      728.6        2.6       ?       ? 
1 1 1    8    6   12 o    451.5    2.0    0.0000   0.0000          ?        ?  2038.1611  17.8786          ?        ?      451.5        2.0       ?       ? 
1 1 1    8    6   13 o   1178.8    4.0    0.0000   0.0000          ?        ? 13897.4229  93.2242          ?        ?     1178.8        4.0       ?       ? 
1 1 1    8    6   14 o    989.3    3.4    0.0000   0.0000          ?        ?  9787.8984  67.0448          ?        ?      989.3        3.4       ?       ? 
1 1 1    8    6   15 o   1149.8    3.9    0.0000   0.0000          ?        ? 13220.5898  89.3930          ?        ?     1149.8        3.9       ?       ? 
1 1 1    8    6   16 o   1241.6    4.1    0.0000   0.0000          ?        ? 15417.1045 102.1635          ?        ?     1241.6        4.1       ?       ? 
1 1 1    8    6   17 o    233.2    1.5    0.0000   0.0000          ?        ?   544.0204   7.0237          ?        ?      233.2        1.5       ?       ? 
1 1 1    8    6   18 f    627.6    2.3    0.0000   0.0000          ?        ?  3939.0400  28.7335          ?        ?      627.6        2.3       ?       ? 
1 1 1    8    6   19 o    105.1    2.7    0.0000   0.0000          ?        ?   110.4642   5.7467          ?        ?      105.1        2.7       ?       ? 
1 1 1    8    6   20 o    783.8    2.8    0.0000   0.0000          ?        ?  6143.2163  43.4195          ?        ?      783.8        2.8       ?       ? 
1 1 1    8    6   21 o    606.9    2.3    0.0000   0.0000          ?        ?  3682.9927  28.0950          ?        ?      606.9        2.3       ?       ? 
1 1 1    8    6   22 o    928.5    3.2    0.0000   0.0000          ?        ?  8621.9580  60.0210          ?        ?      928.5        3.2       ?       ? 
1 1 1    8    6   23 o    946.5    3.3    0.0000   0.0000          ?        ?  8959.7354  63.2136          ?        ?      946.5        3.3       ?       ? 
1 1 1    8    6   24 o    617.6    2.4    0.0000   0.0000          ?        ?  3814.5283  29.3720          ?        ?      617.6        2.4       ?       ? 
1 1 1    8    6   25 o   1226.3    4.1    0.0000   0.0000          ?        ? 15039.7373 101.5249          ?        ?     1226.3        4.1       ?       ? 
1 1 1    8    6   26 o    971.2    3.4    0.0000   0.0000          ?        ?  9433.5186  65.7677          ?        ?      971.2        3.4       ?       ? 
1 1 1    8    6   27 o   1570.7    5.2    0.0000   0.0000          ?        ? 24673.7520 164.1001          ?        ?     1570.7        5.2       ?       ? 
1 1 1    8    6   28 o    196.2    2.9    0.0000   0.0000          ?        ?   385.0285  11.4934          ?        ?      196.2        2.9       ?       ? 
1 1 1    8    6   29 o    156.2    4.1    0.0000   0.0000          ?        ?   243.9153  12.7704          ?        ?      156.2        4.1       ?       ? 
1 1 1    8    6   30 o    384.1    2.4    0.0000   0.0000          ?        ?  1475.6235  18.5171          ?        ?      384.1        2.4       ?       ? 
1 1 1    8    6   31 o    464.1    2.4    0.0000   0.0000          ?        ?  2153.7334  22.3483          ?        ?      464.1        2.4       ?       ? 
1 1 1    8    6   32 o   1760.3    6.5    0.0000   0.0000          ?        ? 30991.2871 227.3137          ?        ?     1760.3        6.5       ?       ? 
1 1 1    8    6   33 o   1388.3    5.2    0.0000   0.0000          ?        ? 19275.0527 144.9444          ?        ?     1388.3        5.2       ?       ? 
1 1 1    8    6   34 o    786.5    3.3    0.0000   0.0000          ?        ?  6185.3589  51.7203          ?        ?      786.5        3.3       ?       ? 
1 1 1    8    6   35 o   2653.9    8.7    0.0000   0.0000          ?        ? 70448.7266 459.7356          ?        ?     2653.9        8.7       ?       ? 
1 1 1    8    6   36 o    351.8    2.9    0.0000   0.0000          ?        ?  1237.4550  20.4327          ?        ?      351.8        2.9       ?       ? 
1 1 1    8    6   37 o   2101.4    6.8    0.0000   0.0000          ?        ? 44164.6250 285.4192          ?        ?     2101.4        6.8       ?       ? 
1 1 1    8    6   38 f   1040.5    3.8    0.0000   0.0000          ?        ? 10827.4111  79.8152          ?        ?     1040.5        3.8       ?       ? 
1 1 1    8    6   39 o   1117.6    3.8    0.0000   0.0000          ?        ? 12492.0371  85.5619          ?        ?     1117.6        3.8       ?       ? 
1 1 1    8    6   40 o    342.5    2.6    0.0000   0.0000          ?        ?  1172.9642  17.8786          ?        ?      342.5        2.6       ?       ? 
1 1 1    8    6   41 o    174.0    5.3    0.0000   0.0000          ?        ?   302.6593  18.5171          ?        ?      174.0        5.3       ?       ? 
1 1 1    8    6   42 o    868.8    3.2    0.0000   0.0000          ?        ?  7549.2417  55.5514          ?        ?      868.8        3.2       ?       ? 
1 1 1    8    6   43 o    906.4    3.4    0.0000   0.0000          ?        ?  8215.8574  61.2981          ?        ?      906.4        3.4       ?       ? 
1 1 1    8    6   44 o    623.4    2.7    0.0000   0.0000          ?        ?  3886.6812  33.8416          ?        ?      623.4        2.7       ?       ? 
1 1 1    8    6   45 o    405.2    2.9    0.0000   0.0000          ?        ?  1641.6392  23.6253          ?        ?      405.2        2.9       ?       ? 
1 1 1    8    6   46 o    231.9    4.1    0.0000   0.0000          ?        ?   537.6352  19.1556          ?        ?      231.9        4.1       ?       ? 
1 1 1    8    6   47 o    594.7    2.7    0.0000   0.0000          ?        ?  3536.7715  31.9261          ?        ?      594.7        2.7       ?       ? 
1 1 1    8    6   48 o    206.3    5.4    0.0000   0.0000          ?        ?   425.8939  22.3483          ?        ?      206.3        5.4       ?       ? 
1 1 1    8    6   49 o    765.3    3.2    0.0000   0.0000          ?        ?  5857.1587  49.1662          ?        ?      765.3        3.2       ?       ? 
1 1 1    8    6   50 o    640.8    2.8    0.0000   0.0000          ?        ?  4106.3325  35.7572          ?        ?      640.8        2.8       ?       ? 
1 1 1    8    6   51 o    368.8    3.5    0.0000   0.0000          ?        ?  1360.0510  25.5409          ?        ?      368.8        3.5       ?       ? 
1 1 1    8    6   52 o    380.8    3.1    0.0000   0.0000          ?        ?  1450.0826  23.6253          ?        ?      380.8        3.1       ?       ? 
1 1 1    8    6   53 o    328.2    3.2    0.0000   0.0000          ?        ?  1077.1859  21.0712          ?        ?      328.2        3.2       ?       ? 
1 1 1    8    6   54 o    509.2    2.8    0.0000   0.0000          ?        ?  2593.0364  28.0950          ?        ?      509.2        2.8       ?       ? 
1 1 1    8    6   55 o    314.0    3.5    0.0000   0.0000          ?        ?   986.5159  21.7097          ?        ?      314.0        3.5       ?       ? 
1 1 1    8    6   56 o    435.7    2.8    0.0000   0.0000          ?        ?  1898.9633  24.2638          ?        ?      435.7        2.8       ?       ? 
1 1 1    8    6   57 o    225.7    4.4    0.0000   0.0000          ?        ?   509.5403  19.7942          ?        ?      225.7        4.4       ?       ? 
1 1 1    8    6   58 o    167.2    5.9    0.0000   0.0000          ?        ?   279.6725  19.7942          ?        ?      167.2        5.9       ?       ? 
1 1 1    8    6   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    6   60 o    242.7    4.2    0.0000   0.0000          ?        ?   589.3555  20.4327          ?        ?      242.7        4.2       ?       ? 
1 1 1    8    6   61 o    262.4    3.8    0.0000   0.0000          ?        ?   688.9648  19.7942          ?        ?      262.4        3.8       ?       ? 
1 1 1    8    6   62 o    273.6    3.7    0.0000   0.0000          ?        ?   748.9859  20.4327          ?        ?      273.6        3.7       ?       ? 
1 1 1    8    6   63 o    163.2    6.1    0.0000   0.0000          ?        ?   266.9020  19.7942          ?        ?      163.2        6.1       ?       ? 
1 1 1    8    6   64 o    256.4    4.1    0.0000   0.0000          ?        ?   657.6772  21.0712          ?        ?      256.4        4.1       ?       ? 
1 1 1    8    6   65 o    145.9    7.0    0.0000   0.0000          ?        ?   213.2662  20.4327          ?        ?      145.9        7.0       ?       ? 
1 1 1    8    6   66 o    137.7    7.7    0.0000   0.0000          ?        ?   190.2794  21.0712          ?        ?      137.7        7.7       ?       ? 
1 1 1    8    6   67 o    320.1    3.6    0.0000   0.0000          ?        ?  1025.4658  22.9868          ?        ?      320.1        3.6       ?       ? 
1 1 1    8    6   68 o    210.2    5.0    0.0000   0.0000          ?        ?   442.4955  21.0712          ?        ?      210.2        5.0       ?       ? 
1 1 1    8    6   69 o    281.0    3.9    0.0000   0.0000          ?        ?   790.4898  21.7097          ?        ?      281.0        3.9       ?       ? 
1 1 1    8    6   70 o    345.9    3.3    0.0000   0.0000          ?        ?  1197.2280  22.9868          ?        ?      345.9        3.3       ?       ? 
1 1 1    8    6   71 f    122.7    8.3    0.0000   0.0000          ?        ?   151.3296  20.4327          ?        ?      122.7        8.3       ?       ? 
1 1 1    8    6   72 o    297.2    3.8    0.0000   0.0000          ?        ?   884.3525  22.3483          ?        ?      297.2        3.8       ?       ? 
1 1 1    8    6   73 o    151.1    7.2    0.0000   0.0000          ?        ?   229.2293  21.7097          ?        ?      151.1        7.2       ?       ? 
1 1 1    8    6   74 o    113.9    9.8    0.0000   0.0000          ?        ?   130.8969  22.3483          ?        ?      113.9        9.8       ?       ? 
1 1 1    8    6   75 o    224.6    5.1    0.0000   0.0000          ?        ?   505.7091  22.9868          ?        ?      224.6        5.1       ?       ? 
1 1 1    8    6   76 o     50.2   17.5    0.0000   0.0000          ?        ?    23.6253  21.7097          ?        ?       50.2       17.5       ?       ? 
1 1 1    8    6   77 o    135.3    8.3    0.0000   0.0000          ?        ?   184.5327  22.3483          ?        ?      135.3        8.3       ?       ? 
1 1 1    8    6   78 o    112.9    9.3    0.0000   0.0000          ?        ?   128.9814  21.0712          ?        ?      112.9        9.3       ?       ? 
1 1 1    8    6   79 o    152.0    7.4    0.0000   0.0000          ?        ?   233.0604  22.3483          ?        ?      152.0        7.4       ?       ? 
1 1 1    8    6   80 o    141.4    7.2    0.0000   0.0000          ?        ?   201.7728  20.4327          ?        ?      141.4        7.2       ?       ? 
1 1 1    8    6   81 o    154.0    6.6    0.0000   0.0000          ?        ?   239.4456  20.4327          ?        ?      154.0        6.6       ?       ? 
1 1 1    8    7    0 o    128.0    3.0  164.1001   7.6623   164.1001   7.6623   164.1001   7.6623      128.0      3.0      128.0        3.0     0.0     0.0 
1 1 1    8    7    1 o    702.4    3.2    0.0000   0.0000          ?        ?  4933.2178  45.3350          ?        ?      702.4        3.2       ?       ? 
1 1 1    8    7    2 o    486.8    2.0    0.0000   0.0000          ?        ?  2369.5537  19.7942          ?        ?      486.8        2.0       ?       ? 
1 1 1    8    7    3 o    338.3    1.7    0.0000   0.0000          ?        ?  1144.2307  11.4934          ?        ?      338.3        1.7       ?       ? 
1 1 1    8    7    4 o    276.6    1.7    0.0000   0.0000          ?        ?   764.9489   9.5778          ?        ?      276.6        1.7       ?       ? 
1 1 1    8    7    5 o    677.7    2.4    0.0000   0.0000          ?        ?  4592.8857  33.2031          ?        ?      677.7        2.4       ?       ? 
1 1 1    8    7    6 o   1333.0    4.4    0.0000   0.0000          ?        ? 17770.6953 118.1265          ?        ?     1333.0        4.4       ?       ? 
1 1 1    8    7    7 o   1574.7    5.1    0.0000   0.0000          ?        ? 24800.1797 161.5460          ?        ?     1574.7        5.1       ?       ? 
1 1 1    8    7    8 o   1473.9    4.9    0.0000   0.0000          ?        ? 21724.4219 144.9444          ?        ?     1473.9        4.9       ?       ? 
1 1 1    8    7    9 o   1447.4    4.7    0.0000   0.0000          ?        ? 20949.8945 136.6436          ?        ?     1447.4        4.7       ?       ? 
1 1 1    8    7   10 o    281.8    1.5    0.0000   0.0000          ?        ?   794.3209   8.3008          ?        ?      281.8        1.5       ?       ? 
1 1 1    8    7   11 o    574.2    2.2    0.0000   0.0000          ?        ?  3296.6870  24.9023          ?        ?      574.2        2.2       ?       ? 
1 1 1    8    7   12 o   1257.0    4.2    0.0000   0.0000          ?        ? 15801.4941 105.3561          ?        ?     1257.0        4.2       ?       ? 
1 1 1    8    7   13 o   1398.4    4.6    0.0000   0.0000          ?        ? 19557.9180 128.9814          ?        ?     1398.4        4.6       ?       ? 
1 1 1    8    7   14 o   1652.2    5.4    0.0000   0.0000          ?        ? 27301.2695 179.4246          ?        ?     1652.2        5.4       ?       ? 
1 1 1    8    7   15 o    644.3    2.3    0.0000   0.0000          ?        ?  4151.0288  30.0105          ?        ?      644.3        2.3       ?       ? 
1 1 1    8    7   16 o   2371.2    7.6    0.0000   0.0000          ?        ? 56239.0703 360.7647          ?        ?     2371.2        7.6       ?       ? 
1 1 1    8    7   17 o    596.7    2.3    0.0000   0.0000          ?        ?  3560.3965  27.4564          ?        ?      596.7        2.3       ?       ? 
1 1 1    8    7   18 o    336.4    1.6    0.0000   0.0000          ?        ?  1131.4603  10.8549          ?        ?      336.4        1.6       ?       ? 
1 1 1    8    7   19 o   1080.1    3.7    0.0000   0.0000          ?        ? 11667.0664  79.1767          ?        ?     1080.1        3.7       ?       ? 
1 1 1    8    7   20 o   1387.7    4.6    0.0000   0.0000          ?        ? 19259.7285 128.3428          ?        ?     1387.7        4.6       ?       ? 
1 1 1    8    7   21 o    835.2    3.0    0.0000   0.0000          ?        ?  6975.2104  49.8047          ?        ?      835.2        3.0       ?       ? 
1 1 1    8    7   22 o    427.9    1.9    0.0000   0.0000          ?        ?  1831.2799  15.9630          ?        ?      427.9        1.9       ?       ? 
1 1 1    8    7   23 o    404.0    2.0    0.0000   0.0000          ?        ?  1632.0613  15.9630          ?        ?      404.0        2.0       ?       ? 
1 1 1    8    7   24 o   1201.0    4.0    0.0000   0.0000          ?        ? 14426.1191  97.0553          ?        ?     1201.0        4.0       ?       ? 
1 1 1    8    7   25 o    673.0    2.5    0.0000   0.0000          ?        ?  4529.0337  33.8416          ?        ?      673.0        2.5       ?       ? 
1 1 1    8    7   26 o   1521.3    5.0    0.0000   0.0000          ?        ? 23146.4082 152.6067          ?        ?     1521.3        5.0       ?       ? 
1 1 1    8    7   27 o    519.9    2.2    0.0000   0.0000          ?        ?  2702.8621  22.9868          ?        ?      519.9        2.2       ?       ? 
1 1 1    8    7   28 o   1576.2    5.2    0.0000   0.0000          ?        ? 24844.8770 164.1001          ?        ?     1576.2        5.2       ?       ? 
1 1 1    8    7   29 o   1500.9    5.5    0.0000   0.0000          ?        ? 22527.6816 164.1001          ?        ?     1500.9        5.5       ?       ? 
1 1 1    8    7   30 o    729.3    3.1    0.0000   0.0000          ?        ?  5318.8853  44.6965          ?        ?      729.3        3.1       ?       ? 
1 1 1    8    7   31 o   1807.6    6.1    0.0000   0.0000          ?        ? 32677.6230 222.2055          ?        ?     1807.6        6.1       ?       ? 
1 1 1    8    7   32 f   1318.3    4.6    0.0000   0.0000          ?        ? 17379.9199 121.3191          ?        ?     1318.3        4.6       ?       ? 
1 1 1    8    7   33 o    733.2    3.1    0.0000   0.0000          ?        ?  5375.7139  45.9736          ?        ?      733.2        3.1       ?       ? 
1 1 1    8    7   34 o    720.7    3.0    0.0000   0.0000          ?        ?  5193.7349  43.4195          ?        ?      720.7        3.0       ?       ? 
1 1 1    8    7   35 o   1365.8    4.8    0.0000   0.0000          ?        ? 18656.3242 130.8969          ?        ?     1365.8        4.8       ?       ? 
1 1 1    8    7   36 o   1417.3    4.8    0.0000   0.0000          ?        ? 20090.4434 134.7281          ?        ?     1417.3        4.8       ?       ? 
1 1 1    8    7   37 o    565.4    2.5    0.0000   0.0000          ?        ?  3197.0779  28.0950          ?        ?      565.4        2.5       ?       ? 
1 1 1    8    7   38 o    363.4    2.5    0.0000   0.0000          ?        ?  1320.4628  17.8786          ?        ?      363.4        2.5       ?       ? 
1 1 1    8    7   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    7   40 o    977.8    3.4    0.0000   0.0000          ?        ?  9561.8613  67.0448          ?        ?      977.8        3.4       ?       ? 
1 1 1    8    7   41 o    417.4    2.6    0.0000   0.0000          ?        ?  1742.5255  21.7097          ?        ?      417.4        2.6       ?       ? 
1 1 1    8    7   42 o    354.2    2.8    0.0000   0.0000          ?        ?  1254.6949  19.7942          ?        ?      354.2        2.8       ?       ? 
1 1 1    8    7   43 o    355.4    3.1    0.0000   0.0000          ?        ?  1262.9958  22.3483          ?        ?      355.4        3.1       ?       ? 
1 1 1    8    7   44 o     43.9   16.1    0.0000   0.0000          ?        ?    15.3245  18.5171          ?        ?       43.9       16.1       ?       ? 
1 1 1    8    7   45 o    471.6    3.0    0.0000   0.0000          ?        ?  2224.6094  28.7335          ?        ?      471.6        3.0       ?       ? 
1 1 1    8    7   46 o    529.2    2.7    0.0000   0.0000          ?        ?  2801.1943  28.7335          ?        ?      529.2        2.7       ?       ? 
1 1 1    8    7   47 f    427.0    3.1    0.0000   0.0000          ?        ?  1823.6178  26.8179          ?        ?      427.0        3.1       ?       ? 
1 1 1    8    7   48 o     61.6   15.5    0.0000   0.0000          ?        ?    39.5883  19.1556          ?        ?       61.6       15.5       ?       ? 
1 1 1    8    7   49 o    568.2    2.8    0.0000   0.0000          ?        ?  3228.3655  31.2876          ?        ?      568.2        2.8       ?       ? 
1 1 1    8    7   50 o    310.4    3.3    0.0000   0.0000          ?        ?   963.5291  20.4327          ?        ?      310.4        3.3       ?       ? 
1 1 1    8    7   51 o    216.9    4.4    0.0000   0.0000          ?        ?   470.5904  19.1556          ?        ?      216.9        4.4       ?       ? 
1 1 1    8    7   52 o    363.1    3.2    0.0000   0.0000          ?        ?  1318.5471  22.9868          ?        ?      363.1        3.2       ?       ? 
1 1 1    8    7   53 o    595.5    2.8    0.0000   0.0000          ?        ?  3546.3494  33.2031          ?        ?      595.5        2.8       ?       ? 
1 1 1    8    7   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    7   55 o    365.7    3.1    0.0000   0.0000          ?        ?  1337.7028  22.3483          ?        ?      365.7        3.1       ?       ? 
1 1 1    8    7   56 o    423.8    2.9    0.0000   0.0000          ?        ?  1796.7998  24.9023          ?        ?      423.8        2.9       ?       ? 
1 1 1    8    7   57 o    511.5    2.7    0.0000   0.0000          ?        ?  2616.6616  28.0950          ?        ?      511.5        2.7       ?       ? 
1 1 1    8    7   58 o    228.5    4.5    0.0000   0.0000          ?        ?   522.3107  20.4327          ?        ?      228.5        4.5       ?       ? 
1 1 1    8    7   59 o    349.2    3.1    0.0000   0.0000          ?        ?  1219.5763  21.7097          ?        ?      349.2        3.1       ?       ? 
1 1 1    8    7   60 o    244.0    3.9    0.0000   0.0000          ?        ?   595.7407  19.1556          ?        ?      244.0        3.9       ?       ? 
1 1 1    8    7   61 o    343.4    3.2    0.0000   0.0000          ?        ?  1179.9880  21.7097          ?        ?      343.4        3.2       ?       ? 
1 1 1    8    7   62 o    210.9    4.7    0.0000   0.0000          ?        ?   445.0496  19.7942          ?        ?      210.9        4.7       ?       ? 
1 1 1    8    7   63 o    338.8    3.2    0.0000   0.0000          ?        ?  1148.0619  21.7097          ?        ?      338.8        3.2       ?       ? 
1 1 1    8    7   64 o    335.5    3.2    0.0000   0.0000          ?        ?  1126.3521  21.7097          ?        ?      335.5        3.2       ?       ? 
1 1 1    8    7   65 o    194.4    5.3    0.0000   0.0000          ?        ?   378.6433  20.4327          ?        ?      194.4        5.3       ?       ? 
1 1 1    8    7   66 o    198.8    5.1    0.0000   0.0000          ?        ?   395.8834  20.4327          ?        ?      198.8        5.1       ?       ? 
1 1 1    8    7   67 o     25.7   12.5    0.0000   0.0000          ?        ?   -35.7572  20.4327          ?        ?       25.7       12.5       ?       ? 
1 1 1    8    7   68 o    257.1    4.2    0.0000   0.0000          ?        ?   661.5084  21.7097          ?        ?      257.1        4.2       ?       ? 
1 1 1    8    7   69 o    130.5    8.3    0.0000   0.0000          ?        ?   171.1238  21.7097          ?        ?      130.5        8.3       ?       ? 
1 1 1    8    7   70 f    103.2   10.5    0.0000   0.0000          ?        ?   107.2716  21.7097          ?        ?      103.2       10.5       ?       ? 
1 1 1    8    7   71 o    203.2    5.3    0.0000   0.0000          ?        ?   413.7620  21.7097          ?        ?      203.2        5.3       ?       ? 
1 1 1    8    7   72 o    144.9    7.3    0.0000   0.0000          ?        ?   210.7121  21.0712          ?        ?      144.9        7.3       ?       ? 
1 1 1    8    7   73 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    7   74 o     94.7   10.8    0.0000   0.0000          ?        ?    90.6701  20.4327          ?        ?       94.7       10.8       ?       ? 
1 1 1    8    7   75 o    160.0    7.2    0.0000   0.0000          ?        ?   257.3242  22.9868          ?        ?      160.0        7.2       ?       ? 
1 1 1    8    7   76 o    158.5    7.3    0.0000   0.0000          ?        ?   252.8546  22.9868          ?        ?      158.5        7.3       ?       ? 
1 1 1    8    7   77 o    136.6    8.6    0.0000   0.0000          ?        ?   188.3639  23.6253          ?        ?      136.6        8.6       ?       ? 
1 1 1    8    7   78 o    100.3   10.5    0.0000   0.0000          ?        ?   102.1635  21.0712          ?        ?      100.3       10.5       ?       ? 
1 1 1    8    7   79 o     56.7   17.8    0.0000   0.0000          ?        ?    33.8416  22.3483          ?        ?       56.7       17.8       ?       ? 
1 1 1    8    7   80 o     37.6   16.4    0.0000   0.0000          ?        ?    -1.9156  22.9868          ?        ?       37.6       16.4       ?       ? 
1 1 1    8    7   81 o    124.6    8.5    0.0000   0.0000          ?        ?   157.7148  21.0712          ?        ?      124.6        8.5       ?       ? 
1 1 1    8    8    0 o    730.2    6.6 5332.9326  95.7782  5332.9326  95.7782  5332.9326  95.7782      730.2      6.6      730.2        6.6     0.0     0.0 
1 1 1    8    8    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    8    2 o   1610.2    9.2 25932.2793 296.9126 25932.2793 296.9126 25932.2793 296.9126     1610.2      9.2     1610.2        9.2     0.0     0.0 
1 1 1    8    8    3 o   1701.7    9.7 28965.8945 328.8386 28965.8945 328.8386 28965.8945 328.8386     1701.7      9.7     1701.7        9.7     0.0     0.0 
1 1 1    8    8    4 o   2442.1   13.5 59658.3555 658.9543 59658.3555 658.9543 59658.3555 658.9543     2442.1     13.5     2442.1       13.5     0.0     0.0 
1 1 1    8    8    5 o   1916.3   10.1 36730.3164 385.6671 36730.3164 385.6671 36730.3164 385.6671     1916.3     10.1     1916.3       10.1     0.0     0.0 
1 1 1    8    8    6 o    615.6    3.7 3789.6257  45.3350  3789.6257  45.3350  3789.6257  45.3350      615.6      3.7      615.6        3.7     0.0     0.0 
1 1 1    8    8    7 o    845.7    4.3 7152.0806  72.7915  7152.0806  72.7915  7152.0806  72.7915      845.7      4.3      845.7        4.3     0.0     0.0 
1 1 1    8    8    8 o     68.0    5.7   47.2506   7.6623    47.2506   7.6623    47.2506   7.6623       68.0      5.7       68.0        5.7     0.0     0.0 
1 1 1    8    8    9 o     54.8    4.7   30.6490   5.1082    30.6490   5.1082    30.6490   5.1082       54.8      4.7       54.8        4.7     0.0     0.0 
1 1 1    8    8   10 o    751.0    3.8 5640.0615  56.8284  5640.0615  56.8284  5640.0615  56.8284      751.0      3.8      751.0        3.8     0.0     0.0 
1 1 1    8    8   11 o    197.2    2.1  388.8597   8.3008   388.8597   8.3008   388.8597   8.3008      197.2      2.1      197.2        2.1     0.0     0.0 
1 1 1    8    8   12 o     45.9    8.5   22.9868   7.0237    22.9868   7.0237    22.9868   7.0237       45.9      8.5       45.9        8.5     0.0     0.0 
1 1 1    8    8   13 o   2035.7    9.3 41448.9922 376.7278 41448.9922 376.7278 41448.9922 376.7278     2035.7      9.3     2035.7        9.3     0.0     0.0 
1 1 1    8    8   14 o    461.7    2.6 2132.0237  24.2638  2132.0237  24.2638  2132.0237  24.2638      461.7      2.6      461.7        2.6     0.0     0.0 
1 1 1    8    8   15 o   1493.5    6.9 22309.9453 207.5195 22309.9453 207.5195 22309.9453 207.5195     1493.5      6.9     1493.5        6.9     0.0     0.0 
1 1 1    8    8   16 o    704.6    3.7 4965.1440  51.7203  4965.1440  51.7203  4965.1440  51.7203      704.6      3.7      704.6        3.7     0.0     0.0 
1 1 1    8    8   17 o    697.6    3.8 4866.8120  52.3588  4866.8120  52.3588  4866.8120  52.3588      697.6      3.8      697.6        3.8     0.0     0.0 
1 1 1    8    8   18 o    584.8    3.2 3419.9216  37.6728  3419.9216  37.6728  3419.9216  37.6728      584.8      3.2      584.8        3.2     0.0     0.0 
1 1 1    8    8   19 o   1281.7    6.1 16430.4375 155.1608 16430.4375 155.1608 16430.4375 155.1608     1281.7      6.1     1281.7        6.1     0.0     0.0 
1 1 1    8    8   20 o    832.6    4.2 6933.0684  70.2374  6933.0684  70.2374  6933.0684  70.2374      832.6      4.2      832.6        4.2     0.0     0.0 
1 1 1    8    8   21 f   1386.8    6.5 19234.8242 181.3401 19234.8242 181.3401 19234.8242 181.3401     1386.8      6.5     1386.8        6.5     0.0     0.0 
1 1 1    8    8   22 o    186.6    3.4  348.6328  12.7704   348.6328  12.7704   348.6328  12.7704      186.6      3.4      186.6        3.4     0.0     0.0 
1 1 1    8    8   23 f      9.4    7.0  -24.9023   8.9393   -24.9023   8.9393   -24.9023   8.9393        9.4      7.0        9.4        7.0     0.0     0.0 
1 1 1    8    8   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    8   25 o    591.8    3.3 3502.9294  38.9498  3502.9294  38.9498  3502.9294  38.9498      591.8      3.3      591.8        3.3     0.0     0.0 
1 1 1    8    8   26 o    499.1    3.3 2491.5115  32.5646  2491.5115  32.5646  2491.5115  32.5646      499.1      3.3      499.1        3.3     0.0     0.0 
1 1 1    8    8   27 o    331.6    3.0 1100.1727  19.7942  1100.1727  19.7942  1100.1727  19.7942      331.6      3.0      331.6        3.0     0.0     0.0 
1 1 1    8    8   28 o   1370.9    7.2 18797.4375 197.3032 18797.4375 197.3032 18797.4375 197.3032     1370.9      7.2     1370.9        7.2     0.0     0.0 
1 1 1    8    8   29 o   2515.3   11.9 63284.5156 599.5718 63284.5156 599.5718 63284.5156 599.5718     2515.3     11.9     2515.3       11.9     0.0     0.0 
1 1 1    8    8   30 o    300.1    3.2  900.9540  19.1556   900.9540  19.1556   900.9540  19.1556      300.1      3.2      300.1        3.2     0.0     0.0 
1 1 1    8    8   31 o    406.5    4.2 1653.1324  33.8416  1653.1324  33.8416  1653.1324  33.8416      406.5      4.2      406.5        4.2     0.0     0.0 
1 1 1    8    8   32 o    247.5    4.5  612.9808  22.3483   612.9808  22.3483   612.9808  22.3483      247.5      4.5      247.5        4.5     0.0     0.0 
1 1 1    8    8   33 o   1300.4    6.5 16911.8848 168.5697 16911.8848 168.5697 16911.8848 168.5697     1300.4      6.5     1300.4        6.5     0.0     0.0 
1 1 1    8    8   34 o    954.2    6.0 9107.2344 114.9339  9107.2344 114.9339  9107.2344 114.9339      954.2      6.0      954.2        6.0     0.0     0.0 
1 1 1    8    8   35 o   2928.4   22.6 85847.9531 1326.2094 85847.9531 1326.2094 85847.9531 1326.2094     2928.4     22.6     2928.4       22.6     0.0     0.0 
1 1 1    8    8   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    8   37 o    255.6    4.5  653.8461  22.9868   653.8461  22.9868   653.8461  22.9868      255.6      4.5      255.6        4.5     0.0     0.0 
1 1 1    8    8   38 o    597.9    3.7 3575.0828  44.6965  3575.0828  44.6965  3575.0828  44.6965      597.9      3.7      597.9        3.7     0.0     0.0 
1 1 1    8    8   39 o    832.6    4.4 6933.0684  74.0685  6933.0684  74.0685  6933.0684  74.0685      832.6      4.4      832.6        4.4     0.0     0.0 
1 1 1    8    8   40 o   1164.4    6.0 13560.9229 139.8362 13560.9229 139.8362 13560.9229 139.8362     1164.4      6.0     1164.4        6.0     0.0     0.0 
1 1 1    8    8   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    8   42 o    349.7    4.4 1223.4075  30.6490  1223.4075  30.6490  1223.4075  30.6490      349.7      4.4      349.7        4.4     0.0     0.0 
1 1 1    8    8   43 o     31.1   19.6    5.7467  24.9023     5.7467  24.9023     5.7467  24.9023       31.1     19.6       31.1       19.6     0.0     0.0 
1 1 1    8    8   44 f    322.8    4.4 1042.7058  28.0950  1042.7058  28.0950  1042.7058  28.0950      322.8      4.4      322.8        4.4     0.0     0.0 
1 1 1    8    8   45 o    112.7   11.2  130.8969  24.9023   130.8969  24.9023   130.8969  24.9023      112.7     11.2      112.7       11.2     0.0     0.0 
1 1 1    8    8   46 o    881.0    4.9 7763.1465  86.2004  7763.1465  86.2004  7763.1465  86.2004      881.0      4.9      881.0        4.9     0.0     0.0 
1 1 1    8    8   47 o    117.4   11.3  141.7518  26.1794   141.7518  26.1794   141.7518  26.1794      117.4     11.3      117.4       11.3     0.0     0.0 
1 1 1    8    8   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    8   49 o    117.5   11.1  141.7518  25.5409   141.7518  25.5409   141.7518  25.5409      117.5     11.1      117.5       11.1     0.0     0.0 
1 1 1    8    8   50 o    335.9    4.8 1128.9062  31.9261  1128.9062  31.9261  1128.9062  31.9261      335.9      4.8      335.9        4.8     0.0     0.0 
1 1 1    8    8   51 o    244.2    5.8  597.6562  28.0950   597.6562  28.0950   597.6562  28.0950      244.2      5.8      244.2        5.8     0.0     0.0 
1 1 1    8    8   52 o    550.4    4.1 3030.4236  44.6965  3030.4236  44.6965  3030.4236  44.6965      550.4      4.1      550.4        4.1     0.0     0.0 
1 1 1    8    8   53 o    177.4    7.8  316.7067  27.4564   316.7067  27.4564   316.7067  27.4564      177.4      7.8      177.4        7.8     0.0     0.0 
1 1 1    8    8   54 o    227.2    6.6  517.8410  30.0105   517.8410  30.0105   517.8410  30.0105      227.2      6.6      227.2        6.6     0.0     0.0 
1 1 1    8    8   55 o    428.4    3.9 1836.3882  33.2031  1836.3882  33.2031  1836.3882  33.2031      428.4      3.9      428.4        3.9     0.0     0.0 
1 1 1    8    8   56 o    315.5    4.5  996.0938  28.0950   996.0938  28.0950   996.0938  28.0950      315.5      4.5      315.5        4.5     0.0     0.0 
1 1 1    8    8   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    8   58 o    183.8    7.5  339.6935  27.4564   339.6935  27.4564   339.6935  27.4564      183.8      7.5      183.8        7.5     0.0     0.0 
1 1 1    8    8   59 o    957.5    5.2 9173.0020  99.6094  9173.0020  99.6094  9173.0020  99.6094      957.5      5.2      957.5        5.2     0.0     0.0 
1 1 1    8    8   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    8   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    8   62 o    497.9    4.3 2480.6565  42.7809  2480.6565  42.7809  2480.6565  42.7809      497.9      4.3      497.9        4.3     0.0     0.0 
1 1 1    8    8   63 o    120.4   11.6  149.4141  27.4564   149.4141  27.4564   149.4141  27.4564      120.4     11.6      120.4       11.6     0.0     0.0 
1 1 1    8    8   64 o     14.4   10.7  -95.1397  26.1794   -95.1397  26.1794   -95.1397  26.1794       14.4     10.7       14.4       10.7     0.0     0.0 
1 1 1    8    8   65 o    518.3    4.1 2687.5376  42.1424  2687.5376  42.1424  2687.5376  42.1424      518.3      4.1      518.3        4.1     0.0     0.0 
1 1 1    8    8   66 o    226.4    6.9  514.6484  31.2876   514.6484  31.2876   514.6484  31.2876      226.4      6.9      226.4        6.9     0.0     0.0 
1 1 1    8    8   67 o     23.0   16.4  -34.4802  30.0105   -34.4802  30.0105   -34.4802  30.0105       23.0     16.4       23.0       16.4     0.0     0.0 
1 1 1    8    8   68 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    8    8   69 o    318.6    5.2 1016.5264  33.2031  1016.5264  33.2031  1016.5264  33.2031      318.6      5.2      318.6        5.2     0.0     0.0 
1 1 1    8    8   70 o    265.7    6.3  708.1205  33.2031   708.1205  33.2031   708.1205  33.2031      265.7      6.3      265.7        6.3     0.0     0.0 
1 1 1    8    8   71 f    420.5    4.6 1769.9821  38.3113  1769.9821  38.3113  1769.9821  38.3113      420.5      4.6      420.5        4.6     0.0     0.0 
1 1 1    8    8   72 o    378.4    4.7 1434.1196  35.7572  1434.1196  35.7572  1434.1196  35.7572      378.4      4.7      378.4        4.7     0.0     0.0 
1 1 1    8    8   73 o    332.9    4.8 1109.7506  31.9261  1109.7506  31.9261  1109.7506  31.9261      332.9      4.8      332.9        4.8     0.0     0.0 
1 1 1    8    8   74 o    281.7    5.6  795.5980  31.2876   795.5980  31.2876   795.5980  31.2876      281.7      5.6      281.7        5.6     0.0     0.0 
1 1 1    8    8   75 o    156.1    9.9  247.7464  30.6490   247.7464  30.6490   247.7464  30.6490      156.1      9.9      156.1        9.9     0.0     0.0 
1 1 1    8    8   76 o    446.2    4.3 1994.1029  38.3113  1994.1029  38.3113  1994.1029  38.3113      446.2      4.3      446.2        4.3     0.0     0.0 
1 1 1    8    8   77 o    421.3    4.5 1777.6442  37.6728  1777.6442  37.6728  1777.6442  37.6728      421.3      4.5      421.3        4.5     0.0     0.0 
1 1 1    8    8   78 o     16.9   12.6  -86.2004  30.0105   -86.2004  30.0105   -86.2004  30.0105       16.9     12.6       16.9       12.6     0.0     0.0 
1 1 1    8    8   79 o    168.5    9.9  289.2503  33.2031   289.2503  33.2031   289.2503  33.2031      168.5      9.9      168.5        9.9     0.0     0.0 
1 1 1    8    8   80 o    122.5   12.2  156.4378  29.3720   156.4378  29.3720   156.4378  29.3720      122.5     12.2      122.5       12.2     0.0     0.0 
1 1 1    8    8   81 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    0    0 o   1607.9   10.5 25856.9336 337.7780 25856.9336 337.7780 25856.9336 337.7780     1607.9     10.5     1607.9       10.5     0.0     0.0 
1 1 1    9    0    1 o    658.3    3.3 4334.2847  43.4195  4334.2847  43.4195  4334.2847  43.4195      658.3      3.3      658.3        3.3     0.0     0.0 
1 1 1    9    0    2 o   1904.5    8.6 36276.3281 328.8386 36276.3281 328.8386 36276.3281 328.8386     1904.5      8.6     1904.5        8.6     0.0     0.0 
1 1 1    9    0    3 o    915.6    4.4 8383.1504  80.4537  8383.1504  80.4537  8383.1504  80.4537      915.6      4.4      915.6        4.4     0.0     0.0 
1 1 1    9    0    4 o    358.3    2.0 1284.0670  14.6860  1284.0670  14.6860  1284.0670  14.6860      358.3      2.0      358.3        2.0     0.0     0.0 
1 1 1    9    0    5 o   1277.9    5.9 16331.4678 151.3296 16331.4678 151.3296 16331.4678 151.3296     1277.9      5.9     1277.9        5.9     0.0     0.0 
1 1 1    9    0    6 o   2073.8    9.4 43015.2891 388.2211 43015.2891 388.2211 43015.2891 388.2211     2073.8      9.4     2073.8        9.4     0.0     0.0 
1 1 1    9    0    7 o    602.0    3.1 3624.8875  37.0343  3624.8875  37.0343  3624.8875  37.0343      602.0      3.1      602.0        3.1     0.0     0.0 
1 1 1    9    0    8 o   1452.1    6.8 21087.1758 196.0261 21087.1758 196.0261 21087.1758 196.0261     1452.1      6.8     1452.1        6.8     0.0     0.0 
1 1 1    9    0    9 o     14.3    8.3    2.5541   3.8311     2.5541   3.8311     2.5541   3.8311       14.3      8.3       14.3        8.3     0.0     0.0 
1 1 1    9    0   10 f   1422.1    6.9 20227.0879 195.3876 20227.0879 195.3876 20227.0879 195.3876     1422.1      6.9     1422.1        6.9     0.0     0.0 
1 1 1    9    0   11 o   1122.9    5.3 12609.5254 119.4035 12609.5254 119.4035 12609.5254 119.4035     1122.9      5.3     1122.9        5.3     0.0     0.0 
1 1 1    9    0   12 o    250.6    2.0  628.3053  10.2163   628.3053  10.2163   628.3053  10.2163      250.6      2.0      250.6        2.0     0.0     0.0 
1 1 1    9    0   13 o    917.3    4.5 8415.0771  83.0078  8415.0771  83.0078  8415.0771  83.0078      917.3      4.5      917.3        4.5     0.0     0.0 
1 1 1    9    0   14 o    399.4    2.3 1595.0271  18.5171  1595.0271  18.5171  1595.0271  18.5171      399.4      2.3      399.4        2.3     0.0     0.0 
1 1 1    9    0   15 o    676.0    3.4 4570.5376  46.6121  4570.5376  46.6121  4570.5376  46.6121      676.0      3.4      676.0        3.4     0.0     0.0 
1 1 1    9    0   16 o   1630.0    7.5 26574.6309 243.9153 26574.6309 243.9153 26574.6309 243.9153     1630.0      7.5     1630.0        7.5     0.0     0.0 
1 1 1    9    0   17 o     11.6    8.2   -7.0237   7.0237    -7.0237   7.0237    -7.0237   7.0237       11.6      8.2       11.6        8.2     0.0     0.0 
1 1 1    9    0   18 f   1224.8    6.3 15002.7051 155.1608 15002.7051 155.1608 15002.7051 155.1608     1224.8      6.3     1224.8        6.3     0.0     0.0 
1 1 1    9    0   19 o   1247.8    5.9 15570.9893 147.4985 15570.9893 147.4985 15570.9893 147.4985     1247.8      5.9     1247.8        5.9     0.0     0.0 
1 1 1    9    0   20 o    656.3    3.5 4308.1055  45.3350  4308.1055  45.3350  4308.1055  45.3350      656.3      3.5      656.3        3.5     0.0     0.0 
1 1 1    9    0   21 o   1646.0    7.6 27096.9434 250.3005 27096.9434 250.3005 27096.9434 250.3005     1646.0      7.6     1646.0        7.6     0.0     0.0 
1 1 1    9    0   22 o    559.0    3.3 3125.5635  37.0343  3125.5635  37.0343  3125.5635  37.0343      559.0      3.3      559.0        3.3     0.0     0.0 
1 1 1    9    0   23 o   1353.9    6.3 18334.5098 171.7623 18334.5098 171.7623 18334.5098 171.7623     1353.9      6.3     1353.9        6.3     0.0     0.0 
1 1 1    9    0   24 o     21.5   13.4    3.1926  11.4934     3.1926  11.4934     3.1926  11.4934       21.5     13.4       21.5       13.4     0.0     0.0 
1 1 1    9    0   25 o    632.0    3.4 3994.5911  42.7809  3994.5911  42.7809  3994.5911  42.7809      632.0      3.4      632.0        3.4     0.0     0.0 
1 1 1    9    0   26 o   1154.5    5.8 13329.7783 134.0895 13329.7783 134.0895 13329.7783 134.0895     1154.5      5.8     1154.5        5.8     0.0     0.0 
1 1 1    9    0   27 o   1088.8    5.5 11857.3467 120.0421 11857.3467 120.0421 11857.3467 120.0421     1088.8      5.5     1088.8        5.5     0.0     0.0 
1 1 1    9    0   28 f    179.3    3.4  321.8149  12.1319   321.8149  12.1319   321.8149  12.1319      179.3      3.4      179.3        3.4     0.0     0.0 
1 1 1    9    0   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    0   30 o     14.4   10.7  -54.9129  20.4327   -54.9129  20.4327   -54.9129  20.4327       14.4     10.7       14.4       10.7     0.0     0.0 
1 1 1    9    0   31 o    468.6    3.5 2195.8757  32.5646  2195.8757  32.5646  2195.8757  32.5646      468.6      3.5      468.6        3.5     0.0     0.0 
1 1 1    9    0   32 o    596.7    3.7 3561.0352  44.0580  3561.0352  44.0580  3561.0352  44.0580      596.7      3.7      596.7        3.7     0.0     0.0 
1 1 1    9    0   33 f    458.0    3.2 2098.1821  29.3720  2098.1821  29.3720  2098.1821  29.3720      458.0      3.2      458.0        3.2     0.0     0.0 
1 1 1    9    0   34 o   1071.4    5.7 11480.6191 121.9576 11480.6191 121.9576 11480.6191 121.9576     1071.4      5.7     1071.4        5.7     0.0     0.0 
1 1 1    9    0   35 o    314.4    3.7  989.0699  22.9868   989.0699  22.9868   989.0699  22.9868      314.4      3.7      314.4        3.7     0.0     0.0 
1 1 1    9    0   36 o    398.8    3.3 1590.5574  26.1794  1590.5574  26.1794  1590.5574  26.1794      398.8      3.3      398.8        3.3     0.0     0.0 
1 1 1    9    0   37 f    835.5    4.3 6980.9570  71.5144  6980.9570  71.5144  6980.9570  71.5144      835.5      4.3      835.5        4.3     0.0     0.0 
1 1 1    9    0   38 o   1022.5    5.1 10455.7920 104.7175 10455.7920 104.7175 10455.7920 104.7175     1022.5      5.1     1022.5        5.1     0.0     0.0 
1 1 1    9    0   39 o    614.3    3.7 3773.6628  45.9736  3773.6628  45.9736  3773.6628  45.9736      614.3      3.7      614.3        3.7     0.0     0.0 
1 1 1    9    0   40 f    174.8    8.6  307.7674  30.0105   307.7674  30.0105   307.7674  30.0105      174.8      8.6      174.8        8.6     0.0     0.0 
1 1 1    9    0   41 o    403.3    4.8 1626.9531  38.9498  1626.9531  38.9498  1626.9531  38.9498      403.3      4.8      403.3        4.8     0.0     0.0 
1 1 1    9    0   42 o    722.2    4.1 5216.0835  58.7440  5216.0835  58.7440  5216.0835  58.7440      722.2      4.1      722.2        4.1     0.0     0.0 
1 1 1    9    0   43 o    913.6    5.0 8347.3936  90.6701  8347.3936  90.6701  8347.3936  90.6701      913.6      5.0      913.6        5.0     0.0     0.0 
1 1 1    9    0   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    0   45 o    826.2    4.9 6827.7119  80.4537  6827.7119  80.4537  6827.7119  80.4537      826.2      4.9      826.2        4.9     0.0     0.0 
1 1 1    9    0   46 f    587.1    4.0 3448.0168  46.6121  3448.0168  46.6121  3448.0168  46.6121      587.1      4.0      587.1        4.0     0.0     0.0 
1 1 1    9    0   47 o   1293.6    6.2 16738.2051 160.2689 16738.2051 160.2689 16738.2051 160.2689     1293.6      6.2     1293.6        6.2     0.0     0.0 
1 1 1    9    0   48 f     33.8   21.4    5.1082  30.6490     5.1082  30.6490     5.1082  30.6490       33.8     21.4       33.8       21.4     0.0     0.0 
1 1 1    9    0   49 o    108.6   13.3  123.2347  28.0950   123.2347  28.0950   123.2347  28.0950      108.6     13.3      108.6       13.3     0.0     0.0 
1 1 1    9    0   50 o   1075.0    5.5 11558.5186 117.4880 11558.5186 117.4880 11558.5186 117.4880     1075.0      5.5     1075.0        5.5     0.0     0.0 
1 1 1    9    0   51 o    351.9    5.1 1239.3705  35.7572  1239.3705  35.7572  1239.3705  35.7572      351.9      5.1      351.9        5.1     0.0     0.0 
1 1 1    9    0   52 o    141.3    9.3  202.4114  26.1794   202.4114  26.1794   202.4114  26.1794      141.3      9.3      141.3        9.3     0.0     0.0 
1 1 1    9    0   53 o    346.8    4.5 1203.6133  31.2876  1203.6133  31.2876  1203.6133  31.2876      346.8      4.5      346.8        4.5     0.0     0.0 
1 1 1    9    0   54 o    581.2    3.7 3379.0566  43.4195  3379.0566  43.4195  3379.0566  43.4195      581.2      3.7      581.2        3.7     0.0     0.0 
1 1 1    9    0   55 o    407.0    4.0 1657.6022  32.5646  1657.6022  32.5646  1657.6022  32.5646      407.0      4.0      407.0        4.0     0.0     0.0 
1 1 1    9    0   56 o    464.3    3.9 2156.2876  36.3957  2156.2876  36.3957  2156.2876  36.3957      464.3      3.9      464.3        3.9     0.0     0.0 
1 1 1    9    0   57 o    320.8    4.5 1029.9354  28.7335  1029.9354  28.7335  1029.9354  28.7335      320.8      4.5      320.8        4.5     0.0     0.0 
1 1 1    9    0   58 o    136.5   10.2  189.6409  27.4564   189.6409  27.4564   189.6409  27.4564      136.5     10.2      136.5       10.2     0.0     0.0 
1 1 1    9    0   59 o    275.6    5.3  760.4792  29.3720   760.4792  29.3720   760.4792  29.3720      275.6      5.3      275.6        5.3     0.0     0.0 
1 1 1    9    0   60 f     16.0   11.9  -73.4300  26.1794   -73.4300  26.1794   -73.4300  26.1794       16.0     11.9       16.0       11.9     0.0     0.0 
1 1 1    9    0   61 o    386.5    4.7 1495.4176  36.3957  1495.4176  36.3957  1495.4176  36.3957      386.5      4.7      386.5        4.7     0.0     0.0 
1 1 1    9    0   62 o    375.4    4.5 1410.4943  33.8416  1410.4943  33.8416  1410.4943  33.8416      375.4      4.5      375.4        4.5     0.0     0.0 
1 1 1    9    0   63 o    396.6    4.0 1573.9558  31.9261  1573.9558  31.9261  1573.9558  31.9261      396.6      4.0      396.6        4.0     0.0     0.0 
1 1 1    9    0   64 o    135.8    9.7  187.7254  26.1794   187.7254  26.1794   187.7254  26.1794      135.8      9.7      135.8        9.7     0.0     0.0 
1 1 1    9    0   65 o    225.6    6.8  510.8173  30.6490   510.8173  30.6490   510.8173  30.6490      225.6      6.8      225.6        6.8     0.0     0.0 
1 1 1    9    0   66 o    161.2    8.6  262.4324  27.4564   262.4324  27.4564   262.4324  27.4564      161.2      8.6      161.2        8.6     0.0     0.0 
1 1 1    9    0   67 o    321.7    5.3 1036.3207  33.8416  1036.3207  33.8416  1036.3207  33.8416      321.7      5.3      321.7        5.3     0.0     0.0 
1 1 1    9    0   68 o     44.9   24.5   29.3720  30.6490    29.3720  30.6490    29.3720  30.6490       44.9     24.5       44.9       24.5     0.0     0.0 
1 1 1    9    0   69 o    229.9    6.7  530.6115  30.6490   530.6115  30.6490   530.6115  30.6490      229.9      6.7      229.9        6.7     0.0     0.0 
1 1 1    9    0   70 o    375.4    4.6 1411.1328  34.4802  1411.1328  34.4802  1411.1328  34.4802      375.4      4.6      375.4        4.6     0.0     0.0 
1 1 1    9    0   71 o    316.2    5.3 1001.8404  33.2031  1001.8404  33.2031  1001.8404  33.2031      316.2      5.3      316.2        5.3     0.0     0.0 
1 1 1    9    0   72 o     22.5   16.2  -42.1424  31.2876   -42.1424  31.2876   -42.1424  31.2876       22.5     16.2       22.5       16.2     0.0     0.0 
1 1 1    9    0   73 o    260.6    6.5  681.3026  33.8416   681.3026  33.8416   681.3026  33.8416      260.6      6.5      260.6        6.5     0.0     0.0 
1 1 1    9    0   74 o    391.2    4.7 1532.4519  37.0343  1532.4519  37.0343  1532.4519  37.0343      391.2      4.7      391.2        4.7     0.0     0.0 
1 1 1    9    0   75 o     60.6   24.7   52.3588  29.3720    52.3588  29.3720    52.3588  29.3720       60.6     24.7       60.6       24.7     0.0     0.0 
1 1 1    9    0   76 f    147.9   10.7  223.4826  31.2876   223.4826  31.2876   223.4826  31.2876      147.9     10.7      147.9       10.7     0.0     0.0 
1 1 1    9    0   77 o    173.5    9.3  305.2133  31.9261   305.2133  31.9261   305.2133  31.9261      173.5      9.3      173.5        9.3     0.0     0.0 
1 1 1    9    0   78 o     19.3   14.2  -70.2374  31.9261   -70.2374  31.9261   -70.2374  31.9261       19.3     14.2       19.3       14.2     0.0     0.0 
1 1 1    9    0   79 o     83.1   21.8   83.6463  31.2876    83.6463  31.2876    83.6463  31.2876       83.1     21.8       83.1       21.8     0.0     0.0 
1 1 1    9    0   80 o    196.0    7.4  387.5826  28.7335   387.5826  28.7335   387.5826  28.7335      196.0      7.4      196.0        7.4     0.0     0.0 
1 1 1    9    0   81 o     43.1   23.6   28.0950  28.7335    28.0950  28.7335    28.0950  28.7335       43.1     23.6       43.1       23.6     0.0     0.0 
1 1 1    9    0   82 o     29.9   19.8   -3.1926  30.0105    -3.1926  30.0105    -3.1926  30.0105       29.9     19.8       29.9       19.8     0.0     0.0 
1 1 1    9    1    0 o    361.0    2.1 1303.2227  15.3245  1303.2227  15.3245  1303.2227  15.3245      361.0      2.1      361.0        2.1     0.0     0.0 
1 1 1    9    1    1 o   1188.9    3.9    0.0000   0.0000          ?        ? 14135.5918  93.2242          ?        ?     1188.9        3.9       ?       ? 
1 1 1    9    1    2 o   1111.7    3.7    0.0000   0.0000          ?        ? 12358.5859  81.7308          ?        ?     1111.7        3.7       ?       ? 
1 1 1    9    1    3 o   1128.0    3.7    0.0000   0.0000          ?        ? 12723.8203  84.2849          ?        ?     1128.0        3.7       ?       ? 
1 1 1    9    1    4 o    509.9    1.9    0.0000   0.0000          ?        ?  2600.0601  19.1556          ?        ?      509.9        1.9       ?       ? 
1 1 1    9    1    5 o   1811.5    5.8    0.0000   0.0000          ?        ? 32818.0977 211.3506          ?        ?     1811.5        5.8       ?       ? 
1 1 1    9    1    6 o    743.6    2.6    0.0000   0.0000          ?        ?  5529.5972  38.3113          ?        ?      743.6        2.6       ?       ? 
1 1 1    9    1    7 o   1946.0    6.3    0.0000   0.0000          ?        ? 37871.3555 243.2767          ?        ?     1946.0        6.3       ?       ? 
1 1 1    9    1    8 o   2124.9    6.8    0.0000   0.0000          ?        ? 45157.5273 289.2503          ?        ?     2124.9        6.8       ?       ? 
1 1 1    9    1    9 o   1447.6    4.7    0.0000   0.0000          ?        ? 20956.9180 136.6436          ?        ?     1447.6        4.7       ?       ? 
1 1 1    9    1   10 o   1699.1    5.6    0.0000   0.0000          ?        ? 28872.6699 190.2794          ?        ?     1699.1        5.6       ?       ? 
1 1 1    9    1   11 o   1301.8    4.4    0.0000   0.0000          ?        ? 16947.6406 114.2954          ?        ?     1301.8        4.4       ?       ? 
1 1 1    9    1   12 o   2764.0    8.7    0.0000   0.0000          ?        ? 76412.5156 483.3608          ?        ?     2764.0        8.7       ?       ? 
1 1 1    9    1   13 o    252.4    1.4    0.0000   0.0000          ?        ?   637.2446   7.0237          ?        ?      252.4        1.4       ?       ? 
1 1 1    9    1   14 o   1017.1    3.5    0.0000   0.0000          ?        ? 10345.3271  71.5144          ?        ?     1017.1        3.5       ?       ? 
1 1 1    9    1   15 o    634.0    2.6    0.0000   0.0000          ?        ?  4019.4937  32.5646          ?        ?      634.0        2.6       ?       ? 
1 1 1    9    1   16 o    760.7    2.7    0.0000   0.0000          ?        ?  5786.9214  41.5039          ?        ?      760.7        2.7       ?       ? 
1 1 1    9    1   17 o   1159.7    4.0    0.0000   0.0000          ?        ? 13449.1816  92.5856          ?        ?     1159.7        4.0       ?       ? 
1 1 1    9    1   18 o    765.9    2.7    0.0000   0.0000          ?        ?  5866.7368  41.5039          ?        ?      765.9        2.7       ?       ? 
1 1 1    9    1   19 o   1557.0    5.1    0.0000   0.0000          ?        ? 24245.3047 158.3534          ?        ?     1557.0        5.1       ?       ? 
1 1 1    9    1   20 o   1152.4    3.9    0.0000   0.0000          ?        ? 13281.8887  88.7545          ?        ?     1152.4        3.9       ?       ? 
1 1 1    9    1   21 o    408.7    1.7    0.0000   0.0000          ?        ?  1670.3726  14.0475          ?        ?      408.7        1.7       ?       ? 
1 1 1    9    1   22 o     81.1    3.9    0.0000   0.0000          ?        ?    65.7677   6.3852          ?        ?       81.1        3.9       ?       ? 
1 1 1    9    1   23 o    197.4    1.9    0.0000   0.0000          ?        ?   389.4982   7.6623          ?        ?      197.4        1.9       ?       ? 
1 1 1    9    1   24 o    224.0    2.0    0.0000   0.0000          ?        ?   501.8780   8.9393          ?        ?      224.0        2.0       ?       ? 
1 1 1    9    1   25 o   1234.3    4.2    0.0000   0.0000          ?        ? 15236.4023 102.8020          ?        ?     1234.3        4.2       ?       ? 
1 1 1    9    1   26 o    533.8    2.2    0.0000   0.0000          ?        ?  2849.7219  23.6253          ?        ?      533.8        2.2       ?       ? 
1 1 1    9    1   27 o    449.9    2.1    0.0000   0.0000          ?        ?  2024.1135  19.1556          ?        ?      449.9        2.1       ?       ? 
1 1 1    9    1   28 f    443.1    2.1    0.0000   0.0000          ?        ?  1963.4540  18.5171          ?        ?      443.1        2.1       ?       ? 
1 1 1    9    1   29 o    344.0    2.2    0.0000   0.0000          ?        ?  1183.1805  15.3245          ?        ?      344.0        2.2       ?       ? 
1 1 1    9    1   30 o   2012.7    7.1    0.0000   0.0000          ?        ? 40516.7500 285.4192          ?        ?     2012.7        7.1       ?       ? 
1 1 1    9    1   31 o   1184.4    4.4    0.0000   0.0000          ?        ? 14028.3203 103.4405          ?        ?     1184.4        4.4       ?       ? 
1 1 1    9    1   32 o   1493.7    5.3    0.0000   0.0000          ?        ? 22313.7773 157.7148          ?        ?     1493.7        5.3       ?       ? 
1 1 1    9    1   33 o    714.9    2.8    0.0000   0.0000          ?        ?  5110.7271  40.2269          ?        ?      714.9        2.8       ?       ? 
1 1 1    9    1   34 o   1149.3    4.1    0.0000   0.0000          ?        ? 13210.3730  93.8627          ?        ?     1149.3        4.1       ?       ? 
1 1 1    9    1   35 o    780.8    2.9    0.0000   0.0000          ?        ?  6095.9658  45.9736          ?        ?      780.8        2.9       ?       ? 
1 1 1    9    1   36 o   1158.5    4.0    0.0000   0.0000          ?        ? 13421.7246  92.5856          ?        ?     1158.5        4.0       ?       ? 
1 1 1    9    1   37 o    783.7    3.2    0.0000   0.0000          ?        ?  6142.5781  49.8047          ?        ?      783.7        3.2       ?       ? 
1 1 1    9    1   38 o   1247.5    4.3    0.0000   0.0000          ?        ? 15564.6035 107.9102          ?        ?     1247.5        4.3       ?       ? 
1 1 1    9    1   39 o    845.0    3.3    0.0000   0.0000          ?        ?  7140.5879  55.5514          ?        ?      845.0        3.3       ?       ? 
1 1 1    9    1   40 o    673.3    2.8    0.0000   0.0000          ?        ?  4533.5034  37.6728          ?        ?      673.3        2.8       ?       ? 
1 1 1    9    1   41 o   1620.3    5.3    0.0000   0.0000          ?        ? 26258.5625 171.7623          ?        ?     1620.3        5.3       ?       ? 
1 1 1    9    1   42 o    750.9    2.9    0.0000   0.0000          ?        ?  5639.4229  44.0580          ?        ?      750.9        2.9       ?       ? 
1 1 1    9    1   43 o    991.7    3.6    0.0000   0.0000          ?        ?  9835.7871  72.1529          ?        ?      991.7        3.6       ?       ? 
1 1 1    9    1   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    1   45 o    814.3    3.2    0.0000   0.0000          ?        ?  6631.6855  51.7203          ?        ?      814.3        3.2       ?       ? 
1 1 1    9    1   46 o     29.8   14.2    0.0000   0.0000          ?        ?   -31.9261  23.6253          ?        ?       29.8       14.2       ?       ? 
1 1 1    9    1   47 o    823.3    3.1    0.0000   0.0000          ?        ?  6778.5454  51.7203          ?        ?      823.3        3.1       ?       ? 
1 1 1    9    1   48 o    834.9    3.3    0.0000   0.0000          ?        ?  6971.3794  54.9129          ?        ?      834.9        3.3       ?       ? 
1 1 1    9    1   49 o    575.1    2.8    0.0000   0.0000          ?        ?  3308.1804  32.5646          ?        ?      575.1        2.8       ?       ? 
1 1 1    9    1   50 o    189.1    6.2    0.0000   0.0000          ?        ?   357.5721  23.6253          ?        ?      189.1        6.2       ?       ? 
1 1 1    9    1   51 o    851.9    3.2    0.0000   0.0000          ?        ?  7258.7144  54.2743          ?        ?      851.9        3.2       ?       ? 
1 1 1    9    1   52 o    342.2    3.1    0.0000   0.0000          ?        ?  1171.0486  21.0712          ?        ?      342.2        3.1       ?       ? 
1 1 1    9    1   53 o    638.7    2.7    0.0000   0.0000          ?        ?  4079.5149  35.1187          ?        ?      638.7        2.7       ?       ? 
1 1 1    9    1   54 o    422.1    2.9    0.0000   0.0000          ?        ?  1782.1139  24.2638          ?        ?      422.1        2.9       ?       ? 
1 1 1    9    1   55 o    603.1    2.8    0.0000   0.0000          ?        ?  3637.6577  33.2031          ?        ?      603.1        2.8       ?       ? 
1 1 1    9    1   56 o     61.5   15.1    0.0000   0.0000          ?        ?    39.5883  18.5171          ?        ?       61.5       15.1       ?       ? 
1 1 1    9    1   57 o    116.5    7.7    0.0000   0.0000          ?        ?   136.0051  17.8786          ?        ?      116.5        7.7       ?       ? 
1 1 1    9    1   58 o    180.4    5.5    0.0000   0.0000          ?        ?   325.6460  19.7942          ?        ?      180.4        5.5       ?       ? 
1 1 1    9    1   59 o    218.8    4.5    0.0000   0.0000          ?        ?   478.8912  19.7942          ?        ?      218.8        4.5       ?       ? 
1 1 1    9    1   60 o    136.9    7.2    0.0000   0.0000          ?        ?   187.7254  19.7942          ?        ?      136.9        7.2       ?       ? 
1 1 1    9    1   61 o    199.8    5.1    0.0000   0.0000          ?        ?   399.7145  20.4327          ?        ?      199.8        5.1       ?       ? 
1 1 1    9    1   62 o    332.8    3.3    0.0000   0.0000          ?        ?  1107.8350  21.7097          ?        ?      332.8        3.3       ?       ? 
1 1 1    9    1   63 o    324.7    3.3    0.0000   0.0000          ?        ?  1054.8376  21.7097          ?        ?      324.7        3.3       ?       ? 
1 1 1    9    1   64 o    209.2    4.9    0.0000   0.0000          ?        ?   438.0258  20.4327          ?        ?      209.2        4.9       ?       ? 
1 1 1    9    1   65 o    292.4    3.7    0.0000   0.0000          ?        ?   855.6190  21.7097          ?        ?      292.4        3.7       ?       ? 
1 1 1    9    1   66 o    494.7    3.0    0.0000   0.0000          ?        ?  2448.7305  29.3720          ?        ?      494.7        3.0       ?       ? 
1 1 1    9    1   67 o     73.3   14.5    0.0000   0.0000          ?        ?    56.1899  20.4327          ?        ?       73.3       14.5       ?       ? 
1 1 1    9    1   68 o    342.5    3.3    0.0000   0.0000          ?        ?  1173.6028  22.3483          ?        ?      342.5        3.3       ?       ? 
1 1 1    9    1   69 o    215.1    5.0    0.0000   0.0000          ?        ?   463.5667  21.7097          ?        ?      215.1        5.0       ?       ? 
1 1 1    9    1   70 o     79.0   14.3    0.0000   0.0000          ?        ?    65.1292  21.7097          ?        ?       79.0       14.3       ?       ? 
1 1 1    9    1   71 o    235.0    4.5    0.0000   0.0000          ?        ?   552.9597  21.0712          ?        ?      235.0        4.5       ?       ? 
1 1 1    9    1   72 o     62.7   16.6    0.0000   0.0000          ?        ?    41.5039  21.0712          ?        ?       62.7       16.6       ?       ? 
1 1 1    9    1   73 o    179.1    6.4    0.0000   0.0000          ?        ?   321.8149  22.9868          ?        ?      179.1        6.4       ?       ? 
1 1 1    9    1   74 o    354.9    3.5    0.0000   0.0000          ?        ?  1261.0802  24.9023          ?        ?      354.9        3.5       ?       ? 
1 1 1    9    1   75 o    147.4    7.4    0.0000   0.0000          ?        ?   218.3744  21.7097          ?        ?      147.4        7.4       ?       ? 
1 1 1    9    1   76 o    115.5    9.4    0.0000   0.0000          ?        ?   134.7281  21.7097          ?        ?      115.5        9.4       ?       ? 
1 1 1    9    1   77 o     59.6   17.2    0.0000   0.0000          ?        ?    37.6728  21.7097          ?        ?       59.6       17.2       ?       ? 
1 1 1    9    1   78 o     91.0   11.9    0.0000   0.0000          ?        ?    84.2849  21.7097          ?        ?       91.0       11.9       ?       ? 
1 1 1    9    1   79 f    120.2    8.8    0.0000   0.0000          ?        ?   146.2215  21.0712          ?        ?      120.2        8.8       ?       ? 
1 1 1    9    1   80 o    144.8    8.2    0.0000   0.0000          ?        ?   211.9892  23.6253          ?        ?      144.8        8.2       ?       ? 
1 1 1    9    1   81 o     30.2   13.8    0.0000   0.0000          ?        ?   -10.8549  18.5171          ?        ?       30.2       13.8       ?       ? 
1 1 1    9    2    0 o   2080.7   11.7 43305.8164 485.9149 43305.8164 485.9149 43305.8164 485.9149     2080.7     11.7     2080.7       11.7     0.0     0.0 
1 1 1    9    2    1 o   1869.5    6.6    0.0000   0.0000          ?        ? 34955.8672 247.1079          ?        ?     1869.5        6.6       ?       ? 
1 1 1    9    2    2 o    643.3    2.3    0.0000   0.0000          ?        ?  4138.2583  29.3720          ?        ?      643.3        2.3       ?       ? 
1 1 1    9    2    3 o    914.4    3.1    0.0000   0.0000          ?        ?  8361.4404  56.1899          ?        ?      914.4        3.1       ?       ? 
1 1 1    9    2    4 f    280.4    1.3    0.0000   0.0000          ?        ?   786.0201   7.0237          ?        ?      280.4        1.3       ?       ? 
1 1 1    9    2    5 o   2566.2   10.6    0.0000   0.0000          ?        ? 65873.0859 544.0204          ?        ?     2566.2       10.6       ?       ? 
1 1 1    9    2    6 o    972.4    3.3    0.0000   0.0000          ?        ?  9455.2285  63.8522          ?        ?      972.4        3.3       ?       ? 
1 1 1    9    2    7 o    606.0    2.2    0.0000   0.0000          ?        ?  3672.7764  26.8179          ?        ?      606.0        2.2       ?       ? 
1 1 1    9    2    8 o   1462.1    4.8    0.0000   0.0000          ?        ? 21379.6191 139.8362          ?        ?     1462.1        4.8       ?       ? 
1 1 1    9    2    9 o   2413.7    7.7    0.0000   0.0000          ?        ? 58267.0117 370.3425          ?        ?     2413.7        7.7       ?       ? 
1 1 1    9    2   10 o    606.8    2.2    0.0000   0.0000          ?        ?  3681.7156  26.8179          ?        ?      606.8        2.2       ?       ? 
1 1 1    9    2   11 o   1489.1    4.9    0.0000   0.0000          ?        ? 22177.1328 145.5829          ?        ?     1489.1        4.9       ?       ? 
1 1 1    9    2   12 f    771.7    2.7    0.0000   0.0000          ?        ?  5955.4912  41.5039          ?        ?      771.7        2.7       ?       ? 
1 1 1    9    2   13 o   1906.1    6.1    0.0000   0.0000          ?        ? 36336.9883 234.3374          ?        ?     1906.1        6.1       ?       ? 
1 1 1    9    2   14 o    729.3    2.7    0.0000   0.0000          ?        ?  5318.8853  39.5883          ?        ?      729.3        2.7       ?       ? 
1 1 1    9    2   15 o    722.4    2.6    0.0000   0.0000          ?        ?  5219.2759  37.0343          ?        ?      722.4        2.6       ?       ? 
1 1 1    9    2   16 o    760.4    2.8    0.0000   0.0000          ?        ?  5781.8135  42.1424          ?        ?      760.4        2.8       ?       ? 
1 1 1    9    2   17 o    778.8    2.9    0.0000   0.0000          ?        ?  6065.3169  45.3350          ?        ?      778.8        2.9       ?       ? 
1 1 1    9    2   18 o    209.1    1.5    0.0000   0.0000          ?        ?   437.3873   6.3852          ?        ?      209.1        1.5       ?       ? 
1 1 1    9    2   19 o    515.0    2.0    0.0000   0.0000          ?        ?  2652.4187  20.4327          ?        ?      515.0        2.0       ?       ? 
1 1 1    9    2   20 o    897.4    3.1    0.0000   0.0000          ?        ?  8054.3120  55.5514          ?        ?      897.4        3.1       ?       ? 
1 1 1    9    2   21 o    748.1    2.8    0.0000   0.0000          ?        ?  5597.2803  41.5039          ?        ?      748.1        2.8       ?       ? 
1 1 1    9    2   22 o    779.1    2.9    0.0000   0.0000          ?        ?  6069.7866  45.3350          ?        ?      779.1        2.9       ?       ? 
1 1 1    9    2   23 o   1372.7    4.7    0.0000   0.0000          ?        ? 18845.3262 127.7043          ?        ?     1372.7        4.7       ?       ? 
1 1 1    9    2   24 o    285.9    1.9    0.0000   0.0000          ?        ?   817.3077  10.8549          ?        ?      285.9        1.9       ?       ? 
1 1 1    9    2   25 o   1224.7    4.2    0.0000   0.0000          ?        ? 15000.1494 103.4405          ?        ?     1224.7        4.2       ?       ? 
1 1 1    9    2   26 f   1499.3    4.9    0.0000   0.0000          ?        ? 22481.0703 148.1370          ?        ?     1499.3        4.9       ?       ? 
1 1 1    9    2   27 o    742.1    2.8    0.0000   0.0000          ?        ?  5507.2490  41.5039          ?        ?      742.1        2.8       ?       ? 
1 1 1    9    2   28 o    499.8    2.2    0.0000   0.0000          ?        ?  2498.5352  22.3483          ?        ?      499.8        2.2       ?       ? 
1 1 1    9    2   29 f    559.2    2.3    0.0000   0.0000          ?        ?  3126.8406  25.5409          ?        ?      559.2        2.3       ?       ? 
1 1 1    9    2   30 o   1223.1    4.5    0.0000   0.0000          ?        ? 14961.8389 110.4642          ?        ?     1223.1        4.5       ?       ? 
1 1 1    9    2   31 o    612.5    2.7    0.0000   0.0000          ?        ?  3751.3145  32.5646          ?        ?      612.5        2.7       ?       ? 
1 1 1    9    2   32 o    444.2    2.4    0.0000   0.0000          ?        ?  1973.0319  21.0712          ?        ?      444.2        2.4       ?       ? 
1 1 1    9    2   33 f    391.4    2.4    0.0000   0.0000          ?        ?  1531.8134  18.5171          ?        ?      391.4        2.4       ?       ? 
1 1 1    9    2   34 o    456.2    2.3    0.0000   0.0000          ?        ?  2081.5806  21.0712          ?        ?      456.2        2.3       ?       ? 
1 1 1    9    2   35 o    340.3    2.5    0.0000   0.0000          ?        ?  1158.2782  17.2401          ?        ?      340.3        2.5       ?       ? 
1 1 1    9    2   36 o   1211.3    4.1    0.0000   0.0000          ?        ? 14673.2266 100.2479          ?        ?     1211.3        4.1       ?       ? 
1 1 1    9    2   37 o   1384.0    4.7    0.0000   0.0000          ?        ? 19156.9258 128.9814          ?        ?     1384.0        4.7       ?       ? 
1 1 1    9    2   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    2   39 f    536.0    2.9    0.0000   0.0000          ?        ?  2873.3474  31.2876          ?        ?      536.0        2.9       ?       ? 
1 1 1    9    2   40 o   1151.6    3.9    0.0000   0.0000          ?        ? 13262.0938  90.6701          ?        ?     1151.6        3.9       ?       ? 
1 1 1    9    2   41 o   1410.8    4.8    0.0000   0.0000          ?        ? 19906.5508 135.3666          ?        ?     1410.8        4.8       ?       ? 
1 1 1    9    2   42 o   1403.9    4.9    0.0000   0.0000          ?        ? 19711.8008 137.9207          ?        ?     1403.9        4.9       ?       ? 
1 1 1    9    2   43 o    771.5    3.0    0.0000   0.0000          ?        ?  5952.9370  46.6121          ?        ?      771.5        3.0       ?       ? 
1 1 1    9    2   44 o    338.9    3.2    0.0000   0.0000          ?        ?  1148.7003  21.7097          ?        ?      338.9        3.2       ?       ? 
1 1 1    9    2   45 o    575.2    2.9    0.0000   0.0000          ?        ?  3308.1804  33.8416          ?        ?      575.2        2.9       ?       ? 
1 1 1    9    2   46 o   1335.1    4.6    0.0000   0.0000          ?        ? 17828.1621 122.5962          ?        ?     1335.1        4.6       ?       ? 
1 1 1    9    2   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    2   48 o    992.8    3.5    0.0000   0.0000          ?        ?  9857.4971  70.2374          ?        ?      992.8        3.5       ?       ? 
1 1 1    9    2   49 o    333.8    3.1    0.0000   0.0000          ?        ?  1114.2202  20.4327          ?        ?      333.8        3.1       ?       ? 
1 1 1    9    2   50 o   1059.0    3.8    0.0000   0.0000          ?        ? 11216.9092  79.8152          ?        ?     1059.0        3.8       ?       ? 
1 1 1    9    2   51 o    423.0    2.9    0.0000   0.0000          ?        ?  1789.7760  24.9023          ?        ?      423.0        2.9       ?       ? 
1 1 1    9    2   52 o    701.0    2.8    0.0000   0.0000          ?        ?  4914.7012  39.5883          ?        ?      701.0        2.8       ?       ? 
1 1 1    9    2   53 o    312.8    3.4    0.0000   0.0000          ?        ?   978.8537  21.0712          ?        ?      312.8        3.4       ?       ? 
1 1 1    9    2   54 o    476.8    2.7    0.0000   0.0000          ?        ?  2273.7756  25.5409          ?        ?      476.8        2.7       ?       ? 
1 1 1    9    2   55 o    560.6    2.7    0.0000   0.0000          ?        ?  3142.8035  30.0105          ?        ?      560.6        2.7       ?       ? 
1 1 1    9    2   56 o    379.3    3.2    0.0000   0.0000          ?        ?  1439.2277  24.2638          ?        ?      379.3        3.2       ?       ? 
1 1 1    9    2   57 o    324.3    3.2    0.0000   0.0000          ?        ?  1052.2837  21.0712          ?        ?      324.3        3.2       ?       ? 
1 1 1    9    2   58 o    351.9    3.2    0.0000   0.0000          ?        ?  1238.7319  22.3483          ?        ?      351.9        3.2       ?       ? 
1 1 1    9    2   59 o    474.8    2.7    0.0000   0.0000          ?        ?  2255.2585  25.5409          ?        ?      474.8        2.7       ?       ? 
1 1 1    9    2   60 o    204.4    5.0    0.0000   0.0000          ?        ?   418.2317  20.4327          ?        ?      204.4        5.0       ?       ? 
1 1 1    9    2   61 o    420.5    2.8    0.0000   0.0000          ?        ?  1768.7050  23.6253          ?        ?      420.5        2.8       ?       ? 
1 1 1    9    2   62 o    524.6    2.9    0.0000   0.0000          ?        ?  2752.6667  30.0105          ?        ?      524.6        2.9       ?       ? 
1 1 1    9    2   63 o    241.2    4.4    0.0000   0.0000          ?        ?   582.3317  21.0712          ?        ?      241.2        4.4       ?       ? 
1 1 1    9    2   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    2   65 o    511.8    2.7    0.0000   0.0000          ?        ?  2619.8542  27.4564          ?        ?      511.8        2.7       ?       ? 
1 1 1    9    2   66 o    471.7    2.8    0.0000   0.0000          ?        ?  2225.8865  26.8179          ?        ?      471.7        2.8       ?       ? 
1 1 1    9    2   67 o     33.1   14.7    0.0000   0.0000          ?        ?    -7.6623  19.7942          ?        ?       33.1       14.7       ?       ? 
1 1 1    9    2   68 o    265.0    3.9    0.0000   0.0000          ?        ?   703.0123  20.4327          ?        ?      265.0        3.9       ?       ? 
1 1 1    9    2   69 o    154.5    6.8    0.0000   0.0000          ?        ?   239.4456  21.0712          ?        ?      154.5        6.8       ?       ? 
1 1 1    9    2   70 o    312.6    3.7    0.0000   0.0000          ?        ?   978.2151  22.9868          ?        ?      312.6        3.7       ?       ? 
1 1 1    9    2   71 o     96.5   10.9    0.0000   0.0000          ?        ?    93.8627  21.0712          ?        ?       96.5       10.9       ?       ? 
1 1 1    9    2   72 o     51.7   17.6    0.0000   0.0000          ?        ?    25.5409  21.7097          ?        ?       51.7       17.6       ?       ? 
1 1 1    9    2   73 o     69.4   16.0    0.0000   0.0000          ?        ?    51.0817  21.7097          ?        ?       69.4       16.0       ?       ? 
1 1 1    9    2   74 o     82.4   13.6    0.0000   0.0000          ?        ?    68.9603  22.3483          ?        ?       82.4       13.6       ?       ? 
1 1 1    9    2   75 o    284.7    3.8    0.0000   0.0000          ?        ?   811.5610  21.7097          ?        ?      284.7        3.8       ?       ? 
1 1 1    9    2   76 o    181.6    6.3    0.0000   0.0000          ?        ?   331.3927  22.9868          ?        ?      181.6        6.3       ?       ? 
1 1 1    9    2   77 o     95.6   10.7    0.0000   0.0000          ?        ?    92.5856  20.4327          ?        ?       95.6       10.7       ?       ? 
1 1 1    9    2   78 o     96.1   11.0    0.0000   0.0000          ?        ?    93.8627  21.0712          ?        ?       96.1       11.0       ?       ? 
1 1 1    9    2   79 o    141.7    7.4    0.0000   0.0000          ?        ?   202.4114  21.0712          ?        ?      141.7        7.4       ?       ? 
1 1 1    9    2   80 o     34.3   15.3    0.0000   0.0000          ?        ?    -6.3852  21.0712          ?        ?       34.3       15.3       ?       ? 
1 1 1    9    2   81 o     26.3   12.7    0.0000   0.0000          ?        ?   -28.7335  19.7942          ?        ?       26.3       12.7       ?       ? 
1 1 1    9    3    0 o   1026.3    5.2 10533.6914 105.9946 10533.6914 105.9946 10533.6914 105.9946     1026.3      5.2     1026.3        5.2     0.0     0.0 
1 1 1    9    3    1 o    438.0    1.7    0.0000   0.0000          ?        ?  1918.1189  15.3245          ?        ?      438.0        1.7       ?       ? 
1 1 1    9    3    2 o   1207.7    4.2    0.0000   0.0000          ?        ? 14586.3877 100.8864          ?        ?     1207.7        4.2       ?       ? 
1 1 1    9    3    3 o   2280.1    8.7    0.0000   0.0000          ?        ? 52000.5625 395.2449          ?        ?     2280.1        8.7       ?       ? 
1 1 1    9    3    4 o   1241.6    4.1    0.0000   0.0000          ?        ? 15416.4658 101.5249          ?        ?     1241.6        4.1       ?       ? 
1 1 1    9    3    5 o   1419.2    4.6    0.0000   0.0000          ?        ? 20141.5254 131.5355          ?        ?     1419.2        4.6       ?       ? 
1 1 1    9    3    6 o   1594.1    5.2    0.0000   0.0000          ?        ? 25414.4375 164.7386          ?        ?     1594.1        5.2       ?       ? 
1 1 1    9    3    7 f   1718.8    5.6    0.0000   0.0000          ?        ? 29543.7559 191.5565          ?        ?     1718.8        5.6       ?       ? 
1 1 1    9    3    8 o   1018.9    3.4    0.0000   0.0000          ?        ? 10381.7236  70.2374          ?        ?     1018.9        3.4       ?       ? 
1 1 1    9    3    9 o    167.0    1.3    0.0000   0.0000          ?        ?   279.0340   4.4697          ?        ?      167.0        1.3       ?       ? 
1 1 1    9    3   10 o   2464.0    8.0    0.0000   0.0000          ?        ? 60724.6836 393.9678          ?        ?     2464.0        8.0       ?       ? 
1 1 1    9    3   11 o   1677.9    5.5    0.0000   0.0000          ?        ? 28154.9727 183.2557          ?        ?     1677.9        5.5       ?       ? 
1 1 1    9    3   12 o    493.0    1.9    0.0000   0.0000          ?        ?  2430.2134  18.5171          ?        ?      493.0        1.9       ?       ? 
1 1 1    9    3   13 o   1018.7    3.4    0.0000   0.0000          ?        ? 10377.2529  70.2374          ?        ?     1018.7        3.4       ?       ? 
1 1 1    9    3   14 o   1013.3    3.4    0.0000   0.0000          ?        ? 10268.0664  69.5989          ?        ?     1013.3        3.4       ?       ? 
1 1 1    9    3   15 o    365.5    1.6    0.0000   0.0000          ?        ?  1335.7872  11.4934          ?        ?      365.5        1.6       ?       ? 
1 1 1    9    3   16 o    670.8    2.5    0.0000   0.0000          ?        ?  4500.3003  33.8416          ?        ?      670.8        2.5       ?       ? 
1 1 1    9    3   17 o    792.2    2.8    0.0000   0.0000          ?        ?  6276.0293  44.0580          ?        ?      792.2        2.8       ?       ? 
1 1 1    9    3   18 o    841.0    3.0    0.0000   0.0000          ?        ?  7072.2651  49.8047          ?        ?      841.0        3.0       ?       ? 
1 1 1    9    3   19 o   1118.2    3.9    0.0000   0.0000          ?        ? 12505.4463  86.2004          ?        ?     1118.2        3.9       ?       ? 
1 1 1    9    3   20 o    349.9    1.6    0.0000   0.0000          ?        ?  1224.0459  11.4934          ?        ?      349.9        1.6       ?       ? 
1 1 1    9    3   21 o   1564.4    5.1    0.0000   0.0000          ?        ? 24477.0879 160.2689          ?        ?     1564.4        5.1       ?       ? 
1 1 1    9    3   22 o    694.3    2.5    0.0000   0.0000          ?        ?  4820.1997  35.1187          ?        ?      694.3        2.5       ?       ? 
1 1 1    9    3   23 o    427.9    1.9    0.0000   0.0000          ?        ?  1831.2799  16.6016          ?        ?      427.9        1.9       ?       ? 
1 1 1    9    3   24 o    755.9    3.0    0.0000   0.0000          ?        ?  5714.7686  44.6965          ?        ?      755.9        3.0       ?       ? 
1 1 1    9    3   25 o   1500.6    4.9    0.0000   0.0000          ?        ? 22521.2969 148.1370          ?        ?     1500.6        4.9       ?       ? 
1 1 1    9    3   26 o    789.7    2.9    0.0000   0.0000          ?        ?  6236.4409  45.3350          ?        ?      789.7        2.9       ?       ? 
1 1 1    9    3   27 o    460.6    2.1    0.0000   0.0000          ?        ?  2121.8074  19.1556          ?        ?      460.6        2.1       ?       ? 
1 1 1    9    3   28 o    905.6    3.3    0.0000   0.0000          ?        ?  8201.8105  59.3825          ?        ?      905.6        3.3       ?       ? 
1 1 1    9    3   29 o   1319.4    4.4    0.0000   0.0000          ?        ? 17410.5684 116.8494          ?        ?     1319.4        4.4       ?       ? 
1 1 1    9    3   30 o    803.1    3.2    0.0000   0.0000          ?        ?  6449.7070  51.7203          ?        ?      803.1        3.2       ?       ? 
1 1 1    9    3   31 o    616.3    2.7    0.0000   0.0000          ?        ?  3797.9265  33.8416          ?        ?      616.3        2.7       ?       ? 
1 1 1    9    3   32 o    914.2    3.6    0.0000   0.0000          ?        ?  8358.2480  66.4062          ?        ?      914.2        3.6       ?       ? 
1 1 1    9    3   33 o   1629.9    5.9    0.0000   0.0000          ?        ? 26568.8848 193.4720          ?        ?     1629.9        5.9       ?       ? 
1 1 1    9    3   34 o   1380.2    4.9    0.0000   0.0000          ?        ? 19050.9316 136.0051          ?        ?     1380.2        4.9       ?       ? 
1 1 1    9    3   35 o   1048.0    4.1    0.0000   0.0000          ?        ? 10983.8486  84.9234          ?        ?     1048.0        4.1       ?       ? 
1 1 1    9    3   36 o   1055.6    3.7    0.0000   0.0000          ?        ? 11144.1182  78.5382          ?        ?     1055.6        3.7       ?       ? 
1 1 1    9    3   37 o    615.8    2.5    0.0000   0.0000          ?        ?  3792.1802  30.6490          ?        ?      615.8        2.5       ?       ? 
1 1 1    9    3   38 o    413.0    2.6    0.0000   0.0000          ?        ?  1705.4913  21.0712          ?        ?      413.0        2.6       ?       ? 
1 1 1    9    3   39 o    295.8    2.8    0.0000   0.0000          ?        ?   874.7747  16.6016          ?        ?      295.8        2.8       ?       ? 
1 1 1    9    3   40 o    244.2    3.7    0.0000   0.0000          ?        ?   596.3792  17.8786          ?        ?      244.2        3.7       ?       ? 
1 1 1    9    3   41 o   1049.9    3.7    0.0000   0.0000          ?        ? 11023.4375  78.5382          ?        ?     1049.9        3.7       ?       ? 
1 1 1    9    3   42 o    781.7    3.0    0.0000   0.0000          ?        ?  6111.2905  47.2506          ?        ?      781.7        3.0       ?       ? 
1 1 1    9    3   43 o   1283.7    4.3    0.0000   0.0000          ?        ? 16480.8828 110.4642          ?        ?     1283.7        4.3       ?       ? 
1 1 1    9    3   44 o    601.5    2.8    0.0000   0.0000          ?        ?  3618.5022  33.2031          ?        ?      601.5        2.8       ?       ? 
1 1 1    9    3   45 o    174.9    5.5    0.0000   0.0000          ?        ?   305.8519  19.1556          ?        ?      174.9        5.5       ?       ? 
1 1 1    9    3   46 f    615.4    3.1    0.0000   0.0000          ?        ?  3787.0715  38.3113          ?        ?      615.4        3.1       ?       ? 
1 1 1    9    3   47 o    337.0    3.4    0.0000   0.0000          ?        ?  1135.9299  22.9868          ?        ?      337.0        3.4       ?       ? 
1 1 1    9    3   48 o   1080.0    3.9    0.0000   0.0000          ?        ? 11665.1514  83.6463          ?        ?     1080.0        3.9       ?       ? 
1 1 1    9    3   49 o    379.9    3.4    0.0000   0.0000          ?        ?  1443.0588  26.1794          ?        ?      379.9        3.4       ?       ? 
1 1 1    9    3   50 o    401.0    3.1    0.0000   0.0000          ?        ?  1607.7975  24.9023          ?        ?      401.0        3.1       ?       ? 
1 1 1    9    3   51 o    996.3    3.6    0.0000   0.0000          ?        ?  9928.3730  72.1529          ?        ?      996.3        3.6       ?       ? 
1 1 1    9    3   52 f    396.5    3.4    0.0000   0.0000          ?        ?  1572.6788  26.8179          ?        ?      396.5        3.4       ?       ? 
1 1 1    9    3   53 o    535.2    2.7    0.0000   0.0000          ?        ?  2865.0466  28.7335          ?        ?      535.2        2.7       ?       ? 
1 1 1    9    3   54 o    515.8    2.7    0.0000   0.0000          ?        ?  2660.7197  27.4564          ?        ?      515.8        2.7       ?       ? 
1 1 1    9    3   55 o    730.9    2.9    0.0000   0.0000          ?        ?  5342.5107  42.1424          ?        ?      730.9        2.9       ?       ? 
1 1 1    9    3   56 o    473.3    3.2    0.0000   0.0000          ?        ?  2240.5723  30.0105          ?        ?      473.3        3.2       ?       ? 
1 1 1    9    3   57 o     49.7   16.5    0.0000   0.0000          ?        ?    23.6253  19.1556          ?        ?       49.7       16.5       ?       ? 
1 1 1    9    3   58 o    491.8    2.7    0.0000   0.0000          ?        ?  2419.3584  26.8179          ?        ?      491.8        2.7       ?       ? 
1 1 1    9    3   59 o    273.7    3.7    0.0000   0.0000          ?        ?   749.6244  20.4327          ?        ?      273.7        3.7       ?       ? 
1 1 1    9    3   60 o    706.9    2.8    0.0000   0.0000          ?        ?  4998.3472  40.2269          ?        ?      706.9        2.8       ?       ? 
1 1 1    9    3   61 o    185.2    5.5    0.0000   0.0000          ?        ?   343.5246  20.4327          ?        ?      185.2        5.5       ?       ? 
1 1 1    9    3   62 o     85.5   11.2    0.0000   0.0000          ?        ?    73.4300  19.1556          ?        ?       85.5       11.2       ?       ? 
1 1 1    9    3   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    3   64 o    243.1    4.5    0.0000   0.0000          ?        ?   591.2710  21.7097          ?        ?      243.1        4.5       ?       ? 
1 1 1    9    3   65 o    278.8    3.9    0.0000   0.0000          ?        ?   777.7194  21.7097          ?        ?      278.8        3.9       ?       ? 
1 1 1    9    3   66 o    491.5    2.7    0.0000   0.0000          ?        ?  2416.8044  26.8179          ?        ?      491.5        2.7       ?       ? 
1 1 1    9    3   67 o     39.7   16.1    0.0000   0.0000          ?        ?     7.0237  19.7942          ?        ?       39.7       16.1       ?       ? 
1 1 1    9    3   68 o    258.9    4.2    0.0000   0.0000          ?        ?   671.0862  21.7097          ?        ?      258.9        4.2       ?       ? 
1 1 1    9    3   69 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    3   70 o     48.2   17.5    0.0000   0.0000          ?        ?    19.7942  21.7097          ?        ?       48.2       17.5       ?       ? 
1 1 1    9    3   71 o     40.8   16.9    0.0000   0.0000          ?        ?     5.1082  22.3483          ?        ?       40.8       16.9       ?       ? 
1 1 1    9    3   72 o    107.7    9.8    0.0000   0.0000          ?        ?   116.8494  21.0712          ?        ?      107.7        9.8       ?       ? 
1 1 1    9    3   73 o     98.7   11.0    0.0000   0.0000          ?        ?    98.3323  21.7097          ?        ?       98.7       11.0       ?       ? 
1 1 1    9    3   74 o    390.8    3.2    0.0000   0.0000          ?        ?  1528.6207  24.9023          ?        ?      390.8        3.2       ?       ? 
1 1 1    9    3   75 o    123.3    9.1    0.0000   0.0000          ?        ?   153.2452  22.3483          ?        ?      123.3        9.1       ?       ? 
1 1 1    9    3   76 o    254.9    4.4    0.0000   0.0000          ?        ?   651.2921  22.3483          ?        ?      254.9        4.4       ?       ? 
1 1 1    9    3   77 o    224.1    4.8    0.0000   0.0000          ?        ?   503.7936  21.7097          ?        ?      224.1        4.8       ?       ? 
1 1 1    9    3   78 o    145.5    7.5    0.0000   0.0000          ?        ?   213.2662  21.7097          ?        ?      145.5        7.5       ?       ? 
1 1 1    9    3   79 o    176.0    6.2    0.0000   0.0000          ?        ?   311.5985  21.7097          ?        ?      176.0        6.2       ?       ? 
1 1 1    9    3   80 o    174.8    6.4    0.0000   0.0000          ?        ?   307.7674  22.3483          ?        ?      174.8        6.4       ?       ? 
1 1 1    9    3   81 o     37.3   16.2    0.0000   0.0000          ?        ?    -1.2770  22.3483          ?        ?       37.3       16.2       ?       ? 
1 1 1    9    4    0 o   3324.9   29.9 110708.7969 1986.4408 110708.7969 1986.4408 110708.7969 1986.4408     3324.9     29.9     3324.9       29.9     0.0     0.0 
1 1 1    9    4    1 o   1961.3    7.6    0.0000   0.0000          ?        ? 38474.7578 297.5511          ?        ?     1961.3        7.6       ?       ? 
1 1 1    9    4    2 f    683.2    2.6    0.0000   0.0000          ?        ?  4668.2314  35.7572          ?        ?      683.2        2.6       ?       ? 
1 1 1    9    4    3 o   1034.1    3.5    0.0000   0.0000          ?        ? 10694.5986  72.7915          ?        ?     1034.1        3.5       ?       ? 
1 1 1    9    4    4 o   1033.5    3.4    0.0000   0.0000          ?        ? 10682.4668  70.8759          ?        ?     1033.5        3.4       ?       ? 
1 1 1    9    4    5 o   2256.8    7.9    0.0000   0.0000          ?        ? 50939.9766 355.0180          ?        ?     2256.8        7.9       ?       ? 
1 1 1    9    4    6 o    908.8    3.1    0.0000   0.0000          ?        ?  8259.2773  56.1899          ?        ?      908.8        3.1       ?       ? 
1 1 1    9    4    7 o   2033.7    6.5    0.0000   0.0000          ?        ? 41365.3438 265.6250          ?        ?     2033.7        6.5       ?       ? 
1 1 1    9    4    8 o    980.8    3.3    0.0000   0.0000          ?        ?  9619.9668  65.1292          ?        ?      980.8        3.3       ?       ? 
1 1 1    9    4    9 o    752.4    2.6    0.0000   0.0000          ?        ?  5661.1328  39.5883          ?        ?      752.4        2.6       ?       ? 
1 1 1    9    4   10 o    398.9    1.7    0.0000   0.0000          ?        ?  1591.1959  13.4090          ?        ?      398.9        1.7       ?       ? 
1 1 1    9    4   11 o    692.8    2.5    0.0000   0.0000          ?        ?  4800.4053  34.4802          ?        ?      692.8        2.5       ?       ? 
1 1 1    9    4   12 o    607.7    2.2    0.0000   0.0000          ?        ?  3693.2092  26.8179          ?        ?      607.7        2.2       ?       ? 
1 1 1    9    4   13 o    556.0    2.2    0.0000   0.0000          ?        ?  3091.0833  24.2638          ?        ?      556.0        2.2       ?       ? 
1 1 1    9    4   14 o    366.1    1.7    0.0000   0.0000          ?        ?  1340.2568  12.1319          ?        ?      366.1        1.7       ?       ? 
1 1 1    9    4   15 o    457.4    1.9    0.0000   0.0000          ?        ?  2092.4355  17.2401          ?        ?      457.4        1.9       ?       ? 
1 1 1    9    4   16 o    816.3    2.9    0.0000   0.0000          ?        ?  6662.9731  46.6121          ?        ?      816.3        2.9       ?       ? 
1 1 1    9    4   17 o    309.9    1.5    0.0000   0.0000          ?        ?   960.3365   9.5778          ?        ?      309.9        1.5       ?       ? 
1 1 1    9    4   18 o    326.7    1.6    0.0000   0.0000          ?        ?  1067.6082  10.2163          ?        ?      326.7        1.6       ?       ? 
1 1 1    9    4   19 o    419.1    1.8    0.0000   0.0000          ?        ?  1756.5730  14.6860          ?        ?      419.1        1.8       ?       ? 
1 1 1    9    4   20 o    445.5    1.9    0.0000   0.0000          ?        ?  1985.1637  16.6016          ?        ?      445.5        1.9       ?       ? 
1 1 1    9    4   21 o    996.3    3.5    0.0000   0.0000          ?        ?  9925.8184  69.5989          ?        ?      996.3        3.5       ?       ? 
1 1 1    9    4   22 o    532.9    2.1    0.0000   0.0000          ?        ?  2839.5059  22.3483          ?        ?      532.9        2.1       ?       ? 
1 1 1    9    4   23 o    983.2    3.4    0.0000   0.0000          ?        ?  9666.5791  67.0448          ?        ?      983.2        3.4       ?       ? 
1 1 1    9    4   24 o    386.2    2.0    0.0000   0.0000          ?        ?  1491.5865  15.3245          ?        ?      386.2        2.0       ?       ? 
1 1 1    9    4   25 o   1104.8    3.9    0.0000   0.0000          ?        ? 12207.2568  86.2004          ?        ?     1104.8        3.9       ?       ? 
1 1 1    9    4   26 o    490.8    2.1    0.0000   0.0000          ?        ?  2408.5037  20.4327          ?        ?      490.8        2.1       ?       ? 
1 1 1    9    4   27 o    796.9    3.2    0.0000   0.0000          ?        ?  6351.3745  50.4432          ?        ?      796.9        3.2       ?       ? 
1 1 1    9    4   28 o    868.8    3.2    0.0000   0.0000          ?        ?  7548.6025  54.9129          ?        ?      868.8        3.2       ?       ? 
1 1 1    9    4   29 o    991.2    3.8    0.0000   0.0000          ?        ?  9824.2939  75.9841          ?        ?      991.2        3.8       ?       ? 
1 1 1    9    4   30 o   1347.8    5.2    0.0000   0.0000          ?        ? 18165.9395 139.8362          ?        ?     1347.8        5.2       ?       ? 
1 1 1    9    4   31 o   2255.4    8.1    0.0000   0.0000          ?        ? 50879.9570 367.1499          ?        ?     2255.4        8.1       ?       ? 
1 1 1    9    4   32 o   1653.4    5.9    0.0000   0.0000          ?        ? 27341.4961 196.6647          ?        ?     1653.4        5.9       ?       ? 
1 1 1    9    4   33 o    236.0    3.4    0.0000   0.0000          ?        ?   556.7908  15.9630          ?        ?      236.0        3.4       ?       ? 
1 1 1    9    4   34 o    789.2    3.1    0.0000   0.0000          ?        ?  6228.1401  49.1662          ?        ?      789.2        3.1       ?       ? 
1 1 1    9    4   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    4   36 o   1048.9    3.7    0.0000   0.0000          ?        ? 11001.7275  77.2611          ?        ?     1048.9        3.7       ?       ? 
1 1 1    9    4   37 o    566.4    2.5    0.0000   0.0000          ?        ?  3207.9326  28.7335          ?        ?      566.4        2.5       ?       ? 
1 1 1    9    4   38 f    633.0    2.7    0.0000   0.0000          ?        ?  4006.7231  33.8416          ?        ?      633.0        2.7       ?       ? 
1 1 1    9    4   39 o   1019.9    3.6    0.0000   0.0000          ?        ? 10402.7939  74.0685          ?        ?     1019.9        3.6       ?       ? 
1 1 1    9    4   40 o    811.6    3.1    0.0000   0.0000          ?        ?  6587.6274  50.4432          ?        ?      811.6        3.1       ?       ? 
1 1 1    9    4   41 o    298.4    3.2    0.0000   0.0000          ?        ?   890.7377  19.1556          ?        ?      298.4        3.2       ?       ? 
1 1 1    9    4   42 o    878.2    3.2    0.0000   0.0000          ?        ?  7712.0645  56.1899          ?        ?      878.2        3.2       ?       ? 
1 1 1    9    4   43 o    532.9    2.5    0.0000   0.0000          ?        ?  2839.5059  26.8179          ?        ?      532.9        2.5       ?       ? 
1 1 1    9    4   44 o    151.4    6.3    0.0000   0.0000          ?        ?   229.2293  19.1556          ?        ?      151.4        6.3       ?       ? 
1 1 1    9    4   45 o    362.1    2.9    0.0000   0.0000          ?        ?  1310.8849  21.0712          ?        ?      362.1        2.9       ?       ? 
1 1 1    9    4   46 o    524.8    2.7    0.0000   0.0000          ?        ?  2753.9436  28.0950          ?        ?      524.8        2.7       ?       ? 
1 1 1    9    4   47 f    410.9    2.7    0.0000   0.0000          ?        ?  1688.2511  22.3483          ?        ?      410.9        2.7       ?       ? 
1 1 1    9    4   48 f    394.5    3.0    0.0000   0.0000          ?        ?  1556.7157  23.6253          ?        ?      394.5        3.0       ?       ? 
1 1 1    9    4   49 o    355.1    3.1    0.0000   0.0000          ?        ?  1261.0802  22.3483          ?        ?      355.1        3.1       ?       ? 
1 1 1    9    4   50 o    223.0    4.6    0.0000   0.0000          ?        ?   497.4084  20.4327          ?        ?      223.0        4.6       ?       ? 
1 1 1    9    4   51 o    232.5    4.4    0.0000   0.0000          ?        ?   540.8278  20.4327          ?        ?      232.5        4.4       ?       ? 
1 1 1    9    4   52 o    705.4    2.9    0.0000   0.0000          ?        ?  4975.9990  41.5039          ?        ?      705.4        2.9       ?       ? 
1 1 1    9    4   53 o    302.9    3.5    0.0000   0.0000          ?        ?   917.5555  21.0712          ?        ?      302.9        3.5       ?       ? 
1 1 1    9    4   54 o    538.4    2.7    0.0000   0.0000          ?        ?  2898.8882  29.3720          ?        ?      538.4        2.7       ?       ? 
1 1 1    9    4   55 o    146.8    7.0    0.0000   0.0000          ?        ?   215.8203  20.4327          ?        ?      146.8        7.0       ?       ? 
1 1 1    9    4   56 o    348.8    3.0    0.0000   0.0000          ?        ?  1217.0222  21.0712          ?        ?      348.8        3.0       ?       ? 
1 1 1    9    4   57 o    196.2    4.7    0.0000   0.0000          ?        ?   385.0285  18.5171          ?        ?      196.2        4.7       ?       ? 
1 1 1    9    4   58 o    184.7    5.5    0.0000   0.0000          ?        ?   341.6091  20.4327          ?        ?      184.7        5.5       ?       ? 
1 1 1    9    4   59 o    547.2    2.7    0.0000   0.0000          ?        ?  2994.6665  29.3720          ?        ?      547.2        2.7       ?       ? 
1 1 1    9    4   60 o     32.7   14.7    0.0000   0.0000          ?        ?    -8.9393  19.7942          ?        ?       32.7       14.7       ?       ? 
1 1 1    9    4   61 o    527.5    2.8    0.0000   0.0000          ?        ?  2783.3157  29.3720          ?        ?      527.5        2.8       ?       ? 
1 1 1    9    4   62 o    298.0    3.5    0.0000   0.0000          ?        ?   888.1836  21.0712          ?        ?      298.0        3.5       ?       ? 
1 1 1    9    4   63 o    261.1    4.0    0.0000   0.0000          ?        ?   681.9411  21.0712          ?        ?      261.1        4.0       ?       ? 
1 1 1    9    4   64 o    338.4    3.1    0.0000   0.0000          ?        ?  1145.5078  21.0712          ?        ?      338.4        3.1       ?       ? 
1 1 1    9    4   65 o    448.7    3.0    0.0000   0.0000          ?        ?  2014.5358  26.8179          ?        ?      448.7        3.0       ?       ? 
1 1 1    9    4   66 o    420.5    2.9    0.0000   0.0000          ?        ?  1769.3435  24.2638          ?        ?      420.5        2.9       ?       ? 
1 1 1    9    4   67 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    4   68 o    161.6    5.9    0.0000   0.0000          ?        ?   261.7939  19.1556          ?        ?      161.6        5.9       ?       ? 
1 1 1    9    4   69 o    228.9    4.7    0.0000   0.0000          ?        ?   524.8647  21.7097          ?        ?      228.9        4.7       ?       ? 
1 1 1    9    4   70 o     96.9   10.5    0.0000   0.0000          ?        ?    94.5012  20.4327          ?        ?       96.9       10.5       ?       ? 
1 1 1    9    4   71 o    239.5    4.8    0.0000   0.0000          ?        ?   574.6694  22.9868          ?        ?      239.5        4.8       ?       ? 
1 1 1    9    4   72 o    249.3    4.5    0.0000   0.0000          ?        ?   622.5586  22.3483          ?        ?      249.3        4.5       ?       ? 
1 1 1    9    4   73 o    177.3    6.3    0.0000   0.0000          ?        ?   315.4297  22.3483          ?        ?      177.3        6.3       ?       ? 
1 1 1    9    4   74 o     95.5   12.4    0.0000   0.0000          ?        ?    92.5856  23.6253          ?        ?       95.5       12.4       ?       ? 
1 1 1    9    4   75 o    133.7    8.6    0.0000   0.0000          ?        ?   180.0631  22.9868          ?        ?      133.7        8.6       ?       ? 
1 1 1    9    4   76 o     63.4   17.9    0.0000   0.0000          ?        ?    42.7809  23.6253          ?        ?       63.4       17.9       ?       ? 
1 1 1    9    4   77 o    107.7   10.1    0.0000   0.0000          ?        ?   117.4880  21.7097          ?        ?      107.7       10.1       ?       ? 
1 1 1    9    4   78 o    214.8    5.2    0.0000   0.0000          ?        ?   462.9282  22.3483          ?        ?      214.8        5.2       ?       ? 
1 1 1    9    4   79 f    133.5    7.9    0.0000   0.0000          ?        ?   180.0631  21.0712          ?        ?      133.5        7.9       ?       ? 
1 1 1    9    4   80 o     31.3   14.7    0.0000   0.0000          ?        ?   -21.0712  22.9868          ?        ?       31.3       14.7       ?       ? 
1 1 1    9    4   81 o    107.1    9.8    0.0000   0.0000          ?        ?   116.8494  21.0712          ?        ?      107.1        9.8       ?       ? 
1 1 1    9    5    0 o   1039.0    5.8 10796.7627 121.3191 10796.7627 121.3191 10796.7627 121.3191     1039.0      5.8     1039.0        5.8     0.0     0.0 
1 1 1    9    5    1 o    533.8    2.3    0.0000   0.0000          ?        ?  2849.7219  24.2638          ?        ?      533.8        2.3       ?       ? 
1 1 1    9    5    2 o    225.6    1.4    0.0000   0.0000          ?        ?   508.9017   6.3852          ?        ?      225.6        1.4       ?       ? 
1 1 1    9    5    3 o    656.2    2.5    0.0000   0.0000          ?        ?  4306.1899  33.2031          ?        ?      656.2        2.5       ?       ? 
1 1 1    9    5    4 o    837.4    2.9    0.0000   0.0000          ?        ?  7012.8833  49.1662          ?        ?      837.4        2.9       ?       ? 
1 1 1    9    5    5 o    709.4    2.5    0.0000   0.0000          ?        ?  5032.8276  35.7572          ?        ?      709.4        2.5       ?       ? 
1 1 1    9    5    6 o   1684.6    5.6    0.0000   0.0000          ?        ? 28381.6465 187.7254          ?        ?     1684.6        5.6       ?       ? 
1 1 1    9    5    7 o   1360.9    4.6    0.0000   0.0000          ?        ? 18522.8730 123.8732          ?        ?     1360.9        4.6       ?       ? 
1 1 1    9    5    8 o   1799.4    5.8    0.0000   0.0000          ?        ? 32380.0703 210.0736          ?        ?     1799.4        5.8       ?       ? 
1 1 1    9    5    9 o   1154.9    3.8    0.0000   0.0000          ?        ? 13338.0771  88.7545          ?        ?     1154.9        3.8       ?       ? 
1 1 1    9    5   10 o    775.8    2.7    0.0000   0.0000          ?        ?  6018.7046  42.1424          ?        ?      775.8        2.7       ?       ? 
1 1 1    9    5   11 o   1259.2    4.2    0.0000   0.0000          ?        ? 15856.4082 105.3561          ?        ?     1259.2        4.2       ?       ? 
1 1 1    9    5   12 o    202.3    1.6    0.0000   0.0000          ?        ?   409.2924   6.3852          ?        ?      202.3        1.6       ?       ? 
1 1 1    9    5   13 o   1217.2    4.1    0.0000   0.0000          ?        ? 14816.8945  98.9709          ?        ?     1217.2        4.1       ?       ? 
1 1 1    9    5   14 o   1019.5    3.5    0.0000   0.0000          ?        ? 10393.8555  70.8759          ?        ?     1019.5        3.5       ?       ? 
1 1 1    9    5   15 o    373.5    1.6    0.0000   0.0000          ?        ?  1395.1698  12.1319          ?        ?      373.5        1.6       ?       ? 
1 1 1    9    5   16 o    655.8    2.4    0.0000   0.0000          ?        ?  4300.4434  31.2876          ?        ?      655.8        2.4       ?       ? 
1 1 1    9    5   17 o   1155.3    3.9    0.0000   0.0000          ?        ? 13347.6553  90.0316          ?        ?     1155.3        3.9       ?       ? 
1 1 1    9    5   18 o    408.5    1.8    0.0000   0.0000          ?        ?  1669.0955  14.6860          ?        ?      408.5        1.8       ?       ? 
1 1 1    9    5   19 o    389.0    1.7    0.0000   0.0000          ?        ?  1513.2963  13.4090          ?        ?      389.0        1.7       ?       ? 
1 1 1    9    5   20 f    235.8    1.8    0.0000   0.0000          ?        ?   556.1523   8.3008          ?        ?      235.8        1.8       ?       ? 
1 1 1    9    5   21 o   1389.7    4.6    0.0000   0.0000          ?        ? 19315.2793 127.7043          ?        ?     1389.7        4.6       ?       ? 
1 1 1    9    5   22 f    349.6    1.7    0.0000   0.0000          ?        ?  1222.1304  12.1319          ?        ?      349.6        1.7       ?       ? 
1 1 1    9    5   23 f    281.8    1.7    0.0000   0.0000          ?        ?   794.3209   9.5778          ?        ?      281.8        1.7       ?       ? 
1 1 1    9    5   24 o    452.0    2.0    0.0000   0.0000          ?        ?  2043.2692  17.8786          ?        ?      452.0        2.0       ?       ? 
1 1 1    9    5   25 o    763.3    2.8    0.0000   0.0000          ?        ?  5826.5098  42.1424          ?        ?      763.3        2.8       ?       ? 
1 1 1    9    5   26 f    787.0    2.9    0.0000   0.0000          ?        ?  6194.2983  45.9736          ?        ?      787.0        2.9       ?       ? 
1 1 1    9    5   27 o   1243.6    4.2    0.0000   0.0000          ?        ? 15467.5469 104.7175          ?        ?     1243.6        4.2       ?       ? 
1 1 1    9    5   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    5   29 o   1000.1    3.7    0.0000   0.0000          ?        ? 10001.8027  74.7070          ?        ?     1000.1        3.7       ?       ? 
1 1 1    9    5   30 o    962.1    3.5    0.0000   0.0000          ?        ?  9257.2871  67.6833          ?        ?      962.1        3.5       ?       ? 
1 1 1    9    5   31 o   1564.0    5.4    0.0000   0.0000          ?        ? 24464.3164 169.8468          ?        ?     1564.0        5.4       ?       ? 
1 1 1    9    5   32 o   1116.2    4.2    0.0000   0.0000          ?        ? 12459.4727  93.8627          ?        ?     1116.2        4.2       ?       ? 
1 1 1    9    5   33 o    955.2    3.5    0.0000   0.0000          ?        ?  9124.4736  67.0448          ?        ?      955.2        3.5       ?       ? 
1 1 1    9    5   34 o    338.9    2.8    0.0000   0.0000          ?        ?  1148.7003  19.1556          ?        ?      338.9        2.8       ?       ? 
1 1 1    9    5   35 o    175.6    4.9    0.0000   0.0000          ?        ?   308.4059  17.2401          ?        ?      175.6        4.9       ?       ? 
1 1 1    9    5   36 o   1491.2    4.9    0.0000   0.0000          ?        ? 22238.4316 147.4985          ?        ?     1491.2        4.9       ?       ? 
1 1 1    9    5   37 f    435.4    2.8    0.0000   0.0000          ?        ?  1895.7706  24.2638          ?        ?      435.4        2.8       ?       ? 
1 1 1    9    5   38 o   1115.0    4.0    0.0000   0.0000          ?        ? 12433.9316  89.3930          ?        ?     1115.0        4.0       ?       ? 
1 1 1    9    5   39 o    559.2    2.6    0.0000   0.0000          ?        ?  3127.4788  28.7335          ?        ?      559.2        2.6       ?       ? 
1 1 1    9    5   40 o    959.1    3.5    0.0000   0.0000          ?        ?  9198.5420  66.4062          ?        ?      959.1        3.5       ?       ? 
1 1 1    9    5   41 o    267.1    3.6    0.0000   0.0000          ?        ?   713.2286  19.1556          ?        ?      267.1        3.6       ?       ? 
1 1 1    9    5   42 o    884.5    3.4    0.0000   0.0000          ?        ?  7823.8057  59.3825          ?        ?      884.5        3.4       ?       ? 
1 1 1    9    5   43 o   1036.2    3.6    0.0000   0.0000          ?        ? 10738.0176  75.3456          ?        ?     1036.2        3.6       ?       ? 
1 1 1    9    5   44 o    736.7    2.9    0.0000   0.0000          ?        ?  5427.4336  42.1424          ?        ?      736.7        2.9       ?       ? 
1 1 1    9    5   45 o     41.0   16.6    0.0000   0.0000          ?        ?     7.0237  21.0712          ?        ?       41.0       16.6       ?       ? 
1 1 1    9    5   46 o   1161.0    4.2    0.0000   0.0000          ?        ? 13481.1074  98.3323          ?        ?     1161.0        4.2       ?       ? 
1 1 1    9    5   47 o     55.5   17.2    0.0000   0.0000          ?        ?    30.6490  21.0712          ?        ?       55.5       17.2       ?       ? 
1 1 1    9    5   48 o   1432.3    5.0    0.0000   0.0000          ?        ? 20520.1699 142.3903          ?        ?     1432.3        5.0       ?       ? 
1 1 1    9    5   49 o    723.1    3.0    0.0000   0.0000          ?        ?  5229.4922  42.7809          ?        ?      723.1        3.0       ?       ? 
1 1 1    9    5   50 o    329.3    3.3    0.0000   0.0000          ?        ?  1084.2097  21.7097          ?        ?      329.3        3.3       ?       ? 
1 1 1    9    5   51 o    142.9    6.3    0.0000   0.0000          ?        ?   204.3269  17.8786          ?        ?      142.9        6.3       ?       ? 
1 1 1    9    5   52 o    463.0    2.8    0.0000   0.0000          ?        ?  2143.5171  25.5409          ?        ?      463.0        2.8       ?       ? 
1 1 1    9    5   53 o    646.3    2.8    0.0000   0.0000          ?        ?  4177.8472  35.7572          ?        ?      646.3        2.8       ?       ? 
1 1 1    9    5   54 o    286.0    3.8    0.0000   0.0000          ?        ?   817.9462  21.7097          ?        ?      286.0        3.8       ?       ? 
1 1 1    9    5   55 o     98.7    9.4    0.0000   0.0000          ?        ?    97.6938  18.5171          ?        ?       98.7        9.4       ?       ? 
1 1 1    9    5   56 o    268.9    3.8    0.0000   0.0000          ?        ?   723.4450  20.4327          ?        ?      268.9        3.8       ?       ? 
1 1 1    9    5   57 o    504.4    2.8    0.0000   0.0000          ?        ?  2544.5088  28.0950          ?        ?      504.4        2.8       ?       ? 
1 1 1    9    5   58 o    225.7    4.5    0.0000   0.0000          ?        ?   509.5403  20.4327          ?        ?      225.7        4.5       ?       ? 
1 1 1    9    5   59 o    118.9    8.1    0.0000   0.0000          ?        ?   141.7518  19.1556          ?        ?      118.9        8.1       ?       ? 
1 1 1    9    5   60 o    321.3    3.2    0.0000   0.0000          ?        ?  1032.4895  20.4327          ?        ?      321.3        3.2       ?       ? 
1 1 1    9    5   61 o    479.2    2.7    0.0000   0.0000          ?        ?  2297.4006  26.1794          ?        ?      479.2        2.7       ?       ? 
1 1 1    9    5   62 o    376.4    3.1    0.0000   0.0000          ?        ?  1417.5181  22.9868          ?        ?      376.4        3.1       ?       ? 
1 1 1    9    5   63 o    216.5    4.6    0.0000   0.0000          ?        ?   469.3134  19.7942          ?        ?      216.5        4.6       ?       ? 
1 1 1    9    5   64 o    260.6    3.8    0.0000   0.0000          ?        ?   679.3870  19.7942          ?        ?      260.6        3.8       ?       ? 
1 1 1    9    5   65 o    106.7    9.3    0.0000   0.0000          ?        ?   114.2954  19.7942          ?        ?      106.7        9.3       ?       ? 
1 1 1    9    5   66 o    129.6    7.9    0.0000   0.0000          ?        ?   168.5697  20.4327          ?        ?      129.6        7.9       ?       ? 
1 1 1    9    5   67 o     60.0   16.5    0.0000   0.0000          ?        ?    37.6728  20.4327          ?        ?       60.0       16.5       ?       ? 
1 1 1    9    5   68 o     79.1   12.9    0.0000   0.0000          ?        ?    63.2136  20.4327          ?        ?       79.1       12.9       ?       ? 
1 1 1    9    5   69 o    344.5    3.3    0.0000   0.0000          ?        ?  1187.6503  22.9868          ?        ?      344.5        3.3       ?       ? 
1 1 1    9    5   70 o    418.6    3.0    0.0000   0.0000          ?        ?  1753.3804  24.9023          ?        ?      418.6        3.0       ?       ? 
1 1 1    9    5   71 o    213.6    4.9    0.0000   0.0000          ?        ?   457.1815  21.0712          ?        ?      213.6        4.9       ?       ? 
1 1 1    9    5   72 o    302.4    3.9    0.0000   0.0000          ?        ?   915.6400  23.6253          ?        ?      302.4        3.9       ?       ? 
1 1 1    9    5   73 o     22.3   11.3    0.0000   0.0000          ?        ?   -71.5144  22.9868          ?        ?       22.3       11.3       ?       ? 
1 1 1    9    5   74 o     62.6   17.6    0.0000   0.0000          ?        ?    41.5039  22.9868          ?        ?       62.6       17.6       ?       ? 
1 1 1    9    5   75 o    178.9    5.9    0.0000   0.0000          ?        ?   321.1764  21.0712          ?        ?      178.9        5.9       ?       ? 
1 1 1    9    5   76 o    155.3    7.6    0.0000   0.0000          ?        ?   242.6382  23.6253          ?        ?      155.3        7.6       ?       ? 
1 1 1    9    5   77 o    254.9    4.5    0.0000   0.0000          ?        ?   651.2921  22.9868          ?        ?      254.9        4.5       ?       ? 
1 1 1    9    5   78 o    149.3    7.5    0.0000   0.0000          ?        ?   224.7596  22.3483          ?        ?      149.3        7.5       ?       ? 
1 1 1    9    5   79 o     47.2   17.6    0.0000   0.0000          ?        ?    18.5171  22.3483          ?        ?       47.2       17.6       ?       ? 
1 1 1    9    5   80 f     32.1   14.6    0.0000   0.0000          ?        ?   -12.7704  21.0712          ?        ?       32.1       14.6       ?       ? 
1 1 1    9    5   81 o     33.6   15.0    0.0000   0.0000          ?        ?    -6.3852  20.4327          ?        ?       33.6       15.0       ?       ? 
1 1 1    9    6    0 o   1605.7    8.6 25786.0566 275.2028 25786.0566 275.2028 25786.0566 275.2028     1605.7      8.6     1605.7        8.6     0.0     0.0 
1 1 1    9    6    1 o    972.3    3.8    0.0000   0.0000          ?        ?  9454.5898  74.7070          ?        ?      972.3        3.8       ?       ? 
1 1 1    9    6    2 o   1333.1    5.1    0.0000   0.0000          ?        ? 17773.2500 134.7281          ?        ?     1333.1        5.1       ?       ? 
1 1 1    9    6    3 o    804.8    3.0    0.0000   0.0000          ?        ?  6476.5249  48.5276          ?        ?      804.8        3.0       ?       ? 
1 1 1    9    6    4 o   1571.6    5.5    0.0000   0.0000          ?        ? 24700.5703 172.4008          ?        ?     1571.6        5.5       ?       ? 
1 1 1    9    6    5 o    525.7    1.9    0.0000   0.0000          ?        ?  2764.1602  20.4327          ?        ?      525.7        1.9       ?       ? 
1 1 1    9    6    6 o    855.5    3.0    0.0000   0.0000          ?        ?  7319.3735  51.7203          ?        ?      855.5        3.0       ?       ? 
1 1 1    9    6    7 o    680.1    2.5    0.0000   0.0000          ?        ?  4625.4507  33.8416          ?        ?      680.1        2.5       ?       ? 
1 1 1    9    6    8 o    307.4    1.5    0.0000   0.0000          ?        ?   945.0120   8.9393          ?        ?      307.4        1.5       ?       ? 
1 1 1    9    6    9 o   1144.5    3.9    0.0000   0.0000          ?        ? 13099.9102  89.3930          ?        ?     1144.5        3.9       ?       ? 
1 1 1    9    6   10 o    316.3    1.5    0.0000   0.0000          ?        ?  1000.5634   9.5778          ?        ?      316.3        1.5       ?       ? 
1 1 1    9    6   11 o    267.5    1.4    0.0000   0.0000          ?        ?   715.7827   7.6623          ?        ?      267.5        1.4       ?       ? 
1 1 1    9    6   12 o    651.0    2.4    0.0000   0.0000          ?        ?  4238.5063  30.6490          ?        ?      651.0        2.4       ?       ? 
1 1 1    9    6   13 o   1270.2    4.2    0.0000   0.0000          ?        ? 16135.4414 107.9102          ?        ?     1270.2        4.2       ?       ? 
1 1 1    9    6   14 o    425.8    1.7    0.0000   0.0000          ?        ?  1812.7628  14.6860          ?        ?      425.8        1.7       ?       ? 
1 1 1    9    6   15 o    817.9    2.8    0.0000   0.0000          ?        ?  6690.4297  46.6121          ?        ?      817.9        2.8       ?       ? 
1 1 1    9    6   16 o    573.7    2.2    0.0000   0.0000          ?        ?  3291.5791  24.9023          ?        ?      573.7        2.2       ?       ? 
1 1 1    9    6   17 o    407.6    1.8    0.0000   0.0000          ?        ?  1661.4333  14.6860          ?        ?      407.6        1.8       ?       ? 
1 1 1    9    6   18 o   1423.4    4.7    0.0000   0.0000          ?        ? 20262.2070 134.0895          ?        ?     1423.4        4.7       ?       ? 
1 1 1    9    6   19 o    326.1    1.8    0.0000   0.0000          ?        ?  1063.1385  11.4934          ?        ?      326.1        1.8       ?       ? 
1 1 1    9    6   20 o    829.9    2.9    0.0000   0.0000          ?        ?  6887.7324  48.5276          ?        ?      829.9        2.9       ?       ? 
1 1 1    9    6   21 o    633.6    2.4    0.0000   0.0000          ?        ?  4015.0239  30.0105          ?        ?      633.6        2.4       ?       ? 
1 1 1    9    6   22 o   1650.0    5.4    0.0000   0.0000          ?        ? 27229.1152 178.7861          ?        ?     1650.0        5.4       ?       ? 
1 1 1    9    6   23 o    224.6    2.0    0.0000   0.0000          ?        ?   504.4321   8.9393          ?        ?      224.6        2.0       ?       ? 
1 1 1    9    6   24 o   1257.6    4.2    0.0000   0.0000          ?        ? 15817.4570 106.6331          ?        ?     1257.6        4.2       ?       ? 
1 1 1    9    6   25 o    105.1    4.3    0.0000   0.0000          ?        ?   110.4642   8.9393          ?        ?      105.1        4.3       ?       ? 
1 1 1    9    6   26 o    165.9    2.7    0.0000   0.0000          ?        ?   275.2028   8.9393          ?        ?      165.9        2.7       ?       ? 
1 1 1    9    6   27 o    672.7    2.7    0.0000   0.0000          ?        ?  4525.2026  35.7572          ?        ?      672.7        2.7       ?       ? 
1 1 1    9    6   28 o   1020.3    3.6    0.0000   0.0000          ?        ? 10411.0947  74.0685          ?        ?     1020.3        3.6       ?       ? 
1 1 1    9    6   29 o     27.3   12.0    0.0000   0.0000          ?        ?    -3.8311  12.7704          ?        ?       27.3       12.0       ?       ? 
1 1 1    9    6   30 o    413.3    2.2    0.0000   0.0000          ?        ?  1708.0454  18.5171          ?        ?      413.3        2.2       ?       ? 
1 1 1    9    6   31 f   1089.8    4.0    0.0000   0.0000          ?        ? 11877.7793  86.8389          ?        ?     1089.8        4.0       ?       ? 
1 1 1    9    6   32 o   1206.0    4.4    0.0000   0.0000          ?        ? 14545.5225 105.9946          ?        ?     1206.0        4.4       ?       ? 
1 1 1    9    6   33 o    836.9    3.3    0.0000   0.0000          ?        ?  7004.5820  54.9129          ?        ?      836.9        3.3       ?       ? 
1 1 1    9    6   34 o   1341.2    4.6    0.0000   0.0000          ?        ? 17988.4316 124.5117          ?        ?     1341.2        4.6       ?       ? 
1 1 1    9    6   35 o    358.1    2.7    0.0000   0.0000          ?        ?  1282.1515  19.1556          ?        ?      358.1        2.7       ?       ? 
1 1 1    9    6   36 o   1922.2    6.2    0.0000   0.0000          ?        ? 36952.5234 240.0841          ?        ?     1922.2        6.2       ?       ? 
1 1 1    9    6   37 o    456.0    2.6    0.0000   0.0000          ?        ?  2079.6650  23.6253          ?        ?      456.0        2.6       ?       ? 
1 1 1    9    6   38 o    754.0    3.0    0.0000   0.0000          ?        ?  5686.0352  44.6965          ?        ?      754.0        3.0       ?       ? 
1 1 1    9    6   39 o    520.6    2.6    0.0000   0.0000          ?        ?  2710.5244  27.4564          ?        ?      520.6        2.6       ?       ? 
1 1 1    9    6   40 o    611.2    2.7    0.0000   0.0000          ?        ?  3735.3516  32.5646          ?        ?      611.2        2.7       ?       ? 
1 1 1    9    6   41 o    453.6    2.6    0.0000   0.0000          ?        ?  2057.9551  23.6253          ?        ?      453.6        2.6       ?       ? 
1 1 1    9    6   42 o    424.1    3.0    0.0000   0.0000          ?        ?  1798.7155  25.5409          ?        ?      424.1        3.0       ?       ? 
1 1 1    9    6   43 o   1101.4    3.9    0.0000   0.0000          ?        ? 12131.9111  86.8389          ?        ?     1101.4        3.9       ?       ? 
1 1 1    9    6   44 o   1229.3    4.3    0.0000   0.0000          ?        ? 15114.4463 104.7175          ?        ?     1229.3        4.3       ?       ? 
1 1 1    9    6   45 o    845.1    3.2    0.0000   0.0000          ?        ?  7143.1411  54.2743          ?        ?      845.1        3.2       ?       ? 
1 1 1    9    6   46 o   1249.2    4.3    0.0000   0.0000          ?        ? 15608.0225 106.6331          ?        ?     1249.2        4.3       ?       ? 
1 1 1    9    6   47 o    237.4    4.3    0.0000   0.0000          ?        ?   563.8146  20.4327          ?        ?      237.4        4.3       ?       ? 
1 1 1    9    6   48 o    582.0    2.7    0.0000   0.0000          ?        ?  3387.3572  31.2876          ?        ?      582.0        2.7       ?       ? 
1 1 1    9    6   49 o    214.8    4.3    0.0000   0.0000          ?        ?   461.6512  18.5171          ?        ?      214.8        4.3       ?       ? 
1 1 1    9    6   50 o    177.2    5.4    0.0000   0.0000          ?        ?   314.1526  19.1556          ?        ?      177.2        5.4       ?       ? 
1 1 1    9    6   51 o    470.5    2.7    0.0000   0.0000          ?        ?  2214.3928  25.5409          ?        ?      470.5        2.7       ?       ? 
1 1 1    9    6   52 o    250.9    3.9    0.0000   0.0000          ?        ?   629.5823  19.7942          ?        ?      250.9        3.9       ?       ? 
1 1 1    9    6   53 o    161.4    5.5    0.0000   0.0000          ?        ?   260.5168  17.8786          ?        ?      161.4        5.5       ?       ? 
1 1 1    9    6   54 o     23.4   11.5    0.0000   0.0000          ?        ?   -41.5039  19.1556          ?        ?       23.4       11.5       ?       ? 
1 1 1    9    6   55 o    377.2    3.0    0.0000   0.0000          ?        ?  1423.2646  22.3483          ?        ?      377.2        3.0       ?       ? 
1 1 1    9    6   56 f    130.5    7.3    0.0000   0.0000          ?        ?   170.4853  19.1556          ?        ?      130.5        7.3       ?       ? 
1 1 1    9    6   57 o    188.9    5.2    0.0000   0.0000          ?        ?   356.9336  19.7942          ?        ?      188.9        5.2       ?       ? 
1 1 1    9    6   58 o    442.3    2.7    0.0000   0.0000          ?        ?  1956.4302  23.6253          ?        ?      442.3        2.7       ?       ? 
1 1 1    9    6   59 o    435.6    2.8    0.0000   0.0000          ?        ?  1897.6864  24.2638          ?        ?      435.6        2.8       ?       ? 
1 1 1    9    6   60 o    204.6    5.0    0.0000   0.0000          ?        ?   418.8702  20.4327          ?        ?      204.6        5.0       ?       ? 
1 1 1    9    6   61 o    321.8    3.5    0.0000   0.0000          ?        ?  1035.6820  22.3483          ?        ?      321.8        3.5       ?       ? 
1 1 1    9    6   62 o    219.5    4.2    0.0000   0.0000          ?        ?   482.0838  18.5171          ?        ?      219.5        4.2       ?       ? 
1 1 1    9    6   63 o     45.8   16.2    0.0000   0.0000          ?        ?    18.5171  18.5171          ?        ?       45.8       16.2       ?       ? 
1 1 1    9    6   64 o     30.9   14.0    0.0000   0.0000          ?        ?   -10.2163  18.5171          ?        ?       30.9       14.0       ?       ? 
1 1 1    9    6   65 o     50.7   16.2    0.0000   0.0000          ?        ?    25.5409  18.5171          ?        ?       50.7       16.2       ?       ? 
1 1 1    9    6   66 o    140.7    7.5    0.0000   0.0000          ?        ?   198.5802  21.0712          ?        ?      140.7        7.5       ?       ? 
1 1 1    9    6   67 o     81.1   13.0    0.0000   0.0000          ?        ?    66.4062  21.0712          ?        ?       81.1       13.0       ?       ? 
1 1 1    9    6   68 o    215.2    4.7    0.0000   0.0000          ?        ?   463.5667  20.4327          ?        ?      215.2        4.7       ?       ? 
1 1 1    9    6   69 o    106.0    9.6    0.0000   0.0000          ?        ?   113.0183  20.4327          ?        ?      106.0        9.6       ?       ? 
1 1 1    9    6   70 f    151.1    7.2    0.0000   0.0000          ?        ?   229.2293  21.7097          ?        ?      151.1        7.2       ?       ? 
1 1 1    9    6   71 o     93.4   12.0    0.0000   0.0000          ?        ?    88.1160  22.3483          ?        ?       93.4       12.0       ?       ? 
1 1 1    9    6   72 o    455.5    2.8    0.0000   0.0000          ?        ?  2075.8337  25.5409          ?        ?      455.5        2.8       ?       ? 
1 1 1    9    6   73 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    6   74 o     97.7   10.5    0.0000   0.0000          ?        ?    96.4168  20.4327          ?        ?       97.7       10.5       ?       ? 
1 1 1    9    6   75 o     32.3   14.7    0.0000   0.0000          ?        ?   -12.7704  21.0712          ?        ?       32.3       14.7       ?       ? 
1 1 1    9    6   76 o    190.6    5.7    0.0000   0.0000          ?        ?   364.5958  21.7097          ?        ?      190.6        5.7       ?       ? 
1 1 1    9    6   77 o     45.6   17.3    0.0000   0.0000          ?        ?    15.9630  21.7097          ?        ?       45.6       17.3       ?       ? 
1 1 1    9    6   78 o    373.3    3.3    0.0000   0.0000          ?        ?  1395.8083  24.9023          ?        ?      373.3        3.3       ?       ? 
1 1 1    9    6   79 o     37.8   16.0    0.0000   0.0000          ?        ?     1.9156  21.0712          ?        ?       37.8       16.0       ?       ? 
1 1 1    9    6   80 o    157.2    6.3    0.0000   0.0000          ?        ?   249.0234  19.7942          ?        ?      157.2        6.3       ?       ? 
1 1 1    9    6   81 o    173.1    6.3    0.0000   0.0000          ?        ?   302.0207  21.7097          ?        ?      173.1        6.3       ?       ? 
1 1 1    9    7    0 o    392.5    2.8 1540.7527  21.7097  1540.7527  21.7097  1540.7527  21.7097      392.5      2.8      392.5        2.8     0.0     0.0 
1 1 1    9    7    1 o    866.8    3.5    0.0000   0.0000          ?        ?  7514.1230  61.2981          ?        ?      866.8        3.5       ?       ? 
1 1 1    9    7    2 o    695.9    2.7    0.0000   0.0000          ?        ?  4842.5483  37.6728          ?        ?      695.9        2.7       ?       ? 
1 1 1    9    7    3 o    213.2    1.3    0.0000   0.0000          ?        ?   454.6274   5.7467          ?        ?      213.2        1.3       ?       ? 
1 1 1    9    7    4 o   1901.2    7.1    0.0000   0.0000          ?        ? 36152.4570 270.7332          ?        ?     1901.2        7.1       ?       ? 
1 1 1    9    7    5 o   1238.0    4.2    0.0000   0.0000          ?        ? 15327.0723 102.8020          ?        ?     1238.0        4.2       ?       ? 
1 1 1    9    7    6 o    389.6    1.6    0.0000   0.0000          ?        ?  1517.7659  12.7704          ?        ?      389.6        1.6       ?       ? 
1 1 1    9    7    7 o    670.0    2.4    0.0000   0.0000          ?        ?  4489.4453  32.5646          ?        ?      670.0        2.4       ?       ? 
1 1 1    9    7    8 o    985.4    3.4    0.0000   0.0000          ?        ?  9710.6377  67.0448          ?        ?      985.4        3.4       ?       ? 
1 1 1    9    7    9 o   1284.9    4.2    0.0000   0.0000          ?        ? 16509.6152 109.1872          ?        ?     1284.9        4.2       ?       ? 
1 1 1    9    7   10 o   1482.6    5.0    0.0000   0.0000          ?        ? 21983.6602 146.8600          ?        ?     1482.6        5.0       ?       ? 
1 1 1    9    7   11 o    850.9    3.0    0.0000   0.0000          ?        ?  7240.1968  50.4432          ?        ?      850.9        3.0       ?       ? 
1 1 1    9    7   12 o    570.5    2.2    0.0000   0.0000          ?        ?  3254.5449  24.9023          ?        ?      570.5        2.2       ?       ? 
1 1 1    9    7   13 o   1304.0    4.3    0.0000   0.0000          ?        ? 17005.1074 113.0183          ?        ?     1304.0        4.3       ?       ? 
1 1 1    9    7   14 o   1876.3    6.1    0.0000   0.0000          ?        ? 35211.2734 229.2293          ?        ?     1876.3        6.1       ?       ? 
1 1 1    9    7   15 o    868.7    3.0    0.0000   0.0000          ?        ?  7546.0488  52.3588          ?        ?      868.7        3.0       ?       ? 
1 1 1    9    7   16 o   1119.3    3.8    0.0000   0.0000          ?        ? 12529.7100  84.9234          ?        ?     1119.3        3.8       ?       ? 
1 1 1    9    7   17 o    475.8    1.9    0.0000   0.0000          ?        ?  2263.5591  18.5171          ?        ?      475.8        1.9       ?       ? 
1 1 1    9    7   18 o    624.7    2.3    0.0000   0.0000          ?        ?  3902.0056  28.7335          ?        ?      624.7        2.3       ?       ? 
1 1 1    9    7   19 o   1277.5    4.3    0.0000   0.0000          ?        ? 16320.6123 109.1872          ?        ?     1277.5        4.3       ?       ? 
1 1 1    9    7   20 o    482.4    2.1    0.0000   0.0000          ?        ?  2327.4114  19.7942          ?        ?      482.4        2.1       ?       ? 
1 1 1    9    7   21 o   1093.6    3.7    0.0000   0.0000          ?        ? 11959.5098  81.0922          ?        ?     1093.6        3.7       ?       ? 
1 1 1    9    7   22 o    292.0    1.7    0.0000   0.0000          ?        ?   852.4264  10.2163          ?        ?      292.0        1.7       ?       ? 
1 1 1    9    7   23 o   1474.3    5.0    0.0000   0.0000          ?        ? 21737.1914 147.4985          ?        ?     1474.3        5.0       ?       ? 
1 1 1    9    7   24 o    582.1    2.3    0.0000   0.0000          ?        ?  3387.9956  26.8179          ?        ?      582.1        2.3       ?       ? 
1 1 1    9    7   25 o    877.7    3.1    0.0000   0.0000          ?        ?  7703.1250  54.9129          ?        ?      877.7        3.1       ?       ? 
1 1 1    9    7   26 o    387.6    2.1    0.0000   0.0000          ?        ?  1502.4414  16.6016          ?        ?      387.6        2.1       ?       ? 
1 1 1    9    7   27 o   1015.3    3.5    0.0000   0.0000          ?        ? 10309.5703  71.5144          ?        ?     1015.3        3.5       ?       ? 
1 1 1    9    7   28 o    124.3    5.9    0.0000   0.0000          ?        ?   154.5222  14.6860          ?        ?      124.3        5.9       ?       ? 
1 1 1    9    7   29 o   1051.9    3.9    0.0000   0.0000          ?        ? 11064.9414  81.7308          ?        ?     1051.9        3.9       ?       ? 
1 1 1    9    7   30 o    987.2    3.6    0.0000   0.0000          ?        ?  9745.1172  70.8759          ?        ?      987.2        3.6       ?       ? 
1 1 1    9    7   31 o   1347.5    4.9    0.0000   0.0000          ?        ? 18159.5547 132.8125          ?        ?     1347.5        4.9       ?       ? 
1 1 1    9    7   32 o   1457.0    5.0    0.0000   0.0000          ?        ? 21228.9277 145.5829          ?        ?     1457.0        5.0       ?       ? 
1 1 1    9    7   33 o    590.7    2.8    0.0000   0.0000          ?        ?  3489.5208  33.2031          ?        ?      590.7        2.8       ?       ? 
1 1 1    9    7   34 o   2771.1    9.3    0.0000   0.0000          ?        ? 76811.5938 512.7329          ?        ?     2771.1        9.3       ?       ? 
1 1 1    9    7   35 o   1014.4    3.7    0.0000   0.0000          ?        ? 10289.7764  74.7070          ?        ?     1014.4        3.7       ?       ? 
1 1 1    9    7   36 f    804.2    3.0    0.0000   0.0000          ?        ?  6466.9468  48.5276          ?        ?      804.2        3.0       ?       ? 
1 1 1    9    7   37 o    296.1    2.9    0.0000   0.0000          ?        ?   876.6902  17.2401          ?        ?      296.1        2.9       ?       ? 
1 1 1    9    7   38 f    841.2    3.1    0.0000   0.0000          ?        ?  7076.7354  52.3588          ?        ?      841.2        3.1       ?       ? 
1 1 1    9    7   39 o    238.9    3.3    0.0000   0.0000          ?        ?   570.8383  15.9630          ?        ?      238.9        3.3       ?       ? 
1 1 1    9    7   40 o    201.0    3.8    0.0000   0.0000          ?        ?   404.1842  15.3245          ?        ?      201.0        3.8       ?       ? 
1 1 1    9    7   41 o    106.0    8.7    0.0000   0.0000          ?        ?   112.3798  18.5171          ?        ?      106.0        8.7       ?       ? 
1 1 1    9    7   42 o    993.6    3.6    0.0000   0.0000          ?        ?  9872.8213  71.5144          ?        ?      993.6        3.6       ?       ? 
1 1 1    9    7   43 o   1270.8    4.4    0.0000   0.0000          ?        ? 16150.1279 111.7413          ?        ?     1270.8        4.4       ?       ? 
1 1 1    9    7   44 o    265.7    3.8    0.0000   0.0000          ?        ?   706.2049  20.4327          ?        ?      265.7        3.8       ?       ? 
1 1 1    9    7   45 o    256.2    3.7    0.0000   0.0000          ?        ?   656.4003  19.1556          ?        ?      256.2        3.7       ?       ? 
1 1 1    9    7   46 o    278.7    3.6    0.0000   0.0000          ?        ?   777.0808  19.7942          ?        ?      278.7        3.6       ?       ? 
1 1 1    9    7   47 o    560.2    2.7    0.0000   0.0000          ?        ?  3138.3337  30.6490          ?        ?      560.2        2.7       ?       ? 
1 1 1    9    7   48 o    656.1    2.9    0.0000   0.0000          ?        ?  4305.5513  38.3113          ?        ?      656.1        2.9       ?       ? 
1 1 1    9    7   49 f    590.9    2.7    0.0000   0.0000          ?        ?  3491.4363  31.9261          ?        ?      590.9        2.7       ?       ? 
1 1 1    9    7   50 o    735.0    3.0    0.0000   0.0000          ?        ?  5402.5312  43.4195          ?        ?      735.0        3.0       ?       ? 
1 1 1    9    7   51 o    764.8    3.0    0.0000   0.0000          ?        ?  5849.4966  46.6121          ?        ?      764.8        3.0       ?       ? 
1 1 1    9    7   52 o    266.2    3.7    0.0000   0.0000          ?        ?   708.7590  19.7942          ?        ?      266.2        3.7       ?       ? 
1 1 1    9    7   53 o     53.4   16.4    0.0000   0.0000          ?        ?    28.7335  19.1556          ?        ?       53.4       16.4       ?       ? 
1 1 1    9    7   54 f    662.0    2.9    0.0000   0.0000          ?        ?  4382.8125  38.3113          ?        ?      662.0        2.9       ?       ? 
1 1 1    9    7   55 o    534.3    2.7    0.0000   0.0000          ?        ?  2854.8303  28.7335          ?        ?      534.3        2.7       ?       ? 
1 1 1    9    7   56 o    486.7    2.6    0.0000   0.0000          ?        ?  2369.5537  25.5409          ?        ?      486.7        2.6       ?       ? 
1 1 1    9    7   57 o    181.6    5.3    0.0000   0.0000          ?        ?   330.1157  19.1556          ?        ?      181.6        5.3       ?       ? 
1 1 1    9    7   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    7   59 o     30.5   14.1    0.0000   0.0000          ?        ?   -17.2401  20.4327          ?        ?       30.5       14.1       ?       ? 
1 1 1    9    7   60 o    207.7    4.9    0.0000   0.0000          ?        ?   431.6406  20.4327          ?        ?      207.7        4.9       ?       ? 
1 1 1    9    7   61 o     63.4   16.1    0.0000   0.0000          ?        ?    42.1424  20.4327          ?        ?       63.4       16.1       ?       ? 
1 1 1    9    7   62 o    316.8    3.3    0.0000   0.0000          ?        ?  1003.7560  21.0712          ?        ?      316.8        3.3       ?       ? 
1 1 1    9    7   63 o    306.3    3.3    0.0000   0.0000          ?        ?   938.6268  20.4327          ?        ?      306.3        3.3       ?       ? 
1 1 1    9    7   64 o     25.1   12.3    0.0000   0.0000          ?        ?   -38.9498  20.4327          ?        ?       25.1       12.3       ?       ? 
1 1 1    9    7   65 o    340.0    3.2    0.0000   0.0000          ?        ?  1156.3627  21.7097          ?        ?      340.0        3.2       ?       ? 
1 1 1    9    7   66 o     21.6   10.8    0.0000   0.0000          ?        ?   -55.5514  19.7942          ?        ?       21.6       10.8       ?       ? 
1 1 1    9    7   67 o    294.0    3.6    0.0000   0.0000          ?        ?   865.1968  21.0712          ?        ?      294.0        3.6       ?       ? 
1 1 1    9    7   68 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    7   69 o    447.5    2.9    0.0000   0.0000          ?        ?  2003.6808  25.5409          ?        ?      447.5        2.9       ?       ? 
1 1 1    9    7   70 o     68.6   16.1    0.0000   0.0000          ?        ?    49.8047  21.7097          ?        ?       68.6       16.1       ?       ? 
1 1 1    9    7   71 o     26.6   12.8    0.0000   0.0000          ?        ?   -31.2876  20.4327          ?        ?       26.6       12.8       ?       ? 
1 1 1    9    7   72 o    196.9    5.7    0.0000   0.0000          ?        ?   388.8597  22.3483          ?        ?      196.9        5.7       ?       ? 
1 1 1    9    7   73 o     52.7   17.8    0.0000   0.0000          ?        ?    26.8179  22.3483          ?        ?       52.7       17.8       ?       ? 
1 1 1    9    7   74 o     67.5   15.9    0.0000   0.0000          ?        ?    48.5276  21.0712          ?        ?       67.5       15.9       ?       ? 
1 1 1    9    7   75 o     30.5   14.2    0.0000   0.0000          ?        ?   -18.5171  21.0712          ?        ?       30.5       14.2       ?       ? 
1 1 1    9    7   76 o    139.3    7.6    0.0000   0.0000          ?        ?   195.3876  21.0712          ?        ?      139.3        7.6       ?       ? 
1 1 1    9    7   77 o    110.6    9.8    0.0000   0.0000          ?        ?   123.8732  21.7097          ?        ?      110.6        9.8       ?       ? 
1 1 1    9    7   78 f     29.1   13.7    0.0000   0.0000          ?        ?   -22.9868  21.0712          ?        ?       29.1       13.7       ?       ? 
1 1 1    9    7   79 o     51.2   17.3    0.0000   0.0000          ?        ?    26.1794  21.0712          ?        ?       51.2       17.3       ?       ? 
1 1 1    9    7   80 o     46.5   17.9    0.0000   0.0000          ?        ?    16.6016  23.6253          ?        ?       46.5       17.9       ?       ? 
1 1 1    9    8    0 o   1008.6    6.0 10174.2041 121.9576 10174.2041 121.9576 10174.2041 121.9576     1008.6      6.0     1008.6        6.0     0.0     0.0 
1 1 1    9    8    1 o    435.2    2.1    0.0000   0.0000          ?        ?  1893.8552  18.5171          ?        ?      435.2        2.1       ?       ? 
1 1 1    9    8    2 o   1357.9    5.4    0.0000   0.0000          ?        ? 18441.7812 145.5829          ?        ?     1357.9        5.4       ?       ? 
1 1 1    9    8    3 o    273.3    1.5    0.0000   0.0000          ?        ?   747.0703   8.3008          ?        ?      273.3        1.5       ?       ? 
1 1 1    9    8    4 o    865.2    3.1    0.0000   0.0000          ?        ?  7486.6660  52.9973          ?        ?      865.2        3.1       ?       ? 
1 1 1    9    8    5 o    877.6    3.0    0.0000   0.0000          ?        ?  7702.4868  52.9973          ?        ?      877.6        3.0       ?       ? 
1 1 1    9    8    6 o   1341.9    4.5    0.0000   0.0000          ?        ? 18007.5859 121.3191          ?        ?     1341.9        4.5       ?       ? 
1 1 1    9    8    7 o    841.4    2.9    0.0000   0.0000          ?        ?  7080.5664  49.1662          ?        ?      841.4        2.9       ?       ? 
1 1 1    9    8    8 o    966.1    3.3    0.0000   0.0000          ?        ?  9334.5479  63.8522          ?        ?      966.1        3.3       ?       ? 
1 1 1    9    8    9 o    593.4    2.3    0.0000   0.0000          ?        ?  3521.4468  26.8179          ?        ?      593.4        2.3       ?       ? 
1 1 1    9    8   10 o   1691.6    5.5    0.0000   0.0000          ?        ? 28619.1777 186.4483          ?        ?     1691.6        5.5       ?       ? 
1 1 1    9    8   11 o   1357.3    4.5    0.0000   0.0000          ?        ? 18423.2656 121.9576          ?        ?     1357.3        4.5       ?       ? 
1 1 1    9    8   12 o   1471.9    4.8    0.0000   0.0000          ?        ? 21666.3164 142.3903          ?        ?     1471.9        4.8       ?       ? 
1 1 1    9    8   13 o   1788.6    5.8    0.0000   0.0000          ?        ? 31993.7656 208.1580          ?        ?     1788.6        5.8       ?       ? 
1 1 1    9    8   14 f    552.0    2.1    0.0000   0.0000          ?        ?  3047.0254  22.9868          ?        ?      552.0        2.1       ?       ? 
1 1 1    9    8   15 o    284.4    1.7    0.0000   0.0000          ?        ?   809.0069   9.5778          ?        ?      284.4        1.7       ?       ? 
1 1 1    9    8   16 o    995.0    3.4    0.0000   0.0000          ?        ?  9900.2773  67.6833          ?        ?      995.0        3.4       ?       ? 
1 1 1    9    8   17 o    966.8    3.3    0.0000   0.0000          ?        ?  9347.9570  64.4907          ?        ?      966.8        3.3       ?       ? 
1 1 1    9    8   18 o    458.8    1.9    0.0000   0.0000          ?        ?  2104.5674  17.2401          ?        ?      458.8        1.9       ?       ? 
1 1 1    9    8   19 o    975.6    3.4    0.0000   0.0000          ?        ?  9519.0811  65.7677          ?        ?      975.6        3.4       ?       ? 
1 1 1    9    8   20 o   1183.4    4.0    0.0000   0.0000          ?        ? 14005.3330  94.5012          ?        ?     1183.4        4.0       ?       ? 
1 1 1    9    8   21 o    887.8    3.1    0.0000   0.0000          ?        ?  7881.9111  55.5514          ?        ?      887.8        3.1       ?       ? 
1 1 1    9    8   22 o   1018.3    3.5    0.0000   0.0000          ?        ? 10370.8682  71.5144          ?        ?     1018.3        3.5       ?       ? 
1 1 1    9    8   23 o    160.8    2.4    0.0000   0.0000          ?        ?   258.6013   7.6623          ?        ?      160.8        2.4       ?       ? 
1 1 1    9    8   24 o    755.5    2.8    0.0000   0.0000          ?        ?  5708.3833  42.1424          ?        ?      755.5        2.8       ?       ? 
1 1 1    9    8   25 o   1306.3    4.4    0.0000   0.0000          ?        ? 17066.4062 114.2954          ?        ?     1306.3        4.4       ?       ? 
1 1 1    9    8   26 o    239.1    2.3    0.0000   0.0000          ?        ?   571.4769  10.8549          ?        ?      239.1        2.3       ?       ? 
1 1 1    9    8   27 o    839.3    3.1    0.0000   0.0000          ?        ?  7044.8096  51.7203          ?        ?      839.3        3.1       ?       ? 
1 1 1    9    8   28 o    798.7    3.2    0.0000   0.0000          ?        ?  6379.4692  51.0817          ?        ?      798.7        3.2       ?       ? 
1 1 1    9    8   29 o    870.5    3.3    0.0000   0.0000          ?        ?  7577.3359  56.8284          ?        ?      870.5        3.3       ?       ? 
1 1 1    9    8   30 o    689.4    2.8    0.0000   0.0000          ?        ?  4753.1553  38.3113          ?        ?      689.4        2.8       ?       ? 
1 1 1    9    8   31 o    736.9    3.2    0.0000   0.0000          ?        ?  5429.9883  47.2506          ?        ?      736.9        3.2       ?       ? 
1 1 1    9    8   32 o    544.1    2.5    0.0000   0.0000          ?        ?  2960.8250  26.8179          ?        ?      544.1        2.5       ?       ? 
1 1 1    9    8   33 o    912.3    3.5    0.0000   0.0000          ?        ?  8322.4912  63.2136          ?        ?      912.3        3.5       ?       ? 
1 1 1    9    8   34 o   1814.0    5.9    0.0000   0.0000          ?        ? 32911.3203 215.1818          ?        ?     1814.0        5.9       ?       ? 
1 1 1    9    8   35 o    724.9    3.2    0.0000   0.0000          ?        ?  5255.6714  45.9736          ?        ?      724.9        3.2       ?       ? 
1 1 1    9    8   36 o    896.0    3.2    0.0000   0.0000          ?        ?  8028.7710  58.1055          ?        ?      896.0        3.2       ?       ? 
1 1 1    9    8   37 o    366.8    2.5    0.0000   0.0000          ?        ?  1345.3650  18.5171          ?        ?      366.8        2.5       ?       ? 
1 1 1    9    8   38 o    847.0    3.1    0.0000   0.0000          ?        ?  7173.7905  52.9973          ?        ?      847.0        3.1       ?       ? 
1 1 1    9    8   39 o    593.2    2.6    0.0000   0.0000          ?        ?  3518.8926  30.6490          ?        ?      593.2        2.6       ?       ? 
1 1 1    9    8   40 o    191.8    5.0    0.0000   0.0000          ?        ?   367.7885  19.1556          ?        ?      191.8        5.0       ?       ? 
1 1 1    9    8   41 o   1476.1    5.0    0.0000   0.0000          ?        ? 21791.4668 148.7755          ?        ?     1476.1        5.0       ?       ? 
1 1 1    9    8   42 o   1133.3    4.0    0.0000   0.0000          ?        ? 12845.1396  90.0316          ?        ?     1133.3        4.0       ?       ? 
1 1 1    9    8   43 o    399.6    2.8    0.0000   0.0000          ?        ?  1596.9426  22.3483          ?        ?      399.6        2.8       ?       ? 
1 1 1    9    8   44 f    358.2    2.9    0.0000   0.0000          ?        ?  1283.4285  21.0712          ?        ?      358.2        2.9       ?       ? 
1 1 1    9    8   45 o    261.4    3.5    0.0000   0.0000          ?        ?   683.2181  18.5171          ?        ?      261.4        3.5       ?       ? 
1 1 1    9    8   46 o    175.8    5.1    0.0000   0.0000          ?        ?   309.0445  17.8786          ?        ?      175.8        5.1       ?       ? 
1 1 1    9    8   47 o    478.0    2.8    0.0000   0.0000          ?        ?  2285.2688  26.8179          ?        ?      478.0        2.8       ?       ? 
1 1 1    9    8   48 o    777.3    3.1    0.0000   0.0000          ?        ?  6042.3301  48.5276          ?        ?      777.3        3.1       ?       ? 
1 1 1    9    8   49 o    568.3    2.6    0.0000   0.0000          ?        ?  3229.6423  30.0105          ?        ?      568.3        2.6       ?       ? 
1 1 1    9    8   50 o    621.5    3.1    0.0000   0.0000          ?        ?  3863.6941  38.3113          ?        ?      621.5        3.1       ?       ? 
1 1 1    9    8   51 o    179.5    5.3    0.0000   0.0000          ?        ?   322.4534  19.1556          ?        ?      179.5        5.3       ?       ? 
1 1 1    9    8   52 o    607.8    2.8    0.0000   0.0000          ?        ?  3695.1248  33.8416          ?        ?      607.8        2.8       ?       ? 
1 1 1    9    8   53 o    567.1    2.6    0.0000   0.0000          ?        ?  3216.2334  30.0105          ?        ?      567.1        2.6       ?       ? 
1 1 1    9    8   54 o    311.3    3.2    0.0000   0.0000          ?        ?   969.2759  19.7942          ?        ?      311.3        3.2       ?       ? 
1 1 1    9    8   55 o    339.6    3.1    0.0000   0.0000          ?        ?  1153.8086  21.0712          ?        ?      339.6        3.1       ?       ? 
1 1 1    9    8   56 o     95.8    9.3    0.0000   0.0000          ?        ?    91.9471  17.8786          ?        ?       95.8        9.3       ?       ? 
1 1 1    9    8   57 o    327.8    3.1    0.0000   0.0000          ?        ?  1074.6320  20.4327          ?        ?      327.8        3.1       ?       ? 
1 1 1    9    8   58 o    340.6    3.1    0.0000   0.0000          ?        ?  1160.1937  21.0712          ?        ?      340.6        3.1       ?       ? 
1 1 1    9    8   59 o    512.5    2.7    0.0000   0.0000          ?        ?  2626.8779  28.0950          ?        ?      512.5        2.7       ?       ? 
1 1 1    9    8   60 o    532.0    2.8    0.0000   0.0000          ?        ?  2831.2048  29.3720          ?        ?      532.0        2.8       ?       ? 
1 1 1    9    8   61 o    324.8    3.4    0.0000   0.0000          ?        ?  1055.4763  22.3483          ?        ?      324.8        3.4       ?       ? 
1 1 1    9    8   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    8   63 o    551.5    2.8    0.0000   0.0000          ?        ?  3042.5557  30.6490          ?        ?      551.5        2.8       ?       ? 
1 1 1    9    8   64 o     61.9   15.9    0.0000   0.0000          ?        ?    40.2269  19.7942          ?        ?       61.9       15.9       ?       ? 
1 1 1    9    8   65 o    435.5    2.9    0.0000   0.0000          ?        ?  1897.6864  24.9023          ?        ?      435.5        2.9       ?       ? 
1 1 1    9    8   66 o    119.4    8.0    0.0000   0.0000          ?        ?   143.0288  19.1556          ?        ?      119.4        8.0       ?       ? 
1 1 1    9    8   67 o    350.2    3.3    0.0000   0.0000          ?        ?  1227.2385  22.9868          ?        ?      350.2        3.3       ?       ? 
1 1 1    9    8   68 o    353.0    3.3    0.0000   0.0000          ?        ?  1247.0327  22.9868          ?        ?      353.0        3.3       ?       ? 
1 1 1    9    8   69 o    119.0    8.6    0.0000   0.0000          ?        ?   142.3903  20.4327          ?        ?      119.0        8.6       ?       ? 
1 1 1    9    8   70 o    155.5    6.6    0.0000   0.0000          ?        ?   242.6382  20.4327          ?        ?      155.5        6.6       ?       ? 
1 1 1    9    8   71 o    186.5    5.6    0.0000   0.0000          ?        ?   348.6328  21.0712          ?        ?      186.5        5.6       ?       ? 
1 1 1    9    8   72 o     33.0   15.0    0.0000   0.0000          ?        ?   -12.7704  21.7097          ?        ?       33.0       15.0       ?       ? 
1 1 1    9    8   73 o    128.5    8.2    0.0000   0.0000          ?        ?   166.0156  21.0712          ?        ?      128.5        8.2       ?       ? 
1 1 1    9    8   74 o     20.7   10.5    0.0000   0.0000          ?        ?   -81.0922  22.3483          ?        ?       20.7       10.5       ?       ? 
1 1 1    9    8   75 o    312.4    4.0    0.0000   0.0000          ?        ?   977.5767  24.9023          ?        ?      312.4        4.0       ?       ? 
1 1 1    9    8   76 o    121.7    8.7    0.0000   0.0000          ?        ?   149.4141  21.0712          ?        ?      121.7        8.7       ?       ? 
1 1 1    9    8   77 o     26.6   12.8    0.0000   0.0000          ?        ?   -30.6490  20.4327          ?        ?       26.6       12.8       ?       ? 
1 1 1    9    8   78 o     61.6   17.1    0.0000   0.0000          ?        ?    40.8654  21.7097          ?        ?       61.6       17.1       ?       ? 
1 1 1    9    8   79 o    215.6    4.9    0.0000   0.0000          ?        ?   466.7593  21.0712          ?        ?      215.6        4.9       ?       ? 
1 1 1    9    8   80 o    188.0    5.6    0.0000   0.0000          ?        ?   355.6566  21.0712          ?        ?      188.0        5.6       ?       ? 
1 1 1    9    9    0 o    320.4    3.2 1026.7428  20.4327  1026.7428  20.4327  1026.7428  20.4327      320.4      3.2      320.4        3.2     0.0     0.0 
1 1 1    9    9    1 f    903.5    4.8 8164.7759  87.4775  8164.7759  87.4775  8164.7759  87.4775      903.5      4.8      903.5        4.8     0.0     0.0 
1 1 1    9    9    2 o   1604.7    9.1 25757.9629 291.1659 25757.9629 291.1659 25757.9629 291.1659     1604.7      9.1     1604.7        9.1     0.0     0.0 
1 1 1    9    9    3 o    352.7    2.3 1243.8401  15.9630  1243.8401  15.9630  1243.8401  15.9630      352.7      2.3      352.7        2.3     0.0     0.0 
1 1 1    9    9    4 o   2009.9   10.5 40408.2031 423.9784 40408.2031 423.9784 40408.2031 423.9784     2009.9     10.5     2009.9       10.5     0.0     0.0 
1 1 1    9    9    5 o    142.7    1.8  203.6884   5.1082   203.6884   5.1082   203.6884   5.1082      142.7      1.8      142.7        1.8     0.0     0.0 
1 1 1    9    9    6 o   1273.4    6.5 16218.4492 165.3771 16218.4492 165.3771 16218.4492 165.3771     1273.4      6.5     1273.4        6.5     0.0     0.0 
1 1 1    9    9    7 o    626.0    3.3 3919.2456  40.8654  3919.2456  40.8654  3919.2456  40.8654      626.0      3.3      626.0        3.3     0.0     0.0 
1 1 1    9    9    8 o    382.5    2.6 1463.4916  19.7942  1463.4916  19.7942  1463.4916  19.7942      382.5      2.6      382.5        2.6     0.0     0.0 
1 1 1    9    9    9 o    551.0    2.9 3036.8088  31.9261  3036.8088  31.9261  3036.8088  31.9261      551.0      2.9      551.0        2.9     0.0     0.0 
1 1 1    9    9   10 o    318.9    2.2 1017.1650  14.0475  1017.1650  14.0475  1017.1650  14.0475      318.9      2.2      318.9        2.2     0.0     0.0 
1 1 1    9    9   11 o    844.4    4.2 7130.3706  70.8759  7130.3706  70.8759  7130.3706  70.8759      844.4      4.2      844.4        4.2     0.0     0.0 
1 1 1    9    9   12 o    740.8    3.7 5488.7319  55.5514  5488.7319  55.5514  5488.7319  55.5514      740.8      3.7      740.8        3.7     0.0     0.0 
1 1 1    9    9   13 o    879.5    4.4 7736.3276  77.2611  7736.3276  77.2611  7736.3276  77.2611      879.5      4.4      879.5        4.4     0.0     0.0 
1 1 1    9    9   14 o    120.3    3.2  144.9444   7.6623   144.9444   7.6623   144.9444   7.6623      120.3      3.2      120.3        3.2     0.0     0.0 
1 1 1    9    9   15 o    251.6    2.2  633.4135  10.8549   633.4135  10.8549   633.4135  10.8549      251.6      2.2      251.6        2.2     0.0     0.0 
1 1 1    9    9   16 o    753.3    3.8 5675.1802  56.8284  5675.1802  56.8284  5675.1802  56.8284      753.3      3.8      753.3        3.8     0.0     0.0 
1 1 1    9    9   17 o    857.6    4.4 7355.1309  74.7070  7355.1309  74.7070  7355.1309  74.7070      857.6      4.4      857.6        4.4     0.0     0.0 
1 1 1    9    9   18 o   1526.2    7.2 23297.1016 218.3744 23297.1016 218.3744 23297.1016 218.3744     1526.2      7.2     1526.2        7.2     0.0     0.0 
1 1 1    9    9   19 o    776.3    3.9 6026.3672  61.2981  6026.3672  61.2981  6026.3672  61.2981      776.3      3.9      776.3        3.9     0.0     0.0 
1 1 1    9    9   20 o   1569.8    7.3 24648.8516 229.2293 24648.8516 229.2293 24648.8516 229.2293     1569.8      7.3     1569.8        7.3     0.0     0.0 
1 1 1    9    9   21 o   1048.6    5.1 10997.2578 107.9102 10997.2578 107.9102 10997.2578 107.9102     1048.6      5.1     1048.6        5.1     0.0     0.0 
1 1 1    9    9   22 o    431.0    2.7 1858.0979  23.6253  1858.0979  23.6253  1858.0979  23.6253      431.0      2.7      431.0        2.7     0.0     0.0 
1 1 1    9    9   23 o    466.2    2.9 2173.5276  26.8179  2173.5276  26.8179  2173.5276  26.8179      466.2      2.9      466.2        2.9     0.0     0.0 
1 1 1    9    9   24 o    497.8    3.1 2478.7410  31.2876  2478.7410  31.2876  2478.7410  31.2876      497.8      3.1      497.8        3.1     0.0     0.0 
1 1 1    9    9   25 o    602.2    3.3 3627.4412  40.2269  3627.4412  40.2269  3627.4412  40.2269      602.2      3.3      602.2        3.3     0.0     0.0 
1 1 1    9    9   26 o   1646.0    8.0 27096.3047 261.7939 27096.3047 261.7939 27096.3047 261.7939     1646.0      8.0     1646.0        8.0     0.0     0.0 
1 1 1    9    9   27 o    536.3    3.8 2876.5400  40.8654  2876.5400  40.8654  2876.5400  40.8654      536.3      3.8      536.3        3.8     0.0     0.0 
1 1 1    9    9   28 o   2082.2   10.0 43363.2812 415.6776 43363.2812 415.6776 43363.2812 415.6776     2082.2     10.0     2082.2       10.0     0.0     0.0 
1 1 1    9    9   29 o   1306.9    6.5 17081.0918 171.1238 17081.0918 171.1238 17081.0918 171.1238     1306.9      6.5     1306.9        6.5     0.0     0.0 
1 1 1    9    9   30 o   1246.3    6.6 15533.9541 165.3771 15533.9541 165.3771 15533.9541 165.3771     1246.3      6.6     1246.3        6.6     0.0     0.0 
1 1 1    9    9   31 o   1590.3    7.7 25293.7578 245.8308 25293.7578 245.8308 25293.7578 245.8308     1590.3      7.7     1590.3        7.7     0.0     0.0 
1 1 1    9    9   32 o   1071.3    5.5 11479.3418 118.7650 11479.3418 118.7650 11479.3418 118.7650     1071.3      5.5     1071.3        5.5     0.0     0.0 
1 1 1    9    9   33 o   1083.9    5.5 11749.4365 120.0421 11749.4365 120.0421 11749.4365 120.0421     1083.9      5.5     1083.9        5.5     0.0     0.0 
1 1 1    9    9   34 o    247.8    5.0  614.8964  24.9023   614.8964  24.9023   614.8964  24.9023      247.8      5.0      247.8        5.0     0.0     0.0 
1 1 1    9    9   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    9   36 o    738.2    4.2 5450.4204  62.5751  5450.4204  62.5751  5450.4204  62.5751      738.2      4.2      738.2        4.2     0.0     0.0 
1 1 1    9    9   37 o    441.2    3.5 1946.8524  30.6490  1946.8524  30.6490  1946.8524  30.6490      441.2      3.5      441.2        3.5     0.0     0.0 
1 1 1    9    9   38 o    339.8    3.9 1155.0856  26.8179  1155.0856  26.8179  1155.0856  26.8179      339.8      3.9      339.8        3.9     0.0     0.0 
1 1 1    9    9   39 f     17.3   12.8  -78.5382  29.3720   -78.5382  29.3720   -78.5382  29.3720       17.3     12.8       17.3       12.8     0.0     0.0 
1 1 1    9    9   40 o    948.0    5.3 8987.8301 100.8864  8987.8301 100.8864  8987.8301 100.8864      948.0      5.3      948.0        5.3     0.0     0.0 
1 1 1    9    9   41 o    999.5    5.1 9992.2246 101.5249  9992.2246 101.5249  9992.2246 101.5249      999.5      5.1      999.5        5.1     0.0     0.0 
1 1 1    9    9   42 o   1031.8    5.2 10648.6250 107.9102 10648.6250 107.9102 10648.6250 107.9102     1031.8      5.2     1031.8        5.2     0.0     0.0 
1 1 1    9    9   43 o   1674.4    7.9 28041.9551 264.3480 28041.9551 264.3480 28041.9551 264.3480     1674.4      7.9     1674.4        7.9     0.0     0.0 
1 1 1    9    9   44 o    267.4    5.0  715.7827  26.8179   715.7827  26.8179   715.7827  26.8179      267.4      5.0      267.4        5.0     0.0     0.0 
1 1 1    9    9   45 o   1203.5    5.8 14488.0557 140.4748 14488.0557 140.4748 14488.0557 140.4748     1203.5      5.8     1203.5        5.8     0.0     0.0 
1 1 1    9    9   46 o    720.3    4.1 5189.9038  58.7440  5189.9038  58.7440  5189.9038  58.7440      720.3      4.1      720.3        4.1     0.0     0.0 
1 1 1    9    9   47 o    511.1    3.9 2612.8306  39.5883  2612.8306  39.5883  2612.8306  39.5883      511.1      3.9      511.1        3.9     0.0     0.0 
1 1 1    9    9   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    9   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    9   50 o   1116.7    5.7 12473.5195 126.4273 12473.5195 126.4273 12473.5195 126.4273     1116.7      5.7     1116.7        5.7     0.0     0.0 
1 1 1    9    9   51 o    446.3    4.1 1992.1875  36.3957  1992.1875  36.3957  1992.1875  36.3957      446.3      4.1      446.3        4.1     0.0     0.0 
1 1 1    9    9   52 o    119.5   11.4  146.8600  26.8179   146.8600  26.8179   146.8600  26.8179      119.5     11.4      119.5       11.4     0.0     0.0 
1 1 1    9    9   53 o     89.4   16.6   87.4775  26.8179    87.4775  26.8179    87.4775  26.8179       89.4     16.6       89.4       16.6     0.0     0.0 
1 1 1    9    9   54 o     15.2   11.4  -83.0078  26.1794   -83.0078  26.1794   -83.0078  26.1794       15.2     11.4       15.2       11.4     0.0     0.0 
1 1 1    9    9   55 o     14.6   10.9  -77.8996  24.2638   -77.8996  24.2638   -77.8996  24.2638       14.6     10.9       14.6       10.9     0.0     0.0 
1 1 1    9    9   56 o    118.3   10.7  143.6674  24.9023   143.6674  24.9023   143.6674  24.9023      118.3     10.7      118.3       10.7     0.0     0.0 
1 1 1    9    9   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    9   58 o    422.9    3.9 1789.1377  33.2031  1789.1377  33.2031  1789.1377  33.2031      422.9      3.9      422.9        3.9     0.0     0.0 
1 1 1    9    9   59 o     33.9   20.9   10.2163  26.8179    10.2163  26.8179    10.2163  26.8179       33.9     20.9       33.9       20.9     0.0     0.0 
1 1 1    9    9   60 o    241.8    6.2  586.1629  30.0105   586.1629  30.0105   586.1629  30.0105      241.8      6.2      241.8        6.2     0.0     0.0 
1 1 1    9    9   61 o    122.4   10.3  153.2452  24.9023   153.2452  24.9023   153.2452  24.9023      122.4     10.3      122.4       10.3     0.0     0.0 
1 1 1    9    9   62 o    238.3    6.3  569.5613  30.0105   569.5613  30.0105   569.5613  30.0105      238.3      6.3      238.3        6.3     0.0     0.0 
1 1 1    9    9   63 o    111.5   12.0  128.9814  26.1794   128.9814  26.1794   128.9814  26.1794      111.5     12.0      111.5       12.0     0.0     0.0 
1 1 1    9    9   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    9   65 o    143.1    9.7  208.1580  27.4564   208.1580  27.4564   208.1580  27.4564      143.1      9.7      143.1        9.7     0.0     0.0 
1 1 1    9    9   66 o    299.8    5.4  900.3155  32.5646   900.3155  32.5646   900.3155  32.5646      299.8      5.4      299.8        5.4     0.0     0.0 
1 1 1    9    9   67 o    221.4    6.6  492.3002  29.3720   492.3002  29.3720   492.3002  29.3720      221.4      6.6      221.4        6.6     0.0     0.0 
1 1 1    9    9   68 o    579.8    4.1 3364.3706  47.2506  3364.3706  47.2506  3364.3706  47.2506      579.8      4.1      579.8        4.1     0.0     0.0 
1 1 1    9    9   69 o    576.1    3.9 3320.9509  44.6965  3320.9509  44.6965  3320.9509  44.6965      576.1      3.9      576.1        3.9     0.0     0.0 
1 1 1    9    9   70 o     16.7   12.4  -85.5619  29.3720   -85.5619  29.3720   -85.5619  29.3720       16.7     12.4       16.7       12.4     0.0     0.0 
1 1 1    9    9   71 o    399.2    4.5 1595.6655  35.7572  1595.6655  35.7572  1595.6655  35.7572      399.2      4.5      399.2        4.5     0.0     0.0 
1 1 1    9    9   72 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1    9    9   73 o    461.9    4.3 2135.8547  39.5883  2135.8547  39.5883  2135.8547  39.5883      461.9      4.3      461.9        4.3     0.0     0.0 
1 1 1    9    9   74 o     65.4   25.6   60.0210  31.9261    60.0210  31.9261    60.0210  31.9261       65.4     25.6       65.4       25.6     0.0     0.0 
1 1 1    9    9   75 o     94.6   15.1   95.7782  26.8179    95.7782  26.8179    95.7782  26.8179       94.6     15.1       94.6       15.1     0.0     0.0 
1 1 1    9    9   76 o    171.4    9.0  297.5511  30.6490   297.5511  30.6490   297.5511  30.6490      171.4      9.0      171.4        9.0     0.0     0.0 
1 1 1    9    9   77 o    118.5   12.9  146.8600  30.0105   146.8600  30.0105   146.8600  30.0105      118.5     12.9      118.5       12.9     0.0     0.0 
1 1 1    9    9   78 o    195.8    7.2  386.3056  28.0950   386.3056  28.0950   386.3056  28.0950      195.8      7.2      195.8        7.2     0.0     0.0 
1 1 1    9    9   79 o     30.0   19.9   -3.1926  30.0105    -3.1926  30.0105    -3.1926  30.0105       30.0     19.9       30.0       19.9     0.0     0.0 
1 1 1    9    9   80 o    108.9   15.4  125.1502  32.5646   125.1502  32.5646   125.1502  32.5646      108.9     15.4      108.9       15.4     0.0     0.0 
1 1 1   10    0    0 o     75.9    3.8   58.1055   5.7467    58.1055   5.7467    58.1055   5.7467       75.9      3.8       75.9        3.8     0.0     0.0 
1 1 1   10    0    1 f    750.9    3.7 5639.4229  54.9129  5639.4229  54.9129  5639.4229  54.9129      750.9      3.7      750.9        3.7     0.0     0.0 
1 1 1   10    0    2 o   1228.6    5.7 15097.2051 141.1133 15097.2051 141.1133 15097.2051 141.1133     1228.6      5.7     1228.6        5.7     0.0     0.0 
1 1 1   10    0    3 o    303.9    1.9  923.9408  11.4934   923.9408  11.4934   923.9408  11.4934      303.9      1.9      303.9        1.9     0.0     0.0 
1 1 1   10    0    4 o    722.3    3.6 5217.9990  51.7203  5217.9990  51.7203  5217.9990  51.7203      722.3      3.6      722.3        3.6     0.0     0.0 
1 1 1   10    0    5 o    248.1    1.8  615.5349   8.9393   615.5349   8.9393   615.5349   8.9393      248.1      1.8      248.1        1.8     0.0     0.0 
1 1 1   10    0    6 o    556.6    2.9 3098.1069  31.9261  3098.1069  31.9261  3098.1069  31.9261      556.6      2.9      556.6        2.9     0.0     0.0 
1 1 1   10    0    7 o    519.7    2.8 2700.9465  28.7335  2700.9465  28.7335  2700.9465  28.7335      519.7      2.8      519.7        2.8     0.0     0.0 
1 1 1   10    0    8 o    133.2    1.9  177.5090   5.1082   177.5090   5.1082   177.5090   5.1082      133.2      1.9      133.2        1.9     0.0     0.0 
1 1 1   10    0    9 f    716.0    3.6 5127.3286  51.7203  5127.3286  51.7203  5127.3286  51.7203      716.0      3.6      716.0        3.6     0.0     0.0 
1 1 1   10    0   10 o   1651.8    7.5 27289.1367 249.0234 27289.1367 249.0234 27289.1367 249.0234     1651.8      7.5     1651.8        7.5     0.0     0.0 
1 1 1   10    0   11 o   1657.4    7.6 27474.9473 252.2160 27474.9473 252.2160 27474.9473 252.2160     1657.4      7.6     1657.4        7.6     0.0     0.0 
1 1 1   10    0   12 o    531.9    2.8 2829.2893  30.0105  2829.2893  30.0105  2829.2893  30.0105      531.9      2.8      531.9        2.8     0.0     0.0 
1 1 1   10    0   13 o    976.2    4.7 9529.9355  92.5856  9529.9355  92.5856  9529.9355  92.5856      976.2      4.7      976.2        4.7     0.0     0.0 
1 1 1   10    0   14 o    952.5    4.8 9073.3926  90.6701  9073.3926  90.6701  9073.3926  90.6701      952.5      4.8      952.5        4.8     0.0     0.0 
1 1 1   10    0   15 f   1243.0    5.8 15452.8623 144.9444 15452.8623 144.9444 15452.8623 144.9444     1243.0      5.8     1243.0        5.8     0.0     0.0 
1 1 1   10    0   16 o    590.0    3.1 3481.8584  36.3957  3481.8584  36.3957  3481.8584  36.3957      590.0      3.1      590.0        3.1     0.0     0.0 
1 1 1   10    0   17 o   1202.9    5.7 14472.0928 136.0051 14472.0928 136.0051 14472.0928 136.0051     1202.9      5.7     1202.9        5.7     0.0     0.0 
1 1 1   10    0   18 o   1007.0    4.9 10141.6396  98.3323 10141.6396  98.3323 10141.6396  98.3323     1007.0      4.9     1007.0        4.9     0.0     0.0 
1 1 1   10    0   19 o    307.0    2.7  942.4579  16.6016   942.4579  16.6016   942.4579  16.6016      307.0      2.7      307.0        2.7     0.0     0.0 
1 1 1   10    0   20 o    150.5    3.0  226.6752   8.9393   226.6752   8.9393   226.6752   8.9393      150.5      3.0      150.5        3.0     0.0     0.0 
1 1 1   10    0   21 o    631.8    3.5 3992.0374  44.6965  3992.0374  44.6965  3992.0374  44.6965      631.8      3.5      631.8        3.5     0.0     0.0 
1 1 1   10    0   22 o   1785.3    8.2 31878.8320 293.7199 31878.8320 293.7199 31878.8320 293.7199     1785.3      8.2     1785.3        8.2     0.0     0.0 
1 1 1   10    0   23 o    176.1    2.9  310.3215  10.2163   310.3215  10.2163   310.3215  10.2163      176.1      2.9      176.1        2.9     0.0     0.0 
1 1 1   10    0   24 o    768.4    3.9 5905.6865  60.0210  5905.6865  60.0210  5905.6865  60.0210      768.4      3.9      768.4        3.9     0.0     0.0 
1 1 1   10    0   25 o   1446.2    6.8 20919.8848 196.0261 20919.8848 196.0261 20919.8848 196.0261     1446.2      6.8     1446.2        6.8     0.0     0.0 
1 1 1   10    0   26 o    840.9    4.2 7072.2651  70.8759  7072.2651  70.8759  7072.2651  70.8759      840.9      4.2      840.9        4.2     0.0     0.0 
1 1 1   10    0   27 o   1446.1    6.8 20916.6914 197.9417 20916.6914 197.9417 20916.6914 197.9417     1446.1      6.8     1446.1        6.8     0.0     0.0 
1 1 1   10    0   28 o    571.7    3.2 3269.2307  37.0343  3269.2307  37.0343  3269.2307  37.0343      571.7      3.2      571.7        3.2     0.0     0.0 
1 1 1   10    0   29 o   1077.1    5.3 11602.5762 114.2954 11602.5762 114.2954 11602.5762 114.2954     1077.1      5.3     1077.1        5.3     0.0     0.0 
1 1 1   10    0   30 o    705.1    4.3 4972.8062  60.0210  4972.8062  60.0210  4972.8062  60.0210      705.1      4.3      705.1        4.3     0.0     0.0 
1 1 1   10    0   31 o   1560.2    7.6 24346.1914 236.8915 24346.1914 236.8915 24346.1914 236.8915     1560.2      7.6     1560.2        7.6     0.0     0.0 
1 1 1   10    0   32 o   1142.3    6.0 13050.7441 137.9207 13050.7441 137.9207 13050.7441 137.9207     1142.3      6.0     1142.3        6.0     0.0     0.0 
1 1 1   10    0   33 o    875.5    5.0 7665.4521  86.8389  7665.4521  86.8389  7665.4521  86.8389      875.5      5.0      875.5        5.0     0.0     0.0 
1 1 1   10    0   34 o    217.6    5.6  474.4216  24.2638   474.4216  24.2638   474.4216  24.2638      217.6      5.6      217.6        5.6     0.0     0.0 
1 1 1   10    0   35 o   1682.2    8.2 28302.4707 275.2028 28302.4707 275.2028 28302.4707 275.2028     1682.2      8.2     1682.2        8.2     0.0     0.0 
1 1 1   10    0   36 o     25.5   18.9 -183.2557  65.7677  -183.2557  65.7677  -183.2557  65.7677       25.5     18.9       25.5       18.9     0.0     0.0 
1 1 1   10    0   37 o    783.5    4.4 6138.7471  68.9603  6138.7471  68.9603  6138.7471  68.9603      783.5      4.4      783.5        4.4     0.0     0.0 
1 1 1   10    0   38 o    655.3    3.8 4295.3350  49.8047  4295.3350  49.8047  4295.3350  49.8047      655.3      3.8      655.3        3.8     0.0     0.0 
1 1 1   10    0   39 f   1381.4    6.5 19084.7715 178.7861 19084.7715 178.7861 19084.7715 178.7861     1381.4      6.5     1381.4        6.5     0.0     0.0 
1 1 1   10    0   40 o    655.3    3.8 4295.3350  49.8047  4295.3350  49.8047  4295.3350  49.8047      655.3      3.8      655.3        3.8     0.0     0.0 
1 1 1   10    0   41 o    347.4    4.2 1207.4445  29.3720  1207.4445  29.3720  1207.4445  29.3720      347.4      4.2      347.4        4.2     0.0     0.0 
1 1 1   10    0   42 o    973.7    5.4 9483.3232 104.7175  9483.3232 104.7175  9483.3232 104.7175      973.7      5.4      973.7        5.4     0.0     0.0 
1 1 1   10    0   43 o   1360.0    6.8 18500.5254 184.5327 18500.5254 184.5327 18500.5254 184.5327     1360.0      6.8     1360.0        6.8     0.0     0.0 
1 1 1   10    0   44 o    154.2    9.8  240.7227  30.0105   240.7227  30.0105   240.7227  30.0105      154.2      9.8      154.2        9.8     0.0     0.0 
1 1 1   10    0   45 o     18.8   13.7  -47.8891  26.1794   -47.8891  26.1794   -47.8891  26.1794       18.8     13.7       18.8       13.7     0.0     0.0 
1 1 1   10    0   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    0   47 o     25.4   17.1   -8.9393  24.2638    -8.9393  24.2638    -8.9393  24.2638       25.4     17.1       25.4       17.1     0.0     0.0 
1 1 1   10    0   48 o    247.3    6.6  612.9808  32.5646   612.9808  32.5646   612.9808  32.5646      247.3      6.6      247.3        6.6     0.0     0.0 
1 1 1   10    0   49 o    601.2    4.4 3615.3096  52.3588  3615.3096  52.3588  3615.3096  52.3588      601.2      4.4      601.2        4.4     0.0     0.0 
1 1 1   10    0   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    0   51 o    356.4    4.6 1270.6581  32.5646  1270.6581  32.5646  1270.6581  32.5646      356.4      4.6      356.4        4.6     0.0     0.0 
1 1 1   10    0   52 o    567.8    3.7 3224.5342  41.5039  3224.5342  41.5039  3224.5342  41.5039      567.8      3.7      567.8        3.7     0.0     0.0 
1 1 1   10    0   53 o    379.5    4.4 1441.1433  33.2031  1441.1433  33.2031  1441.1433  33.2031      379.5      4.4      379.5        4.4     0.0     0.0 
1 1 1   10    0   54 o    342.7    4.3 1174.8798  29.3720  1174.8798  29.3720  1174.8798  29.3720      342.7      4.3      342.7        4.3     0.0     0.0 
1 1 1   10    0   55 o    727.6    4.4 5295.2598  64.4907  5295.2598  64.4907  5295.2598  64.4907      727.6      4.4      727.6        4.4     0.0     0.0 
1 1 1   10    0   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    0   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    0   58 o    122.6   11.4  154.5222  27.4564   154.5222  27.4564   154.5222  27.4564      122.6     11.4      122.6       11.4     0.0     0.0 
1 1 1   10    0   59 o    311.7    4.9  972.4684  30.6490   972.4684  30.6490   972.4684  30.6490      311.7      4.9      311.7        4.9     0.0     0.0 
1 1 1   10    0   60 f     88.1   18.5   87.4775  28.7335    87.4775  28.7335    87.4775  28.7335       88.1     18.5       88.1       18.5     0.0     0.0 
1 1 1   10    0   61 o    371.0    4.4 1377.2911  32.5646  1377.2911  32.5646  1377.2911  32.5646      371.0      4.4      371.0        4.4     0.0     0.0 
1 1 1   10    0   62 o    460.0    4.0 2117.3376  36.3957  2117.3376  36.3957  2117.3376  36.3957      460.0      4.0      460.0        4.0     0.0     0.0 
1 1 1   10    0   63 o     93.3   16.0   93.8627  27.4564    93.8627  27.4564    93.8627  27.4564       93.3     16.0       93.3       16.0     0.0     0.0 
1 1 1   10    0   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    0   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    0   66 o    823.1    4.6 6779.8228  75.9841  6779.8228  75.9841  6779.8228  75.9841      823.1      4.6      823.1        4.6     0.0     0.0 
1 1 1   10    0   67 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    0   68 o    185.0    7.8  344.8017  28.7335   344.8017  28.7335   344.8017  28.7335      185.0      7.8      185.0        7.8     0.0     0.0 
1 1 1   10    0   69 o    132.8   11.2  180.7016  29.3720   180.7016  29.3720   180.7016  29.3720      132.8     11.2      132.8       11.2     0.0     0.0 
1 1 1   10    0   70 o    188.3    7.7  356.9336  28.7335   356.9336  28.7335   356.9336  28.7335      188.3      7.7      188.3        7.7     0.0     0.0 
1 1 1   10    0   71 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    0   72 o    647.2    4.0 4191.8945  52.3588  4191.8945  52.3588  4191.8945  52.3588      647.2      4.0      647.2        4.0     0.0     0.0 
1 1 1   10    0   73 o    229.1    7.1  527.4188  32.5646   527.4188  32.5646   527.4188  32.5646      229.1      7.1      229.1        7.1     0.0     0.0 
1 1 1   10    0   74 o    159.4   10.5  258.6013  33.2031   258.6013  33.2031   258.6013  33.2031      159.4     10.5      159.4       10.5     0.0     0.0 
1 1 1   10    0   75 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    0   76 o    276.6    6.1  767.5030  33.8416   767.5030  33.8416   767.5030  33.8416      276.6      6.1      276.6        6.1     0.0     0.0 
1 1 1   10    0   77 o     26.9   18.4  -15.3245  30.0105   -15.3245  30.0105   -15.3245  30.0105       26.9     18.4       26.9       18.4     0.0     0.0 
1 1 1   10    0   78 o    151.4   11.3  234.9760  33.8416   234.9760  33.8416   234.9760  33.8416      151.4     11.3      151.4       11.3     0.0     0.0 
1 1 1   10    0   79 o    323.6    4.8 1049.7295  31.2876  1049.7295  31.2876  1049.7295  31.2876      323.6      4.8      323.6        4.8     0.0     0.0 
1 1 1   10    0   80 o    182.2    8.8  336.5009  31.9261   336.5009  31.9261   336.5009  31.9261      182.2      8.8      182.2        8.8     0.0     0.0 
1 1 1   10    0   81 o     17.8   13.1  -61.2981  27.4564   -61.2981  27.4564   -61.2981  27.4564       17.8     13.1       17.8       13.1     0.0     0.0 
1 1 1   10    1    0 o   1832.8    8.8 33597.0938 321.8149 33597.0938 321.8149 33597.0938 321.8149     1832.8      8.8     1832.8        8.8     0.0     0.0 
1 1 1   10    1    1 o   1518.2    5.0    0.0000   0.0000          ?        ? 23049.9922 150.6911          ?        ?     1518.2        5.0       ?       ? 
1 1 1   10    1    2 o   1285.5    4.2    0.0000   0.0000          ?        ? 16526.2168 108.5487          ?        ?     1285.5        4.2       ?       ? 
1 1 1   10    1    3 o    253.1    1.3    0.0000   0.0000          ?        ?   640.4372   6.3852          ?        ?      253.1        1.3       ?       ? 
1 1 1   10    1    4 o   2169.5    7.4    0.0000   0.0000          ?        ? 47073.7305 321.8149          ?        ?     2169.5        7.4       ?       ? 
1 1 1   10    1    5 o    599.7    2.1    0.0000   0.0000          ?        ?  3596.1538  25.5409          ?        ?      599.7        2.1       ?       ? 
1 1 1   10    1    6 o    671.0    2.4    0.0000   0.0000          ?        ?  4502.2158  31.9261          ?        ?      671.0        2.4       ?       ? 
1 1 1   10    1    7 o    882.0    3.0    0.0000   0.0000          ?        ?  7779.7476  52.9973          ?        ?      882.0        3.0       ?       ? 
1 1 1   10    1    8 o   1834.2    5.9    0.0000   0.0000          ?        ? 33645.6172 217.0974          ?        ?     1834.2        5.9       ?       ? 
1 1 1   10    1    9 o    969.7    3.3    0.0000   0.0000          ?        ?  9403.5078  63.2136          ?        ?      969.7        3.3       ?       ? 
1 1 1   10    1   10 o   2748.9    9.1    0.0000   0.0000          ?        ? 75581.1719 501.2395          ?        ?     2748.9        9.1       ?       ? 
1 1 1   10    1   11 o   1111.0    3.8    0.0000   0.0000          ?        ? 12343.8994  84.2849          ?        ?     1111.0        3.8       ?       ? 
1 1 1   10    1   12 o   1230.7    4.2    0.0000   0.0000          ?        ? 15147.0098 103.4405          ?        ?     1230.7        4.2       ?       ? 
1 1 1   10    1   13 o   1509.8    5.0    0.0000   0.0000          ?        ? 22796.4980 151.3296          ?        ?     1509.8        5.0       ?       ? 
1 1 1   10    1   14 o   1745.3    5.7    0.0000   0.0000          ?        ? 30463.2285 197.9417          ?        ?     1745.3        5.7       ?       ? 
1 1 1   10    1   15 o    358.2    1.6    0.0000   0.0000          ?        ?  1283.4285  11.4934          ?        ?      358.2        1.6       ?       ? 
1 1 1   10    1   16 o   1024.6    3.5    0.0000   0.0000          ?        ? 10498.5723  72.1529          ?        ?     1024.6        3.5       ?       ? 
1 1 1   10    1   17 o    591.9    2.2    0.0000   0.0000          ?        ?  3502.9294  26.1794          ?        ?      591.9        2.2       ?       ? 
1 1 1   10    1   18 o    632.0    2.3    0.0000   0.0000          ?        ?  3994.5911  29.3720          ?        ?      632.0        2.3       ?       ? 
1 1 1   10    1   19 o    198.2    1.6    0.0000   0.0000          ?        ?   392.6908   6.3852          ?        ?      198.2        1.6       ?       ? 
1 1 1   10    1   20 o    680.6    2.5    0.0000   0.0000          ?        ?  4632.4746  33.8416          ?        ?      680.6        2.5       ?       ? 
1 1 1   10    1   21 o   1046.1    3.6    0.0000   0.0000          ?        ? 10944.2607  74.7070          ?        ?     1046.1        3.6       ?       ? 
1 1 1   10    1   22 o    852.6    3.0    0.0000   0.0000          ?        ?  7270.2070  51.0817          ?        ?      852.6        3.0       ?       ? 
1 1 1   10    1   23 o    600.4    2.4    0.0000   0.0000          ?        ?  3605.0930  28.7335          ?        ?      600.4        2.4       ?       ? 
1 1 1   10    1   24 o    588.3    2.3    0.0000   0.0000          ?        ?  3460.7871  27.4564          ?        ?      588.3        2.3       ?       ? 
1 1 1   10    1   25 o   1287.7    4.4    0.0000   0.0000          ?        ? 16583.6836 114.2954          ?        ?     1287.7        4.4       ?       ? 
1 1 1   10    1   26 o   1668.3    5.6    0.0000   0.0000          ?        ? 27835.0723 187.0868          ?        ?     1668.3        5.6       ?       ? 
1 1 1   10    1   27 o   1257.9    4.2    0.0000   0.0000          ?        ? 15825.1191 106.6331          ?        ?     1257.9        4.2       ?       ? 
1 1 1   10    1   28 o    877.1    3.2    0.0000   0.0000          ?        ?  7694.1855  55.5514          ?        ?      877.1        3.2       ?       ? 
1 1 1   10    1   29 o    514.5    2.3    0.0000   0.0000          ?        ?  2647.3108  23.6253          ?        ?      514.5        2.3       ?       ? 
1 1 1   10    1   30 f   1378.6    4.7    0.0000   0.0000          ?        ? 19007.5117 129.6199          ?        ?     1378.6        4.7       ?       ? 
1 1 1   10    1   31 o   1592.3    5.5    0.0000   0.0000          ?        ? 25355.6934 174.9549          ?        ?     1592.3        5.5       ?       ? 
1 1 1   10    1   32 o   1862.6    7.2    0.0000   0.0000          ?        ? 34697.2656 268.8176          ?        ?     1862.6        7.2       ?       ? 
1 1 1   10    1   33 o   1182.0    4.3    0.0000   0.0000          ?        ? 13972.1299 102.1635          ?        ?     1182.0        4.3       ?       ? 
1 1 1   10    1   34 o    682.0    2.8    0.0000   0.0000          ?        ?  4650.9917  37.6728          ?        ?      682.0        2.8       ?       ? 
1 1 1   10    1   35 o    313.8    2.6    0.0000   0.0000          ?        ?   984.6003  16.6016          ?        ?      313.8        2.6       ?       ? 
1 1 1   10    1   36 o    799.0    3.0    0.0000   0.0000          ?        ?  6383.9390  47.2506          ?        ?      799.0        3.0       ?       ? 
1 1 1   10    1   37 o   1014.5    3.6    0.0000   0.0000          ?        ? 10292.3301  73.4300          ?        ?     1014.5        3.6       ?       ? 
1 1 1   10    1   38 f    977.5    3.5    0.0000   0.0000          ?        ?  9554.8379  68.9603          ?        ?      977.5        3.5       ?       ? 
1 1 1   10    1   39 o   1848.3    6.0    0.0000   0.0000          ?        ? 34168.5703 221.5670          ?        ?     1848.3        6.0       ?       ? 
1 1 1   10    1   40 o    446.0    2.6    0.0000   0.0000          ?        ?  1988.9949  22.9868          ?        ?      446.0        2.6       ?       ? 
1 1 1   10    1   41 o    459.7    2.7    0.0000   0.0000          ?        ?  2113.5066  24.9023          ?        ?      459.7        2.7       ?       ? 
1 1 1   10    1   42 o    322.0    3.7    0.0000   0.0000          ?        ?  1036.9591  23.6253          ?        ?      322.0        3.7       ?       ? 
1 1 1   10    1   43 o   1607.5    5.4    0.0000   0.0000          ?        ? 25845.4395 174.3164          ?        ?     1607.5        5.4       ?       ? 
1 1 1   10    1   44 o    627.9    2.8    0.0000   0.0000          ?        ?  3942.8711  35.1187          ?        ?      627.9        2.8       ?       ? 
1 1 1   10    1   45 o    513.6    2.8    0.0000   0.0000          ?        ?  2638.3713  28.7335          ?        ?      513.6        2.8       ?       ? 
1 1 1   10    1   46 o    403.3    3.1    0.0000   0.0000          ?        ?  1626.9531  24.9023          ?        ?      403.3        3.1       ?       ? 
1 1 1   10    1   47 o    768.7    3.2    0.0000   0.0000          ?        ?  5909.5176  48.5276          ?        ?      768.7        3.2       ?       ? 
1 1 1   10    1   48 o    969.4    3.7    0.0000   0.0000          ?        ?  9398.4004  72.1529          ?        ?      969.4        3.7       ?       ? 
1 1 1   10    1   49 o    489.1    2.7    0.0000   0.0000          ?        ?  2391.9021  26.8179          ?        ?      489.1        2.7       ?       ? 
1 1 1   10    1   50 f    345.4    3.4    0.0000   0.0000          ?        ?  1193.3969  23.6253          ?        ?      345.4        3.4       ?       ? 
1 1 1   10    1   51 o    298.2    3.5    0.0000   0.0000          ?        ?   889.4606  21.0712          ?        ?      298.2        3.5       ?       ? 
1 1 1   10    1   52 o    581.1    2.7    0.0000   0.0000          ?        ?  3377.1411  31.9261          ?        ?      581.1        2.7       ?       ? 
1 1 1   10    1   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    1   54 o    174.3    5.5    0.0000   0.0000          ?        ?   303.9363  19.1556          ?        ?      174.3        5.5       ?       ? 
1 1 1   10    1   55 o    587.7    2.8    0.0000   0.0000          ?        ?  3454.4021  33.2031          ?        ?      587.7        2.8       ?       ? 
1 1 1   10    1   56 o    100.3   10.2    0.0000   0.0000          ?        ?   100.8864  20.4327          ?        ?      100.3       10.2       ?       ? 
1 1 1   10    1   57 f    360.4    3.0    0.0000   0.0000          ?        ?  1299.3915  21.7097          ?        ?      360.4        3.0       ?       ? 
1 1 1   10    1   58 o    209.7    4.7    0.0000   0.0000          ?        ?   439.9414  19.7942          ?        ?      209.7        4.7       ?       ? 
1 1 1   10    1   59 o    300.3    3.6    0.0000   0.0000          ?        ?   902.2311  21.7097          ?        ?      300.3        3.6       ?       ? 
1 1 1   10    1   60 o    262.2    3.8    0.0000   0.0000          ?        ?   687.6877  19.7942          ?        ?      262.2        3.8       ?       ? 
1 1 1   10    1   61 o    360.8    3.1    0.0000   0.0000          ?        ?  1301.9456  22.3483          ?        ?      360.8        3.1       ?       ? 
1 1 1   10    1   62 o    683.9    2.9    0.0000   0.0000          ?        ?  4678.4482  39.5883          ?        ?      683.9        2.9       ?       ? 
1 1 1   10    1   63 o    245.4    4.2    0.0000   0.0000          ?        ?   602.7644  20.4327          ?        ?      245.4        4.2       ?       ? 
1 1 1   10    1   64 o     21.5   10.7    0.0000   0.0000          ?        ?   -56.8284  19.7942          ?        ?       21.5       10.7       ?       ? 
1 1 1   10    1   65 o    273.4    3.6    0.0000   0.0000          ?        ?   747.7088  19.7942          ?        ?      273.4        3.6       ?       ? 
1 1 1   10    1   66 o    274.5    4.0    0.0000   0.0000          ?        ?   754.0941  21.7097          ?        ?      274.5        4.0       ?       ? 
1 1 1   10    1   67 o    160.0    6.4    0.0000   0.0000          ?        ?   256.6857  20.4327          ?        ?      160.0        6.4       ?       ? 
1 1 1   10    1   68 o    312.4    3.5    0.0000   0.0000          ?        ?   976.9381  21.7097          ?        ?      312.4        3.5       ?       ? 
1 1 1   10    1   69 o    162.8    6.5    0.0000   0.0000          ?        ?   265.6250  21.0712          ?        ?      162.8        6.5       ?       ? 
1 1 1   10    1   70 f    418.1    3.1    0.0000   0.0000          ?        ?  1748.9106  25.5409          ?        ?      418.1        3.1       ?       ? 
1 1 1   10    1   71 o     26.4   12.9    0.0000   0.0000          ?        ?   -38.3113  21.7097          ?        ?       26.4       12.9       ?       ? 
1 1 1   10    1   72 o    304.5    4.0    0.0000   0.0000          ?        ?   928.4104  24.2638          ?        ?      304.5        4.0       ?       ? 
1 1 1   10    1   73 o     54.9   17.2    0.0000   0.0000          ?        ?    30.6490  21.0712          ?        ?       54.9       17.2       ?       ? 
1 1 1   10    1   74 o    364.9    3.3    0.0000   0.0000          ?        ?  1332.5946  24.2638          ?        ?      364.9        3.3       ?       ? 
1 1 1   10    1   75 o     20.6   10.4    0.0000   0.0000          ?        ?   -72.1529  21.0712          ?        ?       20.6       10.4       ?       ? 
1 1 1   10    1   76 o    251.8    4.7    0.0000   0.0000          ?        ?   635.3290  23.6253          ?        ?      251.8        4.7       ?       ? 
1 1 1   10    1   77 o    232.6    4.9    0.0000   0.0000          ?        ?   542.7434  22.9868          ?        ?      232.6        4.9       ?       ? 
1 1 1   10    1   78 o    246.6    4.5    0.0000   0.0000          ?        ?   609.7881  22.3483          ?        ?      246.6        4.5       ?       ? 
1 1 1   10    1   79 o    210.3    5.9    0.0000   0.0000          ?        ?   444.4110  24.9023          ?        ?      210.3        5.9       ?       ? 
1 1 1   10    1   80 o     47.8   17.9    0.0000   0.0000          ?        ?    19.1556  22.9868          ?        ?       47.8       17.9       ?       ? 
1 1 1   10    1   81 o    103.8   11.4    0.0000   0.0000          ?        ?   110.4642  23.6253          ?        ?      103.8       11.4       ?       ? 
1 1 1   10    2    0 o    528.3    2.8 2791.6167  30.0105  2791.6167  30.0105  2791.6167  30.0105      528.3      2.8      528.3        2.8     0.0     0.0 
1 1 1   10    2    1 o   1772.6    6.0    0.0000   0.0000          ?        ? 31422.9277 212.6277          ?        ?     1772.6        6.0       ?       ? 
1 1 1   10    2    2 o    897.2    3.1    0.0000   0.0000          ?        ?  8049.2036  54.9129          ?        ?      897.2        3.1       ?       ? 
1 1 1   10    2    3 o   2397.2    9.4    0.0000   0.0000          ?        ? 57480.3516 448.8807          ?        ?     2397.2        9.4       ?       ? 
1 1 1   10    2    4 o   1710.5    5.5    0.0000   0.0000          ?        ? 29259.6152 189.6409          ?        ?     1710.5        5.5       ?       ? 
1 1 1   10    2    5 o    782.4    2.7    0.0000   0.0000          ?        ?  6121.5068  42.7809          ?        ?      782.4        2.7       ?       ? 
1 1 1   10    2    6 o     51.8    2.5    0.0000   0.0000          ?        ?    26.8179   2.5541          ?        ?       51.8        2.5       ?       ? 
1 1 1   10    2    7 o   1507.2    4.9    0.0000   0.0000          ?        ? 22717.9609 147.4985          ?        ?     1507.2        4.9       ?       ? 
1 1 1   10    2    8 o    984.2    3.3    0.0000   0.0000          ?        ?  9686.3730  65.1292          ?        ?      984.2        3.3       ?       ? 
1 1 1   10    2    9 o   1159.0    3.9    0.0000   0.0000          ?        ? 13434.4951  90.0316          ?        ?     1159.0        3.9       ?       ? 
1 1 1   10    2   10 o    268.3    1.4    0.0000   0.0000          ?        ?   719.6138   7.6623          ?        ?      268.3        1.4       ?       ? 
1 1 1   10    2   11 o   1813.0    5.9    0.0000   0.0000          ?        ? 32874.9258 212.6277          ?        ?     1813.0        5.9       ?       ? 
1 1 1   10    2   12 o   1128.5    3.9    0.0000   0.0000          ?        ? 12736.5908  87.4775          ?        ?     1128.5        3.9       ?       ? 
1 1 1   10    2   13 o   1299.7    4.3    0.0000   0.0000          ?        ? 16894.0059 112.3798          ?        ?     1299.7        4.3       ?       ? 
1 1 1   10    2   14 o   1934.5    6.3    0.0000   0.0000          ?        ? 37428.8594 241.9997          ?        ?     1934.5        6.3       ?       ? 
1 1 1   10    2   15 o    778.1    2.7    0.0000   0.0000          ?        ?  6054.4619  42.7809          ?        ?      778.1        2.7       ?       ? 
1 1 1   10    2   16 o   1710.7    5.6    0.0000   0.0000          ?        ? 29268.5527 190.9180          ?        ?     1710.7        5.6       ?       ? 
1 1 1   10    2   17 o    213.8    1.5    0.0000   0.0000          ?        ?   457.1815   6.3852          ?        ?      213.8        1.5       ?       ? 
1 1 1   10    2   18 f    589.0    2.3    0.0000   0.0000          ?        ?  3469.0879  27.4564          ?        ?      589.0        2.3       ?       ? 
1 1 1   10    2   19 o    654.0    2.4    0.0000   0.0000          ?        ?  4277.4565  31.2876          ?        ?      654.0        2.4       ?       ? 
1 1 1   10    2   20 o    214.0    1.9    0.0000   0.0000          ?        ?   457.8200   8.3008          ?        ?      214.0        1.9       ?       ? 
1 1 1   10    2   21 o    937.5    3.3    0.0000   0.0000          ?        ?  8789.2500  62.5751          ?        ?      937.5        3.3       ?       ? 
1 1 1   10    2   22 o    674.2    2.5    0.0000   0.0000          ?        ?  4545.6357  33.8416          ?        ?      674.2        2.5       ?       ? 
1 1 1   10    2   23 o   1795.0    5.9    0.0000   0.0000          ?        ? 32226.1855 210.0736          ?        ?     1795.0        5.9       ?       ? 
1 1 1   10    2   24 o    464.3    2.1    0.0000   0.0000          ?        ?  2155.6492  19.1556          ?        ?      464.3        2.1       ?       ? 
1 1 1   10    2   25 o    502.1    2.1    0.0000   0.0000          ?        ?  2520.8833  21.0712          ?        ?      502.1        2.1       ?       ? 
1 1 1   10    2   26 o    228.1    2.2    0.0000   0.0000          ?        ?   520.3951  10.2163          ?        ?      228.1        2.2       ?       ? 
1 1 1   10    2   27 o    648.9    2.5    0.0000   0.0000          ?        ?  4210.4116  31.9261          ?        ?      648.9        2.5       ?       ? 
1 1 1   10    2   28 o   1921.2    6.2    0.0000   0.0000          ?        ? 36916.1289 238.8071          ?        ?     1921.2        6.2       ?       ? 
1 1 1   10    2   29 o   1147.9    4.2    0.0000   0.0000          ?        ? 13177.1709  95.7782          ?        ?     1147.9        4.2       ?       ? 
1 1 1   10    2   30 o    734.5    2.8    0.0000   0.0000          ?        ?  5394.8691  41.5039          ?        ?      734.5        2.8       ?       ? 
1 1 1   10    2   31 o    738.5    2.9    0.0000   0.0000          ?        ?  5453.6133  43.4195          ?        ?      738.5        2.9       ?       ? 
1 1 1   10    2   32 o    754.7    3.3    0.0000   0.0000          ?        ?  5696.2515  50.4432          ?        ?      754.7        3.3       ?       ? 
1 1 1   10    2   33 o    587.0    2.7    0.0000   0.0000          ?        ?  3445.4626  31.9261          ?        ?      587.0        2.7       ?       ? 
1 1 1   10    2   34 o   1597.5    5.6    0.0000   0.0000          ?        ? 25521.7090 179.4246          ?        ?     1597.5        5.6       ?       ? 
1 1 1   10    2   35 o    411.7    2.5    0.0000   0.0000          ?        ?  1694.6364  20.4327          ?        ?      411.7        2.5       ?       ? 
1 1 1   10    2   36 o   1373.8    4.6    0.0000   0.0000          ?        ? 18874.0605 125.7888          ?        ?     1373.8        4.6       ?       ? 
1 1 1   10    2   37 o    672.4    2.9    0.0000   0.0000          ?        ?  4520.7329  39.5883          ?        ?      672.4        2.9       ?       ? 
1 1 1   10    2   38 o   1170.5    4.2    0.0000   0.0000          ?        ? 13701.3975  97.6938          ?        ?     1170.5        4.2       ?       ? 
1 1 1   10    2   39 o    596.3    2.6    0.0000   0.0000          ?        ?  3555.9270  31.2876          ?        ?      596.3        2.6       ?       ? 
1 1 1   10    2   40 o    402.2    2.9    0.0000   0.0000          ?        ?  1617.3752  22.9868          ?        ?      402.2        2.9       ?       ? 
1 1 1   10    2   41 o    794.9    3.1    0.0000   0.0000          ?        ?  6318.8101  49.1662          ?        ?      794.9        3.1       ?       ? 
1 1 1   10    2   42 o    603.9    2.9    0.0000   0.0000          ?        ?  3647.2356  34.4802          ?        ?      603.9        2.9       ?       ? 
1 1 1   10    2   43 o   1454.8    4.8    0.0000   0.0000          ?        ? 21166.9922 141.1133          ?        ?     1454.8        4.8       ?       ? 
1 1 1   10    2   44 o    271.3    4.6    0.0000   0.0000          ?        ?   736.2155  24.9023          ?        ?      271.3        4.6       ?       ? 
1 1 1   10    2   45 o    150.8    5.9    0.0000   0.0000          ?        ?   227.3137  17.8786          ?        ?      150.8        5.9       ?       ? 
1 1 1   10    2   46 o    141.8    7.0    0.0000   0.0000          ?        ?   201.1343  19.7942          ?        ?      141.8        7.0       ?       ? 
1 1 1   10    2   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    2   48 o    632.4    2.8    0.0000   0.0000          ?        ?  3999.6997  35.1187          ?        ?      632.4        2.8       ?       ? 
1 1 1   10    2   49 o    154.5    6.4    0.0000   0.0000          ?        ?   238.8071  19.7942          ?        ?      154.5        6.4       ?       ? 
1 1 1   10    2   50 o    333.9    3.3    0.0000   0.0000          ?        ?  1114.8588  22.3483          ?        ?      333.9        3.3       ?       ? 
1 1 1   10    2   51 o    193.7    5.1    0.0000   0.0000          ?        ?   375.4507  19.7942          ?        ?      193.7        5.1       ?       ? 
1 1 1   10    2   52 o    570.2    2.7    0.0000   0.0000          ?        ?  3251.9905  30.6490          ?        ?      570.2        2.7       ?       ? 
1 1 1   10    2   53 o    529.2    2.8    0.0000   0.0000          ?        ?  2801.1943  29.3720          ?        ?      529.2        2.8       ?       ? 
1 1 1   10    2   54 o    398.6    2.8    0.0000   0.0000          ?        ?  1589.2803  22.3483          ?        ?      398.6        2.8       ?       ? 
1 1 1   10    2   55 o    512.0    2.7    0.0000   0.0000          ?        ?  2621.7698  27.4564          ?        ?      512.0        2.7       ?       ? 
1 1 1   10    2   56 o    109.2    9.1    0.0000   0.0000          ?        ?   119.4035  19.7942          ?        ?      109.2        9.1       ?       ? 
1 1 1   10    2   57 o    670.1    3.0    0.0000   0.0000          ?        ?  4491.3613  39.5883          ?        ?      670.1        3.0       ?       ? 
1 1 1   10    2   58 o    386.5    3.2    0.0000   0.0000          ?        ?  1494.1406  24.9023          ?        ?      386.5        3.2       ?       ? 
1 1 1   10    2   59 o    151.3    6.1    0.0000   0.0000          ?        ?   229.2293  18.5171          ?        ?      151.3        6.1       ?       ? 
1 1 1   10    2   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    2   61 o    650.9    2.9    0.0000   0.0000          ?        ?  4237.8682  37.6728          ?        ?      650.9        2.9       ?       ? 
1 1 1   10    2   62 o    221.6    4.8    0.0000   0.0000          ?        ?   491.6617  21.0712          ?        ?      221.6        4.8       ?       ? 
1 1 1   10    2   63 o    417.7    3.0    0.0000   0.0000          ?        ?  1745.7181  24.9023          ?        ?      417.7        3.0       ?       ? 
1 1 1   10    2   64 o     42.3   16.4    0.0000   0.0000          ?        ?    11.4934  19.7942          ?        ?       42.3       16.4       ?       ? 
1 1 1   10    2   65 o    590.6    2.8    0.0000   0.0000          ?        ?  3488.8823  33.2031          ?        ?      590.6        2.8       ?       ? 
1 1 1   10    2   66 o    267.7    4.1    0.0000   0.0000          ?        ?   717.0598  21.7097          ?        ?      267.7        4.1       ?       ? 
1 1 1   10    2   67 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    2   68 o    339.5    3.5    0.0000   0.0000          ?        ?  1153.1700  23.6253          ?        ?      339.5        3.5       ?       ? 
1 1 1   10    2   69 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    2   70 o    241.3    4.8    0.0000   0.0000          ?        ?   582.9703  22.9868          ?        ?      241.3        4.8       ?       ? 
1 1 1   10    2   71 o     77.6   14.9    0.0000   0.0000          ?        ?    63.2136  22.3483          ?        ?       77.6       14.9       ?       ? 
1 1 1   10    2   72 o    318.5    3.7    0.0000   0.0000          ?        ?  1015.2494  23.6253          ?        ?      318.5        3.7       ?       ? 
1 1 1   10    2   73 o    183.3    6.1    0.0000   0.0000          ?        ?   337.1394  22.3483          ?        ?      183.3        6.1       ?       ? 
1 1 1   10    2   74 o     63.5   17.2    0.0000   0.0000          ?        ?    42.7809  22.3483          ?        ?       63.5       17.2       ?       ? 
1 1 1   10    2   75 o    107.5   10.4    0.0000   0.0000          ?        ?   116.8494  22.3483          ?        ?      107.5       10.4       ?       ? 
1 1 1   10    2   76 o    198.9    5.8    0.0000   0.0000          ?        ?   397.1605  22.9868          ?        ?      198.9        5.8       ?       ? 
1 1 1   10    2   77 o     30.3   14.2    0.0000   0.0000          ?        ?   -21.0712  21.7097          ?        ?       30.3       14.2       ?       ? 
1 1 1   10    2   78 o    140.9    8.4    0.0000   0.0000          ?        ?   200.4958  23.6253          ?        ?      140.9        8.4       ?       ? 
1 1 1   10    2   79 o    174.3    6.6    0.0000   0.0000          ?        ?   305.8519  22.9868          ?        ?      174.3        6.6       ?       ? 
1 1 1   10    2   80 o     27.6   13.3    0.0000   0.0000          ?        ?   -31.2876  21.7097          ?        ?       27.6       13.3       ?       ? 
1 1 1   10    2   81 o     23.1   11.5    0.0000   0.0000          ?        ?   -48.5276  20.4327          ?        ?       23.1       11.5       ?       ? 
1 1 1   10    3    0 o   1882.3    9.4 35438.5898 355.6566 35438.5898 355.6566 35438.5898 355.6566     1882.3      9.4     1882.3        9.4     0.0     0.0 
1 1 1   10    3    1 o   1279.9    4.2    0.0000   0.0000          ?        ? 16381.9111 107.9102          ?        ?     1279.9        4.2       ?       ? 
1 1 1   10    3    2 o    175.1    1.3    0.0000   0.0000          ?        ?   306.4904   4.4697          ?        ?      175.1        1.3       ?       ? 
1 1 1   10    3    3 o    139.3    1.1    0.0000   0.0000          ?        ?   194.1106   3.1926          ?        ?      139.3        1.1       ?       ? 
1 1 1   10    3    4 o   1592.0    5.3    0.0000   0.0000          ?        ? 25346.1152 167.9312          ?        ?     1592.0        5.3       ?       ? 
1 1 1   10    3    5 o   1057.9    3.5    0.0000   0.0000          ?        ? 11192.0078  74.7070          ?        ?     1057.9        3.5       ?       ? 
1 1 1   10    3    6 o    858.1    2.9    0.0000   0.0000          ?        ?  7362.7925  50.4432          ?        ?      858.1        2.9       ?       ? 
1 1 1   10    3    7 o    624.9    2.3    0.0000   0.0000          ?        ?  3905.1980  28.7335          ?        ?      624.9        2.3       ?       ? 
1 1 1   10    3    8 o    618.2    2.2    0.0000   0.0000          ?        ?  3822.1902  27.4564          ?        ?      618.2        2.2       ?       ? 
1 1 1   10    3    9 o    586.7    2.2    0.0000   0.0000          ?        ?  3441.6316  25.5409          ?        ?      586.7        2.2       ?       ? 
1 1 1   10    3   10 o    608.0    2.2    0.0000   0.0000          ?        ?  3697.0403  26.8179          ?        ?      608.0        2.2       ?       ? 
1 1 1   10    3   11 o    596.8    2.2    0.0000   0.0000          ?        ?  3561.6736  26.8179          ?        ?      596.8        2.2       ?       ? 
1 1 1   10    3   12 o   1186.0    4.0    0.0000   0.0000          ?        ? 14067.2705  94.5012          ?        ?     1186.0        4.0       ?       ? 
1 1 1   10    3   13 o   1527.0    5.1    0.0000   0.0000          ?        ? 23318.8105 155.7993          ?        ?     1527.0        5.1       ?       ? 
1 1 1   10    3   14 o   1258.8    4.2    0.0000   0.0000          ?        ? 15847.4678 105.3561          ?        ?     1258.8        4.2       ?       ? 
1 1 1   10    3   15 o   1270.9    4.2    0.0000   0.0000          ?        ? 16153.3203 107.2716          ?        ?     1270.9        4.2       ?       ? 
1 1 1   10    3   16 o   1194.8    4.0    0.0000   0.0000          ?        ? 14275.4277  94.5012          ?        ?     1194.8        4.0       ?       ? 
1 1 1   10    3   17 o    942.4    3.4    0.0000   0.0000          ?        ?  8882.4746  63.2136          ?        ?      942.4        3.4       ?       ? 
1 1 1   10    3   18 o   1112.5    3.7    0.0000   0.0000          ?        ? 12378.3799  83.0078          ?        ?     1112.5        3.7       ?       ? 
1 1 1   10    3   19 o    506.6    2.0    0.0000   0.0000          ?        ?  2566.8569  20.4327          ?        ?      506.6        2.0       ?       ? 
1 1 1   10    3   20 o   1196.3    4.1    0.0000   0.0000          ?        ? 14311.8232  98.3323          ?        ?     1196.3        4.1       ?       ? 
1 1 1   10    3   21 o    352.0    1.8    0.0000   0.0000          ?        ?  1239.3705  12.7704          ?        ?      352.0        1.8       ?       ? 
1 1 1   10    3   22 o   1403.3    4.7    0.0000   0.0000          ?        ? 19693.9219 130.8969          ?        ?     1403.3        4.7       ?       ? 
1 1 1   10    3   23 o    652.6    2.4    0.0000   0.0000          ?        ?  4259.5776  31.2876          ?        ?      652.6        2.4       ?       ? 
1 1 1   10    3   24 o    922.2    3.2    0.0000   0.0000          ?        ?  8505.1084  59.3825          ?        ?      922.2        3.2       ?       ? 
1 1 1   10    3   25 o    672.4    2.6    0.0000   0.0000          ?        ?  4521.3716  34.4802          ?        ?      672.4        2.6       ?       ? 
1 1 1   10    3   26 o    990.3    3.5    0.0000   0.0000          ?        ?  9807.6924  69.5989          ?        ?      990.3        3.5       ?       ? 
1 1 1   10    3   27 o    926.2    3.4    0.0000   0.0000          ?        ?  8579.1768  63.8522          ?        ?      926.2        3.4       ?       ? 
1 1 1   10    3   28 o    698.4    3.0    0.0000   0.0000          ?        ?  4878.3052  41.5039          ?        ?      698.4        3.0       ?       ? 
1 1 1   10    3   29 o    696.3    2.9    0.0000   0.0000          ?        ?  4848.2944  40.2269          ?        ?      696.3        2.9       ?       ? 
1 1 1   10    3   30 o   1363.1    4.7    0.0000   0.0000          ?        ? 18582.2559 127.0658          ?        ?     1363.1        4.7       ?       ? 
1 1 1   10    3   31 o   1438.8    5.0    0.0000   0.0000          ?        ? 20704.0645 143.6674          ?        ?     1438.8        5.0       ?       ? 
1 1 1   10    3   32 o    260.5    3.4    0.0000   0.0000          ?        ?   678.7485  17.8786          ?        ?      260.5        3.4       ?       ? 
1 1 1   10    3   33 o    119.3    6.7    0.0000   0.0000          ?        ?   142.3903  15.9630          ?        ?      119.3        6.7       ?       ? 
1 1 1   10    3   34 o    305.2    2.7    0.0000   0.0000          ?        ?   931.6030  16.6016          ?        ?      305.2        2.7       ?       ? 
1 1 1   10    3   35 f    538.5    2.7    0.0000   0.0000          ?        ?  2900.1653  29.3720          ?        ?      538.5        2.7       ?       ? 
1 1 1   10    3   36 f   1117.3    4.0    0.0000   0.0000          ?        ? 12483.7363  89.3930          ?        ?     1117.3        4.0       ?       ? 
1 1 1   10    3   37 o   1685.6    5.8    0.0000   0.0000          ?        ? 28416.1270 194.7491          ?        ?     1685.6        5.8       ?       ? 
1 1 1   10    3   38 o    883.4    3.3    0.0000   0.0000          ?        ?  7804.6504  58.1055          ?        ?      883.4        3.3       ?       ? 
1 1 1   10    3   39 o   1099.3    3.8    0.0000   0.0000          ?        ? 12084.6602  84.2849          ?        ?     1099.3        3.8       ?       ? 
1 1 1   10    3   40 o    235.3    3.9    0.0000   0.0000          ?        ?   553.5982  18.5171          ?        ?      235.3        3.9       ?       ? 
1 1 1   10    3   41 o   1141.3    3.9    0.0000   0.0000          ?        ? 13027.7568  90.0316          ?        ?     1141.3        3.9       ?       ? 
1 1 1   10    3   42 o    587.2    2.7    0.0000   0.0000          ?        ?  3448.6550  31.2876          ?        ?      587.2        2.7       ?       ? 
1 1 1   10    3   43 o    947.5    3.6    0.0000   0.0000          ?        ?  8977.6143  67.6833          ?        ?      947.5        3.6       ?       ? 
1 1 1   10    3   44 o    423.1    2.8    0.0000   0.0000          ?        ?  1790.4146  23.6253          ?        ?      423.1        2.8       ?       ? 
1 1 1   10    3   45 o   1035.9    3.7    0.0000   0.0000          ?        ? 10730.9941  76.6226          ?        ?     1035.9        3.7       ?       ? 
1 1 1   10    3   46 o    364.9    3.1    0.0000   0.0000          ?        ?  1331.9562  22.9868          ?        ?      364.9        3.1       ?       ? 
1 1 1   10    3   47 o    201.0    4.6    0.0000   0.0000          ?        ?   404.1842  18.5171          ?        ?      201.0        4.6       ?       ? 
1 1 1   10    3   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    3   49 o    812.0    3.1    0.0000   0.0000          ?        ?  6594.0127  51.0817          ?        ?      812.0        3.1       ?       ? 
1 1 1   10    3   50 o    713.3    2.9    0.0000   0.0000          ?        ?  5088.3789  40.8654          ?        ?      713.3        2.9       ?       ? 
1 1 1   10    3   51 f     24.5   12.0    0.0000   0.0000          ?        ?   -35.7572  19.1556          ?        ?       24.5       12.0       ?       ? 
1 1 1   10    3   52 o    373.2    3.2    0.0000   0.0000          ?        ?  1393.2542  23.6253          ?        ?      373.2        3.2       ?       ? 
1 1 1   10    3   53 o    174.7    5.7    0.0000   0.0000          ?        ?   305.2133  19.7942          ?        ?      174.7        5.7       ?       ? 
1 1 1   10    3   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    3   55 o     50.0   16.2    0.0000   0.0000          ?        ?    24.2638  18.5171          ?        ?       50.0       16.2       ?       ? 
1 1 1   10    3   56 o    177.7    5.4    0.0000   0.0000          ?        ?   316.0682  19.1556          ?        ?      177.7        5.4       ?       ? 
1 1 1   10    3   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    3   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    3   59 o    305.3    3.7    0.0000   0.0000          ?        ?   932.2416  22.3483          ?        ?      305.3        3.7       ?       ? 
1 1 1   10    3   60 o    246.9    4.1    0.0000   0.0000          ?        ?   609.7881  20.4327          ?        ?      246.9        4.1       ?       ? 
1 1 1   10    3   61 o    340.6    3.3    0.0000   0.0000          ?        ?  1160.1937  22.3483          ?        ?      340.6        3.3       ?       ? 
1 1 1   10    3   62 f    487.3    2.9    0.0000   0.0000          ?        ?  2375.3005  28.0950          ?        ?      487.3        2.9       ?       ? 
1 1 1   10    3   63 o    253.9    4.2    0.0000   0.0000          ?        ?   644.9069  21.0712          ?        ?      253.9        4.2       ?       ? 
1 1 1   10    3   64 o    223.2    4.7    0.0000   0.0000          ?        ?   498.6854  21.0712          ?        ?      223.2        4.7       ?       ? 
1 1 1   10    3   65 o    133.3    7.4    0.0000   0.0000          ?        ?   178.1475  19.7942          ?        ?      133.3        7.4       ?       ? 
1 1 1   10    3   66 o    283.9    3.9    0.0000   0.0000          ?        ?   806.4528  22.3483          ?        ?      283.9        3.9       ?       ? 
1 1 1   10    3   67 o     26.8   13.0    0.0000   0.0000          ?        ?   -36.3957  21.7097          ?        ?       26.8       13.0       ?       ? 
1 1 1   10    3   68 o     91.8   10.8    0.0000   0.0000          ?        ?    84.9234  19.7942          ?        ?       91.8       10.8       ?       ? 
1 1 1   10    3   69 o    276.2    4.0    0.0000   0.0000          ?        ?   763.6719  22.3483          ?        ?      276.2        4.0       ?       ? 
1 1 1   10    3   70 o    452.7    3.0    0.0000   0.0000          ?        ?  2050.9316  26.8179          ?        ?      452.7        3.0       ?       ? 
1 1 1   10    3   71 f    253.5    4.5    0.0000   0.0000          ?        ?   643.6298  22.9868          ?        ?      253.5        4.5       ?       ? 
1 1 1   10    3   72 o    163.1    6.7    0.0000   0.0000          ?        ?   266.9020  21.7097          ?        ?      163.1        6.7       ?       ? 
1 1 1   10    3   73 o    250.9    4.7    0.0000   0.0000          ?        ?   630.8594  23.6253          ?        ?      250.9        4.7       ?       ? 
1 1 1   10    3   74 o     99.9   11.2    0.0000   0.0000          ?        ?   100.8864  22.3483          ?        ?       99.9       11.2       ?       ? 
1 1 1   10    3   75 o     44.8   17.6    0.0000   0.0000          ?        ?    12.7704  22.9868          ?        ?       44.8       17.6       ?       ? 
1 1 1   10    3   76 o     25.7   12.6    0.0000   0.0000          ?        ?   -41.5039  21.7097          ?        ?       25.7       12.6       ?       ? 
1 1 1   10    3   77 o    227.9    4.9    0.0000   0.0000          ?        ?   521.0336  22.3483          ?        ?      227.9        4.9       ?       ? 
1 1 1   10    3   78 f     99.6   11.2    0.0000   0.0000          ?        ?   100.8864  22.3483          ?        ?       99.6       11.2       ?       ? 
1 1 1   10    3   79 o    142.1    7.2    0.0000   0.0000          ?        ?   203.6884  20.4327          ?        ?      142.1        7.2       ?       ? 
1 1 1   10    3   80 o    128.0    7.5    0.0000   0.0000          ?        ?   165.3771  19.1556          ?        ?      128.0        7.5       ?       ? 
1 1 1   10    3   81 f     31.2   14.2    0.0000   0.0000          ?        ?   -11.4934  19.7942          ?        ?       31.2       14.2       ?       ? 
1 1 1   10    4    0 o   2020.2   10.6 40823.8789 429.7251 40823.8789 429.7251 40823.8789 429.7251     2020.2     10.6     2020.2       10.6     0.0     0.0 
1 1 1   10    4    1 f   1345.5    4.4    0.0000   0.0000          ?        ? 18105.9199 119.4035          ?        ?     1345.5        4.4       ?       ? 
1 1 1   10    4    2 o   1424.8    4.8    0.0000   0.0000          ?        ? 20302.4336 136.0051          ?        ?     1424.8        4.8       ?       ? 
1 1 1   10    4    3 o    833.8    2.9    0.0000   0.0000          ?        ?  6952.2236  47.8891          ?        ?      833.8        2.9       ?       ? 
1 1 1   10    4    4 o    409.2    1.7    0.0000   0.0000          ?        ?  1674.8422  14.0475          ?        ?      409.2        1.7       ?       ? 
1 1 1   10    4    5 f    607.3    2.2    0.0000   0.0000          ?        ?  3688.1008  26.8179          ?        ?      607.3        2.2       ?       ? 
1 1 1   10    4    6 o   1499.1    4.9    0.0000   0.0000          ?        ? 22475.9609 146.2215          ?        ?     1499.1        4.9       ?       ? 
1 1 1   10    4    7 o   1178.8    4.0    0.0000   0.0000          ?        ? 13895.5068  94.5012          ?        ?     1178.8        4.0       ?       ? 
1 1 1   10    4    8 o   1629.7    5.3    0.0000   0.0000          ?        ? 26561.2207 173.0394          ?        ?     1629.7        5.3       ?       ? 
1 1 1   10    4    9 f   1344.0    4.4    0.0000   0.0000          ?        ? 18065.0527 119.4035          ?        ?     1344.0        4.4       ?       ? 
1 1 1   10    4   10 o    950.2    3.3    0.0000   0.0000          ?        ?  9028.6953  61.9366          ?        ?      950.2        3.3       ?       ? 
1 1 1   10    4   11 o   1006.2    3.4    0.0000   0.0000          ?        ? 10125.6758  68.9603          ?        ?     1006.2        3.4       ?       ? 
1 1 1   10    4   12 o   1449.9    4.7    0.0000   0.0000          ?        ? 21023.9629 137.2822          ?        ?     1449.9        4.7       ?       ? 
1 1 1   10    4   13 o    891.8    3.0    0.0000   0.0000          ?        ?  7953.4253  54.2743          ?        ?      891.8        3.0       ?       ? 
1 1 1   10    4   14 o   1476.7    4.8    0.0000   0.0000          ?        ? 21807.4297 143.0288          ?        ?     1476.7        4.8       ?       ? 
1 1 1   10    4   15 o    484.2    1.9    0.0000   0.0000          ?        ?  2344.6516  18.5171          ?        ?      484.2        1.9       ?       ? 
1 1 1   10    4   16 o    924.8    3.2    0.0000   0.0000          ?        ?  8552.3584  60.0210          ?        ?      924.8        3.2       ?       ? 
1 1 1   10    4   17 o   1229.3    4.1    0.0000   0.0000          ?        ? 15113.8066 100.8864          ?        ?     1229.3        4.1       ?       ? 
1 1 1   10    4   18 o   2003.2    6.4    0.0000   0.0000          ?        ? 40136.1914 257.9627          ?        ?     2003.2        6.4       ?       ? 
1 1 1   10    4   19 o    917.7    3.2    0.0000   0.0000          ?        ?  8422.7383  58.1055          ?        ?      917.7        3.2       ?       ? 
1 1 1   10    4   20 o    500.5    2.3    0.0000   0.0000          ?        ?  2505.5588  22.9868          ?        ?      500.5        2.3       ?       ? 
1 1 1   10    4   21 o    916.3    3.3    0.0000   0.0000          ?        ?  8395.9209  60.0210          ?        ?      916.3        3.3       ?       ? 
1 1 1   10    4   22 o    596.9    2.4    0.0000   0.0000          ?        ?  3563.5891  28.7335          ?        ?      596.9        2.4       ?       ? 
1 1 1   10    4   23 o    649.5    2.4    0.0000   0.0000          ?        ?  4218.0737  31.2876          ?        ?      649.5        2.4       ?       ? 
1 1 1   10    4   24 o    974.2    3.4    0.0000   0.0000          ?        ?  9491.6240  66.4062          ?        ?      974.2        3.4       ?       ? 
1 1 1   10    4   25 o    670.1    2.5    0.0000   0.0000          ?        ?  4490.0840  33.8416          ?        ?      670.1        2.5       ?       ? 
1 1 1   10    4   26 o   1583.0    5.2    0.0000   0.0000          ?        ? 25062.6133 165.3771          ?        ?     1583.0        5.2       ?       ? 
1 1 1   10    4   27 o   1289.0    4.4    0.0000   0.0000          ?        ? 16617.5254 113.6568          ?        ?     1289.0        4.4       ?       ? 
1 1 1   10    4   28 o    634.3    2.5    0.0000   0.0000          ?        ?  4023.9634  31.2876          ?        ?      634.3        2.5       ?       ? 
1 1 1   10    4   29 o   1072.9    3.8    0.0000   0.0000          ?        ? 11510.6289  82.3693          ?        ?     1072.9        3.8       ?       ? 
1 1 1   10    4   30 o   1338.5    4.6    0.0000   0.0000          ?        ? 17917.5566 123.2347          ?        ?     1338.5        4.6       ?       ? 
1 1 1   10    4   31 o    667.7    3.2    0.0000   0.0000          ?        ?  4458.7964  42.1424          ?        ?      667.7        3.2       ?       ? 
1 1 1   10    4   32 o   1822.4    6.4    0.0000   0.0000          ?        ? 33215.2578 233.0604          ?        ?     1822.4        6.4       ?       ? 
1 1 1   10    4   33 o    541.8    2.9    0.0000   0.0000          ?        ?  2935.9224  31.9261          ?        ?      541.8        2.9       ?       ? 
1 1 1   10    4   34 o   1700.9    5.9    0.0000   0.0000          ?        ? 28934.6074 199.2188          ?        ?     1700.9        5.9       ?       ? 
1 1 1   10    4   35 o   1514.1    5.2    0.0000   0.0000          ?        ? 22927.3965 157.0763          ?        ?     1514.1        5.2       ?       ? 
1 1 1   10    4   36 o    470.6    2.8    0.0000   0.0000          ?        ?  2214.3928  26.8179          ?        ?      470.6        2.8       ?       ? 
1 1 1   10    4   37 o   1076.0    3.8    0.0000   0.0000          ?        ? 11577.6738  82.3693          ?        ?     1076.0        3.8       ?       ? 
1 1 1   10    4   38 o    988.1    3.5    0.0000   0.0000          ?        ?  9764.2725  68.9603          ?        ?      988.1        3.5       ?       ? 
1 1 1   10    4   39 o   1043.8    3.6    0.0000   0.0000          ?        ? 10895.7334  75.9841          ?        ?     1043.8        3.6       ?       ? 
1 1 1   10    4   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    4   41 f    586.2    2.8    0.0000   0.0000          ?        ?  3436.5234  33.2031          ?        ?      586.2        2.8       ?       ? 
1 1 1   10    4   42 o    811.5    3.3    0.0000   0.0000          ?        ?  6585.0737  52.9973          ?        ?      811.5        3.3       ?       ? 
1 1 1   10    4   43 o    684.6    2.8    0.0000   0.0000          ?        ?  4687.3872  38.9498          ?        ?      684.6        2.8       ?       ? 
1 1 1   10    4   44 o    304.3    3.4    0.0000   0.0000          ?        ?   925.8564  20.4327          ?        ?      304.3        3.4       ?       ? 
1 1 1   10    4   45 o    216.9    5.0    0.0000   0.0000          ?        ?   470.5904  21.7097          ?        ?      216.9        5.0       ?       ? 
1 1 1   10    4   46 o    363.5    3.4    0.0000   0.0000          ?        ?  1321.1012  24.9023          ?        ?      363.5        3.4       ?       ? 
1 1 1   10    4   47 o   1034.2    3.8    0.0000   0.0000          ?        ? 10696.5137  78.5382          ?        ?     1034.2        3.8       ?       ? 
1 1 1   10    4   48 o    806.4    3.1    0.0000   0.0000          ?        ?  6503.3428  49.8047          ?        ?      806.4        3.1       ?       ? 
1 1 1   10    4   49 o    467.5    2.7    0.0000   0.0000          ?        ?  2185.6594  25.5409          ?        ?      467.5        2.7       ?       ? 
1 1 1   10    4   50 o    702.2    3.0    0.0000   0.0000          ?        ?  4931.3022  41.5039          ?        ?      702.2        3.0       ?       ? 
1 1 1   10    4   51 o    816.8    3.1    0.0000   0.0000          ?        ?  6671.9126  51.0817          ?        ?      816.8        3.1       ?       ? 
1 1 1   10    4   52 o    472.0    2.8    0.0000   0.0000          ?        ?  2228.4404  26.1794          ?        ?      472.0        2.8       ?       ? 
1 1 1   10    4   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    4   54 o    247.0    3.9    0.0000   0.0000          ?        ?   610.4266  19.1556          ?        ?      247.0        3.9       ?       ? 
1 1 1   10    4   55 o    589.8    2.9    0.0000   0.0000          ?        ?  3479.3044  33.8416          ?        ?      589.8        2.9       ?       ? 
1 1 1   10    4   56 f    101.6    9.4    0.0000   0.0000          ?        ?   103.4405  19.1556          ?        ?      101.6        9.4       ?       ? 
1 1 1   10    4   57 o    152.8    6.3    0.0000   0.0000          ?        ?   233.6989  19.1556          ?        ?      152.8        6.3       ?       ? 
1 1 1   10    4   58 o    799.1    3.0    0.0000   0.0000          ?        ?  6387.1318  48.5276          ?        ?      799.1        3.0       ?       ? 
1 1 1   10    4   59 o    338.5    3.0    0.0000   0.0000          ?        ?  1146.1464  20.4327          ?        ?      338.5        3.0       ?       ? 
1 1 1   10    4   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    4   61 o    231.7    4.4    0.0000   0.0000          ?        ?   536.9967  20.4327          ?        ?      231.7        4.4       ?       ? 
1 1 1   10    4   62 o     34.1   14.9    0.0000   0.0000          ?        ?    -3.8311  19.1556          ?        ?       34.1       14.9       ?       ? 
1 1 1   10    4   63 o    151.3    6.5    0.0000   0.0000          ?        ?   229.2293  19.7942          ?        ?      151.3        6.5       ?       ? 
1 1 1   10    4   64 o    179.4    5.5    0.0000   0.0000          ?        ?   322.4534  19.7942          ?        ?      179.4        5.5       ?       ? 
1 1 1   10    4   65 o    341.7    3.3    0.0000   0.0000          ?        ?  1168.4946  22.3483          ?        ?      341.7        3.3       ?       ? 
1 1 1   10    4   66 o    196.1    4.9    0.0000   0.0000          ?        ?   385.0285  19.1556          ?        ?      196.1        4.9       ?       ? 
1 1 1   10    4   67 o     64.2   16.0    0.0000   0.0000          ?        ?    43.4195  20.4327          ?        ?       64.2       16.0       ?       ? 
1 1 1   10    4   68 o    200.2    5.4    0.0000   0.0000          ?        ?   401.6301  21.7097          ?        ?      200.2        5.4       ?       ? 
1 1 1   10    4   69 o    464.4    2.9    0.0000   0.0000          ?        ?  2158.2031  26.8179          ?        ?      464.4        2.9       ?       ? 
1 1 1   10    4   70 o    239.1    4.7    0.0000   0.0000          ?        ?   572.7539  22.3483          ?        ?      239.1        4.7       ?       ? 
1 1 1   10    4   71 o    113.2    9.9    0.0000   0.0000          ?        ?   128.9814  22.3483          ?        ?      113.2        9.9       ?       ? 
1 1 1   10    4   72 o     21.5   10.8    0.0000   0.0000          ?        ?   -79.1767  22.9868          ?        ?       21.5       10.8       ?       ? 
1 1 1   10    4   73 o    351.2    3.4    0.0000   0.0000          ?        ?  1234.9008  23.6253          ?        ?      351.2        3.4       ?       ? 
1 1 1   10    4   74 o    168.6    6.6    0.0000   0.0000          ?        ?   285.4192  22.3483          ?        ?      168.6        6.6       ?       ? 
1 1 1   10    4   75 o     95.8   12.0    0.0000   0.0000          ?        ?    93.2242  22.9868          ?        ?       95.8       12.0       ?       ? 
1 1 1   10    4   76 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    4   77 o    140.0    7.3    0.0000   0.0000          ?        ?   197.3032  20.4327          ?        ?      140.0        7.3       ?       ? 
1 1 1   10    4   78 o     51.1   17.8    0.0000   0.0000          ?        ?    24.9023  22.3483          ?        ?       51.1       17.8       ?       ? 
1 1 1   10    4   79 o    187.8    5.4    0.0000   0.0000          ?        ?   354.3795  20.4327          ?        ?      187.8        5.4       ?       ? 
1 1 1   10    4   80 o     43.7   16.7    0.0000   0.0000          ?        ?    14.6860  20.4327          ?        ?       43.7       16.7       ?       ? 
1 1 1   10    4   81 o     71.9   15.5    0.0000   0.0000          ?        ?    56.1899  21.7097          ?        ?       71.9       15.5       ?       ? 
1 1 1   10    5    0 o    723.9    4.0 5240.3472  58.1055  5240.3472  58.1055  5240.3472  58.1055      723.9      4.0      723.9        4.0     0.0     0.0 
1 1 1   10    5    1 o    452.5    1.9    0.0000   0.0000          ?        ?  2047.7389  17.2401          ?        ?      452.5        1.9       ?       ? 
1 1 1   10    5    2 o    839.6    3.1    0.0000   0.0000          ?        ?  7049.2788  52.3588          ?        ?      839.6        3.1       ?       ? 
1 1 1   10    5    3 f    309.9    1.6    0.0000   0.0000          ?        ?   960.3365  10.2163          ?        ?      309.9        1.6       ?       ? 
1 1 1   10    5    4 o   1760.8    5.8    0.0000   0.0000          ?        ? 31006.6094 204.3269          ?        ?     1760.8        5.8       ?       ? 
1 1 1   10    5    5 f   1911.9    6.1    0.0000   0.0000          ?        ? 36558.5547 234.9760          ?        ?     1911.9        6.1       ?       ? 
1 1 1   10    5    6 o    280.4    1.4    0.0000   0.0000          ?        ?   786.0201   7.6623          ?        ?      280.4        1.4       ?       ? 
1 1 1   10    5    7 o   1956.0    6.3    0.0000   0.0000          ?        ? 38264.0469 246.4693          ?        ?     1956.0        6.3       ?       ? 
1 1 1   10    5    8 o    461.0    1.8    0.0000   0.0000          ?        ?  2125.0000  16.6016          ?        ?      461.0        1.8       ?       ? 
1 1 1   10    5    9 o    410.0    1.6    0.0000   0.0000          ?        ?  1681.2274  13.4090          ?        ?      410.0        1.6       ?       ? 
1 1 1   10    5   10 o   1617.0    5.3    0.0000   0.0000          ?        ? 26148.7383 171.1238          ?        ?     1617.0        5.3       ?       ? 
1 1 1   10    5   11 o   1625.5    5.3    0.0000   0.0000          ?        ? 26425.2168 172.4008          ?        ?     1625.5        5.3       ?       ? 
1 1 1   10    5   12 o    674.8    2.5    0.0000   0.0000          ?        ?  4553.9365  33.2031          ?        ?      674.8        2.5       ?       ? 
1 1 1   10    5   13 o   1064.1    3.6    0.0000   0.0000          ?        ? 11322.9043  76.6226          ?        ?     1064.1        3.6       ?       ? 
1 1 1   10    5   14 o   1851.4    6.0    0.0000   0.0000          ?        ? 34280.3125 221.5670          ?        ?     1851.4        6.0       ?       ? 
1 1 1   10    5   15 o    721.2    2.7    0.0000   0.0000          ?        ?  5201.3970  38.3113          ?        ?      721.2        2.7       ?       ? 
1 1 1   10    5   16 o    348.5    1.7    0.0000   0.0000          ?        ?  1214.4681  12.1319          ?        ?      348.5        1.7       ?       ? 
1 1 1   10    5   17 o   1153.6    3.9    0.0000   0.0000          ?        ? 13308.7070  90.0316          ?        ?     1153.6        3.9       ?       ? 
1 1 1   10    5   18 o    962.9    3.3    0.0000   0.0000          ?        ?  9271.9727  64.4907          ?        ?      962.9        3.3       ?       ? 
1 1 1   10    5   19 o    806.3    2.9    0.0000   0.0000          ?        ?  6502.0654  45.9736          ?        ?      806.3        2.9       ?       ? 
1 1 1   10    5   20 o    626.4    2.3    0.0000   0.0000          ?        ?  3923.7153  29.3720          ?        ?      626.4        2.3       ?       ? 
1 1 1   10    5   21 o    782.8    2.8    0.0000   0.0000          ?        ?  6127.2534  43.4195          ?        ?      782.8        2.8       ?       ? 
1 1 1   10    5   22 o    993.2    3.5    0.0000   0.0000          ?        ?  9864.5205  69.5989          ?        ?      993.2        3.5       ?       ? 
1 1 1   10    5   23 o    629.0    2.6    0.0000   0.0000          ?        ?  3956.9187  32.5646          ?        ?      629.0        2.6       ?       ? 
1 1 1   10    5   24 o    681.7    2.6    0.0000   0.0000          ?        ?  4647.7993  35.7572          ?        ?      681.7        2.6       ?       ? 
1 1 1   10    5   25 o    757.0    2.8    0.0000   0.0000          ?        ?  5731.3701  42.1424          ?        ?      757.0        2.8       ?       ? 
1 1 1   10    5   26 o    742.9    2.8    0.0000   0.0000          ?        ?  5518.7422  41.5039          ?        ?      742.9        2.8       ?       ? 
1 1 1   10    5   27 o   1128.9    3.9    0.0000   0.0000          ?        ? 12745.5303  88.7545          ?        ?     1128.9        3.9       ?       ? 
1 1 1   10    5   28 o   1475.0    5.4    0.0000   0.0000          ?        ? 21757.6250 158.9919          ?        ?     1475.0        5.4       ?       ? 
1 1 1   10    5   29 o   1118.4    4.1    0.0000   0.0000          ?        ? 12508.6387  90.6701          ?        ?     1118.4        4.1       ?       ? 
1 1 1   10    5   30 o   1052.6    3.8    0.0000   0.0000          ?        ? 11080.9043  80.4537          ?        ?     1052.6        3.8       ?       ? 
1 1 1   10    5   31 o   2806.9    9.8    0.0000   0.0000          ?        ? 78807.6172 552.3212          ?        ?     2806.9        9.8       ?       ? 
1 1 1   10    5   32 o    234.2    3.4    0.0000   0.0000          ?        ?   548.4901  15.9630          ?        ?      234.2        3.4       ?       ? 
1 1 1   10    5   33 o    286.3    2.6    0.0000   0.0000          ?        ?   819.8618  14.6860          ?        ?      286.3        2.6       ?       ? 
1 1 1   10    5   34 o    507.0    2.6    0.0000   0.0000          ?        ?  2570.6880  26.1794          ?        ?      507.0        2.6       ?       ? 
1 1 1   10    5   35 o   2069.3    7.0    0.0000   0.0000          ?        ? 42825.0078 288.6118          ?        ?     2069.3        7.0       ?       ? 
1 1 1   10    5   36 o   1169.0    4.0    0.0000   0.0000          ?        ? 13667.5557  93.8627          ?        ?     1169.0        4.0       ?       ? 
1 1 1   10    5   37 o    964.7    4.1    0.0000   0.0000          ?        ?  9307.0908  78.5382          ?        ?      964.7        4.1       ?       ? 
1 1 1   10    5   38 o    906.0    3.4    0.0000   0.0000          ?        ?  8209.4727  61.2981          ?        ?      906.0        3.4       ?       ? 
1 1 1   10    5   39 o    629.4    2.6    0.0000   0.0000          ?        ?  3961.3884  32.5646          ?        ?      629.4        2.6       ?       ? 
1 1 1   10    5   40 o    393.5    2.7    0.0000   0.0000          ?        ?  1548.4149  21.0712          ?        ?      393.5        2.7       ?       ? 
1 1 1   10    5   41 o   1021.5    3.7    0.0000   0.0000          ?        ? 10434.7197  74.7070          ?        ?     1021.5        3.7       ?       ? 
1 1 1   10    5   42 o    854.5    3.2    0.0000   0.0000          ?        ?  7302.7715  54.9129          ?        ?      854.5        3.2       ?       ? 
1 1 1   10    5   43 o    483.7    3.0    0.0000   0.0000          ?        ?  2339.5432  28.7335          ?        ?      483.7        3.0       ?       ? 
1 1 1   10    5   44 o    706.8    2.9    0.0000   0.0000          ?        ?  4995.7935  41.5039          ?        ?      706.8        2.9       ?       ? 
1 1 1   10    5   45 o   1457.2    5.0    0.0000   0.0000          ?        ? 21238.5059 145.5829          ?        ?     1457.2        5.0       ?       ? 
1 1 1   10    5   46 o    147.5    8.2    0.0000   0.0000          ?        ?   217.7359  24.2638          ?        ?      147.5        8.2       ?       ? 
1 1 1   10    5   47 o   1141.8    4.0    0.0000   0.0000          ?        ? 13039.2500  91.3086          ?        ?     1141.8        4.0       ?       ? 
1 1 1   10    5   48 o    278.5    4.1    0.0000   0.0000          ?        ?   775.8038  22.9868          ?        ?      278.5        4.1       ?       ? 
1 1 1   10    5   49 o    132.7    7.9    0.0000   0.0000          ?        ?   176.2320  21.0712          ?        ?      132.7        7.9       ?       ? 
1 1 1   10    5   50 o    730.2    2.9    0.0000   0.0000          ?        ?  5332.9326  42.7809          ?        ?      730.2        2.9       ?       ? 
1 1 1   10    5   51 o    845.6    3.2    0.0000   0.0000          ?        ?  7151.4424  54.2743          ?        ?      845.6        3.2       ?       ? 
1 1 1   10    5   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    5   53 o    322.7    3.4    0.0000   0.0000          ?        ?  1041.4288  21.7097          ?        ?      322.7        3.4       ?       ? 
1 1 1   10    5   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    5   55 o    250.5    4.1    0.0000   0.0000          ?        ?   627.6667  20.4327          ?        ?      250.5        4.1       ?       ? 
1 1 1   10    5   56 o    198.7    5.0    0.0000   0.0000          ?        ?   395.2449  19.7942          ?        ?      198.7        5.0       ?       ? 
1 1 1   10    5   57 o    208.3    4.9    0.0000   0.0000          ?        ?   434.1947  20.4327          ?        ?      208.3        4.9       ?       ? 
1 1 1   10    5   58 o    325.2    3.2    0.0000   0.0000          ?        ?  1058.0303  21.0712          ?        ?      325.2        3.2       ?       ? 
1 1 1   10    5   59 o    224.4    4.4    0.0000   0.0000          ?        ?   503.7936  19.7942          ?        ?      224.4        4.4       ?       ? 
1 1 1   10    5   60 o    305.9    3.4    0.0000   0.0000          ?        ?   936.0728  21.0712          ?        ?      305.9        3.4       ?       ? 
1 1 1   10    5   61 o    240.0    4.1    0.0000   0.0000          ?        ?   576.5850  19.7942          ?        ?      240.0        4.1       ?       ? 
1 1 1   10    5   62 o     99.6    9.6    0.0000   0.0000          ?        ?    99.6094  19.1556          ?        ?       99.6        9.6       ?       ? 
1 1 1   10    5   63 o     29.6   13.6    0.0000   0.0000          ?        ?   -14.0475  18.5171          ?        ?       29.6       13.6       ?       ? 
1 1 1   10    5   64 o     19.4    9.9    0.0000   0.0000          ?        ?   -72.7915  19.7942          ?        ?       19.4        9.9       ?       ? 
1 1 1   10    5   65 o    160.4    6.4    0.0000   0.0000          ?        ?   257.9627  20.4327          ?        ?      160.4        6.4       ?       ? 
1 1 1   10    5   66 o    473.0    2.8    0.0000   0.0000          ?        ?  2238.6570  26.1794          ?        ?      473.0        2.8       ?       ? 
1 1 1   10    5   67 o    159.8    6.6    0.0000   0.0000          ?        ?   256.0471  21.0712          ?        ?      159.8        6.6       ?       ? 
1 1 1   10    5   68 o    241.6    4.5    0.0000   0.0000          ?        ?   584.2473  21.7097          ?        ?      241.6        4.5       ?       ? 
1 1 1   10    5   69 o     22.3   11.2    0.0000   0.0000          ?        ?   -63.2136  21.7097          ?        ?       22.3       11.2       ?       ? 
1 1 1   10    5   70 o     21.7   10.9    0.0000   0.0000          ?        ?   -63.2136  21.0712          ?        ?       21.7       10.9       ?       ? 
1 1 1   10    5   71 o    332.4    3.6    0.0000   0.0000          ?        ?  1105.9194  23.6253          ?        ?      332.4        3.6       ?       ? 
1 1 1   10    5   72 o    200.6    5.7    0.0000   0.0000          ?        ?   403.5457  22.9868          ?        ?      200.6        5.7       ?       ? 
1 1 1   10    5   73 o     54.2   18.1    0.0000   0.0000          ?        ?    28.7335  22.9868          ?        ?       54.2       18.1       ?       ? 
1 1 1   10    5   74 o    107.3   10.1    0.0000   0.0000          ?        ?   116.2109  21.7097          ?        ?      107.3       10.1       ?       ? 
1 1 1   10    5   75 o     43.0   17.2    0.0000   0.0000          ?        ?    10.2163  22.3483          ?        ?       43.0       17.2       ?       ? 
1 1 1   10    5   76 o    199.7    5.4    0.0000   0.0000          ?        ?   400.3531  21.7097          ?        ?      199.7        5.4       ?       ? 
1 1 1   10    5   77 o     98.3   11.4    0.0000   0.0000          ?        ?    98.3323  22.3483          ?        ?       98.3       11.4       ?       ? 
1 1 1   10    5   78 o     72.7   15.8    0.0000   0.0000          ?        ?    56.8284  22.3483          ?        ?       72.7       15.8       ?       ? 
1 1 1   10    5   79 o    105.1   10.0    0.0000   0.0000          ?        ?   112.3798  21.0712          ?        ?      105.1       10.0       ?       ? 
1 1 1   10    5   80 o     30.0   14.0    0.0000   0.0000          ?        ?   -17.2401  20.4327          ?        ?       30.0       14.0       ?       ? 
1 1 1   10    5   81 o     24.9   12.2    0.0000   0.0000          ?        ?   -38.3113  20.4327          ?        ?       24.9       12.2       ?       ? 
1 1 1   10    6    0 o    920.1    5.3 8466.7969  98.3323  8466.7969  98.3323  8466.7969  98.3323      920.1      5.3      920.1        5.3     0.0     0.0 
1 1 1   10    6    1 o   2013.1    8.1    0.0000   0.0000          ?        ? 40533.9922 325.0075          ?        ?     2013.1        8.1       ?       ? 
1 1 1   10    6    2 o    328.4    1.6    0.0000   0.0000          ?        ?  1078.4630  10.2163          ?        ?      328.4        1.6       ?       ? 
1 1 1   10    6    3 o    150.8    1.3    0.0000   0.0000          ?        ?   227.3137   3.8311          ?        ?      150.8        1.3       ?       ? 
1 1 1   10    6    4 o    317.5    1.7    0.0000   0.0000          ?        ?  1008.2256  10.8549          ?        ?      317.5        1.7       ?       ? 
1 1 1   10    6    5 o   1555.3    5.1    0.0000   0.0000          ?        ? 24192.3086 157.7148          ?        ?     1555.3        5.1       ?       ? 
1 1 1   10    6    6 o    588.9    2.1    0.0000   0.0000          ?        ?  3468.4495  24.9023          ?        ?      588.9        2.1       ?       ? 
1 1 1   10    6    7 o   1216.6    4.1    0.0000   0.0000          ?        ? 14802.8477 100.2479          ?        ?     1216.6        4.1       ?       ? 
1 1 1   10    6    8 o   1111.9    3.8    0.0000   0.0000          ?        ? 12364.3330  83.6463          ?        ?     1111.9        3.8       ?       ? 
1 1 1   10    6    9 o   1112.4    3.7    0.0000   0.0000          ?        ? 12374.5488  83.0078          ?        ?     1112.4        3.7       ?       ? 
1 1 1   10    6   10 o    338.7    1.5    0.0000   0.0000          ?        ?  1147.4233  10.2163          ?        ?      338.7        1.5       ?       ? 
1 1 1   10    6   11 o    679.3    2.5    0.0000   0.0000          ?        ?  4613.9570  33.8416          ?        ?      679.3        2.5       ?       ? 
1 1 1   10    6   12 o    860.2    3.0    0.0000   0.0000          ?        ?  7400.4658  51.0817          ?        ?      860.2        3.0       ?       ? 
1 1 1   10    6   13 f    273.6    1.6    0.0000   0.0000          ?        ?   748.3474   8.9393          ?        ?      273.6        1.6       ?       ? 
1 1 1   10    6   14 o    383.2    1.7    0.0000   0.0000          ?        ?  1468.5997  13.4090          ?        ?      383.2        1.7       ?       ? 
1 1 1   10    6   15 f    252.8    1.6    0.0000   0.0000          ?        ?   639.1602   8.3008          ?        ?      252.8        1.6       ?       ? 
1 1 1   10    6   16 f    871.1    3.1    0.0000   0.0000          ?        ?  7588.1914  53.6358          ?        ?      871.1        3.1       ?       ? 
1 1 1   10    6   17 o    664.1    2.5    0.0000   0.0000          ?        ?  4410.9072  32.5646          ?        ?      664.1        2.5       ?       ? 
1 1 1   10    6   18 o   1132.7    3.9    0.0000   0.0000          ?        ? 12831.0918  88.1160          ?        ?     1132.7        3.9       ?       ? 
1 1 1   10    6   19 o    232.6    1.8    0.0000   0.0000          ?        ?   540.8278   8.3008          ?        ?      232.6        1.8       ?       ? 
1 1 1   10    6   20 o    606.1    2.3    0.0000   0.0000          ?        ?  3673.4148  27.4564          ?        ?      606.1        2.3       ?       ? 
1 1 1   10    6   21 o    507.5    2.0    0.0000   0.0000          ?        ?  2575.1577  20.4327          ?        ?      507.5        2.0       ?       ? 
1 1 1   10    6   22 o    499.0    2.1    0.0000   0.0000          ?        ?  2489.5957  21.0712          ?        ?      499.0        2.1       ?       ? 
1 1 1   10    6   23 o    915.4    3.2    0.0000   0.0000          ?        ?  8379.3193  58.1055          ?        ?      915.4        3.2       ?       ? 
1 1 1   10    6   24 o   1395.5    4.7    0.0000   0.0000          ?        ? 19476.8262 130.2584          ?        ?     1395.5        4.7       ?       ? 
1 1 1   10    6   25 o   1353.9    4.6    0.0000   0.0000          ?        ? 18331.3164 125.1502          ?        ?     1353.9        4.6       ?       ? 
1 1 1   10    6   26 o    381.9    2.1    0.0000   0.0000          ?        ?  1458.3833  15.9630          ?        ?      381.9        2.1       ?       ? 
1 1 1   10    6   27 o   1468.1    4.9    0.0000   0.0000          ?        ? 21553.9375 144.9444          ?        ?     1468.1        4.9       ?       ? 
1 1 1   10    6   28 o    913.0    3.5    0.0000   0.0000          ?        ?  8335.2617  63.2136          ?        ?      913.0        3.5       ?       ? 
1 1 1   10    6   29 o   1711.9    6.1    0.0000   0.0000          ?        ? 29309.4219 210.0736          ?        ?     1711.9        6.1       ?       ? 
1 1 1   10    6   30 o   1178.6    4.3    0.0000   0.0000          ?        ? 13892.3145 100.2479          ?        ?     1178.6        4.3       ?       ? 
1 1 1   10    6   31 o    471.1    2.5    0.0000   0.0000          ?        ?  2219.5012  23.6253          ?        ?      471.1        2.5       ?       ? 
1 1 1   10    6   32 o    709.7    2.7    0.0000   0.0000          ?        ?  5037.2974  38.9498          ?        ?      709.7        2.7       ?       ? 
1 1 1   10    6   33 o    663.7    3.0    0.0000   0.0000          ?        ?  4404.5220  40.2269          ?        ?      663.7        3.0       ?       ? 
1 1 1   10    6   34 o    855.6    3.2    0.0000   0.0000          ?        ?  7320.6504  55.5514          ?        ?      855.6        3.2       ?       ? 
1 1 1   10    6   35 o   1630.9    5.5    0.0000   0.0000          ?        ? 26601.4492 179.4246          ?        ?     1630.9        5.5       ?       ? 
1 1 1   10    6   36 o    510.7    2.6    0.0000   0.0000          ?        ?  2607.7222  26.1794          ?        ?      510.7        2.6       ?       ? 
1 1 1   10    6   37 o   1393.2    4.7    0.0000   0.0000          ?        ? 19411.0566 130.2584          ?        ?     1393.2        4.7       ?       ? 
1 1 1   10    6   38 o    390.2    2.5    0.0000   0.0000          ?        ?  1522.2355  19.7942          ?        ?      390.2        2.5       ?       ? 
1 1 1   10    6   39 o   1401.7    4.8    0.0000   0.0000          ?        ? 19649.2266 135.3666          ?        ?     1401.7        4.8       ?       ? 
1 1 1   10    6   40 o    405.8    2.5    0.0000   0.0000          ?        ?  1646.7472  20.4327          ?        ?      405.8        2.5       ?       ? 
1 1 1   10    6   41 o    984.9    3.6    0.0000   0.0000          ?        ?  9700.4199  70.2374          ?        ?      984.9        3.6       ?       ? 
1 1 1   10    6   42 o    720.4    3.0    0.0000   0.0000          ?        ?  5190.5425  42.7809          ?        ?      720.4        3.0       ?       ? 
1 1 1   10    6   43 o    389.9    2.8    0.0000   0.0000          ?        ?  1520.3201  21.7097          ?        ?      389.9        2.8       ?       ? 
1 1 1   10    6   44 o    397.6    3.1    0.0000   0.0000          ?        ?  1580.9796  24.9023          ?        ?      397.6        3.1       ?       ? 
1 1 1   10    6   45 o    855.5    3.2    0.0000   0.0000          ?        ?  7320.0122  55.5514          ?        ?      855.5        3.2       ?       ? 
1 1 1   10    6   46 o    396.0    3.1    0.0000   0.0000          ?        ?  1568.2091  24.2638          ?        ?      396.0        3.1       ?       ? 
1 1 1   10    6   47 o   1279.1    4.5    0.0000   0.0000          ?        ? 16364.6699 114.2954          ?        ?     1279.1        4.5       ?       ? 
1 1 1   10    6   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    6   49 o     31.0   14.2    0.0000   0.0000          ?        ?   -14.0475  19.7942          ?        ?       31.0       14.2       ?       ? 
1 1 1   10    6   50 o    856.5    3.3    0.0000   0.0000          ?        ?  7336.6133  56.8284          ?        ?      856.5        3.3       ?       ? 
1 1 1   10    6   51 o    691.1    2.9    0.0000   0.0000          ?        ?  4776.1416  40.2269          ?        ?      691.1        2.9       ?       ? 
1 1 1   10    6   52 o    530.6    2.6    0.0000   0.0000          ?        ?  2815.8804  27.4564          ?        ?      530.6        2.6       ?       ? 
1 1 1   10    6   53 o    554.0    2.7    0.0000   0.0000          ?        ?  3070.0120  30.0105          ?        ?      554.0        2.7       ?       ? 
1 1 1   10    6   54 o    214.5    4.6    0.0000   0.0000          ?        ?   460.3741  19.7942          ?        ?      214.5        4.6       ?       ? 
1 1 1   10    6   55 o     25.9   12.4    0.0000   0.0000          ?        ?   -26.8179  18.5171          ?        ?       25.9       12.4       ?       ? 
1 1 1   10    6   56 o    318.8    3.1    0.0000   0.0000          ?        ?  1016.5264  19.7942          ?        ?      318.8        3.1       ?       ? 
1 1 1   10    6   57 o    504.0    2.7    0.0000   0.0000          ?        ?  2540.6775  27.4564          ?        ?      504.0        2.7       ?       ? 
1 1 1   10    6   58 o    253.4    4.0    0.0000   0.0000          ?        ?   642.3527  20.4327          ?        ?      253.4        4.0       ?       ? 
1 1 1   10    6   59 o    243.9    4.2    0.0000   0.0000          ?        ?   595.1021  20.4327          ?        ?      243.9        4.2       ?       ? 
1 1 1   10    6   60 o    330.7    3.2    0.0000   0.0000          ?        ?  1093.7876  21.0712          ?        ?      330.7        3.2       ?       ? 
1 1 1   10    6   61 f    220.1    4.5    0.0000   0.0000          ?        ?   484.6379  19.7942          ?        ?      220.1        4.5       ?       ? 
1 1 1   10    6   62 o     44.6   16.6    0.0000   0.0000          ?        ?    15.3245  19.7942          ?        ?       44.6       16.6       ?       ? 
1 1 1   10    6   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    6   64 o    348.1    3.2    0.0000   0.0000          ?        ?  1212.5525  22.3483          ?        ?      348.1        3.2       ?       ? 
1 1 1   10    6   65 o    225.1    4.3    0.0000   0.0000          ?        ?   506.9862  19.1556          ?        ?      225.1        4.3       ?       ? 
1 1 1   10    6   66 o    409.5    2.9    0.0000   0.0000          ?        ?  1678.0348  23.6253          ?        ?      409.5        2.9       ?       ? 
1 1 1   10    6   67 o     19.7   10.0    0.0000   0.0000          ?        ?   -70.2374  19.7942          ?        ?       19.7       10.0       ?       ? 
1 1 1   10    6   68 o     63.7   16.4    0.0000   0.0000          ?        ?    42.7809  21.0712          ?        ?       63.7       16.4       ?       ? 
1 1 1   10    6   69 o    271.8    4.0    0.0000   0.0000          ?        ?   739.4081  21.7097          ?        ?      271.8        4.0       ?       ? 
1 1 1   10    6   70 o    268.8    4.2    0.0000   0.0000          ?        ?   723.4450  22.3483          ?        ?      268.8        4.2       ?       ? 
1 1 1   10    6   71 o    140.4    7.5    0.0000   0.0000          ?        ?   197.9417  21.0712          ?        ?      140.4        7.5       ?       ? 
1 1 1   10    6   72 o    271.5    4.0    0.0000   0.0000          ?        ?   738.1310  21.7097          ?        ?      271.5        4.0       ?       ? 
1 1 1   10    6   73 o    129.2    8.2    0.0000   0.0000          ?        ?   167.9312  21.0712          ?        ?      129.2        8.2       ?       ? 
1 1 1   10    6   74 o     57.6   17.4    0.0000   0.0000          ?        ?    34.4802  21.7097          ?        ?       57.6       17.4       ?       ? 
1 1 1   10    6   75 o     33.5   15.2    0.0000   0.0000          ?        ?   -12.7704  22.3483          ?        ?       33.5       15.2       ?       ? 
1 1 1   10    6   76 o    239.1    4.7    0.0000   0.0000          ?        ?   573.3925  22.3483          ?        ?      239.1        4.7       ?       ? 
1 1 1   10    6   77 o    172.5    6.7    0.0000   0.0000          ?        ?   299.4666  22.9868          ?        ?      172.5        6.7       ?       ? 
1 1 1   10    6   78 o     48.8   17.5    0.0000   0.0000          ?        ?    21.7097  21.7097          ?        ?       48.8       17.5       ?       ? 
1 1 1   10    6   79 o     78.4   13.0    0.0000   0.0000          ?        ?    63.2136  20.4327          ?        ?       78.4       13.0       ?       ? 
1 1 1   10    6   80 o    117.4    9.0    0.0000   0.0000          ?        ?   139.8362  21.0712          ?        ?      117.4        9.0       ?       ? 
1 1 1   10    7    0 o   1027.7    5.7 10563.0635 118.1265 10563.0635 118.1265 10563.0635 118.1265     1027.7      5.7     1027.7        5.7     0.0     0.0 
1 1 1   10    7    1 o    579.0    2.5    0.0000   0.0000          ?        ?  3352.2385  29.3720          ?        ?      579.0        2.5       ?       ? 
1 1 1   10    7    2 o   2018.8    7.5    0.0000   0.0000          ?        ? 40763.8594 303.9363          ?        ?     2018.8        7.5       ?       ? 
1 1 1   10    7    3 o    918.8    3.4    0.0000   0.0000          ?        ?  8441.8945  62.5751          ?        ?      918.8        3.4       ?       ? 
1 1 1   10    7    4 o    713.8    2.5    0.0000   0.0000          ?        ?  5094.7642  36.3957          ?        ?      713.8        2.5       ?       ? 
1 1 1   10    7    5 o   1151.1    3.9    0.0000   0.0000          ?        ? 13251.2393  90.6701          ?        ?     1151.1        3.9       ?       ? 
1 1 1   10    7    6 o    335.8    1.8    0.0000   0.0000          ?        ?  1127.6293  12.1319          ?        ?      335.8        1.8       ?       ? 
1 1 1   10    7    7 o    430.7    1.9    0.0000   0.0000          ?        ?  1854.9053  15.9630          ?        ?      430.7        1.9       ?       ? 
1 1 1   10    7    8 o    589.6    2.2    0.0000   0.0000          ?        ?  3476.1118  25.5409          ?        ?      589.6        2.2       ?       ? 
1 1 1   10    7    9 o    853.8    3.0    0.0000   0.0000          ?        ?  7290.0010  51.7203          ?        ?      853.8        3.0       ?       ? 
1 1 1   10    7   10 o    683.9    2.5    0.0000   0.0000          ?        ?  4677.8091  33.8416          ?        ?      683.9        2.5       ?       ? 
1 1 1   10    7   11 o   1824.6    5.9    0.0000   0.0000          ?        ? 33297.6250 215.8203          ?        ?     1824.6        5.9       ?       ? 
1 1 1   10    7   12 o   1048.6    3.7    0.0000   0.0000          ?        ? 10995.9805  76.6226          ?        ?     1048.6        3.7       ?       ? 
1 1 1   10    7   13 f   1149.1    4.0    0.0000   0.0000          ?        ? 13204.6270  91.3086          ?        ?     1149.1        4.0       ?       ? 
1 1 1   10    7   14 o    337.6    1.6    0.0000   0.0000          ?        ?  1139.7611  10.8549          ?        ?      337.6        1.6       ?       ? 
1 1 1   10    7   15 o    216.8    1.8    0.0000   0.0000          ?        ?   469.9519   7.6623          ?        ?      216.8        1.8       ?       ? 
1 1 1   10    7   16 o   1784.2    5.8    0.0000   0.0000          ?        ? 31839.8809 206.8810          ?        ?     1784.2        5.8       ?       ? 
1 1 1   10    7   17 o     17.0    7.5    0.0000   0.0000          ?        ?    -1.9156   5.1082          ?        ?       17.0        7.5       ?       ? 
1 1 1   10    7   18 o    752.1    2.7    0.0000   0.0000          ?        ?  5657.3018  40.8654          ?        ?      752.1        2.7       ?       ? 
1 1 1   10    7   19 o    346.2    1.8    0.0000   0.0000          ?        ?  1198.5051  12.1319          ?        ?      346.2        1.8       ?       ? 
1 1 1   10    7   20 o    402.6    1.9    0.0000   0.0000          ?        ?  1621.2064  15.3245          ?        ?      402.6        1.9       ?       ? 
1 1 1   10    7   21 o    101.1    3.5    0.0000   0.0000          ?        ?   102.1635   7.0237          ?        ?      101.1        3.5       ?       ? 
1 1 1   10    7   22 o    647.3    2.5    0.0000   0.0000          ?        ?  4190.6172  31.9261          ?        ?      647.3        2.5       ?       ? 
1 1 1   10    7   23 o   1279.7    4.3    0.0000   0.0000          ?        ? 16378.7188 110.4642          ?        ?     1279.7        4.3       ?       ? 
1 1 1   10    7   24 o    530.9    2.2    0.0000   0.0000          ?        ?  2818.4343  23.6253          ?        ?      530.9        2.2       ?       ? 
1 1 1   10    7   25 o    660.8    2.6    0.0000   0.0000          ?        ?  4366.8496  34.4802          ?        ?      660.8        2.6       ?       ? 
1 1 1   10    7   26 o   1861.5    6.1    0.0000   0.0000          ?        ? 34657.6758 225.3981          ?        ?     1861.5        6.1       ?       ? 
1 1 1   10    7   27 o   1501.9    5.1    0.0000   0.0000          ?        ? 22558.3301 152.6067          ?        ?     1501.9        5.1       ?       ? 
1 1 1   10    7   28 o    802.5    3.1    0.0000   0.0000          ?        ?  6439.4907  49.1662          ?        ?      802.5        3.1       ?       ? 
1 1 1   10    7   29 o   1948.3    6.8    0.0000   0.0000          ?        ? 37963.9414 264.3480          ?        ?     1948.3        6.8       ?       ? 
1 1 1   10    7   30 o   2171.8   12.1    0.0000   0.0000          ?        ? 47188.6641 526.1418          ?        ?     2171.8       12.1       ?       ? 
1 1 1   10    7   31 o   2026.0    9.0    0.0000   0.0000          ?        ? 41056.9414 363.9573          ?        ?     2026.0        9.0       ?       ? 
1 1 1   10    7   32 o   1275.6    4.5    0.0000   0.0000          ?        ? 16272.7236 114.9339          ?        ?     1275.6        4.5       ?       ? 
1 1 1   10    7   33 o    639.3    2.9    0.0000   0.0000          ?        ?  4087.1768  37.6728          ?        ?      639.3        2.9       ?       ? 
1 1 1   10    7   34 o    670.6    2.7    0.0000   0.0000          ?        ?  4497.1079  35.7572          ?        ?      670.6        2.7       ?       ? 
1 1 1   10    7   35 o   1207.2    4.1    0.0000   0.0000          ?        ? 14573.6172  99.6094          ?        ?     1207.2        4.1       ?       ? 
1 1 1   10    7   36 o   1934.4    6.3    0.0000   0.0000          ?        ? 37426.9453 243.9153          ?        ?     1934.4        6.3       ?       ? 
1 1 1   10    7   37 f    242.0    3.3    0.0000   0.0000          ?        ?   585.5243  15.9630          ?        ?      242.0        3.3       ?       ? 
1 1 1   10    7   38 o    710.1    2.8    0.0000   0.0000          ?        ?  5043.0439  39.5883          ?        ?      710.1        2.8       ?       ? 
1 1 1   10    7   39 o    435.0    2.6    0.0000   0.0000          ?        ?  1891.9395  22.3483          ?        ?      435.0        2.6       ?       ? 
1 1 1   10    7   40 o    616.5    2.7    0.0000   0.0000          ?        ?  3800.4807  33.8416          ?        ?      616.5        2.7       ?       ? 
1 1 1   10    7   41 o    251.0    3.7    0.0000   0.0000          ?        ?   630.2208  18.5171          ?        ?      251.0        3.7       ?       ? 
1 1 1   10    7   42 o    506.2    3.0    0.0000   0.0000          ?        ?  2562.3872  30.0105          ?        ?      506.2        3.0       ?       ? 
1 1 1   10    7   43 o   1034.9    4.0    0.0000   0.0000          ?        ? 10711.2002  82.3693          ?        ?     1034.9        4.0       ?       ? 
1 1 1   10    7   44 o    604.4    2.8    0.0000   0.0000          ?        ?  3653.6208  33.8416          ?        ?      604.4        2.8       ?       ? 
1 1 1   10    7   45 f   1078.7    3.8    0.0000   0.0000          ?        ? 11637.0566  81.7308          ?        ?     1078.7        3.8       ?       ? 
1 1 1   10    7   46 o    208.2    4.6    0.0000   0.0000          ?        ?   433.5562  19.1556          ?        ?      208.2        4.6       ?       ? 
1 1 1   10    7   47 o    746.1    3.0    0.0000   0.0000          ?        ?  5567.2700  44.0580          ?        ?      746.1        3.0       ?       ? 
1 1 1   10    7   48 o     22.8   11.3    0.0000   0.0000          ?        ?   -44.6965  19.1556          ?        ?       22.8       11.3       ?       ? 
1 1 1   10    7   49 o    362.1    2.9    0.0000   0.0000          ?        ?  1311.5234  21.0712          ?        ?      362.1        2.9       ?       ? 
1 1 1   10    7   50 o    190.7    5.2    0.0000   0.0000          ?        ?   363.9573  19.7942          ?        ?      190.7        5.2       ?       ? 
1 1 1   10    7   51 o    426.9    2.8    0.0000   0.0000          ?        ?  1822.9792  23.6253          ?        ?      426.9        2.8       ?       ? 
1 1 1   10    7   52 o    710.5    2.9    0.0000   0.0000          ?        ?  5048.7905  40.8654          ?        ?      710.5        2.9       ?       ? 
1 1 1   10    7   53 o    377.3    2.9    0.0000   0.0000          ?        ?  1423.9032  21.7097          ?        ?      377.3        2.9       ?       ? 
1 1 1   10    7   54 o     37.5   15.4    0.0000   0.0000          ?        ?     4.4697  18.5171          ?        ?       37.5       15.4       ?       ? 
1 1 1   10    7   55 o    466.5    2.7    0.0000   0.0000          ?        ?  2176.7202  24.9023          ?        ?      466.5        2.7       ?       ? 
1 1 1   10    7   56 o    583.0    2.7    0.0000   0.0000          ?        ?  3399.4893  31.9261          ?        ?      583.0        2.7       ?       ? 
1 1 1   10    7   57 o     70.0   14.6    0.0000   0.0000          ?        ?    51.0817  19.7942          ?        ?       70.0       14.6       ?       ? 
1 1 1   10    7   58 o    195.8    4.9    0.0000   0.0000          ?        ?   383.7515  19.1556          ?        ?      195.8        4.9       ?       ? 
1 1 1   10    7   59 o    257.3    4.0    0.0000   0.0000          ?        ?   662.1469  20.4327          ?        ?      257.3        4.0       ?       ? 
1 1 1   10    7   60 o    478.0    3.1    0.0000   0.0000          ?        ?  2285.2688  29.3720          ?        ?      478.0        3.1       ?       ? 
1 1 1   10    7   61 o    216.7    4.6    0.0000   0.0000          ?        ?   469.9519  19.7942          ?        ?      216.7        4.6       ?       ? 
1 1 1   10    7   62 o    330.8    3.2    0.0000   0.0000          ?        ?  1095.0646  21.0712          ?        ?      330.8        3.2       ?       ? 
1 1 1   10    7   63 o     20.3   10.3    0.0000   0.0000          ?        ?   -60.6596  19.1556          ?        ?       20.3       10.3       ?       ? 
1 1 1   10    7   64 o    529.3    2.9    0.0000   0.0000          ?        ?  2803.1099  30.6490          ?        ?      529.3        2.9       ?       ? 
1 1 1   10    7   65 o    326.1    3.4    0.0000   0.0000          ?        ?  1064.4155  22.3483          ?        ?      326.1        3.4       ?       ? 
1 1 1   10    7   66 o    204.4    4.8    0.0000   0.0000          ?        ?   418.2317  19.7942          ?        ?      204.4        4.8       ?       ? 
1 1 1   10    7   67 o    245.1    4.4    0.0000   0.0000          ?        ?   601.4874  21.7097          ?        ?      245.1        4.4       ?       ? 
1 1 1   10    7   68 o     71.5   14.8    0.0000   0.0000          ?        ?    53.6358  20.4327          ?        ?       71.5       14.8       ?       ? 
1 1 1   10    7   69 o     28.9   13.6    0.0000   0.0000          ?        ?   -22.3483  20.4327          ?        ?       28.9       13.6       ?       ? 
1 1 1   10    7   70 f    155.5    7.0    0.0000   0.0000          ?        ?   242.6382  21.7097          ?        ?      155.5        7.0       ?       ? 
1 1 1   10    7   71 o     59.9   16.9    0.0000   0.0000          ?        ?    37.6728  21.0712          ?        ?       59.9       16.9       ?       ? 
1 1 1   10    7   72 o    403.0    3.0    0.0000   0.0000          ?        ?  1625.0376  24.2638          ?        ?      403.0        3.0       ?       ? 
1 1 1   10    7   73 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    7   74 o     27.6   13.4    0.0000   0.0000          ?        ?   -40.8654  23.6253          ?        ?       27.6       13.4       ?       ? 
1 1 1   10    7   75 o    233.2    4.7    0.0000   0.0000          ?        ?   545.2975  21.7097          ?        ?      233.2        4.7       ?       ? 
1 1 1   10    7   76 o    286.7    3.8    0.0000   0.0000          ?        ?   823.6929  21.7097          ?        ?      286.7        3.8       ?       ? 
1 1 1   10    7   77 f     20.8   10.5    0.0000   0.0000          ?        ?   -70.2374  21.0712          ?        ?       20.8       10.5       ?       ? 
1 1 1   10    7   78 o    237.7    4.8    0.0000   0.0000          ?        ?   567.0072  22.9868          ?        ?      237.7        4.8       ?       ? 
1 1 1   10    7   79 o     29.3   13.9    0.0000   0.0000          ?        ?   -24.2638  21.7097          ?        ?       29.3       13.9       ?       ? 
1 1 1   10    7   80 o    130.1    8.6    0.0000   0.0000          ?        ?   171.7623  22.3483          ?        ?      130.1        8.6       ?       ? 
1 1 1   10    8    0 o    241.9    2.2  585.5243  10.8549   585.5243  10.8549   585.5243  10.8549      241.9      2.2      241.9        2.2     0.0     0.0 
1 1 1   10    8    1 o   1193.7    4.6    0.0000   0.0000          ?        ? 14249.2490 110.4642          ?        ?     1193.7        4.6       ?       ? 
1 1 1   10    8    2 o   1174.0    4.7    0.0000   0.0000          ?        ? 13783.1289 111.1028          ?        ?     1174.0        4.7       ?       ? 
1 1 1   10    8    3 o   1567.8    5.8    0.0000   0.0000          ?        ? 24583.7227 182.6172          ?        ?     1567.8        5.8       ?       ? 
1 1 1   10    8    4 f    495.3    1.9    0.0000   0.0000          ?        ?  2453.2002  19.1556          ?        ?      495.3        1.9       ?       ? 
1 1 1   10    8    5 o    954.8    3.4    0.0000   0.0000          ?        ?  9117.4502  65.1292          ?        ?      954.8        3.4       ?       ? 
1 1 1   10    8    6 o    279.9    1.5    0.0000   0.0000          ?        ?   783.4660   8.3008          ?        ?      279.9        1.5       ?       ? 
1 1 1   10    8    7 o    601.2    2.5    0.0000   0.0000          ?        ?  3614.0325  30.0105          ?        ?      601.2        2.5       ?       ? 
1 1 1   10    8    8 o   1106.9    3.7    0.0000   0.0000          ?        ? 12251.9531  82.3693          ?        ?     1106.9        3.7       ?       ? 
1 1 1   10    8    9 o   1039.6    3.5    0.0000   0.0000          ?        ? 10808.8945  73.4300          ?        ?     1039.6        3.5       ?       ? 
1 1 1   10    8   10 o   1187.1    4.0    0.0000   0.0000          ?        ? 14093.4492  93.8627          ?        ?     1187.1        4.0       ?       ? 
1 1 1   10    8   11 o    475.8    1.9    0.0000   0.0000          ?        ?  2264.1978  18.5171          ?        ?      475.8        1.9       ?       ? 
1 1 1   10    8   12 o    181.2    1.6    0.0000   0.0000          ?        ?   328.2001   5.7467          ?        ?      181.2        1.6       ?       ? 
1 1 1   10    8   13 o    353.2    1.6    0.0000   0.0000          ?        ?  1247.6713  11.4934          ?        ?      353.2        1.6       ?       ? 
1 1 1   10    8   14 o    236.9    1.9    0.0000   0.0000          ?        ?   561.2605   8.9393          ?        ?      236.9        1.9       ?       ? 
1 1 1   10    8   15 o    269.8    1.5    0.0000   0.0000          ?        ?   727.9147   8.3008          ?        ?      269.8        1.5       ?       ? 
1 1 1   10    8   16 o    579.3    2.3    0.0000   0.0000          ?        ?  3356.0696  26.8179          ?        ?      579.3        2.3       ?       ? 
1 1 1   10    8   17 o    452.7    1.9    0.0000   0.0000          ?        ?  2049.0159  17.2401          ?        ?      452.7        1.9       ?       ? 
1 1 1   10    8   18 o   1346.8    4.5    0.0000   0.0000          ?        ? 18140.3984 121.3191          ?        ?     1346.8        4.5       ?       ? 
1 1 1   10    8   19 o    560.5    2.3    0.0000   0.0000          ?        ?  3142.1650  25.5409          ?        ?      560.5        2.3       ?       ? 
1 1 1   10    8   20 o   1060.8    3.6    0.0000   0.0000          ?        ? 11252.6670  76.6226          ?        ?     1060.8        3.6       ?       ? 
1 1 1   10    8   21 o    163.4    2.7    0.0000   0.0000          ?        ?   266.9020   8.9393          ?        ?      163.4        2.7       ?       ? 
1 1 1   10    8   22 o   1136.0    3.9    0.0000   0.0000          ?        ? 12905.7988  88.1160          ?        ?     1136.0        3.9       ?       ? 
1 1 1   10    8   23 o   1442.3    4.8    0.0000   0.0000          ?        ? 20805.5879 138.5592          ?        ?     1442.3        4.8       ?       ? 
1 1 1   10    8   24 o    826.4    3.0    0.0000   0.0000          ?        ?  6830.2656  49.1662          ?        ?      826.4        3.0       ?       ? 
1 1 1   10    8   25 o    615.9    2.4    0.0000   0.0000          ?        ?  3793.4568  30.0105          ?        ?      615.9        2.4       ?       ? 
1 1 1   10    8   26 o    359.1    2.0    0.0000   0.0000          ?        ?  1289.8137  14.6860          ?        ?      359.1        2.0       ?       ? 
1 1 1   10    8   27 o   1063.3    4.0    0.0000   0.0000          ?        ? 11306.3018  84.9234          ?        ?     1063.3        4.0       ?       ? 
1 1 1   10    8   28 o   1469.7    5.2    0.0000   0.0000          ?        ? 21601.1875 152.6067          ?        ?     1469.7        5.2       ?       ? 
1 1 1   10    8   29 o   1647.0    5.8    0.0000   0.0000          ?        ? 27129.5059 190.9180          ?        ?     1647.0        5.8       ?       ? 
1 1 1   10    8   30 o    380.2    2.8    0.0000   0.0000          ?        ?  1445.6129  21.0712          ?        ?      380.2        2.8       ?       ? 
1 1 1   10    8   31 o   1556.8    5.8    0.0000   0.0000          ?        ? 24238.9199 180.7016          ?        ?     1556.8        5.8       ?       ? 
1 1 1   10    8   32 f   1498.6    5.1    0.0000   0.0000          ?        ? 22458.7207 153.2452          ?        ?     1498.6        5.1       ?       ? 
1 1 1   10    8   33 o   1306.0    4.7    0.0000   0.0000          ?        ? 17056.8281 121.9576          ?        ?     1306.0        4.7       ?       ? 
1 1 1   10    8   34 o    530.3    2.4    0.0000   0.0000          ?        ?  2812.0493  25.5409          ?        ?      530.3        2.4       ?       ? 
1 1 1   10    8   35 o   1640.4    5.4    0.0000   0.0000          ?        ? 26911.7715 176.8705          ?        ?     1640.4        5.4       ?       ? 
1 1 1   10    8   36 o    341.7    3.0    0.0000   0.0000          ?        ?  1167.8560  20.4327          ?        ?      341.7        3.0       ?       ? 
1 1 1   10    8   37 o    228.4    3.8    0.0000   0.0000          ?        ?   521.6721  17.2401          ?        ?      228.4        3.8       ?       ? 
1 1 1   10    8   38 o    776.9    3.0    0.0000   0.0000          ?        ?  6035.3066  45.9736          ?        ?      776.9        3.0       ?       ? 
1 1 1   10    8   39 o   1326.2    4.5    0.0000   0.0000          ?        ? 17588.7168 120.0421          ?        ?     1326.2        4.5       ?       ? 
1 1 1   10    8   40 o    717.7    2.9    0.0000   0.0000          ?        ?  5150.9541  42.1424          ?        ?      717.7        2.9       ?       ? 
1 1 1   10    8   41 o    530.7    2.7    0.0000   0.0000          ?        ?  2816.5190  28.7335          ?        ?      530.7        2.7       ?       ? 
1 1 1   10    8   42 o   1354.2    4.6    0.0000   0.0000          ?        ? 18340.8945 125.1502          ?        ?     1354.2        4.6       ?       ? 
1 1 1   10    8   43 o    376.5    3.0    0.0000   0.0000          ?        ?  1417.5181  22.3483          ?        ?      376.5        3.0       ?       ? 
1 1 1   10    8   44 o    339.0    3.6    0.0000   0.0000          ?        ?  1149.3389  24.2638          ?        ?      339.0        3.6       ?       ? 
1 1 1   10    8   45 o    651.0    2.7    0.0000   0.0000          ?        ?  4238.5063  35.7572          ?        ?      651.0        2.7       ?       ? 
1 1 1   10    8   46 o    217.6    4.5    0.0000   0.0000          ?        ?   473.7830  19.7942          ?        ?      217.6        4.5       ?       ? 
1 1 1   10    8   47 o    428.9    2.7    0.0000   0.0000          ?        ?  1839.5808  22.9868          ?        ?      428.9        2.7       ?       ? 
1 1 1   10    8   48 o    360.1    3.3    0.0000   0.0000          ?        ?  1296.8374  23.6253          ?        ?      360.1        3.3       ?       ? 
1 1 1   10    8   49 o     85.6   10.1    0.0000   0.0000          ?        ?    73.4300  17.2401          ?        ?       85.6       10.1       ?       ? 
1 1 1   10    8   50 o    820.2    3.2    0.0000   0.0000          ?        ?  6728.7412  51.7203          ?        ?      820.2        3.2       ?       ? 
1 1 1   10    8   51 o    150.1    6.2    0.0000   0.0000          ?        ?   225.3981  18.5171          ?        ?      150.1        6.2       ?       ? 
1 1 1   10    8   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    8   53 o    201.2    4.4    0.0000   0.0000          ?        ?   404.8227  17.8786          ?        ?      201.2        4.4       ?       ? 
1 1 1   10    8   54 o    390.8    2.9    0.0000   0.0000          ?        ?  1527.3438  22.9868          ?        ?      390.8        2.9       ?       ? 
1 1 1   10    8   55 o    423.8    2.8    0.0000   0.0000          ?        ?  1796.1613  23.6253          ?        ?      423.8        2.8       ?       ? 
1 1 1   10    8   56 o    269.7    3.7    0.0000   0.0000          ?        ?   727.9147  19.7942          ?        ?      269.7        3.7       ?       ? 
1 1 1   10    8   57 o     68.7   14.0    0.0000   0.0000          ?        ?    49.1662  18.5171          ?        ?       68.7       14.0       ?       ? 
1 1 1   10    8   58 o    277.0    3.9    0.0000   0.0000          ?        ?   767.5030  21.7097          ?        ?      277.0        3.9       ?       ? 
1 1 1   10    8   59 o    506.1    2.8    0.0000   0.0000          ?        ?  2562.3872  28.0950          ?        ?      506.1        2.8       ?       ? 
1 1 1   10    8   60 o    510.7    2.8    0.0000   0.0000          ?        ?  2608.9995  28.0950          ?        ?      510.7        2.8       ?       ? 
1 1 1   10    8   61 o    493.9    2.7    0.0000   0.0000          ?        ?  2440.4297  26.1794          ?        ?      493.9        2.7       ?       ? 
1 1 1   10    8   62 o    328.4    3.3    0.0000   0.0000          ?        ?  1079.1016  21.7097          ?        ?      328.4        3.3       ?       ? 
1 1 1   10    8   63 o    351.0    3.1    0.0000   0.0000          ?        ?  1232.3467  21.7097          ?        ?      351.0        3.1       ?       ? 
1 1 1   10    8   64 o    251.3    4.2    0.0000   0.0000          ?        ?   632.1364  21.0712          ?        ?      251.3        4.2       ?       ? 
1 1 1   10    8   65 o    187.1    5.5    0.0000   0.0000          ?        ?   350.5484  20.4327          ?        ?      187.1        5.5       ?       ? 
1 1 1   10    8   66 o    114.7    8.3    0.0000   0.0000          ?        ?   132.1740  19.1556          ?        ?      114.7        8.3       ?       ? 
1 1 1   10    8   67 o    193.9    5.3    0.0000   0.0000          ?        ?   376.7278  20.4327          ?        ?      193.9        5.3       ?       ? 
1 1 1   10    8   68 o    487.4    2.8    0.0000   0.0000          ?        ?  2377.2158  27.4564          ?        ?      487.4        2.8       ?       ? 
1 1 1   10    8   69 o    148.4    7.3    0.0000   0.0000          ?        ?   220.9285  21.7097          ?        ?      148.4        7.3       ?       ? 
1 1 1   10    8   70 o     23.6   11.7    0.0000   0.0000          ?        ?   -46.6121  20.4327          ?        ?       23.6       11.7       ?       ? 
1 1 1   10    8   71 o     26.8   12.8    0.0000   0.0000          ?        ?   -28.0950  19.7942          ?        ?       26.8       12.8       ?       ? 
1 1 1   10    8   72 o     27.3   13.1    0.0000   0.0000          ?        ?   -31.2876  21.0712          ?        ?       27.3       13.1       ?       ? 
1 1 1   10    8   73 o    293.5    3.9    0.0000   0.0000          ?        ?   862.6428  22.9868          ?        ?      293.5        3.9       ?       ? 
1 1 1   10    8   74 o    397.3    3.1    0.0000   0.0000          ?        ?  1579.7025  24.9023          ?        ?      397.3        3.1       ?       ? 
1 1 1   10    8   75 o    152.4    7.1    0.0000   0.0000          ?        ?   233.6989  21.7097          ?        ?      152.4        7.1       ?       ? 
1 1 1   10    8   76 o    178.3    6.1    0.0000   0.0000          ?        ?   319.2608  21.7097          ?        ?      178.3        6.1       ?       ? 
1 1 1   10    8   77 o     59.9   17.2    0.0000   0.0000          ?        ?    38.3113  21.7097          ?        ?       59.9       17.2       ?       ? 
1 1 1   10    8   78 o     25.0   12.2    0.0000   0.0000          ?        ?   -35.1187  19.7942          ?        ?       25.0       12.2       ?       ? 
1 1 1   10    8   79 o     93.1   11.3    0.0000   0.0000          ?        ?    88.7545  21.0712          ?        ?       93.1       11.3       ?       ? 
1 1 1   10    8   80 o     41.6   16.7    0.0000   0.0000          ?        ?    10.2163  21.0712          ?        ?       41.6       16.7       ?       ? 
1 1 1   10    9    0 o    178.4    2.7  318.6223   9.5778   318.6223   9.5778   318.6223   9.5778      178.4      2.7      178.4        2.7     0.0     0.0 
1 1 1   10    9    1 o    688.6    3.2    0.0000   0.0000          ?        ?  4741.6616  43.4195          ?        ?      688.6        3.2       ?       ? 
1 1 1   10    9    2 o    684.6    2.7    0.0000   0.0000          ?        ?  4686.7485  37.0343          ?        ?      684.6        2.7       ?       ? 
1 1 1   10    9    3 o    976.9    3.5    0.0000   0.0000          ?        ?  9544.6221  68.3218          ?        ?      976.9        3.5       ?       ? 
1 1 1   10    9    4 o    587.1    2.8    0.0000   0.0000          ?        ?  3446.7397  32.5646          ?        ?      587.1        2.8       ?       ? 
1 1 1   10    9    5 o    362.3    1.9    0.0000   0.0000          ?        ?  1312.8005  14.0475          ?        ?      362.3        1.9       ?       ? 
1 1 1   10    9    6 o    784.8    2.7    0.0000   0.0000          ?        ?  6159.8184  42.7809          ?        ?      784.8        2.7       ?       ? 
1 1 1   10    9    7 o    702.3    2.5    0.0000   0.0000          ?        ?  4931.9414  35.7572          ?        ?      702.3        2.5       ?       ? 
1 1 1   10    9    8 o    979.1    3.3    0.0000   0.0000          ?        ?  9586.7637  65.1292          ?        ?      979.1        3.3       ?       ? 
1 1 1   10    9    9 o    471.9    1.9    0.0000   0.0000          ?        ?  2226.5249  17.8786          ?        ?      471.9        1.9       ?       ? 
1 1 1   10    9   10 o   1435.0    4.8    0.0000   0.0000          ?        ? 20595.5156 139.1977          ?        ?     1435.0        4.8       ?       ? 
1 1 1   10    9   11 o    815.9    2.9    0.0000   0.0000          ?        ?  6657.2266  47.8891          ?        ?      815.9        2.9       ?       ? 
1 1 1   10    9   12 o   1240.8    4.1    0.0000   0.0000          ?        ? 15396.0332 102.8020          ?        ?     1240.8        4.1       ?       ? 
1 1 1   10    9   13 o    685.1    2.5    0.0000   0.0000          ?        ?  4693.1338  33.8416          ?        ?      685.1        2.5       ?       ? 
1 1 1   10    9   14 o    130.3    2.0    0.0000   0.0000          ?        ?   169.8468   5.1082          ?        ?      130.3        2.0       ?       ? 
1 1 1   10    9   15 o    731.5    2.7    0.0000   0.0000          ?        ?  5350.8110  38.9498          ?        ?      731.5        2.7       ?       ? 
1 1 1   10    9   16 o   1608.2    5.3    0.0000   0.0000          ?        ? 25867.7871 169.2082          ?        ?     1608.2        5.3       ?       ? 
1 1 1   10    9   17 o    923.0    3.3    0.0000   0.0000          ?        ?  8520.4326  60.0210          ?        ?      923.0        3.3       ?       ? 
1 1 1   10    9   18 o   1774.9    5.8    0.0000   0.0000          ?        ? 31506.5723 205.6040          ?        ?     1774.9        5.8       ?       ? 
1 1 1   10    9   19 o    893.1    3.2    0.0000   0.0000          ?        ?  7976.4116  56.8284          ?        ?      893.1        3.2       ?       ? 
1 1 1   10    9   20 o   1604.6    5.3    0.0000   0.0000          ?        ? 25751.5781 169.2082          ?        ?     1604.6        5.3       ?       ? 
1 1 1   10    9   21 o   2129.9    6.9    0.0000   0.0000          ?        ? 45372.0703 294.3585          ?        ?     2129.9        6.9       ?       ? 
1 1 1   10    9   22 o    561.4    2.3    0.0000   0.0000          ?        ?  3151.7427  25.5409          ?        ?      561.4        2.3       ?       ? 
1 1 1   10    9   23 o    489.4    2.2    0.0000   0.0000          ?        ?  2395.0947  21.0712          ?        ?      489.4        2.2       ?       ? 
1 1 1   10    9   24 o    641.3    2.5    0.0000   0.0000          ?        ?  4113.3564  31.9261          ?        ?      641.3        2.5       ?       ? 
1 1 1   10    9   25 o    937.9    3.3    0.0000   0.0000          ?        ?  8796.2734  61.2981          ?        ?      937.9        3.3       ?       ? 
1 1 1   10    9   26 o   1273.3    4.5    0.0000   0.0000          ?        ? 16213.3408 114.2954          ?        ?     1273.3        4.5       ?       ? 
1 1 1   10    9   27 o    463.0    2.4    0.0000   0.0000          ?        ?  2143.5171  22.3483          ?        ?      463.0        2.4       ?       ? 
1 1 1   10    9   28 o    911.7    3.4    0.0000   0.0000          ?        ?  8312.9131  61.9366          ?        ?      911.7        3.4       ?       ? 
1 1 1   10    9   29 o   1133.5    4.1    0.0000   0.0000          ?        ? 12848.3320  92.5856          ?        ?     1133.5        4.1       ?       ? 
1 1 1   10    9   30 o    674.9    3.0    0.0000   0.0000          ?        ?  4554.5747  40.2269          ?        ?      674.9        3.0       ?       ? 
1 1 1   10    9   31 o   1191.8    4.6    0.0000   0.0000          ?        ? 14205.1904 108.5487          ?        ?     1191.8        4.6       ?       ? 
1 1 1   10    9   32 o    421.4    2.4    0.0000   0.0000          ?        ?  1775.7286  20.4327          ?        ?      421.4        2.4       ?       ? 
1 1 1   10    9   33 f    407.4    2.9    0.0000   0.0000          ?        ?  1660.1562  23.6253          ?        ?      407.4        2.9       ?       ? 
1 1 1   10    9   34 o   1717.5    5.6    0.0000   0.0000          ?        ? 29502.2520 193.4720          ?        ?     1717.5        5.6       ?       ? 
1 1 1   10    9   35 o    385.5    2.6    0.0000   0.0000          ?        ?  1486.4784  20.4327          ?        ?      385.5        2.6       ?       ? 
1 1 1   10    9   36 o    888.2    3.2    0.0000   0.0000          ?        ?  7888.9346  57.4669          ?        ?      888.2        3.2       ?       ? 
1 1 1   10    9   37 o   1110.0    3.9    0.0000   0.0000          ?        ? 12321.5518  85.5619          ?        ?     1110.0        3.9       ?       ? 
1 1 1   10    9   38 o    407.7    2.6    0.0000   0.0000          ?        ?  1662.0717  21.0712          ?        ?      407.7        2.6       ?       ? 
1 1 1   10    9   39 o    927.5    3.7    0.0000   0.0000          ?        ?  8602.8018  68.3218          ?        ?      927.5        3.7       ?       ? 
1 1 1   10    9   40 o   1617.4    5.4    0.0000   0.0000          ?        ? 26162.7852 174.3164          ?        ?     1617.4        5.4       ?       ? 
1 1 1   10    9   41 f   1198.5    4.3    0.0000   0.0000          ?        ? 14365.4600 102.1635          ?        ?     1198.5        4.3       ?       ? 
1 1 1   10    9   42 o    696.0    3.2    0.0000   0.0000          ?        ?  4844.4639  44.6965          ?        ?      696.0        3.2       ?       ? 
1 1 1   10    9   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10    9   44 o    990.8    3.6    0.0000   0.0000          ?        ?  9817.9082  70.8759          ?        ?      990.8        3.6       ?       ? 
1 1 1   10    9   45 o    874.9    3.4    0.0000   0.0000          ?        ?  7655.2358  60.0210          ?        ?      874.9        3.4       ?       ? 
1 1 1   10    9   46 o    292.1    3.4    0.0000   0.0000          ?        ?   853.0649  19.7942          ?        ?      292.1        3.4       ?       ? 
1 1 1   10    9   47 o    233.9    4.1    0.0000   0.0000          ?        ?   547.2130  19.1556          ?        ?      233.9        4.1       ?       ? 
1 1 1   10    9   48 o    339.3    3.3    0.0000   0.0000          ?        ?  1151.2545  22.3483          ?        ?      339.3        3.3       ?       ? 
1 1 1   10    9   49 o    900.9    3.3    0.0000   0.0000          ?        ?  8116.8867  59.3825          ?        ?      900.9        3.3       ?       ? 
1 1 1   10    9   50 o    100.4   10.5    0.0000   0.0000          ?        ?   100.8864  21.0712          ?        ?      100.4       10.5       ?       ? 
1 1 1   10    9   51 o    756.7    3.0    0.0000   0.0000          ?        ?  5727.5391  45.3350          ?        ?      756.7        3.0       ?       ? 
1 1 1   10    9   52 o    175.8    5.3    0.0000   0.0000          ?        ?   309.0445  18.5171          ?        ?      175.8        5.3       ?       ? 
1 1 1   10    9   53 o    650.6    2.8    0.0000   0.0000          ?        ?  4234.0366  37.0343          ?        ?      650.6        2.8       ?       ? 
1 1 1   10    9   54 o    294.2    3.6    0.0000   0.0000          ?        ?   865.8354  21.0712          ?        ?      294.2        3.6       ?       ? 
1 1 1   10    9   55 o    578.8    2.7    0.0000   0.0000          ?        ?  3350.3230  31.2876          ?        ?      578.8        2.7       ?       ? 
1 1 1   10    9   56 o    143.5    6.9    0.0000   0.0000          ?        ?   206.2425  19.7942          ?        ?      143.5        6.9       ?       ? 
1 1 1   10    9   57 o    119.0    7.5    0.0000   0.0000          ?        ?   141.7518  17.8786          ?        ?      119.0        7.5       ?       ? 
1 1 1   10    9   58 o     20.4   10.3    0.0000   0.0000          ?        ?   -55.5514  18.5171          ?        ?       20.4       10.3       ?       ? 
1 1 1   10    9   59 o    368.1    3.1    0.0000   0.0000          ?        ?  1355.5814  22.9868          ?        ?      368.1        3.1       ?       ? 
1 1 1   10    9   60 o    277.5    3.7    0.0000   0.0000          ?        ?   770.6956  20.4327          ?        ?      277.5        3.7       ?       ? 
1 1 1   10    9   61 o    144.1    6.9    0.0000   0.0000          ?        ?   208.1580  19.7942          ?        ?      144.1        6.9       ?       ? 
1 1 1   10    9   62 o    269.4    3.7    0.0000   0.0000          ?        ?   725.9991  19.7942          ?        ?      269.4        3.7       ?       ? 
1 1 1   10    9   63 o    502.6    2.8    0.0000   0.0000          ?        ?  2526.6301  28.0950          ?        ?      502.6        2.8       ?       ? 
1 1 1   10    9   64 o     96.6   10.2    0.0000   0.0000          ?        ?    93.8627  19.7942          ?        ?       96.6       10.2       ?       ? 
1 1 1   10    9   65 o    210.5    4.9    0.0000   0.0000          ?        ?   443.7725  20.4327          ?        ?      210.5        4.9       ?       ? 
1 1 1   10    9   66 o    140.7    7.3    0.0000   0.0000          ?        ?   198.5802  20.4327          ?        ?      140.7        7.3       ?       ? 
1 1 1   10    9   67 o    260.7    3.9    0.0000   0.0000          ?        ?   680.0255  20.4327          ?        ?      260.7        3.9       ?       ? 
1 1 1   10    9   68 o    120.1    8.8    0.0000   0.0000          ?        ?   144.9444  21.0712          ?        ?      120.1        8.8       ?       ? 
1 1 1   10    9   69 o    128.3    8.2    0.0000   0.0000          ?        ?   165.3771  21.0712          ?        ?      128.3        8.2       ?       ? 
1 1 1   10    9   70 o    269.5    4.0    0.0000   0.0000          ?        ?   727.2761  21.7097          ?        ?      269.5        4.0       ?       ? 
1 1 1   10    9   71 o    154.4    6.8    0.0000   0.0000          ?        ?   239.4456  21.0712          ?        ?      154.4        6.8       ?       ? 
1 1 1   10    9   72 o    140.6    7.3    0.0000   0.0000          ?        ?   198.5802  20.4327          ?        ?      140.6        7.3       ?       ? 
1 1 1   10    9   73 o    154.6    7.0    0.0000   0.0000          ?        ?   240.0841  21.7097          ?        ?      154.6        7.0       ?       ? 
1 1 1   10    9   74 o    188.3    5.6    0.0000   0.0000          ?        ?   355.6566  21.0712          ?        ?      188.3        5.6       ?       ? 
1 1 1   10    9   75 o    144.2    7.5    0.0000   0.0000          ?        ?   209.4351  21.7097          ?        ?      144.2        7.5       ?       ? 
1 1 1   10    9   76 o     23.6   11.7    0.0000   0.0000          ?        ?   -53.6358  21.7097          ?        ?       23.6       11.7       ?       ? 
1 1 1   10    9   77 o    259.2    4.3    0.0000   0.0000          ?        ?   673.6403  22.3483          ?        ?      259.2        4.3       ?       ? 
1 1 1   10    9   78 o     77.8   14.5    0.0000   0.0000          ?        ?    64.4907  21.7097          ?        ?       77.8       14.5       ?       ? 
1 1 1   10    9   79 o     40.9   16.4    0.0000   0.0000          ?        ?     9.5778  20.4327          ?        ?       40.9       16.4       ?       ? 
1 1 1   10    9   80 o    246.9    4.0    0.0000   0.0000          ?        ?   611.7037  19.7942          ?        ?      246.9        4.0       ?       ? 
1 1 1   10   10    0 o    782.0    6.9 6117.6758 107.9102  6117.6758 107.9102  6117.6758 107.9102      782.0      6.9      782.0        6.9     0.0     0.0 
1 1 1   10   10    1 o    819.3    5.0 6714.0547  82.3693  6714.0547  82.3693  6714.0547  82.3693      819.3      5.0      819.3        5.0     0.0     0.0 
1 1 1   10   10    2 o    434.9    2.7 1891.9395  23.6253  1891.9395  23.6253  1891.9395  23.6253      434.9      2.7      434.9        2.7     0.0     0.0 
1 1 1   10   10    3 o   1087.7    6.0 11831.8057 130.2584 11831.8057 130.2584 11831.8057 130.2584     1087.7      6.0     1087.7        6.0     0.0     0.0 
1 1 1   10   10    4 o   1371.7    6.4 18818.5098 175.5934 18818.5098 175.5934 18818.5098 175.5934     1371.7      6.4     1371.7        6.4     0.0     0.0 
1 1 1   10   10    5 o   1062.0    5.1 11279.4844 108.5487 11279.4844 108.5487 11279.4844 108.5487     1062.0      5.1     1062.0        5.1     0.0     0.0 
1 1 1   10   10    6 o    210.3    2.0  442.4955   8.3008   442.4955   8.3008   442.4955   8.3008      210.3      2.0      210.3        2.0     0.0     0.0 
1 1 1   10   10    7 o    192.6    2.0  370.9810   7.6623   370.9810   7.6623   370.9810   7.6623      192.6      2.0      192.6        2.0     0.0     0.0 
1 1 1   10   10    8 o    860.8    4.2 7410.0435  72.7915  7410.0435  72.7915  7410.0435  72.7915      860.8      4.2      860.8        4.2     0.0     0.0 
1 1 1   10   10    9 o    342.0    2.3 1169.7716  15.9630  1169.7716  15.9630  1169.7716  15.9630      342.0      2.3      342.0        2.3     0.0     0.0 
1 1 1   10   10   10 o    993.5    5.9 9872.1826 116.8494  9872.1826 116.8494  9872.1826 116.8494      993.5      5.9      993.5        5.9     0.0     0.0 
1 1 1   10   10   11 o    176.3    2.4  310.9600   8.3008   310.9600   8.3008   310.9600   8.3008      176.3      2.4      176.3        2.4     0.0     0.0 
1 1 1   10   10   12 o    298.2    2.2  889.4606  13.4090   889.4606  13.4090   889.4606  13.4090      298.2      2.2      298.2        2.2     0.0     0.0 
1 1 1   10   10   13 o   1325.4    6.2 17568.9219 165.3771 17568.9219 165.3771 17568.9219 165.3771     1325.4      6.2     1325.4        6.2     0.0     0.0 
1 1 1   10   10   14 o    727.9    3.8 5299.7295  54.9129  5299.7295  54.9129  5299.7295  54.9129      727.9      3.8      727.9        3.8     0.0     0.0 
1 1 1   10   10   15 o   1003.3    4.9 10068.2090  98.3323 10068.2090  98.3323 10068.2090  98.3323     1003.3      4.9     1003.3        4.9     0.0     0.0 
1 1 1   10   10   16 o    867.2    4.3 7521.7847  74.7070  7521.7847  74.7070  7521.7847  74.7070      867.2      4.3      867.2        4.3     0.0     0.0 
1 1 1   10   10   17 o    275.2    2.6  757.2866  14.0475   757.2866  14.0475   757.2866  14.0475      275.2      2.6      275.2        2.6     0.0     0.0 
1 1 1   10   10   18 o    485.1    3.0 2353.5908  28.7335  2353.5908  28.7335  2353.5908  28.7335      485.1      3.0      485.1        3.0     0.0     0.0 
1 1 1   10   10   19 o   2048.6    9.4 41977.6914 385.6671 41977.6914 385.6671 41977.6914 385.6671     2048.6      9.4     2048.6        9.4     0.0     0.0 
1 1 1   10   10   20 o    895.9    4.7 8027.4937  84.9234  8027.4937  84.9234  8027.4937  84.9234      895.9      4.7      895.9        4.7     0.0     0.0 
1 1 1   10   10   21 o    398.7    2.8 1589.9188  22.3483  1589.9188  22.3483  1589.9188  22.3483      398.7      2.8      398.7        2.8     0.0     0.0 
1 1 1   10   10   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10   10   23 o   1163.8    5.7 13546.8750 132.8125 13546.8750 132.8125 13546.8750 132.8125     1163.8      5.7     1163.8        5.7     0.0     0.0 
1 1 1   10   10   24 o   2155.0    9.8 46449.8945 423.9784 46449.8945 423.9784 46449.8945 423.9784     2155.0      9.8     2155.0        9.8     0.0     0.0 
1 1 1   10   10   25 o   1567.2    7.7 24565.2031 240.7227 24565.2031 240.7227 24565.2031 240.7227     1567.2      7.7     1567.2        7.7     0.0     0.0 
1 1 1   10   10   26 o   1303.0    6.4 16980.2051 167.9312 16980.2051 167.9312 16980.2051 167.9312     1303.0      6.4     1303.0        6.4     0.0     0.0 
1 1 1   10   10   27 o    260.1    3.2  676.8329  16.6016   676.8329  16.6016   676.8329  16.6016      260.1      3.2      260.1        3.2     0.0     0.0 
1 1 1   10   10   28 o   1837.0    9.2 33752.8906 339.6935 33752.8906 339.6935 33752.8906 339.6935     1837.0      9.2     1837.0        9.2     0.0     0.0 
1 1 1   10   10   29 o   1859.1   10.0 34570.8398 370.3425 34570.8398 370.3425 34570.8398 370.3425     1859.1     10.0     1859.1       10.0     0.0     0.0 
1 1 1   10   10   30 o   1538.2    7.2 23664.2500 222.2055 23664.2500 222.2055 23664.2500 222.2055     1538.2      7.2     1538.2        7.2     0.0     0.0 
1 1 1   10   10   31 o    680.1    4.0 4626.0894  54.9129  4626.0894  54.9129  4626.0894  54.9129      680.1      4.0      680.1        4.0     0.0     0.0 
1 1 1   10   10   32 o    353.5    3.4 1250.2253  24.2638  1250.2253  24.2638  1250.2253  24.2638      353.5      3.4      353.5        3.4     0.0     0.0 
1 1 1   10   10   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10   10   34 o    492.5    3.5 2426.3821  34.4802  2426.3821  34.4802  2426.3821  34.4802      492.5      3.5      492.5        3.5     0.0     0.0 
1 1 1   10   10   35 o    989.8    5.5 9798.7529 107.9102  9798.7529 107.9102  9798.7529 107.9102      989.8      5.5      989.8        5.5     0.0     0.0 
1 1 1   10   10   36 o   1548.2    7.3 23972.6562 226.0367 23972.6562 226.0367 23972.6562 226.0367     1548.2      7.3     1548.2        7.3     0.0     0.0 
1 1 1   10   10   37 o    594.1    3.6 3530.3862  42.7809  3530.3862  42.7809  3530.3862  42.7809      594.1      3.6      594.1        3.6     0.0     0.0 
1 1 1   10   10   38 o    864.8    4.5 7480.2808  77.2611  7480.2808  77.2611  7480.2808  77.2611      864.8      4.5      864.8        4.5     0.0     0.0 
1 1 1   10   10   39 o    846.1    4.4 7160.3818  74.7070  7160.3818  74.7070  7160.3818  74.7070      846.1      4.4      846.1        4.4     0.0     0.0 
1 1 1   10   10   40 o   1729.2    8.1 29907.0742 278.3954 29907.0742 278.3954 29907.0742 278.3954     1729.2      8.1     1729.2        8.1     0.0     0.0 
1 1 1   10   10   41 o     21.7   15.6  -43.4195  30.0105   -43.4195  30.0105   -43.4195  30.0105       21.7     15.6       21.7       15.6     0.0     0.0 
1 1 1   10   10   42 o     31.5   20.3    2.5541  28.0950     2.5541  28.0950     2.5541  28.0950       31.5     20.3       31.5       20.3     0.0     0.0 
1 1 1   10   10   43 o    474.7    4.6 2254.6199  43.4195  2254.6199  43.4195  2254.6199  43.4195      474.7      4.6      474.7        4.6     0.0     0.0 
1 1 1   10   10   44 o    699.1    4.1 4887.8828  56.8284  4887.8828  56.8284  4887.8828  56.8284      699.1      4.1      699.1        4.1     0.0     0.0 
1 1 1   10   10   45 o   1359.8    6.6 18496.0547 178.7861 18496.0547 178.7861 18496.0547 178.7861     1359.8      6.6     1359.8        6.6     0.0     0.0 
1 1 1   10   10   46 o    517.8    3.8 2681.7908  39.5883  2681.7908  39.5883  2681.7908  39.5883      517.8      3.8      517.8        3.8     0.0     0.0 
1 1 1   10   10   47 o    439.6    3.8 1933.4434  33.8416  1933.4434  33.8416  1933.4434  33.8416      439.6      3.8      439.6        3.8     0.0     0.0 
1 1 1   10   10   48 o    769.0    4.4 5914.6260  67.6833  5914.6260  67.6833  5914.6260  67.6833      769.0      4.4      769.0        4.4     0.0     0.0 
1 1 1   10   10   49 o    447.2    3.8 2000.4882  33.8416  2000.4882  33.8416  2000.4882  33.8416      447.2      3.8      447.2        3.8     0.0     0.0 
1 1 1   10   10   50 o    316.1    4.9  999.9249  30.6490   999.9249  30.6490   999.9249  30.6490      316.1      4.9      316.1        4.9     0.0     0.0 
1 1 1   10   10   51 o     16.8   12.5  -84.9234  29.3720   -84.9234  29.3720   -84.9234  29.3720       16.8     12.5       16.8       12.5     0.0     0.0 
1 1 1   10   10   52 o    204.7    7.2  420.7858  29.3720   420.7858  29.3720   420.7858  29.3720      204.7      7.2      204.7        7.2     0.0     0.0 
1 1 1   10   10   53 o    230.6    5.8  533.1656  26.8179   533.1656  26.8179   533.1656  26.8179      230.6      5.8      230.6        5.8     0.0     0.0 
1 1 1   10   10   54 o     26.2   17.7  -10.2163  26.1794   -10.2163  26.1794   -10.2163  26.1794       26.2     17.7       26.2       17.7     0.0     0.0 
1 1 1   10   10   55 o    255.5    5.6  653.8461  28.7335   653.8461  28.7335   653.8461  28.7335      255.5      5.6      255.5        5.6     0.0     0.0 
1 1 1   10   10   56 f   1002.4    5.0 10052.2461 100.8864 10052.2461 100.8864 10052.2461 100.8864     1002.4      5.0     1002.4        5.0     0.0     0.0 
1 1 1   10   10   57 o    640.0    3.9 4097.3936  50.4432  4097.3936  50.4432  4097.3936  50.4432      640.0      3.9      640.0        3.9     0.0     0.0 
1 1 1   10   10   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10   10   59 o    129.9   10.7  172.4008  27.4564   172.4008  27.4564   172.4008  27.4564      129.9     10.7      129.9       10.7     0.0     0.0 
1 1 1   10   10   60 o    515.9    4.1 2662.6353  42.1424  2662.6353  42.1424  2662.6353  42.1424      515.9      4.1      515.9        4.1     0.0     0.0 
1 1 1   10   10   61 o    109.1   12.3  123.8732  26.1794   123.8732  26.1794   123.8732  26.1794      109.1     12.3      109.1       12.3     0.0     0.0 
1 1 1   10   10   62 o    614.7    4.1 3780.0481  49.8047  3780.0481  49.8047  3780.0481  49.8047      614.7      4.1      614.7        4.1     0.0     0.0 
1 1 1   10   10   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10   10   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   10   10   65 o    328.7    4.6 1081.6556  30.0105  1081.6556  30.0105  1081.6556  30.0105      328.7      4.6      328.7        4.6     0.0     0.0 
1 1 1   10   10   66 o     17.6   13.0  -67.0448  28.0950   -67.0448  28.0950   -67.0448  28.0950       17.6     13.0       17.6       13.0     0.0     0.0 
1 1 1   10   10   67 f    294.0    5.2  865.8354  30.6490   865.8354  30.6490   865.8354  30.6490      294.0      5.2      294.0        5.2     0.0     0.0 
1 1 1   10   10   68 o    419.2    4.3 1759.1271  36.3957  1759.1271  36.3957  1759.1271  36.3957      419.2      4.3      419.2        4.3     0.0     0.0 
1 1 1   10   10   69 o    144.6   10.5  213.2662  30.0105   213.2662  30.0105   213.2662  30.0105      144.6     10.5      144.6       10.5     0.0     0.0 
1 1 1   10   10   70 o    180.0    8.6  326.9231  30.6490   326.9231  30.6490   326.9231  30.6490      180.0      8.6      180.0        8.6     0.0     0.0 
1 1 1   10   10   71 o     17.6   13.0  -77.8996  30.0105   -77.8996  30.0105   -77.8996  30.0105       17.6     13.0       17.6       13.0     0.0     0.0 
1 1 1   10   10   72 o     28.3   18.9   -7.6623  28.7335    -7.6623  28.7335    -7.6623  28.7335       28.3     18.9       28.3       18.9     0.0     0.0 
1 1 1   10   10   73 o    242.4    6.5  589.9940  31.2876   589.9940  31.2876   589.9940  31.2876      242.4      6.5      242.4        6.5     0.0     0.0 
1 1 1   10   10   74 o    397.3    4.6 1580.9796  36.3957  1580.9796  36.3957  1580.9796  36.3957      397.3      4.6      397.3        4.6     0.0     0.0 
1 1 1   10   10   75 o     36.5   22.5   12.7704  31.2876    12.7704  31.2876    12.7704  31.2876       36.5     22.5       36.5       22.5     0.0     0.0 
1 1 1   10   10   76 o     30.2   19.5    1.9156  26.8179     1.9156  26.8179     1.9156  26.8179       30.2     19.5       30.2       19.5     0.0     0.0 
1 1 1   10   10   77 o     25.0   17.3  -16.6016  27.4564   -16.6016  27.4564   -16.6016  27.4564       25.0     17.3       25.0       17.3     0.0     0.0 
1 1 1   10   10   78 o    199.4    6.7  400.3531  26.8179   400.3531  26.8179   400.3531  26.8179      199.4      6.7      199.4        6.7     0.0     0.0 
1 1 1   10   10   79 o     16.4   12.2  -92.5856  30.0105   -92.5856  30.0105   -92.5856  30.0105       16.4     12.2       16.4       12.2     0.0     0.0 
1 1 1   11    0    0 o   2782.9   30.8 77521.6328 1711.8765 77521.6328 1711.8765 77521.6328 1711.8765     2782.9     30.8     2782.9       30.8     0.0     0.0 
1 1 1   11    0    1 o    354.1    2.1 1254.0564  14.6860  1254.0564  14.6860  1254.0564  14.6860      354.1      2.1      354.1        2.1     0.0     0.0 
1 1 1   11    0    2 o   1119.2    5.3 12526.5176 118.1265 12526.5176 118.1265 12526.5176 118.1265     1119.2      5.3     1119.2        5.3     0.0     0.0 
1 1 1   11    0    3 o   1031.6    4.9 10642.2393 100.2479 10642.2393 100.2479 10642.2393 100.2479     1031.6      4.9     1031.6        4.9     0.0     0.0 
1 1 1   11    0    4 o    944.8    4.5 8927.1709  84.9234  8927.1709  84.9234  8927.1709  84.9234      944.8      4.5      944.8        4.5     0.0     0.0 
1 1 1   11    0    5 o   1514.1    7.0 22927.3965 211.9892 22927.3965 211.9892 22927.3965 211.9892     1514.1      7.0     1514.1        7.0     0.0     0.0 
1 1 1   11    0    6 o   2051.4    9.3 42088.7930 380.5589 42088.7930 380.5589 42088.7930 380.5589     2051.4      9.3     2051.4        9.3     0.0     0.0 
1 1 1   11    0    7 o   1696.7    7.8 28793.4941 263.7094 28793.4941 263.7094 28793.4941 263.7094     1696.7      7.8     1696.7        7.8     0.0     0.0 
1 1 1   11    0    8 o   1070.4    5.0 11458.2705 107.9102 11458.2705 107.9102 11458.2705 107.9102     1070.4      5.0     1070.4        5.0     0.0     0.0 
1 1 1   11    0    9 o    665.6    3.4 4430.0630  45.3350  4430.0630  45.3350  4430.0630  45.3350      665.6      3.4      665.6        3.4     0.0     0.0 
1 1 1   11    0   10 o   1294.4    6.1 16756.7227 157.0763 16756.7227 157.0763 16756.7227 157.0763     1294.4      6.1     1294.4        6.1     0.0     0.0 
1 1 1   11    0   11 o    863.7    4.2 7460.4868  72.7915  7460.4868  72.7915  7460.4868  72.7915      863.7      4.2      863.7        4.2     0.0     0.0 
1 1 1   11    0   12 o   2826.2   12.7 79898.2109 715.1442 79898.2109 715.1442 79898.2109 715.1442     2826.2     12.7     2826.2       12.7     0.0     0.0 
1 1 1   11    0   13 o   1175.7    5.5 13824.6328 130.2584 13824.6328 130.2584 13824.6328 130.2584     1175.7      5.5     1175.7        5.5     0.0     0.0 
1 1 1   11    0   14 o   1065.5    5.1 11354.8301 107.9102 11354.8301 107.9102 11354.8301 107.9102     1065.5      5.1     1065.5        5.1     0.0     0.0 
1 1 1   11    0   15 o   2247.7   10.6 50533.2422 478.2527 50533.2422 478.2527 50533.2422 478.2527     2247.7     10.6     2247.7       10.6     0.0     0.0 
1 1 1   11    0   16 o    883.2    4.4 7802.0957  77.2611  7802.0957  77.2611  7802.0957  77.2611      883.2      4.4      883.2        4.4     0.0     0.0 
1 1 1   11    0   17 o    643.5    3.3 4141.4512  42.7809  4141.4512  42.7809  4141.4512  42.7809      643.5      3.3      643.5        3.3     0.0     0.0 
1 1 1   11    0   18 o    680.3    3.6 4628.6436  48.5276  4628.6436  48.5276  4628.6436  48.5276      680.3      3.6      680.3        3.6     0.0     0.0 
1 1 1   11    0   19 o   1295.0    6.1 16772.0469 157.0763 16772.0469 157.0763 16772.0469 157.0763     1295.0      6.1     1295.0        6.1     0.0     0.0 
1 1 1   11    0   20 o    572.5    3.3 3278.1702  38.3113  3278.1702  38.3113  3278.1702  38.3113      572.5      3.3      572.5        3.3     0.0     0.0 
1 1 1   11    0   21 o     87.9    4.8   77.8996   8.3008    77.8996   8.3008    77.8996   8.3008       87.9      4.8       87.9        4.8     0.0     0.0 
1 1 1   11    0   22 o      8.7    6.5  -25.5409   8.3008   -25.5409   8.3008   -25.5409   8.3008        8.7      6.5        8.7        6.5     0.0     0.0 
1 1 1   11    0   23 o    442.4    2.8 1957.0687  24.9023  1957.0687  24.9023  1957.0687  24.9023      442.4      2.8      442.4        2.8     0.0     0.0 
1 1 1   11    0   24 o    512.6    3.3 2628.1550  33.8416  2628.1550  33.8416  2628.1550  33.8416      512.6      3.3      512.6        3.3     0.0     0.0 
1 1 1   11    0   25 o    234.3    3.3  549.1286  15.3245   549.1286  15.3245   549.1286  15.3245      234.3      3.3      234.3        3.3     0.0     0.0 
1 1 1   11    0   26 o    488.7    3.1 2388.7095  30.6490  2388.7095  30.6490  2388.7095  30.6490      488.7      3.1      488.7        3.1     0.0     0.0 
1 1 1   11    0   27 o   1883.9    8.6 35496.6953 325.6460 35496.6953 325.6460 35496.6953 325.6460     1883.9      8.6     1883.9        8.6     0.0     0.0 
1 1 1   11    0   28 o    360.7    3.0 1301.3071  21.7097  1301.3071  21.7097  1301.3071  21.7097      360.7      3.0      360.7        3.0     0.0     0.0 
1 1 1   11    0   29 o    502.3    3.3 2523.4375  33.2031  2523.4375  33.2031  2523.4375  33.2031      502.3      3.3      502.3        3.3     0.0     0.0 
1 1 1   11    0   30 o   2044.3    9.3 41799.5391 381.1974 41799.5391 381.1974 41799.5391 381.1974     2044.3      9.3     2044.3        9.3     0.0     0.0 
1 1 1   11    0   31 o   1519.6    8.0 23094.6875 243.9153 23094.6875 243.9153 23094.6875 243.9153     1519.6      8.0     1519.6        8.0     0.0     0.0 
1 1 1   11    0   32 o    796.8    5.0 6349.4590  79.8152  6349.4590  79.8152  6349.4590  79.8152      796.8      5.0      796.8        5.0     0.0     0.0 
1 1 1   11    0   33 o   1227.3    6.1 15064.0020 150.0526 15064.0020 150.0526 15064.0020 150.0526     1227.3      6.1     1227.3        6.1     0.0     0.0 
1 1 1   11    0   34 o   1885.7    9.0 35564.3750 340.9706 35564.3750 340.9706 35564.3750 340.9706     1885.7      9.0     1885.7        9.0     0.0     0.0 
1 1 1   11    0   35 o    466.2    3.9 2174.1663  36.3957  2174.1663  36.3957  2174.1663  36.3957      466.2      3.9      466.2        3.9     0.0     0.0 
1 1 1   11    0   36 o    630.5    3.6 3976.0742  45.3350  3976.0742  45.3350  3976.0742  45.3350      630.5      3.6      630.5        3.6     0.0     0.0 
1 1 1   11    0   37 o   1476.1    7.1 21793.3828 208.1580 21793.3828 208.1580 21793.3828 208.1580     1476.1      7.1     1476.1        7.1     0.0     0.0 
1 1 1   11    0   38 o     75.2   22.9   70.2374  30.0105    70.2374  30.0105    70.2374  30.0105       75.2     22.9       75.2       22.9     0.0     0.0 
1 1 1   11    0   39 o   1016.5    5.3 10334.4727 107.9102 10334.4727 107.9102 10334.4727 107.9102     1016.5      5.3     1016.5        5.3     0.0     0.0 
1 1 1   11    0   40 o    443.3    5.6 1966.0081  49.8047  1966.0081  49.8047  1966.0081  49.8047      443.3      5.6      443.3        5.6     0.0     0.0 
1 1 1   11    0   41 o    796.1    4.4 6337.9653  70.2374  6337.9653  70.2374  6337.9653  70.2374      796.1      4.4      796.1        4.4     0.0     0.0 
1 1 1   11    0   42 o   2415.9   10.9 58388.3320 528.0574 58388.3320 528.0574 58388.3320 528.0574     2415.9     10.9     2415.9       10.9     0.0     0.0 
1 1 1   11    0   43 o   1780.5   20.4 31747.2949 725.9991 31747.2949 725.9991 31747.2949 725.9991     1780.5     20.4     1780.5       20.4     0.0     0.0 
1 1 1   11    0   44 o   2258.0   10.3 51003.1914 465.4823 51003.1914 465.4823 51003.1914 465.4823     2258.0     10.3     2258.0       10.3     0.0     0.0 
1 1 1   11    0   45 o    499.9    4.0 2499.8123  39.5883  2499.8123  39.5883  2499.8123  39.5883      499.9      4.0      499.9        4.0     0.0     0.0 
1 1 1   11    0   46 o     88.5   29.6  100.8864  46.6121   100.8864  46.6121   100.8864  46.6121       88.5     29.6       88.5       29.6     0.0     0.0 
1 1 1   11    0   47 o    933.4    4.9 8713.2656  91.9471  8713.2656  91.9471  8713.2656  91.9471      933.4      4.9      933.4        4.9     0.0     0.0 
1 1 1   11    0   48 o   1069.0    5.4 11430.1758 116.2109 11430.1758 116.2109 11430.1758 116.2109     1069.0      5.4     1069.0        5.4     0.0     0.0 
1 1 1   11    0   49 o    780.3    4.8 6089.5811  75.3456  6089.5811  75.3456  6089.5811  75.3456      780.3      4.8      780.3        4.8     0.0     0.0 
1 1 1   11    0   50 o    253.8    5.4  644.9069  27.4564   644.9069  27.4564   644.9069  27.4564      253.8      5.4      253.8        5.4     0.0     0.0 
1 1 1   11    0   51 o    291.2    4.8  848.5952  28.0950   848.5952  28.0950   848.5952  28.0950      291.2      4.8      291.2        4.8     0.0     0.0 
1 1 1   11    0   52 o    470.0    3.8 2209.9233  35.7572  2209.9233  35.7572  2209.9233  35.7572      470.0      3.8      470.0        3.8     0.0     0.0 
1 1 1   11    0   53 o     23.0   16.6  -44.0580  32.5646   -44.0580  32.5646   -44.0580  32.5646       23.0     16.6       23.0       16.6     0.0     0.0 
1 1 1   11    0   54 o    347.7    5.2 1209.9985  36.3957  1209.9985  36.3957  1209.9985  36.3957      347.7      5.2      347.7        5.2     0.0     0.0 
1 1 1   11    0   55 o    454.3    4.0 2064.9790  36.3957  2064.9790  36.3957  2064.9790  36.3957      454.3      4.0      454.3        4.0     0.0     0.0 
1 1 1   11    0   56 o    756.6    4.3 5725.6235  65.1292  5725.6235  65.1292  5725.6235  65.1292      756.6      4.3      756.6        4.3     0.0     0.0 
1 1 1   11    0   57 o     22.0   15.7  -31.9261  27.4564   -31.9261  27.4564   -31.9261  27.4564       22.0     15.7       22.0       15.7     0.0     0.0 
1 1 1   11    0   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    0   59 o    366.1    4.4 1340.8954  31.9261  1340.8954  31.9261  1340.8954  31.9261      366.1      4.4      366.1        4.4     0.0     0.0 
1 1 1   11    0   60 o    295.6    5.2  874.7747  30.6490   874.7747  30.6490   874.7747  30.6490      295.6      5.2      295.6        5.2     0.0     0.0 
1 1 1   11    0   61 o    252.1    5.5  636.6060  27.4564   636.6060  27.4564   636.6060  27.4564      252.1      5.5      252.1        5.5     0.0     0.0 
1 1 1   11    0   62 o     70.6   23.1   63.8522  28.7335    63.8522  28.7335    63.8522  28.7335       70.6     23.1       70.6       23.1     0.0     0.0 
1 1 1   11    0   63 o     15.8   11.8  -93.2242  28.7335   -93.2242  28.7335   -93.2242  28.7335       15.8     11.8       15.8       11.8     0.0     0.0 
1 1 1   11    0   64 o    265.2    5.7  704.9279  30.0105   704.9279  30.0105   704.9279  30.0105      265.2      5.7      265.2        5.7     0.0     0.0 
1 1 1   11    0   65 o     25.4   17.7  -20.4327  29.3720   -20.4327  29.3720   -20.4327  29.3720       25.4     17.7       25.4       17.7     0.0     0.0 
1 1 1   11    0   66 o     28.2   18.8   -5.7467  27.4564    -5.7467  27.4564    -5.7467  27.4564       28.2     18.8       28.2       18.8     0.0     0.0 
1 1 1   11    0   67 o     38.2   22.5   17.8786  28.7335    17.8786  28.7335    17.8786  28.7335       38.2     22.5       38.2       22.5     0.0     0.0 
1 1 1   11    0   68 o     16.2   12.1  -83.0078  28.0950   -83.0078  28.0950   -83.0078  28.0950       16.2     12.1       16.2       12.1     0.0     0.0 
1 1 1   11    0   69 o    232.1    6.8  540.8278  31.2876   540.8278  31.2876   540.8278  31.2876      232.1      6.8      232.1        6.8     0.0     0.0 
1 1 1   11    0   70 o    327.2    5.1 1072.0778  33.2031  1072.0778  33.2031  1072.0778  33.2031      327.2      5.1      327.2        5.1     0.0     0.0 
1 1 1   11    0   71 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    0   72 o    152.4   11.0  236.8915  33.2031   236.8915  33.2031   236.8915  33.2031      152.4     11.0      152.4       11.0     0.0     0.0 
1 1 1   11    0   73 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    0   74 o    184.5    8.3  343.5246  30.6490   343.5246  30.6490   343.5246  30.6490      184.5      8.3      184.5        8.3     0.0     0.0 
1 1 1   11    0   75 o    127.0   13.9  168.5697  34.4802   168.5697  34.4802   168.5697  34.4802      127.0     13.9      127.0       13.9     0.0     0.0 
1 1 1   11    0   76 o     48.5   25.4   35.7572  31.9261    35.7572  31.9261    35.7572  31.9261       48.5     25.4       48.5       25.4     0.0     0.0 
1 1 1   11    0   77 o     47.0   25.5   33.2031  33.2031    33.2031  33.2031    33.2031  33.2031       47.0     25.5       47.0       25.5     0.0     0.0 
1 1 1   11    0   78 o     39.2   23.0   19.7942  30.0105    19.7942  30.0105    19.7942  30.0105       39.2     23.0       39.2       23.0     0.0     0.0 
1 1 1   11    0   79 o     29.6   20.0  -10.8549  33.2031   -10.8549  33.2031   -10.8549  33.2031       29.6     20.0       29.6       20.0     0.0     0.0 
1 1 1   11    0   80 o    163.4    9.6  272.0102  31.2876   272.0102  31.2876   272.0102  31.2876      163.4      9.6      163.4        9.6     0.0     0.0 
1 1 1   11    0   81 o     18.7   13.8  -71.5144  31.2876   -71.5144  31.2876   -71.5144  31.2876       18.7     13.8       18.7       13.8     0.0     0.0 
1 1 1   11    1    0 o   1053.0    5.0 11089.8438 105.3561 11089.8438 105.3561 11089.8438 105.3561     1053.0      5.0     1053.0        5.0     0.0     0.0 
1 1 1   11    1    1 o   1624.3    5.3    0.0000   0.0000          ?        ? 26385.6270 172.4008          ?        ?     1624.3        5.3       ?       ? 
1 1 1   11    1    2 o    762.5    2.7    0.0000   0.0000          ?        ?  5813.7393  40.8654          ?        ?      762.5        2.7       ?       ? 
1 1 1   11    1    3 o   2110.0    6.9    0.0000   0.0000          ?        ? 44524.7539 292.4429          ?        ?     2110.0        6.9       ?       ? 
1 1 1   11    1    4 o   2313.9    7.7    0.0000   0.0000          ?        ? 53552.1719 355.6566          ?        ?     2313.9        7.7       ?       ? 
1 1 1   11    1    5 o    576.7    2.1    0.0000   0.0000          ?        ?  3326.0593  24.2638          ?        ?      576.7        2.1       ?       ? 
1 1 1   11    1    6 o    608.1    2.2    0.0000   0.0000          ?        ?  3697.6785  26.8179          ?        ?      608.1        2.2       ?       ? 
1 1 1   11    1    7 o    498.6    1.9    0.0000   0.0000          ?        ?  2485.7646  18.5171          ?        ?      498.6        1.9       ?       ? 
1 1 1   11    1    8 o   1093.0    3.7    0.0000   0.0000          ?        ? 11946.7393  80.4537          ?        ?     1093.0        3.7       ?       ? 
1 1 1   11    1    9 o   2925.7   11.3    0.0000   0.0000          ?        ? 85629.5781 664.0625          ?        ?     2925.7       11.3       ?       ? 
1 1 1   11    1   10 o   1134.3    3.8    0.0000   0.0000          ?        ? 12866.2109  85.5619          ?        ?     1134.3        3.8       ?       ? 
1 1 1   11    1   11 o    835.4    2.9    0.0000   0.0000          ?        ?  6979.0415  48.5276          ?        ?      835.4        2.9       ?       ? 
1 1 1   11    1   12 o   1152.6    3.8    0.0000   0.0000          ?        ? 13285.7188  88.1160          ?        ?     1152.6        3.8       ?       ? 
1 1 1   11    1   13 o   1624.6    5.3    0.0000   0.0000          ?        ? 26395.2051 172.4008          ?        ?     1624.6        5.3       ?       ? 
1 1 1   11    1   14 o    966.1    3.4    0.0000   0.0000          ?        ?  9334.5479  65.1292          ?        ?      966.1        3.4       ?       ? 
1 1 1   11    1   15 o   1000.2    3.4    0.0000   0.0000          ?        ? 10004.9951  68.3218          ?        ?     1000.2        3.4       ?       ? 
1 1 1   11    1   16 o   1230.8    4.1    0.0000   0.0000          ?        ? 15150.2021 100.8864          ?        ?     1230.8        4.1       ?       ? 
1 1 1   11    1   17 o    538.5    2.1    0.0000   0.0000          ?        ?  2900.1653  22.9868          ?        ?      538.5        2.1       ?       ? 
1 1 1   11    1   18 o   1046.7    3.6    0.0000   0.0000          ?        ? 10955.7539  74.7070          ?        ?     1046.7        3.6       ?       ? 
1 1 1   11    1   19 o    951.3    3.3    0.0000   0.0000          ?        ?  9050.4053  61.9366          ?        ?      951.3        3.3       ?       ? 
1 1 1   11    1   20 o    907.5    3.2    0.0000   0.0000          ?        ?  8236.2910  57.4669          ?        ?      907.5        3.2       ?       ? 
1 1 1   11    1   21 o   1179.7    4.1    0.0000   0.0000          ?        ? 13917.8555  95.7782          ?        ?     1179.7        4.1       ?       ? 
1 1 1   11    1   22 o    225.9    1.8    0.0000   0.0000          ?        ?   510.1788   8.3008          ?        ?      225.9        1.8       ?       ? 
1 1 1   11    1   23 o    525.4    2.2    0.0000   0.0000          ?        ?  2760.9675  22.9868          ?        ?      525.4        2.2       ?       ? 
1 1 1   11    1   24 o    714.0    2.7    0.0000   0.0000          ?        ?  5098.5952  38.9498          ?        ?      714.0        2.7       ?       ? 
1 1 1   11    1   25 o    421.5    2.0    0.0000   0.0000          ?        ?  1777.0056  17.2401          ?        ?      421.5        2.0       ?       ? 
1 1 1   11    1   26 f    111.6    4.3    0.0000   0.0000          ?        ?   124.5117   9.5778          ?        ?      111.6        4.3       ?       ? 
1 1 1   11    1   27 o   1353.1    4.6    0.0000   0.0000          ?        ? 18310.8848 124.5117          ?        ?     1353.1        4.6       ?       ? 
1 1 1   11    1   28 o   1617.8    5.4    0.0000   0.0000          ?        ? 26174.9160 175.5934          ?        ?     1617.8        5.4       ?       ? 
1 1 1   11    1   29 o    798.7    3.5    0.0000   0.0000          ?        ?  6380.1084  55.5514          ?        ?      798.7        3.5       ?       ? 
1 1 1   11    1   30 o    579.9    2.4    0.0000   0.0000          ?        ?  3362.4548  28.0950          ?        ?      579.9        2.4       ?       ? 
1 1 1   11    1   31 o   1899.2    6.6    0.0000   0.0000          ?        ? 36075.1953 249.6619          ?        ?     1899.2        6.6       ?       ? 
1 1 1   11    1   32 o   1376.0    5.0    0.0000   0.0000          ?        ? 18935.9980 137.2822          ?        ?     1376.0        5.0       ?       ? 
1 1 1   11    1   33 f    813.4    3.1    0.0000   0.0000          ?        ?  6617.0000  51.0817          ?        ?      813.4        3.1       ?       ? 
1 1 1   11    1   34 o   1081.9    3.9    0.0000   0.0000          ?        ? 11706.0176  84.9234          ?        ?     1081.9        3.9       ?       ? 
1 1 1   11    1   35 o     85.7    9.7    0.0000   0.0000          ?        ?    73.4300  16.6016          ?        ?       85.7        9.7       ?       ? 
1 1 1   11    1   36 o   1050.9    3.7    0.0000   0.0000          ?        ? 11045.1475  78.5382          ?        ?     1050.9        3.7       ?       ? 
1 1 1   11    1   37 o    654.3    2.9    0.0000   0.0000          ?        ?  4281.2876  37.6728          ?        ?      654.3        2.9       ?       ? 
1 1 1   11    1   38 o   1473.3    4.9    0.0000   0.0000          ?        ? 21709.0957 145.5829          ?        ?     1473.3        4.9       ?       ? 
1 1 1   11    1   39 o    145.6    7.2    0.0000   0.0000          ?        ?   211.9892  21.0712          ?        ?      145.6        7.2       ?       ? 
1 1 1   11    1   40 o   1214.1    4.2    0.0000   0.0000          ?        ? 14741.5488 102.1635          ?        ?     1214.1        4.2       ?       ? 
1 1 1   11    1   41 o    166.6    8.8    0.0000   0.0000          ?        ?   277.7569  29.3720          ?        ?      166.6        8.8       ?       ? 
1 1 1   11    1   42 o    957.0    3.7    0.0000   0.0000          ?        ?  9158.3164  70.2374          ?        ?      957.0        3.7       ?       ? 
1 1 1   11    1   43 o   1555.0    5.2    0.0000   0.0000          ?        ? 24182.7305 160.2689          ?        ?     1555.0        5.2       ?       ? 
1 1 1   11    1   44 o    955.9    3.6    0.0000   0.0000          ?        ?  9138.5215  68.3218          ?        ?      955.9        3.6       ?       ? 
1 1 1   11    1   45 o   1171.9    4.1    0.0000   0.0000          ?        ? 13735.2393  95.1397          ?        ?     1171.9        4.1       ?       ? 
1 1 1   11    1   46 o    280.2    4.7    0.0000   0.0000          ?        ?   785.3816  26.1794          ?        ?      280.2        4.7       ?       ? 
1 1 1   11    1   47 o    906.4    3.3    0.0000   0.0000          ?        ?  8217.1348  60.6596          ?        ?      906.4        3.3       ?       ? 
1 1 1   11    1   48 o    841.2    3.3    0.0000   0.0000          ?        ?  7076.0962  54.9129          ?        ?      841.2        3.3       ?       ? 
1 1 1   11    1   49 o    472.6    2.7    0.0000   0.0000          ?        ?  2233.5486  25.5409          ?        ?      472.6        2.7       ?       ? 
1 1 1   11    1   50 o    489.9    2.8    0.0000   0.0000          ?        ?  2400.2026  27.4564          ?        ?      489.9        2.8       ?       ? 
1 1 1   11    1   51 o    374.5    3.1    0.0000   0.0000          ?        ?  1402.8320  22.9868          ?        ?      374.5        3.1       ?       ? 
1 1 1   11    1   52 o    447.6    2.7    0.0000   0.0000          ?        ?  2003.6808  24.2638          ?        ?      447.6        2.7       ?       ? 
1 1 1   11    1   53 o    521.6    2.7    0.0000   0.0000          ?        ?  2721.3792  28.0950          ?        ?      521.6        2.7       ?       ? 
1 1 1   11    1   54 o    639.6    2.8    0.0000   0.0000          ?        ?  4091.6465  36.3957          ?        ?      639.6        2.8       ?       ? 
1 1 1   11    1   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    1   56 o    301.3    3.6    0.0000   0.0000          ?        ?   907.9777  21.7097          ?        ?      301.3        3.6       ?       ? 
1 1 1   11    1   57 o     55.6   15.9    0.0000   0.0000          ?        ?    31.9261  18.5171          ?        ?       55.6       15.9       ?       ? 
1 1 1   11    1   58 o    298.1    4.0    0.0000   0.0000          ?        ?   888.8221  23.6253          ?        ?      298.1        4.0       ?       ? 
1 1 1   11    1   59 o    434.8    2.9    0.0000   0.0000          ?        ?  1891.3011  24.9023          ?        ?      434.8        2.9       ?       ? 
1 1 1   11    1   60 o    335.8    3.3    0.0000   0.0000          ?        ?  1128.2677  22.3483          ?        ?      335.8        3.3       ?       ? 
1 1 1   11    1   61 f    243.3    4.2    0.0000   0.0000          ?        ?   592.5481  20.4327          ?        ?      243.3        4.2       ?       ? 
1 1 1   11    1   62 o    221.8    4.8    0.0000   0.0000          ?        ?   492.3002  21.0712          ?        ?      221.8        4.8       ?       ? 
1 1 1   11    1   63 o    448.6    2.8    0.0000   0.0000          ?        ?  2013.2587  25.5409          ?        ?      448.6        2.8       ?       ? 
1 1 1   11    1   64 o    141.0    7.7    0.0000   0.0000          ?        ?   199.2188  21.7097          ?        ?      141.0        7.7       ?       ? 
1 1 1   11    1   65 o    401.1    3.2    0.0000   0.0000          ?        ?  1609.7130  25.5409          ?        ?      401.1        3.2       ?       ? 
1 1 1   11    1   66 o     40.2   16.4    0.0000   0.0000          ?        ?     5.7467  21.0712          ?        ?       40.2       16.4       ?       ? 
1 1 1   11    1   67 o    164.0    6.4    0.0000   0.0000          ?        ?   269.4561  21.0712          ?        ?      164.0        6.4       ?       ? 
1 1 1   11    1   68 o    228.9    5.0    0.0000   0.0000          ?        ?   524.8647  22.9868          ?        ?      228.9        5.0       ?       ? 
1 1 1   11    1   69 o    296.9    4.1    0.0000   0.0000          ?        ?   882.4369  24.2638          ?        ?      296.9        4.1       ?       ? 
1 1 1   11    1   70 o     93.1   11.3    0.0000   0.0000          ?        ?    87.4775  21.0712          ?        ?       93.1       11.3       ?       ? 
1 1 1   11    1   71 o    271.5    4.1    0.0000   0.0000          ?        ?   738.1310  22.3483          ?        ?      271.5        4.1       ?       ? 
1 1 1   11    1   72 o     33.9   15.3    0.0000   0.0000          ?        ?   -10.2163  21.7097          ?        ?       33.9       15.3       ?       ? 
1 1 1   11    1   73 o     27.4   13.1    0.0000   0.0000          ?        ?   -28.0950  20.4327          ?        ?       27.4       13.1       ?       ? 
1 1 1   11    1   74 o    168.6    6.6    0.0000   0.0000          ?        ?   285.4192  22.3483          ?        ?      168.6        6.6       ?       ? 
1 1 1   11    1   75 f    138.4    8.5    0.0000   0.0000          ?        ?   192.8335  23.6253          ?        ?      138.4        8.5       ?       ? 
1 1 1   11    1   76 o     23.1   11.6    0.0000   0.0000          ?        ?   -60.6596  22.3483          ?        ?       23.1       11.6       ?       ? 
1 1 1   11    1   77 o    111.0    9.5    0.0000   0.0000          ?        ?   124.5117  21.0712          ?        ?      111.0        9.5       ?       ? 
1 1 1   11    1   78 o    185.9    6.0    0.0000   0.0000          ?        ?   347.3558  22.3483          ?        ?      185.9        6.0       ?       ? 
1 1 1   11    1   79 o     76.3   14.3    0.0000   0.0000          ?        ?    61.9366  21.0712          ?        ?       76.3       14.3       ?       ? 
1 1 1   11    1   80 o    126.0    8.6    0.0000   0.0000          ?        ?   160.9075  21.7097          ?        ?      126.0        8.6       ?       ? 
1 1 1   11    1   81 f     62.6   16.2    0.0000   0.0000          ?        ?    42.7809  20.4327          ?        ?       62.6       16.2       ?       ? 
1 1 1   11    2    0 o     96.8    2.3   93.8627   4.4697    93.8627   4.4697    93.8627   4.4697       96.8      2.3       96.8        2.3     0.0     0.0 
1 1 1   11    2    1 o    220.9    1.3    0.0000   0.0000          ?        ?   487.8305   5.7467          ?        ?      220.9        1.3       ?       ? 
1 1 1   11    2    2 o   1940.7    6.4    0.0000   0.0000          ?        ? 37668.9453 248.3849          ?        ?     1940.7        6.4       ?       ? 
1 1 1   11    2    3 o   1431.9    4.7    0.0000   0.0000          ?        ? 20505.4824 134.7281          ?        ?     1431.9        4.7       ?       ? 
1 1 1   11    2    4 o    958.6    3.2    0.0000   0.0000          ?        ?  9188.9648  61.9366          ?        ?      958.6        3.2       ?       ? 
1 1 1   11    2    5 o   2208.7    7.1    0.0000   0.0000          ?        ? 48791.9922 311.5985          ?        ?     2208.7        7.1       ?       ? 
1 1 1   11    2    6 o   1715.0    5.6    0.0000   0.0000          ?        ? 29414.1387 190.9180          ?        ?     1715.0        5.6       ?       ? 
1 1 1   11    2    7 o   1055.8    3.6    0.0000   0.0000          ?        ? 11147.9492  75.3456          ?        ?     1055.8        3.6       ?       ? 
1 1 1   11    2    8 o   1130.7    3.8    0.0000   0.0000          ?        ? 12784.4795  85.5619          ?        ?     1130.7        3.8       ?       ? 
1 1 1   11    2    9 o    589.4    2.2    0.0000   0.0000          ?        ?  3474.1960  25.5409          ?        ?      589.4        2.2       ?       ? 
1 1 1   11    2   10 o    614.4    2.2    0.0000   0.0000          ?        ?  3774.9399  27.4564          ?        ?      614.4        2.2       ?       ? 
1 1 1   11    2   11 o    395.0    1.6    0.0000   0.0000          ?        ?  1559.9083  12.7704          ?        ?      395.0        1.6       ?       ? 
1 1 1   11    2   12 o   1632.9    5.3    0.0000   0.0000          ?        ? 26665.9414 173.6779          ?        ?     1632.9        5.3       ?       ? 
1 1 1   11    2   13 o   1239.0    4.2    0.0000   0.0000          ?        ? 15351.9756 104.7175          ?        ?     1239.0        4.2       ?       ? 
1 1 1   11    2   14 o    725.0    2.6    0.0000   0.0000          ?        ?  5255.6714  37.6728          ?        ?      725.0        2.6       ?       ? 
1 1 1   11    2   15 o   2009.6    6.5    0.0000   0.0000          ?        ? 40392.2383 260.5168          ?        ?     2009.6        6.5       ?       ? 
1 1 1   11    2   16 o    693.1    2.5    0.0000   0.0000          ?        ?  4804.2368  34.4802          ?        ?      693.1        2.5       ?       ? 
1 1 1   11    2   17 o    951.6    3.3    0.0000   0.0000          ?        ?  9056.1523  62.5751          ?        ?      951.6        3.3       ?       ? 
1 1 1   11    2   18 o    445.4    1.9    0.0000   0.0000          ?        ?  1983.8867  16.6016          ?        ?      445.4        1.9       ?       ? 
1 1 1   11    2   19 o   1107.4    3.8    0.0000   0.0000          ?        ? 12264.7236  84.9234          ?        ?     1107.4        3.8       ?       ? 
1 1 1   11    2   20 o    970.1    3.3    0.0000   0.0000          ?        ?  9411.1699  64.4907          ?        ?      970.1        3.3       ?       ? 
1 1 1   11    2   21 f    657.5    2.9    0.0000   0.0000          ?        ?  4322.7915  38.3113          ?        ?      657.5        2.9       ?       ? 
1 1 1   11    2   22 o    961.5    3.3    0.0000   0.0000          ?        ?  9244.5166  63.8522          ?        ?      961.5        3.3       ?       ? 
1 1 1   11    2   23 o    443.8    1.9    0.0000   0.0000          ?        ?  1969.8392  17.2401          ?        ?      443.8        1.9       ?       ? 
1 1 1   11    2   24 f    631.4    2.4    0.0000   0.0000          ?        ?  3986.9292  30.0105          ?        ?      631.4        2.4       ?       ? 
1 1 1   11    2   25 o    880.9    3.2    0.0000   0.0000          ?        ?  7760.5918  56.1899          ?        ?      880.9        3.2       ?       ? 
1 1 1   11    2   26 o    201.0    2.4    0.0000   0.0000          ?        ?   404.1842   9.5778          ?        ?      201.0        2.4       ?       ? 
1 1 1   11    2   27 o   1376.0    4.6    0.0000   0.0000          ?        ? 18935.9980 125.7888          ?        ?     1376.0        4.6       ?       ? 
1 1 1   11    2   28 o   1441.5    4.8    0.0000   0.0000          ?        ? 20781.9629 138.5592          ?        ?     1441.5        4.8       ?       ? 
1 1 1   11    2   29 f    597.6    2.8    0.0000   0.0000          ?        ?  3571.8901  33.8416          ?        ?      597.6        2.8       ?       ? 
1 1 1   11    2   30 f    726.6    3.1    0.0000   0.0000          ?        ?  5279.9355  44.6965          ?        ?      726.6        3.1       ?       ? 
1 1 1   11    2   31 o   1136.1    4.5    0.0000   0.0000          ?        ? 12908.9912 101.5249          ?        ?     1136.1        4.5       ?       ? 
1 1 1   11    2   32 o   1525.6    5.3    0.0000   0.0000          ?        ? 23276.6660 160.9075          ?        ?     1525.6        5.3       ?       ? 
1 1 1   11    2   33 o    519.0    2.7    0.0000   0.0000          ?        ?  2693.9226  28.0950          ?        ?      519.0        2.7       ?       ? 
1 1 1   11    2   34 o   1664.5    5.7    0.0000   0.0000          ?        ? 27708.6465 190.2794          ?        ?     1664.5        5.7       ?       ? 
1 1 1   11    2   35 f    814.2    3.3    0.0000   0.0000          ?        ?  6629.7705  53.6358          ?        ?      814.2        3.3       ?       ? 
1 1 1   11    2   36 o    429.4    2.5    0.0000   0.0000          ?        ?  1844.0504  21.0712          ?        ?      429.4        2.5       ?       ? 
1 1 1   11    2   37 o   1496.7    4.9    0.0000   0.0000          ?        ? 22403.1699 148.1370          ?        ?     1496.7        4.9       ?       ? 
1 1 1   11    2   38 o    511.0    2.6    0.0000   0.0000          ?        ?  2610.9148  26.8179          ?        ?      511.0        2.6       ?       ? 
1 1 1   11    2   39 o    733.8    3.0    0.0000   0.0000          ?        ?  5385.2915  44.0580          ?        ?      733.8        3.0       ?       ? 
1 1 1   11    2   40 o   1843.5    6.0    0.0000   0.0000          ?        ? 33991.6992 221.5670          ?        ?     1843.5        6.0       ?       ? 
1 1 1   11    2   41 o   1457.0    4.8    0.0000   0.0000          ?        ? 21229.5664 141.1133          ?        ?     1457.0        4.8       ?       ? 
1 1 1   11    2   42 o   1451.8    4.8    0.0000   0.0000          ?        ? 21080.1523 140.4748          ?        ?     1451.8        4.8       ?       ? 
1 1 1   11    2   43 o   1178.4    4.1    0.0000   0.0000          ?        ? 13887.2061  95.7782          ?        ?     1178.4        4.1       ?       ? 
1 1 1   11    2   44 o   1685.8    5.5    0.0000   0.0000          ?        ? 28423.7910 186.4483          ?        ?     1685.8        5.5       ?       ? 
1 1 1   11    2   45 o    556.0    2.8    0.0000   0.0000          ?        ?  3091.0833  31.2876          ?        ?      556.0        2.8       ?       ? 
1 1 1   11    2   46 o    184.8    5.9    0.0000   0.0000          ?        ?   341.6091  21.7097          ?        ?      184.8        5.9       ?       ? 
1 1 1   11    2   47 o   1060.4    3.9    0.0000   0.0000          ?        ? 11245.0039  82.3693          ?        ?     1060.4        3.9       ?       ? 
1 1 1   11    2   48 o    754.5    2.9    0.0000   0.0000          ?        ?  5693.0586  44.0580          ?        ?      754.5        2.9       ?       ? 
1 1 1   11    2   49 o   1014.0    3.9    0.0000   0.0000          ?        ? 10283.3906  79.1767          ?        ?     1014.0        3.9       ?       ? 
1 1 1   11    2   50 o    961.5    3.5    0.0000   0.0000          ?        ?  9246.4316  66.4062          ?        ?      961.5        3.5       ?       ? 
1 1 1   11    2   51 o    433.5    2.8    0.0000   0.0000          ?        ?  1879.8076  24.2638          ?        ?      433.5        2.8       ?       ? 
1 1 1   11    2   52 o    427.5    2.8    0.0000   0.0000          ?        ?  1828.0873  24.2638          ?        ?      427.5        2.8       ?       ? 
1 1 1   11    2   53 f    342.4    3.3    0.0000   0.0000          ?        ?  1172.3258  22.3483          ?        ?      342.4        3.3       ?       ? 
1 1 1   11    2   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    2   55 o    243.2    4.1    0.0000   0.0000          ?        ?   591.9095  19.7942          ?        ?      243.2        4.1       ?       ? 
1 1 1   11    2   56 o    373.7    2.9    0.0000   0.0000          ?        ?  1397.0853  21.7097          ?        ?      373.7        2.9       ?       ? 
1 1 1   11    2   57 o    604.7    2.7    0.0000   0.0000          ?        ?  3657.4519  32.5646          ?        ?      604.7        2.7       ?       ? 
1 1 1   11    2   58 o    453.0    2.7    0.0000   0.0000          ?        ?  2052.8469  24.9023          ?        ?      453.0        2.7       ?       ? 
1 1 1   11    2   59 o    529.7    2.7    0.0000   0.0000          ?        ?  2806.9412  28.7335          ?        ?      529.7        2.7       ?       ? 
1 1 1   11    2   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    2   61 o    339.6    3.3    0.0000   0.0000          ?        ?  1153.8086  22.3483          ?        ?      339.6        3.3       ?       ? 
1 1 1   11    2   62 o     90.2   10.3    0.0000   0.0000          ?        ?    81.7308  18.5171          ?        ?       90.2       10.3       ?       ? 
1 1 1   11    2   63 o    249.6    4.1    0.0000   0.0000          ?        ?   623.1971  20.4327          ?        ?      249.6        4.1       ?       ? 
1 1 1   11    2   64 o     23.0   11.5    0.0000   0.0000          ?        ?   -54.2743  21.0712          ?        ?       23.0       11.5       ?       ? 
1 1 1   11    2   65 o    434.9    2.9    0.0000   0.0000          ?        ?  1891.9395  25.5409          ?        ?      434.9        2.9       ?       ? 
1 1 1   11    2   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    2   67 o    345.2    3.2    0.0000   0.0000          ?        ?  1192.1199  22.3483          ?        ?      345.2        3.2       ?       ? 
1 1 1   11    2   68 o     66.5   15.6    0.0000   0.0000          ?        ?    46.6121  20.4327          ?        ?       66.5       15.6       ?       ? 
1 1 1   11    2   69 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    2   70 o    197.0    5.3    0.0000   0.0000          ?        ?   388.8597  21.0712          ?        ?      197.0        5.3       ?       ? 
1 1 1   11    2   71 o    244.9    4.4    0.0000   0.0000          ?        ?   600.8488  21.7097          ?        ?      244.9        4.4       ?       ? 
1 1 1   11    2   72 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    2   73 o     43.6   16.9    0.0000   0.0000          ?        ?    12.7704  21.0712          ?        ?       43.6       16.9       ?       ? 
1 1 1   11    2   74 o     49.2   17.5    0.0000   0.0000          ?        ?    21.7097  21.7097          ?        ?       49.2       17.5       ?       ? 
1 1 1   11    2   75 o    157.6    6.9    0.0000   0.0000          ?        ?   249.6619  21.7097          ?        ?      157.6        6.9       ?       ? 
1 1 1   11    2   76 o    258.5    4.6    0.0000   0.0000          ?        ?   669.8092  23.6253          ?        ?      258.5        4.6       ?       ? 
1 1 1   11    2   77 o    113.7    9.8    0.0000   0.0000          ?        ?   130.8969  22.3483          ?        ?      113.7        9.8       ?       ? 
1 1 1   11    2   78 o    353.7    3.5    0.0000   0.0000          ?        ?  1253.4180  24.9023          ?        ?      353.7        3.5       ?       ? 
1 1 1   11    2   79 o    126.0    7.9    0.0000   0.0000          ?        ?   160.2689  19.7942          ?        ?      126.0        7.9       ?       ? 
1 1 1   11    2   80 o     22.8   11.4    0.0000   0.0000          ?        ?   -58.1055  21.7097          ?        ?       22.8       11.4       ?       ? 
1 1 1   11    2   81 o     95.8   10.7    0.0000   0.0000          ?        ?    93.8627  20.4327          ?        ?       95.8       10.7       ?       ? 
1 1 1   11    3    0 o    972.9    4.6 9466.7217  90.0316  9466.7217  90.0316  9466.7217  90.0316      972.9      4.6      972.9        4.6     0.0     0.0 
1 1 1   11    3    1 o   1693.1    5.5    0.0000   0.0000          ?        ? 28668.9824 185.8098          ?        ?     1693.1        5.5       ?       ? 
1 1 1   11    3    2 o   1142.0    3.8    0.0000   0.0000          ?        ? 13041.1660  87.4775          ?        ?     1142.0        3.8       ?       ? 
1 1 1   11    3    3 o   2251.3    8.4    0.0000   0.0000          ?        ? 50694.1445 376.7278          ?        ?     2251.3        8.4       ?       ? 
1 1 1   11    3    4 o   1983.8    6.5    0.0000   0.0000          ?        ? 39361.0273 259.8783          ?        ?     1983.8        6.5       ?       ? 
1 1 1   11    3    5 o    495.5    1.9    0.0000   0.0000          ?        ?  2455.1157  18.5171          ?        ?      495.5        1.9       ?       ? 
1 1 1   11    3    6 o   1935.6    6.2    0.0000   0.0000          ?        ? 37467.8086 240.7227          ?        ?     1935.6        6.2       ?       ? 
1 1 1   11    3    7 o    504.6    1.9    0.0000   0.0000          ?        ?  2546.4241  19.1556          ?        ?      504.6        1.9       ?       ? 
1 1 1   11    3    8 o    304.0    1.5    0.0000   0.0000          ?        ?   923.9408   8.9393          ?        ?      304.0        1.5       ?       ? 
1 1 1   11    3    9 o    834.2    2.9    0.0000   0.0000          ?        ?  6959.8857  48.5276          ?        ?      834.2        2.9       ?       ? 
1 1 1   11    3   10 o     54.2    2.9    0.0000   0.0000          ?        ?    29.3720   3.1926          ?        ?       54.2        2.9       ?       ? 
1 1 1   11    3   11 o    473.4    1.9    0.0000   0.0000          ?        ?  2241.2109  17.8786          ?        ?      473.4        1.9       ?       ? 
1 1 1   11    3   12 o   1099.0    3.8    0.0000   0.0000          ?        ? 12078.2754  83.0078          ?        ?     1099.0        3.8       ?       ? 
1 1 1   11    3   13 o   1045.5    3.6    0.0000   0.0000          ?        ? 10931.4902  74.7070          ?        ?     1045.5        3.6       ?       ? 
1 1 1   11    3   14 o    863.1    3.0    0.0000   0.0000          ?        ?  7450.2705  51.0817          ?        ?      863.1        3.0       ?       ? 
1 1 1   11    3   15 o    741.5    2.7    0.0000   0.0000          ?        ?  5497.6714  40.2269          ?        ?      741.5        2.7       ?       ? 
1 1 1   11    3   16 o    876.1    3.1    0.0000   0.0000          ?        ?  7676.3066  54.2743          ?        ?      876.1        3.1       ?       ? 
1 1 1   11    3   17 o   1522.5    5.0    0.0000   0.0000          ?        ? 23182.1660 151.9681          ?        ?     1522.5        5.0       ?       ? 
1 1 1   11    3   18 o    681.9    2.5    0.0000   0.0000          ?        ?  4649.7144  34.4802          ?        ?      681.9        2.5       ?       ? 
1 1 1   11    3   19 o   1476.9    4.9    0.0000   0.0000          ?        ? 21814.4531 144.3059          ?        ?     1476.9        4.9       ?       ? 
1 1 1   11    3   20 o    471.7    2.0    0.0000   0.0000          ?        ?  2225.2478  19.1556          ?        ?      471.7        2.0       ?       ? 
1 1 1   11    3   21 o   1168.2    4.0    0.0000   0.0000          ?        ? 13649.0391  94.5012          ?        ?     1168.2        4.0       ?       ? 
1 1 1   11    3   22 o    375.6    1.9    0.0000   0.0000          ?        ?  1410.4943  14.0475          ?        ?      375.6        1.9       ?       ? 
1 1 1   11    3   23 o   1133.1    3.9    0.0000   0.0000          ?        ? 12840.6699  87.4775          ?        ?     1133.1        3.9       ?       ? 
1 1 1   11    3   24 o    586.8    2.3    0.0000   0.0000          ?        ?  3443.5471  26.8179          ?        ?      586.8        2.3       ?       ? 
1 1 1   11    3   25 o    500.4    2.1    0.0000   0.0000          ?        ?  2503.6433  21.0712          ?        ?      500.4        2.1       ?       ? 
1 1 1   11    3   26 o    698.0    2.7    0.0000   0.0000          ?        ?  4871.9199  37.0343          ?        ?      698.0        2.7       ?       ? 
1 1 1   11    3   27 o    613.0    2.4    0.0000   0.0000          ?        ?  3757.6997  30.0105          ?        ?      613.0        2.4       ?       ? 
1 1 1   11    3   28 o   1411.7    4.8    0.0000   0.0000          ?        ? 19931.4531 136.0051          ?        ?     1411.7        4.8       ?       ? 
1 1 1   11    3   29 o   1386.1    4.7    0.0000   0.0000          ?        ? 19214.3926 130.8969          ?        ?     1386.1        4.7       ?       ? 
1 1 1   11    3   30 o   1173.6    4.1    0.0000   0.0000          ?        ? 13774.1885  96.4168          ?        ?     1173.6        4.1       ?       ? 
1 1 1   11    3   31 o   1646.7    5.9    0.0000   0.0000          ?        ? 27118.6523 195.3876          ?        ?     1646.7        5.9       ?       ? 
1 1 1   11    3   32 o    419.0    2.5    0.0000   0.0000          ?        ?  1755.9344  21.0712          ?        ?      419.0        2.5       ?       ? 
1 1 1   11    3   33 o    684.2    2.8    0.0000   0.0000          ?        ?  4681.6406  38.3113          ?        ?      684.2        2.8       ?       ? 
1 1 1   11    3   34 o   1153.2    4.1    0.0000   0.0000          ?        ? 13300.4053  93.8627          ?        ?     1153.2        4.1       ?       ? 
1 1 1   11    3   35 o    575.7    2.8    0.0000   0.0000          ?        ?  3314.5657  32.5646          ?        ?      575.7        2.8       ?       ? 
1 1 1   11    3   36 o   1004.8    3.6    0.0000   0.0000          ?        ? 10096.9424  72.1529          ?        ?     1004.8        3.6       ?       ? 
1 1 1   11    3   37 o    897.3    3.3    0.0000   0.0000          ?        ?  8052.3960  60.0210          ?        ?      897.3        3.3       ?       ? 
1 1 1   11    3   38 f   1047.9    3.7    0.0000   0.0000          ?        ? 10981.9336  76.6226          ?        ?     1047.9        3.7       ?       ? 
1 1 1   11    3   39 o    895.3    3.4    0.0000   0.0000          ?        ?  8016.0005  60.0210          ?        ?      895.3        3.4       ?       ? 
1 1 1   11    3   40 o    822.3    3.2    0.0000   0.0000          ?        ?  6761.9438  52.3588          ?        ?      822.3        3.2       ?       ? 
1 1 1   11    3   41 o    487.4    3.1    0.0000   0.0000          ?        ?  2375.3005  30.6490          ?        ?      487.4        3.1       ?       ? 
1 1 1   11    3   42 o    583.0    2.8    0.0000   0.0000          ?        ?  3398.8506  32.5646          ?        ?      583.0        2.8       ?       ? 
1 1 1   11    3   43 o   1455.1    4.9    0.0000   0.0000          ?        ? 21175.9297 143.6674          ?        ?     1455.1        4.9       ?       ? 
1 1 1   11    3   44 o    668.7    2.8    0.0000   0.0000          ?        ?  4471.5669  37.6728          ?        ?      668.7        2.8       ?       ? 
1 1 1   11    3   45 o    561.7    3.2    0.0000   0.0000          ?        ?  3155.5740  35.7572          ?        ?      561.7        3.2       ?       ? 
1 1 1   11    3   46 o    912.3    3.4    0.0000   0.0000          ?        ?  8323.7676  61.2981          ?        ?      912.3        3.4       ?       ? 
1 1 1   11    3   47 o   1561.6    5.2    0.0000   0.0000          ?        ? 24390.8867 162.1845          ?        ?     1561.6        5.2       ?       ? 
1 1 1   11    3   48 o    240.5    4.9    0.0000   0.0000          ?        ?   578.5006  23.6253          ?        ?      240.5        4.9       ?       ? 
1 1 1   11    3   49 o    583.7    2.9    0.0000   0.0000          ?        ?  3407.7900  33.8416          ?        ?      583.7        2.9       ?       ? 
1 1 1   11    3   50 o    291.8    3.8    0.0000   0.0000          ?        ?   851.7878  22.3483          ?        ?      291.8        3.8       ?       ? 
1 1 1   11    3   51 o    824.1    3.3    0.0000   0.0000          ?        ?  6791.9541  54.9129          ?        ?      824.1        3.3       ?       ? 
1 1 1   11    3   52 o    659.6    2.9    0.0000   0.0000          ?        ?  4350.8867  38.3113          ?        ?      659.6        2.9       ?       ? 
1 1 1   11    3   53 o    383.3    3.1    0.0000   0.0000          ?        ?  1469.2383  23.6253          ?        ?      383.3        3.1       ?       ? 
1 1 1   11    3   54 o    435.8    2.8    0.0000   0.0000          ?        ?  1899.6018  24.2638          ?        ?      435.8        2.8       ?       ? 
1 1 1   11    3   55 o    908.2    3.4    0.0000   0.0000          ?        ?  8250.3379  62.5751          ?        ?      908.2        3.4       ?       ? 
1 1 1   11    3   56 o    436.6    2.7    0.0000   0.0000          ?        ?  1906.6256  23.6253          ?        ?      436.6        2.7       ?       ? 
1 1 1   11    3   57 o    309.3    3.4    0.0000   0.0000          ?        ?   957.1439  21.0712          ?        ?      309.3        3.4       ?       ? 
1 1 1   11    3   58 o    349.3    3.2    0.0000   0.0000          ?        ?  1220.2148  22.3483          ?        ?      349.3        3.2       ?       ? 
1 1 1   11    3   59 o     55.0   15.6    0.0000   0.0000          ?        ?    31.2876  17.8786          ?        ?       55.0       15.6       ?       ? 
1 1 1   11    3   60 o    307.0    3.4    0.0000   0.0000          ?        ?   943.0964  21.0712          ?        ?      307.0        3.4       ?       ? 
1 1 1   11    3   61 o    195.3    5.1    0.0000   0.0000          ?        ?   381.8359  19.7942          ?        ?      195.3        5.1       ?       ? 
1 1 1   11    3   62 o    248.7    4.0    0.0000   0.0000          ?        ?   618.7275  19.7942          ?        ?      248.7        4.0       ?       ? 
1 1 1   11    3   63 o    371.3    2.9    0.0000   0.0000          ?        ?  1379.2067  21.7097          ?        ?      371.3        2.9       ?       ? 
1 1 1   11    3   64 o    310.8    3.3    0.0000   0.0000          ?        ?   966.7217  20.4327          ?        ?      310.8        3.3       ?       ? 
1 1 1   11    3   65 o    331.4    3.3    0.0000   0.0000          ?        ?  1098.8958  21.7097          ?        ?      331.4        3.3       ?       ? 
1 1 1   11    3   66 o    105.4    9.4    0.0000   0.0000          ?        ?   111.7413  19.7942          ?        ?      105.4        9.4       ?       ? 
1 1 1   11    3   67 o     87.2   11.3    0.0000   0.0000          ?        ?    76.6226  19.7942          ?        ?       87.2       11.3       ?       ? 
1 1 1   11    3   68 o    273.4    4.1    0.0000   0.0000          ?        ?   748.3474  22.3483          ?        ?      273.4        4.1       ?       ? 
1 1 1   11    3   69 o    174.0    5.9    0.0000   0.0000          ?        ?   303.2978  20.4327          ?        ?      174.0        5.9       ?       ? 
1 1 1   11    3   70 f    111.2    9.5    0.0000   0.0000          ?        ?   124.5117  21.0712          ?        ?      111.2        9.5       ?       ? 
1 1 1   11    3   71 o    155.1    7.2    0.0000   0.0000          ?        ?   241.3612  22.3483          ?        ?      155.1        7.2       ?       ? 
1 1 1   11    3   72 o     76.1   14.4    0.0000   0.0000          ?        ?    60.6596  21.0712          ?        ?       76.1       14.4       ?       ? 
1 1 1   11    3   73 o    240.6    4.5    0.0000   0.0000          ?        ?   579.7776  21.7097          ?        ?      240.6        4.5       ?       ? 
1 1 1   11    3   74 o     30.3   14.3    0.0000   0.0000          ?        ?   -23.6253  22.3483          ?        ?       30.3       14.3       ?       ? 
1 1 1   11    3   75 o    277.0    4.1    0.0000   0.0000          ?        ?   768.7800  22.9868          ?        ?      277.0        4.1       ?       ? 
1 1 1   11    3   76 o     26.4   12.9    0.0000   0.0000          ?        ?   -40.8654  22.3483          ?        ?       26.4       12.9       ?       ? 
1 1 1   11    3   77 o     44.5   17.2    0.0000   0.0000          ?        ?    14.0475  21.7097          ?        ?       44.5       17.2       ?       ? 
1 1 1   11    3   78 o     51.1   17.8    0.0000   0.0000          ?        ?    24.9023  22.3483          ?        ?       51.1       17.8       ?       ? 
1 1 1   11    3   79 o     44.2   16.8    0.0000   0.0000          ?        ?    15.3245  20.4327          ?        ?       44.2       16.8       ?       ? 
1 1 1   11    3   80 o     33.3   15.1    0.0000   0.0000          ?        ?   -10.8549  21.7097          ?        ?       33.3       15.1       ?       ? 
1 1 1   11    3   81 o    102.1   10.6    0.0000   0.0000          ?        ?   106.6331  21.7097          ?        ?      102.1       10.6       ?       ? 
1 1 1   11    4    0 o   1369.5    6.3 18757.8496 173.6779 18757.8496 173.6779 18757.8496 173.6779     1369.5      6.3     1369.5        6.3     0.0     0.0 
1 1 1   11    4    1 o    615.8    2.2    0.0000   0.0000          ?        ?  3791.5413  27.4564          ?        ?      615.8        2.2       ?       ? 
1 1 1   11    4    2 o    721.3    2.6    0.0000   0.0000          ?        ?  5202.6743  37.0343          ?        ?      721.3        2.6       ?       ? 
1 1 1   11    4    3 o   1826.8    6.2    0.0000   0.0000          ?        ? 33376.8047 224.7596          ?        ?     1826.8        6.2       ?       ? 
1 1 1   11    4    4 o   1030.6    3.6    0.0000   0.0000          ?        ? 10622.4453  73.4300          ?        ?     1030.6        3.6       ?       ? 
1 1 1   11    4    5 o    471.6    1.8    0.0000   0.0000          ?        ?  2223.9707  16.6016          ?        ?      471.6        1.8       ?       ? 
1 1 1   11    4    6 o    299.8    1.4    0.0000   0.0000          ?        ?   899.0385   8.3008          ?        ?      299.8        1.4       ?       ? 
1 1 1   11    4    7 o    503.0    1.9    0.0000   0.0000          ?        ?  2530.4612  19.1556          ?        ?      503.0        1.9       ?       ? 
1 1 1   11    4    8 o   1102.3    3.7    0.0000   0.0000          ?        ? 12151.7051  81.7308          ?        ?     1102.3        3.7       ?       ? 
1 1 1   11    4    9 o    823.0    2.9    0.0000   0.0000          ?        ?  6773.4375  47.2506          ?        ?      823.0        2.9       ?       ? 
1 1 1   11    4   10 o    970.8    3.3    0.0000   0.0000          ?        ?  9425.2178  63.8522          ?        ?      970.8        3.3       ?       ? 
1 1 1   11    4   11 o   1361.0    4.6    0.0000   0.0000          ?        ? 18525.4277 125.1502          ?        ?     1361.0        4.6       ?       ? 
1 1 1   11    4   12 o    908.8    3.2    0.0000   0.0000          ?        ?  8258.6387  57.4669          ?        ?      908.8        3.2       ?       ? 
1 1 1   11    4   13 o    323.3    1.6    0.0000   0.0000          ?        ?  1045.2599  10.2163          ?        ?      323.3        1.6       ?       ? 
1 1 1   11    4   14 f    320.6    1.6    0.0000   0.0000          ?        ?  1028.0198  10.2163          ?        ?      320.6        1.6       ?       ? 
1 1 1   11    4   15 o    633.3    2.3    0.0000   0.0000          ?        ?  4010.5542  29.3720          ?        ?      633.3        2.3       ?       ? 
1 1 1   11    4   16 o    140.2    2.0    0.0000   0.0000          ?        ?   196.6647   5.7467          ?        ?      140.2        2.0       ?       ? 
1 1 1   11    4   17 o   1016.7    3.5    0.0000   0.0000          ?        ? 10337.6650  70.8759          ?        ?     1016.7        3.5       ?       ? 
1 1 1   11    4   18 o    481.0    2.0    0.0000   0.0000          ?        ?  2314.0024  19.1556          ?        ?      481.0        2.0       ?       ? 
1 1 1   11    4   19 o    633.8    2.4    0.0000   0.0000          ?        ?  4016.9395  30.6490          ?        ?      633.8        2.4       ?       ? 
1 1 1   11    4   20 o    758.6    2.8    0.0000   0.0000          ?        ?  5755.6343  42.7809          ?        ?      758.6        2.8       ?       ? 
1 1 1   11    4   21 o    899.2    3.1    0.0000   0.0000          ?        ?  8086.8765  56.1899          ?        ?      899.2        3.1       ?       ? 
1 1 1   11    4   22 o    440.1    2.0    0.0000   0.0000          ?        ?  1937.2745  17.2401          ?        ?      440.1        2.0       ?       ? 
1 1 1   11    4   23 o    219.7    2.5    0.0000   0.0000          ?        ?   482.7224  10.8549          ?        ?      219.7        2.5       ?       ? 
1 1 1   11    4   24 o    344.9    1.9    0.0000   0.0000          ?        ?  1189.5658  13.4090          ?        ?      344.9        1.9       ?       ? 
1 1 1   11    4   25 o   1889.0    6.1    0.0000   0.0000          ?        ? 35689.5273 231.7833          ?        ?     1889.0        6.1       ?       ? 
1 1 1   11    4   26 o    443.7    1.9    0.0000   0.0000          ?        ?  1968.5621  17.2401          ?        ?      443.7        1.9       ?       ? 
1 1 1   11    4   27 o   2017.1    6.7    0.0000   0.0000          ?        ? 40692.3438 269.4561          ?        ?     2017.1        6.7       ?       ? 
1 1 1   11    4   28 o    927.4    3.6    0.0000   0.0000          ?        ?  8600.8867  67.6833          ?        ?      927.4        3.6       ?       ? 
1 1 1   11    4   29 o   1645.0    5.5    0.0000   0.0000          ?        ? 27062.4609 181.3401          ?        ?     1645.0        5.5       ?       ? 
1 1 1   11    4   30 o   1155.6    4.1    0.0000   0.0000          ?        ? 13354.6797  94.5012          ?        ?     1155.6        4.1       ?       ? 
1 1 1   11    4   31 o   1120.9    4.1    0.0000   0.0000          ?        ? 12564.1895  91.9471          ?        ?     1120.9        4.1       ?       ? 
1 1 1   11    4   32 o   1466.7    5.0    0.0000   0.0000          ?        ? 21512.4336 146.8600          ?        ?     1466.7        5.0       ?       ? 
1 1 1   11    4   33 o    810.2    3.2    0.0000   0.0000          ?        ?  6564.0024  52.3588          ?        ?      810.2        3.2       ?       ? 
1 1 1   11    4   34 o    828.2    3.2    0.0000   0.0000          ?        ?  6858.9990  52.3588          ?        ?      828.2        3.2       ?       ? 
1 1 1   11    4   35 o    481.3    2.6    0.0000   0.0000          ?        ?  2316.5564  24.9023          ?        ?      481.3        2.6       ?       ? 
1 1 1   11    4   36 o    971.6    3.5    0.0000   0.0000          ?        ?  9440.5420  67.6833          ?        ?      971.6        3.5       ?       ? 
1 1 1   11    4   37 o    973.1    3.4    0.0000   0.0000          ?        ?  9470.5527  67.0448          ?        ?      973.1        3.4       ?       ? 
1 1 1   11    4   38 o    568.5    3.0    0.0000   0.0000          ?        ?  3231.5581  33.8416          ?        ?      568.5        3.0       ?       ? 
1 1 1   11    4   39 o    863.2    3.3    0.0000   0.0000          ?        ?  7452.1855  56.8284          ?        ?      863.2        3.3       ?       ? 
1 1 1   11    4   40 o    163.4    6.4    0.0000   0.0000          ?        ?   266.9020  21.0712          ?        ?      163.4        6.4       ?       ? 
1 1 1   11    4   41 f   1821.3    6.2    0.0000   0.0000          ?        ? 33178.2227 226.0367          ?        ?     1821.3        6.2       ?       ? 
1 1 1   11    4   42 o    799.1    3.2    0.0000   0.0000          ?        ?  6385.8545  51.0817          ?        ?      799.1        3.2       ?       ? 
1 1 1   11    4   43 o    913.4    3.3    0.0000   0.0000          ?        ?  8343.5615  60.6596          ?        ?      913.4        3.3       ?       ? 
1 1 1   11    4   44 o    520.5    2.8    0.0000   0.0000          ?        ?  2709.2471  28.7335          ?        ?      520.5        2.8       ?       ? 
1 1 1   11    4   45 f    640.1    2.8    0.0000   0.0000          ?        ?  4097.3936  36.3957          ?        ?      640.1        2.8       ?       ? 
1 1 1   11    4   46 f   1437.9    5.1    0.0000   0.0000          ?        ? 20678.5234 146.8600          ?        ?     1437.9        5.1       ?       ? 
1 1 1   11    4   47 o    404.8    3.1    0.0000   0.0000          ?        ?  1638.4465  24.9023          ?        ?      404.8        3.1       ?       ? 
1 1 1   11    4   48 o    153.0    6.7    0.0000   0.0000          ?        ?   234.3374  20.4327          ?        ?      153.0        6.7       ?       ? 
1 1 1   11    4   49 o    387.8    3.0    0.0000   0.0000          ?        ?  1503.7184  23.6253          ?        ?      387.8        3.0       ?       ? 
1 1 1   11    4   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    4   51 o    465.1    2.8    0.0000   0.0000          ?        ?  2163.3113  26.1794          ?        ?      465.1        2.8       ?       ? 
1 1 1   11    4   52 o    868.4    3.3    0.0000   0.0000          ?        ?  7542.2173  58.1055          ?        ?      868.4        3.3       ?       ? 
1 1 1   11    4   53 o    213.9    4.8    0.0000   0.0000          ?        ?   457.8200  20.4327          ?        ?      213.9        4.8       ?       ? 
1 1 1   11    4   54 o    165.6    5.8    0.0000   0.0000          ?        ?   274.5643  19.1556          ?        ?      165.6        5.8       ?       ? 
1 1 1   11    4   55 o    494.7    2.8    0.0000   0.0000          ?        ?  2448.0918  27.4564          ?        ?      494.7        2.8       ?       ? 
1 1 1   11    4   56 o     39.2   16.0    0.0000   0.0000          ?        ?     5.7467  19.7942          ?        ?       39.2       16.0       ?       ? 
1 1 1   11    4   57 o    562.2    2.7    0.0000   0.0000          ?        ?  3161.3206  30.6490          ?        ?      562.2        2.7       ?       ? 
1 1 1   11    4   58 o    310.2    3.2    0.0000   0.0000          ?        ?   962.2521  19.7942          ?        ?      310.2        3.2       ?       ? 
1 1 1   11    4   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    4   60 o    449.6    2.8    0.0000   0.0000          ?        ?  2021.5594  25.5409          ?        ?      449.6        2.8       ?       ? 
1 1 1   11    4   61 o    342.8    3.2    0.0000   0.0000          ?        ?  1175.5183  21.7097          ?        ?      342.8        3.2       ?       ? 
1 1 1   11    4   62 o    325.5    3.2    0.0000   0.0000          ?        ?  1059.9459  21.0712          ?        ?      325.5        3.2       ?       ? 
1 1 1   11    4   63 f    199.2    5.1    0.0000   0.0000          ?        ?   397.1605  20.4327          ?        ?      199.2        5.1       ?       ? 
1 1 1   11    4   64 o    278.9    3.5    0.0000   0.0000          ?        ?   778.3578  19.7942          ?        ?      278.9        3.5       ?       ? 
1 1 1   11    4   65 o     93.6   10.2    0.0000   0.0000          ?        ?    88.1160  19.1556          ?        ?       93.6       10.2       ?       ? 
1 1 1   11    4   66 o    294.9    3.7    0.0000   0.0000          ?        ?   870.3050  21.7097          ?        ?      294.9        3.7       ?       ? 
1 1 1   11    4   67 o    119.9    8.8    0.0000   0.0000          ?        ?   144.3059  21.0712          ?        ?      119.9        8.8       ?       ? 
1 1 1   11    4   68 o    298.1    3.6    0.0000   0.0000          ?        ?   889.4606  21.7097          ?        ?      298.1        3.6       ?       ? 
1 1 1   11    4   69 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    4   70 o    202.6    5.4    0.0000   0.0000          ?        ?   411.2079  21.7097          ?        ?      202.6        5.4       ?       ? 
1 1 1   11    4   71 o    146.4    7.2    0.0000   0.0000          ?        ?   215.1818  21.0712          ?        ?      146.4        7.2       ?       ? 
1 1 1   11    4   72 o    251.1    4.5    0.0000   0.0000          ?        ?   631.4979  22.3483          ?        ?      251.1        4.5       ?       ? 
1 1 1   11    4   73 o    154.0    7.0    0.0000   0.0000          ?        ?   238.1686  21.7097          ?        ?      154.0        7.0       ?       ? 
1 1 1   11    4   74 o    110.4   10.4    0.0000   0.0000          ?        ?   123.2347  22.9868          ?        ?      110.4       10.4       ?       ? 
1 1 1   11    4   75 o     46.8   17.4    0.0000   0.0000          ?        ?    17.8786  21.7097          ?        ?       46.8       17.4       ?       ? 
1 1 1   11    4   76 o     78.5   14.8    0.0000   0.0000          ?        ?    65.1292  22.3483          ?        ?       78.5       14.8       ?       ? 
1 1 1   11    4   77 o     76.1   14.4    0.0000   0.0000          ?        ?    61.2981  21.0712          ?        ?       76.1       14.4       ?       ? 
1 1 1   11    4   78 o    102.6   11.2    0.0000   0.0000          ?        ?   107.2716  22.9868          ?        ?      102.6       11.2       ?       ? 
1 1 1   11    4   79 o    197.4    5.8    0.0000   0.0000          ?        ?   392.0523  22.9868          ?        ?      197.4        5.8       ?       ? 
1 1 1   11    4   80 o     24.0   11.9    0.0000   0.0000          ?        ?   -46.6121  21.0712          ?        ?       24.0       11.9       ?       ? 
1 1 1   11    4   81 o    172.7    5.5    0.0000   0.0000          ?        ?   300.1052  19.1556          ?        ?      172.7        5.5       ?       ? 
1 1 1   11    5    0 o    118.5    1.9  140.4748   4.4697   140.4748   4.4697   140.4748   4.4697      118.5      1.9      118.5        1.9     0.0     0.0 
1 1 1   11    5    1 o    878.0    3.1    0.0000   0.0000          ?        ?  7708.8721  54.9129          ?        ?      878.0        3.1       ?       ? 
1 1 1   11    5    2 o    846.2    3.0    0.0000   0.0000          ?        ?  7160.3818  50.4432          ?        ?      846.2        3.0       ?       ? 
1 1 1   11    5    3 o    864.0    3.0    0.0000   0.0000          ?        ?  7465.5947  52.3588          ?        ?      864.0        3.0       ?       ? 
1 1 1   11    5    4 o    811.7    2.9    0.0000   0.0000          ?        ?  6588.9048  46.6121          ?        ?      811.7        2.9       ?       ? 
1 1 1   11    5    5 o   1024.9    3.5    0.0000   0.0000          ?        ? 10504.3193  70.8759          ?        ?     1024.9        3.5       ?       ? 
1 1 1   11    5    6 o   1011.7    3.5    0.0000   0.0000          ?        ? 10234.8633  70.2374          ?        ?     1011.7        3.5       ?       ? 
1 1 1   11    5    7 o    358.4    1.5    0.0000   0.0000          ?        ?  1284.7054  10.8549          ?        ?      358.4        1.5       ?       ? 
1 1 1   11    5    8 o    745.1    2.6    0.0000   0.0000          ?        ?  5551.9453  38.9498          ?        ?      745.1        2.6       ?       ? 
1 1 1   11    5    9 o    495.7    1.9    0.0000   0.0000          ?        ?  2457.6697  19.1556          ?        ?      495.7        1.9       ?       ? 
1 1 1   11    5   10 o   1266.0    4.3    0.0000   0.0000          ?        ? 16027.5322 108.5487          ?        ?     1266.0        4.3       ?       ? 
1 1 1   11    5   11 o    578.0    2.2    0.0000   0.0000          ?        ?  3341.3835  24.9023          ?        ?      578.0        2.2       ?       ? 
1 1 1   11    5   12 o   1180.6    4.1    0.0000   0.0000          ?        ? 13938.2881  95.7782          ?        ?     1180.6        4.1       ?       ? 
1 1 1   11    5   13 o    683.5    2.5    0.0000   0.0000          ?        ?  4672.0630  34.4802          ?        ?      683.5        2.5       ?       ? 
1 1 1   11    5   14 o    359.0    1.6    0.0000   0.0000          ?        ?  1288.5366  11.4934          ?        ?      359.0        1.6       ?       ? 
1 1 1   11    5   15 o    441.5    1.9    0.0000   0.0000          ?        ?  1949.4065  16.6016          ?        ?      441.5        1.9       ?       ? 
1 1 1   11    5   16 f    643.4    2.4    0.0000   0.0000          ?        ?  4140.1743  30.6490          ?        ?      643.4        2.4       ?       ? 
1 1 1   11    5   17 o    906.9    3.2    0.0000   0.0000          ?        ?  8225.4355  58.7440          ?        ?      906.9        3.2       ?       ? 
1 1 1   11    5   18 o    578.8    2.2    0.0000   0.0000          ?        ?  3350.3230  25.5409          ?        ?      578.8        2.2       ?       ? 
1 1 1   11    5   19 o    963.4    3.3    0.0000   0.0000          ?        ?  9282.8281  63.8522          ?        ?      963.4        3.3       ?       ? 
1 1 1   11    5   20 o   1101.2    3.7    0.0000   0.0000          ?        ? 12128.0801  82.3693          ?        ?     1101.2        3.7       ?       ? 
1 1 1   11    5   21 o    764.8    2.8    0.0000   0.0000          ?        ?  5849.4966  42.1424          ?        ?      764.8        2.8       ?       ? 
1 1 1   11    5   22 o    982.4    3.4    0.0000   0.0000          ?        ?  9651.8926  67.6833          ?        ?      982.4        3.4       ?       ? 
1 1 1   11    5   23 o    696.6    2.6    0.0000   0.0000          ?        ?  4852.7642  36.3957          ?        ?      696.6        2.6       ?       ? 
1 1 1   11    5   24 o    477.8    2.1    0.0000   0.0000          ?        ?  2282.7148  19.7942          ?        ?      477.8        2.1       ?       ? 
1 1 1   11    5   25 o    838.4    3.2    0.0000   0.0000          ?        ?  7028.8462  52.9973          ?        ?      838.4        3.2       ?       ? 
1 1 1   11    5   26 o    463.0    2.3    0.0000   0.0000          ?        ?  2144.1555  21.7097          ?        ?      463.0        2.3       ?       ? 
1 1 1   11    5   27 o    588.8    2.4    0.0000   0.0000          ?        ?  3467.1724  28.7335          ?        ?      588.8        2.4       ?       ? 
1 1 1   11    5   28 o    722.1    2.9    0.0000   0.0000          ?        ?  5214.8062  41.5039          ?        ?      722.1        2.9       ?       ? 
1 1 1   11    5   29 o    635.5    2.5    0.0000   0.0000          ?        ?  4039.2876  31.2876          ?        ?      635.5        2.5       ?       ? 
1 1 1   11    5   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    5   31 o    515.3    2.5    0.0000   0.0000          ?        ?  2655.6113  26.1794          ?        ?      515.3        2.5       ?       ? 
1 1 1   11    5   32 o    862.1    3.6    0.0000   0.0000          ?        ?  7432.3916  61.2981          ?        ?      862.1        3.6       ?       ? 
1 1 1   11    5   33 o    163.8    4.9    0.0000   0.0000          ?        ?   268.1791  15.9630          ?        ?      163.8        4.9       ?       ? 
1 1 1   11    5   34 o   1127.9    3.9    0.0000   0.0000          ?        ? 12723.1816  87.4775          ?        ?     1127.9        3.9       ?       ? 
1 1 1   11    5   35 o    291.4    3.6    0.0000   0.0000          ?        ?   849.2338  21.0712          ?        ?      291.4        3.6       ?       ? 
1 1 1   11    5   36 o   1540.9    5.2    0.0000   0.0000          ?        ? 23747.2578 160.9075          ?        ?     1540.9        5.2       ?       ? 
1 1 1   11    5   37 o   1276.7    4.4    0.0000   0.0000          ?        ? 16300.1807 113.0183          ?        ?     1276.7        4.4       ?       ? 
1 1 1   11    5   38 o    585.0    3.2    0.0000   0.0000          ?        ?  3422.4758  37.6728          ?        ?      585.0        3.2       ?       ? 
1 1 1   11    5   39 o    461.2    2.5    0.0000   0.0000          ?        ?  2127.5542  22.9868          ?        ?      461.2        2.5       ?       ? 
1 1 1   11    5   40 o   1191.7    4.1    0.0000   0.0000          ?        ? 14203.2744  98.3323          ?        ?     1191.7        4.1       ?       ? 
1 1 1   11    5   41 o    365.4    2.8    0.0000   0.0000          ?        ?  1335.1488  20.4327          ?        ?      365.4        2.8       ?       ? 
1 1 1   11    5   42 o    440.8    2.8    0.0000   0.0000          ?        ?  1943.0212  24.9023          ?        ?      440.8        2.8       ?       ? 
1 1 1   11    5   43 o    419.1    2.6    0.0000   0.0000          ?        ?  1756.5730  21.7097          ?        ?      419.1        2.6       ?       ? 
1 1 1   11    5   44 o    776.5    3.0    0.0000   0.0000          ?        ?  6030.1982  47.2506          ?        ?      776.5        3.0       ?       ? 
1 1 1   11    5   45 o     99.4   10.0    0.0000   0.0000          ?        ?    98.9709  19.7942          ?        ?       99.4       10.0       ?       ? 
1 1 1   11    5   46 o    762.5    3.0    0.0000   0.0000          ?        ?  5814.3779  45.9736          ?        ?      762.5        3.0       ?       ? 
1 1 1   11    5   47 o    902.2    3.3    0.0000   0.0000          ?        ?  8140.5122  60.0210          ?        ?      902.2        3.3       ?       ? 
1 1 1   11    5   48 o    998.9    3.6    0.0000   0.0000          ?        ?  9979.4551  72.1529          ?        ?      998.9        3.6       ?       ? 
1 1 1   11    5   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    5   50 o    670.9    2.9    0.0000   0.0000          ?        ?  4501.5776  38.9498          ?        ?      670.9        2.9       ?       ? 
1 1 1   11    5   51 o    588.1    2.9    0.0000   0.0000          ?        ?  3459.5100  34.4802          ?        ?      588.1        2.9       ?       ? 
1 1 1   11    5   52 o    188.2    5.3    0.0000   0.0000          ?        ?   354.3795  19.7942          ?        ?      188.2        5.3       ?       ? 
1 1 1   11    5   53 o    499.4    2.7    0.0000   0.0000          ?        ?  2494.0654  26.8179          ?        ?      499.4        2.7       ?       ? 
1 1 1   11    5   54 o     43.1   16.3    0.0000   0.0000          ?        ?    13.4090  19.1556          ?        ?       43.1       16.3       ?       ? 
1 1 1   11    5   55 o    141.5    7.0    0.0000   0.0000          ?        ?   200.4958  19.7942          ?        ?      141.5        7.0       ?       ? 
1 1 1   11    5   56 o    306.2    3.2    0.0000   0.0000          ?        ?   937.9882  19.7942          ?        ?      306.2        3.2       ?       ? 
1 1 1   11    5   57 o    205.7    4.5    0.0000   0.0000          ?        ?   423.3398  18.5171          ?        ?      205.7        4.5       ?       ? 
1 1 1   11    5   58 o    425.0    2.8    0.0000   0.0000          ?        ?  1806.3777  23.6253          ?        ?      425.0        2.8       ?       ? 
1 1 1   11    5   59 o    191.7    4.8    0.0000   0.0000          ?        ?   367.7885  18.5171          ?        ?      191.7        4.8       ?       ? 
1 1 1   11    5   60 o    112.6    7.9    0.0000   0.0000          ?        ?   127.0658  17.8786          ?        ?      112.6        7.9       ?       ? 
1 1 1   11    5   61 o    138.5    6.7    0.0000   0.0000          ?        ?   192.1950  18.5171          ?        ?      138.5        6.7       ?       ? 
1 1 1   11    5   62 o    374.3    3.1    0.0000   0.0000          ?        ?  1401.5549  22.9868          ?        ?      374.3        3.1       ?       ? 
1 1 1   11    5   63 o    146.1    6.6    0.0000   0.0000          ?        ?   213.9047  19.1556          ?        ?      146.1        6.6       ?       ? 
1 1 1   11    5   64 o    372.2    3.1    0.0000   0.0000          ?        ?  1386.2305  22.9868          ?        ?      372.2        3.1       ?       ? 
1 1 1   11    5   65 o     71.2   13.9    0.0000   0.0000          ?        ?    52.9973  19.1556          ?        ?       71.2       13.9       ?       ? 
1 1 1   11    5   66 o    187.6    5.4    0.0000   0.0000          ?        ?   352.4639  20.4327          ?        ?      187.6        5.4       ?       ? 
1 1 1   11    5   67 o    283.1    3.9    0.0000   0.0000          ?        ?   801.9832  22.3483          ?        ?      283.1        3.9       ?       ? 
1 1 1   11    5   68 o    256.4    4.4    0.0000   0.0000          ?        ?   658.3158  22.3483          ?        ?      256.4        4.4       ?       ? 
1 1 1   11    5   69 o    225.6    4.8    0.0000   0.0000          ?        ?   509.5403  21.7097          ?        ?      225.6        4.8       ?       ? 
1 1 1   11    5   70 o    361.6    3.4    0.0000   0.0000          ?        ?  1308.3308  24.9023          ?        ?      361.6        3.4       ?       ? 
1 1 1   11    5   71 o    364.9    3.2    0.0000   0.0000          ?        ?  1332.5946  23.6253          ?        ?      364.9        3.2       ?       ? 
1 1 1   11    5   72 o    243.2    4.6    0.0000   0.0000          ?        ?   592.5481  22.3483          ?        ?      243.2        4.6       ?       ? 
1 1 1   11    5   73 o    148.3    7.5    0.0000   0.0000          ?        ?   220.9285  22.3483          ?        ?      148.3        7.5       ?       ? 
1 1 1   11    5   74 o    202.0    5.7    0.0000   0.0000          ?        ?   409.2924  22.9868          ?        ?      202.0        5.7       ?       ? 
1 1 1   11    5   75 o     51.1   17.6    0.0000   0.0000          ?        ?    24.9023  21.7097          ?        ?       51.1       17.6       ?       ? 
1 1 1   11    5   76 o    205.9    5.4    0.0000   0.0000          ?        ?   425.2554  22.3483          ?        ?      205.9        5.4       ?       ? 
1 1 1   11    5   77 o    110.6    9.8    0.0000   0.0000          ?        ?   123.8732  21.7097          ?        ?      110.6        9.8       ?       ? 
1 1 1   11    5   78 o    189.7    5.6    0.0000   0.0000          ?        ?   361.4032  21.0712          ?        ?      189.7        5.6       ?       ? 
1 1 1   11    5   79 o    374.6    3.2    0.0000   0.0000          ?        ?  1405.3861  23.6253          ?        ?      374.6        3.2       ?       ? 
1 1 1   11    5   80 o    113.8    9.0    0.0000   0.0000          ?        ?   131.5355  20.4327          ?        ?      113.8        9.0       ?       ? 
1 1 1   11    6    0 o     29.8    8.7   10.8549   4.4697    10.8549   4.4697    10.8549   4.4697       29.8      8.7       29.8        8.7     0.0     0.0 
1 1 1   11    6    1 o   1845.3    6.6    0.0000   0.0000          ?        ? 34055.5508 241.9997          ?        ?     1845.3        6.6       ?       ? 
1 1 1   11    6    2 o   1280.4    4.4    0.0000   0.0000          ?        ? 16394.6816 113.6568          ?        ?     1280.4        4.4       ?       ? 
1 1 1   11    6    3 o   1808.9    6.3    0.0000   0.0000          ?        ? 32726.7871 226.6752          ?        ?     1808.9        6.3       ?       ? 
1 1 1   11    6    4 o    556.0    2.1    0.0000   0.0000          ?        ?  3091.0833  22.9868          ?        ?      556.0        2.1       ?       ? 
1 1 1   11    6    5 o   1885.8    6.6    0.0000   0.0000          ?        ? 35565.6562 247.1079          ?        ?     1885.8        6.6       ?       ? 
1 1 1   11    6    6 o   1976.0    6.7    0.0000   0.0000          ?        ? 39050.7031 263.0709          ?        ?     1976.0        6.7       ?       ? 
1 1 1   11    6    7 o   1523.1    5.0    0.0000   0.0000          ?        ? 23198.7676 151.3296          ?        ?     1523.1        5.0       ?       ? 
1 1 1   11    6    8 f    590.0    2.3    0.0000   0.0000          ?        ?  3480.5813  26.8179          ?        ?      590.0        2.3       ?       ? 
1 1 1   11    6    9 o    749.5    2.6    0.0000   0.0000          ?        ?  5617.7134  39.5883          ?        ?      749.5        2.6       ?       ? 
1 1 1   11    6   10 o   1372.9    4.5    0.0000   0.0000          ?        ? 18851.0742 123.8732          ?        ?     1372.9        4.5       ?       ? 
1 1 1   11    6   11 o    231.7    1.5    0.0000   0.0000          ?        ?   536.9967   7.0237          ?        ?      231.7        1.5       ?       ? 
1 1 1   11    6   12 o    777.7    2.8    0.0000   0.0000          ?        ?  6048.7153  42.7809          ?        ?      777.7        2.8       ?       ? 
1 1 1   11    6   13 o    810.6    2.9    0.0000   0.0000          ?        ?  6571.6641  47.2506          ?        ?      810.6        2.9       ?       ? 
1 1 1   11    6   14 o    462.6    1.9    0.0000   0.0000          ?        ?  2139.6860  17.2401          ?        ?      462.6        1.9       ?       ? 
1 1 1   11    6   15 o    757.5    2.7    0.0000   0.0000          ?        ?  5737.7554  40.8654          ?        ?      757.5        2.7       ?       ? 
1 1 1   11    6   16 o    938.9    3.3    0.0000   0.0000          ?        ?  8816.0674  62.5751          ?        ?      938.9        3.3       ?       ? 
1 1 1   11    6   17 o    474.1    2.0    0.0000   0.0000          ?        ?  2247.5962  18.5171          ?        ?      474.1        2.0       ?       ? 
1 1 1   11    6   18 o   1113.5    3.8    0.0000   0.0000          ?        ? 12400.7285  84.2849          ?        ?     1113.5        3.8       ?       ? 
1 1 1   11    6   19 o    796.9    2.8    0.0000   0.0000          ?        ?  6350.0977  45.3350          ?        ?      796.9        2.8       ?       ? 
1 1 1   11    6   20 f    747.0    2.7    0.0000   0.0000          ?        ?  5580.6792  40.8654          ?        ?      747.0        2.7       ?       ? 
1 1 1   11    6   21 o    788.3    2.8    0.0000   0.0000          ?        ?  6214.0928  44.6965          ?        ?      788.3        2.8       ?       ? 
1 1 1   11    6   22 o    404.8    1.9    0.0000   0.0000          ?        ?  1638.4465  15.3245          ?        ?      404.8        1.9       ?       ? 
1 1 1   11    6   23 o    740.0    2.7    0.0000   0.0000          ?        ?  5476.6001  40.2269          ?        ?      740.0        2.7       ?       ? 
1 1 1   11    6   24 o    258.6    2.0    0.0000   0.0000          ?        ?   668.5321  10.2163          ?        ?      258.6        2.0       ?       ? 
1 1 1   11    6   25 o    235.1    2.0    0.0000   0.0000          ?        ?   552.9597   9.5778          ?        ?      235.1        2.0       ?       ? 
1 1 1   11    6   26 o    292.6    2.2    0.0000   0.0000          ?        ?   856.2576  12.7704          ?        ?      292.6        2.2       ?       ? 
1 1 1   11    6   27 o   1632.9    5.9    0.0000   0.0000          ?        ? 26667.2168 192.8335          ?        ?     1632.9        5.9       ?       ? 
1 1 1   11    6   28 o   1825.4    6.3    0.0000   0.0000          ?        ? 33324.4453 231.7833          ?        ?     1825.4        6.3       ?       ? 
1 1 1   11    6   29 o   1130.9    4.1    0.0000   0.0000          ?        ? 12790.8652  91.9471          ?        ?     1130.9        4.1       ?       ? 
1 1 1   11    6   30 o   1686.3    5.9    0.0000   0.0000          ?        ? 28440.3926 199.2188          ?        ?     1686.3        5.9       ?       ? 
1 1 1   11    6   31 o   1565.1    5.5    0.0000   0.0000          ?        ? 24498.7988 172.4008          ?        ?     1565.1        5.5       ?       ? 
1 1 1   11    6   32 o    990.4    3.7    0.0000   0.0000          ?        ?  9810.2461  74.0685          ?        ?      990.4        3.7       ?       ? 
1 1 1   11    6   33 o    965.9    3.5    0.0000   0.0000          ?        ?  9330.0781  68.3218          ?        ?      965.9        3.5       ?       ? 
1 1 1   11    6   34 o   1096.8    4.0    0.0000   0.0000          ?        ? 12029.7471  88.1160          ?        ?     1096.8        4.0       ?       ? 
1 1 1   11    6   35 o    158.0    4.8    0.0000   0.0000          ?        ?   249.6619  15.3245          ?        ?      158.0        4.8       ?       ? 
1 1 1   11    6   36 o    995.2    3.6    0.0000   0.0000          ?        ?  9905.3867  71.5144          ?        ?      995.2        3.6       ?       ? 
1 1 1   11    6   37 o    102.6   10.6    0.0000   0.0000          ?        ?   105.3561  21.7097          ?        ?      102.6       10.6       ?       ? 
1 1 1   11    6   38 o    448.3    2.5    0.0000   0.0000          ?        ?  2010.0660  22.3483          ?        ?      448.3        2.5       ?       ? 
1 1 1   11    6   39 o    493.4    3.0    0.0000   0.0000          ?        ?  2434.6829  29.3720          ?        ?      493.4        3.0       ?       ? 
1 1 1   11    6   40 o    875.9    3.4    0.0000   0.0000          ?        ?  7671.8374  58.7440          ?        ?      875.9        3.4       ?       ? 
1 1 1   11    6   41 o   1533.5    5.1    0.0000   0.0000          ?        ? 23519.9434 155.7993          ?        ?     1533.5        5.1       ?       ? 
1 1 1   11    6   42 o    189.9    4.9    0.0000   0.0000          ?        ?   360.7647  18.5171          ?        ?      189.9        4.9       ?       ? 
1 1 1   11    6   43 o    774.8    3.1    0.0000   0.0000          ?        ?  6002.7417  48.5276          ?        ?      774.8        3.1       ?       ? 
1 1 1   11    6   44 o    346.2    3.2    0.0000   0.0000          ?        ?  1198.5051  22.3483          ?        ?      346.2        3.2       ?       ? 
1 1 1   11    6   45 o    212.6    4.5    0.0000   0.0000          ?        ?   452.0733  19.1556          ?        ?      212.6        4.5       ?       ? 
1 1 1   11    6   46 o    482.8    2.8    0.0000   0.0000          ?        ?  2331.2424  27.4564          ?        ?      482.8        2.8       ?       ? 
1 1 1   11    6   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    6   48 o    349.8    3.1    0.0000   0.0000          ?        ?  1223.4075  21.7097          ?        ?      349.8        3.1       ?       ? 
1 1 1   11    6   49 o    107.2    8.9    0.0000   0.0000          ?        ?   114.9339  19.1556          ?        ?      107.2        8.9       ?       ? 
1 1 1   11    6   50 o    424.4    2.7    0.0000   0.0000          ?        ?  1801.2695  22.9868          ?        ?      424.4        2.7       ?       ? 
1 1 1   11    6   51 o    248.5    4.0    0.0000   0.0000          ?        ?   617.4504  19.7942          ?        ?      248.5        4.0       ?       ? 
1 1 1   11    6   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    6   53 o    670.7    2.9    0.0000   0.0000          ?        ?  4499.0234  38.3113          ?        ?      670.7        2.9       ?       ? 
1 1 1   11    6   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    6   55 o    411.2    2.8    0.0000   0.0000          ?        ?  1691.4437  22.9868          ?        ?      411.2        2.8       ?       ? 
1 1 1   11    6   56 o     50.2   15.9    0.0000   0.0000          ?        ?    24.9023  17.8786          ?        ?       50.2       15.9       ?       ? 
1 1 1   11    6   57 o    167.3    5.7    0.0000   0.0000          ?        ?   280.3110  19.1556          ?        ?      167.3        5.7       ?       ? 
1 1 1   11    6   58 o    527.5    2.8    0.0000   0.0000          ?        ?  2783.3157  30.0105          ?        ?      527.5        2.8       ?       ? 
1 1 1   11    6   59 o    475.9    2.7    0.0000   0.0000          ?        ?  2265.4746  25.5409          ?        ?      475.9        2.7       ?       ? 
1 1 1   11    6   60 o    356.7    3.1    0.0000   0.0000          ?        ?  1272.5736  22.3483          ?        ?      356.7        3.1       ?       ? 
1 1 1   11    6   61 o    135.2    7.1    0.0000   0.0000          ?        ?   183.2557  19.1556          ?        ?      135.2        7.1       ?       ? 
1 1 1   11    6   62 o    282.6    3.5    0.0000   0.0000          ?        ?   798.7905  19.7942          ?        ?      282.6        3.5       ?       ? 
1 1 1   11    6   63 o     47.3   16.7    0.0000   0.0000          ?        ?    19.7942  19.7942          ?        ?       47.3       16.7       ?       ? 
1 1 1   11    6   64 o    181.0    5.5    0.0000   0.0000          ?        ?   328.2001  19.7942          ?        ?      181.0        5.5       ?       ? 
1 1 1   11    6   65 o     56.6   16.5    0.0000   0.0000          ?        ?    33.2031  19.7942          ?        ?       56.6       16.5       ?       ? 
1 1 1   11    6   66 o    126.9    8.1    0.0000   0.0000          ?        ?   161.5460  20.4327          ?        ?      126.9        8.1       ?       ? 
1 1 1   11    6   67 o     68.7   15.7    0.0000   0.0000          ?        ?    49.8047  21.0712          ?        ?       68.7       15.7       ?       ? 
1 1 1   11    6   68 o    424.7    2.9    0.0000   0.0000          ?        ?  1804.4622  24.9023          ?        ?      424.7        2.9       ?       ? 
1 1 1   11    6   69 o     24.8   12.2    0.0000   0.0000          ?        ?   -40.2269  20.4327          ?        ?       24.8       12.2       ?       ? 
1 1 1   11    6   70 o    214.1    5.1    0.0000   0.0000          ?        ?   459.0970  21.7097          ?        ?      214.1        5.1       ?       ? 
1 1 1   11    6   71 o     74.7   15.1    0.0000   0.0000          ?        ?    58.7440  21.7097          ?        ?       74.7       15.1       ?       ? 
1 1 1   11    6   72 o     23.7   11.8    0.0000   0.0000          ?        ?   -53.6358  21.7097          ?        ?       23.7       11.8       ?       ? 
1 1 1   11    6   73 o    456.4    3.1    0.0000   0.0000          ?        ?  2084.7732  28.0950          ?        ?      456.4        3.1       ?       ? 
1 1 1   11    6   74 f     88.2   13.0    0.0000   0.0000          ?        ?    79.1767  22.9868          ?        ?       88.2       13.0       ?       ? 
1 1 1   11    6   75 o    154.5    6.8    0.0000   0.0000          ?        ?   240.0841  21.0712          ?        ?      154.5        6.8       ?       ? 
1 1 1   11    6   76 o    256.4    4.4    0.0000   0.0000          ?        ?   658.9543  22.3483          ?        ?      256.4        4.4       ?       ? 
1 1 1   11    6   77 o     81.0   12.6    0.0000   0.0000          ?        ?    67.0448  20.4327          ?        ?       81.0       12.6       ?       ? 
1 1 1   11    6   78 f     40.2   16.5    0.0000   0.0000          ?        ?     7.0237  21.0712          ?        ?       40.2       16.5       ?       ? 
1 1 1   11    6   79 o     89.3   11.8    0.0000   0.0000          ?        ?    81.7308  21.0712          ?        ?       89.3       11.8       ?       ? 
1 1 1   11    6   80 o    132.5    7.5    0.0000   0.0000          ?        ?   177.5090  19.7942          ?        ?      132.5        7.5       ?       ? 
1 1 1   11    7    0 o    600.8    3.7 3609.5627  44.6965  3609.5627  44.6965  3609.5627  44.6965      600.8      3.7      600.8        3.7     0.0     0.0 
1 1 1   11    7    1 o   1353.0    5.1    0.0000   0.0000          ?        ? 18307.6914 137.2822          ?        ?     1353.0        5.1       ?       ? 
1 1 1   11    7    2 o    540.3    2.2    0.0000   0.0000          ?        ?  2919.3210  23.6253          ?        ?      540.3        2.2       ?       ? 
1 1 1   11    7    3 o    359.3    1.7    0.0000   0.0000          ?        ?  1291.0907  12.1319          ?        ?      359.3        1.7       ?       ? 
1 1 1   11    7    4 o   1466.1    5.0    0.0000   0.0000          ?        ? 21497.1074 147.4985          ?        ?     1466.1        5.0       ?       ? 
1 1 1   11    7    5 o     34.8    4.6    0.0000   0.0000          ?        ?    12.1319   3.1926          ?        ?       34.8        4.6       ?       ? 
1 1 1   11    7    6 o   1111.2    4.0    0.0000   0.0000          ?        ? 12349.0078  88.1160          ?        ?     1111.2        4.0       ?       ? 
1 1 1   11    7    7 o   2084.5    7.0    0.0000   0.0000          ?        ? 43457.1445 291.8044          ?        ?     2084.5        7.0       ?       ? 
1 1 1   11    7    8 o   1173.8    4.0    0.0000   0.0000          ?        ? 13778.6572  94.5012          ?        ?     1173.8        4.0       ?       ? 
1 1 1   11    7    9 o    980.5    3.4    0.0000   0.0000          ?        ?  9614.2197  65.7677          ?        ?      980.5        3.4       ?       ? 
1 1 1   11    7   10 o   1722.1    5.6    0.0000   0.0000          ?        ? 29659.3301 192.8335          ?        ?     1722.1        5.6       ?       ? 
1 1 1   11    7   11 o   1502.9    4.9    0.0000   0.0000          ?        ? 22588.3418 148.1370          ?        ?     1502.9        4.9       ?       ? 
1 1 1   11    7   12 o    446.0    1.9    0.0000   0.0000          ?        ?  1988.9949  16.6016          ?        ?      446.0        1.9       ?       ? 
1 1 1   11    7   13 o    855.0    3.0    0.0000   0.0000          ?        ?  7309.7959  51.0817          ?        ?      855.0        3.0       ?       ? 
1 1 1   11    7   14 o    716.9    2.6    0.0000   0.0000          ?        ?  5139.4609  37.6728          ?        ?      716.9        2.6       ?       ? 
1 1 1   11    7   15 o    972.1    3.4    0.0000   0.0000          ?        ?  9450.7588  66.4062          ?        ?      972.1        3.4       ?       ? 
1 1 1   11    7   16 o   1385.5    4.6    0.0000   0.0000          ?        ? 19199.0684 127.0658          ?        ?     1385.5        4.6       ?       ? 
1 1 1   11    7   17 o    896.0    3.1    0.0000   0.0000          ?        ?  8028.1328  56.1899          ?        ?      896.0        3.1       ?       ? 
1 1 1   11    7   18 o   1306.4    4.4    0.0000   0.0000          ?        ? 17068.3223 114.2954          ?        ?     1306.4        4.4       ?       ? 
1 1 1   11    7   19 o    564.7    2.2    0.0000   0.0000          ?        ?  3188.7769  24.9023          ?        ?      564.7        2.2       ?       ? 
1 1 1   11    7   20 o    407.3    1.9    0.0000   0.0000          ?        ?  1658.8792  15.3245          ?        ?      407.3        1.9       ?       ? 
1 1 1   11    7   21 o   1818.2    5.9    0.0000   0.0000          ?        ? 33062.0117 215.1818          ?        ?     1818.2        5.9       ?       ? 
1 1 1   11    7   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    7   23 o    313.1    1.8    0.0000   0.0000          ?        ?   980.1307  11.4934          ?        ?      313.1        1.8       ?       ? 
1 1 1   11    7   24 f    473.7    2.1    0.0000   0.0000          ?        ?  2244.4036  19.7942          ?        ?      473.7        2.1       ?       ? 
1 1 1   11    7   25 o    464.3    2.1    0.0000   0.0000          ?        ?  2155.6492  19.1556          ?        ?      464.3        2.1       ?       ? 
1 1 1   11    7   26 o   1245.3    4.3    0.0000   0.0000          ?        ? 15509.6904 107.9102          ?        ?     1245.3        4.3       ?       ? 
1 1 1   11    7   27 f    419.9    2.3    0.0000   0.0000          ?        ?  1763.5968  19.1556          ?        ?      419.9        2.3       ?       ? 
1 1 1   11    7   28 f   1128.7    4.1    0.0000   0.0000          ?        ? 12739.7832  93.2242          ?        ?     1128.7        4.1       ?       ? 
1 1 1   11    7   29 o     59.3   11.7    0.0000   0.0000          ?        ?    36.3957  13.4090          ?        ?       59.3       11.7       ?       ? 
1 1 1   11    7   30 o   1171.0    4.2    0.0000   0.0000          ?        ? 13714.1680  97.6938          ?        ?     1171.0        4.2       ?       ? 
1 1 1   11    7   31 o   2287.7    8.3    0.0000   0.0000          ?        ? 52345.3672 379.2819          ?        ?     2287.7        8.3       ?       ? 
1 1 1   11    7   32 o    435.4    2.9    0.0000   0.0000          ?        ?  1895.7706  24.9023          ?        ?      435.4        2.9       ?       ? 
1 1 1   11    7   33 o    499.0    2.5    0.0000   0.0000          ?        ?  2489.5957  24.9023          ?        ?      499.0        2.5       ?       ? 
1 1 1   11    7   34 o    483.7    2.4    0.0000   0.0000          ?        ?  2339.5432  22.9868          ?        ?      483.7        2.4       ?       ? 
1 1 1   11    7   35 o   1165.8    4.2    0.0000   0.0000          ?        ? 13592.2100  97.0553          ?        ?     1165.8        4.2       ?       ? 
1 1 1   11    7   36 o    633.2    2.7    0.0000   0.0000          ?        ?  4009.2773  33.8416          ?        ?      633.2        2.7       ?       ? 
1 1 1   11    7   37 o    528.0    2.5    0.0000   0.0000          ?        ?  2788.4241  26.1794          ?        ?      528.0        2.5       ?       ? 
1 1 1   11    7   38 o    868.4    3.6    0.0000   0.0000          ?        ?  7542.2173  62.5751          ?        ?      868.4        3.6       ?       ? 
1 1 1   11    7   39 o    245.2    3.9    0.0000   0.0000          ?        ?   601.4874  19.1556          ?        ?      245.2        3.9       ?       ? 
1 1 1   11    7   40 o   1845.2    6.2    0.0000   0.0000          ?        ? 34054.9102 228.5907          ?        ?     1845.2        6.2       ?       ? 
1 1 1   11    7   41 o   1327.3    4.5    0.0000   0.0000          ?        ? 17619.3652 120.0421          ?        ?     1327.3        4.5       ?       ? 
1 1 1   11    7   42 o    163.9    6.0    0.0000   0.0000          ?        ?   268.8176  19.7942          ?        ?      163.9        6.0       ?       ? 
1 1 1   11    7   43 o    558.7    2.7    0.0000   0.0000          ?        ?  3121.7322  30.0105          ?        ?      558.7        2.7       ?       ? 
1 1 1   11    7   44 f    324.3    3.2    0.0000   0.0000          ?        ?  1051.6451  20.4327          ?        ?      324.3        3.2       ?       ? 
1 1 1   11    7   45 o   1168.2    4.1    0.0000   0.0000          ?        ? 13648.3994  95.7782          ?        ?     1168.2        4.1       ?       ? 
1 1 1   11    7   46 o    681.4    2.9    0.0000   0.0000          ?        ?  4643.3291  39.5883          ?        ?      681.4        2.9       ?       ? 
1 1 1   11    7   47 o    534.2    2.6    0.0000   0.0000          ?        ?  2853.5532  28.0950          ?        ?      534.2        2.6       ?       ? 
1 1 1   11    7   48 o    735.5    3.0    0.0000   0.0000          ?        ?  5410.1938  43.4195          ?        ?      735.5        3.0       ?       ? 
1 1 1   11    7   49 o    174.7    5.1    0.0000   0.0000          ?        ?   305.2133  17.8786          ?        ?      174.7        5.1       ?       ? 
1 1 1   11    7   50 o     82.2   12.0    0.0000   0.0000          ?        ?    67.6833  19.7942          ?        ?       82.2       12.0       ?       ? 
1 1 1   11    7   51 o    867.8    3.3    0.0000   0.0000          ?        ?  7532.6392  57.4669          ?        ?      867.8        3.3       ?       ? 
1 1 1   11    7   52 o    462.7    2.6    0.0000   0.0000          ?        ?  2141.6016  24.2638          ?        ?      462.7        2.6       ?       ? 
1 1 1   11    7   53 o    186.7    5.0    0.0000   0.0000          ?        ?   348.6328  18.5171          ?        ?      186.7        5.0       ?       ? 
1 1 1   11    7   54 o    425.0    2.9    0.0000   0.0000          ?        ?  1807.0162  24.9023          ?        ?      425.0        2.9       ?       ? 
1 1 1   11    7   55 o    288.4    3.5    0.0000   0.0000          ?        ?   831.9937  20.4327          ?        ?      288.4        3.5       ?       ? 
1 1 1   11    7   56 o    308.4    3.2    0.0000   0.0000          ?        ?   951.3972  19.7942          ?        ?      308.4        3.2       ?       ? 
1 1 1   11    7   57 o    305.1    3.2    0.0000   0.0000          ?        ?   930.9645  19.7942          ?        ?      305.1        3.2       ?       ? 
1 1 1   11    7   58 o    521.3    2.8    0.0000   0.0000          ?        ?  2718.1865  29.3720          ?        ?      521.3        2.8       ?       ? 
1 1 1   11    7   59 o    788.3    3.2    0.0000   0.0000          ?        ?  6216.0078  50.4432          ?        ?      788.3        3.2       ?       ? 
1 1 1   11    7   60 o    548.0    2.7    0.0000   0.0000          ?        ?  3004.2441  29.3720          ?        ?      548.0        2.7       ?       ? 
1 1 1   11    7   61 o    208.7    4.6    0.0000   0.0000          ?        ?   436.1103  19.1556          ?        ?      208.7        4.6       ?       ? 
1 1 1   11    7   62 o    207.3    4.9    0.0000   0.0000          ?        ?   430.3636  20.4327          ?        ?      207.3        4.9       ?       ? 
1 1 1   11    7   63 f    110.5    8.7    0.0000   0.0000          ?        ?   122.5962  19.1556          ?        ?      110.5        8.7       ?       ? 
1 1 1   11    7   64 o    293.9    3.7    0.0000   0.0000          ?        ?   864.5582  21.7097          ?        ?      293.9        3.7       ?       ? 
1 1 1   11    7   65 o     54.1   16.3    0.0000   0.0000          ?        ?    30.0105  19.1556          ?        ?       54.1       16.3       ?       ? 
1 1 1   11    7   66 o    194.8    5.2    0.0000   0.0000          ?        ?   379.9204  20.4327          ?        ?      194.8        5.2       ?       ? 
1 1 1   11    7   67 o    282.8    3.8    0.0000   0.0000          ?        ?   800.7061  21.7097          ?        ?      282.8        3.8       ?       ? 
1 1 1   11    7   68 o    262.6    4.0    0.0000   0.0000          ?        ?   690.2419  21.0712          ?        ?      262.6        4.0       ?       ? 
1 1 1   11    7   69 o    227.8    4.9    0.0000   0.0000          ?        ?   519.7566  22.3483          ?        ?      227.8        4.9       ?       ? 
1 1 1   11    7   70 o    195.8    5.5    0.0000   0.0000          ?        ?   384.3900  21.7097          ?        ?      195.8        5.5       ?       ? 
1 1 1   11    7   71 o    109.4   10.2    0.0000   0.0000          ?        ?   120.6806  22.3483          ?        ?      109.4       10.2       ?       ? 
1 1 1   11    7   72 o    452.1    3.0    0.0000   0.0000          ?        ?  2045.8232  26.8179          ?        ?      452.1        3.0       ?       ? 
1 1 1   11    7   73 o    126.4    9.1    0.0000   0.0000          ?        ?   160.9075  22.9868          ?        ?      126.4        9.1       ?       ? 
1 1 1   11    7   74 o    245.3    4.8    0.0000   0.0000          ?        ?   603.4030  23.6253          ?        ?      245.3        4.8       ?       ? 
1 1 1   11    7   75 o    102.0   10.6    0.0000   0.0000          ?        ?   105.3561  21.7097          ?        ?      102.0       10.6       ?       ? 
1 1 1   11    7   76 o    105.0   10.3    0.0000   0.0000          ?        ?   111.7413  21.7097          ?        ?      105.0       10.3       ?       ? 
1 1 1   11    7   77 o    181.6    5.8    0.0000   0.0000          ?        ?   331.3927  21.0712          ?        ?      181.6        5.8       ?       ? 
1 1 1   11    7   78 o     46.1   17.1    0.0000   0.0000          ?        ?    17.8786  21.0712          ?        ?       46.1       17.1       ?       ? 
1 1 1   11    7   79 o     41.4   17.2    0.0000   0.0000          ?        ?     5.7467  23.6253          ?        ?       41.4       17.2       ?       ? 
1 1 1   11    7   80 o     33.1   14.7    0.0000   0.0000          ?        ?    -6.3852  19.7942          ?        ?       33.1       14.7       ?       ? 
1 1 1   11    8    0 o    100.6    2.9  101.5249   5.7467   101.5249   5.7467   101.5249   5.7467      100.6      2.9      100.6        2.9     0.0     0.0 
1 1 1   11    8    1 o    438.4    2.2    0.0000   0.0000          ?        ?  1921.9501  19.1556          ?        ?      438.4        2.2       ?       ? 
1 1 1   11    8    2 o   1882.7    7.1    0.0000   0.0000          ?        ? 35450.7188 266.9020          ?        ?     1882.7        7.1       ?       ? 
1 1 1   11    8    3 o    297.9    1.6    0.0000   0.0000          ?        ?   887.5450   9.5778          ?        ?      297.9        1.6       ?       ? 
1 1 1   11    8    4 o   1252.3    4.3    0.0000   0.0000          ?        ? 15683.3682 106.6331          ?        ?     1252.3        4.3       ?       ? 
1 1 1   11    8    5 o    285.0    1.3    0.0000   0.0000          ?        ?   812.1995   7.6623          ?        ?      285.0        1.3       ?       ? 
1 1 1   11    8    6 o   1140.9    4.0    0.0000   0.0000          ?        ? 13016.2637  91.3086          ?        ?     1140.9        4.0       ?       ? 
1 1 1   11    8    7 o    128.3    1.5    0.0000   0.0000          ?        ?   164.7386   3.8311          ?        ?      128.3        1.5       ?       ? 
1 1 1   11    8    8 o    363.3    1.7    0.0000   0.0000          ?        ?  1319.8242  12.1319          ?        ?      363.3        1.7       ?       ? 
1 1 1   11    8    9 o    730.8    2.6    0.0000   0.0000          ?        ?  5341.2334  38.3113          ?        ?      730.8        2.6       ?       ? 
1 1 1   11    8   10 o    340.9    1.6    0.0000   0.0000          ?        ?  1162.1094  10.8549          ?        ?      340.9        1.6       ?       ? 
1 1 1   11    8   11 o     99.2    2.6    0.0000   0.0000          ?        ?    98.3323   5.1082          ?        ?       99.2        2.6       ?       ? 
1 1 1   11    8   12 o    626.0    2.4    0.0000   0.0000          ?        ?  3919.2456  30.0105          ?        ?      626.0        2.4       ?       ? 
1 1 1   11    8   13 o   1044.5    3.5    0.0000   0.0000          ?        ? 10911.0576  74.0685          ?        ?     1044.5        3.5       ?       ? 
1 1 1   11    8   14 o    403.3    1.8    0.0000   0.0000          ?        ?  1626.3146  14.6860          ?        ?      403.3        1.8       ?       ? 
1 1 1   11    8   15 o    218.4    1.6    0.0000   0.0000          ?        ?   476.9756   7.0237          ?        ?      218.4        1.6       ?       ? 
1 1 1   11    8   16 o   1205.3    4.1    0.0000   0.0000          ?        ? 14528.2832  98.3323          ?        ?     1205.3        4.1       ?       ? 
1 1 1   11    8   17 f    876.9    3.1    0.0000   0.0000          ?        ?  7690.3545  54.2743          ?        ?      876.9        3.1       ?       ? 
1 1 1   11    8   18 o    698.1    2.6    0.0000   0.0000          ?        ?  4873.1973  36.3957          ?        ?      698.1        2.6       ?       ? 
1 1 1   11    8   19 o    732.4    2.7    0.0000   0.0000          ?        ?  5364.8589  39.5883          ?        ?      732.4        2.7       ?       ? 
1 1 1   11    8   20 o    635.8    2.5    0.0000   0.0000          ?        ?  4042.4802  31.2876          ?        ?      635.8        2.5       ?       ? 
1 1 1   11    8   21 o    533.4    2.3    0.0000   0.0000          ?        ?  2845.2524  24.2638          ?        ?      533.4        2.3       ?       ? 
1 1 1   11    8   22 o   1525.3    5.0    0.0000   0.0000          ?        ? 23266.4512 153.8837          ?        ?     1525.3        5.0       ?       ? 
1 1 1   11    8   23 o    946.9    3.3    0.0000   0.0000          ?        ?  8967.3975  63.2136          ?        ?      946.9        3.3       ?       ? 
1 1 1   11    8   24 o    446.3    2.1    0.0000   0.0000          ?        ?  1991.5490  18.5171          ?        ?      446.3        2.1       ?       ? 
1 1 1   11    8   25 o    793.2    2.9    0.0000   0.0000          ?        ?  6291.9922  45.9736          ?        ?      793.2        2.9       ?       ? 
1 1 1   11    8   26 o     47.6   11.5    0.0000   0.0000          ?        ?    23.6253  10.8549          ?        ?       47.6       11.5       ?       ? 
1 1 1   11    8   27 o    944.0    3.4    0.0000   0.0000          ?        ?  8911.2080  64.4907          ?        ?      944.0        3.4       ?       ? 
1 1 1   11    8   28 o   1748.9    5.7    0.0000   0.0000          ?        ? 30590.2930 200.4958          ?        ?     1748.9        5.7       ?       ? 
1 1 1   11    8   29 o    658.2    3.0    0.0000   0.0000          ?        ?  4331.7310  38.9498          ?        ?      658.2        3.0       ?       ? 
1 1 1   11    8   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    8   31 o    844.2    3.3    0.0000   0.0000          ?        ?  7127.1782  54.9129          ?        ?      844.2        3.3       ?       ? 
1 1 1   11    8   32 f    758.9    2.9    0.0000   0.0000          ?        ?  5759.4648  43.4195          ?        ?      758.9        2.9       ?       ? 
1 1 1   11    8   33 o    414.0    2.6    0.0000   0.0000          ?        ?  1713.7920  21.7097          ?        ?      414.0        2.6       ?       ? 
1 1 1   11    8   34 f   1360.6    4.6    0.0000   0.0000          ?        ? 18513.2949 124.5117          ?        ?     1360.6        4.6       ?       ? 
1 1 1   11    8   35 o   1002.6    3.5    0.0000   0.0000          ?        ? 10052.8848  70.8759          ?        ?     1002.6        3.5       ?       ? 
1 1 1   11    8   36 o    930.5    3.4    0.0000   0.0000          ?        ?  8658.9912  63.2136          ?        ?      930.5        3.4       ?       ? 
1 1 1   11    8   37 o    464.2    3.0    0.0000   0.0000          ?        ?  2155.0105  27.4564          ?        ?      464.2        3.0       ?       ? 
1 1 1   11    8   38 o    688.8    2.8    0.0000   0.0000          ?        ?  4744.2158  38.9498          ?        ?      688.8        2.8       ?       ? 
1 1 1   11    8   39 o    993.5    3.5    0.0000   0.0000          ?        ?  9870.2676  70.2374          ?        ?      993.5        3.5       ?       ? 
1 1 1   11    8   40 o    941.0    3.6    0.0000   0.0000          ?        ?  8855.6562  67.0448          ?        ?      941.0        3.6       ?       ? 
1 1 1   11    8   41 o    869.5    3.3    0.0000   0.0000          ?        ?  7560.7344  58.1055          ?        ?      869.5        3.3       ?       ? 
1 1 1   11    8   42 o     33.3   14.8    0.0000   0.0000          ?        ?    -7.6623  19.7942          ?        ?       33.3       14.8       ?       ? 
1 1 1   11    8   43 o    904.2    3.4    0.0000   0.0000          ?        ?  8176.2695  60.6596          ?        ?      904.2        3.4       ?       ? 
1 1 1   11    8   44 o    366.6    2.9    0.0000   0.0000          ?        ?  1344.0880  21.0712          ?        ?      366.6        2.9       ?       ? 
1 1 1   11    8   45 o    895.9    3.3    0.0000   0.0000          ?        ?  8026.8550  58.7440          ?        ?      895.9        3.3       ?       ? 
1 1 1   11    8   46 o    103.5    8.6    0.0000   0.0000          ?        ?   107.2716  17.8786          ?        ?      103.5        8.6       ?       ? 
1 1 1   11    8   47 o    374.7    3.1    0.0000   0.0000          ?        ?  1404.1090  22.9868          ?        ?      374.7        3.1       ?       ? 
1 1 1   11    8   48 o    510.5    2.9    0.0000   0.0000          ?        ?  2606.4453  30.0105          ?        ?      510.5        2.9       ?       ? 
1 1 1   11    8   49 f    467.2    2.8    0.0000   0.0000          ?        ?  2183.1055  26.1794          ?        ?      467.2        2.8       ?       ? 
1 1 1   11    8   50 o    779.3    3.0    0.0000   0.0000          ?        ?  6074.2563  47.2506          ?        ?      779.3        3.0       ?       ? 
1 1 1   11    8   51 o    198.6    4.8    0.0000   0.0000          ?        ?   394.6064  19.1556          ?        ?      198.6        4.8       ?       ? 
1 1 1   11    8   52 o    262.7    3.5    0.0000   0.0000          ?        ?   690.2419  18.5171          ?        ?      262.7        3.5       ?       ? 
1 1 1   11    8   53 o    272.3    3.9    0.0000   0.0000          ?        ?   741.9621  21.0712          ?        ?      272.3        3.9       ?       ? 
1 1 1   11    8   54 o    527.5    2.7    0.0000   0.0000          ?        ?  2782.6772  28.7335          ?        ?      527.5        2.7       ?       ? 
1 1 1   11    8   55 o    146.6    5.9    0.0000   0.0000          ?        ?   215.1818  17.2401          ?        ?      146.6        5.9       ?       ? 
1 1 1   11    8   56 o    218.5    4.4    0.0000   0.0000          ?        ?   477.6142  19.1556          ?        ?      218.5        4.4       ?       ? 
1 1 1   11    8   57 o    240.7    4.0    0.0000   0.0000          ?        ?   579.7776  19.1556          ?        ?      240.7        4.0       ?       ? 
1 1 1   11    8   58 o    132.4    7.2    0.0000   0.0000          ?        ?   175.5934  19.1556          ?        ?      132.4        7.2       ?       ? 
1 1 1   11    8   59 o    166.2    5.8    0.0000   0.0000          ?        ?   276.4799  19.1556          ?        ?      166.2        5.8       ?       ? 
1 1 1   11    8   60 o    441.5    2.8    0.0000   0.0000          ?        ?  1949.4065  24.9023          ?        ?      441.5        2.8       ?       ? 
1 1 1   11    8   61 o    382.2    2.8    0.0000   0.0000          ?        ?  1461.5759  21.7097          ?        ?      382.2        2.8       ?       ? 
1 1 1   11    8   62 o    241.0    4.1    0.0000   0.0000          ?        ?   581.0547  19.7942          ?        ?      241.0        4.1       ?       ? 
1 1 1   11    8   63 o    377.0    3.0    0.0000   0.0000          ?        ?  1421.9877  22.3483          ?        ?      377.0        3.0       ?       ? 
1 1 1   11    8   64 f    252.8    4.0    0.0000   0.0000          ?        ?   639.7986  20.4327          ?        ?      252.8        4.0       ?       ? 
1 1 1   11    8   65 o     74.6   12.4    0.0000   0.0000          ?        ?    56.1899  18.5171          ?        ?       74.6       12.4       ?       ? 
1 1 1   11    8   66 o     94.9   10.8    0.0000   0.0000          ?        ?    90.6701  20.4327          ?        ?       94.9       10.8       ?       ? 
1 1 1   11    8   67 o    230.5    4.6    0.0000   0.0000          ?        ?   531.8885  21.0712          ?        ?      230.5        4.6       ?       ? 
1 1 1   11    8   68 o    111.0    9.2    0.0000   0.0000          ?        ?   123.8732  20.4327          ?        ?      111.0        9.2       ?       ? 
1 1 1   11    8   69 o    163.0    6.1    0.0000   0.0000          ?        ?   266.2635  19.7942          ?        ?      163.0        6.1       ?       ? 
1 1 1   11    8   70 o    169.6    6.2    0.0000   0.0000          ?        ?   288.6118  21.0712          ?        ?      169.6        6.2       ?       ? 
1 1 1   11    8   71 o     23.2   11.6    0.0000   0.0000          ?        ?   -56.8284  21.7097          ?        ?       23.2       11.6       ?       ? 
1 1 1   11    8   72 o     96.7   10.9    0.0000   0.0000          ?        ?    94.5012  21.0712          ?        ?       96.7       10.9       ?       ? 
1 1 1   11    8   73 o    214.7    5.2    0.0000   0.0000          ?        ?   462.2897  22.3483          ?        ?      214.7        5.2       ?       ? 
1 1 1   11    8   74 o     44.6   17.0    0.0000   0.0000          ?        ?    14.6860  21.0712          ?        ?       44.6       17.0       ?       ? 
1 1 1   11    8   75 o     77.7   14.9    0.0000   0.0000          ?        ?    63.8522  22.3483          ?        ?       77.7       14.9       ?       ? 
1 1 1   11    8   76 o    116.8    9.6    0.0000   0.0000          ?        ?   137.9207  22.3483          ?        ?      116.8        9.6       ?       ? 
1 1 1   11    8   77 o    242.2    4.4    0.0000   0.0000          ?        ?   588.0784  21.0712          ?        ?      242.2        4.4       ?       ? 
1 1 1   11    8   78 o     64.2   16.4    0.0000   0.0000          ?        ?    44.6965  21.0712          ?        ?       64.2       16.4       ?       ? 
1 1 1   11    8   79 o    224.5    4.8    0.0000   0.0000          ?        ?   506.3477  21.7097          ?        ?      224.5        4.8       ?       ? 
1 1 1   11    8   80 o    127.9    8.5    0.0000   0.0000          ?        ?   166.0156  21.7097          ?        ?      127.9        8.5       ?       ? 
1 1 1   11    9    0 o    593.8    3.7 3525.9165  44.0580  3525.9165  44.0580  3525.9165  44.0580      593.8      3.7      593.8        3.7     0.0     0.0 
1 1 1   11    9    1 o   1043.7    4.0    0.0000   0.0000          ?        ? 10894.4561  83.6463          ?        ?     1043.7        4.0       ?       ? 
1 1 1   11    9    2 o   1024.5    4.0    0.0000   0.0000          ?        ? 10497.2959  81.0922          ?        ?     1024.5        4.0       ?       ? 
1 1 1   11    9    3 o    173.8    1.7    0.0000   0.0000          ?        ?   302.0207   5.7467          ?        ?      173.8        1.7       ?       ? 
1 1 1   11    9    4 o   1139.0    3.9    0.0000   0.0000          ?        ? 12974.7598  88.7545          ?        ?     1139.0        3.9       ?       ? 
1 1 1   11    9    5 o   1002.7    3.4    0.0000   0.0000          ?        ? 10055.4385  68.9603          ?        ?     1002.7        3.4       ?       ? 
1 1 1   11    9    6 o    390.3    1.6    0.0000   0.0000          ?        ?  1523.5127  12.7704          ?        ?      390.3        1.6       ?       ? 
1 1 1   11    9    7 o    616.1    2.3    0.0000   0.0000          ?        ?  3795.3728  28.7335          ?        ?      616.1        2.3       ?       ? 
1 1 1   11    9    8 o    837.9    3.0    0.0000   0.0000          ?        ?  7020.5454  49.8047          ?        ?      837.9        3.0       ?       ? 
1 1 1   11    9    9 o    639.7    2.3    0.0000   0.0000          ?        ?  4092.2852  30.0105          ?        ?      639.7        2.3       ?       ? 
1 1 1   11    9   10 o    830.0    3.2    0.0000   0.0000          ?        ?  6889.0098  52.3588          ?        ?      830.0        3.2       ?       ? 
1 1 1   11    9   11 o    534.5    2.0    0.0000   0.0000          ?        ?  2856.7456  21.7097          ?        ?      534.5        2.0       ?       ? 
1 1 1   11    9   12 o    565.8    2.1    0.0000   0.0000          ?        ?  3200.9089  24.2638          ?        ?      565.8        2.1       ?       ? 
1 1 1   11    9   13 o    316.0    1.6    0.0000   0.0000          ?        ?   998.6478  10.2163          ?        ?      316.0        1.6       ?       ? 
1 1 1   11    9   14 f    987.7    3.4    0.0000   0.0000          ?        ?  9755.9717  67.0448          ?        ?      987.7        3.4       ?       ? 
1 1 1   11    9   15 o    334.7    1.7    0.0000   0.0000          ?        ?  1119.9669  11.4934          ?        ?      334.7        1.7       ?       ? 
1 1 1   11    9   16 o   1658.0    5.5    0.0000   0.0000          ?        ? 27492.1875 181.3401          ?        ?     1658.0        5.5       ?       ? 
1 1 1   11    9   17 o   1016.8    3.5    0.0000   0.0000          ?        ? 10338.9414  71.5144          ?        ?     1016.8        3.5       ?       ? 
1 1 1   11    9   18 o   1785.1    5.8    0.0000   0.0000          ?        ? 31870.5293 208.7966          ?        ?     1785.1        5.8       ?       ? 
1 1 1   11    9   19 f    664.2    2.5    0.0000   0.0000          ?        ?  4411.5459  33.8416          ?        ?      664.2        2.5       ?       ? 
1 1 1   11    9   20 f   1602.3    5.3    0.0000   0.0000          ?        ? 25677.5078 169.2082          ?        ?     1602.3        5.3       ?       ? 
1 1 1   11    9   21 o    751.2    2.8    0.0000   0.0000          ?        ?  5643.8926  42.1424          ?        ?      751.2        2.8       ?       ? 
1 1 1   11    9   22 o   1470.3    4.9    0.0000   0.0000          ?        ? 21619.0664 143.6674          ?        ?     1470.3        4.9       ?       ? 
1 1 1   11    9   23 o    947.6    3.4    0.0000   0.0000          ?        ?  8978.8906  64.4907          ?        ?      947.6        3.4       ?       ? 
1 1 1   11    9   24 f    835.1    3.1    0.0000   0.0000          ?        ?  6974.5723  51.7203          ?        ?      835.1        3.1       ?       ? 
1 1 1   11    9   25 o   1219.9    4.2    0.0000   0.0000          ?        ? 14883.2998 103.4405          ?        ?     1219.9        4.2       ?       ? 
1 1 1   11    9   26 o    972.7    3.6    0.0000   0.0000          ?        ?  9462.2520  70.2374          ?        ?      972.7        3.6       ?       ? 
1 1 1   11    9   27 o   1481.8    5.1    0.0000   0.0000          ?        ? 21958.1191 152.6067          ?        ?     1481.8        5.1       ?       ? 
1 1 1   11    9   28 o   1046.8    4.0    0.0000   0.0000          ?        ? 10957.6699  83.0078          ?        ?     1046.8        4.0       ?       ? 
1 1 1   11    9   29 o    200.7    3.7    0.0000   0.0000          ?        ?   402.9071  14.6860          ?        ?      200.7        3.7       ?       ? 
1 1 1   11    9   30 o    845.5    3.2    0.0000   0.0000          ?        ?  7148.2495  54.2743          ?        ?      845.5        3.2       ?       ? 
1 1 1   11    9   31 o   1755.5    6.5    0.0000   0.0000          ?        ? 30822.0781 227.3137          ?        ?     1755.5        6.5       ?       ? 
1 1 1   11    9   32 o   1048.9    4.1    0.0000   0.0000          ?        ? 11002.3662  86.2004          ?        ?     1048.9        4.1       ?       ? 
1 1 1   11    9   33 o    830.2    3.3    0.0000   0.0000          ?        ?  6892.8408  54.2743          ?        ?      830.2        3.3       ?       ? 
1 1 1   11    9   34 o   2032.3    6.8    0.0000   0.0000          ?        ? 41311.7109 275.2028          ?        ?     2032.3        6.8       ?       ? 
1 1 1   11    9   35 o   1005.3    3.8    0.0000   0.0000          ?        ? 10106.5205  75.9841          ?        ?     1005.3        3.8       ?       ? 
1 1 1   11    9   36 f     43.2   16.3    0.0000   0.0000          ?        ?    13.4090  19.1556          ?        ?       43.2       16.3       ?       ? 
1 1 1   11    9   37 o    301.0    3.3    0.0000   0.0000          ?        ?   906.0621  19.7942          ?        ?      301.0        3.3       ?       ? 
1 1 1   11    9   38 o   1069.1    3.8    0.0000   0.0000          ?        ? 11431.4531  80.4537          ?        ?     1069.1        3.8       ?       ? 
1 1 1   11    9   39 o    656.0    2.8    0.0000   0.0000          ?        ?  4303.6357  36.3957          ?        ?      656.0        2.8       ?       ? 
1 1 1   11    9   40 o   1238.7    4.3    0.0000   0.0000          ?        ? 15345.5908 106.6331          ?        ?     1238.7        4.3       ?       ? 
1 1 1   11    9   41 f    648.9    2.8    0.0000   0.0000          ?        ?  4211.0503  36.3957          ?        ?      648.9        2.8       ?       ? 
1 1 1   11    9   42 f    405.4    2.8    0.0000   0.0000          ?        ?  1643.5547  22.9868          ?        ?      405.4        2.8       ?       ? 
1 1 1   11    9   43 o   1007.9    3.8    0.0000   0.0000          ?        ? 10159.5176  75.9841          ?        ?     1007.9        3.8       ?       ? 
1 1 1   11    9   44 o    714.3    2.9    0.0000   0.0000          ?        ?  5103.0649  42.1424          ?        ?      714.3        2.9       ?       ? 
1 1 1   11    9   45 o    412.0    3.0    0.0000   0.0000          ?        ?  1697.8290  24.9023          ?        ?      412.0        3.0       ?       ? 
1 1 1   11    9   46 o    578.1    2.7    0.0000   0.0000          ?        ?  3342.6606  30.6490          ?        ?      578.1        2.7       ?       ? 
1 1 1   11    9   47 o    705.5    2.9    0.0000   0.0000          ?        ?  4977.2759  41.5039          ?        ?      705.5        2.9       ?       ? 
1 1 1   11    9   48 o    335.8    3.1    0.0000   0.0000          ?        ?  1127.6293  21.0712          ?        ?      335.8        3.1       ?       ? 
1 1 1   11    9   49 o    739.8    2.9    0.0000   0.0000          ?        ?  5473.4072  43.4195          ?        ?      739.8        2.9       ?       ? 
1 1 1   11    9   50 o    417.0    2.7    0.0000   0.0000          ?        ?  1739.3329  22.3483          ?        ?      417.0        2.7       ?       ? 
1 1 1   11    9   51 o    746.0    3.0    0.0000   0.0000          ?        ?  5566.6313  44.0580          ?        ?      746.0        3.0       ?       ? 
1 1 1   11    9   52 o    669.9    2.9    0.0000   0.0000          ?        ?  4488.1685  38.3113          ?        ?      669.9        2.9       ?       ? 
1 1 1   11    9   53 o    118.2    7.8    0.0000   0.0000          ?        ?   139.8362  18.5171          ?        ?      118.2        7.8       ?       ? 
1 1 1   11    9   54 o    381.5    2.9    0.0000   0.0000          ?        ?  1455.8293  22.3483          ?        ?      381.5        2.9       ?       ? 
1 1 1   11    9   55 o     34.1   14.8    0.0000   0.0000          ?        ?    -2.5541  18.5171          ?        ?       34.1       14.8       ?       ? 
1 1 1   11    9   56 o    256.4    4.1    0.0000   0.0000          ?        ?   657.6772  21.0712          ?        ?      256.4        4.1       ?       ? 
1 1 1   11    9   57 o    113.7    8.4    0.0000   0.0000          ?        ?   129.6199  19.1556          ?        ?      113.7        8.4       ?       ? 
1 1 1   11    9   58 o    257.1    3.7    0.0000   0.0000          ?        ?   661.5084  19.1556          ?        ?      257.1        3.7       ?       ? 
1 1 1   11    9   59 o    115.4    7.7    0.0000   0.0000          ?        ?   133.4510  17.8786          ?        ?      115.4        7.7       ?       ? 
1 1 1   11    9   60 o    128.0    7.2    0.0000   0.0000          ?        ?   164.1001  18.5171          ?        ?      128.0        7.2       ?       ? 
1 1 1   11    9   61 o     22.9   11.3    0.0000   0.0000          ?        ?   -44.0580  19.1556          ?        ?       22.9       11.3       ?       ? 
1 1 1   11    9   62 o    659.8    2.8    0.0000   0.0000          ?        ?  4354.7173  37.0343          ?        ?      659.8        2.8       ?       ? 
1 1 1   11    9   63 o    397.3    3.0    0.0000   0.0000          ?        ?  1579.0640  23.6253          ?        ?      397.3        3.0       ?       ? 
1 1 1   11    9   64 o    313.1    3.4    0.0000   0.0000          ?        ?   980.7693  21.0712          ?        ?      313.1        3.4       ?       ? 
1 1 1   11    9   65 o     29.3   13.7    0.0000   0.0000          ?        ?   -21.0712  20.4327          ?        ?       29.3       13.7       ?       ? 
1 1 1   11    9   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11    9   67 o    578.4    2.8    0.0000   0.0000          ?        ?  3346.4917  31.9261          ?        ?      578.4        2.8       ?       ? 
1 1 1   11    9   68 o     40.9   16.4    0.0000   0.0000          ?        ?     8.3008  20.4327          ?        ?       40.9       16.4       ?       ? 
1 1 1   11    9   69 o    232.5    4.7    0.0000   0.0000          ?        ?   541.4664  21.7097          ?        ?      232.5        4.7       ?       ? 
1 1 1   11    9   70 o    120.5    9.0    0.0000   0.0000          ?        ?   146.2215  21.7097          ?        ?      120.5        9.0       ?       ? 
1 1 1   11    9   71 o    113.7    9.3    0.0000   0.0000          ?        ?   130.2584  21.0712          ?        ?      113.7        9.3       ?       ? 
1 1 1   11    9   72 o     65.3   16.2    0.0000   0.0000          ?        ?    45.3350  21.0712          ?        ?       65.3       16.2       ?       ? 
1 1 1   11    9   73 o     36.4   15.5    0.0000   0.0000          ?        ?     0.6385  19.7942          ?        ?       36.4       15.5       ?       ? 
1 1 1   11    9   74 o     60.6   17.1    0.0000   0.0000          ?        ?    38.9498  21.7097          ?        ?       60.6       17.1       ?       ? 
1 1 1   11    9   75 o     24.4   12.1    0.0000   0.0000          ?        ?   -48.5276  21.7097          ?        ?       24.4       12.1       ?       ? 
1 1 1   11    9   76 o    127.2    8.5    0.0000   0.0000          ?        ?   163.4615  21.7097          ?        ?      127.2        8.5       ?       ? 
1 1 1   11    9   77 o     37.9   15.9    0.0000   0.0000          ?        ?     3.1926  20.4327          ?        ?       37.9       15.9       ?       ? 
1 1 1   11    9   78 o     41.9   16.9    0.0000   0.0000          ?        ?     9.5778  21.7097          ?        ?       41.9       16.9       ?       ? 
1 1 1   11    9   79 o     54.7   16.6    0.0000   0.0000          ?        ?    31.9261  19.7942          ?        ?       54.7       16.6       ?       ? 
1 1 1   11   10    0 o    979.0    5.6 9586.1260 109.1872  9586.1260 109.1872  9586.1260 109.1872      979.0      5.6      979.0        5.6     0.0     0.0 
1 1 1   11   10    1 o   1296.5    5.2    0.0000   0.0000          ?        ? 16811.6348 135.3666          ?        ?     1296.5        5.2       ?       ? 
1 1 1   11   10    2 o    586.7    2.7    0.0000   0.0000          ?        ?  3442.2700  31.2876          ?        ?      586.7        2.7       ?       ? 
1 1 1   11   10    3 o    556.7    2.2    0.0000   0.0000          ?        ?  3098.7454  24.2638          ?        ?      556.7        2.2       ?       ? 
1 1 1   11   10    4 o    145.6    1.8    0.0000   0.0000          ?        ?   211.9892   5.1082          ?        ?      145.6        1.8       ?       ? 
1 1 1   11   10    5 o   1152.0    3.9    0.0000   0.0000          ?        ? 13271.0332  88.7545          ?        ?     1152.0        3.9       ?       ? 
1 1 1   11   10    6 o    324.8    1.6    0.0000   0.0000          ?        ?  1054.8376  10.2163          ?        ?      324.8        1.6       ?       ? 
1 1 1   11   10    7 o    411.2    1.8    0.0000   0.0000          ?        ?  1690.8052  14.6860          ?        ?      411.2        1.8       ?       ? 
1 1 1   11   10    8 o    857.3    2.9    0.0000   0.0000          ?        ?  7350.6606  50.4432          ?        ?      857.3        2.9       ?       ? 
1 1 1   11   10    9 o    613.9    2.3    0.0000   0.0000          ?        ?  3768.5547  28.7335          ?        ?      613.9        2.3       ?       ? 
1 1 1   11   10   10 f    909.5    3.2    0.0000   0.0000          ?        ?  8272.6865  58.1055          ?        ?      909.5        3.2       ?       ? 
1 1 1   11   10   11 o    733.7    2.7    0.0000   0.0000          ?        ?  5383.3755  40.2269          ?        ?      733.7        2.7       ?       ? 
1 1 1   11   10   12 o    502.5    2.0    0.0000   0.0000          ?        ?  2525.3530  20.4327          ?        ?      502.5        2.0       ?       ? 
1 1 1   11   10   13 o    772.0    2.8    0.0000   0.0000          ?        ?  5960.5996  43.4195          ?        ?      772.0        2.8       ?       ? 
1 1 1   11   10   14 o    879.6    3.1    0.0000   0.0000          ?        ?  7737.6055  54.2743          ?        ?      879.6        3.1       ?       ? 
1 1 1   11   10   15 o    582.6    2.2    0.0000   0.0000          ?        ?  3393.7424  26.1794          ?        ?      582.6        2.2       ?       ? 
1 1 1   11   10   16 f   1111.5    3.8    0.0000   0.0000          ?        ? 12354.7549  84.9234          ?        ?     1111.5        3.8       ?       ? 
1 1 1   11   10   17 o   1096.3    3.8    0.0000   0.0000          ?        ? 12018.8926  82.3693          ?        ?     1096.3        3.8       ?       ? 
1 1 1   11   10   18 o   1185.6    4.0    0.0000   0.0000          ?        ? 14057.0537  95.7782          ?        ?     1185.6        4.0       ?       ? 
1 1 1   11   10   19 o    802.6    2.9    0.0000   0.0000          ?        ?  6441.4062  47.2506          ?        ?      802.6        2.9       ?       ? 
1 1 1   11   10   20 o    706.4    2.7    0.0000   0.0000          ?        ?  4990.0464  37.6728          ?        ?      706.4        2.7       ?       ? 
1 1 1   11   10   21 f   2376.6    7.6    0.0000   0.0000          ?        ? 56493.1992 363.3188          ?        ?     2376.6        7.6       ?       ? 
1 1 1   11   10   22 o    829.4    3.0    0.0000   0.0000          ?        ?  6879.4321  50.4432          ?        ?      829.4        3.0       ?       ? 
1 1 1   11   10   23 o   1383.7    4.6    0.0000   0.0000          ?        ? 19147.9863 128.3428          ?        ?     1383.7        4.6       ?       ? 
1 1 1   11   10   24 o    884.0    3.3    0.0000   0.0000          ?        ?  7815.5049  57.4669          ?        ?      884.0        3.3       ?       ? 
1 1 1   11   10   25 o   1722.9    5.9    0.0000   0.0000          ?        ? 29686.7852 203.6884          ?        ?     1722.9        5.9       ?       ? 
1 1 1   11   10   26 o    891.8    3.3    0.0000   0.0000          ?        ?  7953.4253  59.3825          ?        ?      891.8        3.3       ?       ? 
1 1 1   11   10   27 o   1026.5    3.8    0.0000   0.0000          ?        ? 10537.5225  77.2611          ?        ?     1026.5        3.8       ?       ? 
1 1 1   11   10   28 o   1358.9    4.7    0.0000   0.0000          ?        ? 18466.6855 127.0658          ?        ?     1358.9        4.7       ?       ? 
1 1 1   11   10   29 o    514.1    2.4    0.0000   0.0000          ?        ?  2643.4795  24.9023          ?        ?      514.1        2.4       ?       ? 
1 1 1   11   10   30 o   1327.8    4.7    0.0000   0.0000          ?        ? 17630.8594 125.7888          ?        ?     1327.8        4.7       ?       ? 
1 1 1   11   10   31 o   1015.6    3.8    0.0000   0.0000          ?        ? 10315.3164  76.6226          ?        ?     1015.6        3.8       ?       ? 
1 1 1   11   10   32 o   1833.4    6.0    0.0000   0.0000          ?        ? 33618.1641 219.0129          ?        ?     1833.4        6.0       ?       ? 
1 1 1   11   10   33 o    834.5    3.3    0.0000   0.0000          ?        ?  6964.3550  54.2743          ?        ?      834.5        3.3       ?       ? 
1 1 1   11   10   34 o   1314.0    4.6    0.0000   0.0000          ?        ? 17267.5410 120.0421          ?        ?     1314.0        4.6       ?       ? 
1 1 1   11   10   35 o    433.8    2.5    0.0000   0.0000          ?        ?  1881.7233  21.7097          ?        ?      433.8        2.5       ?       ? 
1 1 1   11   10   36 o    198.5    4.2    0.0000   0.0000          ?        ?   393.9678  16.6016          ?        ?      198.5        4.2       ?       ? 
1 1 1   11   10   37 o    549.8    2.6    0.0000   0.0000          ?        ?  3022.7612  28.7335          ?        ?      549.8        2.6       ?       ? 
1 1 1   11   10   38 o    360.3    2.6    0.0000   0.0000          ?        ?  1298.1145  18.5171          ?        ?      360.3        2.6       ?       ? 
1 1 1   11   10   39 o    203.4    4.9    0.0000   0.0000          ?        ?   413.7620  19.7942          ?        ?      203.4        4.9       ?       ? 
1 1 1   11   10   40 o    971.6    3.6    0.0000   0.0000          ?        ?  9439.9043  70.8759          ?        ?      971.6        3.6       ?       ? 
1 1 1   11   10   41 o    230.1    4.3    0.0000   0.0000          ?        ?   529.3344  19.7942          ?        ?      230.1        4.3       ?       ? 
1 1 1   11   10   42 o    241.4    4.0    0.0000   0.0000          ?        ?   582.9703  19.1556          ?        ?      241.4        4.0       ?       ? 
1 1 1   11   10   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11   10   44 o   1063.3    3.8    0.0000   0.0000          ?        ? 11306.9414  80.4537          ?        ?     1063.3        3.8       ?       ? 
1 1 1   11   10   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11   10   46 o    114.7    7.8    0.0000   0.0000          ?        ?   131.5355  17.8786          ?        ?      114.7        7.8       ?       ? 
1 1 1   11   10   47 o    167.6    5.3    0.0000   0.0000          ?        ?   280.9495  17.8786          ?        ?      167.6        5.3       ?       ? 
1 1 1   11   10   48 o    614.2    2.9    0.0000   0.0000          ?        ?  3773.0244  35.1187          ?        ?      614.2        2.9       ?       ? 
1 1 1   11   10   49 o    478.1    2.8    0.0000   0.0000          ?        ?  2285.9075  26.8179          ?        ?      478.1        2.8       ?       ? 
1 1 1   11   10   50 o    838.8    3.2    0.0000   0.0000          ?        ?  7036.5083  52.9973          ?        ?      838.8        3.2       ?       ? 
1 1 1   11   10   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11   10   52 o    195.4    4.6    0.0000   0.0000          ?        ?   381.8359  17.8786          ?        ?      195.4        4.6       ?       ? 
1 1 1   11   10   53 o    219.4    4.4    0.0000   0.0000          ?        ?   481.4453  19.1556          ?        ?      219.4        4.4       ?       ? 
1 1 1   11   10   54 o    328.0    3.1    0.0000   0.0000          ?        ?  1075.9089  20.4327          ?        ?      328.0        3.1       ?       ? 
1 1 1   11   10   55 o    255.0    3.8    0.0000   0.0000          ?        ?   650.6536  19.1556          ?        ?      255.0        3.8       ?       ? 
1 1 1   11   10   56 o    315.1    3.3    0.0000   0.0000          ?        ?   992.9011  21.0712          ?        ?      315.1        3.3       ?       ? 
1 1 1   11   10   57 o     33.1   14.6    0.0000   0.0000          ?        ?    -6.3852  19.1556          ?        ?       33.1       14.6       ?       ? 
1 1 1   11   10   58 o    188.3    5.1    0.0000   0.0000          ?        ?   355.0180  19.1556          ?        ?      188.3        5.1       ?       ? 
1 1 1   11   10   59 o    378.4    3.0    0.0000   0.0000          ?        ?  1432.2040  22.3483          ?        ?      378.4        3.0       ?       ? 
1 1 1   11   10   60 o     85.5   10.8    0.0000   0.0000          ?        ?    73.4300  18.5171          ?        ?       85.5       10.8       ?       ? 
1 1 1   11   10   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11   10   62 o    246.6    4.1    0.0000   0.0000          ?        ?   608.5111  20.4327          ?        ?      246.6        4.1       ?       ? 
1 1 1   11   10   63 o    258.8    3.8    0.0000   0.0000          ?        ?   670.4477  19.7942          ?        ?      258.8        3.8       ?       ? 
1 1 1   11   10   64 o    230.6    4.3    0.0000   0.0000          ?        ?   532.5270  19.7942          ?        ?      230.6        4.3       ?       ? 
1 1 1   11   10   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11   10   66 o    325.5    3.3    0.0000   0.0000          ?        ?  1059.9459  21.7097          ?        ?      325.5        3.3       ?       ? 
1 1 1   11   10   67 o    189.6    5.6    0.0000   0.0000          ?        ?   360.1262  21.0712          ?        ?      189.6        5.6       ?       ? 
1 1 1   11   10   68 o    326.5    3.3    0.0000   0.0000          ?        ?  1066.9697  21.7097          ?        ?      326.5        3.3       ?       ? 
1 1 1   11   10   69 o    275.4    3.8    0.0000   0.0000          ?        ?   759.2022  21.0712          ?        ?      275.4        3.8       ?       ? 
1 1 1   11   10   70 f    209.5    5.3    0.0000   0.0000          ?        ?   439.9414  22.3483          ?        ?      209.5        5.3       ?       ? 
1 1 1   11   10   71 o    245.3    4.6    0.0000   0.0000          ?        ?   602.7644  22.3483          ?        ?      245.3        4.6       ?       ? 
1 1 1   11   10   72 o     32.5   14.6    0.0000   0.0000          ?        ?    -8.9393  19.7942          ?        ?       32.5       14.6       ?       ? 
1 1 1   11   10   73 o     22.9   11.4    0.0000   0.0000          ?        ?   -58.7440  21.7097          ?        ?       22.9       11.4       ?       ? 
1 1 1   11   10   74 o    393.7    3.2    0.0000   0.0000          ?        ?  1551.6075  24.9023          ?        ?      393.7        3.2       ?       ? 
1 1 1   11   10   75 o    131.0    8.0    0.0000   0.0000          ?        ?   173.0394  21.0712          ?        ?      131.0        8.0       ?       ? 
1 1 1   11   10   76 o    185.2    6.0    0.0000   0.0000          ?        ?   344.8017  22.3483          ?        ?      185.2        6.0       ?       ? 
1 1 1   11   10   77 o     89.9   11.4    0.0000   0.0000          ?        ?    82.3693  20.4327          ?        ?       89.9       11.4       ?       ? 
1 1 1   11   10   78 o     66.5   15.6    0.0000   0.0000          ?        ?    47.8891  20.4327          ?        ?       66.5       15.6       ?       ? 
1 1 1   11   10   79 o     81.0   12.6    0.0000   0.0000          ?        ?    67.6833  20.4327          ?        ?       81.0       12.6       ?       ? 
1 1 1   11   11    0 o    932.5    7.1 8697.9414 132.1740  8697.9414 132.1740  8697.9414 132.1740      932.5      7.1      932.5        7.1     0.0     0.0 
1 1 1   11   11    1 o   1278.1    7.0 16339.1289 179.4246 16339.1289 179.4246 16339.1289 179.4246     1278.1      7.0     1278.1        7.0     0.0     0.0 
1 1 1   11   11    2 f    230.0    2.8  529.3344  12.7704   529.3344  12.7704   529.3344  12.7704      230.0      2.8      230.0        2.8     0.0     0.0 
1 1 1   11   11    3 o    851.0    4.5 7243.3896  77.2611  7243.3896  77.2611  7243.3896  77.2611      851.0      4.5      851.0        4.5     0.0     0.0 
1 1 1   11   11    4 o    391.8    2.4 1535.0060  18.5171  1535.0060  18.5171  1535.0060  18.5171      391.8      2.4      391.8        2.4     0.0     0.0 
1 1 1   11   11    5 o   1252.7    5.9 15695.5010 147.4985 15695.5010 147.4985 15695.5010 147.4985     1252.7      5.9     1252.7        5.9     0.0     0.0 
1 1 1   11   11    6 o    771.9    3.8 5959.3223  59.3825  5959.3223  59.3825  5959.3223  59.3825      771.9      3.8      771.9        3.8     0.0     0.0 
1 1 1   11   11    7 o   1496.2    7.0 22389.7617 208.7966 22389.7617 208.7966 22389.7617 208.7966     1496.2      7.0     1496.2        7.0     0.0     0.0 
1 1 1   11   11    8 o   1016.4    5.2 10333.1953 105.3561 10333.1953 105.3561 10333.1953 105.3561     1016.4      5.2     1016.4        5.2     0.0     0.0 
1 1 1   11   11    9 o    469.5    2.7 2204.1768  24.9023  2204.1768  24.9023  2204.1768  24.9023      469.5      2.7      469.5        2.7     0.0     0.0 
1 1 1   11   11   10 o   1246.5    6.5 15540.3398 160.9075 15540.3398 160.9075 15540.3398 160.9075     1246.5      6.5     1246.5        6.5     0.0     0.0 
1 1 1   11   11   11 o    783.2    4.2 6134.2773  66.4062  6134.2773  66.4062  6134.2773  66.4062      783.2      4.2      783.2        4.2     0.0     0.0 
1 1 1   11   11   12 o    279.4    2.2  780.9120  12.1319   780.9120  12.1319   780.9120  12.1319      279.4      2.2      279.4        2.2     0.0     0.0 
1 1 1   11   11   13 o    377.2    2.5 1423.2646  19.1556  1423.2646  19.1556  1423.2646  19.1556      377.2      2.5      377.2        2.5     0.0     0.0 
1 1 1   11   11   14 o   1233.8    5.9 15225.5479 146.2215 15225.5479 146.2215 15225.5479 146.2215     1233.8      5.9     1233.8        5.9     0.0     0.0 
1 1 1   11   11   15 o    209.6    2.4  439.3029  10.2163   439.3029  10.2163   439.3029  10.2163      209.6      2.4      209.6        2.4     0.0     0.0 
1 1 1   11   11   16 o    830.4    4.2 6896.0337  68.9603  6896.0337  68.9603  6896.0337  68.9603      830.4      4.2      830.4        4.2     0.0     0.0 
1 1 1   11   11   17 o     96.0    5.7   93.2242  10.8549    93.2242  10.8549    93.2242  10.8549       96.0      5.7       96.0        5.7     0.0     0.0 
1 1 1   11   11   18 o    210.1    3.0  441.8569  12.7704   441.8569  12.7704   441.8569  12.7704      210.1      3.0      210.1        3.0     0.0     0.0 
1 1 1   11   11   19 o   1151.3    5.6 13255.7090 128.9814 13255.7090 128.9814 13255.7090 128.9814     1151.3      5.6     1151.3        5.6     0.0     0.0 
1 1 1   11   11   20 o   1186.6    6.0 14082.5947 141.7518 14082.5947 141.7518 14082.5947 141.7518     1186.6      6.0     1186.6        6.0     0.0     0.0 
1 1 1   11   11   21 o    640.8    3.6 4106.9712  46.6121  4106.9712  46.6121  4106.9712  46.6121      640.8      3.6      640.8        3.6     0.0     0.0 
1 1 1   11   11   22 o    368.0    3.0 1354.3044  21.7097  1354.3044  21.7097  1354.3044  21.7097      368.0      3.0      368.0        3.0     0.0     0.0 
1 1 1   11   11   23 o    701.6    3.8 4923.0020  53.6358  4923.0020  53.6358  4923.0020  53.6358      701.6      3.8      701.6        3.8     0.0     0.0 
1 1 1   11   11   24 o    641.6    3.7 4117.1875  47.2506  4117.1875  47.2506  4117.1875  47.2506      641.6      3.7      641.6        3.7     0.0     0.0 
1 1 1   11   11   25 o    523.5    3.4 2740.5349  35.7572  2740.5349  35.7572  2740.5349  35.7572      523.5      3.4      523.5        3.4     0.0     0.0 
1 1 1   11   11   26 o   1628.7    7.6 26531.8516 247.7464 26531.8516 247.7464 26531.8516 247.7464     1628.7      7.6     1628.7        7.6     0.0     0.0 
1 1 1   11   11   27 o    892.1    4.8 7959.8105  84.9234  7959.8105  84.9234  7959.8105  84.9234      892.1      4.8      892.1        4.8     0.0     0.0 
1 1 1   11   11   28 f   2231.4   11.1 49803.4102 496.1313 49803.4102 496.1313 49803.4102 496.1313     2231.4     11.1     2231.4       11.1     0.0     0.0 
1 1 1   11   11   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11   11   30 o    555.1    4.0 3082.1440  44.6965  3082.1440  44.6965  3082.1440  44.6965      555.1      4.0      555.1        4.0     0.0     0.0 
1 1 1   11   11   31 o    101.9    9.6  106.6331  19.1556   106.6331  19.1556   106.6331  19.1556      101.9      9.6      101.9        9.6     0.0     0.0 
1 1 1   11   11   32 o     52.5   22.0   38.9498  22.9868    38.9498  22.9868    38.9498  22.9868       52.5     22.0       52.5       22.0     0.0     0.0 
1 1 1   11   11   33 o    447.6    3.4 2003.6808  30.0105  2003.6808  30.0105  2003.6808  30.0105      447.6      3.4      447.6        3.4     0.0     0.0 
1 1 1   11   11   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11   11   35 o   1756.6    8.5 30864.8574 300.1052 30864.8574 300.1052 30864.8574 300.1052     1756.6      8.5     1756.6        8.5     0.0     0.0 
1 1 1   11   11   36 o    303.0    4.1  918.8326  24.9023   918.8326  24.9023   918.8326  24.9023      303.0      4.1      303.0        4.1     0.0     0.0 
1 1 1   11   11   37 o    725.0    4.9 5257.5874  71.5144  5257.5874  71.5144  5257.5874  71.5144      725.0      4.9      725.0        4.9     0.0     0.0 
1 1 1   11   11   38 o   1001.4    5.1 10028.6201 101.5249 10028.6201 101.5249 10028.6201 101.5249     1001.4      5.1     1001.4        5.1     0.0     0.0 
1 1 1   11   11   39 f     42.7   22.2   26.8179  24.2638    26.8179  24.2638    26.8179  24.2638       42.7     22.2       42.7       22.2     0.0     0.0 
1 1 1   11   11   40 o   1108.0    5.5 12278.1328 122.5962 12278.1328 122.5962 12278.1328 122.5962     1108.0      5.5     1108.0        5.5     0.0     0.0 
1 1 1   11   11   41 o   1093.6    5.5 11962.7031 120.0421 11962.7031 120.0421 11962.7031 120.0421     1093.6      5.5     1093.6        5.5     0.0     0.0 
1 1 1   11   11   42 o     33.2   21.6   -1.2770  33.8416    -1.2770  33.8416    -1.2770  33.8416       33.2     21.6       33.2       21.6     0.0     0.0 
1 1 1   11   11   43 o   1028.1    5.3 10572.6416 109.1872 10572.6416 109.1872 10572.6416 109.1872     1028.1      5.3     1028.1        5.3     0.0     0.0 
1 1 1   11   11   44 o    467.0    4.1 2181.1899  38.3113  2181.1899  38.3113  2181.1899  38.3113      467.0      4.1      467.0        4.1     0.0     0.0 
1 1 1   11   11   45 o    558.5    3.8 3119.8167  42.1424  3119.8167  42.1424  3119.8167  42.1424      558.5      3.8      558.5        3.8     0.0     0.0 
1 1 1   11   11   46 o    186.2    6.5  347.9943  24.2638   347.9943  24.2638   347.9943  24.2638      186.2      6.5      186.2        6.5     0.0     0.0 
1 1 1   11   11   47 o    276.6    4.7  765.5875  26.1794   765.5875  26.1794   765.5875  26.1794      276.6      4.7      276.6        4.7     0.0     0.0 
1 1 1   11   11   48 o    256.9    5.2  660.8699  26.8179   660.8699  26.8179   660.8699  26.8179      256.9      5.2      256.9        5.2     0.0     0.0 
1 1 1   11   11   49 o    311.3    5.2  969.9143  32.5646   969.9143  32.5646   969.9143  32.5646      311.3      5.2      311.3        5.2     0.0     0.0 
1 1 1   11   11   50 o    984.7    5.1 9699.7822  99.6094  9699.7822  99.6094  9699.7822  99.6094      984.7      5.1      984.7        5.1     0.0     0.0 
1 1 1   11   11   51 o    217.8    6.6  475.6986  28.7335   475.6986  28.7335   475.6986  28.7335      217.8      6.6      217.8        6.6     0.0     0.0 
1 1 1   11   11   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11   11   53 o     42.0   22.7   25.5409  26.1794    25.5409  26.1794    25.5409  26.1794       42.0     22.7       42.0       22.7     0.0     0.0 
1 1 1   11   11   54 o    656.5    3.9 4311.2983  51.7203  4311.2983  51.7203  4311.2983  51.7203      656.5      3.9      656.5        3.9     0.0     0.0 
1 1 1   11   11   55 o   1148.2    5.6 13190.5801 127.7043 13190.5801 127.7043 13190.5801 127.7043     1148.2      5.6     1148.2        5.6     0.0     0.0 
1 1 1   11   11   56 o    190.7    7.6  365.8729  28.7335   365.8729  28.7335   365.8729  28.7335      190.7      7.6      190.7        7.6     0.0     0.0 
1 1 1   11   11   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11   11   58 o    303.0    4.4  918.8326  26.8179   918.8326  26.8179   918.8326  26.8179      303.0      4.4      303.0        4.4     0.0     0.0 
1 1 1   11   11   59 o     23.6   16.4  -20.4327  26.1794   -20.4327  26.1794   -20.4327  26.1794       23.6     16.4       23.6       16.4     0.0     0.0 
1 1 1   11   11   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   11   11   61 o    623.4    4.0 3888.5967  50.4432  3888.5967  50.4432  3888.5967  50.4432      623.4      4.0      623.4        4.0     0.0     0.0 
1 1 1   11   11   62 o    419.0    4.0 1756.5730  33.8416  1756.5730  33.8416  1756.5730  33.8416      419.0      4.0      419.0        4.0     0.0     0.0 
1 1 1   11   11   63 o    234.4    6.3  551.0442  29.3720   551.0442  29.3720   551.0442  29.3720      234.4      6.3      234.4        6.3     0.0     0.0 
1 1 1   11   11   64 o    461.0    4.0 2126.2771  37.0343  2126.2771  37.0343  2126.2771  37.0343      461.0      4.0      461.0        4.0     0.0     0.0 
1 1 1   11   11   65 o    172.4    8.6  300.1052  29.3720   300.1052  29.3720   300.1052  29.3720      172.4      8.6      172.4        8.6     0.0     0.0 
1 1 1   11   11   66 o    263.5    5.8  695.9886  30.6490   695.9886  30.6490   695.9886  30.6490      263.5      5.8      263.5        5.8     0.0     0.0 
1 1 1   11   11   67 o     28.7   19.2   -7.6623  29.3720    -7.6623  29.3720    -7.6623  29.3720       28.7     19.2       28.7       19.2     0.0     0.0 
1 1 1   11   11   68 o    134.2   11.1  184.5327  29.3720   184.5327  29.3720   184.5327  29.3720      134.2     11.1      134.2       11.1     0.0     0.0 
1 1 1   11   11   69 o    158.9    9.5  256.0471  30.0105   256.0471  30.0105   256.0471  30.0105      158.9      9.5      158.9        9.5     0.0     0.0 
1 1 1   11   11   70 o    155.4    9.5  245.1923  29.3720   245.1923  29.3720   245.1923  29.3720      155.4      9.5      155.4        9.5     0.0     0.0 
1 1 1   11   11   71 o     23.9   16.9  -29.3720  30.0105   -29.3720  30.0105   -29.3720  30.0105       23.9     16.9       23.9       16.9     0.0     0.0 
1 1 1   11   11   72 o     67.4   24.4   61.2981  30.0105    61.2981  30.0105    61.2981  30.0105       67.4     24.4       67.4       24.4     0.0     0.0 
1 1 1   11   11   73 o     21.5   15.5  -41.5039  29.3720   -41.5039  29.3720   -41.5039  29.3720       21.5     15.5       21.5       15.5     0.0     0.0 
1 1 1   11   11   74 o    194.6    7.9  381.8359  30.6490   381.8359  30.6490   381.8359  30.6490      194.6      7.9      194.6        7.9     0.0     0.0 
1 1 1   11   11   75 o     19.5   14.3  -55.5514  29.3720   -55.5514  29.3720   -55.5514  29.3720       19.5     14.3       19.5       14.3     0.0     0.0 
1 1 1   11   11   76 o     69.2   23.3   63.2136  28.7335    63.2136  28.7335    63.2136  28.7335       69.2     23.3       69.2       23.3     0.0     0.0 
1 1 1   11   11   77 o     30.1   19.5    1.9156  26.8179     1.9156  26.8179     1.9156  26.8179       30.1     19.5       30.1       19.5     0.0     0.0 
1 1 1   11   11   78 o     20.6   15.0  -51.7203  30.6490   -51.7203  30.6490   -51.7203  30.6490       20.6     15.0       20.6       15.0     0.0     0.0 
1 1 1   11   11   79 o     27.8   18.6   -5.7467  27.4564    -5.7467  27.4564    -5.7467  27.4564       27.8     18.6       27.8       18.6     0.0     0.0 
1 1 1   12    0    0 o   1695.9   11.1 28766.6777 374.8122 28766.6777 374.8122 28766.6777 374.8122     1695.9     11.1     1695.9       11.1     0.0     0.0 
1 1 1   12    0    1 o   1427.9    6.6 20391.8281 189.6409 20391.8281 189.6409 20391.8281 189.6409     1427.9      6.6     1427.9        6.6     0.0     0.0 
1 1 1   12    0    2 o    630.9    3.2 3981.1824  40.8654  3981.1824  40.8654  3981.1824  40.8654      630.9      3.2      630.9        3.2     0.0     0.0 
1 1 1   12    0    3 o    982.6    4.7 9656.3633  93.2242  9656.3633  93.2242  9656.3633  93.2242      982.6      4.7      982.6        4.7     0.0     0.0 
1 1 1   12    0    4 o    468.2    2.7 2192.0447  24.9023  2192.0447  24.9023  2192.0447  24.9023      468.2      2.7      468.2        2.7     0.0     0.0 
1 1 1   12    0    5 o   1800.6    8.2 32427.3203 295.6355 32427.3203 295.6355 32427.3203 295.6355     1800.6      8.2     1800.6        8.2     0.0     0.0 
1 1 1   12    0    6 o    369.2    2.2 1363.2437  16.6016  1363.2437  16.6016  1363.2437  16.6016      369.2      2.2      369.2        2.2     0.0     0.0 
1 1 1   12    0    7 o    142.9    1.8  204.3269   5.1082   204.3269   5.1082   204.3269   5.1082      142.9      1.8      142.9        1.8     0.0     0.0 
1 1 1   12    0    8 o   1774.1    8.1 31479.1152 287.3347 31479.1152 287.3347 31479.1152 287.3347     1774.1      8.1     1774.1        8.1     0.0     0.0 
1 1 1   12    0    9 o    495.4    2.7 2454.4771  26.8179  2454.4771  26.8179  2454.4771  26.8179      495.4      2.7      495.4        2.7     0.0     0.0 
1 1 1   12    0   10 o   2942.6   13.7 86618.0156 807.0914 86618.0156 807.0914 86618.0156 807.0914     2942.6     13.7     2942.6       13.7     0.0     0.0 
1 1 1   12    0   11 o   2225.3   10.1 49528.8438 448.2422 49528.8438 448.2422 49528.8438 448.2422     2225.3     10.1     2225.3       10.1     0.0     0.0 
1 1 1   12    0   12 f    516.6    2.8 2669.0205  29.3720  2669.0205  29.3720  2669.0205  29.3720      516.6      2.8      516.6        2.8     0.0     0.0 
1 1 1   12    0   13 o   1318.0    6.2 17372.2578 162.8230 17372.2578 162.8230 17372.2578 162.8230     1318.0      6.2     1318.0        6.2     0.0     0.0 
1 1 1   12    0   14 o    140.2    2.5  196.6647   7.0237   196.6647   7.0237   196.6647   7.0237      140.2      2.5      140.2        2.5     0.0     0.0 
1 1 1   12    0   15 o   1626.3    7.4 26453.9512 241.9997 26453.9512 241.9997 26453.9512 241.9997     1626.3      7.4     1626.3        7.4     0.0     0.0 
1 1 1   12    0   16 o    611.9    3.4 3744.9294  41.5039  3744.9294  41.5039  3744.9294  41.5039      611.9      3.4      611.9        3.4     0.0     0.0 
1 1 1   12    0   17 o    815.0    4.9 6643.8174  79.8152  6643.8174  79.8152  6643.8174  79.8152      815.0      4.9      815.0        4.9     0.0     0.0 
1 1 1   12    0   18 o   2014.4    9.1 40589.5430 368.4270 40589.5430 368.4270 40589.5430 368.4270     2014.4      9.1     2014.4        9.1     0.0     0.0 
1 1 1   12    0   19 o    242.7    2.8  589.3555  13.4090   589.3555  13.4090   589.3555  13.4090      242.7      2.8      242.7        2.8     0.0     0.0 
1 1 1   12    0   20 o    663.6    3.8 4404.5220  50.4432  4404.5220  50.4432  4404.5220  50.4432      663.6      3.8      663.6        3.8     0.0     0.0 
1 1 1   12    0   21 o    413.8    3.2 1712.5151  26.8179  1712.5151  26.8179  1712.5151  26.8179      413.8      3.2      413.8        3.2     0.0     0.0 
1 1 1   12    0   22 o    569.0    3.4 3238.5818  38.3113  3238.5818  38.3113  3238.5818  38.3113      569.0      3.4      569.0        3.4     0.0     0.0 
1 1 1   12    0   23 o   2111.1   10.1 44582.8594 426.5325 44582.8594 426.5325 44582.8594 426.5325     2111.1     10.1     2111.1       10.1     0.0     0.0 
1 1 1   12    0   24 o    801.1    4.1 6418.4194  66.4062  6418.4194  66.4062  6418.4194  66.4062      801.1      4.1      801.1        4.1     0.0     0.0 
1 1 1   12    0   25 o   1795.7    8.2 32253.0059 295.6355 32253.0059 295.6355 32253.0059 295.6355     1795.7      8.2     1795.7        8.2     0.0     0.0 
1 1 1   12    0   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    0   27 f   2150.2   13.9 46257.6992 595.7407 46257.6992 595.7407 46257.6992 595.7407     2150.2     13.9     2150.2       13.9     0.0     0.0 
1 1 1   12    0   28 o   2971.0   26.8 88402.6797 1594.3884 88402.6797 1594.3884 88402.6797 1594.3884     2971.0     26.8     2971.0       26.8     0.0     0.0 
1 1 1   12    0   29 o   1255.6    6.6 15767.6523 165.3771 15767.6523 165.3771 15767.6523 165.3771     1255.6      6.6     1255.6        6.6     0.0     0.0 
1 1 1   12    0   30 f   1532.5    7.3 23490.5723 222.8441 23490.5723 222.8441 23490.5723 222.8441     1532.5      7.3     1532.5        7.3     0.0     0.0 
1 1 1   12    0   31 o    346.9    3.8 1203.6133  26.1794  1203.6133  26.1794  1203.6133  26.1794      346.9      3.8      346.9        3.8     0.0     0.0 
1 1 1   12    0   32 o     22.4   16.2  -48.5276  32.5646   -48.5276  32.5646   -48.5276  32.5646       22.4     16.2       22.4       16.2     0.0     0.0 
1 1 1   12    0   33 o    614.7    4.1 3778.7710  49.8047  3778.7710  49.8047  3778.7710  49.8047      614.7      4.1      614.7        4.1     0.0     0.0 
1 1 1   12    0   34 o   1000.5    5.3 10010.7422 105.9946 10010.7422 105.9946 10010.7422 105.9946     1000.5      5.3     1000.5        5.3     0.0     0.0 
1 1 1   12    0   35 o   1263.4    6.3 15964.9561 158.3534 15964.9561 158.3534 15964.9561 158.3534     1263.4      6.3     1263.4        6.3     0.0     0.0 
1 1 1   12    0   36 o   1607.6    7.7 25848.6328 246.4693 25848.6328 246.4693 25848.6328 246.4693     1607.6      7.7     1607.6        7.7     0.0     0.0 
1 1 1   12    0   37 o    679.1    3.9 4612.6802  53.6358  4612.6802  53.6358  4612.6802  53.6358      679.1      3.9      679.1        3.9     0.0     0.0 
1 1 1   12    0   38 o    518.9    3.8 2692.6458  38.9498  2692.6458  38.9498  2692.6458  38.9498      518.9      3.8      518.9        3.8     0.0     0.0 
1 1 1   12    0   39 o   1226.5    6.0 15046.1230 146.2215 15046.1230 146.2215 15046.1230 146.2215     1226.5      6.0     1226.5        6.0     0.0     0.0 
1 1 1   12    0   40 o   1555.4    7.6 24196.1387 234.9760 24196.1387 234.9760 24196.1387 234.9760     1555.4      7.6     1555.4        7.6     0.0     0.0 
1 1 1   12    0   41 o    534.6    4.7 2859.2998  49.8047  2859.2998  49.8047  2859.2998  49.8047      534.6      4.7      534.6        4.7     0.0     0.0 
1 1 1   12    0   42 o    712.9    4.1 5082.6323  58.1055  5082.6323  58.1055  5082.6323  58.1055      712.9      4.1      712.9        4.1     0.0     0.0 
1 1 1   12    0   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    0   44 o   1304.2    6.2 17012.7695 162.8230 17012.7695 162.8230 17012.7695 162.8230     1304.2      6.2     1304.2        6.2     0.0     0.0 
1 1 1   12    0   45 o   1085.8    5.5 11791.5781 120.0421 11791.5781 120.0421 11791.5781 120.0421     1085.8      5.5     1085.8        5.5     0.0     0.0 
1 1 1   12    0   46 f    325.3    6.0 1059.3074  38.9498  1059.3074  38.9498  1059.3074  38.9498      325.3      6.0      325.3        6.0     0.0     0.0 
1 1 1   12    0   47 o   1516.1    7.1 22991.2480 213.9047 22991.2480 213.9047 22991.2480 213.9047     1516.1      7.1     1516.1        7.1     0.0     0.0 
1 1 1   12    0   48 o   1265.9    6.1 16030.0850 155.1608 16030.0850 155.1608 16030.0850 155.1608     1265.9      6.1     1265.9        6.1     0.0     0.0 
1 1 1   12    0   49 o    337.8    5.3 1142.3152  35.7572  1142.3152  35.7572  1142.3152  35.7572      337.8      5.3      337.8        5.3     0.0     0.0 
1 1 1   12    0   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    0   51 o    176.4    7.5  312.8756  26.1794   312.8756  26.1794   312.8756  26.1794      176.4      7.5      176.4        7.5     0.0     0.0 
1 1 1   12    0   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    0   53 o    635.1    4.2 4034.8184  53.6358  4034.8184  53.6358  4034.8184  53.6358      635.1      4.2      635.1        4.2     0.0     0.0 
1 1 1   12    0   54 o    746.7    4.4 5577.4863  66.4062  5577.4863  66.4062  5577.4863  66.4062      746.7      4.4      746.7        4.4     0.0     0.0 
1 1 1   12    0   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    0   56 o    325.4    4.6 1059.9459  30.0105  1059.9459  30.0105  1059.9459  30.0105      325.4      4.6      325.4        4.6     0.0     0.0 
1 1 1   12    0   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    0   58 o     15.8   11.8  -75.3456  26.1794   -75.3456  26.1794   -75.3456  26.1794       15.8     11.8       15.8       11.8     0.0     0.0 
1 1 1   12    0   59 o     84.2   17.1   79.1767  25.5409    79.1767  25.5409    79.1767  25.5409       84.2     17.1       84.2       17.1     0.0     0.0 
1 1 1   12    0   60 o    133.0    9.7  180.0631  25.5409   180.0631  25.5409   180.0631  25.5409      133.0      9.7      133.0        9.7     0.0     0.0 
1 1 1   12    0   61 o    297.1    5.1  883.7139  30.0105   883.7139  30.0105   883.7139  30.0105      297.1      5.1      297.1        5.1     0.0     0.0 
1 1 1   12    0   62 o    181.5    7.6  331.3927  27.4564   331.3927  27.4564   331.3927  27.4564      181.5      7.6      181.5        7.6     0.0     0.0 
1 1 1   12    0   63 o    433.6    4.3 1881.7233  37.0343  1881.7233  37.0343  1881.7233  37.0343      433.6      4.3      433.6        4.3     0.0     0.0 
1 1 1   12    0   64 o    320.1    5.0 1026.1042  31.9261  1026.1042  31.9261  1026.1042  31.9261      320.1      5.0      320.1        5.0     0.0     0.0 
1 1 1   12    0   65 o    214.6    6.7  462.2897  28.7335   462.2897  28.7335   462.2897  28.7335      214.6      6.7      214.6        6.7     0.0     0.0 
1 1 1   12    0   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    0   67 o     62.9   24.6   54.9129  29.3720    54.9129  29.3720    54.9129  29.3720       62.9     24.6       62.9       24.6     0.0     0.0 
1 1 1   12    0   68 o    255.1    5.8  652.5691  29.3720   652.5691  29.3720   652.5691  29.3720      255.1      5.8      255.1        5.8     0.0     0.0 
1 1 1   12    0   69 o     99.2   16.2  105.3561  30.0105   105.3561  30.0105   105.3561  30.0105       99.2     16.2       99.2       16.2     0.0     0.0 
1 1 1   12    0   70 o     20.5   14.9  -51.0817  30.0105   -51.0817  30.0105   -51.0817  30.0105       20.5     14.9       20.5       14.9     0.0     0.0 
1 1 1   12    0   71 f    201.8    7.9  409.9309  31.9261   409.9309  31.9261   409.9309  31.9261      201.8      7.9      201.8        7.9     0.0     0.0 
1 1 1   12    0   72 o    270.4    5.8  733.0228  31.2876   733.0228  31.2876   733.0228  31.2876      270.4      5.8      270.4        5.8     0.0     0.0 
1 1 1   12    0   73 o    268.3    6.0  722.1680  31.9261   722.1680  31.9261   722.1680  31.9261      268.3      6.0      268.3        6.0     0.0     0.0 
1 1 1   12    0   74 f     41.2   23.7   22.9868  30.6490    22.9868  30.6490    22.9868  30.6490       41.2     23.7       41.2       23.7     0.0     0.0 
1 1 1   12    0   75 o    163.3    9.6  270.7332  31.2876   270.7332  31.2876   270.7332  31.2876      163.3      9.6      163.3        9.6     0.0     0.0 
1 1 1   12    0   76 o     16.1   12.0 -106.6331  31.2876  -106.6331  31.2876  -106.6331  31.2876       16.1     12.0       16.1       12.0     0.0     0.0 
1 1 1   12    0   77 o    373.4    4.6 1397.0853  34.4802  1397.0853  34.4802  1397.0853  34.4802      373.4      4.6      373.4        4.6     0.0     0.0 
1 1 1   12    0   78 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    0   79 o    103.0   15.6  113.0183  30.6490   113.0183  30.6490   113.0183  30.6490      103.0     15.6      103.0       15.6     0.0     0.0 
1 1 1   12    0   80 f    166.5    9.7  282.2266  31.9261   282.2266  31.9261   282.2266  31.9261      166.5      9.7      166.5        9.7     0.0     0.0 
1 1 1   12    0   81 o     21.2   15.3  -49.8047  31.2876   -49.8047  31.2876   -49.8047  31.2876       21.2     15.3       21.2       15.3     0.0     0.0 
1 1 1   12    1    0 o   1363.3    6.4 18589.2812 173.6779 18589.2812 173.6779 18589.2812 173.6779     1363.3      6.4     1363.3        6.4     0.0     0.0 
1 1 1   12    1    1 o   1894.1    6.1    0.0000   0.0000          ?        ? 35879.8086 231.7833          ?        ?     1894.1        6.1       ?       ? 
1 1 1   12    1    2 o   1181.5    3.9    0.0000   0.0000          ?        ? 13960.6357  93.2242          ?        ?     1181.5        3.9       ?       ? 
1 1 1   12    1    3 o    786.4    2.8    0.0000   0.0000          ?        ?  6184.0820  43.4195          ?        ?      786.4        2.8       ?       ? 
1 1 1   12    1    4 o   2428.1    8.3    0.0000   0.0000          ?        ? 58970.0273 402.2686          ?        ?     2428.1        8.3       ?       ? 
1 1 1   12    1    5 o   1342.6    4.4    0.0000   0.0000          ?        ? 18025.4648 118.7650          ?        ?     1342.6        4.4       ?       ? 
1 1 1   12    1    6 o   1744.3    5.7    0.0000   0.0000          ?        ? 30428.7480 197.3032          ?        ?     1744.3        5.7       ?       ? 
1 1 1   12    1    7 o   1538.4    5.0    0.0000   0.0000          ?        ? 23669.9961 155.1608          ?        ?     1538.4        5.0       ?       ? 
1 1 1   12    1    8 o   1151.4    3.8    0.0000   0.0000          ?        ? 13258.9014  88.1160          ?        ?     1151.4        3.8       ?       ? 
1 1 1   12    1    9 o   1453.0    4.7    0.0000   0.0000          ?        ? 21112.7168 137.9207          ?        ?     1453.0        4.7       ?       ? 
1 1 1   12    1   10 o   1162.8    3.9    0.0000   0.0000          ?        ? 13522.6113  90.6701          ?        ?     1162.8        3.9       ?       ? 
1 1 1   12    1   11 o    968.2    3.3    0.0000   0.0000          ?        ?  9374.7744  64.4907          ?        ?      968.2        3.3       ?       ? 
1 1 1   12    1   12 o     24.0    7.3    0.0000   0.0000          ?        ?     5.7467   3.8311          ?        ?       24.0        7.3       ?       ? 
1 1 1   12    1   13 o   1460.7    4.8    0.0000   0.0000          ?        ? 21339.3926 139.1977          ?        ?     1460.7        4.8       ?       ? 
1 1 1   12    1   14 o    526.5    2.0    0.0000   0.0000          ?        ?  2772.4609  21.0712          ?        ?      526.5        2.0       ?       ? 
1 1 1   12    1   15 o    728.2    2.6    0.0000   0.0000          ?        ?  5302.2837  38.3113          ?        ?      728.2        2.6       ?       ? 
1 1 1   12    1   16 o   1157.7    3.9    0.0000   0.0000          ?        ? 13403.2080  90.0316          ?        ?     1157.7        3.9       ?       ? 
1 1 1   12    1   17 o   1396.3    4.7    0.0000   0.0000          ?        ? 19498.5352 131.5355          ?        ?     1396.3        4.7       ?       ? 
1 1 1   12    1   18 o    741.0    2.7    0.0000   0.0000          ?        ?  5490.6475  40.2269          ?        ?      741.0        2.7       ?       ? 
1 1 1   12    1   19 o    464.1    2.0    0.0000   0.0000          ?        ?  2154.3718  18.5171          ?        ?      464.1        2.0       ?       ? 
1 1 1   12    1   20 o    667.2    2.5    0.0000   0.0000          ?        ?  4451.7729  33.2031          ?        ?      667.2        2.5       ?       ? 
1 1 1   12    1   21 o    773.5    2.8    0.0000   0.0000          ?        ?  5982.9478  44.0580          ?        ?      773.5        2.8       ?       ? 
1 1 1   12    1   22 o    838.4    3.0    0.0000   0.0000          ?        ?  7029.4849  49.8047          ?        ?      838.4        3.0       ?       ? 
1 1 1   12    1   23 f    564.6    2.2    0.0000   0.0000          ?        ?  3188.1384  24.9023          ?        ?      564.6        2.2       ?       ? 
1 1 1   12    1   24 o   1547.5    5.1    0.0000   0.0000          ?        ? 23949.0312 158.3534          ?        ?     1547.5        5.1       ?       ? 
1 1 1   12    1   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    1   26 o    686.5    2.7    0.0000   0.0000          ?        ?  4712.2896  36.3957          ?        ?      686.5        2.7       ?       ? 
1 1 1   12    1   27 o    667.7    2.6    0.0000   0.0000          ?        ?  4458.7964  35.1187          ?        ?      667.7        2.6       ?       ? 
1 1 1   12    1   28 o    986.1    3.6    0.0000   0.0000          ?        ?  9724.0459  70.2374          ?        ?      986.1        3.6       ?       ? 
1 1 1   12    1   29 o   1350.9    4.5    0.0000   0.0000          ?        ? 18251.5020 121.9576          ?        ?     1350.9        4.5       ?       ? 
1 1 1   12    1   30 o   1086.7    3.9    0.0000   0.0000          ?        ? 11810.0957  85.5619          ?        ?     1086.7        3.9       ?       ? 
1 1 1   12    1   31 o    428.6    3.1    0.0000   0.0000          ?        ?  1837.0269  26.1794          ?        ?      428.6        3.1       ?       ? 
1 1 1   12    1   32 o   1413.7    5.1    0.0000   0.0000          ?        ? 19987.0039 143.0288          ?        ?     1413.7        5.1       ?       ? 
1 1 1   12    1   33 o   1438.3    5.2    0.0000   0.0000          ?        ? 20687.4609 150.6911          ?        ?     1438.3        5.2       ?       ? 
1 1 1   12    1   34 o    603.0    2.6    0.0000   0.0000          ?        ?  3636.3806  31.2876          ?        ?      603.0        2.6       ?       ? 
1 1 1   12    1   35 o    499.8    2.4    0.0000   0.0000          ?        ?  2498.5352  23.6253          ?        ?      499.8        2.4       ?       ? 
1 1 1   12    1   36 o    572.0    2.5    0.0000   0.0000          ?        ?  3272.4233  28.0950          ?        ?      572.0        2.5       ?       ? 
1 1 1   12    1   37 o    588.2    2.6    0.0000   0.0000          ?        ?  3459.5100  30.6490          ?        ?      588.2        2.6       ?       ? 
1 1 1   12    1   38 o   1575.9    5.2    0.0000   0.0000          ?        ? 24838.4922 165.3771          ?        ?     1575.9        5.2       ?       ? 
1 1 1   12    1   39 o     22.9   11.2    0.0000   0.0000          ?        ?   -33.8416  17.2401          ?        ?       22.9       11.2       ?       ? 
1 1 1   12    1   40 f    319.4    3.5    0.0000   0.0000          ?        ?  1020.3576  22.3483          ?        ?      319.4        3.5       ?       ? 
1 1 1   12    1   41 o   1565.7    5.2    0.0000   0.0000          ?        ? 24517.9531 164.1001          ?        ?     1565.7        5.2       ?       ? 
1 1 1   12    1   42 o    704.9    2.9    0.0000   0.0000          ?        ?  4969.6138  40.8654          ?        ?      704.9        2.9       ?       ? 
1 1 1   12    1   43 o    946.8    3.5    0.0000   0.0000          ?        ?  8964.8438  67.0448          ?        ?      946.8        3.5       ?       ? 
1 1 1   12    1   44 o   1277.1    4.3    0.0000   0.0000          ?        ? 16311.0352 111.1028          ?        ?     1277.1        4.3       ?       ? 
1 1 1   12    1   45 o    514.3    3.0    0.0000   0.0000          ?        ?  2644.7566  30.6490          ?        ?      514.3        3.0       ?       ? 
1 1 1   12    1   46 o    450.5    3.2    0.0000   0.0000          ?        ?  2029.8602  28.7335          ?        ?      450.5        3.2       ?       ? 
1 1 1   12    1   47 o    452.9    3.0    0.0000   0.0000          ?        ?  2050.9316  27.4564          ?        ?      452.9        3.0       ?       ? 
1 1 1   12    1   48 o    611.8    2.8    0.0000   0.0000          ?        ?  3743.6521  34.4802          ?        ?      611.8        2.8       ?       ? 
1 1 1   12    1   49 o    994.6    3.6    0.0000   0.0000          ?        ?  9893.8926  70.8759          ?        ?      994.6        3.6       ?       ? 
1 1 1   12    1   50 o     38.4   15.7    0.0000   0.0000          ?        ?     5.1082  19.1556          ?        ?       38.4       15.7       ?       ? 
1 1 1   12    1   51 f    478.2    2.8    0.0000   0.0000          ?        ?  2286.5459  26.8179          ?        ?      478.2        2.8       ?       ? 
1 1 1   12    1   52 o    454.5    2.7    0.0000   0.0000          ?        ?  2065.6174  24.9023          ?        ?      454.5        2.7       ?       ? 
1 1 1   12    1   53 o    483.3    2.8    0.0000   0.0000          ?        ?  2336.3506  26.8179          ?        ?      483.3        2.8       ?       ? 
1 1 1   12    1   54 o    236.5    3.9    0.0000   0.0000          ?        ?   559.3449  18.5171          ?        ?      236.5        3.9       ?       ? 
1 1 1   12    1   55 o    227.8    4.3    0.0000   0.0000          ?        ?   519.1181  19.7942          ?        ?      227.8        4.3       ?       ? 
1 1 1   12    1   56 o    539.5    2.7    0.0000   0.0000          ?        ?  2911.0200  29.3720          ?        ?      539.5        2.7       ?       ? 
1 1 1   12    1   57 o    421.0    2.9    0.0000   0.0000          ?        ?  1773.1747  24.2638          ?        ?      421.0        2.9       ?       ? 
1 1 1   12    1   58 o    296.9    3.3    0.0000   0.0000          ?        ?   881.7984  19.7942          ?        ?      296.9        3.3       ?       ? 
1 1 1   12    1   59 f    198.9    4.7    0.0000   0.0000          ?        ?   395.8834  18.5171          ?        ?      198.9        4.7       ?       ? 
1 1 1   12    1   60 o    227.6    4.1    0.0000   0.0000          ?        ?   518.4796  18.5171          ?        ?      227.6        4.1       ?       ? 
1 1 1   12    1   61 o    269.5    3.8    0.0000   0.0000          ?        ?   726.6376  20.4327          ?        ?      269.5        3.8       ?       ? 
1 1 1   12    1   62 o    382.9    3.3    0.0000   0.0000          ?        ?  1466.6842  24.9023          ?        ?      382.9        3.3       ?       ? 
1 1 1   12    1   63 o    215.4    4.6    0.0000   0.0000          ?        ?   464.2052  19.7942          ?        ?      215.4        4.6       ?       ? 
1 1 1   12    1   64 o    833.3    3.1    0.0000   0.0000          ?        ?  6947.1152  52.3588          ?        ?      833.3        3.1       ?       ? 
1 1 1   12    1   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    1   66 o     19.5    9.9    0.0000   0.0000          ?        ?   -72.1529  19.7942          ?        ?       19.5        9.9       ?       ? 
1 1 1   12    1   67 o    584.9    2.8    0.0000   0.0000          ?        ?  3422.4758  33.2031          ?        ?      584.9        2.8       ?       ? 
1 1 1   12    1   68 o    163.2    6.3    0.0000   0.0000          ?        ?   266.9020  20.4327          ?        ?      163.2        6.3       ?       ? 
1 1 1   12    1   69 o    182.4    5.8    0.0000   0.0000          ?        ?   333.3083  21.0712          ?        ?      182.4        5.8       ?       ? 
1 1 1   12    1   70 o    347.7    3.4    0.0000   0.0000          ?        ?  1209.9985  23.6253          ?        ?      347.7        3.4       ?       ? 
1 1 1   12    1   71 o    100.0   10.5    0.0000   0.0000          ?        ?   100.8864  21.0712          ?        ?      100.0       10.5       ?       ? 
1 1 1   12    1   72 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    1   73 o    253.1    4.4    0.0000   0.0000          ?        ?   641.7142  22.3483          ?        ?      253.1        4.4       ?       ? 
1 1 1   12    1   74 o    219.4    5.1    0.0000   0.0000          ?        ?   482.7224  22.3483          ?        ?      219.4        5.1       ?       ? 
1 1 1   12    1   75 o    194.7    5.9    0.0000   0.0000          ?        ?   380.5589  22.9868          ?        ?      194.7        5.9       ?       ? 
1 1 1   12    1   76 o    139.7    8.0    0.0000   0.0000          ?        ?   196.6647  22.3483          ?        ?      139.7        8.0       ?       ? 
1 1 1   12    1   77 o    104.1   10.1    0.0000   0.0000          ?        ?   109.8257  21.0712          ?        ?      104.1       10.1       ?       ? 
1 1 1   12    1   78 o     48.5   17.2    0.0000   0.0000          ?        ?    21.7097  21.0712          ?        ?       48.5       17.2       ?       ? 
1 1 1   12    1   79 o    102.8    9.6    0.0000   0.0000          ?        ?   107.2716  19.7942          ?        ?      102.8        9.6       ?       ? 
1 1 1   12    1   80 o     45.6   16.9    0.0000   0.0000          ?        ?    17.8786  20.4327          ?        ?       45.6       16.9       ?       ? 
1 1 1   12    1   81 o     30.0   14.0    0.0000   0.0000          ?        ?   -17.2401  20.4327          ?        ?       30.0       14.0       ?       ? 
1 1 1   12    2    0 o    655.3    3.4 4294.0581  44.0580  4294.0581  44.0580  4294.0581  44.0580      655.3      3.4      655.3        3.4     0.0     0.0 
1 1 1   12    2    1 o    700.8    2.5    0.0000   0.0000          ?        ?  4910.8696  35.1187          ?        ?      700.8        2.5       ?       ? 
1 1 1   12    2    2 o    586.3    2.2    0.0000   0.0000          ?        ?  3437.8005  25.5409          ?        ?      586.3        2.2       ?       ? 
1 1 1   12    2    3 o    672.3    2.4    0.0000   0.0000          ?        ?  4520.0947  32.5646          ?        ?      672.3        2.4       ?       ? 
1 1 1   12    2    4 o    840.5    2.9    0.0000   0.0000          ?        ?  7064.6035  49.1662          ?        ?      840.5        2.9       ?       ? 
1 1 1   12    2    5 o   1651.2    5.4    0.0000   0.0000          ?        ? 27265.5117 177.5090          ?        ?     1651.2        5.4       ?       ? 
1 1 1   12    2    6 o    510.5    1.9    0.0000   0.0000          ?        ?  2606.4453  19.7942          ?        ?      510.5        1.9       ?       ? 
1 1 1   12    2    7 o   1094.7    3.6    0.0000   0.0000          ?        ? 11983.7744  79.8152          ?        ?     1094.7        3.6       ?       ? 
1 1 1   12    2    8 o    860.6    3.0    0.0000   0.0000          ?        ?  7406.2124  51.0817          ?        ?      860.6        3.0       ?       ? 
1 1 1   12    2    9 o   1412.0    4.7    0.0000   0.0000          ?        ? 19939.1152 131.5355          ?        ?     1412.0        4.7       ?       ? 
1 1 1   12    2   10 o    578.5    2.2    0.0000   0.0000          ?        ?  3347.1304  24.9023          ?        ?      578.5        2.2       ?       ? 
1 1 1   12    2   11 o    608.3    2.3    0.0000   0.0000          ?        ?  3700.2329  27.4564          ?        ?      608.3        2.3       ?       ? 
1 1 1   12    2   12 o    856.8    2.9    0.0000   0.0000          ?        ?  7341.0830  50.4432          ?        ?      856.8        2.9       ?       ? 
1 1 1   12    2   13 o    988.4    3.4    0.0000   0.0000          ?        ?  9770.6572  67.0448          ?        ?      988.4        3.4       ?       ? 
1 1 1   12    2   14 o   1237.7    4.2    0.0000   0.0000          ?        ? 15320.6875 104.0790          ?        ?     1237.7        4.2       ?       ? 
1 1 1   12    2   15 o    596.7    2.2    0.0000   0.0000          ?        ?  3560.3965  26.8179          ?        ?      596.7        2.2       ?       ? 
1 1 1   12    2   16 o    841.2    3.0    0.0000   0.0000          ?        ?  7076.0962  49.8047          ?        ?      841.2        3.0       ?       ? 
1 1 1   12    2   17 o    488.0    2.0    0.0000   0.0000          ?        ?  2381.0471  19.1556          ?        ?      488.0        2.0       ?       ? 
1 1 1   12    2   18 o    543.4    2.2    0.0000   0.0000          ?        ?  2953.1626  23.6253          ?        ?      543.4        2.2       ?       ? 
1 1 1   12    2   19 o   1335.6    4.4    0.0000   0.0000          ?        ? 17839.6543 118.1265          ?        ?     1335.6        4.4       ?       ? 
1 1 1   12    2   20 o    346.6    1.8    0.0000   0.0000          ?        ?  1201.0592  12.1319          ?        ?      346.6        1.8       ?       ? 
1 1 1   12    2   21 o    752.7    2.7    0.0000   0.0000          ?        ?  5665.6025  40.8654          ?        ?      752.7        2.7       ?       ? 
1 1 1   12    2   22 o   1002.1    3.4    0.0000   0.0000          ?        ? 10043.3066  68.9603          ?        ?     1002.1        3.4       ?       ? 
1 1 1   12    2   23 o    853.9    3.0    0.0000   0.0000          ?        ?  7291.9170  51.7203          ?        ?      853.9        3.0       ?       ? 
1 1 1   12    2   24 o   1044.2    3.7    0.0000   0.0000          ?        ? 10904.6729  76.6226          ?        ?     1044.2        3.7       ?       ? 
1 1 1   12    2   25 o    583.2    2.5    0.0000   0.0000          ?        ?  3400.7661  28.7335          ?        ?      583.2        2.5       ?       ? 
1 1 1   12    2   26 o    661.6    2.6    0.0000   0.0000          ?        ?  4377.0659  34.4802          ?        ?      661.6        2.6       ?       ? 
1 1 1   12    2   27 o    391.0    2.0    0.0000   0.0000          ?        ?  1528.6207  15.9630          ?        ?      391.0        2.0       ?       ? 
1 1 1   12    2   28 o    976.5    3.8    0.0000   0.0000          ?        ?  9536.3203  73.4300          ?        ?      976.5        3.8       ?       ? 
1 1 1   12    2   29 o   2865.4    9.3    0.0000   0.0000          ?        ? 82130.4766 533.8041          ?        ?     2865.4        9.3       ?       ? 
1 1 1   12    2   30 o   1019.3    3.7    0.0000   0.0000          ?        ? 10390.6631  74.7070          ?        ?     1019.3        3.7       ?       ? 
1 1 1   12    2   31 o   1529.3    5.4    0.0000   0.0000          ?        ? 23389.6855 166.6541          ?        ?     1529.3        5.4       ?       ? 
1 1 1   12    2   32 o   1115.3    4.2    0.0000   0.0000          ?        ? 12439.0400  94.5012          ?        ?     1115.3        4.2       ?       ? 
1 1 1   12    2   33 o   1956.7    6.6    0.0000   0.0000          ?        ? 38290.8633 259.8783          ?        ?     1956.7        6.6       ?       ? 
1 1 1   12    2   34 o     25.1   12.6    0.0000   0.0000          ?        ?   -94.5012  29.3720          ?        ?       25.1       12.6       ?       ? 
1 1 1   12    2   35 o    495.3    2.4    0.0000   0.0000          ?        ?  2453.2002  24.2638          ?        ?      495.3        2.4       ?       ? 
1 1 1   12    2   36 o   1688.8    5.5    0.0000   0.0000          ?        ? 28524.6758 186.4483          ?        ?     1688.8        5.5       ?       ? 
1 1 1   12    2   37 o    189.4    5.6    0.0000   0.0000          ?        ?   358.8492  21.0712          ?        ?      189.4        5.6       ?       ? 
1 1 1   12    2   38 o   1290.7    4.5    0.0000   0.0000          ?        ? 16661.5820 114.9339          ?        ?     1290.7        4.5       ?       ? 
1 1 1   12    2   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    2   40 f    494.5    2.9    0.0000   0.0000          ?        ?  2445.5378  28.7335          ?        ?      494.5        2.9       ?       ? 
1 1 1   12    2   41 o   1082.8    3.8    0.0000   0.0000          ?        ? 11725.1729  83.0078          ?        ?     1082.8        3.8       ?       ? 
1 1 1   12    2   42 o   1706.1    5.6    0.0000   0.0000          ?        ? 29113.3945 191.5565          ?        ?     1706.1        5.6       ?       ? 
1 1 1   12    2   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    2   44 o    902.4    3.4    0.0000   0.0000          ?        ?  8143.0664  60.6596          ?        ?      902.4        3.4       ?       ? 
1 1 1   12    2   45 o    817.8    3.2    0.0000   0.0000          ?        ?  6687.8755  51.7203          ?        ?      817.8        3.2       ?       ? 
1 1 1   12    2   46 o    802.2    3.2    0.0000   0.0000          ?        ?  6435.6597  51.0817          ?        ?      802.2        3.2       ?       ? 
1 1 1   12    2   47 f     47.3   18.7    0.0000   0.0000          ?        ?    12.1319  26.1794          ?        ?       47.3       18.7       ?       ? 
1 1 1   12    2   48 o   1178.5    4.1    0.0000   0.0000          ?        ? 13891.0381  96.4168          ?        ?     1178.5        4.1       ?       ? 
1 1 1   12    2   49 f     95.2   11.4    0.0000   0.0000          ?        ?    90.6701  21.7097          ?        ?       95.2       11.4       ?       ? 
1 1 1   12    2   50 o    378.2    3.1    0.0000   0.0000          ?        ?  1430.2885  23.6253          ?        ?      378.2        3.1       ?       ? 
1 1 1   12    2   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    2   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    2   53 o    538.5    2.6    0.0000   0.0000          ?        ?  2900.1653  28.0950          ?        ?      538.5        2.6       ?       ? 
1 1 1   12    2   54 o    514.6    2.7    0.0000   0.0000          ?        ?  2648.5876  28.0950          ?        ?      514.6        2.7       ?       ? 
1 1 1   12    2   55 o     22.1   11.0    0.0000   0.0000          ?        ?   -56.8284  20.4327          ?        ?       22.1       11.0       ?       ? 
1 1 1   12    2   56 o    189.7    5.0    0.0000   0.0000          ?        ?   360.1262  19.1556          ?        ?      189.7        5.0       ?       ? 
1 1 1   12    2   57 o    699.8    2.9    0.0000   0.0000          ?        ?  4898.7378  40.2269          ?        ?      699.8        2.9       ?       ? 
1 1 1   12    2   58 o     60.5   15.3    0.0000   0.0000          ?        ?    38.3113  18.5171          ?        ?       60.5       15.3       ?       ? 
1 1 1   12    2   59 o    121.9    7.9    0.0000   0.0000          ?        ?   148.7755  19.1556          ?        ?      121.9        7.9       ?       ? 
1 1 1   12    2   60 o     27.5   12.9    0.0000   0.0000          ?        ?   -18.5171  17.8786          ?        ?       27.5       12.9       ?       ? 
1 1 1   12    2   61 o     19.1    9.7    0.0000   0.0000          ?        ?   -65.7677  18.5171          ?        ?       19.1        9.7       ?       ? 
1 1 1   12    2   62 o    184.7    5.4    0.0000   0.0000          ?        ?   341.6091  19.7942          ?        ?      184.7        5.4       ?       ? 
1 1 1   12    2   63 o    296.1    3.5    0.0000   0.0000          ?        ?   877.3287  20.4327          ?        ?      296.1        3.5       ?       ? 
1 1 1   12    2   64 o    381.3    3.1    0.0000   0.0000          ?        ?  1454.5522  23.6253          ?        ?      381.3        3.1       ?       ? 
1 1 1   12    2   65 f     50.9   16.5    0.0000   0.0000          ?        ?    25.5409  19.1556          ?        ?       50.9       16.5       ?       ? 
1 1 1   12    2   66 o     51.1   16.8    0.0000   0.0000          ?        ?    25.5409  19.7942          ?        ?       51.1       16.8       ?       ? 
1 1 1   12    2   67 o    213.4    4.8    0.0000   0.0000          ?        ?   455.9044  20.4327          ?        ?      213.4        4.8       ?       ? 
1 1 1   12    2   68 o    149.5    6.8    0.0000   0.0000          ?        ?   224.1211  20.4327          ?        ?      149.5        6.8       ?       ? 
1 1 1   12    2   69 f    453.7    2.8    0.0000   0.0000          ?        ?  2059.8708  25.5409          ?        ?      453.7        2.8       ?       ? 
1 1 1   12    2   70 o    354.4    3.3    0.0000   0.0000          ?        ?  1256.6106  23.6253          ?        ?      354.4        3.3       ?       ? 
1 1 1   12    2   71 o    130.0    8.1    0.0000   0.0000          ?        ?   169.8468  21.0712          ?        ?      130.0        8.1       ?       ? 
1 1 1   12    2   72 o     51.5   17.3    0.0000   0.0000          ?        ?    25.5409  21.0712          ?        ?       51.5       17.3       ?       ? 
1 1 1   12    2   73 o    147.9    7.3    0.0000   0.0000          ?        ?   219.6514  21.7097          ?        ?      147.9        7.3       ?       ? 
1 1 1   12    2   74 o    128.2    8.5    0.0000   0.0000          ?        ?   165.3771  21.7097          ?        ?      128.2        8.5       ?       ? 
1 1 1   12    2   75 o     52.8   18.1    0.0000   0.0000          ?        ?    26.8179  22.9868          ?        ?       52.8       18.1       ?       ? 
1 1 1   12    2   76 o    206.0    5.4    0.0000   0.0000          ?        ?   425.8939  22.3483          ?        ?      206.0        5.4       ?       ? 
1 1 1   12    2   77 o     64.0   17.1    0.0000   0.0000          ?        ?    44.0580  22.3483          ?        ?       64.0       17.1       ?       ? 
1 1 1   12    2   78 o    209.8    4.9    0.0000   0.0000          ?        ?   441.8569  20.4327          ?        ?      209.8        4.9       ?       ? 
1 1 1   12    2   79 o    136.3    7.7    0.0000   0.0000          ?        ?   187.7254  21.0712          ?        ?      136.3        7.7       ?       ? 
1 1 1   12    2   80 o     52.5   16.7    0.0000   0.0000          ?        ?    28.7335  19.7942          ?        ?       52.5       16.7       ?       ? 
1 1 1   12    2   81 o    217.5    5.0    0.0000   0.0000          ?        ?   475.6986  21.7097          ?        ?      217.5        5.0       ?       ? 
1 1 1   12    3    0 o   2285.6   11.4 52254.0547 522.3107 52254.0547 522.3107 52254.0547 522.3107     2285.6     11.4     2285.6       11.4     0.0     0.0 
1 1 1   12    3    1 o   1570.3    5.2    0.0000   0.0000          ?        ? 24660.3438 162.1845          ?        ?     1570.3        5.2       ?       ? 
1 1 1   12    3    2 o   1155.2    3.9    0.0000   0.0000          ?        ? 13345.1016  90.0316          ?        ?     1155.2        3.9       ?       ? 
1 1 1   12    3    3 o   1316.8    4.4    0.0000   0.0000          ?        ? 17340.9707 114.9339          ?        ?     1316.8        4.4       ?       ? 
1 1 1   12    3    4 o    992.7    3.3    0.0000   0.0000          ?        ?  9854.3047  66.4062          ?        ?      992.7        3.3       ?       ? 
1 1 1   12    3    5 o    440.1    1.7    0.0000   0.0000          ?        ?  1937.2745  15.3245          ?        ?      440.1        1.7       ?       ? 
1 1 1   12    3    6 o    804.4    2.9    0.0000   0.0000          ?        ?  6470.7783  45.9736          ?        ?      804.4        2.9       ?       ? 
1 1 1   12    3    7 o   1813.5    5.9    0.0000   0.0000          ?        ? 32892.8008 212.6277          ?        ?     1813.5        5.9       ?       ? 
1 1 1   12    3    8 o   1008.1    3.4    0.0000   0.0000          ?        ? 10163.3486  68.9603          ?        ?     1008.1        3.4       ?       ? 
1 1 1   12    3    9 o   1876.5    6.1    0.0000   0.0000          ?        ? 35217.6602 227.3137          ?        ?     1876.5        6.1       ?       ? 
1 1 1   12    3   10 o    816.4    2.9    0.0000   0.0000          ?        ?  6664.8892  47.2506          ?        ?      816.4        2.9       ?       ? 
1 1 1   12    3   11 o    977.9    3.3    0.0000   0.0000          ?        ?  9562.5000  65.1292          ?        ?      977.9        3.3       ?       ? 
1 1 1   12    3   12 o   1217.9    4.1    0.0000   0.0000          ?        ? 14834.7734  98.9709          ?        ?     1217.9        4.1       ?       ? 
1 1 1   12    3   13 o   1322.6    4.5    0.0000   0.0000          ?        ? 17494.2168 118.1265          ?        ?     1322.6        4.5       ?       ? 
1 1 1   12    3   14 o   1439.0    4.8    0.0000   0.0000          ?        ? 20709.1719 139.1977          ?        ?     1439.0        4.8       ?       ? 
1 1 1   12    3   15 o   1415.6    4.7    0.0000   0.0000          ?        ? 20040.6406 132.1740          ?        ?     1415.6        4.7       ?       ? 
1 1 1   12    3   16 o    718.6    2.6    0.0000   0.0000          ?        ?  5164.3628  37.0343          ?        ?      718.6        2.6       ?       ? 
1 1 1   12    3   17 o    383.5    1.7    0.0000   0.0000          ?        ?  1470.5154  13.4090          ?        ?      383.5        1.7       ?       ? 
1 1 1   12    3   18 o    814.1    2.9    0.0000   0.0000          ?        ?  6627.8545  47.2506          ?        ?      814.1        2.9       ?       ? 
1 1 1   12    3   19 o    857.2    3.1    0.0000   0.0000          ?        ?  7347.4683  52.3588          ?        ?      857.2        3.1       ?       ? 
1 1 1   12    3   20 o    560.4    2.2    0.0000   0.0000          ?        ?  3140.2493  24.9023          ?        ?      560.4        2.2       ?       ? 
1 1 1   12    3   21 o    774.5    2.8    0.0000   0.0000          ?        ?  5998.9106  44.0580          ?        ?      774.5        2.8       ?       ? 
1 1 1   12    3   22 o   1662.8    5.7    0.0000   0.0000          ?        ? 27652.4570 190.2794          ?        ?     1662.8        5.7       ?       ? 
1 1 1   12    3   23 o   1059.2    3.7    0.0000   0.0000          ?        ? 11218.8252  78.5382          ?        ?     1059.2        3.7       ?       ? 
1 1 1   12    3   24 o    958.6    3.4    0.0000   0.0000          ?        ?  9189.6025  65.1292          ?        ?      958.6        3.4       ?       ? 
1 1 1   12    3   25 o    665.9    2.5    0.0000   0.0000          ?        ?  4434.5327  33.2031          ?        ?      665.9        2.5       ?       ? 
1 1 1   12    3   26 f    732.5    2.7    0.0000   0.0000          ?        ?  5366.1357  40.2269          ?        ?      732.5        2.7       ?       ? 
1 1 1   12    3   27 o    581.9    2.5    0.0000   0.0000          ?        ?  3386.7188  28.7335          ?        ?      581.9        2.5       ?       ? 
1 1 1   12    3   28 o   1238.8    4.5    0.0000   0.0000          ?        ? 15346.2285 110.4642          ?        ?     1238.8        4.5       ?       ? 
1 1 1   12    3   29 o   1146.8    4.0    0.0000   0.0000          ?        ? 13152.2686  92.5856          ?        ?     1146.8        4.0       ?       ? 
1 1 1   12    3   30 o   1067.7    4.1    0.0000   0.0000          ?        ? 11399.5273  86.8389          ?        ?     1067.7        4.1       ?       ? 
1 1 1   12    3   31 o   1121.7    4.6    0.0000   0.0000          ?        ? 12582.0684 103.4405          ?        ?     1121.7        4.6       ?       ? 
1 1 1   12    3   32 o   1435.9    5.2    0.0000   0.0000          ?        ? 20618.5020 148.1370          ?        ?     1435.9        5.2       ?       ? 
1 1 1   12    3   33 o    633.8    2.8    0.0000   0.0000          ?        ?  4016.9395  35.7572          ?        ?      633.8        2.8       ?       ? 
1 1 1   12    3   34 o    264.3    2.8    0.0000   0.0000          ?        ?   698.5427  14.6860          ?        ?      264.3        2.8       ?       ? 
1 1 1   12    3   35 o    812.4    3.2    0.0000   0.0000          ?        ?  6600.3979  51.7203          ?        ?      812.4        3.2       ?       ? 
1 1 1   12    3   36 o   1134.6    3.9    0.0000   0.0000          ?        ? 12874.5117  88.7545          ?        ?     1134.6        3.9       ?       ? 
1 1 1   12    3   37 o   1053.2    3.8    0.0000   0.0000          ?        ? 11093.6748  81.0922          ?        ?     1053.2        3.8       ?       ? 
1 1 1   12    3   38 o    908.0    3.3    0.0000   0.0000          ?        ?  8244.5908  60.0210          ?        ?      908.0        3.3       ?       ? 
1 1 1   12    3   39 o    613.2    3.0    0.0000   0.0000          ?        ?  3760.8923  37.0343          ?        ?      613.2        3.0       ?       ? 
1 1 1   12    3   40 o    848.7    3.2    0.0000   0.0000          ?        ?  7203.1621  54.9129          ?        ?      848.7        3.2       ?       ? 
1 1 1   12    3   41 o    926.5    3.4    0.0000   0.0000          ?        ?  8584.2852  62.5751          ?        ?      926.5        3.4       ?       ? 
1 1 1   12    3   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    3   43 f   1572.2    5.2    0.0000   0.0000          ?        ? 24722.9180 164.1001          ?        ?     1572.2        5.2       ?       ? 
1 1 1   12    3   44 f    766.4    3.0    0.0000   0.0000          ?        ?  5873.7607  45.3350          ?        ?      766.4        3.0       ?       ? 
1 1 1   12    3   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    3   46 o   2300.6    7.6    0.0000   0.0000          ?        ? 52953.2344 347.9943          ?        ?     2300.6        7.6       ?       ? 
1 1 1   12    3   47 o    517.8    2.9    0.0000   0.0000          ?        ?  2681.1523  30.0105          ?        ?      517.8        2.9       ?       ? 
1 1 1   12    3   48 o    634.7    2.8    0.0000   0.0000          ?        ?  4028.4331  35.7572          ?        ?      634.7        2.8       ?       ? 
1 1 1   12    3   49 o    512.6    2.7    0.0000   0.0000          ?        ?  2628.1550  27.4564          ?        ?      512.6        2.7       ?       ? 
1 1 1   12    3   50 o    277.0    3.8    0.0000   0.0000          ?        ?   767.5030  21.0712          ?        ?      277.0        3.8       ?       ? 
1 1 1   12    3   51 o    342.5    3.0    0.0000   0.0000          ?        ?  1172.9642  20.4327          ?        ?      342.5        3.0       ?       ? 
1 1 1   12    3   52 o    799.1    3.0    0.0000   0.0000          ?        ?  6385.8545  48.5276          ?        ?      799.1        3.0       ?       ? 
1 1 1   12    3   53 o    592.3    2.8    0.0000   0.0000          ?        ?  3508.6763  33.2031          ?        ?      592.3        2.8       ?       ? 
1 1 1   12    3   54 o     46.7   16.5    0.0000   0.0000          ?        ?    19.1556  19.1556          ?        ?       46.7       16.5       ?       ? 
1 1 1   12    3   55 o    413.6    2.9    0.0000   0.0000          ?        ?  1710.5994  23.6253          ?        ?      413.6        2.9       ?       ? 
1 1 1   12    3   56 f    490.3    2.7    0.0000   0.0000          ?        ?  2404.0339  26.8179          ?        ?      490.3        2.7       ?       ? 
1 1 1   12    3   57 o    138.3    7.2    0.0000   0.0000          ?        ?   191.5565  19.7942          ?        ?      138.3        7.2       ?       ? 
1 1 1   12    3   58 o    511.9    2.7    0.0000   0.0000          ?        ?  2621.1313  28.0950          ?        ?      511.9        2.7       ?       ? 
1 1 1   12    3   59 o     59.0   15.5    0.0000   0.0000          ?        ?    36.3957  18.5171          ?        ?       59.0       15.5       ?       ? 
1 1 1   12    3   60 o    259.5    4.1    0.0000   0.0000          ?        ?   673.6403  21.0712          ?        ?      259.5        4.1       ?       ? 
1 1 1   12    3   61 o     19.8   10.0    0.0000   0.0000          ?        ?   -69.5989  19.7942          ?        ?       19.8       10.0       ?       ? 
1 1 1   12    3   62 o    139.9    6.4    0.0000   0.0000          ?        ?   196.0261  17.8786          ?        ?      139.9        6.4       ?       ? 
1 1 1   12    3   63 o    197.1    4.9    0.0000   0.0000          ?        ?   388.8597  19.1556          ?        ?      197.1        4.9       ?       ? 
1 1 1   12    3   64 o    183.5    5.6    0.0000   0.0000          ?        ?   337.1394  20.4327          ?        ?      183.5        5.6       ?       ? 
1 1 1   12    3   65 o    280.5    3.6    0.0000   0.0000          ?        ?   787.2972  20.4327          ?        ?      280.5        3.6       ?       ? 
1 1 1   12    3   66 o     26.1   12.6    0.0000   0.0000          ?        ?   -33.8416  20.4327          ?        ?       26.1       12.6       ?       ? 
1 1 1   12    3   67 o    151.6    6.7    0.0000   0.0000          ?        ?   230.5063  20.4327          ?        ?      151.6        6.7       ?       ? 
1 1 1   12    3   68 o    313.7    3.5    0.0000   0.0000          ?        ?   984.6003  21.7097          ?        ?      313.7        3.5       ?       ? 
1 1 1   12    3   69 o    126.6    7.8    0.0000   0.0000          ?        ?   160.9075  19.7942          ?        ?      126.6        7.8       ?       ? 
1 1 1   12    3   70 o     22.6   11.3    0.0000   0.0000          ?        ?   -56.8284  21.0712          ?        ?       22.6       11.3       ?       ? 
1 1 1   12    3   71 o    161.3    6.7    0.0000   0.0000          ?        ?   261.1554  21.7097          ?        ?      161.3        6.7       ?       ? 
1 1 1   12    3   72 o    105.9   10.3    0.0000   0.0000          ?        ?   113.0183  21.7097          ?        ?      105.9       10.3       ?       ? 
1 1 1   12    3   73 o    268.5    4.2    0.0000   0.0000          ?        ?   722.1680  22.3483          ?        ?      268.5        4.2       ?       ? 
1 1 1   12    3   74 o    230.8    4.8    0.0000   0.0000          ?        ?   533.8041  22.3483          ?        ?      230.8        4.8       ?       ? 
1 1 1   12    3   75 o    143.4    7.3    0.0000   0.0000          ?        ?   206.8810  21.0712          ?        ?      143.4        7.3       ?       ? 
1 1 1   12    3   76 o     39.8   16.4    0.0000   0.0000          ?        ?     5.7467  21.0712          ?        ?       39.8       16.4       ?       ? 
1 1 1   12    3   77 o     97.0   11.5    0.0000   0.0000          ?        ?    95.7782  22.3483          ?        ?       97.0       11.5       ?       ? 
1 1 1   12    3   78 o     33.2   15.1    0.0000   0.0000          ?        ?   -11.4934  21.7097          ?        ?       33.2       15.1       ?       ? 
1 1 1   12    3   79 o     78.6   14.3    0.0000   0.0000          ?        ?    65.7677  21.7097          ?        ?       78.6       14.3       ?       ? 
1 1 1   12    3   80 o    129.2    8.7    0.0000   0.0000          ?        ?   169.2082  22.3483          ?        ?      129.2        8.7       ?       ? 
1 1 1   12    3   81 o    132.1    7.7    0.0000   0.0000          ?        ?   176.8705  20.4327          ?        ?      132.1        7.7       ?       ? 
1 1 1   12    4    0 o    373.4    2.3 1394.5312  17.2401  1394.5312  17.2401  1394.5312  17.2401      373.4      2.3      373.4        2.3     0.0     0.0 
1 1 1   12    4    1 o   1092.3    3.7    0.0000   0.0000          ?        ? 11931.4150  81.7308          ?        ?     1092.3        3.7       ?       ? 
1 1 1   12    4    2 o   1619.2    5.4    0.0000   0.0000          ?        ? 26220.8906 175.5934          ?        ?     1619.2        5.4       ?       ? 
1 1 1   12    4    3 o    481.3    1.9    0.0000   0.0000          ?        ?  2316.5564  18.5171          ?        ?      481.3        1.9       ?       ? 
1 1 1   12    4    4 o   1428.0    4.7    0.0000   0.0000          ?        ? 20394.3809 134.0895          ?        ?     1428.0        4.7       ?       ? 
1 1 1   12    4    5 f   1668.3    5.4    0.0000   0.0000          ?        ? 27834.4355 180.7016          ?        ?     1668.3        5.4       ?       ? 
1 1 1   12    4    6 o   1287.2    4.2    0.0000   0.0000          ?        ? 16569.6367 109.1872          ?        ?     1287.2        4.2       ?       ? 
1 1 1   12    4    7 o    303.1    1.5    0.0000   0.0000          ?        ?   918.8326   8.9393          ?        ?      303.1        1.5       ?       ? 
1 1 1   12    4    8 f    801.9    2.8    0.0000   0.0000          ?        ?  6429.9126  45.3350          ?        ?      801.9        2.8       ?       ? 
1 1 1   12    4    9 o    949.8    3.3    0.0000   0.0000          ?        ?  9021.6719  61.9366          ?        ?      949.8        3.3       ?       ? 
1 1 1   12    4   10 o   1445.8    4.7    0.0000   0.0000          ?        ? 20904.5586 134.7281          ?        ?     1445.8        4.7       ?       ? 
1 1 1   12    4   11 f    925.8    3.2    0.0000   0.0000          ?        ?  8572.1533  58.7440          ?        ?      925.8        3.2       ?       ? 
1 1 1   12    4   12 o    431.9    1.8    0.0000   0.0000          ?        ?  1865.7603  15.9630          ?        ?      431.9        1.8       ?       ? 
1 1 1   12    4   13 o   1229.0    4.1    0.0000   0.0000          ?        ? 15104.2295 100.8864          ?        ?     1229.0        4.1       ?       ? 
1 1 1   12    4   14 o   1033.7    3.6    0.0000   0.0000          ?        ? 10685.0215  73.4300          ?        ?     1033.7        3.6       ?       ? 
1 1 1   12    4   15 o    872.4    3.0    0.0000   0.0000          ?        ?  7610.5396  52.9973          ?        ?      872.4        3.0       ?       ? 
1 1 1   12    4   16 o    857.6    3.0    0.0000   0.0000          ?        ?  7354.4922  51.0817          ?        ?      857.6        3.0       ?       ? 
1 1 1   12    4   17 o    189.3    1.9    0.0000   0.0000          ?        ?   358.2106   7.0237          ?        ?      189.3        1.9       ?       ? 
1 1 1   12    4   18 o   1167.4    3.9    0.0000   0.0000          ?        ? 13628.6045  91.9471          ?        ?     1167.4        3.9       ?       ? 
1 1 1   12    4   19 o   1259.6    4.2    0.0000   0.0000          ?        ? 15867.9014 106.6331          ?        ?     1259.6        4.2       ?       ? 
1 1 1   12    4   20 o   1122.6    3.8    0.0000   0.0000          ?        ? 12603.1406  86.2004          ?        ?     1122.6        3.8       ?       ? 
1 1 1   12    4   21 o   1382.0    4.7    0.0000   0.0000          ?        ? 19102.6504 129.6199          ?        ?     1382.0        4.7       ?       ? 
1 1 1   12    4   22 o   1155.5    4.0    0.0000   0.0000          ?        ? 13352.1260  93.2242          ?        ?     1155.5        4.0       ?       ? 
1 1 1   12    4   23 o    936.6    3.3    0.0000   0.0000          ?        ?  8772.6484  61.9366          ?        ?      936.6        3.3       ?       ? 
1 1 1   12    4   24 f   1155.3    4.0    0.0000   0.0000          ?        ? 13348.2949  93.2242          ?        ?     1155.3        4.0       ?       ? 
1 1 1   12    4   25 o    395.5    2.3    0.0000   0.0000          ?        ?  1564.3779  18.5171          ?        ?      395.5        2.3       ?       ? 
1 1 1   12    4   26 o    710.3    2.7    0.0000   0.0000          ?        ?  5045.5981  38.3113          ?        ?      710.3        2.7       ?       ? 
1 1 1   12    4   27 o   1303.2    4.7    0.0000   0.0000          ?        ? 16984.0352 123.2347          ?        ?     1303.2        4.7       ?       ? 
1 1 1   12    4   28 o   1328.6    4.7    0.0000   0.0000          ?        ? 17653.2070 123.8732          ?        ?     1328.6        4.7       ?       ? 
1 1 1   12    4   29 o   1107.3    4.0    0.0000   0.0000          ?        ? 12260.8916  88.7545          ?        ?     1107.3        4.0       ?       ? 
1 1 1   12    4   30 o   1367.2    5.0    0.0000   0.0000          ?        ? 18693.9980 137.2822          ?        ?     1367.2        5.0       ?       ? 
1 1 1   12    4   31 o    340.3    2.6    0.0000   0.0000          ?        ?  1158.2782  17.8786          ?        ?      340.3        2.6       ?       ? 
1 1 1   12    4   32 o    800.9    3.1    0.0000   0.0000          ?        ?  6415.2271  49.1662          ?        ?      800.9        3.1       ?       ? 
1 1 1   12    4   33 o    234.7    3.7    0.0000   0.0000          ?        ?   551.0442  17.2401          ?        ?      234.7        3.7       ?       ? 
1 1 1   12    4   34 o   1668.7    5.5    0.0000   0.0000          ?        ? 27847.2070 183.2557          ?        ?     1668.7        5.5       ?       ? 
1 1 1   12    4   35 o   1566.6    5.5    0.0000   0.0000          ?        ? 24544.7715 171.7623          ?        ?     1566.6        5.5       ?       ? 
1 1 1   12    4   36 o   1512.5    5.2    0.0000   0.0000          ?        ? 22877.5898 158.3534          ?        ?     1512.5        5.2       ?       ? 
1 1 1   12    4   37 o   1240.3    4.2    0.0000   0.0000          ?        ? 15384.5391 104.7175          ?        ?     1240.3        4.2       ?       ? 
1 1 1   12    4   38 f   1303.3    4.6    0.0000   0.0000          ?        ? 16987.2285 119.4035          ?        ?     1303.3        4.6       ?       ? 
1 1 1   12    4   39 o    965.0    3.6    0.0000   0.0000          ?        ?  9312.8379  68.9603          ?        ?      965.0        3.6       ?       ? 
1 1 1   12    4   40 o    529.3    2.8    0.0000   0.0000          ?        ?  2801.1943  29.3720          ?        ?      529.3        2.8       ?       ? 
1 1 1   12    4   41 o    659.8    2.8    0.0000   0.0000          ?        ?  4353.4404  36.3957          ?        ?      659.8        2.8       ?       ? 
1 1 1   12    4   42 o    330.5    3.2    0.0000   0.0000          ?        ?  1092.5105  21.0712          ?        ?      330.5        3.2       ?       ? 
1 1 1   12    4   43 o    733.0    3.0    0.0000   0.0000          ?        ?  5372.5210  44.0580          ?        ?      733.0        3.0       ?       ? 
1 1 1   12    4   44 f    570.9    3.0    0.0000   0.0000          ?        ?  3259.6528  34.4802          ?        ?      570.9        3.0       ?       ? 
1 1 1   12    4   45 o    639.7    2.8    0.0000   0.0000          ?        ?  4092.2852  35.7572          ?        ?      639.7        2.8       ?       ? 
1 1 1   12    4   46 o    473.8    2.9    0.0000   0.0000          ?        ?  2245.0420  27.4564          ?        ?      473.8        2.9       ?       ? 
1 1 1   12    4   47 o    909.4    3.3    0.0000   0.0000          ?        ?  8271.4092  60.0210          ?        ?      909.4        3.3       ?       ? 
1 1 1   12    4   48 o    220.3    4.8    0.0000   0.0000          ?        ?   485.2764  21.0712          ?        ?      220.3        4.8       ?       ? 
1 1 1   12    4   49 o    251.4    4.1    0.0000   0.0000          ?        ?   632.1364  20.4327          ?        ?      251.4        4.1       ?       ? 
1 1 1   12    4   50 o    395.6    3.0    0.0000   0.0000          ?        ?  1565.0166  23.6253          ?        ?      395.6        3.0       ?       ? 
1 1 1   12    4   51 o    410.7    3.0    0.0000   0.0000          ?        ?  1686.9742  24.9023          ?        ?      410.7        3.0       ?       ? 
1 1 1   12    4   52 o    308.6    3.2    0.0000   0.0000          ?        ?   952.6743  19.7942          ?        ?      308.6        3.2       ?       ? 
1 1 1   12    4   53 f    383.1    3.0    0.0000   0.0000          ?        ?  1467.9612  22.9868          ?        ?      383.1        3.0       ?       ? 
1 1 1   12    4   54 f    201.6    4.8    0.0000   0.0000          ?        ?   406.7383  19.1556          ?        ?      201.6        4.8       ?       ? 
1 1 1   12    4   55 o    366.7    3.0    0.0000   0.0000          ?        ?  1344.7266  22.3483          ?        ?      366.7        3.0       ?       ? 
1 1 1   12    4   56 o    438.8    2.7    0.0000   0.0000          ?        ?  1925.7812  23.6253          ?        ?      438.8        2.7       ?       ? 
1 1 1   12    4   57 o    483.1    2.9    0.0000   0.0000          ?        ?  2334.4351  28.0950          ?        ?      483.1        2.9       ?       ? 
1 1 1   12    4   58 o    542.5    2.7    0.0000   0.0000          ?        ?  2944.2231  29.3720          ?        ?      542.5        2.7       ?       ? 
1 1 1   12    4   59 o    328.0    3.2    0.0000   0.0000          ?        ?  1075.9089  21.0712          ?        ?      328.0        3.2       ?       ? 
1 1 1   12    4   60 o    340.6    3.3    0.0000   0.0000          ?        ?  1160.8323  22.3483          ?        ?      340.6        3.3       ?       ? 
1 1 1   12    4   61 o    244.7    4.2    0.0000   0.0000          ?        ?   598.9333  20.4327          ?        ?      244.7        4.2       ?       ? 
1 1 1   12    4   62 o    212.5    4.8    0.0000   0.0000          ?        ?   452.0733  20.4327          ?        ?      212.5        4.8       ?       ? 
1 1 1   12    4   63 f    377.2    3.1    0.0000   0.0000          ?        ?  1423.2646  23.6253          ?        ?      377.2        3.1       ?       ? 
1 1 1   12    4   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    4   65 o    445.9    2.9    0.0000   0.0000          ?        ?  1988.9949  25.5409          ?        ?      445.9        2.9       ?       ? 
1 1 1   12    4   66 o     88.6   11.5    0.0000   0.0000          ?        ?    79.1767  20.4327          ?        ?       88.6       11.5       ?       ? 
1 1 1   12    4   67 o    408.3    3.0    0.0000   0.0000          ?        ?  1667.8186  24.9023          ?        ?      408.3        3.0       ?       ? 
1 1 1   12    4   68 o    138.4    7.6    0.0000   0.0000          ?        ?   192.1950  21.0712          ?        ?      138.4        7.6       ?       ? 
1 1 1   12    4   69 o    129.8    8.4    0.0000   0.0000          ?        ?   169.2082  21.7097          ?        ?      129.8        8.4       ?       ? 
1 1 1   12    4   70 o    205.1    5.3    0.0000   0.0000          ?        ?   421.4243  21.7097          ?        ?      205.1        5.3       ?       ? 
1 1 1   12    4   71 o    368.4    3.3    0.0000   0.0000          ?        ?  1358.1355  24.2638          ?        ?      368.4        3.3       ?       ? 
1 1 1   12    4   72 o    138.5    8.1    0.0000   0.0000          ?        ?   192.8335  22.3483          ?        ?      138.5        8.1       ?       ? 
1 1 1   12    4   73 o     51.3   18.0    0.0000   0.0000          ?        ?    24.2638  22.9868          ?        ?       51.3       18.0       ?       ? 
1 1 1   12    4   74 o     91.2   11.9    0.0000   0.0000          ?        ?    84.2849  21.7097          ?        ?       91.2       11.9       ?       ? 
1 1 1   12    4   75 o     31.3   14.5    0.0000   0.0000          ?        ?   -17.8786  21.7097          ?        ?       31.3       14.5       ?       ? 
1 1 1   12    4   76 o    148.3    7.5    0.0000   0.0000          ?        ?   221.5670  22.3483          ?        ?      148.3        7.5       ?       ? 
1 1 1   12    4   77 o    185.1    5.7    0.0000   0.0000          ?        ?   344.1632  21.0712          ?        ?      185.1        5.7       ?       ? 
1 1 1   12    4   78 o     89.8   12.1    0.0000   0.0000          ?        ?    82.3693  21.7097          ?        ?       89.8       12.1       ?       ? 
1 1 1   12    4   79 o     37.2   15.9    0.0000   0.0000          ?        ?     0.6385  21.0712          ?        ?       37.2       15.9       ?       ? 
1 1 1   12    4   80 o     79.2   12.1    0.0000   0.0000          ?        ?    64.4907  19.1556          ?        ?       79.2       12.1       ?       ? 
1 1 1   12    5    0 o    434.8    2.4 1890.6626  21.0712  1890.6626  21.0712  1890.6626  21.0712      434.8      2.4      434.8        2.4     0.0     0.0 
1 1 1   12    5    1 o    592.2    2.2    0.0000   0.0000          ?        ?  3507.3992  25.5409          ?        ?      592.2        2.2       ?       ? 
1 1 1   12    5    2 f   1227.1    4.1    0.0000   0.0000          ?        ? 15057.6162  99.6094          ?        ?     1227.1        4.1       ?       ? 
1 1 1   12    5    3 o   1001.4    3.4    0.0000   0.0000          ?        ? 10028.6201  68.3218          ?        ?     1001.4        3.4       ?       ? 
1 1 1   12    5    4 o    653.2    2.4    0.0000   0.0000          ?        ?  4267.2397  31.2876          ?        ?      653.2        2.4       ?       ? 
1 1 1   12    5    5 o   2166.1    7.5    0.0000   0.0000          ?        ? 46927.5078 323.0919          ?        ?     2166.1        7.5       ?       ? 
1 1 1   12    5    6 o   1236.9    4.1    0.0000   0.0000          ?        ? 15299.6172 101.5249          ?        ?     1236.9        4.1       ?       ? 
1 1 1   12    5    7 f   1938.7    6.3    0.0000   0.0000          ?        ? 37591.6836 243.9153          ?        ?     1938.7        6.3       ?       ? 
1 1 1   12    5    8 o    869.0    3.0    0.0000   0.0000          ?        ?  7552.4341  51.7203          ?        ?      869.0        3.0       ?       ? 
1 1 1   12    5    9 o    915.3    3.2    0.0000   0.0000          ?        ?  8377.4033  58.1055          ?        ?      915.3        3.2       ?       ? 
1 1 1   12    5   10 o   1478.5    4.9    0.0000   0.0000          ?        ? 21860.4277 146.2215          ?        ?     1478.5        4.9       ?       ? 
1 1 1   12    5   11 o    888.8    3.1    0.0000   0.0000          ?        ?  7899.7891  55.5514          ?        ?      888.8        3.1       ?       ? 
1 1 1   12    5   12 o    599.9    2.2    0.0000   0.0000          ?        ?  3599.3464  26.8179          ?        ?      599.9        2.2       ?       ? 
1 1 1   12    5   13 o   1327.9    4.4    0.0000   0.0000          ?        ? 17635.3281 118.1265          ?        ?     1327.9        4.4       ?       ? 
1 1 1   12    5   14 o    983.1    3.4    0.0000   0.0000          ?        ?  9665.9404  66.4062          ?        ?      983.1        3.4       ?       ? 
1 1 1   12    5   15 o    662.3    2.4    0.0000   0.0000          ?        ?  4386.0054  31.9261          ?        ?      662.3        2.4       ?       ? 
1 1 1   12    5   16 o   1174.2    4.1    0.0000   0.0000          ?        ? 13788.2354  95.1397          ?        ?     1174.2        4.1       ?       ? 
1 1 1   12    5   17 o   1306.4    4.3    0.0000   0.0000          ?        ? 17068.9590 113.6568          ?        ?     1306.4        4.3       ?       ? 
1 1 1   12    5   18 o   1394.7    4.6    0.0000   0.0000          ?        ? 19454.4766 129.6199          ?        ?     1394.7        4.6       ?       ? 
1 1 1   12    5   19 o    724.6    2.6    0.0000   0.0000          ?        ?  5251.2021  38.3113          ?        ?      724.6        2.6       ?       ? 
1 1 1   12    5   20 o    792.2    2.9    0.0000   0.0000          ?        ?  6275.3906  45.9736          ?        ?      792.2        2.9       ?       ? 
1 1 1   12    5   21 o    772.8    2.8    0.0000   0.0000          ?        ?  5972.0928  42.7809          ?        ?      772.8        2.8       ?       ? 
1 1 1   12    5   22 o   1640.3    5.4    0.0000   0.0000          ?        ? 26910.4941 177.5090          ?        ?     1640.3        5.4       ?       ? 
1 1 1   12    5   23 o    433.5    1.9    0.0000   0.0000          ?        ?  1879.1691  16.6016          ?        ?      433.5        1.9       ?       ? 
1 1 1   12    5   24 o    637.8    2.5    0.0000   0.0000          ?        ?  4068.0212  31.2876          ?        ?      637.8        2.5       ?       ? 
1 1 1   12    5   25 o    702.5    2.6    0.0000   0.0000          ?        ?  4935.7720  36.3957          ?        ?      702.5        2.6       ?       ? 
1 1 1   12    5   26 o    358.5    2.4    0.0000   0.0000          ?        ?  1285.3440  17.2401          ?        ?      358.5        2.4       ?       ? 
1 1 1   12    5   27 f    993.4    3.6    0.0000   0.0000          ?        ?  9869.6289  72.1529          ?        ?      993.4        3.6       ?       ? 
1 1 1   12    5   28 o   1371.0    4.7    0.0000   0.0000          ?        ? 18797.4375 127.7043          ?        ?     1371.0        4.7       ?       ? 
1 1 1   12    5   29 o    960.4    3.7    0.0000   0.0000          ?        ?  9223.4453  70.2374          ?        ?      960.4        3.7       ?       ? 
1 1 1   12    5   30 o   1408.8    4.8    0.0000   0.0000          ?        ? 19849.0840 136.0051          ?        ?     1408.8        4.8       ?       ? 
1 1 1   12    5   31 o   1349.0    4.9    0.0000   0.0000          ?        ? 18199.1426 131.5355          ?        ?     1349.0        4.9       ?       ? 
1 1 1   12    5   32 o    342.9    2.7    0.0000   0.0000          ?        ?  1175.5183  18.5171          ?        ?      342.9        2.7       ?       ? 
1 1 1   12    5   33 o    787.9    3.2    0.0000   0.0000          ?        ?  6208.3457  49.8047          ?        ?      787.9        3.2       ?       ? 
1 1 1   12    5   34 o    640.9    2.7    0.0000   0.0000          ?        ?  4107.6094  34.4802          ?        ?      640.9        2.7       ?       ? 
1 1 1   12    5   35 o   1651.5    5.6    0.0000   0.0000          ?        ? 27278.2832 185.1713          ?        ?     1651.5        5.6       ?       ? 
1 1 1   12    5   36 o   1086.9    3.8    0.0000   0.0000          ?        ? 11813.9268  83.0078          ?        ?     1086.9        3.8       ?       ? 
1 1 1   12    5   37 o   2172.5    7.0    0.0000   0.0000          ?        ? 47208.4570 303.9363          ?        ?     2172.5        7.0       ?       ? 
1 1 1   12    5   38 o    511.6    2.6    0.0000   0.0000          ?        ?  2617.3000  26.8179          ?        ?      511.6        2.6       ?       ? 
1 1 1   12    5   39 o    714.4    3.2    0.0000   0.0000          ?        ?  5103.7031  45.3350          ?        ?      714.4        3.2       ?       ? 
1 1 1   12    5   40 o    360.5    3.0    0.0000   0.0000          ?        ?  1299.3915  21.7097          ?        ?      360.5        3.0       ?       ? 
1 1 1   12    5   41 o    785.3    3.1    0.0000   0.0000          ?        ?  6166.8418  48.5276          ?        ?      785.3        3.1       ?       ? 
1 1 1   12    5   42 o    649.6    2.8    0.0000   0.0000          ?        ?  4219.9897  35.7572          ?        ?      649.6        2.8       ?       ? 
1 1 1   12    5   43 o    234.1    4.0    0.0000   0.0000          ?        ?   547.8516  18.5171          ?        ?      234.1        4.0       ?       ? 
1 1 1   12    5   44 o    614.2    2.8    0.0000   0.0000          ?        ?  3772.3857  33.8416          ?        ?      614.2        2.8       ?       ? 
1 1 1   12    5   45 o   1098.0    3.9    0.0000   0.0000          ?        ? 12057.8428  86.2004          ?        ?     1098.0        3.9       ?       ? 
1 1 1   12    5   46 o    116.6    8.8    0.0000   0.0000          ?        ?   136.0051  20.4327          ?        ?      116.6        8.8       ?       ? 
1 1 1   12    5   47 o    433.9    2.9    0.0000   0.0000          ?        ?  1883.0002  25.5409          ?        ?      433.9        2.9       ?       ? 
1 1 1   12    5   48 o    552.9    2.8    0.0000   0.0000          ?        ?  3057.2415  30.6490          ?        ?      552.9        2.8       ?       ? 
1 1 1   12    5   49 o   1369.7    4.7    0.0000   0.0000          ?        ? 18766.7891 129.6199          ?        ?     1369.7        4.7       ?       ? 
1 1 1   12    5   50 o    174.7    6.2    0.0000   0.0000          ?        ?   305.2133  21.7097          ?        ?      174.7        6.2       ?       ? 
1 1 1   12    5   51 o   1238.5    4.3    0.0000   0.0000          ?        ? 15343.0352 105.3561          ?        ?     1238.5        4.3       ?       ? 
1 1 1   12    5   52 o    496.5    2.7    0.0000   0.0000          ?        ?  2465.3320  26.8179          ?        ?      496.5        2.7       ?       ? 
1 1 1   12    5   53 o    280.2    3.5    0.0000   0.0000          ?        ?   785.3816  19.7942          ?        ?      280.2        3.5       ?       ? 
1 1 1   12    5   54 o     49.0   15.6    0.0000   0.0000          ?        ?    23.6253  17.2401          ?        ?       49.0       15.6       ?       ? 
1 1 1   12    5   55 o    410.0    3.0    0.0000   0.0000          ?        ?  1681.2274  24.2638          ?        ?      410.0        3.0       ?       ? 
1 1 1   12    5   56 o    430.9    2.8    0.0000   0.0000          ?        ?  1856.8208  24.2638          ?        ?      430.9        2.8       ?       ? 
1 1 1   12    5   57 o    131.9    7.0    0.0000   0.0000          ?        ?   174.3164  18.5171          ?        ?      131.9        7.0       ?       ? 
1 1 1   12    5   58 o    616.9    2.7    0.0000   0.0000          ?        ?  3806.2273  33.2031          ?        ?      616.9        2.7       ?       ? 
1 1 1   12    5   59 o     81.3   12.6    0.0000   0.0000          ?        ?    66.4062  20.4327          ?        ?       81.3       12.6       ?       ? 
1 1 1   12    5   60 o    428.8    2.8    0.0000   0.0000          ?        ?  1838.9423  23.6253          ?        ?      428.8        2.8       ?       ? 
1 1 1   12    5   61 o    299.1    3.4    0.0000   0.0000          ?        ?   895.2073  20.4327          ?        ?      299.1        3.4       ?       ? 
1 1 1   12    5   62 o    266.4    3.8    0.0000   0.0000          ?        ?   710.0360  20.4327          ?        ?      266.4        3.8       ?       ? 
1 1 1   12    5   63 o     25.1   12.2    0.0000   0.0000          ?        ?   -32.5646  19.1556          ?        ?       25.1       12.2       ?       ? 
1 1 1   12    5   64 o    146.5    6.8    0.0000   0.0000          ?        ?   215.1818  19.7942          ?        ?      146.5        6.8       ?       ? 
1 1 1   12    5   65 o    277.6    3.8    0.0000   0.0000          ?        ?   771.3342  21.0712          ?        ?      277.6        3.8       ?       ? 
1 1 1   12    5   66 o    373.1    3.2    0.0000   0.0000          ?        ?  1392.6157  23.6253          ?        ?      373.1        3.2       ?       ? 
1 1 1   12    5   67 o     23.4   11.5    0.0000   0.0000          ?        ?   -44.6965  19.7942          ?        ?       23.4       11.5       ?       ? 
1 1 1   12    5   68 o    126.8    8.3    0.0000   0.0000          ?        ?   161.5460  21.0712          ?        ?      126.8        8.3       ?       ? 
1 1 1   12    5   69 o    218.5    5.1    0.0000   0.0000          ?        ?   478.2527  22.3483          ?        ?      218.5        5.1       ?       ? 
1 1 1   12    5   70 o     34.4   15.4    0.0000   0.0000          ?        ?    -8.9393  21.7097          ?        ?       34.4       15.4       ?       ? 
1 1 1   12    5   71 o     22.8   11.3    0.0000   0.0000          ?        ?   -51.7203  20.4327          ?        ?       22.8       11.3       ?       ? 
1 1 1   12    5   72 o    119.7    9.1    0.0000   0.0000          ?        ?   144.3059  21.7097          ?        ?      119.7        9.1       ?       ? 
1 1 1   12    5   73 o    155.8    6.8    0.0000   0.0000          ?        ?   243.9153  21.0712          ?        ?      155.8        6.8       ?       ? 
1 1 1   12    5   74 o    440.9    3.1    0.0000   0.0000          ?        ?  1946.2139  27.4564          ?        ?      440.9        3.1       ?       ? 
1 1 1   12    5   75 o    278.4    4.1    0.0000   0.0000          ?        ?   776.4423  22.9868          ?        ?      278.4        4.1       ?       ? 
1 1 1   12    5   76 o    125.8    8.6    0.0000   0.0000          ?        ?   159.6304  21.7097          ?        ?      125.8        8.6       ?       ? 
1 1 1   12    5   77 o    188.2    5.4    0.0000   0.0000          ?        ?   355.6566  20.4327          ?        ?      188.2        5.4       ?       ? 
1 1 1   12    5   78 o    165.1    7.0    0.0000   0.0000          ?        ?   274.5643  22.9868          ?        ?      165.1        7.0       ?       ? 
1 1 1   12    5   79 o    125.1    8.4    0.0000   0.0000          ?        ?   158.3534  21.0712          ?        ?      125.1        8.4       ?       ? 
1 1 1   12    5   80 o    139.8    8.0    0.0000   0.0000          ?        ?   197.9417  22.3483          ?        ?      139.8        8.0       ?       ? 
1 1 1   12    6    0 o   1976.7    9.9 39081.9961 392.6908 39081.9961 392.6908 39081.9961 392.6908     1976.7      9.9     1976.7        9.9     0.0     0.0 
1 1 1   12    6    1 o   1337.9    4.6    0.0000   0.0000          ?        ? 17900.3145 123.8732          ?        ?     1337.9        4.6       ?       ? 
1 1 1   12    6    2 o   1357.2    4.7    0.0000   0.0000          ?        ? 18421.9883 127.7043          ?        ?     1357.2        4.7       ?       ? 
1 1 1   12    6    3 o   1256.5    4.4    0.0000   0.0000          ?        ? 15788.0859 109.8257          ?        ?     1256.5        4.4       ?       ? 
1 1 1   12    6    4 o    289.2    1.4    0.0000   0.0000          ?        ?   836.4633   8.3008          ?        ?      289.2        1.4       ?       ? 
1 1 1   12    6    5 o    408.2    1.8    0.0000   0.0000          ?        ?  1665.9028  14.6860          ?        ?      408.2        1.8       ?       ? 
1 1 1   12    6    6 o    505.8    2.1    0.0000   0.0000          ?        ?  2557.9177  21.0712          ?        ?      505.8        2.1       ?       ? 
1 1 1   12    6    7 o    956.7    3.3    0.0000   0.0000          ?        ?  9153.2070  62.5751          ?        ?      956.7        3.3       ?       ? 
1 1 1   12    6    8 o    796.8    2.8    0.0000   0.0000          ?        ?  6349.4590  44.0580          ?        ?      796.8        2.8       ?       ? 
1 1 1   12    6    9 o    999.3    3.5    0.0000   0.0000          ?        ?  9985.8398  68.9603          ?        ?      999.3        3.5       ?       ? 
1 1 1   12    6   10 o    299.7    1.5    0.0000   0.0000          ?        ?   898.3999   8.9393          ?        ?      299.7        1.5       ?       ? 
1 1 1   12    6   11 o    223.7    1.4    0.0000   0.0000          ?        ?   500.6010   6.3852          ?        ?      223.7        1.4       ?       ? 
1 1 1   12    6   12 o    688.2    2.5    0.0000   0.0000          ?        ?  4736.5532  33.8416          ?        ?      688.2        2.5       ?       ? 
1 1 1   12    6   13 o   2374.5    7.8    0.0000   0.0000          ?        ? 56397.4219 369.7040          ?        ?     2374.5        7.8       ?       ? 
1 1 1   12    6   14 o    442.3    1.9    0.0000   0.0000          ?        ?  1956.4302  16.6016          ?        ?      442.3        1.9       ?       ? 
1 1 1   12    6   15 o    878.6    3.1    0.0000   0.0000          ?        ?  7720.3647  54.2743          ?        ?      878.6        3.1       ?       ? 
1 1 1   12    6   16 f    949.4    3.3    0.0000   0.0000          ?        ?  9014.0098  62.5751          ?        ?      949.4        3.3       ?       ? 
1 1 1   12    6   17 o    859.6    3.0    0.0000   0.0000          ?        ?  7390.2495  52.3588          ?        ?      859.6        3.0       ?       ? 
1 1 1   12    6   18 o    350.9    1.7    0.0000   0.0000          ?        ?  1231.0697  12.1319          ?        ?      350.9        1.7       ?       ? 
1 1 1   12    6   19 o    566.1    2.2    0.0000   0.0000          ?        ?  3204.7400  24.9023          ?        ?      566.1        2.2       ?       ? 
1 1 1   12    6   20 o    463.0    2.0    0.0000   0.0000          ?        ?  2144.1555  18.5171          ?        ?      463.0        2.0       ?       ? 
1 1 1   12    6   21 o    940.5    3.3    0.0000   0.0000          ?        ?  8846.7168  61.9366          ?        ?      940.5        3.3       ?       ? 
1 1 1   12    6   22 o    663.4    2.5    0.0000   0.0000          ?        ?  4400.6909  33.2031          ?        ?      663.4        2.5       ?       ? 
1 1 1   12    6   23 o    973.2    3.4    0.0000   0.0000          ?        ?  9471.8301  67.0448          ?        ?      973.2        3.4       ?       ? 
1 1 1   12    6   24 o    282.2    2.0    0.0000   0.0000          ?        ?   796.2365  11.4934          ?        ?      282.2        2.0       ?       ? 
1 1 1   12    6   25 o    978.3    3.5    0.0000   0.0000          ?        ?  9571.4395  67.6833          ?        ?      978.3        3.5       ?       ? 
1 1 1   12    6   26 o    113.3    4.5    0.0000   0.0000          ?        ?   128.3428  10.2163          ?        ?      113.3        4.5       ?       ? 
1 1 1   12    6   27 o    572.2    2.5    0.0000   0.0000          ?        ?  3273.7004  28.0950          ?        ?      572.2        2.5       ?       ? 
1 1 1   12    6   28 o   1489.5    5.1    0.0000   0.0000          ?        ? 22186.7109 151.3296          ?        ?     1489.5        5.1       ?       ? 
1 1 1   12    6   29 o    541.2    2.5    0.0000   0.0000          ?        ?  2929.5371  26.8179          ?        ?      541.2        2.5       ?       ? 
1 1 1   12    6   30 o     97.2    8.9    0.0000   0.0000          ?        ?    94.5012  17.2401          ?        ?       97.2        8.9       ?       ? 
1 1 1   12    6   31 o    781.9    3.2    0.0000   0.0000          ?        ?  6113.8447  50.4432          ?        ?      781.9        3.2       ?       ? 
1 1 1   12    6   32 o    964.8    3.4    0.0000   0.0000          ?        ?  9308.3682  66.4062          ?        ?      964.8        3.4       ?       ? 
1 1 1   12    6   33 o    716.8    3.0    0.0000   0.0000          ?        ?  5138.8218  42.7809          ?        ?      716.8        3.0       ?       ? 
1 1 1   12    6   34 o   1264.2    4.5    0.0000   0.0000          ?        ? 15982.1963 114.2954          ?        ?     1264.2        4.5       ?       ? 
1 1 1   12    6   35 o   1526.4    5.3    0.0000   0.0000          ?        ? 23302.2070 161.5460          ?        ?     1526.4        5.3       ?       ? 
1 1 1   12    6   36 o    994.4    3.5    0.0000   0.0000          ?        ?  9888.7842  70.2374          ?        ?      994.4        3.5       ?       ? 
1 1 1   12    6   37 o   1184.3    4.3    0.0000   0.0000          ?        ? 14026.4043 101.5249          ?        ?     1184.3        4.3       ?       ? 
1 1 1   12    6   38 o   1036.0    3.6    0.0000   0.0000          ?        ? 10734.1865  75.3456          ?        ?     1036.0        3.6       ?       ? 
1 1 1   12    6   39 o   1747.7    5.8    0.0000   0.0000          ?        ? 30548.7891 201.1343          ?        ?     1747.7        5.8       ?       ? 
1 1 1   12    6   40 f   1097.6    4.0    0.0000   0.0000          ?        ? 12047.6260  88.7545          ?        ?     1097.6        4.0       ?       ? 
1 1 1   12    6   41 o   1433.0    4.8    0.0000   0.0000          ?        ? 20537.4082 137.2822          ?        ?     1433.0        4.8       ?       ? 
1 1 1   12    6   42 o    500.0    2.9    0.0000   0.0000          ?        ?  2500.4507  29.3720          ?        ?      500.0        2.9       ?       ? 
1 1 1   12    6   43 o    530.8    2.7    0.0000   0.0000          ?        ?  2817.7959  28.7335          ?        ?      530.8        2.7       ?       ? 
1 1 1   12    6   44 o   1472.5    5.0    0.0000   0.0000          ?        ? 21685.4707 146.2215          ?        ?     1472.5        5.0       ?       ? 
1 1 1   12    6   45 o    471.3    3.0    0.0000   0.0000          ?        ?  2221.4167  28.0950          ?        ?      471.3        3.0       ?       ? 
1 1 1   12    6   46 o    466.9    2.7    0.0000   0.0000          ?        ?  2179.9128  25.5409          ?        ?      466.9        2.7       ?       ? 
1 1 1   12    6   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    6   48 o    879.4    3.3    0.0000   0.0000          ?        ?  7734.4126  57.4669          ?        ?      879.4        3.3       ?       ? 
1 1 1   12    6   49 o    761.8    3.1    0.0000   0.0000          ?        ?  5803.5234  47.2506          ?        ?      761.8        3.1       ?       ? 
1 1 1   12    6   50 o    589.0    2.7    0.0000   0.0000          ?        ?  3469.7266  31.9261          ?        ?      589.0        2.7       ?       ? 
1 1 1   12    6   51 o    519.2    2.8    0.0000   0.0000          ?        ?  2696.4768  29.3720          ?        ?      519.2        2.8       ?       ? 
1 1 1   12    6   52 o    370.1    2.9    0.0000   0.0000          ?        ?  1370.2675  21.7097          ?        ?      370.1        2.9       ?       ? 
1 1 1   12    6   53 o    222.4    4.3    0.0000   0.0000          ?        ?   494.8542  19.1556          ?        ?      222.4        4.3       ?       ? 
1 1 1   12    6   54 o    203.4    4.6    0.0000   0.0000          ?        ?   413.7620  18.5171          ?        ?      203.4        4.6       ?       ? 
1 1 1   12    6   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    6   56 o    181.1    5.5    0.0000   0.0000          ?        ?   328.2001  19.7942          ?        ?      181.1        5.5       ?       ? 
1 1 1   12    6   57 o    323.7    3.3    0.0000   0.0000          ?        ?  1048.4525  21.0712          ?        ?      323.7        3.3       ?       ? 
1 1 1   12    6   58 o    554.4    2.8    0.0000   0.0000          ?        ?  3073.8430  31.2876          ?        ?      554.4        2.8       ?       ? 
1 1 1   12    6   59 o    255.2    4.4    0.0000   0.0000          ?        ?   651.9305  22.3483          ?        ?      255.2        4.4       ?       ? 
1 1 1   12    6   60 o     42.4   16.6    0.0000   0.0000          ?        ?    10.8549  20.4327          ?        ?       42.4       16.6       ?       ? 
1 1 1   12    6   61 o    451.7    2.9    0.0000   0.0000          ?        ?  2040.7152  26.1794          ?        ?      451.7        2.9       ?       ? 
1 1 1   12    6   62 o    219.8    4.6    0.0000   0.0000          ?        ?   483.3608  20.4327          ?        ?      219.8        4.6       ?       ? 
1 1 1   12    6   63 f    424.9    2.9    0.0000   0.0000          ?        ?  1806.3777  24.2638          ?        ?      424.9        2.9       ?       ? 
1 1 1   12    6   64 o    493.1    2.8    0.0000   0.0000          ?        ?  2432.1289  27.4564          ?        ?      493.1        2.8       ?       ? 
1 1 1   12    6   65 o    148.0    6.7    0.0000   0.0000          ?        ?   219.6514  19.7942          ?        ?      148.0        6.7       ?       ? 
1 1 1   12    6   66 o    304.7    3.5    0.0000   0.0000          ?        ?   929.0490  21.0712          ?        ?      304.7        3.5       ?       ? 
1 1 1   12    6   67 o    146.0    7.7    0.0000   0.0000          ?        ?   213.9047  22.3483          ?        ?      146.0        7.7       ?       ? 
1 1 1   12    6   68 o    459.0    2.9    0.0000   0.0000          ?        ?  2108.3984  26.8179          ?        ?      459.0        2.9       ?       ? 
1 1 1   12    6   69 o    264.4    4.2    0.0000   0.0000          ?        ?   699.8197  22.3483          ?        ?      264.4        4.2       ?       ? 
1 1 1   12    6   70 o     98.4   11.0    0.0000   0.0000          ?        ?    97.6938  21.7097          ?        ?       98.4       11.0       ?       ? 
1 1 1   12    6   71 o    260.1    4.4    0.0000   0.0000          ?        ?   677.4714  22.9868          ?        ?      260.1        4.4       ?       ? 
1 1 1   12    6   72 o    227.0    5.1    0.0000   0.0000          ?        ?   516.5640  22.9868          ?        ?      227.0        5.1       ?       ? 
1 1 1   12    6   73 o    475.8    3.0    0.0000   0.0000          ?        ?  2266.1133  28.7335          ?        ?      475.8        3.0       ?       ? 
1 1 1   12    6   74 o    265.7    4.3    0.0000   0.0000          ?        ?   707.4820  22.9868          ?        ?      265.7        4.3       ?       ? 
1 1 1   12    6   75 o    136.0    8.5    0.0000   0.0000          ?        ?   186.4483  22.9868          ?        ?      136.0        8.5       ?       ? 
1 1 1   12    6   76 o    152.6    6.9    0.0000   0.0000          ?        ?   234.3374  21.0712          ?        ?      152.6        6.9       ?       ? 
1 1 1   12    6   77 o     44.0   16.6    0.0000   0.0000          ?        ?    15.3245  19.7942          ?        ?       44.0       16.6       ?       ? 
1 1 1   12    6   78 o    144.1    7.3    0.0000   0.0000          ?        ?   209.4351  21.0712          ?        ?      144.1        7.3       ?       ? 
1 1 1   12    6   79 o    117.8    8.4    0.0000   0.0000          ?        ?   140.4748  19.7942          ?        ?      117.8        8.4       ?       ? 
1 1 1   12    6   80 o    194.5    5.3    0.0000   0.0000          ?        ?   380.5589  20.4327          ?        ?      194.5        5.3       ?       ? 
1 1 1   12    7    0 o    116.2    2.7  135.3666   6.3852   135.3666   6.3852   135.3666   6.3852      116.2      2.7      116.2        2.7     0.0     0.0 
1 1 1   12    7    1 o    617.6    2.4    0.0000   0.0000          ?        ?  3813.8896  30.0105          ?        ?      617.6        2.4       ?       ? 
1 1 1   12    7    2 o   1101.7    3.9    0.0000   0.0000          ?        ? 12137.6582  85.5619          ?        ?     1101.7        3.9       ?       ? 
1 1 1   12    7    3 o    843.1    3.0    0.0000   0.0000          ?        ?  7108.6616  50.4432          ?        ?      843.1        3.0       ?       ? 
1 1 1   12    7    4 f    666.2    2.5    0.0000   0.0000          ?        ?  4437.7251  33.8416          ?        ?      666.2        2.5       ?       ? 
1 1 1   12    7    5 o    605.2    2.2    0.0000   0.0000          ?        ?  3662.5598  26.8179          ?        ?      605.2        2.2       ?       ? 
1 1 1   12    7    6 o    757.5    2.7    0.0000   0.0000          ?        ?  5737.7554  40.8654          ?        ?      757.5        2.7       ?       ? 
1 1 1   12    7    7 o    263.5    1.6    0.0000   0.0000          ?        ?   694.0730   8.3008          ?        ?      263.5        1.6       ?       ? 
1 1 1   12    7    8 o   1232.9    4.3    0.0000   0.0000          ?        ? 15201.9229 106.6331          ?        ?     1232.9        4.3       ?       ? 
1 1 1   12    7    9 o    571.0    2.1    0.0000   0.0000          ?        ?  3260.2915  24.2638          ?        ?      571.0        2.1       ?       ? 
1 1 1   12    7   10 o    608.2    2.3    0.0000   0.0000          ?        ?  3699.5945  27.4564          ?        ?      608.2        2.3       ?       ? 
1 1 1   12    7   11 o    745.1    2.7    0.0000   0.0000          ?        ?  5552.5840  39.5883          ?        ?      745.1        2.7       ?       ? 
1 1 1   12    7   12 f    966.6    3.3    0.0000   0.0000          ?        ?  9343.4873  64.4907          ?        ?      966.6        3.3       ?       ? 
1 1 1   12    7   13 o    954.8    3.3    0.0000   0.0000          ?        ?  9116.8125  63.2136          ?        ?      954.8        3.3       ?       ? 
1 1 1   12    7   14 o    383.2    1.7    0.0000   0.0000          ?        ?  1468.5997  13.4090          ?        ?      383.2        1.7       ?       ? 
1 1 1   12    7   15 o    364.3    1.8    0.0000   0.0000          ?        ?  1326.8479  12.7704          ?        ?      364.3        1.8       ?       ? 
1 1 1   12    7   16 o    936.1    3.2    0.0000   0.0000          ?        ?  8763.0713  60.6596          ?        ?      936.1        3.2       ?       ? 
1 1 1   12    7   17 o    674.9    2.6    0.0000   0.0000          ?        ?  4555.2134  35.1187          ?        ?      674.9        2.6       ?       ? 
1 1 1   12    7   18 o     28.5    9.5    0.0000   0.0000          ?        ?     7.6623   6.3852          ?        ?       28.5        9.5       ?       ? 
1 1 1   12    7   19 o    434.7    1.9    0.0000   0.0000          ?        ?  1890.0240  16.6016          ?        ?      434.7        1.9       ?       ? 
1 1 1   12    7   20 o    504.7    2.1    0.0000   0.0000          ?        ?  2547.7012  21.0712          ?        ?      504.7        2.1       ?       ? 
1 1 1   12    7   21 o   1252.2    4.3    0.0000   0.0000          ?        ? 15682.0908 107.2716          ?        ?     1252.2        4.3       ?       ? 
1 1 1   12    7   22 o    963.9    3.4    0.0000   0.0000          ?        ?  9292.4053  66.4062          ?        ?      963.9        3.4       ?       ? 
1 1 1   12    7   23 o   1253.1    4.3    0.0000   0.0000          ?        ? 15704.4395 107.2716          ?        ?     1253.1        4.3       ?       ? 
1 1 1   12    7   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    7   25 o    381.3    2.3    0.0000   0.0000          ?        ?  1453.9137  17.2401          ?        ?      381.3        2.3       ?       ? 
1 1 1   12    7   26 o   1162.8    4.1    0.0000   0.0000          ?        ? 13521.9727  96.4168          ?        ?     1162.8        4.1       ?       ? 
1 1 1   12    7   27 o    958.3    3.5    0.0000   0.0000          ?        ?  9184.4951  67.6833          ?        ?      958.3        3.5       ?       ? 
1 1 1   12    7   28 o     22.1   10.9    0.0000   0.0000          ?        ?   -41.5039  17.8786          ?        ?       22.1       10.9       ?       ? 
1 1 1   12    7   29 o   1022.2    3.9    0.0000   0.0000          ?        ? 10448.7676  79.1767          ?        ?     1022.2        3.9       ?       ? 
1 1 1   12    7   30 o    952.6    3.5    0.0000   0.0000          ?        ?  9075.3086  65.7677          ?        ?      952.6        3.5       ?       ? 
1 1 1   12    7   31 o   1685.9    5.8    0.0000   0.0000          ?        ? 28426.9824 196.0261          ?        ?     1685.9        5.8       ?       ? 
1 1 1   12    7   32 o   1195.6    4.2    0.0000   0.0000          ?        ? 14295.8604 101.5249          ?        ?     1195.6        4.2       ?       ? 
1 1 1   12    7   33 o    225.3    4.4    0.0000   0.0000          ?        ?   507.6247  19.7942          ?        ?      225.3        4.4       ?       ? 
1 1 1   12    7   34 o    116.9    7.1    0.0000   0.0000          ?        ?   136.6436  16.6016          ?        ?      116.9        7.1       ?       ? 
1 1 1   12    7   35 o   1115.8    4.1    0.0000   0.0000          ?        ? 12451.8105  91.9471          ?        ?     1115.8        4.1       ?       ? 
1 1 1   12    7   36 o   1329.9    4.5    0.0000   0.0000          ?        ? 17687.6875 120.0421          ?        ?     1329.9        4.5       ?       ? 
1 1 1   12    7   37 o    376.7    2.5    0.0000   0.0000          ?        ?  1419.4336  19.1556          ?        ?      376.7        2.5       ?       ? 
1 1 1   12    7   38 o    599.6    3.1    0.0000   0.0000          ?        ?  3595.5151  37.6728          ?        ?      599.6        3.1       ?       ? 
1 1 1   12    7   39 o    623.8    2.9    0.0000   0.0000          ?        ?  3891.1509  35.7572          ?        ?      623.8        2.9       ?       ? 
1 1 1   12    7   40 o    944.0    3.5    0.0000   0.0000          ?        ?  8912.4854  66.4062          ?        ?      944.0        3.5       ?       ? 
1 1 1   12    7   41 o     24.8   12.3    0.0000   0.0000          ?        ?   -62.5751  24.2638          ?        ?       24.8       12.3       ?       ? 
1 1 1   12    7   42 o   1430.7    4.8    0.0000   0.0000          ?        ? 20471.0039 138.5592          ?        ?     1430.7        4.8       ?       ? 
1 1 1   12    7   43 o    704.7    3.0    0.0000   0.0000          ?        ?  4965.7827  42.1424          ?        ?      704.7        3.0       ?       ? 
1 1 1   12    7   44 o    203.4    4.7    0.0000   0.0000          ?        ?   413.7620  19.1556          ?        ?      203.4        4.7       ?       ? 
1 1 1   12    7   45 o    401.4    2.7    0.0000   0.0000          ?        ?  1610.9901  21.7097          ?        ?      401.4        2.7       ?       ? 
1 1 1   12    7   46 f    976.3    3.5    0.0000   0.0000          ?        ?  9533.1279  68.9603          ?        ?      976.3        3.5       ?       ? 
1 1 1   12    7   47 o     96.5    9.9    0.0000   0.0000          ?        ?    93.2242  19.1556          ?        ?       96.5        9.9       ?       ? 
1 1 1   12    7   48 o    541.1    2.7    0.0000   0.0000          ?        ?  2927.6216  29.3720          ?        ?      541.1        2.7       ?       ? 
1 1 1   12    7   49 o    237.6    4.2    0.0000   0.0000          ?        ?   564.4531  19.7942          ?        ?      237.6        4.2       ?       ? 
1 1 1   12    7   50 o    279.0    3.5    0.0000   0.0000          ?        ?   778.3578  19.7942          ?        ?      279.0        3.5       ?       ? 
1 1 1   12    7   51 o    362.5    3.0    0.0000   0.0000          ?        ?  1314.0775  21.7097          ?        ?      362.5        3.0       ?       ? 
1 1 1   12    7   52 o    151.4    5.9    0.0000   0.0000          ?        ?   229.2293  17.8786          ?        ?      151.4        5.9       ?       ? 
1 1 1   12    7   53 o    105.9    8.7    0.0000   0.0000          ?        ?   112.3798  18.5171          ?        ?      105.9        8.7       ?       ? 
1 1 1   12    7   54 o    344.6    3.0    0.0000   0.0000          ?        ?  1187.6503  20.4327          ?        ?      344.6        3.0       ?       ? 
1 1 1   12    7   55 o     24.1   11.7    0.0000   0.0000          ?        ?   -31.2876  17.8786          ?        ?       24.1       11.7       ?       ? 
1 1 1   12    7   56 o    273.7    3.5    0.0000   0.0000          ?        ?   749.6244  19.1556          ?        ?      273.7        3.5       ?       ? 
1 1 1   12    7   57 o    216.7    4.4    0.0000   0.0000          ?        ?   469.9519  19.1556          ?        ?      216.7        4.4       ?       ? 
1 1 1   12    7   58 o    331.2    3.2    0.0000   0.0000          ?        ?  1096.9802  21.0712          ?        ?      331.2        3.2       ?       ? 
1 1 1   12    7   59 o    151.3    6.3    0.0000   0.0000          ?        ?   229.2293  19.1556          ?        ?      151.3        6.3       ?       ? 
1 1 1   12    7   60 o    293.5    3.4    0.0000   0.0000          ?        ?   862.0042  19.7942          ?        ?      293.5        3.4       ?       ? 
1 1 1   12    7   61 o    189.0    5.4    0.0000   0.0000          ?        ?   357.5721  20.4327          ?        ?      189.0        5.4       ?       ? 
1 1 1   12    7   62 o    191.0    5.2    0.0000   0.0000          ?        ?   365.2344  19.7942          ?        ?      191.0        5.2       ?       ? 
1 1 1   12    7   63 o    234.0    4.4    0.0000   0.0000          ?        ?   547.8516  20.4327          ?        ?      234.0        4.4       ?       ? 
1 1 1   12    7   64 o     38.9   15.8    0.0000   0.0000          ?        ?     6.3852  19.1556          ?        ?       38.9       15.8       ?       ? 
1 1 1   12    7   65 o    121.2    8.2    0.0000   0.0000          ?        ?   147.4985  19.7942          ?        ?      121.2        8.2       ?       ? 
1 1 1   12    7   66 o    166.5    6.1    0.0000   0.0000          ?        ?   277.7569  20.4327          ?        ?      166.5        6.1       ?       ? 
1 1 1   12    7   67 o    640.9    2.8    0.0000   0.0000          ?        ?  4109.5249  35.7572          ?        ?      640.9        2.8       ?       ? 
1 1 1   12    7   68 o    211.4    4.8    0.0000   0.0000          ?        ?   447.6036  20.4327          ?        ?      211.4        4.8       ?       ? 
1 1 1   12    7   69 o    347.4    3.2    0.0000   0.0000          ?        ?  1207.4445  22.3483          ?        ?      347.4        3.2       ?       ? 
1 1 1   12    7   70 o     94.2   10.5    0.0000   0.0000          ?        ?    89.3930  19.7942          ?        ?       94.2       10.5       ?       ? 
1 1 1   12    7   71 o    113.1    9.6    0.0000   0.0000          ?        ?   128.9814  21.7097          ?        ?      113.1        9.6       ?       ? 
1 1 1   12    7   72 o     59.8   16.9    0.0000   0.0000          ?        ?    37.6728  21.0712          ?        ?       59.8       16.9       ?       ? 
1 1 1   12    7   73 o    223.3    4.9    0.0000   0.0000          ?        ?   499.9625  21.7097          ?        ?      223.3        4.9       ?       ? 
1 1 1   12    7   74 o    261.0    4.2    0.0000   0.0000          ?        ?   682.5797  21.7097          ?        ?      261.0        4.2       ?       ? 
1 1 1   12    7   75 o     70.9   15.7    0.0000   0.0000          ?        ?    53.6358  21.7097          ?        ?       70.9       15.7       ?       ? 
1 1 1   12    7   76 f    329.9    3.5    0.0000   0.0000          ?        ?  1089.9564  22.9868          ?        ?      329.9        3.5       ?       ? 
1 1 1   12    7   77 o    159.5    6.8    0.0000   0.0000          ?        ?   256.0471  21.7097          ?        ?      159.5        6.8       ?       ? 
1 1 1   12    7   78 o    197.7    5.2    0.0000   0.0000          ?        ?   392.6908  20.4327          ?        ?      197.7        5.2       ?       ? 
1 1 1   12    7   79 o     65.4   16.6    0.0000   0.0000          ?        ?    46.6121  21.7097          ?        ?       65.4       16.6       ?       ? 
1 1 1   12    7   80 o     44.3   16.8    0.0000   0.0000          ?        ?    15.9630  20.4327          ?        ?       44.3       16.8       ?       ? 
1 1 1   12    8    0 o    118.9    3.0  141.7518   7.0237   141.7518   7.0237   141.7518   7.0237      118.9      3.0      118.9        3.0     0.0     0.0 
1 1 1   12    8    1 o   1031.1    4.1    0.0000   0.0000          ?        ? 10631.3848  83.6463          ?        ?     1031.1        4.1       ?       ? 
1 1 1   12    8    2 o    189.1    1.9    0.0000   0.0000          ?        ?   357.5721   7.0237          ?        ?      189.1        1.9       ?       ? 
1 1 1   12    8    3 o    820.4    3.0    0.0000   0.0000          ?        ?  6730.6562  49.1662          ?        ?      820.4        3.0       ?       ? 
1 1 1   12    8    4 o    827.9    3.1    0.0000   0.0000          ?        ?  6855.1680  51.7203          ?        ?      827.9        3.1       ?       ? 
1 1 1   12    8    5 o    978.1    3.3    0.0000   0.0000          ?        ?  9566.9697  65.1292          ?        ?      978.1        3.3       ?       ? 
1 1 1   12    8    6 o    380.5    1.8    0.0000   0.0000          ?        ?  1447.5286  13.4090          ?        ?      380.5        1.8       ?       ? 
1 1 1   12    8    7 o    453.1    2.2    0.0000   0.0000          ?        ?  2052.8469  19.7942          ?        ?      453.1        2.2       ?       ? 
1 1 1   12    8    8 o    947.3    3.3    0.0000   0.0000          ?        ?  8973.7832  61.9366          ?        ?      947.3        3.3       ?       ? 
1 1 1   12    8    9 o    603.5    2.2    0.0000   0.0000          ?        ?  3642.1274  26.8179          ?        ?      603.5        2.2       ?       ? 
1 1 1   12    8   10 o    951.2    3.3    0.0000   0.0000          ?        ?  9047.8516  62.5751          ?        ?      951.2        3.3       ?       ? 
1 1 1   12    8   11 o    586.1    2.2    0.0000   0.0000          ?        ?  3435.2463  26.1794          ?        ?      586.1        2.2       ?       ? 
1 1 1   12    8   12 o    715.1    2.6    0.0000   0.0000          ?        ?  5114.5581  37.0343          ?        ?      715.1        2.6       ?       ? 
1 1 1   12    8   13 o    191.1    1.7    0.0000   0.0000          ?        ?   365.2344   6.3852          ?        ?      191.1        1.7       ?       ? 
1 1 1   12    8   14 o    587.5    2.2    0.0000   0.0000          ?        ?  3451.2095  26.1794          ?        ?      587.5        2.2       ?       ? 
1 1 1   12    8   15 o    811.2    2.9    0.0000   0.0000          ?        ?  6580.6035  47.2506          ?        ?      811.2        2.9       ?       ? 
1 1 1   12    8   16 o    246.3    1.7    0.0000   0.0000          ?        ?   606.5955   8.3008          ?        ?      246.3        1.7       ?       ? 
1 1 1   12    8   17 o   1127.7    3.9    0.0000   0.0000          ?        ? 12718.7129  88.7545          ?        ?     1127.7        3.9       ?       ? 
1 1 1   12    8   18 o    578.6    2.3    0.0000   0.0000          ?        ?  3347.7688  26.1794          ?        ?      578.6        2.3       ?       ? 
1 1 1   12    8   19 o   1390.1    4.6    0.0000   0.0000          ?        ? 19324.8574 128.9814          ?        ?     1390.1        4.6       ?       ? 
1 1 1   12    8   20 o   1027.2    3.6    0.0000   0.0000          ?        ? 10551.5703  73.4300          ?        ?     1027.2        3.6       ?       ? 
1 1 1   12    8   21 o    539.9    2.2    0.0000   0.0000          ?        ?  2914.8513  24.2638          ?        ?      539.9        2.2       ?       ? 
1 1 1   12    8   22 o   1306.9    4.4    0.0000   0.0000          ?        ? 17080.4531 115.5724          ?        ?     1306.9        4.4       ?       ? 
1 1 1   12    8   23 o   1811.6    5.9    0.0000   0.0000          ?        ? 32824.4844 215.1818          ?        ?     1811.6        5.9       ?       ? 
1 1 1   12    8   24 o    680.7    2.6    0.0000   0.0000          ?        ?  4633.7515  35.1187          ?        ?      680.7        2.6       ?       ? 
1 1 1   12    8   25 o    794.5    3.0    0.0000   0.0000          ?        ?  6313.0635  47.2506          ?        ?      794.5        3.0       ?       ? 
1 1 1   12    8   26 o    678.4    2.8    0.0000   0.0000          ?        ?  4602.4639  38.3113          ?        ?      678.4        2.8       ?       ? 
1 1 1   12    8   27 o   1006.6    3.7    0.0000   0.0000          ?        ? 10133.3379  75.3456          ?        ?     1006.6        3.7       ?       ? 
1 1 1   12    8   28 o    447.1    2.3    0.0000   0.0000          ?        ?  1999.2113  20.4327          ?        ?      447.1        2.3       ?       ? 
1 1 1   12    8   29 o    518.0    2.4    0.0000   0.0000          ?        ?  2683.0679  24.9023          ?        ?      518.0        2.4       ?       ? 
1 1 1   12    8   30 o    974.6    3.6    0.0000   0.0000          ?        ?  9499.2861  70.2374          ?        ?      974.6        3.6       ?       ? 
1 1 1   12    8   31 o     48.4   15.9    0.0000   0.0000          ?        ?    22.3483  17.8786          ?        ?       48.4       15.9       ?       ? 
1 1 1   12    8   32 o   1263.2    4.3    0.0000   0.0000          ?        ? 15956.6553 108.5487          ?        ?     1263.2        4.3       ?       ? 
1 1 1   12    8   33 o    981.1    3.9    0.0000   0.0000          ?        ?  9625.7139  77.2611          ?        ?      981.1        3.9       ?       ? 
1 1 1   12    8   34 o   1296.6    4.5    0.0000   0.0000          ?        ? 16813.5508 116.8494          ?        ?     1296.6        4.5       ?       ? 
1 1 1   12    8   35 o   1013.9    3.6    0.0000   0.0000          ?        ? 10279.5596  72.7915          ?        ?     1013.9        3.6       ?       ? 
1 1 1   12    8   36 o   1256.3    4.3    0.0000   0.0000          ?        ? 15782.9775 108.5487          ?        ?     1256.3        4.3       ?       ? 
1 1 1   12    8   37 o    838.4    3.3    0.0000   0.0000          ?        ?  7029.4849  54.9129          ?        ?      838.4        3.3       ?       ? 
1 1 1   12    8   38 o   1945.0    6.3    0.0000   0.0000          ?        ? 37838.7930 245.8308          ?        ?     1945.0        6.3       ?       ? 
1 1 1   12    8   39 o   1159.8    4.2    0.0000   0.0000          ?        ? 13451.7344  96.4168          ?        ?     1159.8        4.2       ?       ? 
1 1 1   12    8   40 o    742.7    3.1    0.0000   0.0000          ?        ?  5516.1885  45.3350          ?        ?      742.7        3.1       ?       ? 
1 1 1   12    8   41 o    924.9    3.5    0.0000   0.0000          ?        ?  8555.5518  63.8522          ?        ?      924.9        3.5       ?       ? 
1 1 1   12    8   42 o    859.6    3.2    0.0000   0.0000          ?        ?  7389.6113  55.5514          ?        ?      859.6        3.2       ?       ? 
1 1 1   12    8   43 o    519.7    2.6    0.0000   0.0000          ?        ?  2700.9465  26.8179          ?        ?      519.7        2.6       ?       ? 
1 1 1   12    8   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    8   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    8   46 o    553.9    2.7    0.0000   0.0000          ?        ?  3068.7349  30.0105          ?        ?      553.9        2.7       ?       ? 
1 1 1   12    8   47 o    301.0    3.3    0.0000   0.0000          ?        ?   906.0621  19.7942          ?        ?      301.0        3.3       ?       ? 
1 1 1   12    8   48 o    631.1    2.7    0.0000   0.0000          ?        ?  3983.0979  33.8416          ?        ?      631.1        2.7       ?       ? 
1 1 1   12    8   49 o    599.0    2.7    0.0000   0.0000          ?        ?  3588.4915  32.5646          ?        ?      599.0        2.7       ?       ? 
1 1 1   12    8   50 o    573.1    2.7    0.0000   0.0000          ?        ?  3285.1938  31.2876          ?        ?      573.1        2.7       ?       ? 
1 1 1   12    8   51 o    818.3    3.1    0.0000   0.0000          ?        ?  6698.0918  50.4432          ?        ?      818.3        3.1       ?       ? 
1 1 1   12    8   52 o    372.8    2.8    0.0000   0.0000          ?        ?  1390.0615  21.0712          ?        ?      372.8        2.8       ?       ? 
1 1 1   12    8   53 o    530.5    2.6    0.0000   0.0000          ?        ?  2814.6033  28.0950          ?        ?      530.5        2.6       ?       ? 
1 1 1   12    8   54 o    422.3    2.8    0.0000   0.0000          ?        ?  1783.3909  23.6253          ?        ?      422.3        2.8       ?       ? 
1 1 1   12    8   55 f    447.4    2.6    0.0000   0.0000          ?        ?  2002.4038  23.6253          ?        ?      447.4        2.6       ?       ? 
1 1 1   12    8   56 o    196.8    4.9    0.0000   0.0000          ?        ?   387.5826  19.1556          ?        ?      196.8        4.9       ?       ? 
1 1 1   12    8   57 o    622.6    2.9    0.0000   0.0000          ?        ?  3877.7417  35.7572          ?        ?      622.6        2.9       ?       ? 
1 1 1   12    8   58 o     26.4   12.6    0.0000   0.0000          ?        ?   -24.9023  18.5171          ?        ?       26.4       12.6       ?       ? 
1 1 1   12    8   59 o    375.0    3.0    0.0000   0.0000          ?        ?  1406.6632  22.3483          ?        ?      375.0        3.0       ?       ? 
1 1 1   12    8   60 o    323.2    3.3    0.0000   0.0000          ?        ?  1045.2599  21.0712          ?        ?      323.2        3.3       ?       ? 
1 1 1   12    8   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    8   62 o    266.6    3.8    0.0000   0.0000          ?        ?   711.3131  20.4327          ?        ?      266.6        3.8       ?       ? 
1 1 1   12    8   63 o    174.6    5.5    0.0000   0.0000          ?        ?   305.2133  19.1556          ?        ?      174.6        5.5       ?       ? 
1 1 1   12    8   64 o    283.2    3.7    0.0000   0.0000          ?        ?   802.6216  21.0712          ?        ?      283.2        3.7       ?       ? 
1 1 1   12    8   65 o     39.0   16.1    0.0000   0.0000          ?        ?     4.4697  20.4327          ?        ?       39.0       16.1       ?       ? 
1 1 1   12    8   66 o     49.6   17.0    0.0000   0.0000          ?        ?    22.9868  20.4327          ?        ?       49.6       17.0       ?       ? 
1 1 1   12    8   67 o    267.5    3.9    0.0000   0.0000          ?        ?   716.4213  21.0712          ?        ?      267.5        3.9       ?       ? 
1 1 1   12    8   68 o    434.6    2.9    0.0000   0.0000          ?        ?  1889.3855  24.9023          ?        ?      434.6        2.9       ?       ? 
1 1 1   12    8   69 o     77.8   14.1    0.0000   0.0000          ?        ?    63.2136  21.0712          ?        ?       77.8       14.1       ?       ? 
1 1 1   12    8   70 o    294.6    3.8    0.0000   0.0000          ?        ?   869.0280  22.3483          ?        ?      294.6        3.8       ?       ? 
1 1 1   12    8   71 o    119.5    8.8    0.0000   0.0000          ?        ?   143.6674  21.0712          ?        ?      119.5        8.8       ?       ? 
1 1 1   12    8   72 o    120.0    8.8    0.0000   0.0000          ?        ?   144.9444  21.0712          ?        ?      120.0        8.8       ?       ? 
1 1 1   12    8   73 o    187.4    6.0    0.0000   0.0000          ?        ?   352.4639  22.3483          ?        ?      187.4        6.0       ?       ? 
1 1 1   12    8   74 o     38.0   16.2    0.0000   0.0000          ?        ?     0.6385  21.7097          ?        ?       38.0       16.2       ?       ? 
1 1 1   12    8   75 o    264.7    4.2    0.0000   0.0000          ?        ?   702.3738  22.3483          ?        ?      264.7        4.2       ?       ? 
1 1 1   12    8   76 o    143.5    7.8    0.0000   0.0000          ?        ?   207.5195  22.3483          ?        ?      143.5        7.8       ?       ? 
1 1 1   12    8   77 o    215.1    4.9    0.0000   0.0000          ?        ?   464.2052  21.0712          ?        ?      215.1        4.9       ?       ? 
1 1 1   12    8   78 o    121.5    8.7    0.0000   0.0000          ?        ?   149.4141  21.0712          ?        ?      121.5        8.7       ?       ? 
1 1 1   12    8   79 o     66.6   14.8    0.0000   0.0000          ?        ?    47.8891  19.1556          ?        ?       66.6       14.8       ?       ? 
1 1 1   12    9    0 o   1188.8    6.6 14135.5918 157.7148 14135.5918 157.7148 14135.5918 157.7148     1188.8      6.6     1188.8        6.6     0.0     0.0 
1 1 1   12    9    1 o    959.5    3.9    0.0000   0.0000          ?        ?  9206.8438  74.0685          ?        ?      959.5        3.9       ?       ? 
1 1 1   12    9    2 o    321.5    1.9    0.0000   0.0000          ?        ?  1033.7665  12.1319          ?        ?      321.5        1.9       ?       ? 
1 1 1   12    9    3 o    964.3    3.4    0.0000   0.0000          ?        ?  9299.4287  66.4062          ?        ?      964.3        3.4       ?       ? 
1 1 1   12    9    4 o    208.4    1.4    0.0000   0.0000          ?        ?   434.1947   5.7467          ?        ?      208.4        1.4       ?       ? 
1 1 1   12    9    5 o    424.7    1.8    0.0000   0.0000          ?        ?  1803.8236  15.3245          ?        ?      424.7        1.8       ?       ? 
1 1 1   12    9    6 o    495.3    2.0    0.0000   0.0000          ?        ?  2453.2002  19.7942          ?        ?      495.3        2.0       ?       ? 
1 1 1   12    9    7 o    736.7    2.6    0.0000   0.0000          ?        ?  5428.0723  38.9498          ?        ?      736.7        2.6       ?       ? 
1 1 1   12    9    8 o    828.5    2.9    0.0000   0.0000          ?        ?  6864.7461  47.8891          ?        ?      828.5        2.9       ?       ? 
1 1 1   12    9    9 o    296.1    1.5    0.0000   0.0000          ?        ?   876.6902   8.9393          ?        ?      296.1        1.5       ?       ? 
1 1 1   12    9   10 o    255.2    1.5    0.0000   0.0000          ?        ?   651.2921   7.6623          ?        ?      255.2        1.5       ?       ? 
1 1 1   12    9   11 o   1609.1    5.3    0.0000   0.0000          ?        ? 25895.2441 169.8468          ?        ?     1609.1        5.3       ?       ? 
1 1 1   12    9   12 o   1154.9    3.9    0.0000   0.0000          ?        ? 13338.0771  89.3930          ?        ?     1154.9        3.9       ?       ? 
1 1 1   12    9   13 o    475.4    2.2    0.0000   0.0000          ?        ?  2259.7280  21.0712          ?        ?      475.4        2.2       ?       ? 
1 1 1   12    9   14 o   1279.6    4.3    0.0000   0.0000          ?        ? 16376.1641 110.4642          ?        ?     1279.6        4.3       ?       ? 
1 1 1   12    9   15 o   1091.2    3.8    0.0000   0.0000          ?        ? 11907.1514  83.0078          ?        ?     1091.2        3.8       ?       ? 
1 1 1   12    9   16 o    241.0    1.9    0.0000   0.0000          ?        ?   581.0547   8.9393          ?        ?      241.0        1.9       ?       ? 
1 1 1   12    9   17 o    804.2    2.9    0.0000   0.0000          ?        ?  6467.5859  46.6121          ?        ?      804.2        2.9       ?       ? 
1 1 1   12    9   18 o   1438.4    4.8    0.0000   0.0000          ?        ? 20691.9316 137.9207          ?        ?     1438.4        4.8       ?       ? 
1 1 1   12    9   19 o    952.5    3.4    0.0000   0.0000          ?        ?  9072.7539  64.4907          ?        ?      952.5        3.4       ?       ? 
1 1 1   12    9   20 o    940.5    3.4    0.0000   0.0000          ?        ?  8846.0791  63.2136          ?        ?      940.5        3.4       ?       ? 
1 1 1   12    9   21 o    900.8    3.2    0.0000   0.0000          ?        ?  8114.3330  58.1055          ?        ?      900.8        3.2       ?       ? 
1 1 1   12    9   22 o   1810.7    5.9    0.0000   0.0000          ?        ? 32790.0000 215.1818          ?        ?     1810.7        5.9       ?       ? 
1 1 1   12    9   23 o    623.0    2.5    0.0000   0.0000          ?        ?  3881.5732  31.2876          ?        ?      623.0        2.5       ?       ? 
1 1 1   12    9   24 o   1089.2    3.8    0.0000   0.0000          ?        ? 11863.7314  83.6463          ?        ?     1089.2        3.8       ?       ? 
1 1 1   12    9   25 o   1307.4    4.7    0.0000   0.0000          ?        ? 17094.5000 123.2347          ?        ?     1307.4        4.7       ?       ? 
1 1 1   12    9   26 o    614.9    2.6    0.0000   0.0000          ?        ?  3780.6863  31.9261          ?        ?      614.9        2.6       ?       ? 
1 1 1   12    9   27 o   1975.3    6.5    0.0000   0.0000          ?        ? 39023.2500 257.3242          ?        ?     1975.3        6.5       ?       ? 
1 1 1   12    9   28 o   1425.5    5.3    0.0000   0.0000          ?        ? 20321.5898 151.9681          ?        ?     1425.5        5.3       ?       ? 
1 1 1   12    9   29 o   1671.2    5.9    0.0000   0.0000          ?        ? 27932.1289 197.3032          ?        ?     1671.2        5.9       ?       ? 
1 1 1   12    9   30 o    760.0    2.9    0.0000   0.0000          ?        ?  5775.4282  43.4195          ?        ?      760.0        2.9       ?       ? 
1 1 1   12    9   31 o   1580.1    5.4    0.0000   0.0000          ?        ? 24970.6641 171.7623          ?        ?     1580.1        5.4       ?       ? 
1 1 1   12    9   32 o   1017.1    3.6    0.0000   0.0000          ?        ? 10345.9658  73.4300          ?        ?     1017.1        3.6       ?       ? 
1 1 1   12    9   33 o   1006.0    3.8    0.0000   0.0000          ?        ? 10120.5674  75.9841          ?        ?     1006.0        3.8       ?       ? 
1 1 1   12    9   34 o    913.7    3.6    0.0000   0.0000          ?        ?  8348.6699  65.7677          ?        ?      913.7        3.6       ?       ? 
1 1 1   12    9   35 o    809.3    3.4    0.0000   0.0000          ?        ?  6549.3159  54.2743          ?        ?      809.3        3.4       ?       ? 
1 1 1   12    9   36 o   1807.5    5.9    0.0000   0.0000          ?        ? 32676.9824 214.5433          ?        ?     1807.5        5.9       ?       ? 
1 1 1   12    9   37 o    777.6    3.0    0.0000   0.0000          ?        ?  6046.7998  46.6121          ?        ?      777.6        3.0       ?       ? 
1 1 1   12    9   38 o    597.3    2.8    0.0000   0.0000          ?        ?  3567.4204  33.8416          ?        ?      597.3        2.8       ?       ? 
1 1 1   12    9   39 f    866.8    3.6    0.0000   0.0000          ?        ?  7514.7612  61.9366          ?        ?      866.8        3.6       ?       ? 
1 1 1   12    9   40 o   1075.9    3.9    0.0000   0.0000          ?        ? 11575.7588  83.6463          ?        ?     1075.9        3.9       ?       ? 
1 1 1   12    9   41 o   1286.2    4.4    0.0000   0.0000          ?        ? 16545.3730 113.0183          ?        ?     1286.2        4.4       ?       ? 
1 1 1   12    9   42 o    750.0    3.0    0.0000   0.0000          ?        ?  5624.7373  44.6965          ?        ?      750.0        3.0       ?       ? 
1 1 1   12    9   43 o    434.4    2.7    0.0000   0.0000          ?        ?  1886.8314  23.6253          ?        ?      434.4        2.7       ?       ? 
1 1 1   12    9   44 o    607.2    2.7    0.0000   0.0000          ?        ?  3686.8240  33.2031          ?        ?      607.2        2.7       ?       ? 
1 1 1   12    9   45 o    216.8    4.1    0.0000   0.0000          ?        ?   469.9519  17.8786          ?        ?      216.8        4.1       ?       ? 
1 1 1   12    9   46 o     20.0   10.1    0.0000   0.0000          ?        ?   -58.7440  18.5171          ?        ?       20.0       10.1       ?       ? 
1 1 1   12    9   47 o    403.5    2.8    0.0000   0.0000          ?        ?  1628.2301  22.3483          ?        ?      403.5        2.8       ?       ? 
1 1 1   12    9   48 o    117.1    7.6    0.0000   0.0000          ?        ?   137.2822  17.8786          ?        ?      117.1        7.6       ?       ? 
1 1 1   12    9   49 o    215.1    4.6    0.0000   0.0000          ?        ?   462.9282  19.7942          ?        ?      215.1        4.6       ?       ? 
1 1 1   12    9   50 o    163.5    5.9    0.0000   0.0000          ?        ?   267.5406  19.1556          ?        ?      163.5        5.9       ?       ? 
1 1 1   12    9   51 o    656.9    2.8    0.0000   0.0000          ?        ?  4316.4062  37.0343          ?        ?      656.9        2.8       ?       ? 
1 1 1   12    9   52 o    598.4    2.7    0.0000   0.0000          ?        ?  3581.4680  32.5646          ?        ?      598.4        2.7       ?       ? 
1 1 1   12    9   53 o    156.3    5.9    0.0000   0.0000          ?        ?   244.5538  18.5171          ?        ?      156.3        5.9       ?       ? 
1 1 1   12    9   54 o    340.9    2.9    0.0000   0.0000          ?        ?  1162.1094  19.7942          ?        ?      340.9        2.9       ?       ? 
1 1 1   12    9   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12    9   56 o    634.8    2.8    0.0000   0.0000          ?        ?  4030.9871  35.1187          ?        ?      634.8        2.8       ?       ? 
1 1 1   12    9   57 o    321.3    3.1    0.0000   0.0000          ?        ?  1032.4895  19.7942          ?        ?      321.3        3.1       ?       ? 
1 1 1   12    9   58 o    131.9    6.8    0.0000   0.0000          ?        ?   174.3164  17.8786          ?        ?      131.9        6.8       ?       ? 
1 1 1   12    9   59 o     97.4    9.5    0.0000   0.0000          ?        ?    95.1397  18.5171          ?        ?       97.4        9.5       ?       ? 
1 1 1   12    9   60 o     78.5   12.2    0.0000   0.0000          ?        ?    61.9366  19.1556          ?        ?       78.5       12.2       ?       ? 
1 1 1   12    9   61 o    439.1    2.9    0.0000   0.0000          ?        ?  1928.9739  25.5409          ?        ?      439.1        2.9       ?       ? 
1 1 1   12    9   62 o    461.2    2.8    0.0000   0.0000          ?        ?  2127.5542  25.5409          ?        ?      461.2        2.8       ?       ? 
1 1 1   12    9   63 o    282.0    3.7    0.0000   0.0000          ?        ?   795.5980  21.0712          ?        ?      282.0        3.7       ?       ? 
1 1 1   12    9   64 o    377.4    3.0    0.0000   0.0000          ?        ?  1425.1803  22.9868          ?        ?      377.4        3.0       ?       ? 
1 1 1   12    9   65 o    217.7    4.7    0.0000   0.0000          ?        ?   474.4216  20.4327          ?        ?      217.7        4.7       ?       ? 
1 1 1   12    9   66 o    536.1    2.7    0.0000   0.0000          ?        ?  2875.2627  29.3720          ?        ?      536.1        2.7       ?       ? 
1 1 1   12    9   67 o    125.3    8.2    0.0000   0.0000          ?        ?   157.7148  20.4327          ?        ?      125.3        8.2       ?       ? 
1 1 1   12    9   68 f    412.5    3.0    0.0000   0.0000          ?        ?  1702.2987  24.9023          ?        ?      412.5        3.0       ?       ? 
1 1 1   12    9   69 o    150.5    7.0    0.0000   0.0000          ?        ?   227.3137  21.0712          ?        ?      150.5        7.0       ?       ? 
1 1 1   12    9   70 o     92.7   11.7    0.0000   0.0000          ?        ?    86.8389  21.7097          ?        ?       92.7       11.7       ?       ? 
1 1 1   12    9   71 o     28.3   13.5    0.0000   0.0000          ?        ?   -26.8179  21.0712          ?        ?       28.3       13.5       ?       ? 
1 1 1   12    9   72 o    150.2    7.2    0.0000   0.0000          ?        ?   226.6752  21.7097          ?        ?      150.2        7.2       ?       ? 
1 1 1   12    9   73 o    104.0    9.8    0.0000   0.0000          ?        ?   109.1872  20.4327          ?        ?      104.0        9.8       ?       ? 
1 1 1   12    9   74 o    254.9    4.5    0.0000   0.0000          ?        ?   651.2921  22.9868          ?        ?      254.9        4.5       ?       ? 
1 1 1   12    9   75 o     23.5   11.7    0.0000   0.0000          ?        ?   -50.4432  21.0712          ?        ?       23.5       11.7       ?       ? 
1 1 1   12    9   76 o    124.0    8.2    0.0000   0.0000          ?        ?   155.1608  20.4327          ?        ?      124.0        8.2       ?       ? 
1 1 1   12    9   77 o    176.4    6.0    0.0000   0.0000          ?        ?   312.8756  21.0712          ?        ?      176.4        6.0       ?       ? 
1 1 1   12    9   78 o     86.8   12.1    0.0000   0.0000          ?        ?    77.2611  21.0712          ?        ?       86.8       12.1       ?       ? 
1 1 1   12    9   79 o     51.0   17.3    0.0000   0.0000          ?        ?    26.1794  21.0712          ?        ?       51.0       17.3       ?       ? 
1 1 1   12   10    0 o    446.8    3.2 1996.6572  28.7335  1996.6572  28.7335  1996.6572  28.7335      446.8      3.2      446.8        3.2     0.0     0.0 
1 1 1   12   10    1 o    474.2    2.5    0.0000   0.0000          ?        ?  2248.8733  23.6253          ?        ?      474.2        2.5       ?       ? 
1 1 1   12   10    2 o    934.7    3.7    0.0000   0.0000          ?        ?  8736.8916  68.3218          ?        ?      934.7        3.7       ?       ? 
1 1 1   12   10    3 o    322.4    1.6    0.0000   0.0000          ?        ?  1039.5132  10.2163          ?        ?      322.4        1.6       ?       ? 
1 1 1   12   10    4 o     42.3    3.0    0.0000   0.0000          ?        ?    17.8786   2.5541          ?        ?       42.3        3.0       ?       ? 
1 1 1   12   10    5 o    649.3    2.5    0.0000   0.0000          ?        ?  4216.1582  31.9261          ?        ?      649.3        2.5       ?       ? 
1 1 1   12   10    6 o    709.8    2.6    0.0000   0.0000          ?        ?  5037.9355  36.3957          ?        ?      709.8        2.6       ?       ? 
1 1 1   12   10    7 o   1132.7    3.8    0.0000   0.0000          ?        ? 12831.7305  86.8389          ?        ?     1132.7        3.8       ?       ? 
1 1 1   12   10    8 o    571.4    2.2    0.0000   0.0000          ?        ?  3264.7610  24.9023          ?        ?      571.4        2.2       ?       ? 
1 1 1   12   10    9 o   1169.5    3.9    0.0000   0.0000          ?        ? 13678.4102  91.9471          ?        ?     1169.5        3.9       ?       ? 
1 1 1   12   10   10 o     88.6    2.9    0.0000   0.0000          ?        ?    78.5382   5.1082          ?        ?       88.6        2.9       ?       ? 
1 1 1   12   10   11 o   1057.3    3.6    0.0000   0.0000          ?        ? 11178.5977  76.6226          ?        ?     1057.3        3.6       ?       ? 
1 1 1   12   10   12 o   2116.9    7.1    0.0000   0.0000          ?        ? 44822.3047 301.3822          ?        ?     2116.9        7.1       ?       ? 
1 1 1   12   10   13 o   1443.8    4.8    0.0000   0.0000          ?        ? 20848.3711 137.9207          ?        ?     1443.8        4.8       ?       ? 
1 1 1   12   10   14 o    551.5    2.2    0.0000   0.0000          ?        ?  3041.2783  24.2638          ?        ?      551.5        2.2       ?       ? 
1 1 1   12   10   15 o   1450.2    4.9    0.0000   0.0000          ?        ? 21034.1797 142.3903          ?        ?     1450.2        4.9       ?       ? 
1 1 1   12   10   16 o    363.5    1.8    0.0000   0.0000          ?        ?  1321.1012  12.7704          ?        ?      363.5        1.8       ?       ? 
1 1 1   12   10   17 o   1166.1    4.0    0.0000   0.0000          ?        ? 13597.9570  93.2242          ?        ?     1166.1        4.0       ?       ? 
1 1 1   12   10   18 o   1533.7    5.1    0.0000   0.0000          ?        ? 23526.3301 155.7993          ?        ?     1533.7        5.1       ?       ? 
1 1 1   12   10   19 o    975.6    3.4    0.0000   0.0000          ?        ?  9517.8027  66.4062          ?        ?      975.6        3.4       ?       ? 
1 1 1   12   10   20 o   1322.5    4.5    0.0000   0.0000          ?        ? 17491.6602 118.1265          ?        ?     1322.5        4.5       ?       ? 
1 1 1   12   10   21 o   1259.3    4.3    0.0000   0.0000          ?        ? 15859.6006 107.9102          ?        ?     1259.3        4.3       ?       ? 
1 1 1   12   10   22 o   1641.5    5.4    0.0000   0.0000          ?        ? 26949.4453 177.5090          ?        ?     1641.5        5.4       ?       ? 
1 1 1   12   10   23 o    862.9    3.1    0.0000   0.0000          ?        ?  7445.8003  54.2743          ?        ?      862.9        3.1       ?       ? 
1 1 1   12   10   24 o    618.2    2.6    0.0000   0.0000          ?        ?  3821.5520  31.9261          ?        ?      618.2        2.6       ?       ? 
1 1 1   12   10   25 o    556.3    2.5    0.0000   0.0000          ?        ?  3094.2759  28.0950          ?        ?      556.3        2.5       ?       ? 
1 1 1   12   10   26 o    676.9    2.8    0.0000   0.0000          ?        ?  4582.0312  38.3113          ?        ?      676.9        2.8       ?       ? 
1 1 1   12   10   27 o   2094.6    8.3    0.0000   0.0000          ?        ? 43881.7578 348.6328          ?        ?     2094.6        8.3       ?       ? 
1 1 1   12   10   28 o   1955.6    7.0    0.0000   0.0000          ?        ? 38247.4453 273.2873          ?        ?     1955.6        7.0       ?       ? 
1 1 1   12   10   29 o    843.1    3.2    0.0000   0.0000          ?        ?  7108.6616  53.6358          ?        ?      843.1        3.2       ?       ? 
1 1 1   12   10   30 o    873.4    3.4    0.0000   0.0000          ?        ?  7628.4175  59.3825          ?        ?      873.4        3.4       ?       ? 
1 1 1   12   10   31 o   1357.1    4.9    0.0000   0.0000          ?        ? 18419.4336 132.1740          ?        ?     1357.1        4.9       ?       ? 
1 1 1   12   10   32 o   1498.3    5.0    0.0000   0.0000          ?        ? 22450.4199 149.4141          ?        ?     1498.3        5.0       ?       ? 
1 1 1   12   10   33 o    882.0    3.4    0.0000   0.0000          ?        ?  7779.1094  60.6596          ?        ?      882.0        3.4       ?       ? 
1 1 1   12   10   34 o   1388.9    4.9    0.0000   0.0000          ?        ? 19291.6543 136.0051          ?        ?     1388.9        4.9       ?       ? 
1 1 1   12   10   35 o    950.3    3.6    0.0000   0.0000          ?        ?  9031.8887  67.6833          ?        ?      950.3        3.6       ?       ? 
1 1 1   12   10   36 o    393.7    2.7    0.0000   0.0000          ?        ?  1550.3306  21.0712          ?        ?      393.7        2.7       ?       ? 
1 1 1   12   10   37 o    466.3    2.5    0.0000   0.0000          ?        ?  2174.1663  23.6253          ?        ?      466.3        2.5       ?       ? 
1 1 1   12   10   38 o    811.8    3.1    0.0000   0.0000          ?        ?  6590.1816  49.8047          ?        ?      811.8        3.1       ?       ? 
1 1 1   12   10   39 o   1296.2    4.5    0.0000   0.0000          ?        ? 16803.3359 116.2109          ?        ?     1296.2        4.5       ?       ? 
1 1 1   12   10   40 f    434.8    2.9    0.0000   0.0000          ?        ?  1890.6626  24.9023          ?        ?      434.8        2.9       ?       ? 
1 1 1   12   10   41 o   1732.8    5.9    0.0000   0.0000          ?        ? 30032.2246 204.3269          ?        ?     1732.8        5.9       ?       ? 
1 1 1   12   10   42 o    250.5    4.0    0.0000   0.0000          ?        ?   627.6667  19.7942          ?        ?      250.5        4.0       ?       ? 
1 1 1   12   10   43 f    637.4    2.8    0.0000   0.0000          ?        ?  4062.9131  35.1187          ?        ?      637.4        2.8       ?       ? 
1 1 1   12   10   44 o     26.8   13.0    0.0000   0.0000          ?        ?   -33.8416  21.0712          ?        ?       26.8       13.0       ?       ? 
1 1 1   12   10   45 o    236.5    3.8    0.0000   0.0000          ?        ?   559.3449  17.8786          ?        ?      236.5        3.8       ?       ? 
1 1 1   12   10   46 o    308.1    3.2    0.0000   0.0000          ?        ?   949.4816  19.7942          ?        ?      308.1        3.2       ?       ? 
1 1 1   12   10   47 o    377.8    2.8    0.0000   0.0000          ?        ?  1427.0958  21.0712          ?        ?      377.8        2.8       ?       ? 
1 1 1   12   10   48 o    754.6    3.0    0.0000   0.0000          ?        ?  5695.6128  44.6965          ?        ?      754.6        3.0       ?       ? 
1 1 1   12   10   49 o    248.1    4.2    0.0000   0.0000          ?        ?   615.5349  21.0712          ?        ?      248.1        4.2       ?       ? 
1 1 1   12   10   50 o    665.2    3.0    0.0000   0.0000          ?        ?  4426.2319  39.5883          ?        ?      665.2        3.0       ?       ? 
1 1 1   12   10   51 o    856.0    3.2    0.0000   0.0000          ?        ?  7328.3125  54.9129          ?        ?      856.0        3.2       ?       ? 
1 1 1   12   10   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12   10   53 o    359.7    2.9    0.0000   0.0000          ?        ?  1294.2833  21.0712          ?        ?      359.7        2.9       ?       ? 
1 1 1   12   10   54 o    507.9    2.6    0.0000   0.0000          ?        ?  2580.2659  26.8179          ?        ?      507.9        2.6       ?       ? 
1 1 1   12   10   55 o    445.8    3.0    0.0000   0.0000          ?        ?  1987.7178  26.8179          ?        ?      445.8        3.0       ?       ? 
1 1 1   12   10   56 o    455.1    2.8    0.0000   0.0000          ?        ?  2072.0027  25.5409          ?        ?      455.1        2.8       ?       ? 
1 1 1   12   10   57 o    339.0    3.2    0.0000   0.0000          ?        ?  1149.3389  21.7097          ?        ?      339.0        3.2       ?       ? 
1 1 1   12   10   58 o    262.3    3.7    0.0000   0.0000          ?        ?   688.3264  19.1556          ?        ?      262.3        3.7       ?       ? 
1 1 1   12   10   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12   10   60 o    199.8    4.8    0.0000   0.0000          ?        ?   399.7145  19.1556          ?        ?      199.8        4.8       ?       ? 
1 1 1   12   10   61 o    491.6    2.7    0.0000   0.0000          ?        ?  2417.4429  26.1794          ?        ?      491.6        2.7       ?       ? 
1 1 1   12   10   62 o    208.6    4.7    0.0000   0.0000          ?        ?   435.4717  19.7942          ?        ?      208.6        4.7       ?       ? 
1 1 1   12   10   63 o    244.6    4.2    0.0000   0.0000          ?        ?   598.9333  20.4327          ?        ?      244.6        4.2       ?       ? 
1 1 1   12   10   64 o     21.4   10.7    0.0000   0.0000          ?        ?   -56.8284  19.7942          ?        ?       21.4       10.7       ?       ? 
1 1 1   12   10   65 o    213.8    4.8    0.0000   0.0000          ?        ?   457.8200  20.4327          ?        ?      213.8        4.8       ?       ? 
1 1 1   12   10   66 o     29.2   13.8    0.0000   0.0000          ?        ?   -23.6253  21.0712          ?        ?       29.2       13.8       ?       ? 
1 1 1   12   10   67 o     79.1   12.9    0.0000   0.0000          ?        ?    63.2136  20.4327          ?        ?       79.1       12.9       ?       ? 
1 1 1   12   10   68 o    225.4    4.7    0.0000   0.0000          ?        ?   508.9017  21.0712          ?        ?      225.4        4.7       ?       ? 
1 1 1   12   10   69 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12   10   70 o    135.3    7.6    0.0000   0.0000          ?        ?   183.8942  20.4327          ?        ?      135.3        7.6       ?       ? 
1 1 1   12   10   71 o     35.5   15.5    0.0000   0.0000          ?        ?    -4.4697  21.0712          ?        ?       35.5       15.5       ?       ? 
1 1 1   12   10   72 o    155.4    7.0    0.0000   0.0000          ?        ?   242.6382  21.7097          ?        ?      155.4        7.0       ?       ? 
1 1 1   12   10   73 o    217.2    5.0    0.0000   0.0000          ?        ?   473.1445  21.7097          ?        ?      217.2        5.0       ?       ? 
1 1 1   12   10   74 o    207.4    5.1    0.0000   0.0000          ?        ?   431.6406  21.0712          ?        ?      207.4        5.1       ?       ? 
1 1 1   12   10   75 o    255.1    4.5    0.0000   0.0000          ?        ?   652.5691  22.9868          ?        ?      255.1        4.5       ?       ? 
1 1 1   12   10   76 o    143.5    7.6    0.0000   0.0000          ?        ?   207.5195  21.7097          ?        ?      143.5        7.6       ?       ? 
1 1 1   12   10   77 o     25.0   12.3    0.0000   0.0000          ?        ?   -41.5039  21.0712          ?        ?       25.0       12.3       ?       ? 
1 1 1   12   10   78 o     95.9   10.7    0.0000   0.0000          ?        ?    93.8627  20.4327          ?        ?       95.9       10.7       ?       ? 
1 1 1   12   10   79 o     76.7   14.7    0.0000   0.0000          ?        ?    63.2136  21.7097          ?        ?       76.7       14.7       ?       ? 
1 1 1   12   11    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12   11    1 o    621.5    2.7    0.0000   0.0000          ?        ?  3862.4175  33.2031          ?        ?      621.5        2.7       ?       ? 
1 1 1   12   11    2 o    964.3    3.8    0.0000   0.0000          ?        ?  9299.4287  72.7915          ?        ?      964.3        3.8       ?       ? 
1 1 1   12   11    3 o    719.6    2.9    0.0000   0.0000          ?        ?  5178.4102  42.1424          ?        ?      719.6        2.9       ?       ? 
1 1 1   12   11    4 o   1670.4    5.7    0.0000   0.0000          ?        ? 27907.2266 190.9180          ?        ?     1670.4        5.7       ?       ? 
1 1 1   12   11    5 o   1085.7    3.7    0.0000   0.0000          ?        ? 11789.0254  79.8152          ?        ?     1085.7        3.7       ?       ? 
1 1 1   12   11    6 o    393.3    1.7    0.0000   0.0000          ?        ?  1546.4994  13.4090          ?        ?      393.3        1.7       ?       ? 
1 1 1   12   11    7 o    326.2    1.6    0.0000   0.0000          ?        ?  1063.7771  10.2163          ?        ?      326.2        1.6       ?       ? 
1 1 1   12   11    8 o    731.2    2.8    0.0000   0.0000          ?        ?  5346.9805  40.2269          ?        ?      731.2        2.8       ?       ? 
1 1 1   12   11    9 f   1310.2    4.4    0.0000   0.0000          ?        ? 17166.6543 114.2954          ?        ?     1310.2        4.4       ?       ? 
1 1 1   12   11   10 o    758.7    2.8    0.0000   0.0000          ?        ?  5756.2725  42.7809          ?        ?      758.7        2.8       ?       ? 
1 1 1   12   11   11 o   1840.2    6.1    0.0000   0.0000          ?        ? 33871.0195 226.0367          ?        ?     1840.2        6.1       ?       ? 
1 1 1   12   11   12 o    593.7    2.3    0.0000   0.0000          ?        ?  3525.2778  26.8179          ?        ?      593.7        2.3       ?       ? 
1 1 1   12   11   13 o   1014.9    3.6    0.0000   0.0000          ?        ? 10300.6309  72.7915          ?        ?     1014.9        3.6       ?       ? 
1 1 1   12   11   14 o   1268.1    4.3    0.0000   0.0000          ?        ? 16082.4443 109.8257          ?        ?     1268.1        4.3       ?       ? 
1 1 1   12   11   15 o    388.0    1.8    0.0000   0.0000          ?        ?  1505.6340  14.0475          ?        ?      388.0        1.8       ?       ? 
1 1 1   12   11   16 o   1133.0    3.9    0.0000   0.0000          ?        ? 12837.4775  87.4775          ?        ?     1133.0        3.9       ?       ? 
1 1 1   12   11   17 o    693.2    2.6    0.0000   0.0000          ?        ?  4804.8750  36.3957          ?        ?      693.2        2.6       ?       ? 
1 1 1   12   11   18 o   1597.2    5.3    0.0000   0.0000          ?        ? 25512.7715 169.2082          ?        ?     1597.2        5.3       ?       ? 
1 1 1   12   11   19 o    957.6    3.4    0.0000   0.0000          ?        ?  9170.4473  64.4907          ?        ?      957.6        3.4       ?       ? 
1 1 1   12   11   20 o    557.6    2.4    0.0000   0.0000          ?        ?  3109.6003  26.8179          ?        ?      557.6        2.4       ?       ? 
1 1 1   12   11   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12   11   22 o   1101.6    3.8    0.0000   0.0000          ?        ? 12135.1035  84.2849          ?        ?     1101.6        3.8       ?       ? 
1 1 1   12   11   23 o   1325.0    4.7    0.0000   0.0000          ?        ? 17558.0684 123.2347          ?        ?     1325.0        4.7       ?       ? 
1 1 1   12   11   24 o   1158.2    4.2    0.0000   0.0000          ?        ? 13415.9785  98.3323          ?        ?     1158.2        4.2       ?       ? 
1 1 1   12   11   25 o   1449.2    5.0    0.0000   0.0000          ?        ? 21003.5293 144.3059          ?        ?     1449.2        5.0       ?       ? 
1 1 1   12   11   26 o    629.1    2.7    0.0000   0.0000          ?        ?  3958.1958  33.8416          ?        ?      629.1        2.7       ?       ? 
1 1 1   12   11   27 o   1055.6    4.0    0.0000   0.0000          ?        ? 11142.8408  83.6463          ?        ?     1055.6        4.0       ?       ? 
1 1 1   12   11   28 o   1135.4    4.0    0.0000   0.0000          ?        ? 12893.0283  90.0316          ?        ?     1135.4        4.0       ?       ? 
1 1 1   12   11   29 o    689.1    2.8    0.0000   0.0000          ?        ?  4748.6855  38.3113          ?        ?      689.1        2.8       ?       ? 
1 1 1   12   11   30 o   1356.6    4.5    0.0000   0.0000          ?        ? 18404.1094 123.2347          ?        ?     1356.6        4.5       ?       ? 
1 1 1   12   11   31 o    707.3    2.9    0.0000   0.0000          ?        ?  5003.4551  40.8654          ?        ?      707.3        2.9       ?       ? 
1 1 1   12   11   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12   11   33 o   1620.5    5.5    0.0000   0.0000          ?        ? 26262.3945 177.5090          ?        ?     1620.5        5.5       ?       ? 
1 1 1   12   11   34 o    269.8    3.6    0.0000   0.0000          ?        ?   727.9147  19.1556          ?        ?      269.8        3.6       ?       ? 
1 1 1   12   11   35 o   1156.9    4.1    0.0000   0.0000          ?        ? 13384.6904  95.1397          ?        ?     1156.9        4.1       ?       ? 
1 1 1   12   11   36 o    869.1    3.5    0.0000   0.0000          ?        ?  7553.0723  60.0210          ?        ?      869.1        3.5       ?       ? 
1 1 1   12   11   37 o    959.5    3.5    0.0000   0.0000          ?        ?  9206.2051  67.0448          ?        ?      959.5        3.5       ?       ? 
1 1 1   12   11   38 o   1637.2    5.5    0.0000   0.0000          ?        ? 26807.6914 178.7861          ?        ?     1637.2        5.5       ?       ? 
1 1 1   12   11   39 o    458.1    2.6    0.0000   0.0000          ?        ?  2098.8206  24.2638          ?        ?      458.1        2.6       ?       ? 
1 1 1   12   11   40 o    934.3    3.5    0.0000   0.0000          ?        ?  8729.2285  65.7677          ?        ?      934.3        3.5       ?       ? 
1 1 1   12   11   41 o    936.8    3.4    0.0000   0.0000          ?        ?  8777.1182  63.8522          ?        ?      936.8        3.4       ?       ? 
1 1 1   12   11   42 o    363.9    2.9    0.0000   0.0000          ?        ?  1324.2938  21.0712          ?        ?      363.9        2.9       ?       ? 
1 1 1   12   11   43 o    550.6    2.6    0.0000   0.0000          ?        ?  3031.7007  28.7335          ?        ?      550.6        2.6       ?       ? 
1 1 1   12   11   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12   11   45 o    637.7    2.7    0.0000   0.0000          ?        ?  4066.7444  34.4802          ?        ?      637.7        2.7       ?       ? 
1 1 1   12   11   46 o    188.1    4.6    0.0000   0.0000          ?        ?   353.7410  17.2401          ?        ?      188.1        4.6       ?       ? 
1 1 1   12   11   47 o    173.8    5.0    0.0000   0.0000          ?        ?   302.0207  17.2401          ?        ?      173.8        5.0       ?       ? 
1 1 1   12   11   48 o    168.9    5.3    0.0000   0.0000          ?        ?   285.4192  17.8786          ?        ?      168.9        5.3       ?       ? 
1 1 1   12   11   49 o    179.2    5.0    0.0000   0.0000          ?        ?   321.1764  17.8786          ?        ?      179.2        5.0       ?       ? 
1 1 1   12   11   50 o    111.5    8.3    0.0000   0.0000          ?        ?   124.5117  18.5171          ?        ?      111.5        8.3       ?       ? 
1 1 1   12   11   51 o    118.2    7.8    0.0000   0.0000          ?        ?   139.8362  18.5171          ?        ?      118.2        7.8       ?       ? 
1 1 1   12   11   52 o    363.6    2.9    0.0000   0.0000          ?        ?  1322.3783  21.0712          ?        ?      363.6        2.9       ?       ? 
1 1 1   12   11   53 o    173.7    5.1    0.0000   0.0000          ?        ?   302.0207  17.8786          ?        ?      173.7        5.1       ?       ? 
1 1 1   12   11   54 o    273.3    3.7    0.0000   0.0000          ?        ?   747.0703  20.4327          ?        ?      273.3        3.7       ?       ? 
1 1 1   12   11   55 o    503.7    2.7    0.0000   0.0000          ?        ?  2538.1235  27.4564          ?        ?      503.7        2.7       ?       ? 
1 1 1   12   11   56 o    733.2    2.9    0.0000   0.0000          ?        ?  5376.9902  42.7809          ?        ?      733.2        2.9       ?       ? 
1 1 1   12   11   57 o    133.4    6.9    0.0000   0.0000          ?        ?   178.1475  18.5171          ?        ?      133.4        6.9       ?       ? 
1 1 1   12   11   58 o     40.9   15.6    0.0000   0.0000          ?        ?    11.4934  17.8786          ?        ?       40.9       15.6       ?       ? 
1 1 1   12   11   59 o    160.7    5.8    0.0000   0.0000          ?        ?   258.6013  18.5171          ?        ?      160.7        5.8       ?       ? 
1 1 1   12   11   60 o    365.4    2.9    0.0000   0.0000          ?        ?  1335.7872  21.0712          ?        ?      365.4        2.9       ?       ? 
1 1 1   12   11   61 o    114.8    8.1    0.0000   0.0000          ?        ?   132.1740  18.5171          ?        ?      114.8        8.1       ?       ? 
1 1 1   12   11   62 o    100.9    8.9    0.0000   0.0000          ?        ?   102.1635  17.8786          ?        ?      100.9        8.9       ?       ? 
1 1 1   12   11   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12   11   64 o    162.8    5.9    0.0000   0.0000          ?        ?   265.6250  19.1556          ?        ?      162.8        5.9       ?       ? 
1 1 1   12   11   65 o    195.2    5.4    0.0000   0.0000          ?        ?   381.8359  21.0712          ?        ?      195.2        5.4       ?       ? 
1 1 1   12   11   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12   11   67 o    498.1    2.8    0.0000   0.0000          ?        ?  2481.9336  28.0950          ?        ?      498.1        2.8       ?       ? 
1 1 1   12   11   68 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12   11   69 o    129.0    7.7    0.0000   0.0000          ?        ?   167.2927  19.7942          ?        ?      129.0        7.7       ?       ? 
1 1 1   12   11   70 o    108.3    9.4    0.0000   0.0000          ?        ?   118.1265  20.4327          ?        ?      108.3        9.4       ?       ? 
1 1 1   12   11   71 o    172.8    6.1    0.0000   0.0000          ?        ?   299.4666  21.0712          ?        ?      172.8        6.1       ?       ? 
1 1 1   12   11   72 f     80.8   12.6    0.0000   0.0000          ?        ?    66.4062  20.4327          ?        ?       80.8       12.6       ?       ? 
1 1 1   12   11   73 o    314.6    3.8    0.0000   0.0000          ?        ?   990.9855  23.6253          ?        ?      314.6        3.8       ?       ? 
1 1 1   12   11   74 o     69.4   16.7    0.0000   0.0000          ?        ?    51.7203  22.9868          ?        ?       69.4       16.7       ?       ? 
1 1 1   12   11   75 o     24.5   12.2    0.0000   0.0000          ?        ?   -51.0817  22.3483          ?        ?       24.5       12.2       ?       ? 
1 1 1   12   11   76 o     48.4   17.5    0.0000   0.0000          ?        ?    21.0712  21.7097          ?        ?       48.4       17.5       ?       ? 
1 1 1   12   11   77 o     64.6   17.0    0.0000   0.0000          ?        ?    45.3350  22.3483          ?        ?       64.6       17.0       ?       ? 
1 1 1   12   11   78 o    137.5    7.4    0.0000   0.0000          ?        ?   190.9180  20.4327          ?        ?      137.5        7.4       ?       ? 
1 1 1   12   11   79 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12   12    0 o   1153.4    8.5 13306.1514 196.6647 13306.1514 196.6647 13306.1514 196.6647     1153.4      8.5     1153.4        8.5     0.0     0.0 
1 1 1   12   12    1 o   1566.4    9.7 24546.0488 303.9363 24546.0488 303.9363 24546.0488 303.9363     1566.4      9.7     1566.4        9.7     0.0     0.0 
1 1 1   12   12    2 o     96.1    2.7   92.5856   5.1082    92.5856   5.1082    92.5856   5.1082       96.1      2.7       96.1        2.7     0.0     0.0 
1 1 1   12   12    3 o   2678.6   14.9 71797.9297 797.5135 71797.9297 797.5135 71797.9297 797.5135     2678.6     14.9     2678.6       14.9     0.0     0.0 
1 1 1   12   12    4 o    197.7    1.9  390.7752   7.6623   390.7752   7.6623   390.7752   7.6623      197.7      1.9      197.7        1.9     0.0     0.0 
1 1 1   12   12    5 o    913.1    4.4 8338.4541  80.4537  8338.4541  80.4537  8338.4541  80.4537      913.1      4.4      913.1        4.4     0.0     0.0 
1 1 1   12   12    6 o    117.4    2.5  137.9207   5.7467   137.9207   5.7467   137.9207   5.7467      117.4      2.5      117.4        2.5     0.0     0.0 
1 1 1   12   12    7 o   1000.2    4.9 10005.6338  97.6938 10005.6338  97.6938 10005.6338  97.6938     1000.2      4.9     1000.2        4.9     0.0     0.0 
1 1 1   12   12    8 o    895.5    4.5 8019.8315  80.4537  8019.8315  80.4537  8019.8315  80.4537      895.5      4.5      895.5        4.5     0.0     0.0 
1 1 1   12   12    9 o    289.3    2.5  837.1019  14.6860   837.1019  14.6860   837.1019  14.6860      289.3      2.5      289.3        2.5     0.0     0.0 
1 1 1   12   12   10 o    694.8    3.8 4827.8618  52.9973  4827.8618  52.9973  4827.8618  52.9973      694.8      3.8      694.8        3.8     0.0     0.0 
1 1 1   12   12   11 o   2275.1   10.3 51776.4414 469.9519 51776.4414 469.9519 51776.4414 469.9519     2275.1     10.3     2275.1       10.3     0.0     0.0 
1 1 1   12   12   12 o    213.9    2.5  457.8200  10.8549   457.8200  10.8549   457.8200  10.8549      213.9      2.5      213.9        2.5     0.0     0.0 
1 1 1   12   12   13 o   1164.4    5.8 13560.2832 136.0051 13560.2832 136.0051 13560.2832 136.0051     1164.4      5.8     1164.4        5.8     0.0     0.0 
1 1 1   12   12   14 o   1159.4    5.6 13444.7119 128.9814 13444.7119 128.9814 13444.7119 128.9814     1159.4      5.6     1159.4        5.6     0.0     0.0 
1 1 1   12   12   15 o    933.4    4.7 8713.9043  87.4775  8713.9043  87.4775  8713.9043  87.4775      933.4      4.7      933.4        4.7     0.0     0.0 
1 1 1   12   12   16 o    862.1    4.4 7432.3916  75.9841  7432.3916  75.9841  7432.3916  75.9841      862.1      4.4      862.1        4.4     0.0     0.0 
1 1 1   12   12   17 o   1323.3    6.3 17514.6484 166.6541 17514.6484 166.6541 17514.6484 166.6541     1323.3      6.3     1323.3        6.3     0.0     0.0 
1 1 1   12   12   18 o    791.1    4.1 6258.7891  65.1292  6258.7891  65.1292  6258.7891  65.1292      791.1      4.1      791.1        4.1     0.0     0.0 
1 1 1   12   12   19 o   1963.7    9.1 38568.6211 356.2951 38568.6211 356.2951 38568.6211 356.2951     1963.7      9.1     1963.7        9.1     0.0     0.0 
1 1 1   12   12   20 o   1575.2    7.7 24816.7812 241.9997 24816.7812 241.9997 24816.7812 241.9997     1575.2      7.7     1575.2        7.7     0.0     0.0 
1 1 1   12   12   21 o   1782.8    8.3 31790.7129 294.3585 31790.7129 294.3585 31790.7129 294.3585     1782.8      8.3     1782.8        8.3     0.0     0.0 
1 1 1   12   12   22 o   1173.2    6.3 13765.8867 147.4985 13765.8867 147.4985 13765.8867 147.4985     1173.2      6.3     1173.2        6.3     0.0     0.0 
1 1 1   12   12   23 o   1557.8    9.7 24272.7598 301.3822 24272.7598 301.3822 24272.7598 301.3822     1557.8      9.7     1557.8        9.7     0.0     0.0 
1 1 1   12   12   24 o   3024.1   21.1 91524.4141 1277.0432 91524.4141 1277.0432 91524.4141 1277.0432     3024.1     21.1     3024.1       21.1     0.0     0.0 
1 1 1   12   12   25 o   1656.7   11.0 27454.5156 365.8729 27454.5156 365.8729 27454.5156 365.8729     1656.7     11.0     1656.7       11.0     0.0     0.0 
1 1 1   12   12   26 o   1369.5    6.8 18759.1270 185.8098 18759.1270 185.8098 18759.1270 185.8098     1369.5      6.8     1369.5        6.8     0.0     0.0 
1 1 1   12   12   27 o   1137.6    5.8 12943.4717 132.1740 12943.4717 132.1740 12943.4717 132.1740     1137.6      5.8     1137.6        5.8     0.0     0.0 
1 1 1   12   12   28 o   1291.9    6.5 16692.2324 168.5697 16692.2324 168.5697 16692.2324 168.5697     1291.9      6.5     1291.9        6.5     0.0     0.0 
1 1 1   12   12   29 o    288.2    3.5  830.7167  20.4327   830.7167  20.4327   830.7167  20.4327      288.2      3.5      288.2        3.5     0.0     0.0 
1 1 1   12   12   30 f     13.9   10.4  -73.4300  22.3483   -73.4300  22.3483   -73.4300  22.3483       13.9     10.4       13.9       10.4     0.0     0.0 
1 1 1   12   12   31 o    865.1    5.1 7484.7500  88.7545  7484.7500  88.7545  7484.7500  88.7545      865.1      5.1      865.1        5.1     0.0     0.0 
1 1 1   12   12   32 o   1293.8    6.2 16742.0371 160.9075 16742.0371 160.9075 16742.0371 160.9075     1293.8      6.2     1293.8        6.2     0.0     0.0 
1 1 1   12   12   33 o    808.7    4.7 6541.0156  76.6226  6541.0156  76.6226  6541.0156  76.6226      808.7      4.7      808.7        4.7     0.0     0.0 
1 1 1   12   12   34 o    832.2    4.6 6926.6831  77.2611  6926.6831  77.2611  6926.6831  77.2611      832.2      4.6      832.2        4.6     0.0     0.0 
1 1 1   12   12   35 o    301.4    4.2  909.2548  25.5409   909.2548  25.5409   909.2548  25.5409      301.4      4.2      301.4        4.2     0.0     0.0 
1 1 1   12   12   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12   12   37 o    649.0    4.1 4212.9658  53.6358  4212.9658  53.6358  4212.9658  53.6358      649.0      4.1      649.0        4.1     0.0     0.0 
1 1 1   12   12   38 o    176.2    7.3  312.2371  25.5409   312.2371  25.5409   312.2371  25.5409      176.2      7.3      176.2        7.3     0.0     0.0 
1 1 1   12   12   39 f     17.9   13.3  -71.5144  29.3720   -71.5144  29.3720   -71.5144  29.3720       17.9     13.3       17.9       13.3     0.0     0.0 
1 1 1   12   12   40 o    639.5    4.0 4089.7310  51.0817  4089.7310  51.0817  4089.7310  51.0817      639.5      4.0      639.5        4.0     0.0     0.0 
1 1 1   12   12   41 o    857.6    4.8 7355.7690  83.0078  7355.7690  83.0078  7355.7690  83.0078      857.6      4.8      857.6        4.8     0.0     0.0 
1 1 1   12   12   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12   12   43 o    366.1    4.1 1340.8954  30.0105  1340.8954  30.0105  1340.8954  30.0105      366.1      4.1      366.1        4.1     0.0     0.0 
1 1 1   12   12   44 o    247.8    5.5  614.8964  27.4564   614.8964  27.4564   614.8964  27.4564      247.8      5.5      247.8        5.5     0.0     0.0 
1 1 1   12   12   45 o    180.4    7.8  327.5616  28.0950   327.5616  28.0950   327.5616  28.0950      180.4      7.8      180.4        7.8     0.0     0.0 
1 1 1   12   12   46 o    571.8    4.0 3269.8691  45.3350  3269.8691  45.3350  3269.8691  45.3350      571.8      4.0      571.8        4.0     0.0     0.0 
1 1 1   12   12   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12   12   48 o    145.6    9.1  214.5433  26.1794   214.5433  26.1794   214.5433  26.1794      145.6      9.1      145.6        9.1     0.0     0.0 
1 1 1   12   12   49 o    308.5    4.7  952.6743  28.7335   952.6743  28.7335   952.6743  28.7335      308.5      4.7      308.5        4.7     0.0     0.0 
1 1 1   12   12   50 o    573.0    4.0 3283.9167  45.3350  3283.9167  45.3350  3283.9167  45.3350      573.0      4.0      573.0        4.0     0.0     0.0 
1 1 1   12   12   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12   12   52 o    101.8   12.5  108.5487  24.9023   108.5487  24.9023   108.5487  24.9023      101.8     12.5      101.8       12.5     0.0     0.0 
1 1 1   12   12   53 o    274.4    5.1  754.0941  28.0950   754.0941  28.0950   754.0941  28.0950      274.4      5.1      274.4        5.1     0.0     0.0 
1 1 1   12   12   54 o    483.7    4.0 2340.1816  38.3113  2340.1816  38.3113  2340.1816  38.3113      483.7      4.0      483.7        4.0     0.0     0.0 
1 1 1   12   12   55 o     58.8   23.2   47.8891  26.1794    47.8891  26.1794    47.8891  26.1794       58.8     23.2       58.8       23.2     0.0     0.0 
1 1 1   12   12   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12   12   57 o    467.0    3.8 2181.8284  35.7572  2181.8284  35.7572  2181.8284  35.7572      467.0      3.8      467.0        3.8     0.0     0.0 
1 1 1   12   12   58 o     18.3   13.4  -54.2743  26.8179   -54.2743  26.8179   -54.2743  26.8179       18.3     13.4       18.3       13.4     0.0     0.0 
1 1 1   12   12   59 o     21.9   15.6  -35.1187  28.0950   -35.1187  28.0950   -35.1187  28.0950       21.9     15.6       21.9       15.6     0.0     0.0 
1 1 1   12   12   60 o    266.0    5.3  708.7590  28.0950   708.7590  28.0950   708.7590  28.0950      266.0      5.3      266.0        5.3     0.0     0.0 
1 1 1   12   12   61 o    178.9    7.7  322.4534  27.4564   322.4534  27.4564   322.4534  27.4564      178.9      7.7      178.9        7.7     0.0     0.0 
1 1 1   12   12   62 o     60.4   23.4   50.4432  26.8179    50.4432  26.8179    50.4432  26.8179       60.4     23.4       60.4       23.4     0.0     0.0 
1 1 1   12   12   63 o     17.2   12.7  -63.8522  26.8179   -63.8522  26.8179   -63.8522  26.8179       17.2     12.7       17.2       12.7     0.0     0.0 
1 1 1   12   12   64 o    464.6    4.3 2160.1187  39.5883  2160.1187  39.5883  2160.1187  39.5883      464.6      4.3      464.6        4.3     0.0     0.0 
1 1 1   12   12   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12   12   66 o    584.5    4.1 3418.6450  47.8891  3418.6450  47.8891  3418.6450  47.8891      584.5      4.1      584.5        4.1     0.0     0.0 
1 1 1   12   12   67 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   12   12   68 o     65.5   24.6   58.7440  30.0105    58.7440  30.0105    58.7440  30.0105       65.5     24.6       65.5       24.6     0.0     0.0 
1 1 1   12   12   69 o    110.4   14.1  124.5117  31.2876   124.5117  31.2876   124.5117  31.2876      110.4     14.1      110.4       14.1     0.0     0.0 
1 1 1   12   12   70 o    205.2    7.2  423.3398  29.3720   423.3398  29.3720   423.3398  29.3720      205.2      7.2      205.2        7.2     0.0     0.0 
1 1 1   12   12   71 o    174.6    9.0  308.4059  31.2876   308.4059  31.2876   308.4059  31.2876      174.6      9.0      174.6        9.0     0.0     0.0 
1 1 1   12   12   72 o     37.8   22.8   15.9630  30.6490    15.9630  30.6490    15.9630  30.6490       37.8     22.8       37.8       22.8     0.0     0.0 
1 1 1   12   12   73 o     23.1   16.5  -35.7572  30.6490   -35.7572  30.6490   -35.7572  30.6490       23.1     16.5       23.1       16.5     0.0     0.0 
1 1 1   12   12   74 o    140.3   10.8  201.7728  30.0105   201.7728  30.0105   201.7728  30.0105      140.3     10.8      140.3       10.8     0.0     0.0 
1 1 1   12   12   75 o     49.1   24.2   37.0343  28.0950    37.0343  28.0950    37.0343  28.0950       49.1     24.2       49.1       24.2     0.0     0.0 
1 1 1   12   12   76 o     26.7   18.3  -14.0475  29.3720   -14.0475  29.3720   -14.0475  29.3720       26.7     18.3       26.7       18.3     0.0     0.0 
1 1 1   12   12   77 o     51.4   24.8   40.8654  29.3720    40.8654  29.3720    40.8654  29.3720       51.4     24.8       51.4       24.8     0.0     0.0 
1 1 1   12   12   78 o     37.6   22.7   16.6016  30.6490    16.6016  30.6490    16.6016  30.6490       37.6     22.7       37.6       22.7     0.0     0.0 
1 1 1   13    0    0 o    527.8    3.9 2785.8699  40.8654  2785.8699  40.8654  2785.8699  40.8654      527.8      3.9      527.8        3.9     0.0     0.0 
1 1 1   13    0    1 o      8.7    6.2   -5.7467   4.4697    -5.7467   4.4697    -5.7467   4.4697        8.7      6.2        8.7        6.2     0.0     0.0 
1 1 1   13    0    2 o    583.2    3.0 3402.0432  35.1187  3402.0432  35.1187  3402.0432  35.1187      583.2      3.0      583.2        3.0     0.0     0.0 
1 1 1   13    0    3 o   2010.3    9.1 40420.3320 367.1499 40420.3320 367.1499 40420.3320 367.1499     2010.3      9.1     2010.3        9.1     0.0     0.0 
1 1 1   13    0    4 o    407.7    2.3 1662.0717  18.5171  1662.0717  18.5171  1662.0717  18.5171      407.7      2.3      407.7        2.3     0.0     0.0 
1 1 1   13    0    5 o    858.9    4.2 7378.1172  71.5144  7378.1172  71.5144  7378.1172  71.5144      858.9      4.2      858.9        4.2     0.0     0.0 
1 1 1   13    0    6 o   2939.7   17.2 86464.7734 1013.9724 86464.7734 1013.9724 86464.7734 1013.9724     2939.7     17.2     2939.7       17.2     0.0     0.0 
1 1 1   13    0    7 o    650.5    3.3 4231.4829  43.4195  4231.4829  43.4195  4231.4829  43.4195      650.5      3.3      650.5        3.3     0.0     0.0 
1 1 1   13    0    8 o    159.0    2.0  252.8546   6.3852   252.8546   6.3852   252.8546   6.3852      159.0      2.0      159.0        2.0     0.0     0.0 
1 1 1   13    0    9 o   2361.5   10.6 55778.6914 502.5165 55778.6914 502.5165 55778.6914 502.5165     2361.5     10.6     2361.5       10.6     0.0     0.0 
1 1 1   13    0   10 o   2622.0   11.8 68768.7812 618.0889 68768.7812 618.0889 68768.7812 618.0889     2622.0     11.8     2622.0       11.8     0.0     0.0 
1 1 1   13    0   11 o   1039.1    5.0 10799.3164 103.4405 10799.3164 103.4405 10799.3164 103.4405     1039.1      5.0     1039.1        5.0     0.0     0.0 
1 1 1   13    0   12 f    110.9    2.9  123.2347   6.3852   123.2347   6.3852   123.2347   6.3852      110.9      2.9      110.9        2.9     0.0     0.0 
1 1 1   13    0   13 o    530.7    2.9 2816.5190  30.6490  2816.5190  30.6490  2816.5190  30.6490      530.7      2.9      530.7        2.9     0.0     0.0 
1 1 1   13    0   14 o    820.8    4.1 6737.6797  67.0448  6737.6797  67.0448  6737.6797  67.0448      820.8      4.1      820.8        4.1     0.0     0.0 
1 1 1   13    0   15 o   1024.2    5.0 10490.9102 101.5249 10490.9102 101.5249 10490.9102 101.5249     1024.2      5.0     1024.2        5.0     0.0     0.0 
1 1 1   13    0   16 o   1137.6    5.5 12942.1953 124.5117 12942.1953 124.5117 12942.1953 124.5117     1137.6      5.5     1137.6        5.5     0.0     0.0 
1 1 1   13    0   17 o    407.9    2.7 1663.9874  21.7097  1663.9874  21.7097  1663.9874  21.7097      407.9      2.7      407.9        2.7     0.0     0.0 
1 1 1   13    0   18 o    955.5    4.7 9131.4980  89.3930  9131.4980  89.3930  9131.4980  89.3930      955.5      4.7      955.5        4.7     0.0     0.0 
1 1 1   13    0   19 o    615.3    3.5 3786.4333  42.7809  3786.4333  42.7809  3786.4333  42.7809      615.3      3.5      615.3        3.5     0.0     0.0 
1 1 1   13    0   20 o    502.4    3.1 2524.0759  30.6490  2524.0759  30.6490  2524.0759  30.6490      502.4      3.1      502.4        3.1     0.0     0.0 
1 1 1   13    0   21 o   1461.8    6.9 21373.2344 200.4958 21373.2344 200.4958 21373.2344 200.4958     1461.8      6.9     1461.8        6.9     0.0     0.0 
1 1 1   13    0   22 f    421.2    2.7 1774.4515  22.3483  1774.4515  22.3483  1774.4515  22.3483      421.2      2.7      421.2        2.7     0.0     0.0 
1 1 1   13    0   23 o     88.4    5.8   79.1767  10.2163    79.1767  10.2163    79.1767  10.2163       88.4      5.8       88.4        5.8     0.0     0.0 
1 1 1   13    0   24 o    306.3    3.1  938.6268  19.1556   938.6268  19.1556   938.6268  19.1556      306.3      3.1      306.3        3.1     0.0     0.0 
1 1 1   13    0   25 o   1068.3    5.2 11413.5742 111.7413 11413.5742 111.7413 11413.5742 111.7413     1068.3      5.2     1068.3        5.2     0.0     0.0 
1 1 1   13    0   26 o    524.1    3.7 2747.5586  38.9498  2747.5586  38.9498  2747.5586  38.9498      524.1      3.7      524.1        3.7     0.0     0.0 
1 1 1   13    0   27 o   1949.2    8.9 38002.8945 347.3558 38002.8945 347.3558 38002.8945 347.3558     1949.2      8.9     1949.2        8.9     0.0     0.0 
1 1 1   13    0   28 o    711.2    4.6 5059.0068  65.7677  5059.0068  65.7677  5059.0068  65.7677      711.2      4.6      711.2        4.6     0.0     0.0 
1 1 1   13    0   29 o    907.5    4.7 8235.6523  84.9234  8235.6523  84.9234  8235.6523  84.9234      907.5      4.7      907.5        4.7     0.0     0.0 
1 1 1   13    0   30 o    692.9    4.1 4802.3208  57.4669  4802.3208  57.4669  4802.3208  57.4669      692.9      4.1      692.9        4.1     0.0     0.0 
1 1 1   13    0   31 o    670.6    4.3 4497.7466  58.1055  4497.7466  58.1055  4497.7466  58.1055      670.6      4.3      670.6        4.3     0.0     0.0 
1 1 1   13    0   32 o    468.7    4.2 2197.1531  38.9498  2197.1531  38.9498  2197.1531  38.9498      468.7      4.2      468.7        4.2     0.0     0.0 
1 1 1   13    0   33 o   2801.6   16.4 78526.6641 918.8326 78526.6641 918.8326 78526.6641 918.8326     2801.6     16.4     2801.6       16.4     0.0     0.0 
1 1 1   13    0   34 o    493.2    3.9 2433.4060  38.3113  2433.4060  38.3113  2433.4060  38.3113      493.2      3.9      493.2        3.9     0.0     0.0 
1 1 1   13    0   35 o    441.8    3.5 1952.5990  31.2876  1952.5990  31.2876  1952.5990  31.2876      441.8      3.5      441.8        3.5     0.0     0.0 
1 1 1   13    0   36 o    334.8    4.0 1121.2440  26.8179  1121.2440  26.8179  1121.2440  26.8179      334.8      4.0      334.8        4.0     0.0     0.0 
1 1 1   13    0   37 o    991.3    5.0 9827.4863  98.9709  9827.4863  98.9709  9827.4863  98.9709      991.3      5.0      991.3        5.0     0.0     0.0 
1 1 1   13    0   38 o   1043.2    5.2 10883.6016 108.5487 10883.6016 108.5487 10883.6016 108.5487     1043.2      5.2     1043.2        5.2     0.0     0.0 
1 1 1   13    0   39 o   1104.0    5.6 12190.0166 123.8732 12190.0166 123.8732 12190.0166 123.8732     1104.0      5.6     1104.0        5.6     0.0     0.0 
1 1 1   13    0   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    0   41 o    136.4    8.7  188.3639  23.6253   188.3639  23.6253   188.3639  23.6253      136.4      8.7      136.4        8.7     0.0     0.0 
1 1 1   13    0   42 o    890.5    4.6 7930.4385  81.7308  7930.4385  81.7308  7930.4385  81.7308      890.5      4.6      890.5        4.6     0.0     0.0 
1 1 1   13    0   43 o    304.1    5.6  925.8564  33.8416   925.8564  33.8416   925.8564  33.8416      304.1      5.6      304.1        5.6     0.0     0.0 
1 1 1   13    0   44 o   1022.3    5.2 10452.5986 106.6331 10452.5986 106.6331 10452.5986 106.6331     1022.3      5.2     1022.3        5.2     0.0     0.0 
1 1 1   13    0   45 o    482.6    4.2 2329.3269  40.2269  2329.3269  40.2269  2329.3269  40.2269      482.6      4.2      482.6        4.2     0.0     0.0 
1 1 1   13    0   46 o    286.6    6.6  823.0543  37.6728   823.0543  37.6728   823.0543  37.6728      286.6      6.6      286.6        6.6     0.0     0.0 
1 1 1   13    0   47 o   1362.1    7.2 18559.2695 195.3876 18559.2695 195.3876 18559.2695 195.3876     1362.1      7.2     1362.1        7.2     0.0     0.0 
1 1 1   13    0   48 o    779.9    4.3 6083.8340  67.6833  6083.8340  67.6833  6083.8340  67.6833      779.9      4.3      779.9        4.3     0.0     0.0 
1 1 1   13    0   49 o    521.5    4.0 2720.7407  42.1424  2720.7407  42.1424  2720.7407  42.1424      521.5      4.0      521.5        4.0     0.0     0.0 
1 1 1   13    0   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    0   51 o    237.0    6.5  563.1760  30.6490   563.1760  30.6490   563.1760  30.6490      237.0      6.5      237.0        6.5     0.0     0.0 
1 1 1   13    0   52 o    341.7    4.8 1168.4946  32.5646  1168.4946  32.5646  1168.4946  32.5646      341.7      4.8      341.7        4.8     0.0     0.0 
1 1 1   13    0   53 o    211.4    6.5  448.2422  27.4564   448.2422  27.4564   448.2422  27.4564      211.4      6.5      211.4        6.5     0.0     0.0 
1 1 1   13    0   54 o    132.7   10.2  179.4246  26.8179   179.4246  26.8179   179.4246  26.8179      132.7     10.2      132.7       10.2     0.0     0.0 
1 1 1   13    0   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    0   56 o    401.5    4.1 1612.9056  32.5646  1612.9056  32.5646  1612.9056  32.5646      401.5      4.1      401.5        4.1     0.0     0.0 
1 1 1   13    0   57 o    372.0    4.2 1384.9534  31.2876  1384.9534  31.2876  1384.9534  31.2876      372.0      4.2      372.0        4.2     0.0     0.0 
1 1 1   13    0   58 o    363.2    4.3 1319.8242  31.2876  1319.8242  31.2876  1319.8242  31.2876      363.2      4.3      363.2        4.3     0.0     0.0 
1 1 1   13    0   59 o     16.4   12.2  -94.5012  30.0105   -94.5012  30.0105   -94.5012  30.0105       16.4     12.2       16.4       12.2     0.0     0.0 
1 1 1   13    0   60 o    257.3    5.7  663.4240  29.3720   663.4240  29.3720   663.4240  29.3720      257.3      5.7      257.3        5.7     0.0     0.0 
1 1 1   13    0   61 o    166.5    7.5  279.0340  24.9023   279.0340  24.9023   279.0340  24.9023      166.5      7.5      166.5        7.5     0.0     0.0 
1 1 1   13    0   62 o    175.6    7.7  310.3215  26.8179   310.3215  26.8179   310.3215  26.8179      175.6      7.7      175.6        7.7     0.0     0.0 
1 1 1   13    0   63 o     21.4   15.5  -47.2506  30.6490   -47.2506  30.6490   -47.2506  30.6490       21.4     15.5       21.4       15.5     0.0     0.0 
1 1 1   13    0   64 o    308.0    5.1  950.1202  31.2876   950.1202  31.2876   950.1202  31.2876      308.0      5.1      308.0        5.1     0.0     0.0 
1 1 1   13    0   65 o    279.0    5.4  779.6349  30.0105   779.6349  30.0105   779.6349  30.0105      279.0      5.4      279.0        5.4     0.0     0.0 
1 1 1   13    0   66 o    544.8    4.0 2970.4026  43.4195  2970.4026  43.4195  2970.4026  43.4195      544.8      4.0      544.8        4.0     0.0     0.0 
1 1 1   13    0   67 o     99.3   14.8  103.4405  28.0950   103.4405  28.0950   103.4405  28.0950       99.3     14.8       99.3       14.8     0.0     0.0 
1 1 1   13    0   68 o    396.0    4.3 1569.4862  33.8416  1569.4862  33.8416  1569.4862  33.8416      396.0      4.3      396.0        4.3     0.0     0.0 
1 1 1   13    0   69 o     39.9   23.2   20.4327  30.0105    20.4327  30.0105    20.4327  30.0105       39.9     23.2       39.9       23.2     0.0     0.0 
1 1 1   13    0   70 o    219.4    6.9  483.3608  30.0105   483.3608  30.0105   483.3608  30.0105      219.4      6.9      219.4        6.9     0.0     0.0 
1 1 1   13    0   71 o    213.8    7.3  459.7356  31.2876   459.7356  31.2876   459.7356  31.2876      213.8      7.3      213.8        7.3     0.0     0.0 
1 1 1   13    0   72 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    0   73 o    295.8    5.6  877.3287  33.2031   877.3287  33.2031   877.3287  33.2031      295.8      5.6      295.8        5.6     0.0     0.0 
1 1 1   13    0   74 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    0   75 o     34.2   21.8    5.7467  31.9261     5.7467  31.9261     5.7467  31.9261       34.2     21.8       34.2       21.8     0.0     0.0 
1 1 1   13    0   76 o    410.3    4.4 1685.6971  36.3957  1685.6971  36.3957  1685.6971  36.3957      410.3      4.4      410.3        4.4     0.0     0.0 
1 1 1   13    0   77 o    145.0   10.0  214.5433  28.7335   214.5433  28.7335   214.5433  28.7335      145.0     10.0      145.0       10.0     0.0     0.0 
1 1 1   13    0   78 o     29.4   19.5   -4.4697  29.3720    -4.4697  29.3720    -4.4697  29.3720       29.4     19.5       29.4       19.5     0.0     0.0 
1 1 1   13    0   79 o    337.0    5.3 1139.1226  35.7572  1139.1226  35.7572  1139.1226  35.7572      337.0      5.3      337.0        5.3     0.0     0.0 
1 1 1   13    0   80 o     42.3   23.9   26.1794  30.6490    26.1794  30.6490    26.1794  30.6490       42.3     23.9       42.3       23.9     0.0     0.0 
1 1 1   13    0   81 o    200.2    8.0  405.4612  31.9261   405.4612  31.9261   405.4612  31.9261      200.2      8.0      200.2        8.0     0.0     0.0 
1 1 1   13    1    0 o   1731.0    8.0 29969.0117 276.4799 29969.0117 276.4799 29969.0117 276.4799     1731.0      8.0     1731.0        8.0     0.0     0.0 
1 1 1   13    1    1 o    820.6    2.8    0.0000   0.0000          ?        ?  6734.4873  46.6121          ?        ?      820.6        2.8       ?       ? 
1 1 1   13    1    2 o    406.0    1.7    0.0000   0.0000          ?        ?  1648.0244  13.4090          ?        ?      406.0        1.7       ?       ? 
1 1 1   13    1    3 o   1387.7    4.6    0.0000   0.0000          ?        ? 19258.4512 127.0658          ?        ?     1387.7        4.6       ?       ? 
1 1 1   13    1    4 o   1106.7    3.7    0.0000   0.0000          ?        ? 12247.4834  82.3693          ?        ?     1106.7        3.7       ?       ? 
1 1 1   13    1    5 o    635.9    2.3    0.0000   0.0000          ?        ?  4043.7573  29.3720          ?        ?      635.9        2.3       ?       ? 
1 1 1   13    1    6 o    990.1    3.3    0.0000   0.0000          ?        ?  9803.2227  65.7677          ?        ?      990.1        3.3       ?       ? 
1 1 1   13    1    7 o   1105.2    3.7    0.0000   0.0000          ?        ? 12215.5566  81.7308          ?        ?     1105.2        3.7       ?       ? 
1 1 1   13    1    8 o   1068.4    3.6    0.0000   0.0000          ?        ? 11414.8506  76.6226          ?        ?     1068.4        3.6       ?       ? 
1 1 1   13    1    9 o   1763.1    5.7    0.0000   0.0000          ?        ? 31087.7031 201.7728          ?        ?     1763.1        5.7       ?       ? 
1 1 1   13    1   10 o    269.2    1.4    0.0000   0.0000          ?        ?   724.7220   7.6623          ?        ?      269.2        1.4       ?       ? 
1 1 1   13    1   11 o   1531.8    5.0    0.0000   0.0000          ?        ? 23466.3086 152.6067          ?        ?     1531.8        5.0       ?       ? 
1 1 1   13    1   12 o    736.8    2.6    0.0000   0.0000          ?        ?  5428.7109  38.3113          ?        ?      736.8        2.6       ?       ? 
1 1 1   13    1   13 o   1309.9    4.4    0.0000   0.0000          ?        ? 17158.9922 114.2954          ?        ?     1309.9        4.4       ?       ? 
1 1 1   13    1   14 o    838.0    2.9    0.0000   0.0000          ?        ?  7022.4609  49.1662          ?        ?      838.0        2.9       ?       ? 
1 1 1   13    1   15 o    723.9    2.6    0.0000   0.0000          ?        ?  5240.3472  37.6728          ?        ?      723.9        2.6       ?       ? 
1 1 1   13    1   16 o    670.0    2.5    0.0000   0.0000          ?        ?  4488.8071  33.2031          ?        ?      670.0        2.5       ?       ? 
1 1 1   13    1   17 o    598.8    2.2    0.0000   0.0000          ?        ?  3585.2988  26.8179          ?        ?      598.8        2.2       ?       ? 
1 1 1   13    1   18 f    859.8    3.2    0.0000   0.0000          ?        ?  7392.1646  54.2743          ?        ?      859.8        3.2       ?       ? 
1 1 1   13    1   19 o    509.0    2.1    0.0000   0.0000          ?        ?  2590.4824  21.0712          ?        ?      509.0        2.1       ?       ? 
1 1 1   13    1   20 o   1262.6    4.2    0.0000   0.0000          ?        ? 15943.2461 107.2716          ?        ?     1262.6        4.2       ?       ? 
1 1 1   13    1   21 o    237.0    1.8    0.0000   0.0000          ?        ?   561.8990   8.3008          ?        ?      237.0        1.8       ?       ? 
1 1 1   13    1   22 o    691.5    2.6    0.0000   0.0000          ?        ?  4781.2500  36.3957          ?        ?      691.5        2.6       ?       ? 
1 1 1   13    1   23 o    914.9    3.2    0.0000   0.0000          ?        ?  8371.6572  58.7440          ?        ?      914.9        3.2       ?       ? 
1 1 1   13    1   24 o    748.8    2.8    0.0000   0.0000          ?        ?  5607.4971  42.1424          ?        ?      748.8        2.8       ?       ? 
1 1 1   13    1   25 o   1225.7    4.1    0.0000   0.0000          ?        ? 15024.4141 101.5249          ?        ?     1225.7        4.1       ?       ? 
1 1 1   13    1   26 o   1043.8    3.8    0.0000   0.0000          ?        ? 10896.3711  79.8152          ?        ?     1043.8        3.8       ?       ? 
1 1 1   13    1   27 o   1182.8    4.0    0.0000   0.0000          ?        ? 13991.2852  94.5012          ?        ?     1182.8        4.0       ?       ? 
1 1 1   13    1   28 o    340.5    2.5    0.0000   0.0000          ?        ?  1159.5553  17.2401          ?        ?      340.5        2.5       ?       ? 
1 1 1   13    1   29 o    670.5    2.8    0.0000   0.0000          ?        ?  4496.4692  37.0343          ?        ?      670.5        2.8       ?       ? 
1 1 1   13    1   30 o    402.6    2.5    0.0000   0.0000          ?        ?  1620.5679  19.7942          ?        ?      402.6        2.5       ?       ? 
1 1 1   13    1   31 o    230.8    3.0    0.0000   0.0000          ?        ?   532.5270  14.0475          ?        ?      230.8        3.0       ?       ? 
1 1 1   13    1   32 o    442.8    2.2    0.0000   0.0000          ?        ?  1960.8999  19.7942          ?        ?      442.8        2.2       ?       ? 
1 1 1   13    1   33 o    437.2    2.4    0.0000   0.0000          ?        ?  1911.7338  21.0712          ?        ?      437.2        2.4       ?       ? 
1 1 1   13    1   34 f    502.1    2.4    0.0000   0.0000          ?        ?  2520.8833  24.2638          ?        ?      502.1        2.4       ?       ? 
1 1 1   13    1   35 o    408.1    2.7    0.0000   0.0000          ?        ?  1665.2643  21.7097          ?        ?      408.1        2.7       ?       ? 
1 1 1   13    1   36 o   1414.8    4.9    0.0000   0.0000          ?        ? 20018.2930 137.9207          ?        ?     1414.8        4.9       ?       ? 
1 1 1   13    1   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    1   38 o    256.7    3.1    0.0000   0.0000          ?        ?   658.9543  15.9630          ?        ?      256.7        3.1       ?       ? 
1 1 1   13    1   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    1   40 o    694.7    3.1    0.0000   0.0000          ?        ?  4826.5850  42.7809          ?        ?      694.7        3.1       ?       ? 
1 1 1   13    1   41 o   1560.1    5.2    0.0000   0.0000          ?        ? 24342.3594 161.5460          ?        ?     1560.1        5.2       ?       ? 
1 1 1   13    1   42 o    579.3    2.7    0.0000   0.0000          ?        ?  3356.0696  31.2876          ?        ?      579.3        2.7       ?       ? 
1 1 1   13    1   43 o    884.9    3.2    0.0000   0.0000          ?        ?  7831.4678  56.8284          ?        ?      884.9        3.2       ?       ? 
1 1 1   13    1   44 o    289.1    3.9    0.0000   0.0000          ?        ?   835.8248  22.3483          ?        ?      289.1        3.9       ?       ? 
1 1 1   13    1   45 o    887.1    3.6    0.0000   0.0000          ?        ?  7871.0557  64.4907          ?        ?      887.1        3.6       ?       ? 
1 1 1   13    1   46 o   1658.7    5.4    0.0000   0.0000          ?        ? 27519.6426 180.7016          ?        ?     1658.7        5.4       ?       ? 
1 1 1   13    1   47 o   1728.1    5.8    0.0000   0.0000          ?        ? 29872.5957 200.4958          ?        ?     1728.1        5.8       ?       ? 
1 1 1   13    1   48 o    309.7    3.7    0.0000   0.0000          ?        ?   959.0594  22.9868          ?        ?      309.7        3.7       ?       ? 
1 1 1   13    1   49 o    518.0    2.7    0.0000   0.0000          ?        ?  2683.7063  27.4564          ?        ?      518.0        2.7       ?       ? 
1 1 1   13    1   50 o     68.4   13.6    0.0000   0.0000          ?        ?    48.5276  17.8786          ?        ?       68.4       13.6       ?       ? 
1 1 1   13    1   51 o    181.8    5.1    0.0000   0.0000          ?        ?   330.7542  18.5171          ?        ?      181.8        5.1       ?       ? 
1 1 1   13    1   52 o    649.1    2.8    0.0000   0.0000          ?        ?  4213.6045  36.3957          ?        ?      649.1        2.8       ?       ? 
1 1 1   13    1   53 o    477.0    2.7    0.0000   0.0000          ?        ?  2275.6909  25.5409          ?        ?      477.0        2.7       ?       ? 
1 1 1   13    1   54 o    268.6    3.7    0.0000   0.0000          ?        ?   721.5294  19.7942          ?        ?      268.6        3.7       ?       ? 
1 1 1   13    1   55 o    240.9    3.8    0.0000   0.0000          ?        ?   580.4161  18.5171          ?        ?      240.9        3.8       ?       ? 
1 1 1   13    1   56 o    261.2    3.8    0.0000   0.0000          ?        ?   682.5797  19.7942          ?        ?      261.2        3.8       ?       ? 
1 1 1   13    1   57 o    302.8    3.4    0.0000   0.0000          ?        ?   916.9171  20.4327          ?        ?      302.8        3.4       ?       ? 
1 1 1   13    1   58 o     22.3   11.1    0.0000   0.0000          ?        ?   -43.4195  18.5171          ?        ?       22.3       11.1       ?       ? 
1 1 1   13    1   59 o    257.6    4.0    0.0000   0.0000          ?        ?   664.0625  20.4327          ?        ?      257.6        4.0       ?       ? 
1 1 1   13    1   60 o    247.9    4.1    0.0000   0.0000          ?        ?   614.8964  20.4327          ?        ?      247.9        4.1       ?       ? 
1 1 1   13    1   61 o    380.2    3.0    0.0000   0.0000          ?        ?  1446.2515  22.9868          ?        ?      380.2        3.0       ?       ? 
1 1 1   13    1   62 o    222.8    4.6    0.0000   0.0000          ?        ?   496.7698  20.4327          ?        ?      222.8        4.6       ?       ? 
1 1 1   13    1   63 f     31.2   14.1    0.0000   0.0000          ?        ?    -9.5778  18.5171          ?        ?       31.2       14.1       ?       ? 
1 1 1   13    1   64 o    204.7    4.8    0.0000   0.0000          ?        ?   419.5087  19.7942          ?        ?      204.7        4.8       ?       ? 
1 1 1   13    1   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    1   66 o    121.5    8.4    0.0000   0.0000          ?        ?   148.1370  20.4327          ?        ?      121.5        8.4       ?       ? 
1 1 1   13    1   67 o    543.8    2.7    0.0000   0.0000          ?        ?  2958.2705  29.3720          ?        ?      543.8        2.7       ?       ? 
1 1 1   13    1   68 o    290.0    3.6    0.0000   0.0000          ?        ?   841.5715  21.0712          ?        ?      290.0        3.6       ?       ? 
1 1 1   13    1   69 o    262.9    4.1    0.0000   0.0000          ?        ?   692.1575  21.7097          ?        ?      262.9        4.1       ?       ? 
1 1 1   13    1   70 o     70.5   14.9    0.0000   0.0000          ?        ?    52.3588  20.4327          ?        ?       70.5       14.9       ?       ? 
1 1 1   13    1   71 o    153.4    7.1    0.0000   0.0000          ?        ?   236.2530  21.7097          ?        ?      153.4        7.1       ?       ? 
1 1 1   13    1   72 o    203.3    5.5    0.0000   0.0000          ?        ?   414.4005  22.3483          ?        ?      203.3        5.5       ?       ? 
1 1 1   13    1   73 o    136.8    8.2    0.0000   0.0000          ?        ?   188.3639  22.3483          ?        ?      136.8        8.2       ?       ? 
1 1 1   13    1   74 f    127.6    8.8    0.0000   0.0000          ?        ?   164.1001  22.3483          ?        ?      127.6        8.8       ?       ? 
1 1 1   13    1   75 o    267.4    4.3    0.0000   0.0000          ?        ?   716.4213  22.9868          ?        ?      267.4        4.3       ?       ? 
1 1 1   13    1   76 o     46.4   16.9    0.0000   0.0000          ?        ?    18.5171  20.4327          ?        ?       46.4       16.9       ?       ? 
1 1 1   13    1   77 f     42.9   17.2    0.0000   0.0000          ?        ?    10.2163  22.3483          ?        ?       42.9       17.2       ?       ? 
1 1 1   13    1   78 o    152.2    6.7    0.0000   0.0000          ?        ?   233.0604  20.4327          ?        ?      152.2        6.7       ?       ? 
1 1 1   13    1   79 o     54.8   17.5    0.0000   0.0000          ?        ?    31.2876  21.7097          ?        ?       54.8       17.5       ?       ? 
1 1 1   13    1   80 o     34.1   15.0    0.0000   0.0000          ?        ?    -3.8311  19.7942          ?        ?       34.1       15.0       ?       ? 
1 1 1   13    1   81 o     48.8   16.8    0.0000   0.0000          ?        ?    23.6253  19.7942          ?        ?       48.8       16.8       ?       ? 
1 1 1   13    2    0 o    316.8    2.0 1003.7560  12.7704  1003.7560  12.7704  1003.7560  12.7704      316.8      2.0      316.8        2.0     0.0     0.0 
1 1 1   13    2    1 o   1244.0    4.1    0.0000   0.0000          ?        ? 15476.4873 102.8020          ?        ?     1244.0        4.1       ?       ? 
1 1 1   13    2    2 o   1432.7    4.7    0.0000   0.0000          ?        ? 20526.5547 134.0895          ?        ?     1432.7        4.7       ?       ? 
1 1 1   13    2    3 o    642.0    2.3    0.0000   0.0000          ?        ?  4121.6572  30.0105          ?        ?      642.0        2.3       ?       ? 
1 1 1   13    2    4 o    826.8    2.9    0.0000   0.0000          ?        ?  6836.0122  47.8891          ?        ?      826.8        2.9       ?       ? 
1 1 1   13    2    5 o   1062.6    3.6    0.0000   0.0000          ?        ? 11292.2549  75.9841          ?        ?     1062.6        3.6       ?       ? 
1 1 1   13    2    6 o    382.6    1.7    0.0000   0.0000          ?        ?  1464.1301  12.7704          ?        ?      382.6        1.7       ?       ? 
1 1 1   13    2    7 o   1329.7    4.4    0.0000   0.0000          ?        ? 17683.2168 118.1265          ?        ?     1329.7        4.4       ?       ? 
1 1 1   13    2    8 o    655.8    2.3    0.0000   0.0000          ?        ?  4300.4434  30.6490          ?        ?      655.8        2.3       ?       ? 
1 1 1   13    2    9 o    673.2    2.4    0.0000   0.0000          ?        ?  4532.2266  32.5646          ?        ?      673.2        2.4       ?       ? 
1 1 1   13    2   10 o    825.9    2.9    0.0000   0.0000          ?        ?  6820.6875  47.2506          ?        ?      825.9        2.9       ?       ? 
1 1 1   13    2   11 f    675.4    2.5    0.0000   0.0000          ?        ?  4562.2368  33.2031          ?        ?      675.4        2.5       ?       ? 
1 1 1   13    2   12 o    699.3    2.5    0.0000   0.0000          ?        ?  4889.7983  35.1187          ?        ?      699.3        2.5       ?       ? 
1 1 1   13    2   13 o    534.4    2.1    0.0000   0.0000          ?        ?  2855.4688  22.3483          ?        ?      534.4        2.1       ?       ? 
1 1 1   13    2   14 o    396.4    1.7    0.0000   0.0000          ?        ?  1571.4017  13.4090          ?        ?      396.4        1.7       ?       ? 
1 1 1   13    2   15 o    808.0    2.9    0.0000   0.0000          ?        ?  6528.8838  46.6121          ?        ?      808.0        2.9       ?       ? 
1 1 1   13    2   16 o    610.0    2.3    0.0000   0.0000          ?        ?  3720.6655  27.4564          ?        ?      610.0        2.3       ?       ? 
1 1 1   13    2   17 f    613.3    2.3    0.0000   0.0000          ?        ?  3760.8923  28.7335          ?        ?      613.3        2.3       ?       ? 
1 1 1   13    2   18 f    464.4    1.9    0.0000   0.0000          ?        ?  2156.2876  17.8786          ?        ?      464.4        1.9       ?       ? 
1 1 1   13    2   19 o    419.0    1.8    0.0000   0.0000          ?        ?  1755.9344  15.3245          ?        ?      419.0        1.8       ?       ? 
1 1 1   13    2   20 o     78.7    4.1    0.0000   0.0000          ?        ?    61.9366   6.3852          ?        ?       78.7        4.1       ?       ? 
1 1 1   13    2   21 o    249.0    1.8    0.0000   0.0000          ?        ?   620.0045   8.9393          ?        ?      249.0        1.8       ?       ? 
1 1 1   13    2   22 o   1445.6    4.8    0.0000   0.0000          ?        ? 20900.7285 139.8362          ?        ?     1445.6        4.8       ?       ? 
1 1 1   13    2   23 o   1418.3    4.7    0.0000   0.0000          ?        ? 20117.2637 134.0895          ?        ?     1418.3        4.7       ?       ? 
1 1 1   13    2   24 o   2010.1    6.7    0.0000   0.0000          ?        ? 40410.7539 268.1791          ?        ?     2010.1        6.7       ?       ? 
1 1 1   13    2   25 o    802.3    2.9    0.0000   0.0000          ?        ?  6436.9365  47.2506          ?        ?      802.3        2.9       ?       ? 
1 1 1   13    2   26 o    397.4    2.1    0.0000   0.0000          ?        ?  1579.0640  16.6016          ?        ?      397.4        2.1       ?       ? 
1 1 1   13    2   27 o   1516.0    5.5    0.0000   0.0000          ?        ? 22984.2246 167.2927          ?        ?     1516.0        5.5       ?       ? 
1 1 1   13    2   28 o   2029.8    6.7    0.0000   0.0000          ?        ? 41206.9922 272.6487          ?        ?     2029.8        6.7       ?       ? 
1 1 1   13    2   29 o    756.8    3.0    0.0000   0.0000          ?        ?  5727.5391  44.6965          ?        ?      756.8        3.0       ?       ? 
1 1 1   13    2   30 o   1671.9    6.2    0.0000   0.0000          ?        ? 27956.3906 206.8810          ?        ?     1671.9        6.2       ?       ? 
1 1 1   13    2   31 o   1652.2    5.7    0.0000   0.0000          ?        ? 27301.2695 187.7254          ?        ?     1652.2        5.7       ?       ? 
1 1 1   13    2   32 o    718.2    3.0    0.0000   0.0000          ?        ?  5158.6162  42.7809          ?        ?      718.2        3.0       ?       ? 
1 1 1   13    2   33 o   1148.1    4.2    0.0000   0.0000          ?        ? 13181.0020  95.7782          ?        ?     1148.1        4.2       ?       ? 
1 1 1   13    2   34 o   1210.7    4.2    0.0000   0.0000          ?        ? 14659.1797 102.8020          ?        ?     1210.7        4.2       ?       ? 
1 1 1   13    2   35 o    357.9    2.5    0.0000   0.0000          ?        ?  1280.8744  17.8786          ?        ?      357.9        2.5       ?       ? 
1 1 1   13    2   36 o    525.3    2.6    0.0000   0.0000          ?        ?  2759.6904  26.8179          ?        ?      525.3        2.6       ?       ? 
1 1 1   13    2   37 o   1057.6    3.9    0.0000   0.0000          ?        ? 11186.2607  82.3693          ?        ?     1057.6        3.9       ?       ? 
1 1 1   13    2   38 o   1168.1    4.0    0.0000   0.0000          ?        ? 13645.8467  93.2242          ?        ?     1168.1        4.0       ?       ? 
1 1 1   13    2   39 o    199.6    5.1    0.0000   0.0000          ?        ?   398.4375  20.4327          ?        ?      199.6        5.1       ?       ? 
1 1 1   13    2   40 o   1362.0    4.6    0.0000   0.0000          ?        ? 18552.8848 125.7888          ?        ?     1362.0        4.6       ?       ? 
1 1 1   13    2   41 o    421.5    2.9    0.0000   0.0000          ?        ?  1777.0056  24.2638          ?        ?      421.5        2.9       ?       ? 
1 1 1   13    2   42 o    834.8    3.2    0.0000   0.0000          ?        ?  6970.1021  52.9973          ?        ?      834.8        3.2       ?       ? 
1 1 1   13    2   43 o   1007.3    3.7    0.0000   0.0000          ?        ? 10147.3857  74.0685          ?        ?     1007.3        3.7       ?       ? 
1 1 1   13    2   44 o    612.3    3.0    0.0000   0.0000          ?        ?  3749.3992  37.0343          ?        ?      612.3        3.0       ?       ? 
1 1 1   13    2   45 o   1147.8    4.1    0.0000   0.0000          ?        ? 13175.8936  93.8627          ?        ?     1147.8        4.1       ?       ? 
1 1 1   13    2   46 o    216.6    5.0    0.0000   0.0000          ?        ?   469.3134  21.7097          ?        ?      216.6        5.0       ?       ? 
1 1 1   13    2   47 o    240.1    4.1    0.0000   0.0000          ?        ?   576.5850  19.7942          ?        ?      240.1        4.1       ?       ? 
1 1 1   13    2   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    2   49 o     35.3   14.9    0.0000   0.0000          ?        ?     1.2770  17.8786          ?        ?       35.3       14.9       ?       ? 
1 1 1   13    2   50 o    489.9    2.5    0.0000   0.0000          ?        ?  2400.2026  24.9023          ?        ?      489.9        2.5       ?       ? 
1 1 1   13    2   51 o    445.2    2.7    0.0000   0.0000          ?        ?  1981.9711  24.2638          ?        ?      445.2        2.7       ?       ? 
1 1 1   13    2   52 o     89.3   10.0    0.0000   0.0000          ?        ?    79.8152  17.8786          ?        ?       89.3       10.0       ?       ? 
1 1 1   13    2   53 o    260.4    3.8    0.0000   0.0000          ?        ?   678.1099  19.7942          ?        ?      260.4        3.8       ?       ? 
1 1 1   13    2   54 o    459.0    2.8    0.0000   0.0000          ?        ?  2107.1213  25.5409          ?        ?      459.0        2.8       ?       ? 
1 1 1   13    2   55 o    280.1    3.4    0.0000   0.0000          ?        ?   784.7431  19.1556          ?        ?      280.1        3.4       ?       ? 
1 1 1   13    2   56 o    644.7    2.8    0.0000   0.0000          ?        ?  4156.7759  35.7572          ?        ?      644.7        2.8       ?       ? 
1 1 1   13    2   57 o    549.5    2.7    0.0000   0.0000          ?        ?  3019.5688  29.3720          ?        ?      549.5        2.7       ?       ? 
1 1 1   13    2   58 o    447.3    2.8    0.0000   0.0000          ?        ?  2001.1267  24.9023          ?        ?      447.3        2.8       ?       ? 
1 1 1   13    2   59 o    345.5    3.1    0.0000   0.0000          ?        ?  1194.0354  21.7097          ?        ?      345.5        3.1       ?       ? 
1 1 1   13    2   60 o    132.4    7.0    0.0000   0.0000          ?        ?   175.5934  18.5171          ?        ?      132.4        7.0       ?       ? 
1 1 1   13    2   61 o    261.9    4.0    0.0000   0.0000          ?        ?   686.4108  21.0712          ?        ?      261.9        4.0       ?       ? 
1 1 1   13    2   62 o    233.7    4.2    0.0000   0.0000          ?        ?   546.5745  19.7942          ?        ?      233.7        4.2       ?       ? 
1 1 1   13    2   63 o    394.7    3.0    0.0000   0.0000          ?        ?  1558.6313  23.6253          ?        ?      394.7        3.0       ?       ? 
1 1 1   13    2   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    2   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    2   66 o     61.8   16.3    0.0000   0.0000          ?        ?    40.2269  20.4327          ?        ?       61.8       16.3       ?       ? 
1 1 1   13    2   67 o    106.0    9.6    0.0000   0.0000          ?        ?   113.0183  20.4327          ?        ?      106.0        9.6       ?       ? 
1 1 1   13    2   68 o     25.6   12.4    0.0000   0.0000          ?        ?   -33.2031  19.7942          ?        ?       25.6       12.4       ?       ? 
1 1 1   13    2   69 o    284.6    4.0    0.0000   0.0000          ?        ?   810.9225  22.9868          ?        ?      284.6        4.0       ?       ? 
1 1 1   13    2   70 o     55.4   17.2    0.0000   0.0000          ?        ?    31.2876  21.0712          ?        ?       55.4       17.2       ?       ? 
1 1 1   13    2   71 o    184.8    5.9    0.0000   0.0000          ?        ?   342.2476  21.7097          ?        ?      184.8        5.9       ?       ? 
1 1 1   13    2   72 o    105.6   10.0    0.0000   0.0000          ?        ?   112.3798  21.0712          ?        ?      105.6       10.0       ?       ? 
1 1 1   13    2   73 o    277.2    4.0    0.0000   0.0000          ?        ?   769.4186  22.3483          ?        ?      277.2        4.0       ?       ? 
1 1 1   13    2   74 o    108.2    9.7    0.0000   0.0000          ?        ?   118.1265  21.0712          ?        ?      108.2        9.7       ?       ? 
1 1 1   13    2   75 o    181.5    6.2    0.0000   0.0000          ?        ?   330.7542  22.3483          ?        ?      181.5        6.2       ?       ? 
1 1 1   13    2   76 o    197.8    5.6    0.0000   0.0000          ?        ?   392.6908  22.3483          ?        ?      197.8        5.6       ?       ? 
1 1 1   13    2   77 f    102.9   10.2    0.0000   0.0000          ?        ?   107.2716  21.0712          ?        ?      102.9       10.2       ?       ? 
1 1 1   13    2   78 o    147.9    7.1    0.0000   0.0000          ?        ?   220.2900  21.0712          ?        ?      147.9        7.1       ?       ? 
1 1 1   13    2   79 o     27.3   13.1    0.0000   0.0000          ?        ?   -30.0105  21.0712          ?        ?       27.3       13.1       ?       ? 
1 1 1   13    2   80 o     19.8   10.0    0.0000   0.0000          ?        ?   -73.4300  20.4327          ?        ?       19.8       10.0       ?       ? 
1 1 1   13    3    0 o     39.0    5.0   15.9630   3.8311    15.9630   3.8311    15.9630   3.8311       39.0      5.0       39.0        5.0     0.0     0.0 
1 1 1   13    3    1 o    916.3    3.2    0.0000   0.0000          ?        ?  8397.1973  58.7440          ?        ?      916.3        3.2       ?       ? 
1 1 1   13    3    2 o    862.8    3.0    0.0000   0.0000          ?        ?  7443.8853  51.7203          ?        ?      862.8        3.0       ?       ? 
1 1 1   13    3    3 o   1458.0    4.8    0.0000   0.0000          ?        ? 21258.9375 139.8362          ?        ?     1458.0        4.8       ?       ? 
1 1 1   13    3    4 o    394.0    1.6    0.0000   0.0000          ?        ?  1552.2461  12.7704          ?        ?      394.0        1.6       ?       ? 
1 1 1   13    3    5 o   1021.2    3.5    0.0000   0.0000          ?        ? 10428.3350  70.8759          ?        ?     1021.2        3.5       ?       ? 
1 1 1   13    3    6 o   1351.5    4.4    0.0000   0.0000          ?        ? 18267.4648 120.0421          ?        ?     1351.5        4.4       ?       ? 
1 1 1   13    3    7 o    654.4    2.4    0.0000   0.0000          ?        ?  4281.9258  31.2876          ?        ?      654.4        2.4       ?       ? 
1 1 1   13    3    8 o    220.7    1.3    0.0000   0.0000          ?        ?   487.1920   5.7467          ?        ?      220.7        1.3       ?       ? 
1 1 1   13    3    9 o   1093.4    3.7    0.0000   0.0000          ?        ? 11955.0410  80.4537          ?        ?     1093.4        3.7       ?       ? 
1 1 1   13    3   10 o    906.5    3.2    0.0000   0.0000          ?        ?  8217.1348  57.4669          ?        ?      906.5        3.2       ?       ? 
1 1 1   13    3   11 o    157.0    1.4    0.0000   0.0000          ?        ?   246.4693   4.4697          ?        ?      157.0        1.4       ?       ? 
1 1 1   13    3   12 f   1886.0    6.1    0.0000   0.0000          ?        ? 35575.2305 229.8678          ?        ?     1886.0        6.1       ?       ? 
1 1 1   13    3   13 o    361.4    1.7    0.0000   0.0000          ?        ?  1306.4153  12.1319          ?        ?      361.4        1.7       ?       ? 
1 1 1   13    3   14 o    476.6    1.9    0.0000   0.0000          ?        ?  2271.8599  18.5171          ?        ?      476.6        1.9       ?       ? 
1 1 1   13    3   15 o   1384.1    4.6    0.0000   0.0000          ?        ? 19160.1172 126.4273          ?        ?     1384.1        4.6       ?       ? 
1 1 1   13    3   16 o    422.8    1.9    0.0000   0.0000          ?        ?  1787.2220  15.9630          ?        ?      422.8        1.9       ?       ? 
1 1 1   13    3   17 o    106.6    2.7    0.0000   0.0000          ?        ?   113.6568   5.7467          ?        ?      106.6        2.7       ?       ? 
1 1 1   13    3   18 o    208.1    1.7    0.0000   0.0000          ?        ?   432.9177   7.0237          ?        ?      208.1        1.7       ?       ? 
1 1 1   13    3   19 o    256.9    2.2    0.0000   0.0000          ?        ?   660.2314  11.4934          ?        ?      256.9        2.2       ?       ? 
1 1 1   13    3   20 o   1117.3    3.8    0.0000   0.0000          ?        ? 12483.7363  84.2849          ?        ?     1117.3        3.8       ?       ? 
1 1 1   13    3   21 o    471.9    2.0    0.0000   0.0000          ?        ?  2227.1633  18.5171          ?        ?      471.9        2.0       ?       ? 
1 1 1   13    3   22 o    526.4    2.1    0.0000   0.0000          ?        ?  2771.1838  22.3483          ?        ?      526.4        2.1       ?       ? 
1 1 1   13    3   23 o    662.2    2.6    0.0000   0.0000          ?        ?  4385.3662  33.8416          ?        ?      662.2        2.6       ?       ? 
1 1 1   13    3   24 o    161.8    2.8    0.0000   0.0000          ?        ?   261.7939   8.9393          ?        ?      161.8        2.8       ?       ? 
1 1 1   13    3   25 o   1144.6    4.0    0.0000   0.0000          ?        ? 13101.1875  91.9471          ?        ?     1144.6        4.0       ?       ? 
1 1 1   13    3   26 o   1150.2    4.0    0.0000   0.0000          ?        ? 13231.4453  92.5856          ?        ?     1150.2        4.0       ?       ? 
1 1 1   13    3   27 o   1100.9    4.0    0.0000   0.0000          ?        ? 12121.0566  88.7545          ?        ?     1100.9        4.0       ?       ? 
1 1 1   13    3   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    3   29 o   1239.3    4.4    0.0000   0.0000          ?        ? 15358.9990 107.9102          ?        ?     1239.3        4.4       ?       ? 
1 1 1   13    3   30 o   1044.6    4.0    0.0000   0.0000          ?        ? 10911.6963  83.6463          ?        ?     1044.6        4.0       ?       ? 
1 1 1   13    3   31 o   1192.9    4.4    0.0000   0.0000          ?        ? 14231.3701 104.0790          ?        ?     1192.9        4.4       ?       ? 
1 1 1   13    3   32 o   1031.5    3.8    0.0000   0.0000          ?        ? 10640.3242  79.1767          ?        ?     1031.5        3.8       ?       ? 
1 1 1   13    3   33 o   2654.8   10.4    0.0000   0.0000          ?        ? 70504.9219 550.4056          ?        ?     2654.8       10.4       ?       ? 
1 1 1   13    3   34 o   1343.1    4.7    0.0000   0.0000          ?        ? 18039.5117 126.4273          ?        ?     1343.1        4.7       ?       ? 
1 1 1   13    3   35 o   1012.4    3.7    0.0000   0.0000          ?        ? 10250.8262  75.3456          ?        ?     1012.4        3.7       ?       ? 
1 1 1   13    3   36 o    687.4    2.8    0.0000   0.0000          ?        ?  4725.6982  38.3113          ?        ?      687.4        2.8       ?       ? 
1 1 1   13    3   37 o    499.7    2.5    0.0000   0.0000          ?        ?  2496.6196  24.9023          ?        ?      499.7        2.5       ?       ? 
1 1 1   13    3   38 o   1525.5    5.1    0.0000   0.0000          ?        ? 23274.1133 154.5222          ?        ?     1525.5        5.1       ?       ? 
1 1 1   13    3   39 o    899.5    3.5    0.0000   0.0000          ?        ?  8091.9849  62.5751          ?        ?      899.5        3.5       ?       ? 
1 1 1   13    3   40 o   1067.3    3.8    0.0000   0.0000          ?        ? 11392.5029  81.7308          ?        ?     1067.3        3.8       ?       ? 
1 1 1   13    3   41 o    882.3    3.3    0.0000   0.0000          ?        ?  7784.2168  57.4669          ?        ?      882.3        3.3       ?       ? 
1 1 1   13    3   42 o    733.0    3.1    0.0000   0.0000          ?        ?  5373.1597  45.3350          ?        ?      733.0        3.1       ?       ? 
1 1 1   13    3   43 o   1362.7    4.6    0.0000   0.0000          ?        ? 18572.6777 125.7888          ?        ?     1362.7        4.6       ?       ? 
1 1 1   13    3   44 o    444.7    2.8    0.0000   0.0000          ?        ?  1977.5016  24.9023          ?        ?      444.7        2.8       ?       ? 
1 1 1   13    3   45 o    891.3    3.3    0.0000   0.0000          ?        ?  7944.4858  58.7440          ?        ?      891.3        3.3       ?       ? 
1 1 1   13    3   46 o    773.1    3.0    0.0000   0.0000          ?        ?  5977.8394  46.6121          ?        ?      773.1        3.0       ?       ? 
1 1 1   13    3   47 o    488.1    3.1    0.0000   0.0000          ?        ?  2382.3242  30.0105          ?        ?      488.1        3.1       ?       ? 
1 1 1   13    3   48 o    103.2   10.8    0.0000   0.0000          ?        ?   106.6331  22.3483          ?        ?      103.2       10.8       ?       ? 
1 1 1   13    3   49 o    653.7    2.8    0.0000   0.0000          ?        ?  4274.2642  36.3957          ?        ?      653.7        2.8       ?       ? 
1 1 1   13    3   50 o    268.5    3.7    0.0000   0.0000          ?        ?   720.8909  19.7942          ?        ?      268.5        3.7       ?       ? 
1 1 1   13    3   51 o    513.6    2.7    0.0000   0.0000          ?        ?  2638.3713  27.4564          ?        ?      513.6        2.7       ?       ? 
1 1 1   13    3   52 o    785.5    3.1    0.0000   0.0000          ?        ?  6170.6733  49.1662          ?        ?      785.5        3.1       ?       ? 
1 1 1   13    3   53 o     90.7   10.6    0.0000   0.0000          ?        ?    82.3693  19.1556          ?        ?       90.7       10.6       ?       ? 
1 1 1   13    3   54 o    222.1    4.5    0.0000   0.0000          ?        ?   493.5772  19.7942          ?        ?      222.1        4.5       ?       ? 
1 1 1   13    3   55 o    293.0    3.6    0.0000   0.0000          ?        ?   858.8116  21.0712          ?        ?      293.0        3.6       ?       ? 
1 1 1   13    3   56 o    236.7    4.2    0.0000   0.0000          ?        ?   560.6220  19.7942          ?        ?      236.7        4.2       ?       ? 
1 1 1   13    3   57 o    220.7    4.5    0.0000   0.0000          ?        ?   487.1920  19.7942          ?        ?      220.7        4.5       ?       ? 
1 1 1   13    3   58 o    198.7    4.8    0.0000   0.0000          ?        ?   395.2449  19.1556          ?        ?      198.7        4.8       ?       ? 
1 1 1   13    3   59 o    271.0    3.5    0.0000   0.0000          ?        ?   734.9384  19.1556          ?        ?      271.0        3.5       ?       ? 
1 1 1   13    3   60 o    435.3    2.9    0.0000   0.0000          ?        ?  1895.1321  25.5409          ?        ?      435.3        2.9       ?       ? 
1 1 1   13    3   61 o     24.5   12.0    0.0000   0.0000          ?        ?   -42.1424  20.4327          ?        ?       24.5       12.0       ?       ? 
1 1 1   13    3   62 o     59.0   15.9    0.0000   0.0000          ?        ?    36.3957  19.1556          ?        ?       59.0       15.9       ?       ? 
1 1 1   13    3   63 o    363.2    3.1    0.0000   0.0000          ?        ?  1319.8242  22.3483          ?        ?      363.2        3.1       ?       ? 
1 1 1   13    3   64 o     84.7   11.7    0.0000   0.0000          ?        ?    72.1529  19.7942          ?        ?       84.7       11.7       ?       ? 
1 1 1   13    3   65 o     39.9   15.9    0.0000   0.0000          ?        ?     8.3008  19.1556          ?        ?       39.9       15.9       ?       ? 
1 1 1   13    3   66 o    420.5    3.0    0.0000   0.0000          ?        ?  1769.3435  25.5409          ?        ?      420.5        3.0       ?       ? 
1 1 1   13    3   67 o    158.4    6.7    0.0000   0.0000          ?        ?   251.5775  21.0712          ?        ?      158.4        6.7       ?       ? 
1 1 1   13    3   68 o     23.0   11.4    0.0000   0.0000          ?        ?   -50.4432  20.4327          ?        ?       23.0       11.4       ?       ? 
1 1 1   13    3   69 o    175.8    6.0    0.0000   0.0000          ?        ?   309.6830  21.0712          ?        ?      175.8        6.0       ?       ? 
1 1 1   13    3   70 o    199.4    5.4    0.0000   0.0000          ?        ?   398.4375  21.7097          ?        ?      199.4        5.4       ?       ? 
1 1 1   13    3   71 o    177.3    6.5    0.0000   0.0000          ?        ?   315.4297  22.9868          ?        ?      177.3        6.5       ?       ? 
1 1 1   13    3   72 o    268.8    4.4    0.0000   0.0000          ?        ?   723.4450  23.6253          ?        ?      268.8        4.4       ?       ? 
1 1 1   13    3   73 o     39.3   16.4    0.0000   0.0000          ?        ?     3.1926  21.7097          ?        ?       39.3       16.4       ?       ? 
1 1 1   13    3   74 o    119.3    9.6    0.0000   0.0000          ?        ?   143.6674  22.9868          ?        ?      119.3        9.6       ?       ? 
1 1 1   13    3   75 o    210.6    5.5    0.0000   0.0000          ?        ?   445.0496  22.9868          ?        ?      210.6        5.5       ?       ? 
1 1 1   13    3   76 o     30.8   14.4    0.0000   0.0000          ?        ?   -21.7097  22.3483          ?        ?       30.8       14.4       ?       ? 
1 1 1   13    3   77 o    198.7    5.6    0.0000   0.0000          ?        ?   396.5219  22.3483          ?        ?      198.7        5.6       ?       ? 
1 1 1   13    3   78 o     26.8   13.0    0.0000   0.0000          ?        ?   -38.3113  22.3483          ?        ?       26.8       13.0       ?       ? 
1 1 1   13    3   79 o     56.6   17.8    0.0000   0.0000          ?        ?    33.8416  22.3483          ?        ?       56.6       17.8       ?       ? 
1 1 1   13    3   80 o     61.7   16.3    0.0000   0.0000          ?        ?    41.5039  20.4327          ?        ?       61.7       16.3       ?       ? 
1 1 1   13    4    0 o    254.7    1.9  648.7380   9.5778   648.7380   9.5778   648.7380   9.5778      254.7      1.9      254.7        1.9     0.0     0.0 
1 1 1   13    4    1 o    792.0    2.8    0.0000   0.0000          ?        ?  6273.4751  44.0580          ?        ?      792.0        2.8       ?       ? 
1 1 1   13    4    2 o    858.1    3.1    0.0000   0.0000          ?        ?  7363.4312  52.3588          ?        ?      858.1        3.1       ?       ? 
1 1 1   13    4    3 o    464.8    1.8    0.0000   0.0000          ?        ?  2160.1187  16.6016          ?        ?      464.8        1.8       ?       ? 
1 1 1   13    4    4 f   1070.9    3.6    0.0000   0.0000          ?        ? 11469.7646  77.2611          ?        ?     1070.9        3.6       ?       ? 
1 1 1   13    4    5 o    586.5    2.2    0.0000   0.0000          ?        ?  3439.7161  26.1794          ?        ?      586.5        2.2       ?       ? 
1 1 1   13    4    6 o    715.3    2.5    0.0000   0.0000          ?        ?  5116.4736  36.3957          ?        ?      715.3        2.5       ?       ? 
1 1 1   13    4    7 o    456.3    1.8    0.0000   0.0000          ?        ?  2082.2190  16.6016          ?        ?      456.3        1.8       ?       ? 
1 1 1   13    4    8 o    454.1    1.9    0.0000   0.0000          ?        ?  2062.4248  17.2401          ?        ?      454.1        1.9       ?       ? 
1 1 1   13    4    9 o    318.3    1.5    0.0000   0.0000          ?        ?  1013.3338   9.5778          ?        ?      318.3        1.5       ?       ? 
1 1 1   13    4   10 o    996.3    3.4    0.0000   0.0000          ?        ?  9927.0957  68.3218          ?        ?      996.3        3.4       ?       ? 
1 1 1   13    4   11 o    918.6    3.1    0.0000   0.0000          ?        ?  8438.0635  57.4669          ?        ?      918.6        3.1       ?       ? 
1 1 1   13    4   12 o    697.7    2.6    0.0000   0.0000          ?        ?  4867.4502  36.3957          ?        ?      697.7        2.6       ?       ? 
1 1 1   13    4   13 o    516.4    2.1    0.0000   0.0000          ?        ?  2666.4663  21.7097          ?        ?      516.4        2.1       ?       ? 
1 1 1   13    4   14 o    762.1    2.7    0.0000   0.0000          ?        ?  5808.6313  41.5039          ?        ?      762.1        2.7       ?       ? 
1 1 1   13    4   15 o    239.3    1.7    0.0000   0.0000          ?        ?   572.7539   8.3008          ?        ?      239.3        1.7       ?       ? 
1 1 1   13    4   16 o    772.8    2.7    0.0000   0.0000          ?        ?  5972.0928  42.1424          ?        ?      772.8        2.7       ?       ? 
1 1 1   13    4   17 o     70.1    4.1    0.0000   0.0000          ?        ?    49.1662   5.7467          ?        ?       70.1        4.1       ?       ? 
1 1 1   13    4   18 o    696.7    2.6    0.0000   0.0000          ?        ?  4854.6797  35.7572          ?        ?      696.7        2.6       ?       ? 
1 1 1   13    4   19 o    905.4    3.1    0.0000   0.0000          ?        ?  8197.9795  56.8284          ?        ?      905.4        3.1       ?       ? 
1 1 1   13    4   20 o    183.3    2.3    0.0000   0.0000          ?        ?   335.8624   8.3008          ?        ?      183.3        2.3       ?       ? 
1 1 1   13    4   21 o   1038.2    3.5    0.0000   0.0000          ?        ? 10780.1611  73.4300          ?        ?     1038.2        3.5       ?       ? 
1 1 1   13    4   22 o    721.4    2.7    0.0000   0.0000          ?        ?  5204.5898  39.5883          ?        ?      721.4        2.7       ?       ? 
1 1 1   13    4   23 o    836.9    3.0    0.0000   0.0000          ?        ?  7003.9438  50.4432          ?        ?      836.9        3.0       ?       ? 
1 1 1   13    4   24 o   1508.0    5.1    0.0000   0.0000          ?        ? 22743.5020 154.5222          ?        ?     1508.0        5.1       ?       ? 
1 1 1   13    4   25 o    442.7    2.2    0.0000   0.0000          ?        ?  1960.2614  19.7942          ?        ?      442.7        2.2       ?       ? 
1 1 1   13    4   26 o    561.7    2.4    0.0000   0.0000          ?        ?  3155.5740  27.4564          ?        ?      561.7        2.4       ?       ? 
1 1 1   13    4   27 o   1650.0    5.6    0.0000   0.0000          ?        ? 27229.1152 184.5327          ?        ?     1650.0        5.6       ?       ? 
1 1 1   13    4   28 o   1531.4    5.5    0.0000   0.0000          ?        ? 23454.1758 167.2927          ?        ?     1531.4        5.5       ?       ? 
1 1 1   13    4   29 o   2038.0    7.0    0.0000   0.0000          ?        ? 41542.2188 287.3347          ?        ?     2038.0        7.0       ?       ? 
1 1 1   13    4   30 f    514.3    2.6    0.0000   0.0000          ?        ?  2645.3950  26.8179          ?        ?      514.3        2.6       ?       ? 
1 1 1   13    4   31 o     41.5   15.9    0.0000   0.0000          ?        ?    11.4934  18.5171          ?        ?       41.5       15.9       ?       ? 
1 1 1   13    4   32 o   1890.4    6.6    0.0000   0.0000          ?        ? 35739.3320 250.3005          ?        ?     1890.4        6.6       ?       ? 
1 1 1   13    4   33 o    704.2    2.9    0.0000   0.0000          ?        ?  4958.7588  40.8654          ?        ?      704.2        2.9       ?       ? 
1 1 1   13    4   34 o   1068.6    3.7    0.0000   0.0000          ?        ? 11419.9590  79.8152          ?        ?     1068.6        3.7       ?       ? 
1 1 1   13    4   35 o   1533.1    5.5    0.0000   0.0000          ?        ? 23505.2578 167.2927          ?        ?     1533.1        5.5       ?       ? 
1 1 1   13    4   36 o    573.2    2.7    0.0000   0.0000          ?        ?  3285.8320  31.2876          ?        ?      573.2        2.7       ?       ? 
1 1 1   13    4   37 f    211.9    4.1    0.0000   0.0000          ?        ?   448.8807  17.2401          ?        ?      211.9        4.1       ?       ? 
1 1 1   13    4   38 o    200.4    5.1    0.0000   0.0000          ?        ?   401.6301  20.4327          ?        ?      200.4        5.1       ?       ? 
1 1 1   13    4   39 o   1122.2    4.0    0.0000   0.0000          ?        ? 12594.8389  88.7545          ?        ?     1122.2        4.0       ?       ? 
1 1 1   13    4   40 o    299.9    3.2    0.0000   0.0000          ?        ?   899.6769  19.1556          ?        ?      299.9        3.2       ?       ? 
1 1 1   13    4   41 o    734.0    3.0    0.0000   0.0000          ?        ?  5387.2070  43.4195          ?        ?      734.0        3.0       ?       ? 
1 1 1   13    4   42 o    182.4    5.1    0.0000   0.0000          ?        ?   332.6698  18.5171          ?        ?      182.4        5.1       ?       ? 
1 1 1   13    4   43 o    297.7    3.2    0.0000   0.0000          ?        ?   886.2681  19.1556          ?        ?      297.7        3.2       ?       ? 
1 1 1   13    4   44 o     99.8    9.0    0.0000   0.0000          ?        ?    99.6094  17.8786          ?        ?       99.8        9.0       ?       ? 
1 1 1   13    4   45 o    263.6    3.6    0.0000   0.0000          ?        ?   694.7115  19.1556          ?        ?      263.6        3.6       ?       ? 
1 1 1   13    4   46 o    230.7    4.3    0.0000   0.0000          ?        ?   532.5270  19.7942          ?        ?      230.7        4.3       ?       ? 
1 1 1   13    4   47 o    535.9    2.9    0.0000   0.0000          ?        ?  2872.0703  31.2876          ?        ?      535.9        2.9       ?       ? 
1 1 1   13    4   48 o    626.0    2.8    0.0000   0.0000          ?        ?  3919.2456  34.4802          ?        ?      626.0        2.8       ?       ? 
1 1 1   13    4   49 o    477.2    2.8    0.0000   0.0000          ?        ?  2276.9683  26.8179          ?        ?      477.2        2.8       ?       ? 
1 1 1   13    4   50 o    811.7    3.1    0.0000   0.0000          ?        ?  6590.1816  51.0817          ?        ?      811.7        3.1       ?       ? 
1 1 1   13    4   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    4   52 o    875.4    3.4    0.0000   0.0000          ?        ?  7665.4521  59.3825          ?        ?      875.4        3.4       ?       ? 
1 1 1   13    4   53 o    228.1    4.5    0.0000   0.0000          ?        ?   520.3951  20.4327          ?        ?      228.1        4.5       ?       ? 
1 1 1   13    4   54 o    224.3    4.6    0.0000   0.0000          ?        ?   503.1551  20.4327          ?        ?      224.3        4.6       ?       ? 
1 1 1   13    4   55 o    497.6    2.7    0.0000   0.0000          ?        ?  2476.8254  26.8179          ?        ?      497.6        2.7       ?       ? 
1 1 1   13    4   56 o    508.7    2.8    0.0000   0.0000          ?        ?  2588.5667  28.0950          ?        ?      508.7        2.8       ?       ? 
1 1 1   13    4   57 f    409.3    2.9    0.0000   0.0000          ?        ?  1675.4807  23.6253          ?        ?      409.3        2.9       ?       ? 
1 1 1   13    4   58 o    317.8    3.4    0.0000   0.0000          ?        ?  1010.1412  21.7097          ?        ?      317.8        3.4       ?       ? 
1 1 1   13    4   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    4   60 o    419.4    3.0    0.0000   0.0000          ?        ?  1759.1271  25.5409          ?        ?      419.4        3.0       ?       ? 
1 1 1   13    4   61 f    556.1    2.7    0.0000   0.0000          ?        ?  3092.9988  30.0105          ?        ?      556.1        2.7       ?       ? 
1 1 1   13    4   62 o    125.4    7.9    0.0000   0.0000          ?        ?   157.7148  19.7942          ?        ?      125.4        7.9       ?       ? 
1 1 1   13    4   63 o    510.9    2.7    0.0000   0.0000          ?        ?  2611.5535  28.0950          ?        ?      510.9        2.7       ?       ? 
1 1 1   13    4   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    4   65 o    165.9    5.8    0.0000   0.0000          ?        ?   275.8413  19.1556          ?        ?      165.9        5.8       ?       ? 
1 1 1   13    4   66 o    176.9    5.8    0.0000   0.0000          ?        ?   313.5141  20.4327          ?        ?      176.9        5.8       ?       ? 
1 1 1   13    4   67 o    181.0    5.5    0.0000   0.0000          ?        ?   328.2001  19.7942          ?        ?      181.0        5.5       ?       ? 
1 1 1   13    4   68 o    307.9    3.5    0.0000   0.0000          ?        ?   948.8432  21.7097          ?        ?      307.9        3.5       ?       ? 
1 1 1   13    4   69 o     30.2   14.0    0.0000   0.0000          ?        ?   -17.8786  20.4327          ?        ?       30.2       14.0       ?       ? 
1 1 1   13    4   70 o     74.1   14.3    0.0000   0.0000          ?        ?    57.4669  20.4327          ?        ?       74.1       14.3       ?       ? 
1 1 1   13    4   71 o     37.9   16.1    0.0000   0.0000          ?        ?     1.2770  21.0712          ?        ?       37.9       16.1       ?       ? 
1 1 1   13    4   72 o    206.4    5.4    0.0000   0.0000          ?        ?   427.1710  22.3483          ?        ?      206.4        5.4       ?       ? 
1 1 1   13    4   73 o    302.7    3.7    0.0000   0.0000          ?        ?   917.5555  22.3483          ?        ?      302.7        3.7       ?       ? 
1 1 1   13    4   74 o    134.9    8.0    0.0000   0.0000          ?        ?   183.2557  21.7097          ?        ?      134.9        8.0       ?       ? 
1 1 1   13    4   75 o     63.3   16.9    0.0000   0.0000          ?        ?    42.7809  21.7097          ?        ?       63.3       16.9       ?       ? 
1 1 1   13    4   76 o    161.7    6.7    0.0000   0.0000          ?        ?   263.0709  21.7097          ?        ?      161.7        6.7       ?       ? 
1 1 1   13    4   77 o    200.6    5.4    0.0000   0.0000          ?        ?   404.1842  21.7097          ?        ?      200.6        5.4       ?       ? 
1 1 1   13    4   78 o     24.9   12.2    0.0000   0.0000          ?        ?   -42.1424  21.0712          ?        ?       24.9       12.2       ?       ? 
1 1 1   13    4   79 o    143.2    7.1    0.0000   0.0000          ?        ?   206.8810  20.4327          ?        ?      143.2        7.1       ?       ? 
1 1 1   13    4   80 o    114.8    9.2    0.0000   0.0000          ?        ?   134.0895  21.0712          ?        ?      114.8        9.2       ?       ? 
1 1 1   13    5    0 o      6.3    4.7  -14.0475   4.4697   -14.0475   4.4697   -14.0475   4.4697        6.3      4.7        6.3        4.7     0.0     0.0 
1 1 1   13    5    1 o    677.7    2.4    0.0000   0.0000          ?        ?  4592.2476  33.2031          ?        ?      677.7        2.4       ?       ? 
1 1 1   13    5    2 o    178.1    1.3    0.0000   0.0000          ?        ?   317.3452   4.4697          ?        ?      178.1        1.3       ?       ? 
1 1 1   13    5    3 o    619.2    2.3    0.0000   0.0000          ?        ?  3834.3223  28.0950          ?        ?      619.2        2.3       ?       ? 
1 1 1   13    5    4 o    901.1    3.1    0.0000   0.0000          ?        ?  8119.4409  55.5514          ?        ?      901.1        3.1       ?       ? 
1 1 1   13    5    5 o   1204.5    4.0    0.0000   0.0000          ?        ? 14509.1270  96.4168          ?        ?     1204.5        4.0       ?       ? 
1 1 1   13    5    6 o   1221.4    4.2    0.0000   0.0000          ?        ? 14919.6973 101.5249          ?        ?     1221.4        4.2       ?       ? 
1 1 1   13    5    7 o    966.8    3.3    0.0000   0.0000          ?        ?  9347.9570  63.2136          ?        ?      966.8        3.3       ?       ? 
1 1 1   13    5    8 o    862.5    3.0    0.0000   0.0000          ?        ?  7439.4155  51.7203          ?        ?      862.5        3.0       ?       ? 
1 1 1   13    5    9 o    411.9    1.7    0.0000   0.0000          ?        ?  1696.5520  14.0475          ?        ?      411.9        1.7       ?       ? 
1 1 1   13    5   10 o    146.5    1.5    0.0000   0.0000          ?        ?   214.5433   4.4697          ?        ?      146.5        1.5       ?       ? 
1 1 1   13    5   11 o    755.9    2.7    0.0000   0.0000          ?        ?  5714.1304  41.5039          ?        ?      755.9        2.7       ?       ? 
1 1 1   13    5   12 o    510.5    2.0    0.0000   0.0000          ?        ?  2605.8069  20.4327          ?        ?      510.5        2.0       ?       ? 
1 1 1   13    5   13 o    209.6    1.5    0.0000   0.0000          ?        ?   439.3029   6.3852          ?        ?      209.6        1.5       ?       ? 
1 1 1   13    5   14 o    915.1    3.2    0.0000   0.0000          ?        ?  8374.8496  58.7440          ?        ?      915.1        3.2       ?       ? 
1 1 1   13    5   15 o    262.0    1.5    0.0000   0.0000          ?        ?   686.4108   7.6623          ?        ?      262.0        1.5       ?       ? 
1 1 1   13    5   16 o    747.5    2.7    0.0000   0.0000          ?        ?  5587.7026  40.2269          ?        ?      747.5        2.7       ?       ? 
1 1 1   13    5   17 o   1202.7    4.1    0.0000   0.0000          ?        ? 14465.7070  98.3323          ?        ?     1202.7        4.1       ?       ? 
1 1 1   13    5   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    5   19 o    407.4    1.8    0.0000   0.0000          ?        ?  1660.1562  14.6860          ?        ?      407.4        1.8       ?       ? 
1 1 1   13    5   20 o    321.1    1.8    0.0000   0.0000          ?        ?  1031.2124  11.4934          ?        ?      321.1        1.8       ?       ? 
1 1 1   13    5   21 o    690.8    2.9    0.0000   0.0000          ?        ?  4771.6719  39.5883          ?        ?      690.8        2.9       ?       ? 
1 1 1   13    5   22 o    426.6    2.0    0.0000   0.0000          ?        ?  1819.7866  17.2401          ?        ?      426.6        2.0       ?       ? 
1 1 1   13    5   23 f    939.5    3.4    0.0000   0.0000          ?        ?  8827.5615  64.4907          ?        ?      939.5        3.4       ?       ? 
1 1 1   13    5   24 f    832.1    3.0    0.0000   0.0000          ?        ?  6924.7671  49.8047          ?        ?      832.1        3.0       ?       ? 
1 1 1   13    5   25 o    517.5    2.3    0.0000   0.0000          ?        ?  2678.5981  23.6253          ?        ?      517.5        2.3       ?       ? 
1 1 1   13    5   26 o    686.9    2.8    0.0000   0.0000          ?        ?  4718.6748  38.9498          ?        ?      686.9        2.8       ?       ? 
1 1 1   13    5   27 o   2124.4    7.3    0.0000   0.0000          ?        ? 45136.4531 311.5985          ?        ?     2124.4        7.3       ?       ? 
1 1 1   13    5   28 o   1513.8    5.1    0.0000   0.0000          ?        ? 22917.1797 155.7993          ?        ?     1513.8        5.1       ?       ? 
1 1 1   13    5   29 o    787.0    3.5    0.0000   0.0000          ?        ?  6193.6597  54.9129          ?        ?      787.0        3.5       ?       ? 
1 1 1   13    5   30 o    277.4    2.4    0.0000   0.0000          ?        ?   769.4186  13.4090          ?        ?      277.4        2.4       ?       ? 
1 1 1   13    5   31 o    354.8    2.3    0.0000   0.0000          ?        ?  1259.1647  16.6016          ?        ?      354.8        2.3       ?       ? 
1 1 1   13    5   32 o    786.8    3.0    0.0000   0.0000          ?        ?  6190.4673  46.6121          ?        ?      786.8        3.0       ?       ? 
1 1 1   13    5   33 o   1072.9    4.2    0.0000   0.0000          ?        ? 11511.9062  89.3930          ?        ?     1072.9        4.2       ?       ? 
1 1 1   13    5   34 o    920.5    3.4    0.0000   0.0000          ?        ?  8474.4590  62.5751          ?        ?      920.5        3.4       ?       ? 
1 1 1   13    5   35 o    930.9    3.6    0.0000   0.0000          ?        ?  8666.6543  67.0448          ?        ?      930.9        3.6       ?       ? 
1 1 1   13    5   36 o    235.5    4.5    0.0000   0.0000          ?        ?   554.8753  21.0712          ?        ?      235.5        4.5       ?       ? 
1 1 1   13    5   37 o    935.5    3.5    0.0000   0.0000          ?        ?  8752.8545  66.4062          ?        ?      935.5        3.5       ?       ? 
1 1 1   13    5   38 o    378.1    2.6    0.0000   0.0000          ?        ?  1429.6499  19.7942          ?        ?      378.1        2.6       ?       ? 
1 1 1   13    5   39 o   1333.5    4.5    0.0000   0.0000          ?        ? 17783.4668 121.3191          ?        ?     1333.5        4.5       ?       ? 
1 1 1   13    5   40 o   1047.5    3.7    0.0000   0.0000          ?        ? 10974.2705  77.8996          ?        ?     1047.5        3.7       ?       ? 
1 1 1   13    5   41 o   1145.4    4.1    0.0000   0.0000          ?        ? 13119.7031  93.2242          ?        ?     1145.4        4.1       ?       ? 
1 1 1   13    5   42 o    658.5    2.8    0.0000   0.0000          ?        ?  4336.8389  36.3957          ?        ?      658.5        2.8       ?       ? 
1 1 1   13    5   43 o    126.1    8.1    0.0000   0.0000          ?        ?   158.9919  20.4327          ?        ?      126.1        8.1       ?       ? 
1 1 1   13    5   44 o    911.4    3.4    0.0000   0.0000          ?        ?  8307.1660  62.5751          ?        ?      911.4        3.4       ?       ? 
1 1 1   13    5   45 o    366.2    2.9    0.0000   0.0000          ?        ?  1340.8954  21.0712          ?        ?      366.2        2.9       ?       ? 
1 1 1   13    5   46 o   1314.2    4.5    0.0000   0.0000          ?        ? 17274.5625 117.4880          ?        ?     1314.2        4.5       ?       ? 
1 1 1   13    5   47 o    487.7    2.8    0.0000   0.0000          ?        ?  2378.4932  27.4564          ?        ?      487.7        2.8       ?       ? 
1 1 1   13    5   48 f    810.5    3.1    0.0000   0.0000          ?        ?  6569.7490  50.4432          ?        ?      810.5        3.1       ?       ? 
1 1 1   13    5   49 o     35.3   16.0    0.0000   0.0000          ?        ?   -14.0475  24.2638          ?        ?       35.3       16.0       ?       ? 
1 1 1   13    5   50 o    580.0    3.0    0.0000   0.0000          ?        ?  3365.0090  35.1187          ?        ?      580.0        3.0       ?       ? 
1 1 1   13    5   51 o    157.1    6.5    0.0000   0.0000          ?        ?   247.1079  20.4327          ?        ?      157.1        6.5       ?       ? 
1 1 1   13    5   52 o    607.8    2.8    0.0000   0.0000          ?        ?  3695.1248  33.8416          ?        ?      607.8        2.8       ?       ? 
1 1 1   13    5   53 o    415.9    2.8    0.0000   0.0000          ?        ?  1729.7550  22.9868          ?        ?      415.9        2.8       ?       ? 
1 1 1   13    5   54 o    486.1    2.7    0.0000   0.0000          ?        ?  2363.8071  26.1794          ?        ?      486.1        2.7       ?       ? 
1 1 1   13    5   55 o    399.6    2.8    0.0000   0.0000          ?        ?  1596.9426  22.3483          ?        ?      399.6        2.8       ?       ? 
1 1 1   13    5   56 o    951.1    3.5    0.0000   0.0000          ?        ?  9049.1279  65.7677          ?        ?      951.1        3.5       ?       ? 
1 1 1   13    5   57 o    323.7    3.1    0.0000   0.0000          ?        ?  1047.8141  19.7942          ?        ?      323.7        3.1       ?       ? 
1 1 1   13    5   58 o    306.4    3.4    0.0000   0.0000          ?        ?   939.2654  21.0712          ?        ?      306.4        3.4       ?       ? 
1 1 1   13    5   59 o    741.7    2.9    0.0000   0.0000          ?        ?  5502.1411  42.7809          ?        ?      741.7        2.9       ?       ? 
1 1 1   13    5   60 o    267.6    3.7    0.0000   0.0000          ?        ?   716.4213  19.7942          ?        ?      267.6        3.7       ?       ? 
1 1 1   13    5   61 o    379.6    2.9    0.0000   0.0000          ?        ?  1441.1433  21.7097          ?        ?      379.6        2.9       ?       ? 
1 1 1   13    5   62 o     94.7   10.8    0.0000   0.0000          ?        ?    90.0316  20.4327          ?        ?       94.7       10.8       ?       ? 
1 1 1   13    5   63 f     96.0   10.0    0.0000   0.0000          ?        ?    92.5856  19.1556          ?        ?       96.0       10.0       ?       ? 
1 1 1   13    5   64 o    307.4    3.5    0.0000   0.0000          ?        ?   945.6506  21.7097          ?        ?      307.4        3.5       ?       ? 
1 1 1   13    5   65 o     23.6   11.6    0.0000   0.0000          ?        ?   -43.4195  19.7942          ?        ?       23.6       11.6       ?       ? 
1 1 1   13    5   66 o    338.7    3.2    0.0000   0.0000          ?        ?  1148.0619  21.7097          ?        ?      338.7        3.2       ?       ? 
1 1 1   13    5   67 o     86.8   11.0    0.0000   0.0000          ?        ?    75.9841  19.1556          ?        ?       86.8       11.0       ?       ? 
1 1 1   13    5   68 o    254.8    4.3    0.0000   0.0000          ?        ?   650.0150  21.7097          ?        ?      254.8        4.3       ?       ? 
1 1 1   13    5   69 o    143.6    7.3    0.0000   0.0000          ?        ?   206.8810  21.0712          ?        ?      143.6        7.3       ?       ? 
1 1 1   13    5   70 o     81.4   12.9    0.0000   0.0000          ?        ?    67.0448  21.0712          ?        ?       81.4       12.9       ?       ? 
1 1 1   13    5   71 o    134.8    8.1    0.0000   0.0000          ?        ?   182.6172  21.7097          ?        ?      134.8        8.1       ?       ? 
1 1 1   13    5   72 o    344.6    3.4    0.0000   0.0000          ?        ?  1188.9272  23.6253          ?        ?      344.6        3.4       ?       ? 
1 1 1   13    5   73 o    244.0    4.7    0.0000   0.0000          ?        ?   596.3792  22.9868          ?        ?      244.0        4.7       ?       ? 
1 1 1   13    5   74 o    156.0    7.2    0.0000   0.0000          ?        ?   244.5538  22.3483          ?        ?      156.0        7.2       ?       ? 
1 1 1   13    5   75 o    312.5    3.8    0.0000   0.0000          ?        ?   978.2151  23.6253          ?        ?      312.5        3.8       ?       ? 
1 1 1   13    5   76 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    5   77 o    113.2    9.3    0.0000   0.0000          ?        ?   129.6199  21.0712          ?        ?      113.2        9.3       ?       ? 
1 1 1   13    5   78 o    228.8    4.7    0.0000   0.0000          ?        ?   525.5033  21.7097          ?        ?      228.8        4.7       ?       ? 
1 1 1   13    5   79 o    110.2    9.3    0.0000   0.0000          ?        ?   123.2347  20.4327          ?        ?      110.2        9.3       ?       ? 
1 1 1   13    5   80 o     90.7   10.9    0.0000   0.0000          ?        ?    84.2849  19.7942          ?        ?       90.7       10.9       ?       ? 
1 1 1   13    6    0 o    487.7    2.7 2378.4932  26.1794  2378.4932  26.1794  2378.4932  26.1794      487.7      2.7      487.7        2.7     0.0     0.0 
1 1 1   13    6    1 o    124.0    1.3    0.0000   0.0000          ?        ?   153.8837   3.1926          ?        ?      124.0        1.3       ?       ? 
1 1 1   13    6    2 o   1136.6    3.9    0.0000   0.0000          ?        ? 12918.5693  88.7545          ?        ?     1136.6        3.9       ?       ? 
1 1 1   13    6    3 o   2385.7    9.1    0.0000   0.0000          ?        ? 56933.1445 435.4717          ?        ?     2385.7        9.1       ?       ? 
1 1 1   13    6    4 f    804.4    2.9    0.0000   0.0000          ?        ?  6470.1396  45.9736          ?        ?      804.4        2.9       ?       ? 
1 1 1   13    6    5 o   1141.4    3.9    0.0000   0.0000          ?        ? 13029.6719  88.7545          ?        ?     1141.4        3.9       ?       ? 
1 1 1   13    6    6 o   1192.2    4.2    0.0000   0.0000          ?        ? 14215.4072  98.9709          ?        ?     1192.2        4.2       ?       ? 
1 1 1   13    6    7 o    990.8    3.4    0.0000   0.0000          ?        ?  9817.9082  66.4062          ?        ?      990.8        3.4       ?       ? 
1 1 1   13    6    8 o    906.5    3.2    0.0000   0.0000          ?        ?  8217.1348  58.1055          ?        ?      906.5        3.2       ?       ? 
1 1 1   13    6    9 o    337.7    1.5    0.0000   0.0000          ?        ?  1140.3997  10.2163          ?        ?      337.7        1.5       ?       ? 
1 1 1   13    6   10 o    355.4    1.5    0.0000   0.0000          ?        ?  1262.9958  10.8549          ?        ?      355.4        1.5       ?       ? 
1 1 1   13    6   11 o    999.2    3.5    0.0000   0.0000          ?        ?  9983.9238  70.2374          ?        ?      999.2        3.5       ?       ? 
1 1 1   13    6   12 o   1016.6    3.5    0.0000   0.0000          ?        ? 10334.4727  70.2374          ?        ?     1016.6        3.5       ?       ? 
1 1 1   13    6   13 o    961.6    3.3    0.0000   0.0000          ?        ?  9247.0703  63.8522          ?        ?      961.6        3.3       ?       ? 
1 1 1   13    6   14 o    931.4    3.2    0.0000   0.0000          ?        ?  8675.5928  59.3825          ?        ?      931.4        3.2       ?       ? 
1 1 1   13    6   15 o   1075.4    3.7    0.0000   0.0000          ?        ? 11564.9033  78.5382          ?        ?     1075.4        3.7       ?       ? 
1 1 1   13    6   16 o    134.9    2.4    0.0000   0.0000          ?        ?   181.9787   6.3852          ?        ?      134.9        2.4       ?       ? 
1 1 1   13    6   17 o   1291.1    4.3    0.0000   0.0000          ?        ? 16670.5234 111.7413          ?        ?     1291.1        4.3       ?       ? 
1 1 1   13    6   18 o   1336.1    4.5    0.0000   0.0000          ?        ? 17852.4258 119.4035          ?        ?     1336.1        4.5       ?       ? 
1 1 1   13    6   19 o    658.0    2.5    0.0000   0.0000          ?        ?  4329.1768  32.5646          ?        ?      658.0        2.5       ?       ? 
1 1 1   13    6   20 o   1287.7    4.3    0.0000   0.0000          ?        ? 16584.3223 110.4642          ?        ?     1287.7        4.3       ?       ? 
1 1 1   13    6   21 o    468.3    2.0    0.0000   0.0000          ?        ?  2193.3218  19.1556          ?        ?      468.3        2.0       ?       ? 
1 1 1   13    6   22 o    683.6    2.6    0.0000   0.0000          ?        ?  4673.3398  35.7572          ?        ?      683.6        2.6       ?       ? 
1 1 1   13    6   23 o    554.6    2.3    0.0000   0.0000          ?        ?  3076.3972  25.5409          ?        ?      554.6        2.3       ?       ? 
1 1 1   13    6   24 o   1342.7    4.5    0.0000   0.0000          ?        ? 18029.9355 120.6806          ?        ?     1342.7        4.5       ?       ? 
1 1 1   13    6   25 o   1120.8    4.0    0.0000   0.0000          ?        ? 12561.6367  90.6701          ?        ?     1120.8        4.0       ?       ? 
1 1 1   13    6   26 o    829.1    3.2    0.0000   0.0000          ?        ?  6874.9619  52.9973          ?        ?      829.1        3.2       ?       ? 
1 1 1   13    6   27 o   1999.8    6.8    0.0000   0.0000          ?        ? 39997.6328 270.0946          ?        ?     1999.8        6.8       ?       ? 
1 1 1   13    6   28 o    657.2    2.9    0.0000   0.0000          ?        ?  4318.9604  37.6728          ?        ?      657.2        2.9       ?       ? 
1 1 1   13    6   29 o   1000.0    3.6    0.0000   0.0000          ?        ? 10000.5254  72.7915          ?        ?     1000.0        3.6       ?       ? 
1 1 1   13    6   30 o   1033.0    3.8    0.0000   0.0000          ?        ? 10670.9727  78.5382          ?        ?     1033.0        3.8       ?       ? 
1 1 1   13    6   31 o    944.6    3.6    0.0000   0.0000          ?        ?  8923.3398  67.6833          ?        ?      944.6        3.6       ?       ? 
1 1 1   13    6   32 o   1609.6    5.5    0.0000   0.0000          ?        ? 25909.9316 175.5934          ?        ?     1609.6        5.5       ?       ? 
1 1 1   13    6   33 o   1605.3    6.1    0.0000   0.0000          ?        ? 25774.5645 197.3032          ?        ?     1605.3        6.1       ?       ? 
1 1 1   13    6   34 o   2367.0    8.8    0.0000   0.0000          ?        ? 56043.0430 416.3161          ?        ?     2367.0        8.8       ?       ? 
1 1 1   13    6   35 o   1064.2    3.8    0.0000   0.0000          ?        ? 11325.4580  81.0922          ?        ?     1064.2        3.8       ?       ? 
1 1 1   13    6   36 o   1254.3    4.3    0.0000   0.0000          ?        ? 15735.0889 107.9102          ?        ?     1254.3        4.3       ?       ? 
1 1 1   13    6   37 o    340.5    2.9    0.0000   0.0000          ?        ?  1159.5553  19.7942          ?        ?      340.5        2.9       ?       ? 
1 1 1   13    6   38 o    477.4    2.6    0.0000   0.0000          ?        ?  2278.8835  24.9023          ?        ?      477.4        2.6       ?       ? 
1 1 1   13    6   39 o    546.1    2.6    0.0000   0.0000          ?        ?  2982.5347  28.7335          ?        ?      546.1        2.6       ?       ? 
1 1 1   13    6   40 o    268.0    3.7    0.0000   0.0000          ?        ?   718.3369  19.7942          ?        ?      268.0        3.7       ?       ? 
1 1 1   13    6   41 o    477.9    3.0    0.0000   0.0000          ?        ?  2283.9919  28.7335          ?        ?      477.9        3.0       ?       ? 
1 1 1   13    6   42 o    664.9    2.8    0.0000   0.0000          ?        ?  4420.4854  37.6728          ?        ?      664.9        2.8       ?       ? 
1 1 1   13    6   43 o    584.4    2.8    0.0000   0.0000          ?        ?  3415.4524  32.5646          ?        ?      584.4        2.8       ?       ? 
1 1 1   13    6   44 f    751.3    3.0    0.0000   0.0000          ?        ?  5645.1694  44.6965          ?        ?      751.3        3.0       ?       ? 
1 1 1   13    6   45 o    895.1    3.4    0.0000   0.0000          ?        ?  8013.4463  61.2981          ?        ?      895.1        3.4       ?       ? 
1 1 1   13    6   46 o    471.2    2.7    0.0000   0.0000          ?        ?  2220.1399  25.5409          ?        ?      471.2        2.7       ?       ? 
1 1 1   13    6   47 f    740.3    3.1    0.0000   0.0000          ?        ?  5480.4312  45.3350          ?        ?      740.3        3.1       ?       ? 
1 1 1   13    6   48 o    520.2    2.7    0.0000   0.0000          ?        ?  2706.6931  28.0950          ?        ?      520.2        2.7       ?       ? 
1 1 1   13    6   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    6   50 o    144.9    6.4    0.0000   0.0000          ?        ?   210.0736  18.5171          ?        ?      144.9        6.4       ?       ? 
1 1 1   13    6   51 f    576.9    2.8    0.0000   0.0000          ?        ?  3328.6133  31.9261          ?        ?      576.9        2.8       ?       ? 
1 1 1   13    6   52 o     91.4   10.5    0.0000   0.0000          ?        ?    83.6463  19.1556          ?        ?       91.4       10.5       ?       ? 
1 1 1   13    6   53 o    256.0    3.5    0.0000   0.0000          ?        ?   655.7617  17.8786          ?        ?      256.0        3.5       ?       ? 
1 1 1   13    6   54 o    562.3    2.8    0.0000   0.0000          ?        ?  3162.5977  31.9261          ?        ?      562.3        2.8       ?       ? 
1 1 1   13    6   55 o     82.1   11.3    0.0000   0.0000          ?        ?    67.6833  18.5171          ?        ?       82.1       11.3       ?       ? 
1 1 1   13    6   56 o    792.9    3.1    0.0000   0.0000          ?        ?  6288.1611  48.5276          ?        ?      792.9        3.1       ?       ? 
1 1 1   13    6   57 o    470.2    2.9    0.0000   0.0000          ?        ?  2211.2002  27.4564          ?        ?      470.2        2.9       ?       ? 
1 1 1   13    6   58 o    298.4    3.3    0.0000   0.0000          ?        ?   890.7377  19.7942          ?        ?      298.4        3.3       ?       ? 
1 1 1   13    6   59 o    342.4    3.2    0.0000   0.0000          ?        ?  1172.9642  21.7097          ?        ?      342.4        3.2       ?       ? 
1 1 1   13    6   60 o    405.9    2.8    0.0000   0.0000          ?        ?  1648.0244  22.9868          ?        ?      405.9        2.8       ?       ? 
1 1 1   13    6   61 o    206.4    4.8    0.0000   0.0000          ?        ?   426.5325  19.7942          ?        ?      206.4        4.8       ?       ? 
1 1 1   13    6   62 o    363.4    3.0    0.0000   0.0000          ?        ?  1321.1012  21.7097          ?        ?      363.4        3.0       ?       ? 
1 1 1   13    6   63 o    278.7    3.8    0.0000   0.0000          ?        ?   777.0808  21.0712          ?        ?      278.7        3.8       ?       ? 
1 1 1   13    6   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    6   65 o    604.1    2.7    0.0000   0.0000          ?        ?  3650.4282  33.2031          ?        ?      604.1        2.7       ?       ? 
1 1 1   13    6   66 o     29.2   13.7    0.0000   0.0000          ?        ?   -19.1556  19.7942          ?        ?       29.2       13.7       ?       ? 
1 1 1   13    6   67 o    325.8    3.4    0.0000   0.0000          ?        ?  1062.5000  22.3483          ?        ?      325.8        3.4       ?       ? 
1 1 1   13    6   68 o     57.4   16.1    0.0000   0.0000          ?        ?    34.4802  19.1556          ?        ?       57.4       16.1       ?       ? 
1 1 1   13    6   69 o    219.7    4.7    0.0000   0.0000          ?        ?   483.3608  20.4327          ?        ?      219.7        4.7       ?       ? 
1 1 1   13    6   70 o    174.5    5.9    0.0000   0.0000          ?        ?   305.2133  20.4327          ?        ?      174.5        5.9       ?       ? 
1 1 1   13    6   71 o    102.2   10.6    0.0000   0.0000          ?        ?   105.3561  21.7097          ?        ?      102.2       10.6       ?       ? 
1 1 1   13    6   72 o    195.8    5.4    0.0000   0.0000          ?        ?   384.3900  21.0712          ?        ?      195.8        5.4       ?       ? 
1 1 1   13    6   73 o    224.6    4.8    0.0000   0.0000          ?        ?   505.7091  21.7097          ?        ?      224.6        4.8       ?       ? 
1 1 1   13    6   74 o     26.6   12.9    0.0000   0.0000          ?        ?   -37.0343  21.7097          ?        ?       26.6       12.9       ?       ? 
1 1 1   13    6   75 o    104.1   10.7    0.0000   0.0000          ?        ?   109.8257  22.3483          ?        ?      104.1       10.7       ?       ? 
1 1 1   13    6   76 o     76.6   15.5    0.0000   0.0000          ?        ?    62.5751  22.9868          ?        ?       76.6       15.5       ?       ? 
1 1 1   13    6   77 o     37.8   16.2    0.0000   0.0000          ?        ?     0.6385  21.7097          ?        ?       37.8       16.2       ?       ? 
1 1 1   13    6   78 o     60.5   16.1    0.0000   0.0000          ?        ?    39.5883  19.7942          ?        ?       60.5       16.1       ?       ? 
1 1 1   13    6   79 o    103.8   10.1    0.0000   0.0000          ?        ?   109.8257  21.0712          ?        ?      103.8       10.1       ?       ? 
1 1 1   13    6   80 o    127.4    8.3    0.0000   0.0000          ?        ?   164.7386  21.0712          ?        ?      127.4        8.3       ?       ? 
1 1 1   13    7    0 o   1435.5    7.4 20610.2012 213.2662 20610.2012 213.2662 20610.2012 213.2662     1435.5      7.4     1435.5        7.4     0.0     0.0 
1 1 1   13    7    1 f    339.0    1.7    0.0000   0.0000          ?        ?  1149.3389  11.4934          ?        ?      339.0        1.7       ?       ? 
1 1 1   13    7    2 o   1782.1    6.4    0.0000   0.0000          ?        ? 31765.1719 227.9522          ?        ?     1782.1        6.4       ?       ? 
1 1 1   13    7    3 o    123.8    1.5    0.0000   0.0000          ?        ?   153.2452   3.8311          ?        ?      123.8        1.5       ?       ? 
1 1 1   13    7    4 o    763.8    2.7    0.0000   0.0000          ?        ?  5833.5332  40.8654          ?        ?      763.8        2.7       ?       ? 
1 1 1   13    7    5 o    731.3    2.7    0.0000   0.0000          ?        ?  5347.6187  39.5883          ?        ?      731.3        2.7       ?       ? 
1 1 1   13    7    6 o    644.7    2.3    0.0000   0.0000          ?        ?  4156.1372  30.0105          ?        ?      644.7        2.3       ?       ? 
1 1 1   13    7    7 o    372.1    1.6    0.0000   0.0000          ?        ?  1384.3149  12.1319          ?        ?      372.1        1.6       ?       ? 
1 1 1   13    7    8 o    235.0    1.5    0.0000   0.0000          ?        ?   552.3212   7.0237          ?        ?      235.0        1.5       ?       ? 
1 1 1   13    7    9 o    868.9    3.1    0.0000   0.0000          ?        ?  7549.8799  53.6358          ?        ?      868.9        3.1       ?       ? 
1 1 1   13    7   10 o    206.1    1.4    0.0000   0.0000          ?        ?   424.6169   5.7467          ?        ?      206.1        1.4       ?       ? 
1 1 1   13    7   11 o    329.9    1.6    0.0000   0.0000          ?        ?  1088.6793  10.8549          ?        ?      329.9        1.6       ?       ? 
1 1 1   13    7   12 o    830.4    2.9    0.0000   0.0000          ?        ?  6896.0337  47.8891          ?        ?      830.4        2.9       ?       ? 
1 1 1   13    7   13 o    482.7    2.0    0.0000   0.0000          ?        ?  2329.9653  19.1556          ?        ?      482.7        2.0       ?       ? 
1 1 1   13    7   14 o    378.2    1.9    0.0000   0.0000          ?        ?  1430.2885  14.0475          ?        ?      378.2        1.9       ?       ? 
1 1 1   13    7   15 o    344.4    1.7    0.0000   0.0000          ?        ?  1186.3732  11.4934          ?        ?      344.4        1.7       ?       ? 
1 1 1   13    7   16 o    938.4    3.3    0.0000   0.0000          ?        ?  8805.8516  61.9366          ?        ?      938.4        3.3       ?       ? 
1 1 1   13    7   17 o    513.5    2.1    0.0000   0.0000          ?        ?  2636.4558  21.7097          ?        ?      513.5        2.1       ?       ? 
1 1 1   13    7   18 o    411.1    1.9    0.0000   0.0000          ?        ?  1690.1669  15.3245          ?        ?      411.1        1.9       ?       ? 
1 1 1   13    7   19 o    407.3    1.9    0.0000   0.0000          ?        ?  1658.8792  15.3245          ?        ?      407.3        1.9       ?       ? 
1 1 1   13    7   20 o    986.9    3.5    0.0000   0.0000          ?        ?  9740.0088  69.5989          ?        ?      986.9        3.5       ?       ? 
1 1 1   13    7   21 o    109.3    3.5    0.0000   0.0000          ?        ?   119.4035   7.6623          ?        ?      109.3        3.5       ?       ? 
1 1 1   13    7   22 o    724.4    2.7    0.0000   0.0000          ?        ?  5247.3706  39.5883          ?        ?      724.4        2.7       ?       ? 
1 1 1   13    7   23 o    533.9    2.2    0.0000   0.0000          ?        ?  2850.9990  23.6253          ?        ?      533.9        2.2       ?       ? 
1 1 1   13    7   24 o   1368.3    4.7    0.0000   0.0000          ?        ? 18722.7305 128.3428          ?        ?     1368.3        4.7       ?       ? 
1 1 1   13    7   25 o   1079.5    3.9    0.0000   0.0000          ?        ? 11654.2969  84.2849          ?        ?     1079.5        3.9       ?       ? 
1 1 1   13    7   26 o    347.0    2.1    0.0000   0.0000          ?        ?  1204.2518  14.6860          ?        ?      347.0        2.1       ?       ? 
1 1 1   13    7   27 o    527.1    2.5    0.0000   0.0000          ?        ?  2778.8462  26.8179          ?        ?      527.1        2.5       ?       ? 
1 1 1   13    7   28 o   1464.1    5.2    0.0000   0.0000          ?        ? 21436.4473 152.6067          ?        ?     1464.1        5.2       ?       ? 
1 1 1   13    7   29 f   1424.4    5.2    0.0000   0.0000          ?        ? 20289.6641 148.1370          ?        ?     1424.4        5.2       ?       ? 
1 1 1   13    7   30 o    397.6    2.9    0.0000   0.0000          ?        ?  1580.9796  22.9868          ?        ?      397.6        2.9       ?       ? 
1 1 1   13    7   31 o   1274.2    4.4    0.0000   0.0000          ?        ? 16236.9658 111.7413          ?        ?     1274.2        4.4       ?       ? 
1 1 1   13    7   32 o   1012.7    3.8    0.0000   0.0000          ?        ? 10255.2959  77.8996          ?        ?     1012.7        3.8       ?       ? 
1 1 1   13    7   33 o    577.5    2.6    0.0000   0.0000          ?        ?  3335.6372  30.0105          ?        ?      577.5        2.6       ?       ? 
1 1 1   13    7   34 o    630.8    2.7    0.0000   0.0000          ?        ?  3978.6282  33.8416          ?        ?      630.8        2.7       ?       ? 
1 1 1   13    7   35 o   1422.0    5.0    0.0000   0.0000          ?        ? 20223.8965 141.7518          ?        ?     1422.0        5.0       ?       ? 
1 1 1   13    7   36 o    711.3    2.9    0.0000   0.0000          ?        ?  5059.6455  41.5039          ?        ?      711.3        2.9       ?       ? 
1 1 1   13    7   37 o    467.9    2.7    0.0000   0.0000          ?        ?  2189.4907  24.9023          ?        ?      467.9        2.7       ?       ? 
1 1 1   13    7   38 o    346.2    2.8    0.0000   0.0000          ?        ?  1198.5051  19.1556          ?        ?      346.2        2.8       ?       ? 
1 1 1   13    7   39 o    549.0    3.0    0.0000   0.0000          ?        ?  3014.4607  32.5646          ?        ?      549.0        3.0       ?       ? 
1 1 1   13    7   40 o   1260.5    4.3    0.0000   0.0000          ?        ? 15889.6104 107.9102          ?        ?     1260.5        4.3       ?       ? 
1 1 1   13    7   41 o    457.3    2.8    0.0000   0.0000          ?        ?  2091.1584  25.5409          ?        ?      457.3        2.8       ?       ? 
1 1 1   13    7   42 o    293.5    3.2    0.0000   0.0000          ?        ?   861.3657  18.5171          ?        ?      293.5        3.2       ?       ? 
1 1 1   13    7   43 o    502.2    2.7    0.0000   0.0000          ?        ?  2522.1604  26.8179          ?        ?      502.2        2.7       ?       ? 
1 1 1   13    7   44 f   1058.0    3.8    0.0000   0.0000          ?        ? 11193.9229  79.8152          ?        ?     1058.0        3.8       ?       ? 
1 1 1   13    7   45 o    266.9    3.7    0.0000   0.0000          ?        ?   712.5901  19.7942          ?        ?      266.9        3.7       ?       ? 
1 1 1   13    7   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    7   47 o    597.8    2.7    0.0000   0.0000          ?        ?  3573.8057  31.9261          ?        ?      597.8        2.7       ?       ? 
1 1 1   13    7   48 o    744.7    2.9    0.0000   0.0000          ?        ?  5546.1987  43.4195          ?        ?      744.7        2.9       ?       ? 
1 1 1   13    7   49 f    758.9    2.9    0.0000   0.0000          ?        ?  5760.7422  44.6965          ?        ?      758.9        2.9       ?       ? 
1 1 1   13    7   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    7   51 o    201.0    4.6    0.0000   0.0000          ?        ?   404.1842  18.5171          ?        ?      201.0        4.6       ?       ? 
1 1 1   13    7   52 o    451.8    2.8    0.0000   0.0000          ?        ?  2041.3538  24.9023          ?        ?      451.8        2.8       ?       ? 
1 1 1   13    7   53 o    254.2    3.9    0.0000   0.0000          ?        ?   646.1838  19.7942          ?        ?      254.2        3.9       ?       ? 
1 1 1   13    7   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    7   55 o    727.4    3.0    0.0000   0.0000          ?        ?  5292.7061  43.4195          ?        ?      727.4        3.0       ?       ? 
1 1 1   13    7   56 o    138.8    6.7    0.0000   0.0000          ?        ?   192.8335  18.5171          ?        ?      138.8        6.7       ?       ? 
1 1 1   13    7   57 o    380.6    3.0    0.0000   0.0000          ?        ?  1448.8055  22.9868          ?        ?      380.6        3.0       ?       ? 
1 1 1   13    7   58 o    157.1    6.3    0.0000   0.0000          ?        ?   247.1079  19.7942          ?        ?      157.1        6.3       ?       ? 
1 1 1   13    7   59 o    164.1    5.8    0.0000   0.0000          ?        ?   269.4561  19.1556          ?        ?      164.1        5.8       ?       ? 
1 1 1   13    7   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    7   61 o    378.0    2.8    0.0000   0.0000          ?        ?  1429.6499  21.0712          ?        ?      378.0        2.8       ?       ? 
1 1 1   13    7   62 o    442.7    2.8    0.0000   0.0000          ?        ?  1960.2614  24.9023          ?        ?      442.7        2.8       ?       ? 
1 1 1   13    7   63 o     40.5   16.2    0.0000   0.0000          ?        ?     8.3008  19.7942          ?        ?       40.5       16.2       ?       ? 
1 1 1   13    7   64 o    386.4    3.1    0.0000   0.0000          ?        ?  1493.5021  23.6253          ?        ?      386.4        3.1       ?       ? 
1 1 1   13    7   65 o     21.8   10.9    0.0000   0.0000          ?        ?   -58.7440  20.4327          ?        ?       21.8       10.9       ?       ? 
1 1 1   13    7   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    7   67 o    225.6    4.7    0.0000   0.0000          ?        ?   509.5403  21.0712          ?        ?      225.6        4.7       ?       ? 
1 1 1   13    7   68 o     21.6   10.9    0.0000   0.0000          ?        ?   -63.8522  21.0712          ?        ?       21.6       10.9       ?       ? 
1 1 1   13    7   69 o    156.0    6.3    0.0000   0.0000          ?        ?   243.9153  19.7942          ?        ?      156.0        6.3       ?       ? 
1 1 1   13    7   70 o     24.7   12.2    0.0000   0.0000          ?        ?   -44.0580  21.0712          ?        ?       24.7       12.2       ?       ? 
1 1 1   13    7   71 o    114.6    8.9    0.0000   0.0000          ?        ?   132.1740  20.4327          ?        ?      114.6        8.9       ?       ? 
1 1 1   13    7   72 o     24.4   12.0    0.0000   0.0000          ?        ?   -42.1424  20.4327          ?        ?       24.4       12.0       ?       ? 
1 1 1   13    7   73 o    128.4    8.7    0.0000   0.0000          ?        ?   166.0156  22.3483          ?        ?      128.4        8.7       ?       ? 
1 1 1   13    7   74 o     44.9   17.0    0.0000   0.0000          ?        ?    15.3245  21.0712          ?        ?       44.9       17.0       ?       ? 
1 1 1   13    7   75 o     31.5   14.5    0.0000   0.0000          ?        ?   -15.3245  21.0712          ?        ?       31.5       14.5       ?       ? 
1 1 1   13    7   76 o    119.8    8.8    0.0000   0.0000          ?        ?   144.9444  21.0712          ?        ?      119.8        8.8       ?       ? 
1 1 1   13    7   77 o    173.1    6.3    0.0000   0.0000          ?        ?   301.3822  21.7097          ?        ?      173.1        6.3       ?       ? 
1 1 1   13    7   78 o     23.9   11.8    0.0000   0.0000          ?        ?   -44.0580  20.4327          ?        ?       23.9       11.8       ?       ? 
1 1 1   13    7   79 o    138.3    7.9    0.0000   0.0000          ?        ?   193.4720  21.7097          ?        ?      138.3        7.9       ?       ? 
1 1 1   13    8    0 o    494.7    3.1 2448.0918  30.6490  2448.0918  30.6490  2448.0918  30.6490      494.7      3.1      494.7        3.1     0.0     0.0 
1 1 1   13    8    1 o   1604.4    5.8    0.0000   0.0000          ?        ? 25745.8320 185.8098          ?        ?     1604.4        5.8       ?       ? 
1 1 1   13    8    2 o    787.2    3.0    0.0000   0.0000          ?        ?  6196.8525  46.6121          ?        ?      787.2        3.0       ?       ? 
1 1 1   13    8    3 o   1341.4    4.6    0.0000   0.0000          ?        ? 17994.1777 124.5117          ?        ?     1341.4        4.6       ?       ? 
1 1 1   13    8    4 o    502.0    1.9    0.0000   0.0000          ?        ?  2520.2449  19.1556          ?        ?      502.0        1.9       ?       ? 
1 1 1   13    8    5 o     53.0    3.0    0.0000   0.0000          ?        ?    28.0950   3.1926          ?        ?       53.0        3.0       ?       ? 
1 1 1   13    8    6 o    772.2    2.7    0.0000   0.0000          ?        ?  5962.5146  42.1424          ?        ?      772.2        2.7       ?       ? 
1 1 1   13    8    7 o    607.1    2.3    0.0000   0.0000          ?        ?  3685.5469  28.0950          ?        ?      607.1        2.3       ?       ? 
1 1 1   13    8    8 o    717.9    2.6    0.0000   0.0000          ?        ?  5154.1465  37.6728          ?        ?      717.9        2.6       ?       ? 
1 1 1   13    8    9 o     46.6    4.1    0.0000   0.0000          ?        ?    21.7097   3.8311          ?        ?       46.6        4.1       ?       ? 
1 1 1   13    8   10 o   1052.1    3.6    0.0000   0.0000          ?        ? 11070.6885  75.3456          ?        ?     1052.1        3.6       ?       ? 
1 1 1   13    8   11 o    777.1    2.8    0.0000   0.0000          ?        ?  6038.4990  42.7809          ?        ?      777.1        2.8       ?       ? 
1 1 1   13    8   12 o    815.4    2.9    0.0000   0.0000          ?        ?  6648.2866  47.2506          ?        ?      815.4        2.9       ?       ? 
1 1 1   13    8   13 o    735.8    2.7    0.0000   0.0000          ?        ?  5414.6636  39.5883          ?        ?      735.8        2.7       ?       ? 
1 1 1   13    8   14 o   1304.3    4.4    0.0000   0.0000          ?        ? 17014.6855 114.2954          ?        ?     1304.3        4.4       ?       ? 
1 1 1   13    8   15 o    641.9    2.4    0.0000   0.0000          ?        ?  4120.3799  31.2876          ?        ?      641.9        2.4       ?       ? 
1 1 1   13    8   16 o   1393.9    4.6    0.0000   0.0000          ?        ? 19432.1289 128.9814          ?        ?     1393.9        4.6       ?       ? 
1 1 1   13    8   17 o    180.1    2.1    0.0000   0.0000          ?        ?   324.3690   7.6623          ?        ?      180.1        2.1       ?       ? 
1 1 1   13    8   18 o    909.1    3.2    0.0000   0.0000          ?        ?  8265.0244  58.1055          ?        ?      909.1        3.2       ?       ? 
1 1 1   13    8   19 o    426.4    2.0    0.0000   0.0000          ?        ?  1817.8711  17.2401          ?        ?      426.4        2.0       ?       ? 
1 1 1   13    8   20 o    807.9    3.0    0.0000   0.0000          ?        ?  6527.6064  49.1662          ?        ?      807.9        3.0       ?       ? 
1 1 1   13    8   21 o    641.6    2.5    0.0000   0.0000          ?        ?  4116.5488  31.9261          ?        ?      641.6        2.5       ?       ? 
1 1 1   13    8   22 o   1425.5    4.8    0.0000   0.0000          ?        ? 20321.5898 136.0051          ?        ?     1425.5        4.8       ?       ? 
1 1 1   13    8   23 o   1603.7    5.3    0.0000   0.0000          ?        ? 25720.2910 169.2082          ?        ?     1603.7        5.3       ?       ? 
1 1 1   13    8   24 o     28.3   11.7    0.0000   0.0000          ?        ?     1.9156  10.8549          ?        ?       28.3       11.7       ?       ? 
1 1 1   13    8   25 o    323.7    2.1    0.0000   0.0000          ?        ?  1047.8141  13.4090          ?        ?      323.7        2.1       ?       ? 
1 1 1   13    8   26 o   1246.6    4.5    0.0000   0.0000          ?        ? 15541.6162 111.1028          ?        ?     1246.6        4.5       ?       ? 
1 1 1   13    8   27 o   1339.7    4.9    0.0000   0.0000          ?        ? 17950.1191 130.2584          ?        ?     1339.7        4.9       ?       ? 
1 1 1   13    8   28 o   1293.2    4.6    0.0000   0.0000          ?        ? 16724.7969 118.7650          ?        ?     1293.2        4.6       ?       ? 
1 1 1   13    8   29 o    887.0    3.2    0.0000   0.0000          ?        ?  7868.5024  57.4669          ?        ?      887.0        3.2       ?       ? 
1 1 1   13    8   30 o   1235.0    4.2    0.0000   0.0000          ?        ? 15254.2812 104.0790          ?        ?     1235.0        4.2       ?       ? 
1 1 1   13    8   31 o    711.6    3.0    0.0000   0.0000          ?        ?  5063.4766  42.7809          ?        ?      711.6        3.0       ?       ? 
1 1 1   13    8   32 o     42.0   14.4    0.0000   0.0000          ?        ?    15.9630  14.6860          ?        ?       42.0       14.4       ?       ? 
1 1 1   13    8   33 f   1220.8    4.4    0.0000   0.0000          ?        ? 14905.6484 106.6331          ?        ?     1220.8        4.4       ?       ? 
1 1 1   13    8   34 o    409.2    2.5    0.0000   0.0000          ?        ?  1674.8422  20.4327          ?        ?      409.2        2.5       ?       ? 
1 1 1   13    8   35 o   2060.4    6.8    0.0000   0.0000          ?        ? 42461.0508 282.2266          ?        ?     2060.4        6.8       ?       ? 
1 1 1   13    8   36 o    444.8    2.7    0.0000   0.0000          ?        ?  1978.1399  23.6253          ?        ?      444.8        2.7       ?       ? 
1 1 1   13    8   37 f   1047.6    3.9    0.0000   0.0000          ?        ? 10976.1865  81.7308          ?        ?     1047.6        3.9       ?       ? 
1 1 1   13    8   38 o    589.4    2.9    0.0000   0.0000          ?        ?  3473.5576  33.8416          ?        ?      589.4        2.9       ?       ? 
1 1 1   13    8   39 o    539.3    2.7    0.0000   0.0000          ?        ?  2908.4661  28.7335          ?        ?      539.3        2.7       ?       ? 
1 1 1   13    8   40 o   1191.6    4.2    0.0000   0.0000          ?        ? 14200.0820 100.8864          ?        ?     1191.6        4.2       ?       ? 
1 1 1   13    8   41 o    990.6    3.6    0.0000   0.0000          ?        ?  9814.0771  70.8759          ?        ?      990.6        3.6       ?       ? 
1 1 1   13    8   42 o    909.4    3.4    0.0000   0.0000          ?        ?  8270.7705  61.9366          ?        ?      909.4        3.4       ?       ? 
1 1 1   13    8   43 o     31.0   14.3    0.0000   0.0000          ?        ?   -15.9630  20.4327          ?        ?       31.0       14.3       ?       ? 
1 1 1   13    8   44 o     73.7   13.5    0.0000   0.0000          ?        ?    56.1899  19.1556          ?        ?       73.7       13.5       ?       ? 
1 1 1   13    8   45 o    896.3    3.4    0.0000   0.0000          ?        ?  8033.8789  61.2981          ?        ?      896.3        3.4       ?       ? 
1 1 1   13    8   46 o    541.2    2.6    0.0000   0.0000          ?        ?  2929.5371  28.0950          ?        ?      541.2        2.6       ?       ? 
1 1 1   13    8   47 o    643.5    3.0    0.0000   0.0000          ?        ?  4140.8130  38.9498          ?        ?      643.5        3.0       ?       ? 
1 1 1   13    8   48 o    202.1    4.7    0.0000   0.0000          ?        ?   408.6538  19.1556          ?        ?      202.1        4.7       ?       ? 
1 1 1   13    8   49 o    180.4    5.1    0.0000   0.0000          ?        ?   325.6460  18.5171          ?        ?      180.4        5.1       ?       ? 
1 1 1   13    8   50 o    419.1    2.7    0.0000   0.0000          ?        ?  1756.5730  22.3483          ?        ?      419.1        2.7       ?       ? 
1 1 1   13    8   51 o    676.0    2.8    0.0000   0.0000          ?        ?  4570.5376  37.6728          ?        ?      676.0        2.8       ?       ? 
1 1 1   13    8   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    8   53 o    503.7    2.6    0.0000   0.0000          ?        ?  2537.4849  26.1794          ?        ?      503.7        2.6       ?       ? 
1 1 1   13    8   54 o    455.1    2.7    0.0000   0.0000          ?        ?  2071.3640  24.9023          ?        ?      455.1        2.7       ?       ? 
1 1 1   13    8   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    8   56 o    418.5    2.7    0.0000   0.0000          ?        ?  1752.1033  22.9868          ?        ?      418.5        2.7       ?       ? 
1 1 1   13    8   57 o    313.9    3.2    0.0000   0.0000          ?        ?   985.8774  19.7942          ?        ?      313.9        3.2       ?       ? 
1 1 1   13    8   58 o    103.7    8.9    0.0000   0.0000          ?        ?   107.9102  18.5171          ?        ?      103.7        8.9       ?       ? 
1 1 1   13    8   59 o    107.1    8.3    0.0000   0.0000          ?        ?   114.9339  17.8786          ?        ?      107.1        8.3       ?       ? 
1 1 1   13    8   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    8   61 o    352.8    3.0    0.0000   0.0000          ?        ?  1245.1172  21.0712          ?        ?      352.8        3.0       ?       ? 
1 1 1   13    8   62 o    250.4    4.0    0.0000   0.0000          ?        ?   627.6667  19.7942          ?        ?      250.4        4.0       ?       ? 
1 1 1   13    8   63 o    537.8    2.7    0.0000   0.0000          ?        ?  2893.7800  28.7335          ?        ?      537.8        2.7       ?       ? 
1 1 1   13    8   64 o    295.7    3.7    0.0000   0.0000          ?        ?   874.7747  21.7097          ?        ?      295.7        3.7       ?       ? 
1 1 1   13    8   65 o    117.2    8.7    0.0000   0.0000          ?        ?   137.9207  20.4327          ?        ?      117.2        8.7       ?       ? 
1 1 1   13    8   66 o    245.1    4.3    0.0000   0.0000          ?        ?   601.4874  21.0712          ?        ?      245.1        4.3       ?       ? 
1 1 1   13    8   67 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    8   68 o    390.9    3.0    0.0000   0.0000          ?        ?  1529.2593  23.6253          ?        ?      390.9        3.0       ?       ? 
1 1 1   13    8   69 o    228.9    4.6    0.0000   0.0000          ?        ?   524.8647  21.0712          ?        ?      228.9        4.6       ?       ? 
1 1 1   13    8   70 o     34.4   15.2    0.0000   0.0000          ?        ?    -5.7467  20.4327          ?        ?       34.4       15.2       ?       ? 
1 1 1   13    8   71 o    162.3    6.5    0.0000   0.0000          ?        ?   264.3480  21.0712          ?        ?      162.3        6.5       ?       ? 
1 1 1   13    8   72 o    234.2    4.8    0.0000   0.0000          ?        ?   549.7671  22.3483          ?        ?      234.2        4.8       ?       ? 
1 1 1   13    8   73 o    231.7    4.8    0.0000   0.0000          ?        ?   538.2737  22.3483          ?        ?      231.7        4.8       ?       ? 
1 1 1   13    8   74 o     48.2   17.7    0.0000   0.0000          ?        ?    19.7942  22.3483          ?        ?       48.2       17.7       ?       ? 
1 1 1   13    8   75 o     24.1   11.9    0.0000   0.0000          ?        ?   -43.4195  20.4327          ?        ?       24.1       11.9       ?       ? 
1 1 1   13    8   76 o     20.1   10.2    0.0000   0.0000          ?        ?   -70.8759  20.4327          ?        ?       20.1       10.2       ?       ? 
1 1 1   13    8   77 o    318.9    3.8    0.0000   0.0000          ?        ?  1019.0806  24.2638          ?        ?      318.9        3.8       ?       ? 
1 1 1   13    8   78 f     28.1   13.4    0.0000   0.0000          ?        ?   -26.8179  21.0712          ?        ?       28.1       13.4       ?       ? 
1 1 1   13    8   79 o    149.8    7.0    0.0000   0.0000          ?        ?   226.6752  21.0712          ?        ?      149.8        7.0       ?       ? 
1 1 1   13    9    0 o   1270.0    6.6 16132.8877 167.9312 16132.8877 167.9312 16132.8877 167.9312     1270.0      6.6     1270.0        6.6     0.0     0.0 
1 1 1   13    9    1 o   1219.0    4.6    0.0000   0.0000          ?        ? 14861.5908 113.0183          ?        ?     1219.0        4.6       ?       ? 
1 1 1   13    9    2 o    560.4    2.4    0.0000   0.0000          ?        ?  3140.8879  26.8179          ?        ?      560.4        2.4       ?       ? 
1 1 1   13    9    3 f    128.6    1.5    0.0000   0.0000          ?        ?   165.3771   3.8311          ?        ?      128.6        1.5       ?       ? 
1 1 1   13    9    4 o    777.5    2.8    0.0000   0.0000          ?        ?  6045.5225  42.7809          ?        ?      777.5        2.8       ?       ? 
1 1 1   13    9    5 o    470.7    1.9    0.0000   0.0000          ?        ?  2215.6699  17.8786          ?        ?      470.7        1.9       ?       ? 
1 1 1   13    9    6 o    546.1    2.4    0.0000   0.0000          ?        ?  2981.8960  26.1794          ?        ?      546.1        2.4       ?       ? 
1 1 1   13    9    7 o    330.8    1.5    0.0000   0.0000          ?        ?  1094.4260  10.2163          ?        ?      330.8        1.5       ?       ? 
1 1 1   13    9    8 o    309.6    1.8    0.0000   0.0000          ?        ?   958.4210  10.8549          ?        ?      309.6        1.8       ?       ? 
1 1 1   13    9    9 o    885.2    3.1    0.0000   0.0000          ?        ?  7835.9370  54.2743          ?        ?      885.2        3.1       ?       ? 
1 1 1   13    9   10 o    816.9    2.9    0.0000   0.0000          ?        ?  6673.1895  47.2506          ?        ?      816.9        2.9       ?       ? 
1 1 1   13    9   11 o   1174.6    4.0    0.0000   0.0000          ?        ? 13798.4521  93.2242          ?        ?     1174.6        4.0       ?       ? 
1 1 1   13    9   12 o    632.8    2.4    0.0000   0.0000          ?        ?  4004.8076  30.0105          ?        ?      632.8        2.4       ?       ? 
1 1 1   13    9   13 o   1603.3    5.3    0.0000   0.0000          ?        ? 25708.7969 168.5697          ?        ?     1603.3        5.3       ?       ? 
1 1 1   13    9   14 o    828.0    2.9    0.0000   0.0000          ?        ?  6856.4453  48.5276          ?        ?      828.0        2.9       ?       ? 
1 1 1   13    9   15 o    521.2    2.2    0.0000   0.0000          ?        ?  2716.2710  22.9868          ?        ?      521.2        2.2       ?       ? 
1 1 1   13    9   16 o   1167.2    4.0    0.0000   0.0000          ?        ? 13625.4121  92.5856          ?        ?     1167.2        4.0       ?       ? 
1 1 1   13    9   17 o    582.5    2.3    0.0000   0.0000          ?        ?  3393.1040  26.8179          ?        ?      582.5        2.3       ?       ? 
1 1 1   13    9   18 o   1022.2    3.6    0.0000   0.0000          ?        ? 10449.4062  74.0685          ?        ?     1022.2        3.6       ?       ? 
1 1 1   13    9   19 o   1154.3    4.0    0.0000   0.0000          ?        ? 13324.6699  93.2242          ?        ?     1154.3        4.0       ?       ? 
1 1 1   13    9   20 o   1034.8    3.6    0.0000   0.0000          ?        ? 10709.2842  74.7070          ?        ?     1034.8        3.6       ?       ? 
1 1 1   13    9   21 o   1888.3    6.2    0.0000   0.0000          ?        ? 35660.7930 233.0604          ?        ?     1888.3        6.2       ?       ? 
1 1 1   13    9   22 o    553.0    2.4    0.0000   0.0000          ?        ?  3058.5186  26.1794          ?        ?      553.0        2.4       ?       ? 
1 1 1   13    9   23 o   1282.3    4.4    0.0000   0.0000          ?        ? 16445.1250 113.6568          ?        ?     1282.3        4.4       ?       ? 
1 1 1   13    9   24 o   1908.5    6.5    0.0000   0.0000          ?        ? 36430.2109 248.3849          ?        ?     1908.5        6.5       ?       ? 
1 1 1   13    9   25 o    512.2    2.4    0.0000   0.0000          ?        ?  2623.0469  24.2638          ?        ?      512.2        2.4       ?       ? 
1 1 1   13    9   26 o    969.1    3.6    0.0000   0.0000          ?        ?  9391.3760  70.2374          ?        ?      969.1        3.6       ?       ? 
1 1 1   13    9   27 o   1983.8    7.0    0.0000   0.0000          ?        ? 39362.3047 279.0340          ?        ?     1983.8        7.0       ?       ? 
1 1 1   13    9   28 o    938.3    3.5    0.0000   0.0000          ?        ?  8804.5752  65.7677          ?        ?      938.3        3.5       ?       ? 
1 1 1   13    9   29 o    864.7    3.2    0.0000   0.0000          ?        ?  7476.4497  55.5514          ?        ?      864.7        3.2       ?       ? 
1 1 1   13    9   30 o    379.9    2.6    0.0000   0.0000          ?        ?  1443.0588  19.7942          ?        ?      379.9        2.6       ?       ? 
1 1 1   13    9   31 o    915.5    3.4    0.0000   0.0000          ?        ?  8382.5127  61.9366          ?        ?      915.5        3.4       ?       ? 
1 1 1   13    9   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    9   33 o    261.9    3.0    0.0000   0.0000          ?        ?   685.7722  15.9630          ?        ?      261.9        3.0       ?       ? 
1 1 1   13    9   34 o   1428.9    4.8    0.0000   0.0000          ?        ? 20420.5605 136.0051          ?        ?     1428.9        4.8       ?       ? 
1 1 1   13    9   35 o    382.5    2.8    0.0000   0.0000          ?        ?  1463.4916  21.0712          ?        ?      382.5        2.8       ?       ? 
1 1 1   13    9   36 o    538.9    2.7    0.0000   0.0000          ?        ?  2904.6348  28.7335          ?        ?      538.9        2.7       ?       ? 
1 1 1   13    9   37 f    693.1    2.8    0.0000   0.0000          ?        ?  4803.5981  38.9498          ?        ?      693.1        2.8       ?       ? 
1 1 1   13    9   38 o   1340.1    4.6    0.0000   0.0000          ?        ? 17961.6133 123.8732          ?        ?     1340.1        4.6       ?       ? 
1 1 1   13    9   39 f   1194.7    4.2    0.0000   0.0000          ?        ? 14275.4277 100.2479          ?        ?     1194.7        4.2       ?       ? 
1 1 1   13    9   40 o    259.3    3.8    0.0000   0.0000          ?        ?   672.3633  19.7942          ?        ?      259.3        3.8       ?       ? 
1 1 1   13    9   41 o   1195.5    4.2    0.0000   0.0000          ?        ? 14293.9453 100.2479          ?        ?     1195.5        4.2       ?       ? 
1 1 1   13    9   42 o   1550.3    5.1    0.0000   0.0000          ?        ? 24040.3398 159.6304          ?        ?     1550.3        5.1       ?       ? 
1 1 1   13    9   43 o    692.2    3.0    0.0000   0.0000          ?        ?  4792.1050  40.8654          ?        ?      692.2        3.0       ?       ? 
1 1 1   13    9   44 o    939.0    3.6    0.0000   0.0000          ?        ?  8818.6221  67.6833          ?        ?      939.0        3.6       ?       ? 
1 1 1   13    9   45 o    712.8    3.0    0.0000   0.0000          ?        ?  5081.9937  42.1424          ?        ?      712.8        3.0       ?       ? 
1 1 1   13    9   46 o    182.9    5.2    0.0000   0.0000          ?        ?   334.5853  19.1556          ?        ?      182.9        5.2       ?       ? 
1 1 1   13    9   47 o    878.7    3.3    0.0000   0.0000          ?        ?  7722.9189  58.7440          ?        ?      878.7        3.3       ?       ? 
1 1 1   13    9   48 o    438.7    2.8    0.0000   0.0000          ?        ?  1925.1427  24.9023          ?        ?      438.7        2.8       ?       ? 
1 1 1   13    9   49 o    495.7    2.6    0.0000   0.0000          ?        ?  2457.0312  25.5409          ?        ?      495.7        2.6       ?       ? 
1 1 1   13    9   50 o   1106.0    3.9    0.0000   0.0000          ?        ? 12235.3516  86.8389          ?        ?     1106.0        3.9       ?       ? 
1 1 1   13    9   51 o    193.4    5.1    0.0000   0.0000          ?        ?   374.1737  19.7942          ?        ?      193.4        5.1       ?       ? 
1 1 1   13    9   52 o    452.9    2.7    0.0000   0.0000          ?        ?  2051.5698  24.2638          ?        ?      452.9        2.7       ?       ? 
1 1 1   13    9   53 o    951.0    3.5    0.0000   0.0000          ?        ?  9046.5752  65.7677          ?        ?      951.0        3.5       ?       ? 
1 1 1   13    9   54 o    331.5    3.2    0.0000   0.0000          ?        ?  1098.8958  21.0712          ?        ?      331.5        3.2       ?       ? 
1 1 1   13    9   55 o    152.8    6.3    0.0000   0.0000          ?        ?   233.6989  19.1556          ?        ?      152.8        6.3       ?       ? 
1 1 1   13    9   56 f    533.9    2.8    0.0000   0.0000          ?        ?  2851.6377  29.3720          ?        ?      533.9        2.8       ?       ? 
1 1 1   13    9   57 o    746.0    3.0    0.0000   0.0000          ?        ?  5567.2700  44.0580          ?        ?      746.0        3.0       ?       ? 
1 1 1   13    9   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13    9   59 o    519.8    2.7    0.0000   0.0000          ?        ?  2702.2236  28.0950          ?        ?      519.8        2.7       ?       ? 
1 1 1   13    9   60 o     21.6   10.8    0.0000   0.0000          ?        ?   -51.7203  19.1556          ?        ?       21.6       10.8       ?       ? 
1 1 1   13    9   61 o    392.0    2.9    0.0000   0.0000          ?        ?  1536.9215  22.9868          ?        ?      392.0        2.9       ?       ? 
1 1 1   13    9   62 o    199.3    4.8    0.0000   0.0000          ?        ?   397.7990  19.1556          ?        ?      199.3        4.8       ?       ? 
1 1 1   13    9   63 f    196.9    4.9    0.0000   0.0000          ?        ?   388.2211  19.1556          ?        ?      196.9        4.9       ?       ? 
1 1 1   13    9   64 o    105.5    9.1    0.0000   0.0000          ?        ?   111.7413  19.1556          ?        ?      105.5        9.1       ?       ? 
1 1 1   13    9   65 o    225.4    4.7    0.0000   0.0000          ?        ?   508.9017  21.0712          ?        ?      225.4        4.7       ?       ? 
1 1 1   13    9   66 o    205.9    5.1    0.0000   0.0000          ?        ?   424.6169  21.0712          ?        ?      205.9        5.1       ?       ? 
1 1 1   13    9   67 f    231.6    4.7    0.0000   0.0000          ?        ?   536.9967  21.7097          ?        ?      231.6        4.7       ?       ? 
1 1 1   13    9   68 o     92.8   11.4    0.0000   0.0000          ?        ?    86.8389  21.0712          ?        ?       92.8       11.4       ?       ? 
1 1 1   13    9   69 o    230.9    4.6    0.0000   0.0000          ?        ?   533.8041  21.0712          ?        ?      230.9        4.6       ?       ? 
1 1 1   13    9   70 o    111.5    8.9    0.0000   0.0000          ?        ?   125.1502  19.7942          ?        ?      111.5        8.9       ?       ? 
1 1 1   13    9   71 o    228.7    4.9    0.0000   0.0000          ?        ?   524.2263  22.3483          ?        ?      228.7        4.9       ?       ? 
1 1 1   13    9   72 o    109.6    9.9    0.0000   0.0000          ?        ?   121.3191  21.7097          ?        ?      109.6        9.9       ?       ? 
1 1 1   13    9   73 o    101.0   11.1    0.0000   0.0000          ?        ?   103.4405  22.3483          ?        ?      101.0       11.1       ?       ? 
1 1 1   13    9   74 o     20.1   10.2    0.0000   0.0000          ?        ?   -75.9841  21.0712          ?        ?       20.1       10.2       ?       ? 
1 1 1   13    9   75 o     85.6   12.3    0.0000   0.0000          ?        ?    74.7070  21.0712          ?        ?       85.6       12.3       ?       ? 
1 1 1   13    9   76 o    116.3    8.8    0.0000   0.0000          ?        ?   136.6436  20.4327          ?        ?      116.3        8.8       ?       ? 
1 1 1   13    9   77 o    194.8    5.6    0.0000   0.0000          ?        ?   381.1974  21.7097          ?        ?      194.8        5.6       ?       ? 
1 1 1   13    9   78 o     49.4   16.8    0.0000   0.0000          ?        ?    24.2638  19.7942          ?        ?       49.4       16.8       ?       ? 
1 1 1   13    9   79 o     39.0   15.4    0.0000   0.0000          ?        ?     9.5778  17.8786          ?        ?       39.0       15.4       ?       ? 
1 1 1   13   10    0 o   1153.8    6.4 13314.4531 148.7755 13314.4531 148.7755 13314.4531 148.7755     1153.8      6.4     1153.8        6.4     0.0     0.0 
1 1 1   13   10    1 o    783.2    3.3    0.0000   0.0000          ?        ?  6134.9155  51.0817          ?        ?      783.2        3.3       ?       ? 
1 1 1   13   10    2 o   1141.8    4.3    0.0000   0.0000          ?        ? 13039.2500  97.6938          ?        ?     1141.8        4.3       ?       ? 
1 1 1   13   10    3 o    907.5    3.5    0.0000   0.0000          ?        ?  8236.2910  63.2136          ?        ?      907.5        3.5       ?       ? 
1 1 1   13   10    4 o    407.5    1.7    0.0000   0.0000          ?        ?  1660.7948  14.0475          ?        ?      407.5        1.7       ?       ? 
1 1 1   13   10    5 o    368.7    1.6    0.0000   0.0000          ?        ?  1359.4125  12.1319          ?        ?      368.7        1.6       ?       ? 
1 1 1   13   10    6 o    723.8    2.7    0.0000   0.0000          ?        ?  5239.7085  38.9498          ?        ?      723.8        2.7       ?       ? 
1 1 1   13   10    7 o    630.8    2.4    0.0000   0.0000          ?        ?  3978.6282  30.0105          ?        ?      630.8        2.4       ?       ? 
1 1 1   13   10    8 o   1060.7    3.6    0.0000   0.0000          ?        ? 11252.0273  76.6226          ?        ?     1060.7        3.6       ?       ? 
1 1 1   13   10    9 o   1162.0    3.9    0.0000   0.0000          ?        ? 13504.0928  91.3086          ?        ?     1162.0        3.9       ?       ? 
1 1 1   13   10   10 o     93.2    2.7    0.0000   0.0000          ?        ?    86.8389   5.1082          ?        ?       93.2        2.7       ?       ? 
1 1 1   13   10   11 o    826.2    2.9    0.0000   0.0000          ?        ?  6827.0728  47.8891          ?        ?      826.2        2.9       ?       ? 
1 1 1   13   10   12 o    854.8    3.0    0.0000   0.0000          ?        ?  7307.8799  51.0817          ?        ?      854.8        3.0       ?       ? 
1 1 1   13   10   13 o   1212.0    4.1    0.0000   0.0000          ?        ? 14691.1055  98.9709          ?        ?     1212.0        4.1       ?       ? 
1 1 1   13   10   14 f    693.7    2.6    0.0000   0.0000          ?        ?  4812.5376  35.7572          ?        ?      693.7        2.6       ?       ? 
1 1 1   13   10   15 o    338.3    1.8    0.0000   0.0000          ?        ?  1144.2307  12.1319          ?        ?      338.3        1.8       ?       ? 
1 1 1   13   10   16 o    654.7    2.5    0.0000   0.0000          ?        ?  4287.0342  33.2031          ?        ?      654.7        2.5       ?       ? 
1 1 1   13   10   17 o    773.3    2.8    0.0000   0.0000          ?        ?  5980.3936  44.0580          ?        ?      773.3        2.8       ?       ? 
1 1 1   13   10   18 o   1595.8    5.4    0.0000   0.0000          ?        ? 25469.9883 172.4008          ?        ?     1595.8        5.4       ?       ? 
1 1 1   13   10   19 o    374.5    2.1    0.0000   0.0000          ?        ?  1402.1935  15.9630          ?        ?      374.5        2.1       ?       ? 
1 1 1   13   10   20 o    486.9    2.2    0.0000   0.0000          ?        ?  2370.8308  21.0712          ?        ?      486.9        2.2       ?       ? 
1 1 1   13   10   21 o   1364.2    4.7    0.0000   0.0000          ?        ? 18612.9062 127.7043          ?        ?     1364.2        4.7       ?       ? 
1 1 1   13   10   22 o   1209.3    4.4    0.0000   0.0000          ?        ? 14624.0615 106.6331          ?        ?     1209.3        4.4       ?       ? 
1 1 1   13   10   23 o   1168.3    4.2    0.0000   0.0000          ?        ? 13649.0391  98.3323          ?        ?     1168.3        4.2       ?       ? 
1 1 1   13   10   24 o    630.4    2.6    0.0000   0.0000          ?        ?  3973.5200  32.5646          ?        ?      630.4        2.6       ?       ? 
1 1 1   13   10   25 o    991.3    3.8    0.0000   0.0000          ?        ?  9826.2090  74.7070          ?        ?      991.3        3.8       ?       ? 
1 1 1   13   10   26 o   1452.4    5.0    0.0000   0.0000          ?        ? 21095.4785 145.5829          ?        ?     1452.4        5.0       ?       ? 
1 1 1   13   10   27 o   1349.1    4.9    0.0000   0.0000          ?        ? 18202.9746 131.5355          ?        ?     1349.1        4.9       ?       ? 
1 1 1   13   10   28 o    620.3    2.7    0.0000   0.0000          ?        ?  3847.7312  33.2031          ?        ?      620.3        2.7       ?       ? 
1 1 1   13   10   29 o     68.7    9.8    0.0000   0.0000          ?        ?    47.2506  13.4090          ?        ?       68.7        9.8       ?       ? 
1 1 1   13   10   30 o   1182.9    4.0    0.0000   0.0000          ?        ? 13994.4785  95.1397          ?        ?     1182.9        4.0       ?       ? 
1 1 1   13   10   31 o   1137.6    4.1    0.0000   0.0000          ?        ? 12942.1953  92.5856          ?        ?     1137.6        4.1       ?       ? 
1 1 1   13   10   32 o   1503.2    5.1    0.0000   0.0000          ?        ? 22597.2812 153.8837          ?        ?     1503.2        5.1       ?       ? 
1 1 1   13   10   33 o    670.2    2.9    0.0000   0.0000          ?        ?  4491.3613  38.3113          ?        ?      670.2        2.9       ?       ? 
1 1 1   13   10   34 f    811.9    3.0    0.0000   0.0000          ?        ?  6592.7358  48.5276          ?        ?      811.9        3.0       ?       ? 
1 1 1   13   10   35 o    300.8    3.1    0.0000   0.0000          ?        ?   904.7851  18.5171          ?        ?      300.8        3.1       ?       ? 
1 1 1   13   10   36 o   1451.1    5.3    0.0000   0.0000          ?        ? 21059.0820 152.6067          ?        ?     1451.1        5.3       ?       ? 
1 1 1   13   10   37 o    586.9    2.9    0.0000   0.0000          ?        ?  3444.1858  33.8416          ?        ?      586.9        2.9       ?       ? 
1 1 1   13   10   38 o    694.1    2.9    0.0000   0.0000          ?        ?  4818.2842  39.5883          ?        ?      694.1        2.9       ?       ? 
1 1 1   13   10   39 o    276.5    3.7    0.0000   0.0000          ?        ?   764.3104  20.4327          ?        ?      276.5        3.7       ?       ? 
1 1 1   13   10   40 o    284.8    3.3    0.0000   0.0000          ?        ?   810.9225  18.5171          ?        ?      284.8        3.3       ?       ? 
1 1 1   13   10   41 o    339.5    3.0    0.0000   0.0000          ?        ?  1152.5315  20.4327          ?        ?      339.5        3.0       ?       ? 
1 1 1   13   10   42 o    189.8    5.2    0.0000   0.0000          ?        ?   360.1262  19.7942          ?        ?      189.8        5.2       ?       ? 
1 1 1   13   10   43 o   1163.6    4.0    0.0000   0.0000          ?        ? 13541.7666  93.8627          ?        ?     1163.6        4.0       ?       ? 
1 1 1   13   10   44 o    670.1    2.8    0.0000   0.0000          ?        ?  4490.0840  37.6728          ?        ?      670.1        2.8       ?       ? 
1 1 1   13   10   45 f    279.0    3.3    0.0000   0.0000          ?        ?   778.3578  18.5171          ?        ?      279.0        3.3       ?       ? 
1 1 1   13   10   46 o    654.2    2.9    0.0000   0.0000          ?        ?  4280.0103  37.6728          ?        ?      654.2        2.9       ?       ? 
1 1 1   13   10   47 o    715.5    2.9    0.0000   0.0000          ?        ?  5119.6665  40.8654          ?        ?      715.5        2.9       ?       ? 
1 1 1   13   10   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   10   49 o    399.9    2.7    0.0000   0.0000          ?        ?  1599.4967  21.7097          ?        ?      399.9        2.7       ?       ? 
1 1 1   13   10   50 o    471.4    2.7    0.0000   0.0000          ?        ?  2222.6938  25.5409          ?        ?      471.4        2.7       ?       ? 
1 1 1   13   10   51 o    318.7    3.4    0.0000   0.0000          ?        ?  1015.8879  21.7097          ?        ?      318.7        3.4       ?       ? 
1 1 1   13   10   52 o    738.0    3.0    0.0000   0.0000          ?        ?  5447.2280  44.0580          ?        ?      738.0        3.0       ?       ? 
1 1 1   13   10   53 o    259.5    3.8    0.0000   0.0000          ?        ?   673.6403  19.7942          ?        ?      259.5        3.8       ?       ? 
1 1 1   13   10   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   10   55 o    319.5    3.4    0.0000   0.0000          ?        ?  1020.9960  21.7097          ?        ?      319.5        3.4       ?       ? 
1 1 1   13   10   56 o    406.6    2.8    0.0000   0.0000          ?        ?  1653.7710  22.9868          ?        ?      406.6        2.8       ?       ? 
1 1 1   13   10   57 o    193.7    4.9    0.0000   0.0000          ?        ?   375.4507  19.1556          ?        ?      193.7        4.9       ?       ? 
1 1 1   13   10   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   10   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   10   60 o    148.5    6.2    0.0000   0.0000          ?        ?   220.9285  18.5171          ?        ?      148.5        6.2       ?       ? 
1 1 1   13   10   61 o    213.6    4.6    0.0000   0.0000          ?        ?   456.5430  19.7942          ?        ?      213.6        4.6       ?       ? 
1 1 1   13   10   62 o    311.1    3.3    0.0000   0.0000          ?        ?   968.6373  20.4327          ?        ?      311.1        3.3       ?       ? 
1 1 1   13   10   63 o    275.1    3.7    0.0000   0.0000          ?        ?   757.2866  20.4327          ?        ?      275.1        3.7       ?       ? 
1 1 1   13   10   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   10   65 o     24.3   11.9    0.0000   0.0000          ?        ?   -36.3957  19.1556          ?        ?       24.3       11.9       ?       ? 
1 1 1   13   10   66 o    207.0    5.1    0.0000   0.0000          ?        ?   429.0865  21.0712          ?        ?      207.0        5.1       ?       ? 
1 1 1   13   10   67 o    297.7    3.6    0.0000   0.0000          ?        ?   886.9065  21.7097          ?        ?      297.7        3.6       ?       ? 
1 1 1   13   10   68 o    295.1    3.7    0.0000   0.0000          ?        ?   871.5820  21.7097          ?        ?      295.1        3.7       ?       ? 
1 1 1   13   10   69 o    125.0    8.2    0.0000   0.0000          ?        ?   157.0763  20.4327          ?        ?      125.0        8.2       ?       ? 
1 1 1   13   10   70 o    216.4    4.9    0.0000   0.0000          ?        ?   469.3134  21.0712          ?        ?      216.4        4.9       ?       ? 
1 1 1   13   10   71 o    218.9    5.0    0.0000   0.0000          ?        ?   480.1682  21.7097          ?        ?      218.9        5.0       ?       ? 
1 1 1   13   10   72 o    173.7    5.9    0.0000   0.0000          ?        ?   302.6593  20.4327          ?        ?      173.7        5.9       ?       ? 
1 1 1   13   10   73 o    261.5    4.2    0.0000   0.0000          ?        ?   685.1337  21.7097          ?        ?      261.5        4.2       ?       ? 
1 1 1   13   10   74 o    182.7    5.9    0.0000   0.0000          ?        ?   335.2238  21.7097          ?        ?      182.7        5.9       ?       ? 
1 1 1   13   10   75 o    200.1    5.7    0.0000   0.0000          ?        ?   402.2686  22.9868          ?        ?      200.1        5.7       ?       ? 
1 1 1   13   10   76 o    129.4    8.4    0.0000   0.0000          ?        ?   169.2082  21.7097          ?        ?      129.4        8.4       ?       ? 
1 1 1   13   10   77 f     28.1   13.4    0.0000   0.0000          ?        ?   -26.8179  21.0712          ?        ?       28.1       13.4       ?       ? 
1 1 1   13   10   78 o    146.2    7.0    0.0000   0.0000          ?        ?   215.8203  20.4327          ?        ?      146.2        7.0       ?       ? 
1 1 1   13   10   79 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   11    0 o     54.3    7.0   30.0105   7.6623    30.0105   7.6623    30.0105   7.6623       54.3      7.0       54.3        7.0     0.0     0.0 
1 1 1   13   11    1 o    851.2    3.6    0.0000   0.0000          ?        ?  7246.5820  60.6596          ?        ?      851.2        3.6       ?       ? 
1 1 1   13   11    2 o   1229.4    4.5    0.0000   0.0000          ?        ? 15115.0840 111.7413          ?        ?     1229.4        4.5       ?       ? 
1 1 1   13   11    3 o    469.6    2.2    0.0000   0.0000          ?        ?  2205.4536  21.0712          ?        ?      469.6        2.2       ?       ? 
1 1 1   13   11    4 o    929.3    3.3    0.0000   0.0000          ?        ?  8636.6436  61.2981          ?        ?      929.3        3.3       ?       ? 
1 1 1   13   11    5 o    101.4    1.9    0.0000   0.0000          ?        ?   102.8020   3.8311          ?        ?      101.4        1.9       ?       ? 
1 1 1   13   11    6 o    259.1    1.6    0.0000   0.0000          ?        ?   671.0862   8.3008          ?        ?      259.1        1.6       ?       ? 
1 1 1   13   11    7 o    588.5    2.2    0.0000   0.0000          ?        ?  3463.9797  26.1794          ?        ?      588.5        2.2       ?       ? 
1 1 1   13   11    8 o    768.5    2.7    0.0000   0.0000          ?        ?  5906.3252  42.1424          ?        ?      768.5        2.7       ?       ? 
1 1 1   13   11    9 o   1060.4    3.7    0.0000   0.0000          ?        ? 11245.0039  78.5382          ?        ?     1060.4        3.7       ?       ? 
1 1 1   13   11   10 o    992.6    3.5    0.0000   0.0000          ?        ?  9853.0273  68.9603          ?        ?      992.6        3.5       ?       ? 
1 1 1   13   11   11 o   1214.4    4.1    0.0000   0.0000          ?        ? 14749.2100 100.2479          ?        ?     1214.4        4.1       ?       ? 
1 1 1   13   11   12 o    338.9    1.8    0.0000   0.0000          ?        ?  1148.7003  12.1319          ?        ?      338.9        1.8       ?       ? 
1 1 1   13   11   13 o   1476.7    4.9    0.0000   0.0000          ?        ? 21809.3457 144.3059          ?        ?     1476.7        4.9       ?       ? 
1 1 1   13   11   14 o    847.0    3.0    0.0000   0.0000          ?        ?  7175.0674  51.0817          ?        ?      847.0        3.0       ?       ? 
1 1 1   13   11   15 o    666.7    2.5    0.0000   0.0000          ?        ?  4444.7490  33.2031          ?        ?      666.7        2.5       ?       ? 
1 1 1   13   11   16 o   1107.7    3.9    0.0000   0.0000          ?        ? 12269.8311  86.2004          ?        ?     1107.7        3.9       ?       ? 
1 1 1   13   11   17 o    839.3    3.1    0.0000   0.0000          ?        ?  7044.8096  51.7203          ?        ?      839.3        3.1       ?       ? 
1 1 1   13   11   18 o    781.0    2.9    0.0000   0.0000          ?        ?  6099.7969  45.3350          ?        ?      781.0        2.9       ?       ? 
1 1 1   13   11   19 o    471.2    2.1    0.0000   0.0000          ?        ?  2220.7781  19.7942          ?        ?      471.2        2.1       ?       ? 
1 1 1   13   11   20 o   1080.5    3.7    0.0000   0.0000          ?        ? 11674.7295  80.4537          ?        ?     1080.5        3.7       ?       ? 
1 1 1   13   11   21 o    848.3    3.2    0.0000   0.0000          ?        ?  7196.7769  53.6358          ?        ?      848.3        3.2       ?       ? 
1 1 1   13   11   22 o   1823.6    6.2    0.0000   0.0000          ?        ? 33259.9531 227.3137          ?        ?     1823.6        6.2       ?       ? 
1 1 1   13   11   23 o    517.1    2.3    0.0000   0.0000          ?        ?  2674.1284  24.2638          ?        ?      517.1        2.3       ?       ? 
1 1 1   13   11   24 o   1401.4    4.8    0.0000   0.0000          ?        ? 19639.6484 134.0895          ?        ?     1401.4        4.8       ?       ? 
1 1 1   13   11   25 o    733.8    2.9    0.0000   0.0000          ?        ?  5384.6528  42.1424          ?        ?      733.8        2.9       ?       ? 
1 1 1   13   11   26 o    560.3    2.4    0.0000   0.0000          ?        ?  3138.9724  26.8179          ?        ?      560.3        2.4       ?       ? 
1 1 1   13   11   27 o    571.2    2.5    0.0000   0.0000          ?        ?  3262.8455  28.0950          ?        ?      571.2        2.5       ?       ? 
1 1 1   13   11   28 o    718.4    2.8    0.0000   0.0000          ?        ?  5161.8091  40.2269          ?        ?      718.4        2.8       ?       ? 
1 1 1   13   11   29 o   1066.4    3.9    0.0000   0.0000          ?        ? 11373.3467  83.0078          ?        ?     1066.4        3.9       ?       ? 
1 1 1   13   11   30 o    176.3    4.3    0.0000   0.0000          ?        ?   310.9600  15.3245          ?        ?      176.3        4.3       ?       ? 
1 1 1   13   11   31 o   1329.3    4.6    0.0000   0.0000          ?        ? 17671.0859 122.5962          ?        ?     1329.3        4.6       ?       ? 
1 1 1   13   11   32 o   1071.8    3.8    0.0000   0.0000          ?        ? 11487.6426  82.3693          ?        ?     1071.8        3.8       ?       ? 
1 1 1   13   11   33 o   1178.9    4.3    0.0000   0.0000          ?        ? 13898.7002 100.2479          ?        ?     1178.9        4.3       ?       ? 
1 1 1   13   11   34 o    351.9    2.9    0.0000   0.0000          ?        ?  1238.0934  20.4327          ?        ?      351.9        2.9       ?       ? 
1 1 1   13   11   35 o   1694.8    6.2    0.0000   0.0000          ?        ? 28727.7266 210.7121          ?        ?     1694.8        6.2       ?       ? 
1 1 1   13   11   36 o    788.8    3.3    0.0000   0.0000          ?        ?  6223.0317  52.3588          ?        ?      788.8        3.3       ?       ? 
1 1 1   13   11   37 o   1402.3    4.8    0.0000   0.0000          ?        ? 19667.1055 136.0051          ?        ?     1402.3        4.8       ?       ? 
1 1 1   13   11   38 o    675.6    3.0    0.0000   0.0000          ?        ?  4564.7915  40.8654          ?        ?      675.6        3.0       ?       ? 
1 1 1   13   11   39 o    275.2    3.4    0.0000   0.0000          ?        ?   757.2866  18.5171          ?        ?      275.2        3.4       ?       ? 
1 1 1   13   11   40 o    937.1    3.6    0.0000   0.0000          ?        ?  8781.5879  67.0448          ?        ?      937.1        3.6       ?       ? 
1 1 1   13   11   41 o    909.1    3.4    0.0000   0.0000          ?        ?  8265.0244  62.5751          ?        ?      909.1        3.4       ?       ? 
1 1 1   13   11   42 o    732.6    3.0    0.0000   0.0000          ?        ?  5366.7744  43.4195          ?        ?      732.6        3.0       ?       ? 
1 1 1   13   11   43 o    862.3    3.3    0.0000   0.0000          ?        ?  7436.2227  56.1899          ?        ?      862.3        3.3       ?       ? 
1 1 1   13   11   44 o    170.0    5.6    0.0000   0.0000          ?        ?   289.2503  19.1556          ?        ?      170.0        5.6       ?       ? 
1 1 1   13   11   45 o    689.9    3.0    0.0000   0.0000          ?        ?  4760.1787  41.5039          ?        ?      689.9        3.0       ?       ? 
1 1 1   13   11   46 o    377.7    2.9    0.0000   0.0000          ?        ?  1427.0958  21.7097          ?        ?      377.7        2.9       ?       ? 
1 1 1   13   11   47 o    394.3    2.8    0.0000   0.0000          ?        ?  1554.8002  21.7097          ?        ?      394.3        2.8       ?       ? 
1 1 1   13   11   48 o    619.3    2.7    0.0000   0.0000          ?        ?  3836.2378  33.8416          ?        ?      619.3        2.7       ?       ? 
1 1 1   13   11   49 f    533.1    2.8    0.0000   0.0000          ?        ?  2842.0598  30.0105          ?        ?      533.1        2.8       ?       ? 
1 1 1   13   11   50 o    421.5    2.7    0.0000   0.0000          ?        ?  1777.0056  22.9868          ?        ?      421.5        2.7       ?       ? 
1 1 1   13   11   51 o    389.6    2.8    0.0000   0.0000          ?        ?  1518.4044  21.7097          ?        ?      389.6        2.8       ?       ? 
1 1 1   13   11   52 o    462.8    2.7    0.0000   0.0000          ?        ?  2142.2400  24.9023          ?        ?      462.8        2.7       ?       ? 
1 1 1   13   11   53 o    700.1    2.8    0.0000   0.0000          ?        ?  4901.9307  39.5883          ?        ?      700.1        2.8       ?       ? 
1 1 1   13   11   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   11   55 o    595.6    2.7    0.0000   0.0000          ?        ?  3547.6260  31.9261          ?        ?      595.6        2.7       ?       ? 
1 1 1   13   11   56 o    486.3    2.7    0.0000   0.0000          ?        ?  2365.0840  26.1794          ?        ?      486.3        2.7       ?       ? 
1 1 1   13   11   57 o     19.6    9.9    0.0000   0.0000          ?        ?   -61.9366  18.5171          ?        ?       19.6        9.9       ?       ? 
1 1 1   13   11   58 o     85.5   11.6    0.0000   0.0000          ?        ?    73.4300  19.7942          ?        ?       85.5       11.6       ?       ? 
1 1 1   13   11   59 o    435.3    2.8    0.0000   0.0000          ?        ?  1895.7706  24.2638          ?        ?      435.3        2.8       ?       ? 
1 1 1   13   11   60 o    411.7    2.9    0.0000   0.0000          ?        ?  1695.9135  23.6253          ?        ?      411.7        2.9       ?       ? 
1 1 1   13   11   61 o    426.4    2.8    0.0000   0.0000          ?        ?  1819.1481  24.2638          ?        ?      426.4        2.8       ?       ? 
1 1 1   13   11   62 o     46.6   16.2    0.0000   0.0000          ?        ?    19.7942  18.5171          ?        ?       46.6       16.2       ?       ? 
1 1 1   13   11   63 o     24.6   11.9    0.0000   0.0000          ?        ?   -31.9261  18.5171          ?        ?       24.6       11.9       ?       ? 
1 1 1   13   11   64 f    234.5    4.4    0.0000   0.0000          ?        ?   550.4056  20.4327          ?        ?      234.5        4.4       ?       ? 
1 1 1   13   11   65 o     44.1   16.8    0.0000   0.0000          ?        ?    14.0475  20.4327          ?        ?       44.1       16.8       ?       ? 
1 1 1   13   11   66 o    266.2    4.2    0.0000   0.0000          ?        ?   709.3975  22.3483          ?        ?      266.2        4.2       ?       ? 
1 1 1   13   11   67 o    208.0    5.4    0.0000   0.0000          ?        ?   433.5562  22.3483          ?        ?      208.0        5.4       ?       ? 
1 1 1   13   11   68 o    173.2    6.5    0.0000   0.0000          ?        ?   300.7437  22.3483          ?        ?      173.2        6.5       ?       ? 
1 1 1   13   11   69 o     32.8   15.0    0.0000   0.0000          ?        ?   -13.4090  21.7097          ?        ?       32.8       15.0       ?       ? 
1 1 1   13   11   70 o    236.3    4.6    0.0000   0.0000          ?        ?   559.3449  21.7097          ?        ?      236.3        4.6       ?       ? 
1 1 1   13   11   71 o    250.9    4.5    0.0000   0.0000          ?        ?   630.8594  22.3483          ?        ?      250.9        4.5       ?       ? 
1 1 1   13   11   72 o    142.1    7.2    0.0000   0.0000          ?        ?   203.0499  20.4327          ?        ?      142.1        7.2       ?       ? 
1 1 1   13   11   73 o    144.3    7.5    0.0000   0.0000          ?        ?   209.4351  21.7097          ?        ?      144.3        7.5       ?       ? 
1 1 1   13   11   74 o     29.7   13.9    0.0000   0.0000          ?        ?   -21.0712  21.0712          ?        ?       29.7       13.9       ?       ? 
1 1 1   13   11   75 o     32.9   14.8    0.0000   0.0000          ?        ?    -8.9393  20.4327          ?        ?       32.9       14.8       ?       ? 
1 1 1   13   11   76 o     85.4   12.3    0.0000   0.0000          ?        ?    74.7070  21.0712          ?        ?       85.4       12.3       ?       ? 
1 1 1   13   11   77 o     55.8   16.6    0.0000   0.0000          ?        ?    33.2031  19.7942          ?        ?       55.8       16.6       ?       ? 
1 1 1   13   11   78 o     25.7   12.4    0.0000   0.0000          ?        ?   -31.2876  19.7942          ?        ?       25.7       12.4       ?       ? 
1 1 1   13   12    0 o    290.3    3.0  842.8486  17.2401   842.8486  17.2401   842.8486  17.2401      290.3      3.0      290.3        3.0     0.0     0.0 
1 1 1   13   12    1 o   1058.5    4.6    0.0000   0.0000          ?        ? 11205.4160  97.6938          ?        ?     1058.5        4.6       ?       ? 
1 1 1   13   12    2 o   1104.5    4.2    0.0000   0.0000          ?        ? 12199.5938  93.8627          ?        ?     1104.5        4.2       ?       ? 
1 1 1   13   12    3 o    373.0    1.8    0.0000   0.0000          ?        ?  1391.3386  13.4090          ?        ?      373.0        1.8       ?       ? 
1 1 1   13   12    4 o    695.7    2.9    0.0000   0.0000          ?        ?  4840.6323  40.8654          ?        ?      695.7        2.9       ?       ? 
1 1 1   13   12    5 f    182.7    1.4    0.0000   0.0000          ?        ?   333.9468   5.1082          ?        ?      182.7        1.4       ?       ? 
1 1 1   13   12    6 o   1310.6    4.4    0.0000   0.0000          ?        ? 17178.1484 114.2954          ?        ?     1310.6        4.4       ?       ? 
1 1 1   13   12    7 o    879.8    3.0    0.0000   0.0000          ?        ?  7741.4365  53.6358          ?        ?      879.8        3.0       ?       ? 
1 1 1   13   12    8 o    589.5    2.2    0.0000   0.0000          ?        ?  3475.4731  26.1794          ?        ?      589.5        2.2       ?       ? 
1 1 1   13   12    9 o    979.3    3.4    0.0000   0.0000          ?        ?  9590.5947  66.4062          ?        ?      979.3        3.4       ?       ? 
1 1 1   13   12   10 o    716.5    2.6    0.0000   0.0000          ?        ?  5133.7139  37.6728          ?        ?      716.5        2.6       ?       ? 
1 1 1   13   12   11 o   1173.6    4.0    0.0000   0.0000          ?        ? 13774.1885  93.8627          ?        ?     1173.6        4.0       ?       ? 
1 1 1   13   12   12 o   1070.0    3.8    0.0000   0.0000          ?        ? 11449.9697  81.0922          ?        ?     1070.0        3.8       ?       ? 
1 1 1   13   12   13 o    296.2    1.9    0.0000   0.0000          ?        ?   877.3287  11.4934          ?        ?      296.2        1.9       ?       ? 
1 1 1   13   12   14 o    216.6    1.9    0.0000   0.0000          ?        ?   469.3134   8.3008          ?        ?      216.6        1.9       ?       ? 
1 1 1   13   12   15 o    909.2    3.3    0.0000   0.0000          ?        ?  8266.9395  59.3825          ?        ?      909.2        3.3       ?       ? 
1 1 1   13   12   16 o    644.6    2.6    0.0000   0.0000          ?        ?  4154.8604  33.2031          ?        ?      644.6        2.6       ?       ? 
1 1 1   13   12   17 o    675.2    2.6    0.0000   0.0000          ?        ?  4558.4062  35.1187          ?        ?      675.2        2.6       ?       ? 
1 1 1   13   12   18 o   1318.6    4.5    0.0000   0.0000          ?        ? 17388.8594 117.4880          ?        ?     1318.6        4.5       ?       ? 
1 1 1   13   12   19 o   1576.0    5.2    0.0000   0.0000          ?        ? 24841.0449 164.7386          ?        ?     1576.0        5.2       ?       ? 
1 1 1   13   12   20 o   1140.1    4.0    0.0000   0.0000          ?        ? 12999.6621  91.3086          ?        ?     1140.1        4.0       ?       ? 
1 1 1   13   12   21 o   1145.8    4.1    0.0000   0.0000          ?        ? 13128.6436  93.8627          ?        ?     1145.8        4.1       ?       ? 
1 1 1   13   12   22 o   1751.6    5.9    0.0000   0.0000          ?        ? 30684.7969 205.6040          ?        ?     1751.6        5.9       ?       ? 
1 1 1   13   12   23 o    327.8    2.3    0.0000   0.0000          ?        ?  1074.6320  15.3245          ?        ?      327.8        2.3       ?       ? 
1 1 1   13   12   24 o    942.1    3.7    0.0000   0.0000          ?        ?  8876.7275  69.5989          ?        ?      942.1        3.7       ?       ? 
1 1 1   13   12   25 o    640.6    2.8    0.0000   0.0000          ?        ?  4103.7788  36.3957          ?        ?      640.6        2.8       ?       ? 
1 1 1   13   12   26 o    902.4    3.4    0.0000   0.0000          ?        ?  8144.3433  61.2981          ?        ?      902.4        3.4       ?       ? 
1 1 1   13   12   27 f    940.8    3.5    0.0000   0.0000          ?        ?  8851.8252  65.1292          ?        ?      940.8        3.5       ?       ? 
1 1 1   13   12   28 o   1607.9    5.5    0.0000   0.0000          ?        ? 25857.5723 175.5934          ?        ?     1607.9        5.5       ?       ? 
1 1 1   13   12   29 o   1198.5    4.2    0.0000   0.0000          ?        ? 14364.8203 100.2479          ?        ?     1198.5        4.2       ?       ? 
1 1 1   13   12   30 o    752.3    2.9    0.0000   0.0000          ?        ?  5659.8560  44.0580          ?        ?      752.3        2.9       ?       ? 
1 1 1   13   12   31 o   1304.8    4.6    0.0000   0.0000          ?        ? 17025.5391 121.3191          ?        ?     1304.8        4.6       ?       ? 
1 1 1   13   12   32 o    535.6    2.9    0.0000   0.0000          ?        ?  2868.8777  31.2876          ?        ?      535.6        2.9       ?       ? 
1 1 1   13   12   33 o   1622.7    5.8    0.0000   0.0000          ?        ? 26335.1855 187.0868          ?        ?     1622.7        5.8       ?       ? 
1 1 1   13   12   34 o   1011.2    3.8    0.0000   0.0000          ?        ? 10226.5625  76.6226          ?        ?     1011.2        3.8       ?       ? 
1 1 1   13   12   35 o   1232.6    4.4    0.0000   0.0000          ?        ? 15195.5381 109.1872          ?        ?     1232.6        4.4       ?       ? 
1 1 1   13   12   36 o    776.9    3.1    0.0000   0.0000          ?        ?  6035.9448  47.8891          ?        ?      776.9        3.1       ?       ? 
1 1 1   13   12   37 o    874.6    3.2    0.0000   0.0000          ?        ?  7650.1274  56.8284          ?        ?      874.6        3.2       ?       ? 
1 1 1   13   12   38 o    505.6    2.7    0.0000   0.0000          ?        ?  2556.0020  27.4564          ?        ?      505.6        2.7       ?       ? 
1 1 1   13   12   39 o    516.9    3.1    0.0000   0.0000          ?        ?  2672.2129  31.9261          ?        ?      516.9        3.1       ?       ? 
1 1 1   13   12   40 o    389.7    2.6    0.0000   0.0000          ?        ?  1519.0430  20.4327          ?        ?      389.7        2.6       ?       ? 
1 1 1   13   12   41 o    650.5    2.7    0.0000   0.0000          ?        ?  4231.4829  35.7572          ?        ?      650.5        2.7       ?       ? 
1 1 1   13   12   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   12   43 o    306.9    3.2    0.0000   0.0000          ?        ?   941.8194  19.7942          ?        ?      306.9        3.2       ?       ? 
1 1 1   13   12   44 o    874.9    3.4    0.0000   0.0000          ?        ?  7655.8745  58.7440          ?        ?      874.9        3.4       ?       ? 
1 1 1   13   12   45 o    636.3    2.8    0.0000   0.0000          ?        ?  4049.5042  35.7572          ?        ?      636.3        2.8       ?       ? 
1 1 1   13   12   46 o    266.7    3.6    0.0000   0.0000          ?        ?   711.3131  19.1556          ?        ?      266.7        3.6       ?       ? 
1 1 1   13   12   47 o    405.1    2.7    0.0000   0.0000          ?        ?  1641.6392  21.7097          ?        ?      405.1        2.7       ?       ? 
1 1 1   13   12   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   12   49 o    737.6    2.9    0.0000   0.0000          ?        ?  5440.8428  43.4195          ?        ?      737.6        2.9       ?       ? 
1 1 1   13   12   50 f    347.1    2.9    0.0000   0.0000          ?        ?  1204.8903  20.4327          ?        ?      347.1        2.9       ?       ? 
1 1 1   13   12   51 f    291.2    3.4    0.0000   0.0000          ?        ?   847.9567  19.7942          ?        ?      291.2        3.4       ?       ? 
1 1 1   13   12   52 o    482.7    2.7    0.0000   0.0000          ?        ?  2330.6040  26.1794          ?        ?      482.7        2.7       ?       ? 
1 1 1   13   12   53 o    102.5    8.7    0.0000   0.0000          ?        ?   105.3561  17.8786          ?        ?      102.5        8.7       ?       ? 
1 1 1   13   12   54 o    560.3    2.7    0.0000   0.0000          ?        ?  3140.2493  30.0105          ?        ?      560.3        2.7       ?       ? 
1 1 1   13   12   55 o    320.3    3.3    0.0000   0.0000          ?        ?  1026.1042  21.0712          ?        ?      320.3        3.3       ?       ? 
1 1 1   13   12   56 o     60.0   15.8    0.0000   0.0000          ?        ?    37.6728  19.1556          ?        ?       60.0       15.8       ?       ? 
1 1 1   13   12   57 o    202.4    5.0    0.0000   0.0000          ?        ?   409.9309  20.4327          ?        ?      202.4        5.0       ?       ? 
1 1 1   13   12   58 o    422.2    2.9    0.0000   0.0000          ?        ?  1782.7524  24.9023          ?        ?      422.2        2.9       ?       ? 
1 1 1   13   12   59 o    137.3    7.2    0.0000   0.0000          ?        ?   189.0024  19.7942          ?        ?      137.3        7.2       ?       ? 
1 1 1   13   12   60 o    198.1    5.0    0.0000   0.0000          ?        ?   392.6908  19.7942          ?        ?      198.1        5.0       ?       ? 
1 1 1   13   12   61 o     38.9   15.4    0.0000   0.0000          ?        ?     8.3008  17.8786          ?        ?       38.9       15.4       ?       ? 
1 1 1   13   12   62 o    131.1    7.3    0.0000   0.0000          ?        ?   172.4008  19.1556          ?        ?      131.1        7.3       ?       ? 
1 1 1   13   12   63 o     78.8   12.2    0.0000   0.0000          ?        ?    62.5751  19.1556          ?        ?       78.8       12.2       ?       ? 
1 1 1   13   12   64 o     72.5   13.7    0.0000   0.0000          ?        ?    54.9129  19.1556          ?        ?       72.5       13.7       ?       ? 
1 1 1   13   12   65 o    183.1    5.4    0.0000   0.0000          ?        ?   335.8624  19.7942          ?        ?      183.1        5.4       ?       ? 
1 1 1   13   12   66 o    469.2    2.8    0.0000   0.0000          ?        ?  2202.2610  26.1794          ?        ?      469.2        2.8       ?       ? 
1 1 1   13   12   67 o    279.9    3.9    0.0000   0.0000          ?        ?   784.1046  21.7097          ?        ?      279.9        3.9       ?       ? 
1 1 1   13   12   68 o    461.5    3.0    0.0000   0.0000          ?        ?  2131.3850  27.4564          ?        ?      461.5        3.0       ?       ? 
1 1 1   13   12   69 f     31.2   14.4    0.0000   0.0000          ?        ?   -16.6016  21.0712          ?        ?       31.2       14.4       ?       ? 
1 1 1   13   12   70 o    102.1   10.6    0.0000   0.0000          ?        ?   105.3561  21.7097          ?        ?      102.1       10.6       ?       ? 
1 1 1   13   12   71 o    179.1    6.1    0.0000   0.0000          ?        ?   321.8149  21.7097          ?        ?      179.1        6.1       ?       ? 
1 1 1   13   12   72 o    105.1   10.3    0.0000   0.0000          ?        ?   111.7413  21.7097          ?        ?      105.1       10.3       ?       ? 
1 1 1   13   12   73 o     20.8   10.5    0.0000   0.0000          ?        ?   -65.1292  20.4327          ?        ?       20.8       10.5       ?       ? 
1 1 1   13   12   74 o     69.1   15.6    0.0000   0.0000          ?        ?    51.0817  21.0712          ?        ?       69.1       15.6       ?       ? 
1 1 1   13   12   75 o    231.5    4.8    0.0000   0.0000          ?        ?   537.6352  22.3483          ?        ?      231.5        4.8       ?       ? 
1 1 1   13   12   76 o    309.8    3.5    0.0000   0.0000          ?        ?   961.6136  21.7097          ?        ?      309.8        3.5       ?       ? 
1 1 1   13   12   77 o     53.3   16.4    0.0000   0.0000          ?        ?    30.0105  19.1556          ?        ?       53.3       16.4       ?       ? 
1 1 1   13   12   78 o     32.2   14.6    0.0000   0.0000          ?        ?   -10.2163  20.4327          ?        ?       32.2       14.6       ?       ? 
1 1 1   13   13    0 o    914.0    8.2 8356.3320 149.4141  8356.3320 149.4141  8356.3320 149.4141      914.0      8.2      914.0        8.2     0.0     0.0 
1 1 1   13   13    1 o   2105.0   11.9 44328.7266 502.5165 44328.7266 502.5165 44328.7266 502.5165     2105.0     11.9     2105.0       11.9     0.0     0.0 
1 1 1   13   13    2 o    806.3    4.3 6502.0654  69.5989  6502.0654  69.5989  6502.0654  69.5989      806.3      4.3      806.3        4.3     0.0     0.0 
1 1 1   13   13    3 o    387.3    2.4 1499.8872  18.5171  1499.8872  18.5171  1499.8872  18.5171      387.3      2.4      387.3        2.4     0.0     0.0 
1 1 1   13   13    4 o    187.7    2.2  352.4639   8.3008   352.4639   8.3008   352.4639   8.3008      187.7      2.2      187.7        2.2     0.0     0.0 
1 1 1   13   13    5 f    775.1    3.9 6008.4883  60.6596  6008.4883  60.6596  6008.4883  60.6596      775.1      3.9      775.1        3.9     0.0     0.0 
1 1 1   13   13    6 o    823.4    4.1 6780.4614  67.0448  6780.4614  67.0448  6780.4614  67.0448      823.4      4.1      823.4        4.1     0.0     0.0 
1 1 1   13   13    7 o    643.5    3.4 4140.8130  43.4195  4140.8130  43.4195  4140.8130  43.4195      643.5      3.4      643.5        3.4     0.0     0.0 
1 1 1   13   13    8 o   2061.4    9.4 42504.4688 389.4982 42504.4688 389.4982 42504.4688 389.4982     2061.4      9.4     2061.4        9.4     0.0     0.0 
1 1 1   13   13    9 f    295.8    2.4  875.4132  14.0475   875.4132  14.0475   875.4132  14.0475      295.8      2.4      295.8        2.4     0.0     0.0 
1 1 1   13   13   10 o   1909.2    8.8 36457.0312 335.2238 36457.0312 335.2238 36457.0312 335.2238     1909.2      8.8     1909.2        8.8     0.0     0.0 
1 1 1   13   13   11 o    607.3    3.3 3688.1008  40.2269  3688.1008  40.2269  3688.1008  40.2269      607.3      3.3      607.3        3.3     0.0     0.0 
1 1 1   13   13   12 o   2038.3    9.8 41555.6250 398.4375 41555.6250 398.4375 41555.6250 398.4375     2038.3      9.8     2038.3        9.8     0.0     0.0 
1 1 1   13   13   13 o   1789.6    9.0 32034.6309 323.7305 32034.6309 323.7305 32034.6309 323.7305     1789.6      9.0     1789.6        9.0     0.0     0.0 
1 1 1   13   13   14 o   2337.2   13.1 54648.5078 614.2578 54648.5078 614.2578 54648.5078 614.2578     2337.2     13.1     2337.2       13.1     0.0     0.0 
1 1 1   13   13   15 o   1467.2    7.2 21531.5879 211.9892 21531.5879 211.9892 21531.5879 211.9892     1467.2      7.2     1467.2        7.2     0.0     0.0 
1 1 1   13   13   16 o    970.6    4.9 9422.6631  95.1397  9422.6631  95.1397  9422.6631  95.1397      970.6      4.9      970.6        4.9     0.0     0.0 
1 1 1   13   13   17 o    617.2    3.5 3810.0586  43.4195  3810.0586  43.4195  3810.0586  43.4195      617.2      3.5      617.2        3.5     0.0     0.0 
1 1 1   13   13   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   13   19 o    333.8    3.2 1114.8588  21.0712  1114.8588  21.0712  1114.8588  21.0712      333.8      3.2      333.8        3.2     0.0     0.0 
1 1 1   13   13   20 o    710.6    4.3 5050.7061  60.6596  5050.7061  60.6596  5050.7061  60.6596      710.6      4.3      710.6        4.3     0.0     0.0 
1 1 1   13   13   21 o    224.9    4.0  506.3477  17.8786   506.3477  17.8786   506.3477  17.8786      224.9      4.0      224.9        4.0     0.0     0.0 
1 1 1   13   13   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   13   23 f   1267.0    6.4 16054.3496 160.9075 16054.3496 160.9075 16054.3496 160.9075     1267.0      6.4     1267.0        6.4     0.0     0.0 
1 1 1   13   13   24 o    578.3    4.3 3344.5762  49.8047  3344.5762  49.8047  3344.5762  49.8047      578.3      4.3      578.3        4.3     0.0     0.0 
1 1 1   13   13   25 f    816.2    4.5 6662.9731  74.0685  6662.9731  74.0685  6662.9731  74.0685      816.2      4.5      816.2        4.5     0.0     0.0 
1 1 1   13   13   26 o     81.2   10.1   68.9603  15.9630    68.9603  15.9630    68.9603  15.9630       81.2     10.1       81.2       10.1     0.0     0.0 
1 1 1   13   13   27 o   1751.2    8.5 30674.5781 298.8281 30674.5781 298.8281 30674.5781 298.8281     1751.2      8.5     1751.2        8.5     0.0     0.0 
1 1 1   13   13   28 o   1582.2    7.5 25038.9863 236.2530 25038.9863 236.2530 25038.9863 236.2530     1582.2      7.5     1582.2        7.5     0.0     0.0 
1 1 1   13   13   29 o   1293.2    6.6 16727.3516 171.1238 16727.3516 171.1238 16727.3516 171.1238     1293.2      6.6     1293.2        6.6     0.0     0.0 
1 1 1   13   13   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   13   31 o   1759.2    9.1 30954.2500 318.6223 30954.2500 318.6223 30954.2500 318.6223     1759.2      9.1     1759.2        9.1     0.0     0.0 
1 1 1   13   13   32 o   2796.3   15.5 78243.8047 865.8354 78243.8047 865.8354 78243.8047 865.8354     2796.3     15.5     2796.3       15.5     0.0     0.0 
1 1 1   13   13   33 o    770.1    4.6 5931.8657  70.8759  5931.8657  70.8759  5931.8657  70.8759      770.1      4.6      770.1        4.6     0.0     0.0 
1 1 1   13   13   34 o     27.7   20.7 -280.3110  87.4775  -280.3110  87.4775  -280.3110  87.4775       27.7     20.7       27.7       20.7     0.0     0.0 
1 1 1   13   13   35 o   1591.4    8.6 25332.7070 273.9258 25332.7070 273.9258 25332.7070 273.9258     1591.4      8.6     1591.4        8.6     0.0     0.0 
1 1 1   13   13   36 o    288.3    4.7  831.9937  26.8179   831.9937  26.8179   831.9937  26.8179      288.3      4.7      288.3        4.7     0.0     0.0 
1 1 1   13   13   37 o    277.0    4.5  768.1415  24.9023   768.1415  24.9023   768.1415  24.9023      277.0      4.5      277.0        4.5     0.0     0.0 
1 1 1   13   13   38 o   1296.3    6.3 16807.8047 164.1001 16807.8047 164.1001 16807.8047 164.1001     1296.3      6.3     1296.3        6.3     0.0     0.0 
1 1 1   13   13   39 o    595.1    3.7 3541.8796  44.0580  3541.8796  44.0580  3541.8796  44.0580      595.1      3.7      595.1        3.7     0.0     0.0 
1 1 1   13   13   40 o    635.8    4.3 4043.7573  54.2743  4043.7573  54.2743  4043.7573  54.2743      635.8      4.3      635.8        4.3     0.0     0.0 
1 1 1   13   13   41 o    602.4    3.9 3629.9954  46.6121  3629.9954  46.6121  3629.9954  46.6121      602.4      3.9      602.4        3.9     0.0     0.0 
1 1 1   13   13   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   13   43 o    223.2    5.4  499.3239  24.2638   499.3239  24.2638   499.3239  24.2638      223.2      5.4      223.2        5.4     0.0     0.0 
1 1 1   13   13   44 o    509.2    3.6 2593.0364  37.0343  2593.0364  37.0343  2593.0364  37.0343      509.2      3.6      509.2        3.6     0.0     0.0 
1 1 1   13   13   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   13   46 o   1030.3    5.5 10619.2529 113.6568 10619.2529 113.6568 10619.2529 113.6568     1030.3      5.5     1030.3        5.5     0.0     0.0 
1 1 1   13   13   47 o    473.5    4.3 2243.1265  40.8654  2243.1265  40.8654  2243.1265  40.8654      473.5      4.3      473.5        4.3     0.0     0.0 
1 1 1   13   13   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   13   49 o    172.7    8.5  300.7437  29.3720   300.7437  29.3720   300.7437  29.3720      172.7      8.5      172.7        8.5     0.0     0.0 
1 1 1   13   13   50 o    607.6    4.2 3693.2092  50.4432  3693.2092  50.4432  3693.2092  50.4432      607.6      4.2      607.6        4.2     0.0     0.0 
1 1 1   13   13   51 o     21.1   15.1  -32.5646  26.1794   -32.5646  26.1794   -32.5646  26.1794       21.1     15.1       21.1       15.1     0.0     0.0 
1 1 1   13   13   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   13   53 o     17.3   12.7  -50.4432  24.2638   -50.4432  24.2638   -50.4432  24.2638       17.3     12.7       17.3       12.7     0.0     0.0 
1 1 1   13   13   54 o     14.7   11.0  -75.9841  24.2638   -75.9841  24.2638   -75.9841  24.2638       14.7     11.0       14.7       11.0     0.0     0.0 
1 1 1   13   13   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   13   56 o     44.4   22.6   29.3720  24.9023    29.3720  24.9023    29.3720  24.9023       44.4     22.6       44.4       22.6     0.0     0.0 
1 1 1   13   13   57 o    234.8    6.1  552.9597  28.7335   552.9597  28.7335   552.9597  28.7335      234.8      6.1      234.8        6.1     0.0     0.0 
1 1 1   13   13   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   13   59 f     41.1   22.5   24.2638  26.1794    24.2638  26.1794    24.2638  26.1794       41.1     22.5       41.1       22.5     0.0     0.0 
1 1 1   13   13   60 o    127.4   10.7  166.0156  26.8179   166.0156  26.8179   166.0156  26.8179      127.4     10.7      127.4       10.7     0.0     0.0 
1 1 1   13   13   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   13   62 f    773.5    4.3 5986.7788  66.4062  5986.7788  66.4062  5986.7788  66.4062      773.5      4.3      773.5        4.3     0.0     0.0 
1 1 1   13   13   63 o    158.6    9.3  254.7701  29.3720   254.7701  29.3720   254.7701  29.3720      158.6      9.3      158.6        9.3     0.0     0.0 
1 1 1   13   13   64 f    171.2    8.2  295.6355  28.0950   295.6355  28.0950   295.6355  28.0950      171.2      8.2      171.2        8.2     0.0     0.0 
1 1 1   13   13   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   13   66 o    227.2    6.6  518.4796  30.0105   518.4796  30.0105   518.4796  30.0105      227.2      6.6      227.2        6.6     0.0     0.0 
1 1 1   13   13   67 o     21.6   15.6  -40.8654  29.3720   -40.8654  29.3720   -40.8654  29.3720       21.6     15.6       21.6       15.6     0.0     0.0 
1 1 1   13   13   68 o    278.3    5.7  776.4423  31.9261   776.4423  31.9261   776.4423  31.9261      278.3      5.7      278.3        5.7     0.0     0.0 
1 1 1   13   13   69 o     94.8   15.6   96.4168  27.4564    96.4168  27.4564    96.4168  27.4564       94.8     15.6       94.8       15.6     0.0     0.0 
1 1 1   13   13   70 o     54.0   24.6   43.4195  28.7335    43.4195  28.7335    43.4195  28.7335       54.0     24.6       54.0       24.6     0.0     0.0 
1 1 1   13   13   71 o    148.8   10.6  226.0367  31.2876   226.0367  31.2876   226.0367  31.2876      148.8     10.6      148.8       10.6     0.0     0.0 
1 1 1   13   13   72 f    226.5    7.1  515.9255  31.9261   515.9255  31.9261   515.9255  31.9261      226.5      7.1      226.5        7.1     0.0     0.0 
1 1 1   13   13   73 o    337.3    5.1 1140.3997  34.4802  1140.3997  34.4802  1140.3997  34.4802      337.3      5.1      337.3        5.1     0.0     0.0 
1 1 1   13   13   74 o     30.0   20.0   -5.7467  31.2876    -5.7467  31.2876    -5.7467  31.2876       30.0     20.0       30.0       20.0     0.0     0.0 
1 1 1   13   13   75 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   13   13   76 o    291.6    5.1  853.0649  30.0105   853.0649  30.0105   853.0649  30.0105      291.6      5.1      291.6        5.1     0.0     0.0 
1 1 1   13   13   77 o    145.7   11.1  218.3744  31.9261   218.3744  31.9261   218.3744  31.9261      145.7     11.1      145.7       11.1     0.0     0.0 
1 1 1   14    0    0 o    806.1    5.8 6499.5117  93.8627  6499.5117  93.8627  6499.5117  93.8627      806.1      5.8      806.1        5.8     0.0     0.0 
1 1 1   14    0    1 o    158.8    2.0  252.2160   6.3852   252.2160   6.3852   252.2160   6.3852      158.8      2.0      158.8        2.0     0.0     0.0 
1 1 1   14    0    2 o   1310.0    6.2 17162.8223 162.1845 17162.8223 162.1845 17162.8223 162.1845     1310.0      6.2     1310.0        6.2     0.0     0.0 
1 1 1   14    0    3 o    310.4    2.1  963.5291  12.7704   963.5291  12.7704   963.5291  12.7704      310.4      2.1      310.4        2.1     0.0     0.0 
1 1 1   14    0    4 o   1041.6    5.0 10850.3984 104.0790 10850.3984 104.0790 10850.3984 104.0790     1041.6      5.0     1041.6        5.0     0.0     0.0 
1 1 1   14    0    5 o   1279.6    6.0 16375.5264 154.5222 16375.5264 154.5222 16375.5264 154.5222     1279.6      6.0     1279.6        6.0     0.0     0.0 
1 1 1   14    0    6 o    827.2    4.1 6843.0361  67.0448  6843.0361  67.0448  6843.0361  67.0448      827.2      4.1      827.2        4.1     0.0     0.0 
1 1 1   14    0    7 o    207.9    2.2  432.2791   8.9393   432.2791   8.9393   432.2791   8.9393      207.9      2.2      207.9        2.2     0.0     0.0 
1 1 1   14    0    8 o   1283.0    6.0 16462.3652 154.5222 16462.3652 154.5222 16462.3652 154.5222     1283.0      6.0     1283.0        6.0     0.0     0.0 
1 1 1   14    0    9 o    600.2    3.1 3603.1775  37.6728  3603.1775  37.6728  3603.1775  37.6728      600.2      3.1      600.2        3.1     0.0     0.0 
1 1 1   14    0   10 o   1282.5    6.0 16450.2324 154.5222 16450.2324 154.5222 16450.2324 154.5222     1282.5      6.0     1282.5        6.0     0.0     0.0 
1 1 1   14    0   11 o    314.2    2.4  987.1545  15.3245   987.1545  15.3245   987.1545  15.3245      314.2      2.4      314.2        2.4     0.0     0.0 
1 1 1   14    0   12 o    561.0    3.1 3147.9116  34.4802  3147.9116  34.4802  3147.9116  34.4802      561.0      3.1      561.0        3.1     0.0     0.0 
1 1 1   14    0   13 o    733.9    3.7 5385.9297  53.6358  5385.9297  53.6358  5385.9297  53.6358      733.9      3.7      733.9        3.7     0.0     0.0 
1 1 1   14    0   14 o     22.8   11.5    7.6623   6.3852     7.6623   6.3852     7.6623   6.3852       22.8     11.5       22.8       11.5     0.0     0.0 
1 1 1   14    0   15 o    925.1    4.6 8560.0205  84.2849  8560.0205  84.2849  8560.0205  84.2849      925.1      4.6      925.1        4.6     0.0     0.0 
1 1 1   14    0   16 o    734.9    3.7 5401.8931  54.2743  5401.8931  54.2743  5401.8931  54.2743      734.9      3.7      734.9        3.7     0.0     0.0 
1 1 1   14    0   17 o     72.7    4.9   53.6358   7.0237    53.6358   7.0237    53.6358   7.0237       72.7      4.9       72.7        4.9     0.0     0.0 
1 1 1   14    0   18 o     82.6    5.1   68.9603   8.3008    68.9603   8.3008    68.9603   8.3008       82.6      5.1       82.6        5.1     0.0     0.0 
1 1 1   14    0   19 o      8.0    6.0  -30.6490   8.3008   -30.6490   8.3008   -30.6490   8.3008        8.0      6.0        8.0        6.0     0.0     0.0 
1 1 1   14    0   20 o   1024.8    5.0 10503.6807 101.5249 10503.6807 101.5249 10503.6807 101.5249     1024.8      5.0     1024.8        5.0     0.0     0.0 
1 1 1   14    0   21 o    265.3    2.5  704.2894  13.4090   704.2894  13.4090   704.2894  13.4090      265.3      2.5      265.3        2.5     0.0     0.0 
1 1 1   14    0   22 o    593.3    3.2 3520.1697  38.3113  3520.1697  38.3113  3520.1697  38.3113      593.3      3.2      593.3        3.2     0.0     0.0 
1 1 1   14    0   23 o    324.4    2.8 1052.2837  17.8786  1052.2837  17.8786  1052.2837  17.8786      324.4      2.8      324.4        2.8     0.0     0.0 
1 1 1   14    0   24 o   1057.4    5.2 11181.7900 110.4642 11181.7900 110.4642 11181.7900 110.4642     1057.4      5.2     1057.4        5.2     0.0     0.0 
1 1 1   14    0   25 f     11.3    8.4  -47.8891  14.6860   -47.8891  14.6860   -47.8891  14.6860       11.3      8.4       11.3        8.4     0.0     0.0 
1 1 1   14    0   26 o   1580.2    7.4 24973.8574 232.4219 24973.8574 232.4219 24973.8574 232.4219     1580.2      7.4     1580.2        7.4     0.0     0.0 
1 1 1   14    0   27 o   1098.4    6.0 12066.1426 130.8969 12066.1426 130.8969 12066.1426 130.8969     1098.4      6.0     1098.4        6.0     0.0     0.0 
1 1 1   14    0   28 o    687.8    4.0 4731.4453  55.5514  4731.4453  55.5514  4731.4453  55.5514      687.8      4.0      687.8        4.0     0.0     0.0 
1 1 1   14    0   29 o   2160.7    9.8 46694.4492 425.2554 46694.4492 425.2554 46694.4492 425.2554     2160.7      9.8     2160.7        9.8     0.0     0.0 
1 1 1   14    0   30 o   2300.5   12.1 52937.2695 558.7064 52937.2695 558.7064 52937.2695 558.7064     2300.5     12.1     2300.5       12.1     0.0     0.0 
1 1 1   14    0   31 o    619.6    3.9 3840.0693  48.5276  3840.0693  48.5276  3840.0693  48.5276      619.6      3.9      619.6        3.9     0.0     0.0 
1 1 1   14    0   32 o   1318.2    6.6 17379.9199 174.3164 17379.9199 174.3164 17379.9199 174.3164     1318.2      6.6     1318.2        6.6     0.0     0.0 
1 1 1   14    0   33 f    255.6    4.4  653.8461  22.3483   653.8461  22.3483   653.8461  22.3483      255.6      4.4      255.6        4.4     0.0     0.0 
1 1 1   14    0   34 o    531.1    3.7 2821.6270  38.9498  2821.6270  38.9498  2821.6270  38.9498      531.1      3.7      531.1        3.7     0.0     0.0 
1 1 1   14    0   35 o   1467.3    7.2 21532.8652 210.7121 21532.8652 210.7121 21532.8652 210.7121     1467.3      7.2     1467.3        7.2     0.0     0.0 
1 1 1   14    0   36 o   1158.1    5.6 13412.7861 129.6199 13412.7861 129.6199 13412.7861 129.6199     1158.1      5.6     1158.1        5.6     0.0     0.0 
1 1 1   14    0   37 o   1291.4    6.2 16679.4609 158.9919 16679.4609 158.9919 16679.4609 158.9919     1291.4      6.2     1291.4        6.2     0.0     0.0 
1 1 1   14    0   38 o     24.0   16.2   -8.3008  21.7097    -8.3008  21.7097    -8.3008  21.7097       24.0     16.2       24.0       16.2     0.0     0.0 
1 1 1   14    0   39 o    254.9    7.4  651.2921  37.6728   651.2921  37.6728   651.2921  37.6728      254.9      7.4      254.9        7.4     0.0     0.0 
1 1 1   14    0   40 o   1349.0    6.6 18201.0586 178.7861 18201.0586 178.7861 18201.0586 178.7861     1349.0      6.6     1349.0        6.6     0.0     0.0 
1 1 1   14    0   41 o   1185.9    5.8 14064.7158 137.2822 14064.7158 137.2822 14064.7158 137.2822     1185.9      5.8     1185.9        5.8     0.0     0.0 
1 1 1   14    0   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14    0   43 o    333.6    5.4 1113.5817  35.7572  1113.5817  35.7572  1113.5817  35.7572      333.6      5.4      333.6        5.4     0.0     0.0 
1 1 1   14    0   44 o    166.8    9.2  280.9495  30.6490   280.9495  30.6490   280.9495  30.6490      166.8      9.2      166.8        9.2     0.0     0.0 
1 1 1   14    0   45 o   1150.5    5.9 13238.4688 136.0051 13238.4688 136.0051 13238.4688 136.0051     1150.5      5.9     1150.5        5.9     0.0     0.0 
1 1 1   14    0   46 o    458.3    4.3 2100.7361  38.9498  2100.7361  38.9498  2100.7361  38.9498      458.3      4.3      458.3        4.3     0.0     0.0 
1 1 1   14    0   47 f     23.6   17.5 -189.6409  61.2981  -189.6409  61.2981  -189.6409  61.2981       23.6     17.5       23.6       17.5     0.0     0.0 
1 1 1   14    0   48 o    829.9    4.7 6889.0098  77.8996  6889.0098  77.8996  6889.0098  77.8996      829.9      4.7      829.9        4.7     0.0     0.0 
1 1 1   14    0   49 o    341.4    4.7 1166.5790  31.9261  1166.5790  31.9261  1166.5790  31.9261      341.4      4.7      341.4        4.7     0.0     0.0 
1 1 1   14    0   50 o    267.2    5.3  715.1442  28.0950   715.1442  28.0950   715.1442  28.0950      267.2      5.3      267.2        5.3     0.0     0.0 
1 1 1   14    0   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14    0   52 o    744.8    4.5 5548.7529  66.4062  5548.7529  66.4062  5548.7529  66.4062      744.8      4.5      744.8        4.5     0.0     0.0 
1 1 1   14    0   53 o    369.1    4.2 1363.2437  30.6490  1363.2437  30.6490  1363.2437  30.6490      369.1      4.2      369.1        4.2     0.0     0.0 
1 1 1   14    0   54 o     20.0   14.5  -42.1424  26.8179   -42.1424  26.8179   -42.1424  26.8179       20.0     14.5       20.0       14.5     0.0     0.0 
1 1 1   14    0   55 o    537.5    4.3 2890.5874  45.9736  2890.5874  45.9736  2890.5874  45.9736      537.5      4.3      537.5        4.3     0.0     0.0 
1 1 1   14    0   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14    0   57 o    533.4    3.6 2845.8909  38.3113  2845.8909  38.3113  2845.8909  38.3113      533.4      3.6      533.4        3.6     0.0     0.0 
1 1 1   14    0   58 o     14.9   11.1  -91.9471  26.8179   -91.9471  26.8179   -91.9471  26.8179       14.9     11.1       14.9       11.1     0.0     0.0 
1 1 1   14    0   59 o    334.1    4.6 1117.4128  30.6490  1117.4128  30.6490  1117.4128  30.6490      334.1      4.6      334.1        4.6     0.0     0.0 
1 1 1   14    0   60 o    212.2    6.6  452.0733  28.0950   452.0733  28.0950   452.0733  28.0950      212.2      6.6      212.2        6.6     0.0     0.0 
1 1 1   14    0   61 f     86.2   18.1   83.6463  27.4564    83.6463  27.4564    83.6463  27.4564       86.2     18.1       86.2       18.1     0.0     0.0 
1 1 1   14    0   62 o    166.6    8.9  280.3110  29.3720   280.3110  29.3720   280.3110  29.3720      166.6      8.9      166.6        8.9     0.0     0.0 
1 1 1   14    0   63 o    228.5    6.0  523.5877  27.4564   523.5877  27.4564   523.5877  27.4564      228.5      6.0      228.5        6.0     0.0     0.0 
1 1 1   14    0   64 o    132.3   10.5  178.7861  27.4564   178.7861  27.4564   178.7861  27.4564      132.3     10.5      132.3       10.5     0.0     0.0 
1 1 1   14    0   65 o    310.2    4.8  963.5291  30.0105   963.5291  30.0105   963.5291  30.0105      310.2      4.8      310.2        4.8     0.0     0.0 
1 1 1   14    0   66 f    246.1    6.0  607.2341  29.3720   607.2341  29.3720   607.2341  29.3720      246.1      6.0      246.1        6.0     0.0     0.0 
1 1 1   14    0   67 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14    0   68 o    143.8   10.3  210.7121  29.3720   210.7121  29.3720   210.7121  29.3720      143.8     10.3      143.8       10.3     0.0     0.0 
1 1 1   14    0   69 f     38.7   22.8   18.5171  29.3720    18.5171  29.3720    18.5171  29.3720       38.7     22.8       38.7       22.8     0.0     0.0 
1 1 1   14    0   70 o    115.6   13.6  139.8362  30.6490   139.8362  30.6490   139.8362  30.6490      115.6     13.6      115.6       13.6     0.0     0.0 
1 1 1   14    0   71 o     77.0   22.5   73.4300  30.0105    73.4300  30.0105    73.4300  30.0105       77.0     22.5       77.0       22.5     0.0     0.0 
1 1 1   14    0   72 o    116.5   13.2  141.7518  30.0105   141.7518  30.0105   141.7518  30.0105      116.5     13.2      116.5       13.2     0.0     0.0 
1 1 1   14    0   73 o     18.8   13.9  -75.9841  31.9261   -75.9841  31.9261   -75.9841  31.9261       18.8     13.9       18.8       13.9     0.0     0.0 
1 1 1   14    0   74 o    244.6    6.7  600.8488  32.5646   600.8488  32.5646   600.8488  32.5646      244.6      6.7      244.6        6.7     0.0     0.0 
1 1 1   14    0   75 f     22.6   16.2  -38.9498  30.6490   -38.9498  30.6490   -38.9498  30.6490       22.6     16.2       22.6       16.2     0.0     0.0 
1 1 1   14    0   76 o     60.7   25.7   53.6358  31.2876    53.6358  31.2876    53.6358  31.2876       60.7     25.7       60.7       25.7     0.0     0.0 
1 1 1   14    0   77 o     36.5   22.7   11.4934  32.5646    11.4934  32.5646    11.4934  32.5646       36.5     22.7       36.5       22.7     0.0     0.0 
1 1 1   14    0   78 o    125.8   13.2  165.3771  32.5646   165.3771  32.5646   165.3771  32.5646      125.8     13.2      125.8       13.2     0.0     0.0 
1 1 1   14    0   79 o     52.3   24.8   42.1424  29.3720    42.1424  29.3720    42.1424  29.3720       52.3     24.8       52.3       24.8     0.0     0.0 
1 1 1   14    0   80 o    243.2    6.0  594.4636  29.3720   594.4636  29.3720   594.4636  29.3720      243.2      6.0      243.2        6.0     0.0     0.0 
1 1 1   14    1    0 o    609.1    3.1 3710.4490  38.3113  3710.4490  38.3113  3710.4490  38.3113      609.1      3.1      609.1        3.1     0.0     0.0 
1 1 1   14    1    1 o    921.7    3.2    0.0000   0.0000          ?        ?  8494.8916  58.7440          ?        ?      921.7        3.2       ?       ? 
1 1 1   14    1    2 o    187.9    1.4    0.0000   0.0000          ?        ?   353.1024   5.1082          ?        ?      187.9        1.4       ?       ? 
1 1 1   14    1    3 o    890.4    3.1    0.0000   0.0000          ?        ?  7928.5229  54.9129          ?        ?      890.4        3.1       ?       ? 
1 1 1   14    1    4 o   1805.4    5.9    0.0000   0.0000          ?        ? 32597.1680 211.9892          ?        ?     1805.4        5.9       ?       ? 
1 1 1   14    1    5 f   1126.5    3.8    0.0000   0.0000          ?        ? 12691.2559  84.9234          ?        ?     1126.5        3.8       ?       ? 
1 1 1   14    1    6 o   1729.0    5.6    0.0000   0.0000          ?        ? 29896.2227 194.1106          ?        ?     1729.0        5.6       ?       ? 
1 1 1   14    1    7 o    599.2    2.2    0.0000   0.0000          ?        ?  3590.4070  26.1794          ?        ?      599.2        2.2       ?       ? 
1 1 1   14    1    8 o    583.9    2.2    0.0000   0.0000          ?        ?  3409.7056  25.5409          ?        ?      583.9        2.2       ?       ? 
1 1 1   14    1    9 o    758.8    2.7    0.0000   0.0000          ?        ?  5758.1880  41.5039          ?        ?      758.8        2.7       ?       ? 
1 1 1   14    1   10 o   1035.0    3.5    0.0000   0.0000          ?        ? 10711.8389  72.1529          ?        ?     1035.0        3.5       ?       ? 
1 1 1   14    1   11 o    730.5    2.6    0.0000   0.0000          ?        ?  5336.7637  38.3113          ?        ?      730.5        2.6       ?       ? 
1 1 1   14    1   12 o     38.3    5.8    0.0000   0.0000          ?        ?    14.6860   4.4697          ?        ?       38.3        5.8       ?       ? 
1 1 1   14    1   13 o    896.4    3.2    0.0000   0.0000          ?        ?  8035.7944  56.8284          ?        ?      896.4        3.2       ?       ? 
1 1 1   14    1   14 o    894.6    3.1    0.0000   0.0000          ?        ?  8003.2300  55.5514          ?        ?      894.6        3.1       ?       ? 
1 1 1   14    1   15 o   1752.2    5.6    0.0000   0.0000          ?        ? 30705.2266 197.9417          ?        ?     1752.2        5.6       ?       ? 
1 1 1   14    1   16 o    481.2    1.9    0.0000   0.0000          ?        ?  2315.9180  18.5171          ?        ?      481.2        1.9       ?       ? 
1 1 1   14    1   17 o    310.9    1.6    0.0000   0.0000          ?        ?   966.7217  10.2163          ?        ?      310.9        1.6       ?       ? 
1 1 1   14    1   18 o   1263.0    4.2    0.0000   0.0000          ?        ? 15952.8232 106.6331          ?        ?     1263.0        4.2       ?       ? 
1 1 1   14    1   19 o    729.6    2.7    0.0000   0.0000          ?        ?  5322.7163  38.9498          ?        ?      729.6        2.7       ?       ? 
1 1 1   14    1   20 o    376.5    1.9    0.0000   0.0000          ?        ?  1417.5181  14.0475          ?        ?      376.5        1.9       ?       ? 
1 1 1   14    1   21 o    409.2    1.9    0.0000   0.0000          ?        ?  1674.8422  15.3245          ?        ?      409.2        1.9       ?       ? 
1 1 1   14    1   22 o    690.9    2.5    0.0000   0.0000          ?        ?  4773.5874  35.1187          ?        ?      690.9        2.5       ?       ? 
1 1 1   14    1   23 o   1031.9    3.6    0.0000   0.0000          ?        ? 10647.9863  74.0685          ?        ?     1031.9        3.6       ?       ? 
1 1 1   14    1   24 o   1044.9    3.7    0.0000   0.0000          ?        ? 10919.3584  77.2611          ?        ?     1044.9        3.7       ?       ? 
1 1 1   14    1   25 o    364.0    1.9    0.0000   0.0000          ?        ?  1324.9324  14.0475          ?        ?      364.0        1.9       ?       ? 
1 1 1   14    1   26 o    759.0    2.9    0.0000   0.0000          ?        ?  5761.3804  44.0580          ?        ?      759.0        2.9       ?       ? 
1 1 1   14    1   27 o    441.4    2.4    0.0000   0.0000          ?        ?  1948.1295  21.0712          ?        ?      441.4        2.4       ?       ? 
1 1 1   14    1   28 o   1190.7    4.0    0.0000   0.0000          ?        ? 14177.7334  95.7782          ?        ?     1190.7        4.0       ?       ? 
1 1 1   14    1   29 o   1150.6    4.0    0.0000   0.0000          ?        ? 13240.3848  91.3086          ?        ?     1150.6        4.0       ?       ? 
1 1 1   14    1   30 o   1093.5    4.0    0.0000   0.0000          ?        ? 11958.8721  86.8389          ?        ?     1093.5        4.0       ?       ? 
1 1 1   14    1   31 f   1486.6    5.2    0.0000   0.0000          ?        ? 22102.4258 153.2452          ?        ?     1486.6        5.2       ?       ? 
1 1 1   14    1   32 o    702.4    3.0    0.0000   0.0000          ?        ?  4933.8564  42.1424          ?        ?      702.4        3.0       ?       ? 
1 1 1   14    1   33 o    471.7    2.5    0.0000   0.0000          ?        ?  2225.2478  23.6253          ?        ?      471.7        2.5       ?       ? 
1 1 1   14    1   34 o   1188.7    4.3    0.0000   0.0000          ?        ? 14131.7607 101.5249          ?        ?     1188.7        4.3       ?       ? 
1 1 1   14    1   35 o    394.3    2.4    0.0000   0.0000          ?        ?  1554.8002  19.1556          ?        ?      394.3        2.4       ?       ? 
1 1 1   14    1   36 o    965.3    3.5    0.0000   0.0000          ?        ?  9319.2227  67.0448          ?        ?      965.3        3.5       ?       ? 
1 1 1   14    1   37 o   1306.7    4.4    0.0000   0.0000          ?        ? 17077.2617 114.9339          ?        ?     1306.7        4.4       ?       ? 
1 1 1   14    1   38 o   1094.1    3.8    0.0000   0.0000          ?        ? 11972.2803  83.6463          ?        ?     1094.1        3.8       ?       ? 
1 1 1   14    1   39 o    305.4    3.1    0.0000   0.0000          ?        ?   932.8801  19.1556          ?        ?      305.4        3.1       ?       ? 
1 1 1   14    1   40 o    954.7    3.5    0.0000   0.0000          ?        ?  9114.2578  67.0448          ?        ?      954.7        3.5       ?       ? 
1 1 1   14    1   41 o    548.7    2.9    0.0000   0.0000          ?        ?  3011.2681  31.9261          ?        ?      548.7        2.9       ?       ? 
1 1 1   14    1   42 o    930.7    3.5    0.0000   0.0000          ?        ?  8662.8223  65.1292          ?        ?      930.7        3.5       ?       ? 
1 1 1   14    1   43 o    218.2    4.5    0.0000   0.0000          ?        ?   476.3371  19.7942          ?        ?      218.2        4.5       ?       ? 
1 1 1   14    1   44 o   1093.2    3.9    0.0000   0.0000          ?        ? 11952.4863  85.5619          ?        ?     1093.2        3.9       ?       ? 
1 1 1   14    1   45 o    864.0    3.3    0.0000   0.0000          ?        ?  7466.2339  56.8284          ?        ?      864.0        3.3       ?       ? 
1 1 1   14    1   46 o    775.3    3.0    0.0000   0.0000          ?        ?  6011.0430  47.2506          ?        ?      775.3        3.0       ?       ? 
1 1 1   14    1   47 o    944.3    3.5    0.0000   0.0000          ?        ?  8918.8701  67.0448          ?        ?      944.3        3.5       ?       ? 
1 1 1   14    1   48 o    592.5    2.7    0.0000   0.0000          ?        ?  3511.2305  32.5646          ?        ?      592.5        2.7       ?       ? 
1 1 1   14    1   49 o    221.0    4.8    0.0000   0.0000          ?        ?   488.4691  21.0712          ?        ?      221.0        4.8       ?       ? 
1 1 1   14    1   50 o    410.2    2.8    0.0000   0.0000          ?        ?  1682.5045  22.9868          ?        ?      410.2        2.8       ?       ? 
1 1 1   14    1   51 o    409.8    2.7    0.0000   0.0000          ?        ?  1679.3119  22.3483          ?        ?      409.8        2.7       ?       ? 
1 1 1   14    1   52 o     79.8   11.6    0.0000   0.0000          ?        ?    63.8522  18.5171          ?        ?       79.8       11.6       ?       ? 
1 1 1   14    1   53 o     70.7   13.1    0.0000   0.0000          ?        ?    51.7203  17.8786          ?        ?       70.7       13.1       ?       ? 
1 1 1   14    1   54 o     64.0   14.8    0.0000   0.0000          ?        ?    42.7809  18.5171          ?        ?       64.0       14.8       ?       ? 
1 1 1   14    1   55 o    391.0    2.9    0.0000   0.0000          ?        ?  1529.2593  22.3483          ?        ?      391.0        2.9       ?       ? 
1 1 1   14    1   56 f    194.5    5.1    0.0000   0.0000          ?        ?   378.6433  19.7942          ?        ?      194.5        5.1       ?       ? 
1 1 1   14    1   57 o    175.4    5.6    0.0000   0.0000          ?        ?   307.7674  19.7942          ?        ?      175.4        5.6       ?       ? 
1 1 1   14    1   58 o    401.4    2.9    0.0000   0.0000          ?        ?  1611.6285  23.6253          ?        ?      401.4        2.9       ?       ? 
1 1 1   14    1   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14    1   60 o    306.8    3.2    0.0000   0.0000          ?        ?   941.8194  19.7942          ?        ?      306.8        3.2       ?       ? 
1 1 1   14    1   61 o    318.2    3.3    0.0000   0.0000          ?        ?  1012.6953  21.0712          ?        ?      318.2        3.3       ?       ? 
1 1 1   14    1   62 o    517.4    2.7    0.0000   0.0000          ?        ?  2677.9597  27.4564          ?        ?      517.4        2.7       ?       ? 
1 1 1   14    1   63 o    273.7    3.8    0.0000   0.0000          ?        ?   749.6244  21.0712          ?        ?      273.7        3.8       ?       ? 
1 1 1   14    1   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14    1   65 o    182.4    5.4    0.0000   0.0000          ?        ?   333.3083  19.7942          ?        ?      182.4        5.4       ?       ? 
1 1 1   14    1   66 o    331.4    3.4    0.0000   0.0000          ?        ?  1098.8958  22.3483          ?        ?      331.4        3.4       ?       ? 
1 1 1   14    1   67 o     21.3   10.8    0.0000   0.0000          ?        ?   -66.4062  21.0712          ?        ?       21.3       10.8       ?       ? 
1 1 1   14    1   68 o    467.3    2.9    0.0000   0.0000          ?        ?  2184.3826  26.8179          ?        ?      467.3        2.9       ?       ? 
1 1 1   14    1   69 o    178.8    5.7    0.0000   0.0000          ?        ?   320.5379  20.4327          ?        ?      178.8        5.7       ?       ? 
1 1 1   14    1   70 o    308.7    3.5    0.0000   0.0000          ?        ?   953.9513  21.7097          ?        ?      308.7        3.5       ?       ? 
1 1 1   14    1   71 o     99.7   10.6    0.0000   0.0000          ?        ?   100.2479  21.0712          ?        ?       99.7       10.6       ?       ? 
1 1 1   14    1   72 o    359.5    3.3    0.0000   0.0000          ?        ?  1293.6449  23.6253          ?        ?      359.5        3.3       ?       ? 
1 1 1   14    1   73 o    225.1    4.8    0.0000   0.0000          ?        ?   507.6247  21.7097          ?        ?      225.1        4.8       ?       ? 
1 1 1   14    1   74 o     70.6   15.3    0.0000   0.0000          ?        ?    52.9973  21.0712          ?        ?       70.6       15.3       ?       ? 
1 1 1   14    1   75 f    243.4    4.5    0.0000   0.0000          ?        ?   593.8251  21.7097          ?        ?      243.4        4.5       ?       ? 
1 1 1   14    1   76 o     42.8   17.0    0.0000   0.0000          ?        ?    10.8549  21.7097          ?        ?       42.8       17.0       ?       ? 
1 1 1   14    1   77 o    269.8    4.4    0.0000   0.0000          ?        ?   729.8303  23.6253          ?        ?      269.8        4.4       ?       ? 
1 1 1   14    1   78 o    248.9    4.6    0.0000   0.0000          ?        ?   621.2816  22.9868          ?        ?      248.9        4.6       ?       ? 
1 1 1   14    1   79 o     35.8   15.5    0.0000   0.0000          ?        ?    -1.2770  20.4327          ?        ?       35.8       15.5       ?       ? 
1 1 1   14    1   80 o    125.5    8.4    0.0000   0.0000          ?        ?   159.6304  21.0712          ?        ?      125.5        8.4       ?       ? 
1 1 1   14    2    0 o    414.6    2.5 1718.9003  20.4327  1718.9003  20.4327  1718.9003  20.4327      414.6      2.5      414.6        2.5     0.0     0.0 
1 1 1   14    2    1 o    471.9    1.9    0.0000   0.0000          ?        ?  2226.5249  17.8786          ?        ?      471.9        1.9       ?       ? 
1 1 1   14    2    2 o   1680.0    5.5    0.0000   0.0000          ?        ? 28226.4883 185.1713          ?        ?     1680.0        5.5       ?       ? 
1 1 1   14    2    3 o   1081.9    3.7    0.0000   0.0000          ?        ? 11705.3779  79.8152          ?        ?     1081.9        3.7       ?       ? 
1 1 1   14    2    4 o    866.9    3.0    0.0000   0.0000          ?        ?  7514.7612  52.3588          ?        ?      866.9        3.0       ?       ? 
1 1 1   14    2    5 o   1195.8    4.0    0.0000   0.0000          ?        ? 14299.6914  95.1397          ?        ?     1195.8        4.0       ?       ? 
1 1 1   14    2    6 o    814.4    2.9    0.0000   0.0000          ?        ?  6632.9629  46.6121          ?        ?      814.4        2.9       ?       ? 
1 1 1   14    2    7 o   1800.9    5.8    0.0000   0.0000          ?        ? 32436.2598 210.0736          ?        ?     1800.9        5.8       ?       ? 
1 1 1   14    2    8 o   1200.4    4.0    0.0000   0.0000          ?        ? 14410.7939  95.7782          ?        ?     1200.4        4.0       ?       ? 
1 1 1   14    2    9 o   2048.1    6.5    0.0000   0.0000          ?        ? 41955.3398 264.9865          ?        ?     2048.1        6.5       ?       ? 
1 1 1   14    2   10 o   1230.1    4.1    0.0000   0.0000          ?        ? 15132.3232 100.8864          ?        ?     1230.1        4.1       ?       ? 
1 1 1   14    2   11 o    863.0    3.0    0.0000   0.0000          ?        ?  7447.7163  52.3588          ?        ?      863.0        3.0       ?       ? 
1 1 1   14    2   12 o    535.7    2.0    0.0000   0.0000          ?        ?  2870.1548  21.7097          ?        ?      535.7        2.0       ?       ? 
1 1 1   14    2   13 o   1854.3    6.0    0.0000   0.0000          ?        ? 34388.8594 222.8441          ?        ?     1854.3        6.0       ?       ? 
1 1 1   14    2   14 o    729.9    2.6    0.0000   0.0000          ?        ?  5327.1860  38.3113          ?        ?      729.9        2.6       ?       ? 
1 1 1   14    2   15 o   1250.6    4.2    0.0000   0.0000          ?        ? 15642.5029 104.7175          ?        ?     1250.6        4.2       ?       ? 
1 1 1   14    2   16 o    494.1    2.0    0.0000   0.0000          ?        ?  2441.0681  19.7942          ?        ?      494.1        2.0       ?       ? 
1 1 1   14    2   17 o    599.3    2.3    0.0000   0.0000          ?        ?  3591.6841  27.4564          ?        ?      599.3        2.3       ?       ? 
1 1 1   14    2   18 o    423.7    1.8    0.0000   0.0000          ?        ?  1795.5229  15.3245          ?        ?      423.7        1.8       ?       ? 
1 1 1   14    2   19 o   1270.8    4.2    0.0000   0.0000          ?        ? 16150.7656 107.9102          ?        ?     1270.8        4.2       ?       ? 
1 1 1   14    2   20 o    578.9    2.3    0.0000   0.0000          ?        ?  3350.9614  26.1794          ?        ?      578.9        2.3       ?       ? 
1 1 1   14    2   21 o   1074.0    3.7    0.0000   0.0000          ?        ? 11535.5312  78.5382          ?        ?     1074.0        3.7       ?       ? 
1 1 1   14    2   22 o    179.7    2.1    0.0000   0.0000          ?        ?   323.0919   7.6623          ?        ?      179.7        2.1       ?       ? 
1 1 1   14    2   23 o   1170.2    4.0    0.0000   0.0000          ?        ? 13693.7354  93.8627          ?        ?     1170.2        4.0       ?       ? 
1 1 1   14    2   24 o   1754.6    5.7    0.0000   0.0000          ?        ? 30790.1523 201.7728          ?        ?     1754.6        5.7       ?       ? 
1 1 1   14    2   25 o    986.3    3.5    0.0000   0.0000          ?        ?  9729.1533  69.5989          ?        ?      986.3        3.5       ?       ? 
1 1 1   14    2   26 o    634.7    2.6    0.0000   0.0000          ?        ?  4028.4331  32.5646          ?        ?      634.7        2.6       ?       ? 
1 1 1   14    2   27 o    866.5    3.2    0.0000   0.0000          ?        ?  7509.0142  54.9129          ?        ?      866.5        3.2       ?       ? 
1 1 1   14    2   28 o   1022.5    3.6    0.0000   0.0000          ?        ? 10456.4297  73.4300          ?        ?     1022.5        3.6       ?       ? 
1 1 1   14    2   29 o    721.3    3.0    0.0000   0.0000          ?        ?  5203.3130  43.4195          ?        ?      721.3        3.0       ?       ? 
1 1 1   14    2   30 o    673.3    2.8    0.0000   0.0000          ?        ?  4532.8652  38.3113          ?        ?      673.3        2.8       ?       ? 
1 1 1   14    2   31 o    974.9    3.8    0.0000   0.0000          ?        ?  9503.7559  74.0685          ?        ?      974.9        3.8       ?       ? 
1 1 1   14    2   32 o   1569.7    5.3    0.0000   0.0000          ?        ? 24641.1895 167.9312          ?        ?     1569.7        5.3       ?       ? 
1 1 1   14    2   33 o   1057.4    3.8    0.0000   0.0000          ?        ? 11180.5137  81.0922          ?        ?     1057.4        3.8       ?       ? 
1 1 1   14    2   34 o    626.3    3.0    0.0000   0.0000          ?        ?  3923.0771  37.6728          ?        ?      626.3        3.0       ?       ? 
1 1 1   14    2   35 o    514.0    2.7    0.0000   0.0000          ?        ?  2641.5640  27.4564          ?        ?      514.0        2.7       ?       ? 
1 1 1   14    2   36 o   1550.1    5.2    0.0000   0.0000          ?        ? 24029.4844 160.9075          ?        ?     1550.1        5.2       ?       ? 
1 1 1   14    2   37 o    519.9    2.6    0.0000   0.0000          ?        ?  2703.5005  26.8179          ?        ?      519.9        2.6       ?       ? 
1 1 1   14    2   38 o    925.8    3.4    0.0000   0.0000          ?        ?  8571.5146  63.8522          ?        ?      925.8        3.4       ?       ? 
1 1 1   14    2   39 o    159.2    5.8    0.0000   0.0000          ?        ?   253.4931  18.5171          ?        ?      159.2        5.8       ?       ? 
1 1 1   14    2   40 o    654.3    2.8    0.0000   0.0000          ?        ?  4280.6489  36.3957          ?        ?      654.3        2.8       ?       ? 
1 1 1   14    2   41 o    382.5    2.8    0.0000   0.0000          ?        ?  1463.4916  21.7097          ?        ?      382.5        2.8       ?       ? 
1 1 1   14    2   42 o   1011.3    3.6    0.0000   0.0000          ?        ? 10228.4785  73.4300          ?        ?     1011.3        3.6       ?       ? 
1 1 1   14    2   43 o    932.2    3.4    0.0000   0.0000          ?        ?  8689.6406  63.2136          ?        ?      932.2        3.4       ?       ? 
1 1 1   14    2   44 o    509.0    2.9    0.0000   0.0000          ?        ?  2591.1206  29.3720          ?        ?      509.0        2.9       ?       ? 
1 1 1   14    2   45 o    337.5    3.1    0.0000   0.0000          ?        ?  1139.1226  21.0712          ?        ?      337.5        3.1       ?       ? 
1 1 1   14    2   46 o    486.1    2.8    0.0000   0.0000          ?        ?  2363.1685  26.8179          ?        ?      486.1        2.8       ?       ? 
1 1 1   14    2   47 f    336.6    3.3    0.0000   0.0000          ?        ?  1133.3759  22.3483          ?        ?      336.6        3.3       ?       ? 
1 1 1   14    2   48 o    236.6    4.3    0.0000   0.0000          ?        ?   559.9835  20.4327          ?        ?      236.6        4.3       ?       ? 
1 1 1   14    2   49 o    541.7    2.7    0.0000   0.0000          ?        ?  2934.6455  29.3720          ?        ?      541.7        2.7       ?       ? 
1 1 1   14    2   50 o    343.9    3.2    0.0000   0.0000          ?        ?  1182.5420  22.3483          ?        ?      343.9        3.2       ?       ? 
1 1 1   14    2   51 o     28.2   13.3    0.0000   0.0000          ?        ?   -22.9868  19.7942          ?        ?       28.2       13.3       ?       ? 
1 1 1   14    2   52 o    470.5    2.8    0.0000   0.0000          ?        ?  2214.3928  26.1794          ?        ?      470.5        2.8       ?       ? 
1 1 1   14    2   53 o    390.2    2.9    0.0000   0.0000          ?        ?  1522.8740  22.3483          ?        ?      390.2        2.9       ?       ? 
1 1 1   14    2   54 o    772.9    3.2    0.0000   0.0000          ?        ?  5974.6470  49.1662          ?        ?      772.9        3.2       ?       ? 
1 1 1   14    2   55 o    373.5    3.0    0.0000   0.0000          ?        ?  1395.1698  22.3483          ?        ?      373.5        3.0       ?       ? 
1 1 1   14    2   56 o    265.5    3.5    0.0000   0.0000          ?        ?   704.9279  18.5171          ?        ?      265.5        3.5       ?       ? 
1 1 1   14    2   57 o    357.7    2.9    0.0000   0.0000          ?        ?  1279.5973  21.0712          ?        ?      357.7        2.9       ?       ? 
1 1 1   14    2   58 o    275.7    3.5    0.0000   0.0000          ?        ?   760.4792  19.1556          ?        ?      275.7        3.5       ?       ? 
1 1 1   14    2   59 o    219.9    4.5    0.0000   0.0000          ?        ?   483.9994  19.7942          ?        ?      219.9        4.5       ?       ? 
1 1 1   14    2   60 o    299.9    3.4    0.0000   0.0000          ?        ?   899.6769  20.4327          ?        ?      299.9        3.4       ?       ? 
1 1 1   14    2   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14    2   62 o    267.7    3.7    0.0000   0.0000          ?        ?   717.0598  19.7942          ?        ?      267.7        3.7       ?       ? 
1 1 1   14    2   63 o    326.5    3.2    0.0000   0.0000          ?        ?  1066.3312  21.0712          ?        ?      326.5        3.2       ?       ? 
1 1 1   14    2   64 f     19.4    9.8    0.0000   0.0000          ?        ?   -63.2136  18.5171          ?        ?       19.4        9.8       ?       ? 
1 1 1   14    2   65 o    151.6    6.5    0.0000   0.0000          ?        ?   230.5063  19.7942          ?        ?      151.6        6.5       ?       ? 
1 1 1   14    2   66 o    299.2    3.6    0.0000   0.0000          ?        ?   895.8459  21.7097          ?        ?      299.2        3.6       ?       ? 
1 1 1   14    2   67 o    334.3    3.4    0.0000   0.0000          ?        ?  1118.6898  22.9868          ?        ?      334.3        3.4       ?       ? 
1 1 1   14    2   68 f    103.2   10.2    0.0000   0.0000          ?        ?   107.2716  21.0712          ?        ?      103.2       10.2       ?       ? 
1 1 1   14    2   69 o     21.5   10.8    0.0000   0.0000          ?        ?   -65.1292  21.0712          ?        ?       21.5       10.8       ?       ? 
1 1 1   14    2   70 o     22.6   11.3    0.0000   0.0000          ?        ?   -56.8284  21.0712          ?        ?       22.6       11.3       ?       ? 
1 1 1   14    2   71 o    406.0    3.1    0.0000   0.0000          ?        ?  1649.3013  25.5409          ?        ?      406.0        3.1       ?       ? 
1 1 1   14    2   72 f     59.8   16.9    0.0000   0.0000          ?        ?    37.6728  21.0712          ?        ?       59.8       16.9       ?       ? 
1 1 1   14    2   73 o    182.8    5.9    0.0000   0.0000          ?        ?   335.2238  21.7097          ?        ?      182.8        5.9       ?       ? 
1 1 1   14    2   74 o    228.0    5.0    0.0000   0.0000          ?        ?   521.0336  22.9868          ?        ?      228.0        5.0       ?       ? 
1 1 1   14    2   75 o     51.4   17.0    0.0000   0.0000          ?        ?    26.1794  20.4327          ?        ?       51.4       17.0       ?       ? 
1 1 1   14    2   76 f    200.8    5.7    0.0000   0.0000          ?        ?   404.8227  22.9868          ?        ?      200.8        5.7       ?       ? 
1 1 1   14    2   77 o    313.0    3.8    0.0000   0.0000          ?        ?   981.4077  23.6253          ?        ?      313.0        3.8       ?       ? 
1 1 1   14    2   78 o    247.8    4.5    0.0000   0.0000          ?        ?   616.1733  22.3483          ?        ?      247.8        4.5       ?       ? 
1 1 1   14    2   79 o     39.1   16.4    0.0000   0.0000          ?        ?     3.8311  21.7097          ?        ?       39.1       16.4       ?       ? 
1 1 1   14    2   80 o     94.3   11.5    0.0000   0.0000          ?        ?    91.3086  21.7097          ?        ?       94.3       11.5       ?       ? 
1 1 1   14    3    0 o   1451.4    6.8 21068.6602 196.0261 21068.6602 196.0261 21068.6602 196.0261     1451.4      6.8     1451.4        6.8     0.0     0.0 
1 1 1   14    3    1 o    744.7    2.6    0.0000   0.0000          ?        ?  5545.5605  38.9498          ?        ?      744.7        2.6       ?       ? 
1 1 1   14    3    2 o    537.7    2.0    0.0000   0.0000          ?        ?  2891.2258  21.7097          ?        ?      537.7        2.0       ?       ? 
1 1 1   14    3    3 o    561.0    2.1    0.0000   0.0000          ?        ?  3147.2729  23.6253          ?        ?      561.0        2.1       ?       ? 
1 1 1   14    3    4 o    897.6    3.1    0.0000   0.0000          ?        ?  8057.5044  56.1899          ?        ?      897.6        3.1       ?       ? 
1 1 1   14    3    5 o    981.7    3.3    0.0000   0.0000          ?        ?  9637.2070  65.7677          ?        ?      981.7        3.3       ?       ? 
1 1 1   14    3    6 o    518.9    2.0    0.0000   0.0000          ?        ?  2692.6458  20.4327          ?        ?      518.9        2.0       ?       ? 
1 1 1   14    3    7 o    322.8    1.6    0.0000   0.0000          ?        ?  1042.0673  10.2163          ?        ?      322.8        1.6       ?       ? 
1 1 1   14    3    8 o    853.5    3.0    0.0000   0.0000          ?        ?  7285.5317  50.4432          ?        ?      853.5        3.0       ?       ? 
1 1 1   14    3    9 o    394.7    1.7    0.0000   0.0000          ?        ?  1557.9928  13.4090          ?        ?      394.7        1.7       ?       ? 
1 1 1   14    3   10 o   1090.0    3.6    0.0000   0.0000          ?        ? 11882.2490  79.1767          ?        ?     1090.0        3.6       ?       ? 
1 1 1   14    3   11 o    512.5    2.0    0.0000   0.0000          ?        ?  2626.8779  20.4327          ?        ?      512.5        2.0       ?       ? 
1 1 1   14    3   12 o    410.3    1.8    0.0000   0.0000          ?        ?  1683.1431  14.6860          ?        ?      410.3        1.8       ?       ? 
1 1 1   14    3   13 o   1235.3    4.1    0.0000   0.0000          ?        ? 15261.9434 102.1635          ?        ?     1235.3        4.1       ?       ? 
1 1 1   14    3   14 o   1099.8    3.7    0.0000   0.0000          ?        ? 12097.4307  82.3693          ?        ?     1099.8        3.7       ?       ? 
1 1 1   14    3   15 o    774.9    2.8    0.0000   0.0000          ?        ?  6004.6577  44.0580          ?        ?      774.9        2.8       ?       ? 
1 1 1   14    3   16 o    732.7    2.7    0.0000   0.0000          ?        ?  5368.6899  38.9498          ?        ?      732.7        2.7       ?       ? 
1 1 1   14    3   17 o    576.1    2.2    0.0000   0.0000          ?        ?  3319.0354  25.5409          ?        ?      576.1        2.2       ?       ? 
1 1 1   14    3   18 o   1068.2    3.7    0.0000   0.0000          ?        ? 11410.3818  78.5382          ?        ?     1068.2        3.7       ?       ? 
1 1 1   14    3   19 o    736.1    2.7    0.0000   0.0000          ?        ?  5418.4941  39.5883          ?        ?      736.1        2.7       ?       ? 
1 1 1   14    3   20 o    476.1    2.0    0.0000   0.0000          ?        ?  2266.7517  19.1556          ?        ?      476.1        2.0       ?       ? 
1 1 1   14    3   21 f    928.8    3.3    0.0000   0.0000          ?        ?  8627.7041  61.9366          ?        ?      928.8        3.3       ?       ? 
1 1 1   14    3   22 o    240.5    2.0    0.0000   0.0000          ?        ?   578.5006   9.5778          ?        ?      240.5        2.0       ?       ? 
1 1 1   14    3   23 o    671.2    2.5    0.0000   0.0000          ?        ?  4504.7700  33.8416          ?        ?      671.2        2.5       ?       ? 
1 1 1   14    3   24 o    582.4    2.4    0.0000   0.0000          ?        ?  3392.4653  28.0950          ?        ?      582.4        2.4       ?       ? 
1 1 1   14    3   25 o    664.0    2.7    0.0000   0.0000          ?        ?  4409.6304  35.7572          ?        ?      664.0        2.7       ?       ? 
1 1 1   14    3   26 o    768.1    3.0    0.0000   0.0000          ?        ?  5899.9399  46.6121          ?        ?      768.1        3.0       ?       ? 
1 1 1   14    3   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14    3   28 o   1076.4    3.8    0.0000   0.0000          ?        ? 11585.9746  81.0922          ?        ?     1076.4        3.8       ?       ? 
1 1 1   14    3   29 o    601.5    2.7    0.0000   0.0000          ?        ?  3617.8633  31.9261          ?        ?      601.5        2.7       ?       ? 
1 1 1   14    3   30 o   1355.7    4.9    0.0000   0.0000          ?        ? 18380.4844 132.1740          ?        ?     1355.7        4.9       ?       ? 
1 1 1   14    3   31 o   1583.6    5.6    0.0000   0.0000          ?        ? 25081.1289 176.8705          ?        ?     1583.6        5.6       ?       ? 
1 1 1   14    3   32 o   1566.7    5.4    0.0000   0.0000          ?        ? 24547.3242 169.8468          ?        ?     1566.7        5.4       ?       ? 
1 1 1   14    3   33 o    860.7    3.3    0.0000   0.0000          ?        ?  7408.7666  57.4669          ?        ?      860.7        3.3       ?       ? 
1 1 1   14    3   34 o    778.0    3.0    0.0000   0.0000          ?        ?  6053.1851  47.2506          ?        ?      778.0        3.0       ?       ? 
1 1 1   14    3   35 o    281.6    3.2    0.0000   0.0000          ?        ?   793.0438  17.8786          ?        ?      281.6        3.2       ?       ? 
1 1 1   14    3   36 f   1042.0    3.7    0.0000   0.0000          ?        ? 10858.6982  76.6226          ?        ?     1042.0        3.7       ?       ? 
1 1 1   14    3   37 o    776.3    3.1    0.0000   0.0000          ?        ?  6027.0059  48.5276          ?        ?      776.3        3.1       ?       ? 
1 1 1   14    3   38 o    919.5    3.4    0.0000   0.0000          ?        ?  8454.6650  61.9366          ?        ?      919.5        3.4       ?       ? 
1 1 1   14    3   39 o    586.2    3.0    0.0000   0.0000          ?        ?  3435.8848  35.1187          ?        ?      586.2        3.0       ?       ? 
1 1 1   14    3   40 o   1459.3    4.9    0.0000   0.0000          ?        ? 21298.5273 143.0288          ?        ?     1459.3        4.9       ?       ? 
1 1 1   14    3   41 o    427.8    2.8    0.0000   0.0000          ?        ?  1830.0031  23.6253          ?        ?      427.8        2.8       ?       ? 
1 1 1   14    3   42 o    449.7    2.8    0.0000   0.0000          ?        ?  2022.8364  24.9023          ?        ?      449.7        2.8       ?       ? 
1 1 1   14    3   43 o    958.5    3.5    0.0000   0.0000          ?        ?  9188.3262  67.6833          ?        ?      958.5        3.5       ?       ? 
1 1 1   14    3   44 f    788.2    3.0    0.0000   0.0000          ?        ?  6213.4536  47.8891          ?        ?      788.2        3.0       ?       ? 
1 1 1   14    3   45 o     86.8   11.0    0.0000   0.0000          ?        ?    75.3456  19.1556          ?        ?       86.8       11.0       ?       ? 
1 1 1   14    3   46 o    606.9    2.8    0.0000   0.0000          ?        ?  3683.6313  34.4802          ?        ?      606.9        2.8       ?       ? 
1 1 1   14    3   47 o   1288.4    4.4    0.0000   0.0000          ?        ? 16603.4785 113.0183          ?        ?     1288.4        4.4       ?       ? 
1 1 1   14    3   48 o    845.0    3.2    0.0000   0.0000          ?        ?  7141.2261  54.2743          ?        ?      845.0        3.2       ?       ? 
1 1 1   14    3   49 o    687.5    2.9    0.0000   0.0000          ?        ?  4727.6143  39.5883          ?        ?      687.5        2.9       ?       ? 
1 1 1   14    3   50 o    221.6    4.3    0.0000   0.0000          ?        ?   491.0231  19.1556          ?        ?      221.6        4.3       ?       ? 
1 1 1   14    3   51 o    232.7    4.3    0.0000   0.0000          ?        ?   541.4664  19.7942          ?        ?      232.7        4.3       ?       ? 
1 1 1   14    3   52 o    456.7    2.7    0.0000   0.0000          ?        ?  2086.0503  24.2638          ?        ?      456.7        2.7       ?       ? 
1 1 1   14    3   53 o    613.2    2.8    0.0000   0.0000          ?        ?  3760.2539  33.8416          ?        ?      613.2        2.8       ?       ? 
1 1 1   14    3   54 o    339.7    3.1    0.0000   0.0000          ?        ?  1154.4471  21.0712          ?        ?      339.7        3.1       ?       ? 
1 1 1   14    3   55 o    711.3    3.2    0.0000   0.0000          ?        ?  5060.2837  45.9736          ?        ?      711.3        3.2       ?       ? 
1 1 1   14    3   56 o    245.8    4.0    0.0000   0.0000          ?        ?   604.6799  19.7942          ?        ?      245.8        4.0       ?       ? 
1 1 1   14    3   57 o    806.0    3.1    0.0000   0.0000          ?        ?  6498.2349  50.4432          ?        ?      806.0        3.1       ?       ? 
1 1 1   14    3   58 o    312.5    3.7    0.0000   0.0000          ?        ?   976.9381  22.9868          ?        ?      312.5        3.7       ?       ? 
1 1 1   14    3   59 o    198.9    4.8    0.0000   0.0000          ?        ?   395.8834  19.1556          ?        ?      198.9        4.8       ?       ? 
1 1 1   14    3   60 o    430.9    2.7    0.0000   0.0000          ?        ?  1856.8208  23.6253          ?        ?      430.9        2.7       ?       ? 
1 1 1   14    3   61 o     23.3   11.6    0.0000   0.0000          ?        ?   -48.5276  20.4327          ?        ?       23.3       11.6       ?       ? 
1 1 1   14    3   62 o    286.9    3.4    0.0000   0.0000          ?        ?   823.6929  19.7942          ?        ?      286.9        3.4       ?       ? 
1 1 1   14    3   63 o     98.0    9.8    0.0000   0.0000          ?        ?    96.4168  19.1556          ?        ?       98.0        9.8       ?       ? 
1 1 1   14    3   64 o    206.3    4.6    0.0000   0.0000          ?        ?   425.8939  19.1556          ?        ?      206.3        4.6       ?       ? 
1 1 1   14    3   65 o    160.8    6.0    0.0000   0.0000          ?        ?   259.2398  19.1556          ?        ?      160.8        6.0       ?       ? 
1 1 1   14    3   66 o     34.1   15.0    0.0000   0.0000          ?        ?    -5.1082  19.7942          ?        ?       34.1       15.0       ?       ? 
1 1 1   14    3   67 o    163.0    6.3    0.0000   0.0000          ?        ?   266.2635  20.4327          ?        ?      163.0        6.3       ?       ? 
1 1 1   14    3   68 o    123.3    8.5    0.0000   0.0000          ?        ?   152.6067  21.0712          ?        ?      123.3        8.5       ?       ? 
1 1 1   14    3   69 o    163.7    6.2    0.0000   0.0000          ?        ?   268.8176  20.4327          ?        ?      163.7        6.2       ?       ? 
1 1 1   14    3   70 o    232.9    4.7    0.0000   0.0000          ?        ?   543.3819  21.7097          ?        ?      232.9        4.7       ?       ? 
1 1 1   14    3   71 o    250.5    4.2    0.0000   0.0000          ?        ?   628.3053  21.0712          ?        ?      250.5        4.2       ?       ? 
1 1 1   14    3   72 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14    3   73 o     38.9   16.5    0.0000   0.0000          ?        ?     1.2770  22.3483          ?        ?       38.9       16.5       ?       ? 
1 1 1   14    3   74 o    180.8    6.2    0.0000   0.0000          ?        ?   328.2001  22.3483          ?        ?      180.8        6.2       ?       ? 
1 1 1   14    3   75 o    375.2    3.3    0.0000   0.0000          ?        ?  1409.2172  24.9023          ?        ?      375.2        3.3       ?       ? 
1 1 1   14    3   76 o    109.0    9.1    0.0000   0.0000          ?        ?   120.0421  19.7942          ?        ?      109.0        9.1       ?       ? 
1 1 1   14    3   77 o    103.0   11.2    0.0000   0.0000          ?        ?   107.9102  22.9868          ?        ?      103.0       11.2       ?       ? 
1 1 1   14    3   78 o     24.0   11.8    0.0000   0.0000          ?        ?   -43.4195  20.4327          ?        ?       24.0       11.8       ?       ? 
1 1 1   14    3   79 o    243.6    4.8    0.0000   0.0000          ?        ?   595.7407  23.6253          ?        ?      243.6        4.8       ?       ? 
1 1 1   14    3   80 o    163.3    6.3    0.0000   0.0000          ?        ?   268.8176  20.4327          ?        ?      163.3        6.3       ?       ? 
1 1 1   14    4    0 f   2235.9   10.7 50004.5430 477.6142 50004.5430 477.6142 50004.5430 477.6142     2235.9     10.7     2235.9       10.7     0.0     0.0 
1 1 1   14    4    1 o    719.0    2.6    0.0000   0.0000          ?        ?  5169.4707  37.0343          ?        ?      719.0        2.6       ?       ? 
1 1 1   14    4    2 o    312.7    1.4    0.0000   0.0000          ?        ?   977.5767   8.9393          ?        ?      312.7        1.4       ?       ? 
1 1 1   14    4    3 o    588.7    2.2    0.0000   0.0000          ?        ?  3465.8953  26.1794          ?        ?      588.7        2.2       ?       ? 
1 1 1   14    4    4 o    202.8    1.4    0.0000   0.0000          ?        ?   411.2079   5.7467          ?        ?      202.8        1.4       ?       ? 
1 1 1   14    4    5 o    826.2    2.9    0.0000   0.0000          ?        ?  6826.4346  47.8891          ?        ?      826.2        2.9       ?       ? 
1 1 1   14    4    6 o    926.3    3.2    0.0000   0.0000          ?        ?  8579.8145  58.7440          ?        ?      926.3        3.2       ?       ? 
1 1 1   14    4    7 o    544.8    2.1    0.0000   0.0000          ?        ?  2967.8484  22.3483          ?        ?      544.8        2.1       ?       ? 
1 1 1   14    4    8 f    345.4    1.6    0.0000   0.0000          ?        ?  1192.7584  10.8549          ?        ?      345.4        1.6       ?       ? 
1 1 1   14    4    9 o   1015.0    3.4    0.0000   0.0000          ?        ? 10301.9082  69.5989          ?        ?     1015.0        3.4       ?       ? 
1 1 1   14    4   10 o    422.9    1.9    0.0000   0.0000          ?        ?  1788.4991  15.9630          ?        ?      422.9        1.9       ?       ? 
1 1 1   14    4   11 o   1728.1    5.6    0.0000   0.0000          ?        ? 29866.8496 194.7491          ?        ?     1728.1        5.6       ?       ? 
1 1 1   14    4   12 o    805.1    2.9    0.0000   0.0000          ?        ?  6482.2715  45.9736          ?        ?      805.1        2.9       ?       ? 
1 1 1   14    4   13 o   1640.4    5.4    0.0000   0.0000          ?        ? 26912.4082 175.5934          ?        ?     1640.4        5.4       ?       ? 
1 1 1   14    4   14 o    556.3    2.2    0.0000   0.0000          ?        ?  3094.9143  24.2638          ?        ?      556.3        2.2       ?       ? 
1 1 1   14    4   15 o   1004.7    3.5    0.0000   0.0000          ?        ? 10095.0273  69.5989          ?        ?     1004.7        3.5       ?       ? 
1 1 1   14    4   16 o    524.8    2.1    0.0000   0.0000          ?        ?  2753.9436  21.7097          ?        ?      524.8        2.1       ?       ? 
1 1 1   14    4   17 o   1140.6    3.9    0.0000   0.0000          ?        ? 13011.1553  88.1160          ?        ?     1140.6        3.9       ?       ? 
1 1 1   14    4   18 o    861.5    3.0    0.0000   0.0000          ?        ?  7421.5371  52.3588          ?        ?      861.5        3.0       ?       ? 
1 1 1   14    4   19 o    852.1    3.0    0.0000   0.0000          ?        ?  7261.9067  51.7203          ?        ?      852.1        3.0       ?       ? 
1 1 1   14    4   20 o    879.9    3.1    0.0000   0.0000          ?        ?  7743.3516  54.9129          ?        ?      879.9        3.1       ?       ? 
1 1 1   14    4   21 o   1918.0    6.3    0.0000   0.0000          ?        ? 36794.1680 240.7227          ?        ?     1918.0        6.3       ?       ? 
1 1 1   14    4   22 o    620.9    2.4    0.0000   0.0000          ?        ?  3854.7551  30.0105          ?        ?      620.9        2.4       ?       ? 
1 1 1   14    4   23 o   1454.2    4.8    0.0000   0.0000          ?        ? 21149.7520 140.4748          ?        ?     1454.2        4.8       ?       ? 
1 1 1   14    4   24 o   2728.1    8.9    0.0000   0.0000          ?        ? 74447.1484 484.6379          ?        ?     2728.1        8.9       ?       ? 
1 1 1   14    4   25 o    307.4    2.2    0.0000   0.0000          ?        ?   945.0120  13.4090          ?        ?      307.4        2.2       ?       ? 
1 1 1   14    4   26 o   1886.6    6.5    0.0000   0.0000          ?        ? 35598.2188 247.1079          ?        ?     1886.6        6.5       ?       ? 
1 1 1   14    4   27 o     73.2    7.4    0.0000   0.0000          ?        ?    53.6358  10.8549          ?        ?       73.2        7.4       ?       ? 
1 1 1   14    4   28 o    303.3    2.5    0.0000   0.0000          ?        ?   920.1097  15.3245          ?        ?      303.3        2.5       ?       ? 
1 1 1   14    4   29 o   1171.2    4.3    0.0000   0.0000          ?        ? 13717.9980  99.6094          ?        ?     1171.2        4.3       ?       ? 
1 1 1   14    4   30 o    617.2    2.8    0.0000   0.0000          ?        ?  3809.4199  34.4802          ?        ?      617.2        2.8       ?       ? 
1 1 1   14    4   31 o   1304.0    4.6    0.0000   0.0000          ?        ? 17005.1074 120.0421          ?        ?     1304.0        4.6       ?       ? 
1 1 1   14    4   32 o   1147.5    4.2    0.0000   0.0000          ?        ? 13168.8691  96.4168          ?        ?     1147.5        4.2       ?       ? 
1 1 1   14    4   33 o    758.0    3.2    0.0000   0.0000          ?        ?  5746.0562  47.8891          ?        ?      758.0        3.2       ?       ? 
1 1 1   14    4   34 o    936.6    3.4    0.0000   0.0000          ?        ?  8773.2871  63.8522          ?        ?      936.6        3.4       ?       ? 
1 1 1   14    4   35 o   1329.8    4.6    0.0000   0.0000          ?        ? 17683.8555 121.3191          ?        ?     1329.8        4.6       ?       ? 
1 1 1   14    4   36 o    939.3    3.7    0.0000   0.0000          ?        ?  8822.4531  68.9603          ?        ?      939.3        3.7       ?       ? 
1 1 1   14    4   37 o    429.4    2.5    0.0000   0.0000          ?        ?  1844.0504  21.7097          ?        ?      429.4        2.5       ?       ? 
1 1 1   14    4   38 o   1560.2    5.2    0.0000   0.0000          ?        ? 24344.9141 163.4615          ?        ?     1560.2        5.2       ?       ? 
1 1 1   14    4   39 o   1360.6    4.8    0.0000   0.0000          ?        ? 18514.5742 130.8969          ?        ?     1360.6        4.8       ?       ? 
1 1 1   14    4   40 o    847.1    3.3    0.0000   0.0000          ?        ?  7176.9829  55.5514          ?        ?      847.1        3.3       ?       ? 
1 1 1   14    4   41 o    357.2    2.9    0.0000   0.0000          ?        ?  1275.7662  21.0712          ?        ?      357.2        2.9       ?       ? 
1 1 1   14    4   42 o    893.0    3.3    0.0000   0.0000          ?        ?  7974.4966  59.3825          ?        ?      893.0        3.3       ?       ? 
1 1 1   14    4   43 o    796.2    3.1    0.0000   0.0000          ?        ?  6339.8813  49.1662          ?        ?      796.2        3.1       ?       ? 
1 1 1   14    4   44 o    524.8    2.8    0.0000   0.0000          ?        ?  2754.5823  29.3720          ?        ?      524.8        2.8       ?       ? 
1 1 1   14    4   45 o    268.7    3.6    0.0000   0.0000          ?        ?   722.1680  19.1556          ?        ?      268.7        3.6       ?       ? 
1 1 1   14    4   46 o    528.9    2.8    0.0000   0.0000          ?        ?  2798.0020  29.3720          ?        ?      528.9        2.8       ?       ? 
1 1 1   14    4   47 o    258.3    4.1    0.0000   0.0000          ?        ?   667.2551  21.0712          ?        ?      258.3        4.1       ?       ? 
1 1 1   14    4   48 o    748.8    2.9    0.0000   0.0000          ?        ?  5607.4971  44.0580          ?        ?      748.8        2.9       ?       ? 
1 1 1   14    4   49 o    473.9    3.0    0.0000   0.0000          ?        ?  2246.3191  28.0950          ?        ?      473.9        3.0       ?       ? 
1 1 1   14    4   50 o    627.8    2.8    0.0000   0.0000          ?        ?  3941.5940  35.1187          ?        ?      627.8        2.8       ?       ? 
1 1 1   14    4   51 o    789.5    3.1    0.0000   0.0000          ?        ?  6234.5254  49.1662          ?        ?      789.5        3.1       ?       ? 
1 1 1   14    4   52 o    331.0    3.3    0.0000   0.0000          ?        ?  1095.7031  21.7097          ?        ?      331.0        3.3       ?       ? 
1 1 1   14    4   53 f    273.5    3.6    0.0000   0.0000          ?        ?   748.3474  19.7942          ?        ?      273.5        3.6       ?       ? 
1 1 1   14    4   54 o     99.7    9.3    0.0000   0.0000          ?        ?    99.6094  18.5171          ?        ?       99.7        9.3       ?       ? 
1 1 1   14    4   55 o     94.4    9.5    0.0000   0.0000          ?        ?    89.3930  17.8786          ?        ?       94.4        9.5       ?       ? 
1 1 1   14    4   56 o    161.9    6.1    0.0000   0.0000          ?        ?   262.4324  19.7942          ?        ?      161.9        6.1       ?       ? 
1 1 1   14    4   57 f    247.5    4.0    0.0000   0.0000          ?        ?   612.9808  19.7942          ?        ?      247.5        4.0       ?       ? 
1 1 1   14    4   58 o    426.9    2.8    0.0000   0.0000          ?        ?  1822.9792  23.6253          ?        ?      426.9        2.8       ?       ? 
1 1 1   14    4   59 o     20.7   10.4    0.0000   0.0000          ?        ?   -67.0448  20.4327          ?        ?       20.7       10.4       ?       ? 
1 1 1   14    4   60 o    283.1    3.5    0.0000   0.0000          ?        ?   801.9832  19.7942          ?        ?      283.1        3.5       ?       ? 
1 1 1   14    4   61 o    216.0    4.4    0.0000   0.0000          ?        ?   466.7593  19.1556          ?        ?      216.0        4.4       ?       ? 
1 1 1   14    4   62 o    203.9    4.9    0.0000   0.0000          ?        ?   416.3161  19.7942          ?        ?      203.9        4.9       ?       ? 
1 1 1   14    4   63 o    165.6    5.8    0.0000   0.0000          ?        ?   274.5643  19.1556          ?        ?      165.6        5.8       ?       ? 
1 1 1   14    4   64 o    137.3    7.2    0.0000   0.0000          ?        ?   189.0024  19.7942          ?        ?      137.3        7.2       ?       ? 
1 1 1   14    4   65 o    345.7    3.0    0.0000   0.0000          ?        ?  1195.9510  20.4327          ?        ?      345.7        3.0       ?       ? 
1 1 1   14    4   66 o    239.5    4.3    0.0000   0.0000          ?        ?   574.0309  20.4327          ?        ?      239.5        4.3       ?       ? 
1 1 1   14    4   67 o    269.1    3.9    0.0000   0.0000          ?        ?   724.7220  21.0712          ?        ?      269.1        3.9       ?       ? 
1 1 1   14    4   68 o    169.9    6.2    0.0000   0.0000          ?        ?   289.2503  21.0712          ?        ?      169.9        6.2       ?       ? 
1 1 1   14    4   69 o    189.9    5.5    0.0000   0.0000          ?        ?   361.4032  21.0712          ?        ?      189.9        5.5       ?       ? 
1 1 1   14    4   70 o    265.3    4.1    0.0000   0.0000          ?        ?   704.9279  21.7097          ?        ?      265.3        4.1       ?       ? 
1 1 1   14    4   71 o    237.0    4.7    0.0000   0.0000          ?        ?   562.5375  22.3483          ?        ?      237.0        4.7       ?       ? 
1 1 1   14    4   72 o     96.4   10.9    0.0000   0.0000          ?        ?    93.8627  21.0712          ?        ?       96.4       10.9       ?       ? 
1 1 1   14    4   73 o     97.3   10.8    0.0000   0.0000          ?        ?    95.7782  21.0712          ?        ?       97.3       10.8       ?       ? 
1 1 1   14    4   74 o    401.5    3.2    0.0000   0.0000          ?        ?  1613.5442  25.5409          ?        ?      401.5        3.2       ?       ? 
1 1 1   14    4   75 o    143.8    7.8    0.0000   0.0000          ?        ?   208.1580  22.3483          ?        ?      143.8        7.8       ?       ? 
1 1 1   14    4   76 o     66.0   15.7    0.0000   0.0000          ?        ?    46.6121  20.4327          ?        ?       66.0       15.7       ?       ? 
1 1 1   14    4   77 o     53.8   17.0    0.0000   0.0000          ?        ?    30.0105  20.4327          ?        ?       53.8       17.0       ?       ? 
1 1 1   14    4   78 o     30.3   14.0    0.0000   0.0000          ?        ?   -14.6860  19.7942          ?        ?       30.3       14.0       ?       ? 
1 1 1   14    4   79 o     74.9   14.6    0.0000   0.0000          ?        ?    60.0210  21.0712          ?        ?       74.9       14.6       ?       ? 
1 1 1   14    4   80 o    150.1    6.6    0.0000   0.0000          ?        ?   227.3137  19.7942          ?        ?      150.1        6.6       ?       ? 
1 1 1   14    5    0 o    155.9    1.8  243.2767   5.7467   243.2767   5.7467   243.2767   5.7467      155.9      1.8      155.9        1.8     0.0     0.0 
1 1 1   14    5    1 o    123.8    1.5    0.0000   0.0000          ?        ?   153.2452   3.8311          ?        ?      123.8        1.5       ?       ? 
1 1 1   14    5    2 o    882.6    3.0    0.0000   0.0000          ?        ?  7790.6021  53.6358          ?        ?      882.6        3.0       ?       ? 
1 1 1   14    5    3 o    368.2    1.6    0.0000   0.0000          ?        ?  1355.5814  11.4934          ?        ?      368.2        1.6       ?       ? 
1 1 1   14    5    4 o    696.3    2.5    0.0000   0.0000          ?        ?  4848.2944  34.4802          ?        ?      696.3        2.5       ?       ? 
1 1 1   14    5    5 o    558.8    2.1    0.0000   0.0000          ?        ?  3123.0093  23.6253          ?        ?      558.8        2.1       ?       ? 
1 1 1   14    5    6 o   1108.4    3.7    0.0000   0.0000          ?        ? 12286.4326  82.3693          ?        ?     1108.4        3.7       ?       ? 
1 1 1   14    5    7 o    458.8    1.9    0.0000   0.0000          ?        ?  2105.2058  17.2401          ?        ?      458.8        1.9       ?       ? 
1 1 1   14    5    8 o   1114.4    3.8    0.0000   0.0000          ?        ? 12418.6074  83.6463          ?        ?     1114.4        3.8       ?       ? 
1 1 1   14    5    9 o    689.8    2.5    0.0000   0.0000          ?        ?  4758.9014  34.4802          ?        ?      689.8        2.5       ?       ? 
1 1 1   14    5   10 o   1008.5    3.5    0.0000   0.0000          ?        ? 10170.3730  69.5989          ?        ?     1008.5        3.5       ?       ? 
1 1 1   14    5   11 o    702.9    2.5    0.0000   0.0000          ?        ?  4940.2417  35.7572          ?        ?      702.9        2.5       ?       ? 
1 1 1   14    5   12 o   1224.4    4.1    0.0000   0.0000          ?        ? 14991.8486 100.8864          ?        ?     1224.4        4.1       ?       ? 
1 1 1   14    5   13 o    426.6    1.9    0.0000   0.0000          ?        ?  1819.7866  15.9630          ?        ?      426.6        1.9       ?       ? 
1 1 1   14    5   14 o    813.7    2.9    0.0000   0.0000          ?        ?  6622.1074  47.2506          ?        ?      813.7        2.9       ?       ? 
1 1 1   14    5   15 o    183.8    1.7    0.0000   0.0000          ?        ?   337.7780   6.3852          ?        ?      183.8        1.7       ?       ? 
1 1 1   14    5   16 o    627.6    2.4    0.0000   0.0000          ?        ?  3939.0400  30.0105          ?        ?      627.6        2.4       ?       ? 
1 1 1   14    5   17 o    730.3    2.9    0.0000   0.0000          ?        ?  5334.2100  42.1424          ?        ?      730.3        2.9       ?       ? 
1 1 1   14    5   18 o    205.3    2.0    0.0000   0.0000          ?        ?   421.4243   8.3008          ?        ?      205.3        2.0       ?       ? 
1 1 1   14    5   19 o    737.7    2.7    0.0000   0.0000          ?        ?  5441.4814  40.2269          ?        ?      737.7        2.7       ?       ? 
1 1 1   14    5   20 o   1515.4    5.0    0.0000   0.0000          ?        ? 22965.7070 152.6067          ?        ?     1515.4        5.0       ?       ? 
1 1 1   14    5   21 o    941.7    3.4    0.0000   0.0000          ?        ?  8868.4268  63.2136          ?        ?      941.7        3.4       ?       ? 
1 1 1   14    5   22 o    620.4    2.4    0.0000   0.0000          ?        ?  3849.6470  30.0105          ?        ?      620.4        2.4       ?       ? 
1 1 1   14    5   23 o   1136.5    3.9    0.0000   0.0000          ?        ? 12916.6543  88.1160          ?        ?     1136.5        3.9       ?       ? 
1 1 1   14    5   24 o    847.9    3.0    0.0000   0.0000          ?        ?  7189.7534  51.7203          ?        ?      847.9        3.0       ?       ? 
1 1 1   14    5   25 o    585.4    2.5    0.0000   0.0000          ?        ?  3426.9456  29.3720          ?        ?      585.4        2.5       ?       ? 
1 1 1   14    5   26 o    764.6    2.9    0.0000   0.0000          ?        ?  5845.6655  44.6965          ?        ?      764.6        2.9       ?       ? 
1 1 1   14    5   27 o   1170.6    4.3    0.0000   0.0000          ?        ? 13704.5898 100.2479          ?        ?     1170.6        4.3       ?       ? 
1 1 1   14    5   28 o   1083.5    4.0    0.0000   0.0000          ?        ? 11739.2197  87.4775          ?        ?     1083.5        4.0       ?       ? 
1 1 1   14    5   29 o    444.5    2.5    0.0000   0.0000          ?        ?  1975.5858  22.3483          ?        ?      444.5        2.5       ?       ? 
1 1 1   14    5   30 o    607.7    2.6    0.0000   0.0000          ?        ?  3692.5706  31.2876          ?        ?      607.7        2.6       ?       ? 
1 1 1   14    5   31 o    856.9    3.5    0.0000   0.0000          ?        ?  7343.6372  59.3825          ?        ?      856.9        3.5       ?       ? 
1 1 1   14    5   32 o    977.4    3.5    0.0000   0.0000          ?        ?  9554.1992  67.6833          ?        ?      977.4        3.5       ?       ? 
1 1 1   14    5   33 o    204.7    4.1    0.0000   0.0000          ?        ?   418.8702  16.6016          ?        ?      204.7        4.1       ?       ? 
1 1 1   14    5   34 o    298.1    3.2    0.0000   0.0000          ?        ?   888.8221  19.1556          ?        ?      298.1        3.2       ?       ? 
1 1 1   14    5   35 o    487.6    2.6    0.0000   0.0000          ?        ?  2377.8545  25.5409          ?        ?      487.6        2.6       ?       ? 
1 1 1   14    5   36 o   1029.3    3.7    0.0000   0.0000          ?        ? 10594.3506  76.6226          ?        ?     1029.3        3.7       ?       ? 
1 1 1   14    5   37 o   1019.0    3.7    0.0000   0.0000          ?        ? 10383.6387  75.3456          ?        ?     1019.0        3.7       ?       ? 
1 1 1   14    5   38 o   1445.9    4.9    0.0000   0.0000          ?        ? 20908.3906 140.4748          ?        ?     1445.9        4.9       ?       ? 
1 1 1   14    5   39 o   1088.8    3.8    0.0000   0.0000          ?        ? 11856.7080  82.3693          ?        ?     1088.8        3.8       ?       ? 
1 1 1   14    5   40 o    843.4    3.2    0.0000   0.0000          ?        ?  7113.7690  53.6358          ?        ?      843.4        3.2       ?       ? 
1 1 1   14    5   41 o   1160.4    4.2    0.0000   0.0000          ?        ? 13465.7822  97.6938          ?        ?     1160.4        4.2       ?       ? 
1 1 1   14    5   42 o    497.1    2.6    0.0000   0.0000          ?        ?  2471.0786  25.5409          ?        ?      497.1        2.6       ?       ? 
1 1 1   14    5   43 o   1136.2    4.1    0.0000   0.0000          ?        ? 12910.2686  93.2242          ?        ?     1136.2        4.1       ?       ? 
1 1 1   14    5   44 o    423.4    2.9    0.0000   0.0000          ?        ?  1792.9686  24.9023          ?        ?      423.4        2.9       ?       ? 
1 1 1   14    5   45 o    552.0    2.7    0.0000   0.0000          ?        ?  3047.0254  29.3720          ?        ?      552.0        2.7       ?       ? 
1 1 1   14    5   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14    5   47 o    145.8    6.4    0.0000   0.0000          ?        ?   212.6277  18.5171          ?        ?      145.8        6.4       ?       ? 
1 1 1   14    5   48 o    219.7    4.4    0.0000   0.0000          ?        ?   482.7224  19.1556          ?        ?      219.7        4.4       ?       ? 
1 1 1   14    5   49 o    831.7    3.3    0.0000   0.0000          ?        ?  6919.0200  54.2743          ?        ?      831.7        3.3       ?       ? 
1 1 1   14    5   50 o    358.9    3.2    0.0000   0.0000          ?        ?  1288.5366  22.9868          ?        ?      358.9        3.2       ?       ? 
1 1 1   14    5   51 o    459.4    2.7    0.0000   0.0000          ?        ?  2110.3140  24.9023          ?        ?      459.4        2.7       ?       ? 
1 1 1   14    5   52 o   1071.1    3.7    0.0000   0.0000          ?        ? 11476.1494  79.8152          ?        ?     1071.1        3.7       ?       ? 
1 1 1   14    5   53 o    180.0    5.5    0.0000   0.0000          ?        ?   324.3690  19.7942          ?        ?      180.0        5.5       ?       ? 
1 1 1   14    5   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14    5   55 o    593.9    2.7    0.0000   0.0000          ?        ?  3527.8320  32.5646          ?        ?      593.9        2.7       ?       ? 
1 1 1   14    5   56 o    340.4    3.2    0.0000   0.0000          ?        ?  1158.9167  21.7097          ?        ?      340.4        3.2       ?       ? 
1 1 1   14    5   57 o    319.3    3.1    0.0000   0.0000          ?        ?  1019.7190  19.7942          ?        ?      319.3        3.1       ?       ? 
1 1 1   14    5   58 o    155.1    6.4    0.0000   0.0000          ?        ?   240.7227  19.7942          ?        ?      155.1        6.4       ?       ? 
1 1 1   14    5   59 f     37.6   15.7    0.0000   0.0000          ?        ?     2.5541  19.7942          ?        ?       37.6       15.7       ?       ? 
1 1 1   14    5   60 o    415.3    2.9    0.0000   0.0000          ?        ?  1725.2855  24.2638          ?        ?      415.3        2.9       ?       ? 
1 1 1   14    5   61 o     76.8   13.8    0.0000   0.0000          ?        ?    61.2981  20.4327          ?        ?       76.8       13.8       ?       ? 
1 1 1   14    5   62 f    114.8    8.9    0.0000   0.0000          ?        ?   132.1740  20.4327          ?        ?      114.8        8.9       ?       ? 
1 1 1   14    5   63 o    196.6    5.0    0.0000   0.0000          ?        ?   386.9441  19.7942          ?        ?      196.6        5.0       ?       ? 
1 1 1   14    5   64 o    191.8    5.2    0.0000   0.0000          ?        ?   368.4270  19.7942          ?        ?      191.8        5.2       ?       ? 
1 1 1   14    5   65 o    236.1    4.5    0.0000   0.0000          ?        ?   558.0679  21.0712          ?        ?      236.1        4.5       ?       ? 
1 1 1   14    5   66 o    174.0    6.2    0.0000   0.0000          ?        ?   303.2978  21.7097          ?        ?      174.0        6.2       ?       ? 
1 1 1   14    5   67 o    350.5    3.4    0.0000   0.0000          ?        ?  1229.1542  23.6253          ?        ?      350.5        3.4       ?       ? 
1 1 1   14    5   68 o    311.6    3.7    0.0000   0.0000          ?        ?   971.8299  22.9868          ?        ?      311.6        3.7       ?       ? 
1 1 1   14    5   69 o    156.7    6.9    0.0000   0.0000          ?        ?   246.4693  21.7097          ?        ?      156.7        6.9       ?       ? 
1 1 1   14    5   70 o    185.6    5.8    0.0000   0.0000          ?        ?   345.4402  21.7097          ?        ?      185.6        5.8       ?       ? 
1 1 1   14    5   71 o    252.2    4.3    0.0000   0.0000          ?        ?   637.2446  21.7097          ?        ?      252.2        4.3       ?       ? 
1 1 1   14    5   72 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14    5   73 o     71.4   16.0    0.0000   0.0000          ?        ?    54.2743  22.3483          ?        ?       71.4       16.0       ?       ? 
1 1 1   14    5   74 o    145.8    7.7    0.0000   0.0000          ?        ?   213.9047  22.3483          ?        ?      145.8        7.7       ?       ? 
1 1 1   14    5   75 o    130.6    7.8    0.0000   0.0000          ?        ?   171.7623  20.4327          ?        ?      130.6        7.8       ?       ? 
1 1 1   14    5   76 o    107.3   10.4    0.0000   0.0000          ?        ?   116.8494  22.3483          ?        ?      107.3       10.4       ?       ? 
1 1 1   14    5   77 o     62.6   15.8    0.0000   0.0000          ?        ?    42.1424  19.7942          ?        ?       62.6       15.8       ?       ? 
1 1 1   14    5   78 o    115.8    9.4    0.0000   0.0000          ?        ?   136.0051  21.7097          ?        ?      115.8        9.4       ?       ? 
1 1 1   14    5   79 o     25.4   12.4    0.0000   0.0000          ?        ?   -35.7572  20.4327          ?        ?       25.4       12.4       ?       ? 
1 1 1   14    5   80 o    169.6    6.0    0.0000   0.0000          ?        ?   289.8888  20.4327          ?        ?      169.6        6.0       ?       ? 
1 1 1   14    6    0 o    397.7    2.6 1581.6180  20.4327  1581.6180  20.4327  1581.6180  20.4327      397.7      2.6      397.7        2.6     0.0     0.0 
1 1 1   14    6    1 o    310.3    1.4    0.0000   0.0000          ?        ?   962.8906   8.9393          ?        ?      310.3        1.4       ?       ? 
1 1 1   14    6    2 o   1056.0    3.7    0.0000   0.0000          ?        ? 11151.1416  77.2611          ?        ?     1056.0        3.7       ?       ? 
1 1 1   14    6    3 o    898.6    3.2    0.0000   0.0000          ?        ?  8074.7441  57.4669          ?        ?      898.6        3.2       ?       ? 
1 1 1   14    6    4 o     68.7    2.3    0.0000   0.0000          ?        ?    47.2506   3.1926          ?        ?       68.7        2.3       ?       ? 
1 1 1   14    6    5 f   1203.3    4.1    0.0000   0.0000          ?        ? 14479.7549  97.6938          ?        ?     1203.3        4.1       ?       ? 
1 1 1   14    6    6 o   1149.7    3.9    0.0000   0.0000          ?        ? 13218.0371  90.6701          ?        ?     1149.7        3.9       ?       ? 
1 1 1   14    6    7 o    590.0    2.3    0.0000   0.0000          ?        ?  3481.2200  27.4564          ?        ?      590.0        2.3       ?       ? 
1 1 1   14    6    8 o    960.2    3.3    0.0000   0.0000          ?        ?  9219.6143  63.2136          ?        ?      960.2        3.3       ?       ? 
1 1 1   14    6    9 f    745.8    2.7    0.0000   0.0000          ?        ?  5562.8003  39.5883          ?        ?      745.8        2.7       ?       ? 
1 1 1   14    6   10 f    716.6    2.5    0.0000   0.0000          ?        ?  5134.9912  36.3957          ?        ?      716.6        2.5       ?       ? 
1 1 1   14    6   11 o    517.7    2.0    0.0000   0.0000          ?        ?  2679.8752  21.0712          ?        ?      517.7        2.0       ?       ? 
1 1 1   14    6   12 o    150.8    2.1    0.0000   0.0000          ?        ?   227.3137   6.3852          ?        ?      150.8        2.1       ?       ? 
1 1 1   14    6   13 f    758.2    2.7    0.0000   0.0000          ?        ?  5749.2490  41.5039          ?        ?      758.2        2.7       ?       ? 
1 1 1   14    6   14 o   1098.1    3.8    0.0000   0.0000          ?        ? 12059.1191  82.3693          ?        ?     1098.1        3.8       ?       ? 
1 1 1   14    6   15 o    357.8    1.7    0.0000   0.0000          ?        ?  1280.2358  12.1319          ?        ?      357.8        1.7       ?       ? 
1 1 1   14    6   16 o   1051.7    3.6    0.0000   0.0000          ?        ? 11062.3867  75.9841          ?        ?     1051.7        3.6       ?       ? 
1 1 1   14    6   17 o    758.9    2.7    0.0000   0.0000          ?        ?  5760.1035  41.5039          ?        ?      758.9        2.7       ?       ? 
1 1 1   14    6   18 o    747.6    2.7    0.0000   0.0000          ?        ?  5588.9795  40.8654          ?        ?      747.6        2.7       ?       ? 
1 1 1   14    6   19 o   1614.6    5.3    0.0000   0.0000          ?        ? 26072.7539 172.4008          ?        ?     1614.6        5.3       ?       ? 
1 1 1   14    6   20 o    513.0    2.1    0.0000   0.0000          ?        ?  2631.9863  21.7097          ?        ?      513.0        2.1       ?       ? 
1 1 1   14    6   21 f    623.8    2.4    0.0000   0.0000          ?        ?  3891.7893  30.0105          ?        ?      623.8        2.4       ?       ? 
1 1 1   14    6   22 o   1460.3    4.9    0.0000   0.0000          ?        ? 21325.9824 142.3903          ?        ?     1460.3        4.9       ?       ? 
1 1 1   14    6   23 o    632.4    2.5    0.0000   0.0000          ?        ?  3999.0608  31.9261          ?        ?      632.4        2.5       ?       ? 
1 1 1   14    6   24 o   2076.7    7.2    0.0000   0.0000          ?        ? 43132.7734 299.4666          ?        ?     2076.7        7.2       ?       ? 
1 1 1   14    6   25 o    733.7    2.9    0.0000   0.0000          ?        ?  5382.7373  42.7809          ?        ?      733.7        2.9       ?       ? 
1 1 1   14    6   26 o   1247.7    4.3    0.0000   0.0000          ?        ? 15569.0732 108.5487          ?        ?     1247.7        4.3       ?       ? 
1 1 1   14    6   27 o    355.7    2.3    0.0000   0.0000          ?        ?  1264.9114  16.6016          ?        ?      355.7        2.3       ?       ? 
1 1 1   14    6   28 o    447.1    2.4    0.0000   0.0000          ?        ?  1999.2113  21.0712          ?        ?      447.1        2.4       ?       ? 
1 1 1   14    6   29 o   2335.0    7.8    0.0000   0.0000          ?        ? 54531.0234 366.5114          ?        ?     2335.0        7.8       ?       ? 
1 1 1   14    6   30 o   1167.7    4.0    0.0000   0.0000          ?        ? 13634.9902  93.8627          ?        ?     1167.7        4.0       ?       ? 
1 1 1   14    6   31 o    389.4    2.5    0.0000   0.0000          ?        ?  1516.4889  19.7942          ?        ?      389.4        2.5       ?       ? 
1 1 1   14    6   32 f   1048.4    3.9    0.0000   0.0000          ?        ? 10991.5117  81.0922          ?        ?     1048.4        3.9       ?       ? 
1 1 1   14    6   33 o   1377.8    4.8    0.0000   0.0000          ?        ? 18985.1641 132.8125          ?        ?     1377.8        4.8       ?       ? 
1 1 1   14    6   34 o     26.5   12.9    0.0000   0.0000          ?        ?   -41.5039  22.3483          ?        ?       26.5       12.9       ?       ? 
1 1 1   14    6   35 o    409.9    2.7    0.0000   0.0000          ?        ?  1680.5890  22.3483          ?        ?      409.9        2.7       ?       ? 
1 1 1   14    6   36 o    572.9    2.7    0.0000   0.0000          ?        ?  3282.6394  30.6490          ?        ?      572.9        2.7       ?       ? 
1 1 1   14    6   37 o   1477.4    5.1    0.0000   0.0000          ?        ? 21831.0547 149.4141          ?        ?     1477.4        5.1       ?       ? 
1 1 1   14    6   38 o    495.0    2.5    0.0000   0.0000          ?        ?  2450.0076  24.9023          ?        ?      495.0        2.5       ?       ? 
1 1 1   14    6   39 o    562.4    2.6    0.0000   0.0000          ?        ?  3162.5977  29.3720          ?        ?      562.4        2.6       ?       ? 
1 1 1   14    6   40 o    460.1    2.6    0.0000   0.0000          ?        ?  2116.6992  23.6253          ?        ?      460.1        2.6       ?       ? 
1 1 1   14    6   41 o    791.6    3.1    0.0000   0.0000          ?        ?  6267.0898  49.1662          ?        ?      791.6        3.1       ?       ? 
1 1 1   14    6   42 o    718.5    2.9    0.0000   0.0000          ?        ?  5162.4473  42.1424          ?        ?      718.5        2.9       ?       ? 
1 1 1   14    6   43 o   1070.9    3.8    0.0000   0.0000          ?        ? 11469.7646  81.0922          ?        ?     1070.9        3.8       ?       ? 
1 1 1   14    6   44 o    428.2    2.8    0.0000   0.0000          ?        ?  1833.8342  24.2638          ?        ?      428.2        2.8       ?       ? 
1 1 1   14    6   45 o    891.0    3.3    0.0000   0.0000          ?        ?  7938.7397  58.1055          ?        ?      891.0        3.3       ?       ? 
1 1 1   14    6   46 o    511.6    2.7    0.0000   0.0000          ?        ?  2617.9387  27.4564          ?        ?      511.6        2.7       ?       ? 
1 1 1   14    6   47 o    384.8    2.9    0.0000   0.0000          ?        ?  1480.7316  22.3483          ?        ?      384.8        2.9       ?       ? 
1 1 1   14    6   48 o    545.5    2.6    0.0000   0.0000          ?        ?  2976.1494  28.0950          ?        ?      545.5        2.6       ?       ? 
1 1 1   14    6   49 o    243.9    3.8    0.0000   0.0000          ?        ?   595.1021  18.5171          ?        ?      243.9        3.8       ?       ? 
1 1 1   14    6   50 o    146.4    6.5    0.0000   0.0000          ?        ?   214.5433  19.1556          ?        ?      146.4        6.5       ?       ? 
1 1 1   14    6   51 o    686.5    2.9    0.0000   0.0000          ?        ?  4713.5669  39.5883          ?        ?      686.5        2.9       ?       ? 
1 1 1   14    6   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14    6   53 o    277.8    3.6    0.0000   0.0000          ?        ?   771.9727  19.7942          ?        ?      277.8        3.6       ?       ? 
1 1 1   14    6   54 o    519.7    2.7    0.0000   0.0000          ?        ?  2700.9465  28.0950          ?        ?      519.7        2.7       ?       ? 
1 1 1   14    6   55 o    111.5    8.3    0.0000   0.0000          ?        ?   124.5117  18.5171          ?        ?      111.5        8.3       ?       ? 
1 1 1   14    6   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14    6   57 o    659.6    2.9    0.0000   0.0000          ?        ?  4351.5249  37.6728          ?        ?      659.6        2.9       ?       ? 
1 1 1   14    6   58 o    377.7    3.0    0.0000   0.0000          ?        ?  1427.0958  22.9868          ?        ?      377.7        3.0       ?       ? 
1 1 1   14    6   59 o    570.9    2.7    0.0000   0.0000          ?        ?  3259.6528  31.2876          ?        ?      570.9        2.7       ?       ? 
1 1 1   14    6   60 o     65.8   14.9    0.0000   0.0000          ?        ?    45.3350  19.1556          ?        ?       65.8       14.9       ?       ? 
1 1 1   14    6   61 o    443.6    2.8    0.0000   0.0000          ?        ?  1968.5621  24.9023          ?        ?      443.6        2.8       ?       ? 
1 1 1   14    6   62 o    200.3    4.9    0.0000   0.0000          ?        ?   401.6301  19.7942          ?        ?      200.3        4.9       ?       ? 
1 1 1   14    6   63 o    136.6    7.2    0.0000   0.0000          ?        ?   187.0868  19.7942          ?        ?      136.6        7.2       ?       ? 
1 1 1   14    6   64 o    506.2    2.7    0.0000   0.0000          ?        ?  2563.6643  27.4564          ?        ?      506.2        2.7       ?       ? 
1 1 1   14    6   65 o    163.8    6.2    0.0000   0.0000          ?        ?   268.8176  20.4327          ?        ?      163.8        6.2       ?       ? 
1 1 1   14    6   66 o    227.7    4.5    0.0000   0.0000          ?        ?   519.1181  20.4327          ?        ?      227.7        4.5       ?       ? 
1 1 1   14    6   67 o    413.3    3.0    0.0000   0.0000          ?        ?  1709.3225  24.9023          ?        ?      413.3        3.0       ?       ? 
1 1 1   14    6   68 o     88.9   11.8    0.0000   0.0000          ?        ?    79.8152  21.0712          ?        ?       88.9       11.8       ?       ? 
1 1 1   14    6   69 o    241.3    4.4    0.0000   0.0000          ?        ?   582.9703  21.0712          ?        ?      241.3        4.4       ?       ? 
1 1 1   14    6   70 o    375.6    3.2    0.0000   0.0000          ?        ?  1411.7714  24.2638          ?        ?      375.6        3.2       ?       ? 
1 1 1   14    6   71 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14    6   72 o     93.3   11.3    0.0000   0.0000          ?        ?    88.1160  21.0712          ?        ?       93.3       11.3       ?       ? 
1 1 1   14    6   73 o    219.3    4.9    0.0000   0.0000          ?        ?   482.0838  21.7097          ?        ?      219.3        4.9       ?       ? 
1 1 1   14    6   74 o    311.4    3.7    0.0000   0.0000          ?        ?   971.1914  22.9868          ?        ?      311.4        3.7       ?       ? 
1 1 1   14    6   75 o    166.9    6.9    0.0000   0.0000          ?        ?   280.3110  22.9868          ?        ?      166.9        6.9       ?       ? 
1 1 1   14    6   76 o    205.2    5.3    0.0000   0.0000          ?        ?   422.7013  21.7097          ?        ?      205.2        5.3       ?       ? 
1 1 1   14    6   77 o    248.6    4.4    0.0000   0.0000          ?        ?   620.0045  21.7097          ?        ?      248.6        4.4       ?       ? 
1 1 1   14    6   78 o     26.1   12.8    0.0000   0.0000          ?        ?   -38.3113  21.7097          ?        ?       26.1       12.8       ?       ? 
1 1 1   14    6   79 o     40.4   16.2    0.0000   0.0000          ?        ?     9.5778  19.7942          ?        ?       40.4       16.2       ?       ? 
1 1 1   14    7    0 f   1661.2    8.4 27600.7363 280.3110 27600.7363 280.3110 27600.7363 280.3110     1661.2      8.4     1661.2        8.4     0.0     0.0 
1 1 1   14    7    1 o    196.4    1.6    0.0000   0.0000          ?        ?   385.6671   6.3852          ?        ?      196.4        1.6       ?       ? 
1 1 1   14    7    2 o    813.9    3.0    0.0000   0.0000          ?        ?  6624.6621  49.1662          ?        ?      813.9        3.0       ?       ? 
1 1 1   14    7    3 o   1674.5    5.7    0.0000   0.0000          ?        ? 28045.1484 191.5565          ?        ?     1674.5        5.7       ?       ? 
1 1 1   14    7    4 o    721.3    2.6    0.0000   0.0000          ?        ?  5203.3130  37.0343          ?        ?      721.3        2.6       ?       ? 
1 1 1   14    7    5 o   1259.0    4.2    0.0000   0.0000          ?        ? 15851.9385 105.3561          ?        ?     1259.0        4.2       ?       ? 
1 1 1   14    7    6 f    670.8    2.5    0.0000   0.0000          ?        ?  4499.6621  33.2031          ?        ?      670.8        2.5       ?       ? 
1 1 1   14    7    7 o    697.3    2.5    0.0000   0.0000          ?        ?  4862.9805  35.1187          ?        ?      697.3        2.5       ?       ? 
1 1 1   14    7    8 o    408.2    1.9    0.0000   0.0000          ?        ?  1665.9028  15.3245          ?        ?      408.2        1.9       ?       ? 
1 1 1   14    7    9 o   1084.2    3.7    0.0000   0.0000          ?        ? 11756.4600  79.8152          ?        ?     1084.2        3.7       ?       ? 
1 1 1   14    7   10 o   1147.1    4.0    0.0000   0.0000          ?        ? 13158.6543  91.3086          ?        ?     1147.1        4.0       ?       ? 
1 1 1   14    7   11 o    608.4    2.3    0.0000   0.0000          ?        ?  3701.5100  27.4564          ?        ?      608.4        2.3       ?       ? 
1 1 1   14    7   12 o    609.7    2.3    0.0000   0.0000          ?        ?  3717.4729  28.0950          ?        ?      609.7        2.3       ?       ? 
1 1 1   14    7   13 o   1348.1    4.5    0.0000   0.0000          ?        ? 18176.7949 121.3191          ?        ?     1348.1        4.5       ?       ? 
1 1 1   14    7   14 o    651.6    2.4    0.0000   0.0000          ?        ?  4245.5303  31.2876          ?        ?      651.6        2.4       ?       ? 
1 1 1   14    7   15 o    271.1    1.6    0.0000   0.0000          ?        ?   734.9384   8.9393          ?        ?      271.1        1.6       ?       ? 
1 1 1   14    7   16 o   1256.9    4.2    0.0000   0.0000          ?        ? 15798.3018 105.9946          ?        ?     1256.9        4.2       ?       ? 
1 1 1   14    7   17 o    526.6    2.2    0.0000   0.0000          ?        ?  2773.0994  22.9868          ?        ?      526.6        2.2       ?       ? 
1 1 1   14    7   18 f    648.1    2.5    0.0000   0.0000          ?        ?  4200.8340  31.9261          ?        ?      648.1        2.5       ?       ? 
1 1 1   14    7   19 o    866.5    3.2    0.0000   0.0000          ?        ?  7507.7378  54.9129          ?        ?      866.5        3.2       ?       ? 
1 1 1   14    7   20 o   1023.4    3.6    0.0000   0.0000          ?        ? 10473.6709  73.4300          ?        ?     1023.4        3.6       ?       ? 
1 1 1   14    7   21 o    931.3    3.3    0.0000   0.0000          ?        ?  8673.6777  61.2981          ?        ?      931.3        3.3       ?       ? 
1 1 1   14    7   22 o   1807.0    5.9    0.0000   0.0000          ?        ? 32656.5488 213.2662          ?        ?     1807.0        5.9       ?       ? 
1 1 1   14    7   23 o    414.3    2.2    0.0000   0.0000          ?        ?  1716.3461  17.8786          ?        ?      414.3        2.2       ?       ? 
1 1 1   14    7   24 o    829.5    3.3    0.0000   0.0000          ?        ?  6880.7090  54.2743          ?        ?      829.5        3.3       ?       ? 
1 1 1   14    7   25 o    816.7    3.0    0.0000   0.0000          ?        ?  6670.6353  49.8047          ?        ?      816.7        3.0       ?       ? 
1 1 1   14    7   26 o    183.1    2.8    0.0000   0.0000          ?        ?   335.2238  10.2163          ?        ?      183.1        2.8       ?       ? 
1 1 1   14    7   27 o    937.7    3.6    0.0000   0.0000          ?        ?  8793.7197  67.6833          ?        ?      937.7        3.6       ?       ? 
1 1 1   14    7   28 o    215.9    2.8    0.0000   0.0000          ?        ?   466.1208  12.1319          ?        ?      215.9        2.8       ?       ? 
1 1 1   14    7   29 o    161.4    4.4    0.0000   0.0000          ?        ?   260.5168  14.0475          ?        ?      161.4        4.4       ?       ? 
1 1 1   14    7   30 o   1585.7    5.5    0.0000   0.0000          ?        ? 25147.5352 174.3164          ?        ?     1585.7        5.5       ?       ? 
1 1 1   14    7   31 o   1631.4    5.6    0.0000   0.0000          ?        ? 26616.1348 183.2557          ?        ?     1631.4        5.6       ?       ? 
1 1 1   14    7   32 o    217.7    3.4    0.0000   0.0000          ?        ?   473.7830  14.6860          ?        ?      217.7        3.4       ?       ? 
1 1 1   14    7   33 o    633.3    3.0    0.0000   0.0000          ?        ?  4010.5542  37.6728          ?        ?      633.3        3.0       ?       ? 
1 1 1   14    7   34 o    913.1    3.3    0.0000   0.0000          ?        ?  8337.1768  60.6596          ?        ?      913.1        3.3       ?       ? 
1 1 1   14    7   35 o   1136.7    4.0    0.0000   0.0000          ?        ? 12921.1230  90.6701          ?        ?     1136.7        4.0       ?       ? 
1 1 1   14    7   36 o    175.1    4.4    0.0000   0.0000          ?        ?   306.4904  15.3245          ?        ?      175.1        4.4       ?       ? 
1 1 1   14    7   37 o    323.0    2.9    0.0000   0.0000          ?        ?  1043.3442  18.5171          ?        ?      323.0        2.9       ?       ? 
1 1 1   14    7   38 o    854.0    3.2    0.0000   0.0000          ?        ?  7293.1938  54.2743          ?        ?      854.0        3.2       ?       ? 
1 1 1   14    7   39 o    784.5    3.0    0.0000   0.0000          ?        ?  6155.3486  46.6121          ?        ?      784.5        3.0       ?       ? 
1 1 1   14    7   40 o    442.3    2.7    0.0000   0.0000          ?        ?  1956.4302  24.2638          ?        ?      442.3        2.7       ?       ? 
1 1 1   14    7   41 o     19.5    9.8    0.0000   0.0000          ?        ?   -63.2136  18.5171          ?        ?       19.5        9.8       ?       ? 
1 1 1   14    7   42 o   1119.2    3.9    0.0000   0.0000          ?        ? 12526.5176  86.8389          ?        ?     1119.2        3.9       ?       ? 
1 1 1   14    7   43 o    364.8    3.2    0.0000   0.0000          ?        ?  1330.6791  22.9868          ?        ?      364.8        3.2       ?       ? 
1 1 1   14    7   44 o    715.7    2.9    0.0000   0.0000          ?        ?  5122.2207  41.5039          ?        ?      715.7        2.9       ?       ? 
1 1 1   14    7   45 o    768.2    3.0    0.0000   0.0000          ?        ?  5901.2168  46.6121          ?        ?      768.2        3.0       ?       ? 
1 1 1   14    7   46 o    697.4    2.9    0.0000   0.0000          ?        ?  4864.2578  40.2269          ?        ?      697.4        2.9       ?       ? 
1 1 1   14    7   47 o    640.4    2.7    0.0000   0.0000          ?        ?  4101.2241  35.1187          ?        ?      640.4        2.7       ?       ? 
1 1 1   14    7   48 o    539.5    2.7    0.0000   0.0000          ?        ?  2910.3816  29.3720          ?        ?      539.5        2.7       ?       ? 
1 1 1   14    7   49 o    277.7    3.6    0.0000   0.0000          ?        ?   771.3342  19.7942          ?        ?      277.7        3.6       ?       ? 
1 1 1   14    7   50 o    252.1    4.1    0.0000   0.0000          ?        ?   635.9675  20.4327          ?        ?      252.1        4.1       ?       ? 
1 1 1   14    7   51 o    284.2    3.6    0.0000   0.0000          ?        ?   807.7299  20.4327          ?        ?      284.2        3.6       ?       ? 
1 1 1   14    7   52 o    766.5    3.0    0.0000   0.0000          ?        ?  5876.9531  46.6121          ?        ?      766.5        3.0       ?       ? 
1 1 1   14    7   53 o    367.0    2.9    0.0000   0.0000          ?        ?  1347.2806  21.0712          ?        ?      367.0        2.9       ?       ? 
1 1 1   14    7   54 o     37.2   15.4    0.0000   0.0000          ?        ?     3.8311  18.5171          ?        ?       37.2       15.4       ?       ? 
1 1 1   14    7   55 o    934.6    3.5    0.0000   0.0000          ?        ?  8738.1689  65.1292          ?        ?      934.6        3.5       ?       ? 
1 1 1   14    7   56 o    255.6    4.1    0.0000   0.0000          ?        ?   653.8461  21.0712          ?        ?      255.6        4.1       ?       ? 
1 1 1   14    7   57 o    733.6    3.0    0.0000   0.0000          ?        ?  5382.7373  44.0580          ?        ?      733.6        3.0       ?       ? 
1 1 1   14    7   58 o    354.5    3.1    0.0000   0.0000          ?        ?  1257.2490  21.7097          ?        ?      354.5        3.1       ?       ? 
1 1 1   14    7   59 o    329.2    3.1    0.0000   0.0000          ?        ?  1084.2097  20.4327          ?        ?      329.2        3.1       ?       ? 
1 1 1   14    7   60 o    283.6    3.5    0.0000   0.0000          ?        ?   804.5372  19.7942          ?        ?      283.6        3.5       ?       ? 
1 1 1   14    7   61 o    175.7    5.6    0.0000   0.0000          ?        ?   309.0445  19.7942          ?        ?      175.7        5.6       ?       ? 
1 1 1   14    7   62 o     21.9   10.9    0.0000   0.0000          ?        ?   -49.8047  19.1556          ?        ?       21.9       10.9       ?       ? 
1 1 1   14    7   63 o    122.8    8.1    0.0000   0.0000          ?        ?   151.3296  19.7942          ?        ?      122.8        8.1       ?       ? 
1 1 1   14    7   64 o    191.6    5.3    0.0000   0.0000          ?        ?   367.7885  20.4327          ?        ?      191.6        5.3       ?       ? 
1 1 1   14    7   65 o    262.7    3.8    0.0000   0.0000          ?        ?   690.8804  19.7942          ?        ?      262.7        3.8       ?       ? 
1 1 1   14    7   66 o    393.2    3.2    0.0000   0.0000          ?        ?  1547.1379  24.9023          ?        ?      393.2        3.2       ?       ? 
1 1 1   14    7   67 o    196.0    5.5    0.0000   0.0000          ?        ?   385.0285  21.7097          ?        ?      196.0        5.5       ?       ? 
1 1 1   14    7   68 o    441.9    2.9    0.0000   0.0000          ?        ?  1953.8762  25.5409          ?        ?      441.9        2.9       ?       ? 
1 1 1   14    7   69 o    260.5    4.3    0.0000   0.0000          ?        ?   679.3870  22.3483          ?        ?      260.5        4.3       ?       ? 
1 1 1   14    7   70 o    145.1    7.3    0.0000   0.0000          ?        ?   211.3506  21.0712          ?        ?      145.1        7.3       ?       ? 
1 1 1   14    7   71 o    106.8    9.6    0.0000   0.0000          ?        ?   114.9339  20.4327          ?        ?      106.8        9.6       ?       ? 
1 1 1   14    7   72 o    135.7    7.5    0.0000   0.0000          ?        ?   185.1713  20.4327          ?        ?      135.7        7.5       ?       ? 
1 1 1   14    7   73 o     74.8   15.5    0.0000   0.0000          ?        ?    59.3825  22.3483          ?        ?       74.8       15.5       ?       ? 
1 1 1   14    7   74 o    285.5    4.0    0.0000   0.0000          ?        ?   816.6692  22.9868          ?        ?      285.5        4.0       ?       ? 
1 1 1   14    7   75 o     25.1   12.4    0.0000   0.0000          ?        ?   -47.8891  22.3483          ?        ?       25.1       12.4       ?       ? 
1 1 1   14    7   76 o    141.3    7.5    0.0000   0.0000          ?        ?   201.1343  21.0712          ?        ?      141.3        7.5       ?       ? 
1 1 1   14    7   77 o     38.3   15.8    0.0000   0.0000          ?        ?     5.1082  19.7942          ?        ?       38.3       15.8       ?       ? 
1 1 1   14    7   78 o    151.0    6.8    0.0000   0.0000          ?        ?   229.8678  20.4327          ?        ?      151.0        6.8       ?       ? 
1 1 1   14    7   79 o     32.5   14.5    0.0000   0.0000          ?        ?    -6.3852  19.1556          ?        ?       32.5       14.5       ?       ? 
1 1 1   14    8    0 o   1224.4    6.5 14993.1270 158.3534 14993.1270 158.3534 14993.1270 158.3534     1224.4      6.5     1224.4        6.5     0.0     0.0 
1 1 1   14    8    1 o   1391.8    5.1    0.0000   0.0000          ?        ? 19372.7461 142.3903          ?        ?     1391.8        5.1       ?       ? 
1 1 1   14    8    2 f   1088.5    4.0    0.0000   0.0000          ?        ? 11849.6846  86.8389          ?        ?     1088.5        4.0       ?       ? 
1 1 1   14    8    3 o   1357.6    4.7    0.0000   0.0000          ?        ? 18431.5664 128.3428          ?        ?     1357.6        4.7       ?       ? 
1 1 1   14    8    4 o    796.1    2.8    0.0000   0.0000          ?        ?  6337.3271  44.6965          ?        ?      796.1        2.8       ?       ? 
1 1 1   14    8    5 o    594.2    2.3    0.0000   0.0000          ?        ?  3531.0247  27.4564          ?        ?      594.2        2.3       ?       ? 
1 1 1   14    8    6 o    455.8    2.0    0.0000   0.0000          ?        ?  2077.7493  18.5171          ?        ?      455.8        2.0       ?       ? 
1 1 1   14    8    7 o    580.2    2.1    0.0000   0.0000          ?        ?  3366.9246  24.9023          ?        ?      580.2        2.1       ?       ? 
1 1 1   14    8    8 o    215.0    1.5    0.0000   0.0000          ?        ?   462.2897   6.3852          ?        ?      215.0        1.5       ?       ? 
1 1 1   14    8    9 o    990.6    3.5    0.0000   0.0000          ?        ?  9814.0771  68.9603          ?        ?      990.6        3.5       ?       ? 
1 1 1   14    8   10 o   1104.7    3.8    0.0000   0.0000          ?        ? 12205.3408  83.0078          ?        ?     1104.7        3.8       ?       ? 
1 1 1   14    8   11 o    762.1    2.8    0.0000   0.0000          ?        ?  5808.6313  42.1424          ?        ?      762.1        2.8       ?       ? 
1 1 1   14    8   12 o    523.3    2.1    0.0000   0.0000          ?        ?  2738.6191  21.7097          ?        ?      523.3        2.1       ?       ? 
1 1 1   14    8   13 o    427.2    1.9    0.0000   0.0000          ?        ?  1824.8948  15.9630          ?        ?      427.2        1.9       ?       ? 
1 1 1   14    8   14 f    646.3    2.4    0.0000   0.0000          ?        ?  4177.2085  31.2876          ?        ?      646.3        2.4       ?       ? 
1 1 1   14    8   15 f   1200.7    4.1    0.0000   0.0000          ?        ? 14419.0947  97.6938          ?        ?     1200.7        4.1       ?       ? 
1 1 1   14    8   16 o    558.0    2.2    0.0000   0.0000          ?        ?  3113.4314  24.2638          ?        ?      558.0        2.2       ?       ? 
1 1 1   14    8   17 o    306.8    1.8    0.0000   0.0000          ?        ?   941.1808  10.8549          ?        ?      306.8        1.8       ?       ? 
1 1 1   14    8   18 o    349.6    1.9    0.0000   0.0000          ?        ?  1222.1304  13.4090          ?        ?      349.6        1.9       ?       ? 
1 1 1   14    8   19 o    882.7    3.3    0.0000   0.0000          ?        ?  7791.8799  58.1055          ?        ?      882.7        3.3       ?       ? 
1 1 1   14    8   20 o    434.9    2.0    0.0000   0.0000          ?        ?  1891.3011  17.2401          ?        ?      434.9        2.0       ?       ? 
1 1 1   14    8   21 o    722.6    2.7    0.0000   0.0000          ?        ?  5221.8296  39.5883          ?        ?      722.6        2.7       ?       ? 
1 1 1   14    8   22 o    844.9    3.2    0.0000   0.0000          ?        ?  7139.3101  53.6358          ?        ?      844.9        3.2       ?       ? 
1 1 1   14    8   23 o   1983.4    6.7    0.0000   0.0000          ?        ? 39344.4258 267.5406          ?        ?     1983.4        6.7       ?       ? 
1 1 1   14    8   24 o    594.8    2.5    0.0000   0.0000          ?        ?  3538.0481  30.0105          ?        ?      594.8        2.5       ?       ? 
1 1 1   14    8   25 o    542.3    2.5    0.0000   0.0000          ?        ?  2941.0308  26.8179          ?        ?      542.3        2.5       ?       ? 
1 1 1   14    8   26 o    558.5    2.6    0.0000   0.0000          ?        ?  3119.8167  28.7335          ?        ?      558.5        2.6       ?       ? 
1 1 1   14    8   27 o   1252.5    4.4    0.0000   0.0000          ?        ? 15688.4766 109.8257          ?        ?     1252.5        4.4       ?       ? 
1 1 1   14    8   28 o   1846.5    6.6    0.0000   0.0000          ?        ? 34098.3320 243.9153          ?        ?     1846.5        6.6       ?       ? 
1 1 1   14    8   29 o    497.6    2.6    0.0000   0.0000          ?        ?  2476.1868  25.5409          ?        ?      497.6        2.6       ?       ? 
1 1 1   14    8   30 o   1233.2    4.3    0.0000   0.0000          ?        ? 15208.3086 105.3561          ?        ?     1233.2        4.3       ?       ? 
1 1 1   14    8   31 o    504.2    2.5    0.0000   0.0000          ?        ?  2542.5933  25.5409          ?        ?      504.2        2.5       ?       ? 
1 1 1   14    8   32 o   1657.1    5.5    0.0000   0.0000          ?        ? 27462.1758 181.3401          ?        ?     1657.1        5.5       ?       ? 
1 1 1   14    8   33 o    849.1    3.4    0.0000   0.0000          ?        ?  7209.5474  57.4669          ?        ?      849.1        3.4       ?       ? 
1 1 1   14    8   34 o     27.6   12.5    0.0000   0.0000          ?        ?    -8.3008  14.6860          ?        ?       27.6       12.5       ?       ? 
1 1 1   14    8   35 o    467.5    2.5    0.0000   0.0000          ?        ?  2185.6594  22.9868          ?        ?      467.5        2.5       ?       ? 
1 1 1   14    8   36 o    156.0    5.3    0.0000   0.0000          ?        ?   243.2767  16.6016          ?        ?      156.0        5.3       ?       ? 
1 1 1   14    8   37 o    952.6    3.7    0.0000   0.0000          ?        ?  9074.6689  70.8759          ?        ?      952.6        3.7       ?       ? 
1 1 1   14    8   38 o    837.4    3.4    0.0000   0.0000          ?        ?  7012.8833  56.8284          ?        ?      837.4        3.4       ?       ? 
1 1 1   14    8   39 o    724.8    2.9    0.0000   0.0000          ?        ?  5253.1177  42.1424          ?        ?      724.8        2.9       ?       ? 
1 1 1   14    8   40 o    416.2    2.7    0.0000   0.0000          ?        ?  1732.3091  22.3483          ?        ?      416.2        2.7       ?       ? 
1 1 1   14    8   41 o    564.5    2.7    0.0000   0.0000          ?        ?  3186.2229  30.6490          ?        ?      564.5        2.7       ?       ? 
1 1 1   14    8   42 o    464.4    3.0    0.0000   0.0000          ?        ?  2156.9260  27.4564          ?        ?      464.4        3.0       ?       ? 
1 1 1   14    8   43 o    164.9    5.4    0.0000   0.0000          ?        ?   272.0102  17.8786          ?        ?      164.9        5.4       ?       ? 
1 1 1   14    8   44 o    640.5    2.7    0.0000   0.0000          ?        ?  4103.1396  35.1187          ?        ?      640.5        2.7       ?       ? 
1 1 1   14    8   45 o    276.6    3.9    0.0000   0.0000          ?        ?   764.9489  21.7097          ?        ?      276.6        3.9       ?       ? 
1 1 1   14    8   46 o    921.8    3.4    0.0000   0.0000          ?        ?  8498.0850  63.2136          ?        ?      921.8        3.4       ?       ? 
1 1 1   14    8   47 o    412.1    2.8    0.0000   0.0000          ?        ?  1698.4675  22.9868          ?        ?      412.1        2.8       ?       ? 
1 1 1   14    8   48 o    355.1    3.0    0.0000   0.0000          ?        ?  1261.0802  21.0712          ?        ?      355.1        3.0       ?       ? 
1 1 1   14    8   49 o    725.2    2.9    0.0000   0.0000          ?        ?  5260.1411  42.1424          ?        ?      725.2        2.9       ?       ? 
1 1 1   14    8   50 o    333.0    3.6    0.0000   0.0000          ?        ?  1109.1121  24.2638          ?        ?      333.0        3.6       ?       ? 
1 1 1   14    8   51 o    448.2    2.7    0.0000   0.0000          ?        ?  2009.4276  24.2638          ?        ?      448.2        2.7       ?       ? 
1 1 1   14    8   52 o    437.7    2.6    0.0000   0.0000          ?        ?  1916.2035  22.9868          ?        ?      437.7        2.6       ?       ? 
1 1 1   14    8   53 o    233.6    4.1    0.0000   0.0000          ?        ?   545.9360  19.1556          ?        ?      233.6        4.1       ?       ? 
1 1 1   14    8   54 f    715.2    2.9    0.0000   0.0000          ?        ?  5115.8354  40.8654          ?        ?      715.2        2.9       ?       ? 
1 1 1   14    8   55 f     66.3   15.2    0.0000   0.0000          ?        ?    45.9736  19.7942          ?        ?       66.3       15.2       ?       ? 
1 1 1   14    8   56 o    253.5    3.9    0.0000   0.0000          ?        ?   642.9913  19.7942          ?        ?      253.5        3.9       ?       ? 
1 1 1   14    8   57 o    107.1    8.6    0.0000   0.0000          ?        ?   114.9339  18.5171          ?        ?      107.1        8.6       ?       ? 
1 1 1   14    8   58 o    176.8    5.4    0.0000   0.0000          ?        ?   312.8756  19.1556          ?        ?      176.8        5.4       ?       ? 
1 1 1   14    8   59 o    141.5    6.5    0.0000   0.0000          ?        ?   200.4958  18.5171          ?        ?      141.5        6.5       ?       ? 
1 1 1   14    8   60 o    316.9    3.2    0.0000   0.0000          ?        ?  1004.3945  20.4327          ?        ?      316.9        3.2       ?       ? 
1 1 1   14    8   61 o     85.5   10.8    0.0000   0.0000          ?        ?    73.4300  18.5171          ?        ?       85.5       10.8       ?       ? 
1 1 1   14    8   62 o    309.6    3.3    0.0000   0.0000          ?        ?   959.0594  20.4327          ?        ?      309.6        3.3       ?       ? 
1 1 1   14    8   63 o     20.1   10.1    0.0000   0.0000          ?        ?   -62.5751  19.1556          ?        ?       20.1       10.1       ?       ? 
1 1 1   14    8   64 o    293.3    3.5    0.0000   0.0000          ?        ?   860.7272  20.4327          ?        ?      293.3        3.5       ?       ? 
1 1 1   14    8   65 o    223.3    4.6    0.0000   0.0000          ?        ?   499.3239  20.4327          ?        ?      223.3        4.6       ?       ? 
1 1 1   14    8   66 o    400.5    3.0    0.0000   0.0000          ?        ?  1604.6049  24.2638          ?        ?      400.5        3.0       ?       ? 
1 1 1   14    8   67 o    169.9    6.2    0.0000   0.0000          ?        ?   289.2503  21.0712          ?        ?      169.9        6.2       ?       ? 
1 1 1   14    8   68 o    205.6    5.1    0.0000   0.0000          ?        ?   423.3398  21.0712          ?        ?      205.6        5.1       ?       ? 
1 1 1   14    8   69 o    309.2    3.6    0.0000   0.0000          ?        ?   957.1439  22.3483          ?        ?      309.2        3.6       ?       ? 
1 1 1   14    8   70 o    266.2    4.2    0.0000   0.0000          ?        ?   709.3975  22.3483          ?        ?      266.2        4.2       ?       ? 
1 1 1   14    8   71 o    125.4    8.4    0.0000   0.0000          ?        ?   158.3534  21.0712          ?        ?      125.4        8.4       ?       ? 
1 1 1   14    8   72 o    184.9    5.9    0.0000   0.0000          ?        ?   342.8861  21.7097          ?        ?      184.9        5.9       ?       ? 
1 1 1   14    8   73 o    112.5    9.4    0.0000   0.0000          ?        ?   127.7043  21.0712          ?        ?      112.5        9.4       ?       ? 
1 1 1   14    8   74 o    133.5    7.7    0.0000   0.0000          ?        ?   179.4246  20.4327          ?        ?      133.5        7.7       ?       ? 
1 1 1   14    8   75 o    247.8    4.3    0.0000   0.0000          ?        ?   615.5349  21.0712          ?        ?      247.8        4.3       ?       ? 
1 1 1   14    8   76 o    129.0    7.9    0.0000   0.0000          ?        ?   167.9312  20.4327          ?        ?      129.0        7.9       ?       ? 
1 1 1   14    8   77 o     76.0   14.0    0.0000   0.0000          ?        ?    61.2981  20.4327          ?        ?       76.0       14.0       ?       ? 
1 1 1   14    8   78 o     89.1   10.7    0.0000   0.0000          ?        ?    81.0922  19.1556          ?        ?       89.1       10.7       ?       ? 
1 1 1   14    8   79 o    209.1    5.3    0.0000   0.0000          ?        ?   439.9414  22.3483          ?        ?      209.1        5.3       ?       ? 
1 1 1   14    9    0 o    562.6    3.4 3165.7900  38.3113  3165.7900  38.3113  3165.7900  38.3113      562.6      3.4      562.6        3.4     0.0     0.0 
1 1 1   14    9    1 o    431.1    2.0    0.0000   0.0000          ?        ?  1858.7365  17.2401          ?        ?      431.1        2.0       ?       ? 
1 1 1   14    9    2 o   1203.5    4.3    0.0000   0.0000          ?        ? 14485.5020 104.0790          ?        ?     1203.5        4.3       ?       ? 
1 1 1   14    9    3 o    563.4    2.2    0.0000   0.0000          ?        ?  3174.7295  24.9023          ?        ?      563.4        2.2       ?       ? 
1 1 1   14    9    4 o     87.9    2.2    0.0000   0.0000          ?        ?    77.2611   3.8311          ?        ?       87.9        2.2       ?       ? 
1 1 1   14    9    5 o    475.2    1.9    0.0000   0.0000          ?        ?  2258.4512  17.8786          ?        ?      475.2        1.9       ?       ? 
1 1 1   14    9    6 o    759.7    2.8    0.0000   0.0000          ?        ?  5770.9585  42.7809          ?        ?      759.7        2.8       ?       ? 
1 1 1   14    9    7 o    122.8    2.1    0.0000   0.0000          ?        ?   150.6911   5.1082          ?        ?      122.8        2.1       ?       ? 
1 1 1   14    9    8 o    494.8    2.3    0.0000   0.0000          ?        ?  2448.0918  22.9868          ?        ?      494.8        2.3       ?       ? 
1 1 1   14    9    9 o    498.9    2.2    0.0000   0.0000          ?        ?  2488.9573  21.7097          ?        ?      498.9        2.2       ?       ? 
1 1 1   14    9   10 o   1709.9    5.6    0.0000   0.0000          ?        ? 29243.0117 191.5565          ?        ?     1709.9        5.6       ?       ? 
1 1 1   14    9   11 f   1149.2    4.0    0.0000   0.0000          ?        ? 13207.8203  91.3086          ?        ?     1149.2        4.0       ?       ? 
1 1 1   14    9   12 o    876.0    3.1    0.0000   0.0000          ?        ?  7673.7534  53.6358          ?        ?      876.0        3.1       ?       ? 
1 1 1   14    9   13 o    407.8    1.9    0.0000   0.0000          ?        ?  1663.3489  15.3245          ?        ?      407.8        1.9       ?       ? 
1 1 1   14    9   14 o    687.8    2.6    0.0000   0.0000          ?        ?  4731.4453  35.1187          ?        ?      687.8        2.6       ?       ? 
1 1 1   14    9   15 o    970.0    3.4    0.0000   0.0000          ?        ?  9409.2549  65.1292          ?        ?      970.0        3.4       ?       ? 
1 1 1   14    9   16 o   2038.6    6.6    0.0000   0.0000          ?        ? 41567.7578 268.8176          ?        ?     2038.6        6.6       ?       ? 
1 1 1   14    9   17 o   1329.7    4.4    0.0000   0.0000          ?        ? 17682.5801 118.1265          ?        ?     1329.7        4.4       ?       ? 
1 1 1   14    9   18 o   1345.6    4.5    0.0000   0.0000          ?        ? 18107.8340 121.9576          ?        ?     1345.6        4.5       ?       ? 
1 1 1   14    9   19 o    710.6    2.7    0.0000   0.0000          ?        ?  5049.4287  38.9498          ?        ?      710.6        2.7       ?       ? 
1 1 1   14    9   20 o    598.7    2.4    0.0000   0.0000          ?        ?  3584.6606  28.7335          ?        ?      598.7        2.4       ?       ? 
1 1 1   14    9   21 o    435.9    2.2    0.0000   0.0000          ?        ?  1900.2404  19.1556          ?        ?      435.9        2.2       ?       ? 
1 1 1   14    9   22 o   1322.6    4.7    0.0000   0.0000          ?        ? 17494.8535 123.2347          ?        ?     1322.6        4.7       ?       ? 
1 1 1   14    9   23 o    174.7    3.1    0.0000   0.0000          ?        ?   305.2133  10.8549          ?        ?      174.7        3.1       ?       ? 
1 1 1   14    9   24 o   2177.5    7.4    0.0000   0.0000          ?        ? 47421.0859 320.5379          ?        ?     2177.5        7.4       ?       ? 
1 1 1   14    9   25 f    626.7    2.6    0.0000   0.0000          ?        ?  3927.5464  33.2031          ?        ?      626.7        2.6       ?       ? 
1 1 1   14    9   26 o    873.7    3.3    0.0000   0.0000          ?        ?  7634.1646  57.4669          ?        ?      873.7        3.3       ?       ? 
1 1 1   14    9   27 o   1066.7    4.0    0.0000   0.0000          ?        ? 11378.4551  84.2849          ?        ?     1066.7        4.0       ?       ? 
1 1 1   14    9   28 o    411.7    2.3    0.0000   0.0000          ?        ?  1694.6364  19.1556          ?        ?      411.7        2.3       ?       ? 
1 1 1   14    9   29 o    271.6    2.6    0.0000   0.0000          ?        ?   737.4925  14.0475          ?        ?      271.6        2.6       ?       ? 
1 1 1   14    9   30 o    803.1    3.1    0.0000   0.0000          ?        ?  6450.3457  49.1662          ?        ?      803.1        3.1       ?       ? 
1 1 1   14    9   31 o    882.1    3.3    0.0000   0.0000          ?        ?  7781.0244  58.1055          ?        ?      882.1        3.3       ?       ? 
1 1 1   14    9   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14    9   33 o    625.4    3.0    0.0000   0.0000          ?        ?  3910.9451  37.0343          ?        ?      625.4        3.0       ?       ? 
1 1 1   14    9   34 o    699.4    2.8    0.0000   0.0000          ?        ?  4891.7139  38.9498          ?        ?      699.4        2.8       ?       ? 
1 1 1   14    9   35 o    346.0    2.8    0.0000   0.0000          ?        ?  1197.2280  19.1556          ?        ?      346.0        2.8       ?       ? 
1 1 1   14    9   36 o    448.3    2.6    0.0000   0.0000          ?        ?  2010.0660  22.9868          ?        ?      448.3        2.6       ?       ? 
1 1 1   14    9   37 o   1604.6    5.5    0.0000   0.0000          ?        ? 25752.2168 175.5934          ?        ?     1604.6        5.5       ?       ? 
1 1 1   14    9   38 o    768.8    3.2    0.0000   0.0000          ?        ?  5910.7949  48.5276          ?        ?      768.8        3.2       ?       ? 
1 1 1   14    9   39 o    539.6    2.5    0.0000   0.0000          ?        ?  2912.2971  27.4564          ?        ?      539.6        2.5       ?       ? 
1 1 1   14    9   40 o    741.8    3.0    0.0000   0.0000          ?        ?  5502.7793  44.0580          ?        ?      741.8        3.0       ?       ? 
1 1 1   14    9   41 o    379.2    2.7    0.0000   0.0000          ?        ?  1437.9507  20.4327          ?        ?      379.2        2.7       ?       ? 
1 1 1   14    9   42 o    320.7    3.3    0.0000   0.0000          ?        ?  1028.6583  21.0712          ?        ?      320.7        3.3       ?       ? 
1 1 1   14    9   43 o    785.5    3.1    0.0000   0.0000          ?        ?  6170.6733  48.5276          ?        ?      785.5        3.1       ?       ? 
1 1 1   14    9   44 o    492.9    2.9    0.0000   0.0000          ?        ?  2429.5747  28.7335          ?        ?      492.9        2.9       ?       ? 
1 1 1   14    9   45 o    338.8    3.2    0.0000   0.0000          ?        ?  1148.0619  21.7097          ?        ?      338.8        3.2       ?       ? 
1 1 1   14    9   46 o   1264.8    4.4    0.0000   0.0000          ?        ? 16001.3516 111.1028          ?        ?     1264.8        4.4       ?       ? 
1 1 1   14    9   47 o    558.7    2.8    0.0000   0.0000          ?        ?  3121.7322  31.2876          ?        ?      558.7        2.8       ?       ? 
1 1 1   14    9   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14    9   49 o     20.4   10.2    0.0000   0.0000          ?        ?   -51.7203  17.8786          ?        ?       20.4       10.2       ?       ? 
1 1 1   14    9   50 o    786.4    3.1    0.0000   0.0000          ?        ?  6185.3589  48.5276          ?        ?      786.4        3.1       ?       ? 
1 1 1   14    9   51 o    504.7    2.6    0.0000   0.0000          ?        ?  2547.7012  26.1794          ?        ?      504.7        2.6       ?       ? 
1 1 1   14    9   52 f    278.4    3.4    0.0000   0.0000          ?        ?   775.1653  19.1556          ?        ?      278.4        3.4       ?       ? 
1 1 1   14    9   53 o    301.2    3.4    0.0000   0.0000          ?        ?   907.3393  20.4327          ?        ?      301.2        3.4       ?       ? 
1 1 1   14    9   54 o    353.5    3.0    0.0000   0.0000          ?        ?  1250.2253  21.0712          ?        ?      353.5        3.0       ?       ? 
1 1 1   14    9   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14    9   56 o    529.3    2.7    0.0000   0.0000          ?        ?  2802.4714  28.0950          ?        ?      529.3        2.7       ?       ? 
1 1 1   14    9   57 o    385.4    2.9    0.0000   0.0000          ?        ?  1485.8398  22.3483          ?        ?      385.4        2.9       ?       ? 
1 1 1   14    9   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14    9   59 o    313.2    3.3    0.0000   0.0000          ?        ?   981.4077  20.4327          ?        ?      313.2        3.3       ?       ? 
1 1 1   14    9   60 o    321.2    3.3    0.0000   0.0000          ?        ?  1031.8510  21.0712          ?        ?      321.2        3.3       ?       ? 
1 1 1   14    9   61 o     21.4   10.7    0.0000   0.0000          ?        ?   -49.1662  18.5171          ?        ?       21.4       10.7       ?       ? 
1 1 1   14    9   62 o    281.6    3.7    0.0000   0.0000          ?        ?   793.6824  21.0712          ?        ?      281.6        3.7       ?       ? 
1 1 1   14    9   63 o     35.7   15.2    0.0000   0.0000          ?        ?     0.0000  19.1556          ?        ?       35.7       15.2       ?       ? 
1 1 1   14    9   64 o    187.6    5.3    0.0000   0.0000          ?        ?   352.4639  19.7942          ?        ?      187.6        5.3       ?       ? 
1 1 1   14    9   65 o    103.0    9.3    0.0000   0.0000          ?        ?   106.6331  19.1556          ?        ?      103.0        9.3       ?       ? 
1 1 1   14    9   66 o     52.9   16.7    0.0000   0.0000          ?        ?    28.0950  19.7942          ?        ?       52.9       16.7       ?       ? 
1 1 1   14    9   67 o    227.7    4.6    0.0000   0.0000          ?        ?   519.1181  21.0712          ?        ?      227.7        4.6       ?       ? 
1 1 1   14    9   68 o    108.1    9.2    0.0000   0.0000          ?        ?   117.4880  19.7942          ?        ?      108.1        9.2       ?       ? 
1 1 1   14    9   69 o    109.5    9.0    0.0000   0.0000          ?        ?   120.6806  19.7942          ?        ?      109.5        9.0       ?       ? 
1 1 1   14    9   70 o     22.1   11.0    0.0000   0.0000          ?        ?   -60.6596  21.0712          ?        ?       22.1       11.0       ?       ? 
1 1 1   14    9   71 o    383.8    3.2    0.0000   0.0000          ?        ?  1474.3464  24.2638          ?        ?      383.8        3.2       ?       ? 
1 1 1   14    9   72 o     54.7   17.3    0.0000   0.0000          ?        ?    30.6490  21.0712          ?        ?       54.7       17.3       ?       ? 
1 1 1   14    9   73 o     33.6   15.2    0.0000   0.0000          ?        ?   -10.8549  21.7097          ?        ?       33.6       15.2       ?       ? 
1 1 1   14    9   74 o    294.6    4.0    0.0000   0.0000          ?        ?   869.6664  23.6253          ?        ?      294.6        4.0       ?       ? 
1 1 1   14    9   75 o    159.7    6.8    0.0000   0.0000          ?        ?   256.6857  21.7097          ?        ?      159.7        6.8       ?       ? 
1 1 1   14    9   76 o    288.4    4.0    0.0000   0.0000          ?        ?   833.9093  22.9868          ?        ?      288.4        4.0       ?       ? 
1 1 1   14    9   77 o    172.5    6.1    0.0000   0.0000          ?        ?   299.4666  21.0712          ?        ?      172.5        6.1       ?       ? 
1 1 1   14    9   78 o    115.1    9.4    0.0000   0.0000          ?        ?   134.7281  21.7097          ?        ?      115.1        9.4       ?       ? 
1 1 1   14   10    0 o   1346.3    7.0 18130.1816 188.3639 18130.1816 188.3639 18130.1816 188.3639     1346.3      7.0     1346.3        7.0     0.0     0.0 
1 1 1   14   10    1 o    400.5    2.0    0.0000   0.0000          ?        ?  1603.9663  15.9630          ?        ?      400.5        2.0       ?       ? 
1 1 1   14   10    2 o   1220.0    4.4    0.0000   0.0000          ?        ? 14885.8555 107.9102          ?        ?     1220.0        4.4       ?       ? 
1 1 1   14   10    3 o    536.4    2.3    0.0000   0.0000          ?        ?  2877.1785  24.2638          ?        ?      536.4        2.3       ?       ? 
1 1 1   14   10    4 o   1058.0    3.6    0.0000   0.0000          ?        ? 11195.2002  76.6226          ?        ?     1058.0        3.6       ?       ? 
1 1 1   14   10    5 o   1320.4    4.4    0.0000   0.0000          ?        ? 17436.1094 117.4880          ?        ?     1320.4        4.4       ?       ? 
1 1 1   14   10    6 o   1494.9    5.1    0.0000   0.0000          ?        ? 22349.5332 153.8837          ?        ?     1494.9        5.1       ?       ? 
1 1 1   14   10    7 o    354.7    1.7    0.0000   0.0000          ?        ?  1257.8876  12.1319          ?        ?      354.7        1.7       ?       ? 
1 1 1   14   10    8 o    390.2    1.7    0.0000   0.0000          ?        ?  1522.2355  13.4090          ?        ?      390.2        1.7       ?       ? 
1 1 1   14   10    9 o    765.6    2.8    0.0000   0.0000          ?        ?  5861.6284  42.7809          ?        ?      765.6        2.8       ?       ? 
1 1 1   14   10   10 o    961.0    3.3    0.0000   0.0000          ?        ?  9235.5771  63.8522          ?        ?      961.0        3.3       ?       ? 
1 1 1   14   10   11 o    252.6    1.6    0.0000   0.0000          ?        ?   637.8831   8.3008          ?        ?      252.6        1.6       ?       ? 
1 1 1   14   10   12 o   1233.2    4.1    0.0000   0.0000          ?        ? 15209.5850 102.1635          ?        ?     1233.2        4.1       ?       ? 
1 1 1   14   10   13 o    313.8    1.7    0.0000   0.0000          ?        ?   984.6003  10.8549          ?        ?      313.8        1.7       ?       ? 
1 1 1   14   10   14 o    681.5    2.5    0.0000   0.0000          ?        ?  4643.9678  34.4802          ?        ?      681.5        2.5       ?       ? 
1 1 1   14   10   15 o    745.2    2.7    0.0000   0.0000          ?        ?  5553.8608  40.2269          ?        ?      745.2        2.7       ?       ? 
1 1 1   14   10   16 o    597.8    2.4    0.0000   0.0000          ?        ?  3573.8057  28.7335          ?        ?      597.8        2.4       ?       ? 
1 1 1   14   10   17 o   1129.7    3.9    0.0000   0.0000          ?        ? 12762.7705  88.1160          ?        ?     1129.7        3.9       ?       ? 
1 1 1   14   10   18 o    281.5    2.0    0.0000   0.0000          ?        ?   792.4053  11.4934          ?        ?      281.5        2.0       ?       ? 
1 1 1   14   10   19 o   1419.5    4.8    0.0000   0.0000          ?        ? 20151.1035 136.0051          ?        ?     1419.5        4.8       ?       ? 
1 1 1   14   10   20 o    951.3    3.4    0.0000   0.0000          ?        ?  9050.4053  65.1292          ?        ?      951.3        3.4       ?       ? 
1 1 1   14   10   21 o   2399.0    8.3    0.0000   0.0000          ?        ? 57564.6406 395.8834          ?        ?     2399.0        8.3       ?       ? 
1 1 1   14   10   22 o    417.4    2.1    0.0000   0.0000          ?        ?  1742.5255  17.2401          ?        ?      417.4        2.1       ?       ? 
1 1 1   14   10   23 o   2103.7    7.0    0.0000   0.0000          ?        ? 44262.3203 292.4429          ?        ?     2103.7        7.0       ?       ? 
1 1 1   14   10   24 o   1034.8    3.9    0.0000   0.0000          ?        ? 10708.0078  79.8152          ?        ?     1034.8        3.9       ?       ? 
1 1 1   14   10   25 o    665.8    2.8    0.0000   0.0000          ?        ?  4433.2554  37.6728          ?        ?      665.8        2.8       ?       ? 
1 1 1   14   10   26 o   1766.4    6.1    0.0000   0.0000          ?        ? 31204.5527 213.9047          ?        ?     1766.4        6.1       ?       ? 
1 1 1   14   10   27 o    295.2    2.7    0.0000   0.0000          ?        ?   871.5820  15.9630          ?        ?      295.2        2.7       ?       ? 
1 1 1   14   10   28 f    355.1    2.6    0.0000   0.0000          ?        ?  1261.0802  18.5171          ?        ?      355.1        2.6       ?       ? 
1 1 1   14   10   29 o   2135.2    7.1    0.0000   0.0000          ?        ? 45600.6602 301.3822          ?        ?     2135.2        7.1       ?       ? 
1 1 1   14   10   30 o    951.2    3.4    0.0000   0.0000          ?        ?  9048.4902  63.8522          ?        ?      951.2        3.4       ?       ? 
1 1 1   14   10   31 o   1054.1    3.8    0.0000   0.0000          ?        ? 11112.1924  80.4537          ?        ?     1054.1        3.8       ?       ? 
1 1 1   14   10   32 o    550.8    2.5    0.0000   0.0000          ?        ?  3033.6162  27.4564          ?        ?      550.8        2.5       ?       ? 
1 1 1   14   10   33 o    679.2    3.1    0.0000   0.0000          ?        ?  4613.9570  42.1424          ?        ?      679.2        3.1       ?       ? 
1 1 1   14   10   34 o   1148.2    4.0    0.0000   0.0000          ?        ? 13184.8320  91.9471          ?        ?     1148.2        4.0       ?       ? 
1 1 1   14   10   35 o    406.5    2.7    0.0000   0.0000          ?        ?  1652.4939  21.7097          ?        ?      406.5        2.7       ?       ? 
1 1 1   14   10   36 f    628.6    2.9    0.0000   0.0000          ?        ?  3951.8105  37.0343          ?        ?      628.6        2.9       ?       ? 
1 1 1   14   10   37 o    206.7    4.5    0.0000   0.0000          ?        ?   427.1710  18.5171          ?        ?      206.7        4.5       ?       ? 
1 1 1   14   10   38 o   1011.2    3.8    0.0000   0.0000          ?        ? 10225.2852  76.6226          ?        ?     1011.2        3.8       ?       ? 
1 1 1   14   10   39 o    240.8    3.7    0.0000   0.0000          ?        ?   579.7776  17.8786          ?        ?      240.8        3.7       ?       ? 
1 1 1   14   10   40 o    245.4    3.6    0.0000   0.0000          ?        ?   602.1259  17.8786          ?        ?      245.4        3.6       ?       ? 
1 1 1   14   10   41 o    179.4    4.6    0.0000   0.0000          ?        ?   321.8149  16.6016          ?        ?      179.4        4.6       ?       ? 
1 1 1   14   10   42 o    623.5    2.8    0.0000   0.0000          ?        ?  3887.3196  34.4802          ?        ?      623.5        2.8       ?       ? 
1 1 1   14   10   43 o    347.5    3.0    0.0000   0.0000          ?        ?  1207.4445  21.0712          ?        ?      347.5        3.0       ?       ? 
1 1 1   14   10   44 o    101.0    9.2    0.0000   0.0000          ?        ?   102.1635  18.5171          ?        ?      101.0        9.2       ?       ? 
1 1 1   14   10   45 o    322.9    3.1    0.0000   0.0000          ?        ?  1042.7058  19.7942          ?        ?      322.9        3.1       ?       ? 
1 1 1   14   10   46 f    759.9    3.0    0.0000   0.0000          ?        ?  5774.7896  45.9736          ?        ?      759.9        3.0       ?       ? 
1 1 1   14   10   47 o    290.1    3.3    0.0000   0.0000          ?        ?   841.5715  19.1556          ?        ?      290.1        3.3       ?       ? 
1 1 1   14   10   48 o     27.2   13.0    0.0000   0.0000          ?        ?   -26.8179  19.7942          ?        ?       27.2       13.0       ?       ? 
1 1 1   14   10   49 o    522.2    2.7    0.0000   0.0000          ?        ?  2727.1260  28.0950          ?        ?      522.2        2.7       ?       ? 
1 1 1   14   10   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14   10   51 o    342.3    3.0    0.0000   0.0000          ?        ?  1171.6871  20.4327          ?        ?      342.3        3.0       ?       ? 
1 1 1   14   10   52 o    340.9    3.1    0.0000   0.0000          ?        ?  1162.1094  21.0712          ?        ?      340.9        3.1       ?       ? 
1 1 1   14   10   53 o    188.9    4.7    0.0000   0.0000          ?        ?   356.9336  17.8786          ?        ?      188.9        4.7       ?       ? 
1 1 1   14   10   54 o    425.3    2.7    0.0000   0.0000          ?        ?  1809.5702  22.9868          ?        ?      425.3        2.7       ?       ? 
1 1 1   14   10   55 o    150.3    5.9    0.0000   0.0000          ?        ?   226.0367  17.8786          ?        ?      150.3        5.9       ?       ? 
1 1 1   14   10   56 o    117.6    7.9    0.0000   0.0000          ?        ?   138.5592  18.5171          ?        ?      117.6        7.9       ?       ? 
1 1 1   14   10   57 o     38.7   15.4    0.0000   0.0000          ?        ?     7.6623  17.8786          ?        ?       38.7       15.4       ?       ? 
1 1 1   14   10   58 o    146.1    6.6    0.0000   0.0000          ?        ?   213.9047  19.1556          ?        ?      146.1        6.6       ?       ? 
1 1 1   14   10   59 o    299.2    3.3    0.0000   0.0000          ?        ?   895.8459  19.7942          ?        ?      299.2        3.3       ?       ? 
1 1 1   14   10   60 o    168.6    5.7    0.0000   0.0000          ?        ?   284.7806  19.1556          ?        ?      168.6        5.7       ?       ? 
1 1 1   14   10   61 o    215.1    4.3    0.0000   0.0000          ?        ?   462.9282  18.5171          ?        ?      215.1        4.3       ?       ? 
1 1 1   14   10   62 o    383.8    3.1    0.0000   0.0000          ?        ?  1473.7079  23.6253          ?        ?      383.8        3.1       ?       ? 
1 1 1   14   10   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14   10   64 o    250.0    4.1    0.0000   0.0000          ?        ?   625.7512  20.4327          ?        ?      250.0        4.1       ?       ? 
1 1 1   14   10   65 o     21.2   10.7    0.0000   0.0000          ?        ?   -62.5751  20.4327          ?        ?       21.2       10.7       ?       ? 
1 1 1   14   10   66 o    316.7    3.3    0.0000   0.0000          ?        ?  1003.7560  21.0712          ?        ?      316.7        3.3       ?       ? 
1 1 1   14   10   67 o    189.1    5.7    0.0000   0.0000          ?        ?   358.2106  21.7097          ?        ?      189.1        5.7       ?       ? 
1 1 1   14   10   68 o    158.6    6.6    0.0000   0.0000          ?        ?   252.2160  21.0712          ?        ?      158.6        6.6       ?       ? 
1 1 1   14   10   69 o    320.1    3.4    0.0000   0.0000          ?        ?  1025.4658  21.7097          ?        ?      320.1        3.4       ?       ? 
1 1 1   14   10   70 o     41.1   16.7    0.0000   0.0000          ?        ?     7.0237  21.7097          ?        ?       41.1       16.7       ?       ? 
1 1 1   14   10   71 o     37.5   16.1    0.0000   0.0000          ?        ?    -0.6385  21.7097          ?        ?       37.5       16.1       ?       ? 
1 1 1   14   10   72 o    133.8    7.9    0.0000   0.0000          ?        ?   180.0631  21.0712          ?        ?      133.8        7.9       ?       ? 
1 1 1   14   10   73 f    104.8   10.4    0.0000   0.0000          ?        ?   111.1028  21.7097          ?        ?      104.8       10.4       ?       ? 
1 1 1   14   10   74 o    177.3    6.5    0.0000   0.0000          ?        ?   316.0682  22.9868          ?        ?      177.3        6.5       ?       ? 
1 1 1   14   10   75 o    138.5    7.8    0.0000   0.0000          ?        ?   193.4720  21.7097          ?        ?      138.5        7.8       ?       ? 
1 1 1   14   10   76 o    140.0    8.0    0.0000   0.0000          ?        ?   197.9417  22.3483          ?        ?      140.0        8.0       ?       ? 
1 1 1   14   10   77 o    146.7    7.0    0.0000   0.0000          ?        ?   217.0974  20.4327          ?        ?      146.7        7.0       ?       ? 
1 1 1   14   10   78 o     50.0   16.5    0.0000   0.0000          ?        ?    25.5409  19.1556          ?        ?       50.0       16.5       ?       ? 
1 1 1   14   11    0 o   2375.1   13.4 56442.7539 634.6905 56442.7539 634.6905 56442.7539 634.6905     2375.1     13.4     2375.1       13.4     0.0     0.0 
1 1 1   14   11    1 o   1261.3    5.0    0.0000   0.0000          ?        ? 15911.3193 125.1502          ?        ?     1261.3        5.0       ?       ? 
1 1 1   14   11    2 o   1004.7    3.8    0.0000   0.0000          ?        ? 10095.0273  76.6226          ?        ?     1004.7        3.8       ?       ? 
1 1 1   14   11    3 o    437.1    2.0    0.0000   0.0000          ?        ?  1910.4568  17.2401          ?        ?      437.1        2.0       ?       ? 
1 1 1   14   11    4 o    207.8    1.5    0.0000   0.0000          ?        ?   431.6406   6.3852          ?        ?      207.8        1.5       ?       ? 
1 1 1   14   11    5 o    734.7    2.7    0.0000   0.0000          ?        ?  5398.7002  39.5883          ?        ?      734.7        2.7       ?       ? 
1 1 1   14   11    6 o   1109.4    3.8    0.0000   0.0000          ?        ? 12308.7812  83.6463          ?        ?     1109.4        3.8       ?       ? 
1 1 1   14   11    7 o    839.5    3.0    0.0000   0.0000          ?        ?  7048.6406  49.8047          ?        ?      839.5        3.0       ?       ? 
1 1 1   14   11    8 f   1178.0    4.1    0.0000   0.0000          ?        ? 13877.6279  96.4168          ?        ?     1178.0        4.1       ?       ? 
1 1 1   14   11    9 o    317.6    1.7    0.0000   0.0000          ?        ?  1008.8642  10.8549          ?        ?      317.6        1.7       ?       ? 
1 1 1   14   11   10 o   1021.9    3.5    0.0000   0.0000          ?        ? 10442.3828  71.5144          ?        ?     1021.9        3.5       ?       ? 
1 1 1   14   11   11 o   1123.5    3.8    0.0000   0.0000          ?        ? 12623.5723  84.9234          ?        ?     1123.5        3.8       ?       ? 
1 1 1   14   11   12 o    449.8    1.9    0.0000   0.0000          ?        ?  2023.4750  17.2401          ?        ?      449.8        1.9       ?       ? 
1 1 1   14   11   13 o   1417.2    4.7    0.0000   0.0000          ?        ? 20087.2520 132.8125          ?        ?     1417.2        4.7       ?       ? 
1 1 1   14   11   14 o    845.3    3.0    0.0000   0.0000          ?        ?  7145.6953  51.0817          ?        ?      845.3        3.0       ?       ? 
1 1 1   14   11   15 o    278.3    1.8    0.0000   0.0000          ?        ?   774.5267  10.2163          ?        ?      278.3        1.8       ?       ? 
1 1 1   14   11   16 o    548.7    2.2    0.0000   0.0000          ?        ?  3010.6294  24.2638          ?        ?      548.7        2.2       ?       ? 
1 1 1   14   11   17 o    902.9    3.2    0.0000   0.0000          ?        ?  8152.0054  58.1055          ?        ?      902.9        3.2       ?       ? 
1 1 1   14   11   18 o   2309.5    7.5    0.0000   0.0000          ?        ? 53347.8477 344.8017          ?        ?     2309.5        7.5       ?       ? 
1 1 1   14   11   19 o   1075.6    3.8    0.0000   0.0000          ?        ? 11568.7354  81.7308          ?        ?     1075.6        3.8       ?       ? 
1 1 1   14   11   20 o    984.9    3.6    0.0000   0.0000          ?        ?  9700.4199  71.5144          ?        ?      984.9        3.6       ?       ? 
1 1 1   14   11   21 o   1039.6    3.9    0.0000   0.0000          ?        ? 10808.2549  81.7308          ?        ?     1039.6        3.9       ?       ? 
1 1 1   14   11   22 o   1309.0    4.7    0.0000   0.0000          ?        ? 17135.3672 121.9576          ?        ?     1309.0        4.7       ?       ? 
1 1 1   14   11   23 o   1410.8    5.1    0.0000   0.0000          ?        ? 19903.9961 143.0288          ?        ?     1410.8        5.1       ?       ? 
1 1 1   14   11   24 o   1534.1    5.3    0.0000   0.0000          ?        ? 23537.8223 163.4615          ?        ?     1534.1        5.3       ?       ? 
1 1 1   14   11   25 o   1135.3    4.2    0.0000   0.0000          ?        ? 12890.4746  95.1397          ?        ?     1135.3        4.2       ?       ? 
1 1 1   14   11   26 o   1258.1    4.4    0.0000   0.0000          ?        ? 15829.5898 109.8257          ?        ?     1258.1        4.4       ?       ? 
1 1 1   14   11   27 o    623.0    2.7    0.0000   0.0000          ?        ?  3881.5732  33.8416          ?        ?      623.0        2.7       ?       ? 
1 1 1   14   11   28 o    830.3    3.1    0.0000   0.0000          ?        ?  6894.7568  51.7203          ?        ?      830.3        3.1       ?       ? 
1 1 1   14   11   29 o    786.6    3.0    0.0000   0.0000          ?        ?  6187.2744  47.2506          ?        ?      786.6        3.0       ?       ? 
1 1 1   14   11   30 o    765.6    3.1    0.0000   0.0000          ?        ?  5861.6284  47.2506          ?        ?      765.6        3.1       ?       ? 
1 1 1   14   11   31 o    837.8    3.2    0.0000   0.0000          ?        ?  7018.6294  53.6358          ?        ?      837.8        3.2       ?       ? 
1 1 1   14   11   32 o    359.4    2.5    0.0000   0.0000          ?        ?  1291.7292  17.8786          ?        ?      359.4        2.5       ?       ? 
1 1 1   14   11   33 o    544.3    2.8    0.0000   0.0000          ?        ?  2962.7402  30.0105          ?        ?      544.3        2.8       ?       ? 
1 1 1   14   11   34 o    973.4    3.6    0.0000   0.0000          ?        ?  9475.0225  69.5989          ?        ?      973.4        3.6       ?       ? 
1 1 1   14   11   35 o    475.8    2.6    0.0000   0.0000          ?        ?  2264.1978  24.9023          ?        ?      475.8        2.6       ?       ? 
1 1 1   14   11   36 o    796.1    3.3    0.0000   0.0000          ?        ?  6337.3271  52.9973          ?        ?      796.1        3.3       ?       ? 
1 1 1   14   11   37 o   1306.0    4.7    0.0000   0.0000          ?        ? 17058.7441 122.5962          ?        ?     1306.0        4.7       ?       ? 
1 1 1   14   11   38 o   1089.2    3.9    0.0000   0.0000          ?        ? 11865.6475  84.9234          ?        ?     1089.2        3.9       ?       ? 
1 1 1   14   11   39 o   1288.5    4.4    0.0000   0.0000          ?        ? 16603.4785 113.0183          ?        ?     1288.5        4.4       ?       ? 
1 1 1   14   11   40 o    946.8    3.5    0.0000   0.0000          ?        ?  8964.2051  66.4062          ?        ?      946.8        3.5       ?       ? 
1 1 1   14   11   41 o    144.0    6.2    0.0000   0.0000          ?        ?   207.5195  17.8786          ?        ?      144.0        6.2       ?       ? 
1 1 1   14   11   42 o    186.7    4.8    0.0000   0.0000          ?        ?   348.6328  17.8786          ?        ?      186.7        4.8       ?       ? 
1 1 1   14   11   43 o    706.5    2.9    0.0000   0.0000          ?        ?  4991.3237  40.8654          ?        ?      706.5        2.9       ?       ? 
1 1 1   14   11   44 o   1000.2    3.6    0.0000   0.0000          ?        ? 10004.9951  72.1529          ?        ?     1000.2        3.6       ?       ? 
1 1 1   14   11   45 o    367.8    3.0    0.0000   0.0000          ?        ?  1353.0273  21.7097          ?        ?      367.8        3.0       ?       ? 
1 1 1   14   11   46 o    612.9    2.9    0.0000   0.0000          ?        ?  3756.4226  35.1187          ?        ?      612.9        2.9       ?       ? 
1 1 1   14   11   47 o    283.6    3.3    0.0000   0.0000          ?        ?   804.5372  18.5171          ?        ?      283.6        3.3       ?       ? 
1 1 1   14   11   48 o    275.9    3.5    0.0000   0.0000          ?        ?   761.1177  19.1556          ?        ?      275.9        3.5       ?       ? 
1 1 1   14   11   49 o    167.6    5.5    0.0000   0.0000          ?        ?   280.9495  18.5171          ?        ?      167.6        5.5       ?       ? 
1 1 1   14   11   50 o    725.3    2.9    0.0000   0.0000          ?        ?  5262.0566  42.1424          ?        ?      725.3        2.9       ?       ? 
1 1 1   14   11   51 o    319.9    3.2    0.0000   0.0000          ?        ?  1023.5502  20.4327          ?        ?      319.9        3.2       ?       ? 
1 1 1   14   11   52 o    299.7    3.4    0.0000   0.0000          ?        ?   898.3999  20.4327          ?        ?      299.7        3.4       ?       ? 
1 1 1   14   11   53 o    371.4    3.1    0.0000   0.0000          ?        ?  1379.8452  22.9868          ?        ?      371.4        3.1       ?       ? 
1 1 1   14   11   54 o    193.5    4.8    0.0000   0.0000          ?        ?   374.8122  18.5171          ?        ?      193.5        4.8       ?       ? 
1 1 1   14   11   55 o    770.2    3.1    0.0000   0.0000          ?        ?  5933.7812  47.2506          ?        ?      770.2        3.1       ?       ? 
1 1 1   14   11   56 f    187.3    5.5    0.0000   0.0000          ?        ?   351.1869  20.4327          ?        ?      187.3        5.5       ?       ? 
1 1 1   14   11   57 o    575.5    2.7    0.0000   0.0000          ?        ?  3312.6501  31.2876          ?        ?      575.5        2.7       ?       ? 
1 1 1   14   11   58 f    410.2    2.9    0.0000   0.0000          ?        ?  1683.1431  23.6253          ?        ?      410.2        2.9       ?       ? 
1 1 1   14   11   59 o    394.2    3.0    0.0000   0.0000          ?        ?  1554.8002  23.6253          ?        ?      394.2        3.0       ?       ? 
1 1 1   14   11   60 o    203.1    4.9    0.0000   0.0000          ?        ?   413.1235  19.7942          ?        ?      203.1        4.9       ?       ? 
1 1 1   14   11   61 o     82.0   11.3    0.0000   0.0000          ?        ?    67.6833  18.5171          ?        ?       82.0       11.3       ?       ? 
1 1 1   14   11   62 o     82.7   12.0    0.0000   0.0000          ?        ?    68.9603  19.7942          ?        ?       82.7       12.0       ?       ? 
1 1 1   14   11   63 o     40.3   16.0    0.0000   0.0000          ?        ?     8.9393  19.1556          ?        ?       40.3       16.0       ?       ? 
1 1 1   14   11   64 o    256.3    4.1    0.0000   0.0000          ?        ?   657.6772  21.0712          ?        ?      256.3        4.1       ?       ? 
1 1 1   14   11   65 o    267.1    3.9    0.0000   0.0000          ?        ?   713.8672  21.0712          ?        ?      267.1        3.9       ?       ? 
1 1 1   14   11   66 o    277.7    3.9    0.0000   0.0000          ?        ?   771.9727  21.7097          ?        ?      277.7        3.9       ?       ? 
1 1 1   14   11   67 o     90.3   11.3    0.0000   0.0000          ?        ?    82.3693  20.4327          ?        ?       90.3       11.3       ?       ? 
1 1 1   14   11   68 o    253.6    4.3    0.0000   0.0000          ?        ?   644.2683  21.7097          ?        ?      253.6        4.3       ?       ? 
1 1 1   14   11   69 o    243.0    4.2    0.0000   0.0000          ?        ?   591.2710  20.4327          ?        ?      243.0        4.2       ?       ? 
1 1 1   14   11   70 o    148.3    7.3    0.0000   0.0000          ?        ?   220.9285  21.7097          ?        ?      148.3        7.3       ?       ? 
1 1 1   14   11   71 o    193.2    5.5    0.0000   0.0000          ?        ?   374.1737  21.0712          ?        ?      193.2        5.5       ?       ? 
1 1 1   14   11   72 o     25.3   12.4    0.0000   0.0000          ?        ?   -37.0343  20.4327          ?        ?       25.3       12.4       ?       ? 
1 1 1   14   11   73 o    115.7    9.7    0.0000   0.0000          ?        ?   135.3666  22.3483          ?        ?      115.7        9.7       ?       ? 
1 1 1   14   11   74 o    376.8    3.2    0.0000   0.0000          ?        ?  1421.3491  24.2638          ?        ?      376.8        3.2       ?       ? 
1 1 1   14   11   75 o    122.9    8.6    0.0000   0.0000          ?        ?   152.6067  21.0712          ?        ?      122.9        8.6       ?       ? 
1 1 1   14   11   76 o     93.4   10.6    0.0000   0.0000          ?        ?    88.7545  19.7942          ?        ?       93.4       10.6       ?       ? 
1 1 1   14   11   77 o     29.9   14.1    0.0000   0.0000          ?        ?   -24.2638  22.3483          ?        ?       29.9       14.1       ?       ? 
1 1 1   14   11   78 o    186.7    5.3    0.0000   0.0000          ?        ?   350.5484  19.7942          ?        ?      186.7        5.3       ?       ? 
1 1 1   14   12    0 o    634.8    4.4 4030.3486  55.5514  4030.3486  55.5514  4030.3486  55.5514      634.8      4.4      634.8        4.4     0.0     0.0 
1 1 1   14   12    1 o    871.1    3.6    0.0000   0.0000          ?        ?  7588.1914  62.5751          ?        ?      871.1        3.6       ?       ? 
1 1 1   14   12    2 o    813.6    3.3    0.0000   0.0000          ?        ?  6619.5532  53.6358          ?        ?      813.6        3.3       ?       ? 
1 1 1   14   12    3 o   1046.4    3.9    0.0000   0.0000          ?        ? 10950.6455  82.3693          ?        ?     1046.4        3.9       ?       ? 
1 1 1   14   12    4 o    595.5    2.3    0.0000   0.0000          ?        ?  3545.7104  27.4564          ?        ?      595.5        2.3       ?       ? 
1 1 1   14   12    5 o    629.7    2.4    0.0000   0.0000          ?        ?  3965.2192  30.0105          ?        ?      629.7        2.4       ?       ? 
1 1 1   14   12    6 o    175.6    1.6    0.0000   0.0000          ?        ?   308.4059   5.7467          ?        ?      175.6        1.6       ?       ? 
1 1 1   14   12    7 o    530.0    2.0    0.0000   0.0000          ?        ?  2809.4951  21.7097          ?        ?      530.0        2.0       ?       ? 
1 1 1   14   12    8 o    643.4    2.4    0.0000   0.0000          ?        ?  4139.5356  31.2876          ?        ?      643.4        2.4       ?       ? 
1 1 1   14   12    9 f    566.3    2.2    0.0000   0.0000          ?        ?  3207.2939  24.9023          ?        ?      566.3        2.2       ?       ? 
1 1 1   14   12   10 f    802.8    2.9    0.0000   0.0000          ?        ?  6445.8760  45.9736          ?        ?      802.8        2.9       ?       ? 
1 1 1   14   12   11 o    582.4    2.3    0.0000   0.0000          ?        ?  3391.8269  26.8179          ?        ?      582.4        2.3       ?       ? 
1 1 1   14   12   12 o   1932.8    6.4    0.0000   0.0000          ?        ? 37361.8164 247.7464          ?        ?     1932.8        6.4       ?       ? 
1 1 1   14   12   13 o    676.1    2.5    0.0000   0.0000          ?        ?  4571.1763  34.4802          ?        ?      676.1        2.5       ?       ? 
1 1 1   14   12   14 f    574.9    2.3    0.0000   0.0000          ?        ?  3305.6265  26.8179          ?        ?      574.9        2.3       ?       ? 
1 1 1   14   12   15 o   1245.0    4.2    0.0000   0.0000          ?        ? 15500.1123 105.3561          ?        ?     1245.0        4.2       ?       ? 
1 1 1   14   12   16 o   1145.9    3.9    0.0000   0.0000          ?        ? 13131.8359  90.0316          ?        ?     1145.9        3.9       ?       ? 
1 1 1   14   12   17 o   1165.2    4.0    0.0000   0.0000          ?        ? 13578.1621  92.5856          ?        ?     1165.2        4.0       ?       ? 
1 1 1   14   12   18 o    542.4    2.7    0.0000   0.0000          ?        ?  2941.6692  29.3720          ?        ?      542.4        2.7       ?       ? 
1 1 1   14   12   19 o   1220.4    4.4    0.0000   0.0000          ?        ? 14894.7939 106.6331          ?        ?     1220.4        4.4       ?       ? 
1 1 1   14   12   20 o    901.6    3.4    0.0000   0.0000          ?        ?  8129.0186  61.2981          ?        ?      901.6        3.4       ?       ? 
1 1 1   14   12   21 o   2248.0    8.0    0.0000   0.0000          ?        ? 50546.0117 357.5721          ?        ?     2248.0        8.0       ?       ? 
1 1 1   14   12   22 o   1167.0    4.2    0.0000   0.0000          ?        ? 13619.0273  97.0553          ?        ?     1167.0        4.2       ?       ? 
1 1 1   14   12   23 f   1501.6    5.3    0.0000   0.0000          ?        ? 22548.7520 157.7148          ?        ?     1501.6        5.3       ?       ? 
1 1 1   14   12   24 o    672.2    2.7    0.0000   0.0000          ?        ?  4518.8179  35.7572          ?        ?      672.2        2.7       ?       ? 
1 1 1   14   12   25 o   1233.7    4.4    0.0000   0.0000          ?        ? 15220.4395 109.1872          ?        ?     1233.7        4.4       ?       ? 
1 1 1   14   12   26 o   1527.5    5.4    0.0000   0.0000          ?        ? 23334.1328 166.0156          ?        ?     1527.5        5.4       ?       ? 
1 1 1   14   12   27 f   1177.5    4.2    0.0000   0.0000          ?        ? 13864.8584  98.9709          ?        ?     1177.5        4.2       ?       ? 
1 1 1   14   12   28 o    918.7    3.3    0.0000   0.0000          ?        ?  8439.9795  60.6596          ?        ?      918.7        3.3       ?       ? 
1 1 1   14   12   29 o    695.6    2.9    0.0000   0.0000          ?        ?  4838.0786  40.2269          ?        ?      695.6        2.9       ?       ? 
1 1 1   14   12   30 o    534.1    2.5    0.0000   0.0000          ?        ?  2852.2761  26.8179          ?        ?      534.1        2.5       ?       ? 
1 1 1   14   12   31 o   1160.9    4.2    0.0000   0.0000          ?        ? 13478.5527  96.4168          ?        ?     1160.9        4.2       ?       ? 
1 1 1   14   12   32 o    866.2    3.2    0.0000   0.0000          ?        ?  7503.9058  54.9129          ?        ?      866.2        3.2       ?       ? 
1 1 1   14   12   33 o    487.5    2.8    0.0000   0.0000          ?        ?  2376.5776  26.8179          ?        ?      487.5        2.8       ?       ? 
1 1 1   14   12   34 o   1327.9    4.9    0.0000   0.0000          ?        ? 17635.9668 129.6199          ?        ?     1327.9        4.9       ?       ? 
1 1 1   14   12   35 o    739.7    2.9    0.0000   0.0000          ?        ?  5472.1304  43.4195          ?        ?      739.7        2.9       ?       ? 
1 1 1   14   12   36 o    228.8    3.8    0.0000   0.0000          ?        ?   523.5877  17.2401          ?        ?      228.8        3.8       ?       ? 
1 1 1   14   12   37 o     23.5   11.7    0.0000   0.0000          ?        ?   -55.5514  21.7097          ?        ?       23.5       11.7       ?       ? 
1 1 1   14   12   38 o    891.7    3.4    0.0000   0.0000          ?        ?  7951.5103  60.0210          ?        ?      891.7        3.4       ?       ? 
1 1 1   14   12   39 o    788.1    3.1    0.0000   0.0000          ?        ?  6212.1772  49.1662          ?        ?      788.1        3.1       ?       ? 
1 1 1   14   12   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14   12   41 o     31.6   13.7    0.0000   0.0000          ?        ?    -2.5541  15.9630          ?        ?       31.6       13.7       ?       ? 
1 1 1   14   12   42 o    229.8    4.0    0.0000   0.0000          ?        ?   528.0574  18.5171          ?        ?      229.8        4.0       ?       ? 
1 1 1   14   12   43 o    248.6    3.6    0.0000   0.0000          ?        ?   618.0889  17.8786          ?        ?      248.6        3.6       ?       ? 
1 1 1   14   12   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14   12   45 o   1074.7    4.1    0.0000   0.0000          ?        ? 11552.7725  88.7545          ?        ?     1074.7        4.1       ?       ? 
1 1 1   14   12   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14   12   47 o    603.9    2.9    0.0000   0.0000          ?        ?  3647.8740  35.1187          ?        ?      603.9        2.9       ?       ? 
1 1 1   14   12   48 o    527.5    2.8    0.0000   0.0000          ?        ?  2782.6772  29.3720          ?        ?      527.5        2.8       ?       ? 
1 1 1   14   12   49 o    308.8    3.3    0.0000   0.0000          ?        ?   953.9513  20.4327          ?        ?      308.8        3.3       ?       ? 
1 1 1   14   12   50 o    695.2    3.0    0.0000   0.0000          ?        ?  4834.2471  42.1424          ?        ?      695.2        3.0       ?       ? 
1 1 1   14   12   51 o    557.3    2.7    0.0000   0.0000          ?        ?  3106.4077  30.6490          ?        ?      557.3        2.7       ?       ? 
1 1 1   14   12   52 o    182.2    5.1    0.0000   0.0000          ?        ?   332.0312  18.5171          ?        ?      182.2        5.1       ?       ? 
1 1 1   14   12   53 o     95.8    9.3    0.0000   0.0000          ?        ?    91.9471  17.8786          ?        ?       95.8        9.3       ?       ? 
1 1 1   14   12   54 o    317.1    3.1    0.0000   0.0000          ?        ?  1005.6716  19.7942          ?        ?      317.1        3.1       ?       ? 
1 1 1   14   12   55 o     24.6   11.9    0.0000   0.0000          ?        ?   -26.1794  17.2401          ?        ?       24.6       11.9       ?       ? 
1 1 1   14   12   56 o    262.8    3.5    0.0000   0.0000          ?        ?   690.8804  18.5171          ?        ?      262.8        3.5       ?       ? 
1 1 1   14   12   57 o     24.2   11.8    0.0000   0.0000          ?        ?   -33.8416  18.5171          ?        ?       24.2       11.8       ?       ? 
1 1 1   14   12   58 o     24.9   12.1    0.0000   0.0000          ?        ?   -33.8416  19.1556          ?        ?       24.9       12.1       ?       ? 
1 1 1   14   12   59 o    652.1    2.8    0.0000   0.0000          ?        ?  4253.8311  37.0343          ?        ?      652.1        2.8       ?       ? 
1 1 1   14   12   60 o    143.7    6.7    0.0000   0.0000          ?        ?   206.8810  19.1556          ?        ?      143.7        6.7       ?       ? 
1 1 1   14   12   61 o    199.3    4.8    0.0000   0.0000          ?        ?   397.7990  19.1556          ?        ?      199.3        4.8       ?       ? 
1 1 1   14   12   62 o     48.1   16.7    0.0000   0.0000          ?        ?    21.0712  19.7942          ?        ?       48.1       16.7       ?       ? 
1 1 1   14   12   63 o    352.5    3.3    0.0000   0.0000          ?        ?  1243.2015  22.9868          ?        ?      352.5        3.3       ?       ? 
1 1 1   14   12   64 o    122.0    8.1    0.0000   0.0000          ?        ?   149.4141  19.7942          ?        ?      122.0        8.1       ?       ? 
1 1 1   14   12   65 f     93.9    9.9    0.0000   0.0000          ?        ?    88.7545  18.5171          ?        ?       93.9        9.9       ?       ? 
1 1 1   14   12   66 o     24.3   11.9    0.0000   0.0000          ?        ?   -39.5883  19.7942          ?        ?       24.3       11.9       ?       ? 
1 1 1   14   12   67 o    340.3    3.4    0.0000   0.0000          ?        ?  1158.9167  22.9868          ?        ?      340.3        3.4       ?       ? 
1 1 1   14   12   68 o    118.7    8.9    0.0000   0.0000          ?        ?   141.7518  21.0712          ?        ?      118.7        8.9       ?       ? 
1 1 1   14   12   69 o     20.5   10.4    0.0000   0.0000          ?        ?   -72.7915  21.0712          ?        ?       20.5       10.4       ?       ? 
1 1 1   14   12   70 o    104.6   10.1    0.0000   0.0000          ?        ?   110.4642  21.0712          ?        ?      104.6       10.1       ?       ? 
1 1 1   14   12   71 o     75.5   14.5    0.0000   0.0000          ?        ?    60.0210  21.0712          ?        ?       75.5       14.5       ?       ? 
1 1 1   14   12   72 o    175.5    6.7    0.0000   0.0000          ?        ?   309.6830  23.6253          ?        ?      175.5        6.7       ?       ? 
1 1 1   14   12   73 o    189.7    5.7    0.0000   0.0000          ?        ?   361.4032  21.7097          ?        ?      189.7        5.7       ?       ? 
1 1 1   14   12   74 o    138.7    8.3    0.0000   0.0000          ?        ?   194.1106  22.9868          ?        ?      138.7        8.3       ?       ? 
1 1 1   14   12   75 o    110.0    9.6    0.0000   0.0000          ?        ?   122.5962  21.0712          ?        ?      110.0        9.6       ?       ? 
1 1 1   14   12   76 o    101.7   10.4    0.0000   0.0000          ?        ?   105.3561  21.0712          ?        ?      101.7       10.4       ?       ? 
1 1 1   14   12   77 o    123.9    8.8    0.0000   0.0000          ?        ?   155.7993  21.7097          ?        ?      123.9        8.8       ?       ? 
1 1 1   14   13    0 o   1044.4    6.5 10910.4189 136.0051 10910.4189 136.0051 10910.4189 136.0051     1044.4      6.5     1044.4        6.5     0.0     0.0 
1 1 1   14   13    1 o   1571.7    6.5    0.0000   0.0000          ?        ? 24705.6777 204.3269          ?        ?     1571.7        6.5       ?       ? 
1 1 1   14   13    2 o   1188.5    4.6    0.0000   0.0000          ?        ? 14127.2910 109.1872          ?        ?     1188.5        4.6       ?       ? 
1 1 1   14   13    3 o    543.9    2.3    0.0000   0.0000          ?        ?  2958.2705  24.9023          ?        ?      543.9        2.3       ?       ? 
1 1 1   14   13    4 o    562.6    2.2    0.0000   0.0000          ?        ?  3165.7900  24.2638          ?        ?      562.6        2.2       ?       ? 
1 1 1   14   13    5 o   1014.3    3.5    0.0000   0.0000          ?        ? 10287.8604  70.8759          ?        ?     1014.3        3.5       ?       ? 
1 1 1   14   13    6 f    386.4    1.7    0.0000   0.0000          ?        ?  1492.8635  13.4090          ?        ?      386.4        1.7       ?       ? 
1 1 1   14   13    7 o    153.1    1.9    0.0000   0.0000          ?        ?   234.3374   5.7467          ?        ?      153.1        1.9       ?       ? 
1 1 1   14   13    8 o   1339.2    4.5    0.0000   0.0000          ?        ? 17934.7949 120.0421          ?        ?     1339.2        4.5       ?       ? 
1 1 1   14   13    9 o   1637.1    5.6    0.0000   0.0000          ?        ? 26803.2227 184.5327          ?        ?     1637.1        5.6       ?       ? 
1 1 1   14   13   10 o   1494.1    4.9    0.0000   0.0000          ?        ? 22326.5469 146.8600          ?        ?     1494.1        4.9       ?       ? 
1 1 1   14   13   11 o    650.7    2.5    0.0000   0.0000          ?        ?  4234.6753  31.9261          ?        ?      650.7        2.5       ?       ? 
1 1 1   14   13   12 o    833.3    3.0    0.0000   0.0000          ?        ?  6944.5610  49.8047          ?        ?      833.3        3.0       ?       ? 
1 1 1   14   13   13 o   1070.9    3.8    0.0000   0.0000          ?        ? 11468.4863  81.7308          ?        ?     1070.9        3.8       ?       ? 
1 1 1   14   13   14 o   1432.7    4.9    0.0000   0.0000          ?        ? 20527.1934 140.4748          ?        ?     1432.7        4.9       ?       ? 
1 1 1   14   13   15 o    684.0    2.6    0.0000   0.0000          ?        ?  4679.0864  35.7572          ?        ?      684.0        2.6       ?       ? 
1 1 1   14   13   16 o    538.9    2.3    0.0000   0.0000          ?        ?  2903.9963  24.2638          ?        ?      538.9        2.3       ?       ? 
1 1 1   14   13   17 o   1997.6    6.6    0.0000   0.0000          ?        ? 39910.7930 265.6250          ?        ?     1997.6        6.6       ?       ? 
1 1 1   14   13   18 o   1180.4    4.6    0.0000   0.0000          ?        ? 13934.4580 108.5487          ?        ?     1180.4        4.6       ?       ? 
1 1 1   14   13   19 o   1776.9    6.0    0.0000   0.0000          ?        ? 31578.7266 211.9892          ?        ?     1776.9        6.0       ?       ? 
1 1 1   14   13   20 o    893.5    3.2    0.0000   0.0000          ?        ?  7984.0747  57.4669          ?        ?      893.5        3.2       ?       ? 
1 1 1   14   13   21 o    546.1    2.6    0.0000   0.0000          ?        ?  2981.8960  28.7335          ?        ?      546.1        2.6       ?       ? 
1 1 1   14   13   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14   13   23 o   1642.0    6.7    0.0000   0.0000          ?        ? 26965.4082 221.5670          ?        ?     1642.0        6.7       ?       ? 
1 1 1   14   13   24 o   1141.5    4.0    0.0000   0.0000          ?        ? 13030.3105  91.3086          ?        ?     1141.5        4.0       ?       ? 
1 1 1   14   13   25 o    361.6    2.4    0.0000   0.0000          ?        ?  1307.6923  17.2401          ?        ?      361.6        2.4       ?       ? 
1 1 1   14   13   26 o    340.9    2.5    0.0000   0.0000          ?        ?  1162.1094  17.2401          ?        ?      340.9        2.5       ?       ? 
1 1 1   14   13   27 o    698.8    2.7    0.0000   0.0000          ?        ?  4883.4131  38.3113          ?        ?      698.8        2.7       ?       ? 
1 1 1   14   13   28 o   1569.9    5.2    0.0000   0.0000          ?        ? 24647.5742 164.1001          ?        ?     1569.9        5.2       ?       ? 
1 1 1   14   13   29 f     28.3   13.3    0.0000   0.0000          ?        ?   -20.4327  19.1556          ?        ?       28.3       13.3       ?       ? 
1 1 1   14   13   30 o    734.5    2.9    0.0000   0.0000          ?        ?  5395.5078  42.1424          ?        ?      734.5        2.9       ?       ? 
1 1 1   14   13   31 o   1122.4    4.2    0.0000   0.0000          ?        ? 12598.6699  95.1397          ?        ?     1122.4        4.2       ?       ? 
1 1 1   14   13   32 o    788.3    3.1    0.0000   0.0000          ?        ?  6214.7310  48.5276          ?        ?      788.3        3.1       ?       ? 
1 1 1   14   13   33 o    759.0    3.3    0.0000   0.0000          ?        ?  5761.3804  49.8047          ?        ?      759.0        3.3       ?       ? 
1 1 1   14   13   34 o    187.7    4.6    0.0000   0.0000          ?        ?   352.4639  17.2401          ?        ?      187.7        4.6       ?       ? 
1 1 1   14   13   35 o   1144.4    4.4    0.0000   0.0000          ?        ? 13097.9941 100.2479          ?        ?     1144.4        4.4       ?       ? 
1 1 1   14   13   36 o    201.8    5.1    0.0000   0.0000          ?        ?   407.3768  20.4327          ?        ?      201.8        5.1       ?       ? 
1 1 1   14   13   37 o    770.8    3.2    0.0000   0.0000          ?        ?  5941.4438  49.8047          ?        ?      770.8        3.2       ?       ? 
1 1 1   14   13   38 o   1022.3    3.9    0.0000   0.0000          ?        ? 10452.5986  79.8152          ?        ?     1022.3        3.9       ?       ? 
1 1 1   14   13   39 o    175.6    5.5    0.0000   0.0000          ?        ?   308.4059  19.1556          ?        ?      175.6        5.5       ?       ? 
1 1 1   14   13   40 o    505.4    3.1    0.0000   0.0000          ?        ?  2554.0864  31.2876          ?        ?      505.4        3.1       ?       ? 
1 1 1   14   13   41 o    462.5    3.0    0.0000   0.0000          ?        ?  2139.6860  27.4564          ?        ?      462.5        3.0       ?       ? 
1 1 1   14   13   42 o    334.0    3.2    0.0000   0.0000          ?        ?  1115.4973  21.0712          ?        ?      334.0        3.2       ?       ? 
1 1 1   14   13   43 o    296.3    3.2    0.0000   0.0000          ?        ?   877.9672  19.1556          ?        ?      296.3        3.2       ?       ? 
1 1 1   14   13   44 o    325.5    3.0    0.0000   0.0000          ?        ?  1059.3074  19.7942          ?        ?      325.5        3.0       ?       ? 
1 1 1   14   13   45 o    348.1    2.9    0.0000   0.0000          ?        ?  1211.9141  20.4327          ?        ?      348.1        2.9       ?       ? 
1 1 1   14   13   46 o    337.6    3.0    0.0000   0.0000          ?        ?  1139.7611  20.4327          ?        ?      337.6        3.0       ?       ? 
1 1 1   14   13   47 f    459.3    2.6    0.0000   0.0000          ?        ?  2109.6753  24.2638          ?        ?      459.3        2.6       ?       ? 
1 1 1   14   13   48 o    382.1    2.8    0.0000   0.0000          ?        ?  1460.2990  21.0712          ?        ?      382.1        2.8       ?       ? 
1 1 1   14   13   49 o    391.4    2.8    0.0000   0.0000          ?        ?  1532.4519  21.7097          ?        ?      391.4        2.8       ?       ? 
1 1 1   14   13   50 o    382.6    2.9    0.0000   0.0000          ?        ?  1464.1301  22.3483          ?        ?      382.6        2.9       ?       ? 
1 1 1   14   13   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14   13   52 o    151.1    5.7    0.0000   0.0000          ?        ?   228.5907  17.2401          ?        ?      151.1        5.7       ?       ? 
1 1 1   14   13   53 o    386.6    2.7    0.0000   0.0000          ?        ?  1494.7792  21.0712          ?        ?      386.6        2.7       ?       ? 
1 1 1   14   13   54 o    330.5    3.1    0.0000   0.0000          ?        ?  1092.5105  20.4327          ?        ?      330.5        3.1       ?       ? 
1 1 1   14   13   55 o    243.0    3.7    0.0000   0.0000          ?        ?   590.6325  17.8786          ?        ?      243.0        3.7       ?       ? 
1 1 1   14   13   56 o    318.6    3.1    0.0000   0.0000          ?        ?  1015.2494  19.7942          ?        ?      318.6        3.1       ?       ? 
1 1 1   14   13   57 o    328.5    3.0    0.0000   0.0000          ?        ?  1079.7401  19.7942          ?        ?      328.5        3.0       ?       ? 
1 1 1   14   13   58 o    431.2    2.7    0.0000   0.0000          ?        ?  1860.0134  23.6253          ?        ?      431.2        2.7       ?       ? 
1 1 1   14   13   59 o    234.0    4.1    0.0000   0.0000          ?        ?   547.8516  19.1556          ?        ?      234.0        4.1       ?       ? 
1 1 1   14   13   60 o    111.1    8.6    0.0000   0.0000          ?        ?   123.8732  19.1556          ?        ?      111.1        8.6       ?       ? 
1 1 1   14   13   61 o    264.4    3.9    0.0000   0.0000          ?        ?   699.8197  20.4327          ?        ?      264.4        3.9       ?       ? 
1 1 1   14   13   62 o     58.5   16.3    0.0000   0.0000          ?        ?    35.7572  19.7942          ?        ?       58.5       16.3       ?       ? 
1 1 1   14   13   63 o    213.4    4.6    0.0000   0.0000          ?        ?   455.9044  19.7942          ?        ?      213.4        4.6       ?       ? 
1 1 1   14   13   64 f     31.7   14.5    0.0000   0.0000          ?        ?   -15.3245  21.0712          ?        ?       31.7       14.5       ?       ? 
1 1 1   14   13   65 o    296.6    3.8    0.0000   0.0000          ?        ?   880.5213  22.3483          ?        ?      296.6        3.8       ?       ? 
1 1 1   14   13   66 o     55.2   17.5    0.0000   0.0000          ?        ?    30.6490  21.7097          ?        ?       55.2       17.5       ?       ? 
1 1 1   14   13   67 o     31.2   14.4    0.0000   0.0000          ?        ?   -16.6016  21.0712          ?        ?       31.2       14.4       ?       ? 
1 1 1   14   13   68 o    350.3    3.3    0.0000   0.0000          ?        ?  1227.8771  22.9868          ?        ?      350.3        3.3       ?       ? 
1 1 1   14   13   69 o     92.0   11.5    0.0000   0.0000          ?        ?    85.5619  21.0712          ?        ?       92.0       11.5       ?       ? 
1 1 1   14   13   70 o     24.0   11.8    0.0000   0.0000          ?        ?   -40.8654  19.7942          ?        ?       24.0       11.8       ?       ? 
1 1 1   14   13   71 o    222.3    4.9    0.0000   0.0000          ?        ?   495.4928  21.7097          ?        ?      222.3        4.9       ?       ? 
1 1 1   14   13   72 o    141.6    7.2    0.0000   0.0000          ?        ?   201.7728  20.4327          ?        ?      141.6        7.2       ?       ? 
1 1 1   14   13   73 o    139.5    7.6    0.0000   0.0000          ?        ?   196.0261  21.0712          ?        ?      139.5        7.6       ?       ? 
1 1 1   14   13   74 f    258.2    4.0    0.0000   0.0000          ?        ?   667.8936  20.4327          ?        ?      258.2        4.0       ?       ? 
1 1 1   14   13   75 o    203.3    5.3    0.0000   0.0000          ?        ?   415.0391  21.7097          ?        ?      203.3        5.3       ?       ? 
1 1 1   14   13   76 o     71.0   14.9    0.0000   0.0000          ?        ?    54.2743  20.4327          ?        ?       71.0       14.9       ?       ? 
1 1 1   14   13   77 o    122.8    8.8    0.0000   0.0000          ?        ?   153.2452  21.7097          ?        ?      122.8        8.8       ?       ? 
1 1 1   14   14    0 o   1076.5    9.3 11591.0830 201.1343 11591.0830 201.1343 11591.0830 201.1343     1076.5      9.3     1076.5        9.3     0.0     0.0 
1 1 1   14   14    1 o   1960.8   11.2 38460.0703 438.0258 38460.0703 438.0258 38460.0703 438.0258     1960.8     11.2     1960.8       11.2     0.0     0.0 
1 1 1   14   14    2 o   1027.6    5.5 10560.5098 112.3798 10560.5098 112.3798 10560.5098 112.3798     1027.6      5.5     1027.6        5.5     0.0     0.0 
1 1 1   14   14    3 o    595.1    4.1 3541.8796  49.1662  3541.8796  49.1662  3541.8796  49.1662      595.1      4.1      595.1        4.1     0.0     0.0 
1 1 1   14   14    4 o     98.0    3.3   96.4168   6.3852    96.4168   6.3852    96.4168   6.3852       98.0      3.3       98.0        3.3     0.0     0.0 
1 1 1   14   14    5 o   1500.3    7.0 22512.9961 208.7966 22512.9961 208.7966 22512.9961 208.7966     1500.3      7.0     1500.3        7.0     0.0     0.0 
1 1 1   14   14    6 f   1391.0    7.2 19351.6738 199.2188 19351.6738 199.2188 19351.6738 199.2188     1391.0      7.2     1391.0        7.2     0.0     0.0 
1 1 1   14   14    7 o    903.2    4.5 8158.3906  81.7308  8158.3906  81.7308  8158.3906  81.7308      903.2      4.5      903.2        4.5     0.0     0.0 
1 1 1   14   14    8 o     36.7   17.2   19.7942  14.0475    19.7942  14.0475    19.7942  14.0475       36.7     17.2       36.7       17.2     0.0     0.0 
1 1 1   14   14    9 o   1554.7    7.3 24173.7891 227.3137 24173.7891 227.3137 24173.7891 227.3137     1554.7      7.3     1554.7        7.3     0.0     0.0 
1 1 1   14   14   10 o   1181.0    6.7 13949.1445 157.0763 13949.1445 157.0763 13949.1445 157.0763     1181.0      6.7     1181.0        6.7     0.0     0.0 
1 1 1   14   14   11 o    214.4    2.8  459.7356  12.1319   459.7356  12.1319   459.7356  12.1319      214.4      2.8      214.4        2.8     0.0     0.0 
1 1 1   14   14   12 o    474.9    3.2 2255.8967  30.0105  2255.8967  30.0105  2255.8967  30.0105      474.9      3.2      474.9        3.2     0.0     0.0 
1 1 1   14   14   13 o    783.4    4.1 6137.4697  63.8522  6137.4697  63.8522  6137.4697  63.8522      783.4      4.1      783.4        4.1     0.0     0.0 
1 1 1   14   14   14 o    339.5    2.8 1152.5315  19.1556  1152.5315  19.1556  1152.5315  19.1556      339.5      2.8      339.5        2.8     0.0     0.0 
1 1 1   14   14   15 o    363.3    3.1 1319.8242  22.3483  1319.8242  22.3483  1319.8242  22.3483      363.3      3.1      363.3        3.1     0.0     0.0 
1 1 1   14   14   16 o   1484.1    7.7 22029.6348 228.5907 22029.6348 228.5907 22029.6348 228.5907     1484.1      7.7     1484.1        7.7     0.0     0.0 
1 1 1   14   14   17 o   1828.8    9.4 33452.7891 344.1632 33452.7891 344.1632 33452.7891 344.1632     1828.8      9.4     1828.8        9.4     0.0     0.0 
1 1 1   14   14   18 f   1134.2    5.8 12866.2109 130.8969 12866.2109 130.8969 12866.2109 130.8969     1134.2      5.8     1134.2        5.8     0.0     0.0 
1 1 1   14   14   19 o    693.9    3.7 4815.7300  51.0817  4815.7300  51.0817  4815.7300  51.0817      693.9      3.7      693.9        3.7     0.0     0.0 
1 1 1   14   14   20 o   2201.9   11.0 48496.3555 485.2764 48496.3555 485.2764 48496.3555 485.2764     2201.9     11.0     2201.9       11.0     0.0     0.0 
1 1 1   14   14   21 o   1196.3    6.2 14314.3779 148.1370 14314.3779 148.1370 14314.3779 148.1370     1196.3      6.2     1196.3        6.2     0.0     0.0 
1 1 1   14   14   22 o    687.3    4.8 4725.0601  65.7677  4725.0601  65.7677  4725.0601  65.7677      687.3      4.8      687.3        4.8     0.0     0.0 
1 1 1   14   14   23 o   2746.1   16.5 75452.1875 905.4237 75452.1875 905.4237 75452.1875 905.4237     2746.1     16.5     2746.1       16.5     0.0     0.0 
1 1 1   14   14   24 o   1288.5    6.4 16604.1152 164.7386 16604.1152 164.7386 16604.1152 164.7386     1288.5      6.4     1288.5        6.4     0.0     0.0 
1 1 1   14   14   25 o    804.9    4.8 6479.7173  77.8996  6479.7173  77.8996  6479.7173  77.8996      804.9      4.8      804.9        4.8     0.0     0.0 
1 1 1   14   14   26 o    252.3    3.8  637.2446  19.1556   637.2446  19.1556   637.2446  19.1556      252.3      3.8      252.3        3.8     0.0     0.0 
1 1 1   14   14   27 o    670.8    3.9 4500.3003  52.3588  4500.3003  52.3588  4500.3003  52.3588      670.8      3.9      670.8        3.9     0.0     0.0 
1 1 1   14   14   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14   14   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14   14   30 o    357.8    3.9 1280.8744  28.0950  1280.8744  28.0950  1280.8744  28.0950      357.8      3.9      357.8        3.9     0.0     0.0 
1 1 1   14   14   31 o    178.9    5.9  321.1764  21.0712   321.1764  21.0712   321.1764  21.0712      178.9      5.9      178.9        5.9     0.0     0.0 
1 1 1   14   14   32 o     22.1   15.7  -31.9261  27.4564   -31.9261  27.4564   -31.9261  27.4564       22.1     15.7       22.1       15.7     0.0     0.0 
1 1 1   14   14   33 o    348.3    5.4 1213.8297  37.6728  1213.8297  37.6728  1213.8297  37.6728      348.3      5.4      348.3        5.4     0.0     0.0 
1 1 1   14   14   34 o    484.1    3.8 2344.0129  36.3957  2344.0129  36.3957  2344.0129  36.3957      484.1      3.8      484.1        3.8     0.0     0.0 
1 1 1   14   14   35 o    854.6    4.6 7304.6875  77.8996  7304.6875  77.8996  7304.6875  77.8996      854.6      4.6      854.6        4.6     0.0     0.0 
1 1 1   14   14   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14   14   37 o    126.5   10.5  163.4615  26.1794   163.4615  26.1794   163.4615  26.1794      126.5     10.5      126.5       10.5     0.0     0.0 
1 1 1   14   14   38 o    955.3    5.1 9127.0283  98.3323  9127.0283  98.3323  9127.0283  98.3323      955.3      5.1      955.3        5.1     0.0     0.0 
1 1 1   14   14   39 o    709.0    4.6 5028.3579  65.1292  5028.3579  65.1292  5028.3579  65.1292      709.0      4.6      709.0        4.6     0.0     0.0 
1 1 1   14   14   40 o     20.7   14.4  -16.6016  20.4327   -16.6016  20.4327   -16.6016  20.4327       20.7     14.4       20.7       14.4     0.0     0.0 
1 1 1   14   14   41 o    763.1    4.7 5823.9556  71.5144  5823.9556  71.5144  5823.9556  71.5144      763.1      4.7      763.1        4.7     0.0     0.0 
1 1 1   14   14   42 o     28.0   18.6   -5.7467  26.8179    -5.7467  26.8179    -5.7467  26.8179       28.0     18.6       28.0       18.6     0.0     0.0 
1 1 1   14   14   43 o    749.0    4.3 5611.3281  64.4907  5611.3281  64.4907  5611.3281  64.4907      749.0      4.3      749.0        4.3     0.0     0.0 
1 1 1   14   14   44 o     19.2   14.3 -140.4748  42.7809  -140.4748  42.7809  -140.4748  42.7809       19.2     14.3       19.2       14.3     0.0     0.0 
1 1 1   14   14   45 o    515.9    4.4 2662.6353  45.3350  2662.6353  45.3350  2662.6353  45.3350      515.9      4.4      515.9        4.4     0.0     0.0 
1 1 1   14   14   46 o    260.3    5.4  678.7485  28.0950   678.7485  28.0950   678.7485  28.0950      260.3      5.4      260.3        5.4     0.0     0.0 
1 1 1   14   14   47 o     16.5   12.1  -54.2743  23.6253   -54.2743  23.6253   -54.2743  23.6253       16.5     12.1       16.5       12.1     0.0     0.0 
1 1 1   14   14   48 o    414.6    3.9 1719.5387  32.5646  1719.5387  32.5646  1719.5387  32.5646      414.6      3.9      414.6        3.9     0.0     0.0 
1 1 1   14   14   49 o    728.1    4.1 5302.2837  59.3825  5302.2837  59.3825  5302.2837  59.3825      728.1      4.1      728.1        4.1     0.0     0.0 
1 1 1   14   14   50 o    233.6    5.2  546.5745  24.2638   546.5745  24.2638   546.5745  24.2638      233.6      5.2      233.6        5.2     0.0     0.0 
1 1 1   14   14   51 f     15.3   11.4  -77.2611  25.5409   -77.2611  25.5409   -77.2611  25.5409       15.3     11.4       15.3       11.4     0.0     0.0 
1 1 1   14   14   52 o    376.4    4.2 1417.5181  31.2876  1417.5181  31.2876  1417.5181  31.2876      376.4      4.2      376.4        4.2     0.0     0.0 
1 1 1   14   14   53 o    389.7    4.1 1519.6815  31.9261  1519.6815  31.9261  1519.6815  31.9261      389.7      4.1      389.7        4.1     0.0     0.0 
1 1 1   14   14   54 o     98.0   12.2   97.0553  24.2638    97.0553  24.2638    97.0553  24.2638       98.0     12.2       98.0       12.2     0.0     0.0 
1 1 1   14   14   55 o    314.3    5.1  989.0699  31.9261   989.0699  31.9261   989.0699  31.9261      314.3      5.1      314.3        5.1     0.0     0.0 
1 1 1   14   14   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   14   14   57 o    241.4    6.0  584.2473  28.7335   584.2473  28.7335   584.2473  28.7335      241.4      6.0      241.4        6.0     0.0     0.0 
1 1 1   14   14   58 o     66.1   23.0   57.4669  27.4564    57.4669  27.4564    57.4669  27.4564       66.1     23.0       66.1       23.0     0.0     0.0 
1 1 1   14   14   59 o    372.1    4.5 1385.5919  33.2031  1385.5919  33.2031  1385.5919  33.2031      372.1      4.5      372.1        4.5     0.0     0.0 
1 1 1   14   14   60 o    111.1   12.3  128.3428  26.8179   128.3428  26.8179   128.3428  26.8179      111.1     12.3      111.1       12.3     0.0     0.0 
1 1 1   14   14   61 o    113.7   12.9  134.7281  28.7335   134.7281  28.7335   134.7281  28.7335      113.7     12.9      113.7       12.9     0.0     0.0 
1 1 1   14   14   62 o    371.5    4.4 1381.7607  32.5646  1381.7607  32.5646  1381.7607  32.5646      371.5      4.4      371.5        4.4     0.0     0.0 
1 1 1   14   14   63 o    343.8    4.7 1183.1805  32.5646  1183.1805  32.5646  1183.1805  32.5646      343.8      4.7      343.8        4.7     0.0     0.0 
1 1 1   14   14   64 o    404.4    4.1 1636.5309  33.2031  1636.5309  33.2031  1636.5309  33.2031      404.4      4.1      404.4        4.1     0.0     0.0 
1 1 1   14   14   65 o     25.8   17.7  -14.0475  27.4564   -14.0475  27.4564   -14.0475  27.4564       25.8     17.7       25.8       17.7     0.0     0.0 
1 1 1   14   14   66 o     20.6   14.9  -42.7809  28.0950   -42.7809  28.0950   -42.7809  28.0950       20.6     14.9       20.6       14.9     0.0     0.0 
1 1 1   14   14   67 o    266.4    5.9  711.9516  31.2876   711.9516  31.2876   711.9516  31.2876      266.4      5.9      266.4        5.9     0.0     0.0 
1 1 1   14   14   68 o    241.8    6.3  586.8014  30.6490   586.8014  30.6490   586.8014  30.6490      241.8      6.3      241.8        6.3     0.0     0.0 
1 1 1   14   14   69 o     16.1   12.0  -97.0553  30.0105   -97.0553  30.0105   -97.0553  30.0105       16.1     12.0       16.1       12.0     0.0     0.0 
1 1 1   14   14   70 o     15.4   11.5 -102.8020  29.3720  -102.8020  29.3720  -102.8020  29.3720       15.4     11.5       15.4       11.5     0.0     0.0 
1 1 1   14   14   71 o    122.7   12.5  156.4378  30.0105   156.4378  30.0105   156.4378  30.0105      122.7     12.5      122.7       12.5     0.0     0.0 
1 1 1   14   14   72 o    243.9    6.6  597.6562  31.9261   597.6562  31.9261   597.6562  31.9261      243.9      6.6      243.9        6.6     0.0     0.0 
1 1 1   14   14   73 o     46.6   23.9   33.2031  28.0950    33.2031  28.0950    33.2031  28.0950       46.6     23.9       46.6       23.9     0.0     0.0 
1 1 1   14   14   74 o     15.7   11.7 -103.4405  30.0105  -103.4405  30.0105  -103.4405  30.0105       15.7     11.7       15.7       11.7     0.0     0.0 
1 1 1   14   14   75 f    252.5    6.3  641.0757  31.9261   641.0757  31.9261   641.0757  31.9261      252.5      6.3      252.5        6.3     0.0     0.0 
1 1 1   14   14   76 o    121.6   11.8  153.8837  28.0950   153.8837  28.0950   153.8837  28.0950      121.6     11.8      121.6       11.8     0.0     0.0 
1 1 1   14   14   77 o    177.0    8.0  317.3452  28.0950   317.3452  28.0950   317.3452  28.0950      177.0      8.0      177.0        8.0     0.0     0.0 
1 1 1   15    0    0 o    270.7    2.8  733.0228  15.3245   733.0228  15.3245   733.0228  15.3245      270.7      2.8      270.7        2.8     0.0     0.0 
1 1 1   15    0    1 o    127.6    2.0  162.8230   5.1082   162.8230   5.1082   162.8230   5.1082      127.6      2.0      127.6        2.0     0.0     0.0 
1 1 1   15    0    2 o     11.7    7.7   -0.6385   4.4697    -0.6385   4.4697    -0.6385   4.4697       11.7      7.7       11.7        7.7     0.0     0.0 
1 1 1   15    0    3 o   2085.1    9.5 43483.9609 394.6064 43483.9609 394.6064 43483.9609 394.6064     2085.1      9.5     2085.1        9.5     0.0     0.0 
1 1 1   15    0    4 o   1543.3    7.1 23821.3262 220.2900 23821.3262 220.2900 23821.3262 220.2900     1543.3      7.1     1543.3        7.1     0.0     0.0 
1 1 1   15    0    5 o    722.1    3.6 5215.4443  52.3588  5215.4443  52.3588  5215.4443  52.3588      722.1      3.6      722.1        3.6     0.0     0.0 
1 1 1   15    0    6 o    848.2    4.2 7194.8618  70.8759  7194.8618  70.8759  7194.8618  70.8759      848.2      4.2      848.2        4.2     0.0     0.0 
1 1 1   15    0    7 o    675.0    3.4 4557.1289  45.9736  4557.1289  45.9736  4557.1289  45.9736      675.0      3.4      675.0        3.4     0.0     0.0 
1 1 1   15    0    8 o   1173.9    5.6 13783.1289 130.8969 13783.1289 130.8969 13783.1289 130.8969     1173.9      5.6     1173.9        5.6     0.0     0.0 
1 1 1   15    0    9 o   1250.1    5.9 15629.7324 147.4985 15629.7324 147.4985 15629.7324 147.4985     1250.1      5.9     1250.1        5.9     0.0     0.0 
1 1 1   15    0   10 o   1211.2    5.7 14672.5879 138.5592 14672.5879 138.5592 14672.5879 138.5592     1211.2      5.7     1211.2        5.7     0.0     0.0 
1 1 1   15    0   11 o   1888.5    8.6 35673.5625 325.6460 35673.5625 325.6460 35673.5625 325.6460     1888.5      8.6     1888.5        8.6     0.0     0.0 
1 1 1   15    0   12 o    630.9    3.3 3981.1824  41.5039  3981.1824  41.5039  3981.1824  41.5039      630.9      3.3      630.9        3.3     0.0     0.0 
1 1 1   15    0   13 o   2815.1   12.6 79280.7578 711.3131 79280.7578 711.3131 79280.7578 711.3131     2815.1     12.6     2815.1       12.6     0.0     0.0 
1 1 1   15    0   14 o    963.8    4.7 9291.1279  90.0316  9291.1279  90.0316  9291.1279  90.0316      963.8      4.7      963.8        4.7     0.0     0.0 
1 1 1   15    0   15 o    618.0    3.5 3820.2749  42.7809  3820.2749  42.7809  3820.2749  42.7809      618.0      3.5      618.0        3.5     0.0     0.0 
1 1 1   15    0   16 o   1062.4    5.1 11289.0625 109.1872 11289.0625 109.1872 11289.0625 109.1872     1062.4      5.1     1062.4        5.1     0.0     0.0 
1 1 1   15    0   17 o   1271.7    6.0 16173.7529 151.9681 16173.7529 151.9681 16173.7529 151.9681     1271.7      6.0     1271.7        6.0     0.0     0.0 
1 1 1   15    0   18 o   1072.4    5.2 11501.6904 111.1028 11501.6904 111.1028 11501.6904 111.1028     1072.4      5.2     1072.4        5.2     0.0     0.0 
1 1 1   15    0   19 o   1284.0    6.3 16488.5449 162.1845 16488.5449 162.1845 16488.5449 162.1845     1284.0      6.3     1284.0        6.3     0.0     0.0 
1 1 1   15    0   20 o    432.6    3.2 1871.5070  27.4564  1871.5070  27.4564  1871.5070  27.4564      432.6      3.2      432.6        3.2     0.0     0.0 
1 1 1   15    0   21 o    841.3    4.3 7079.2891  71.5144  7079.2891  71.5144  7079.2891  71.5144      841.3      4.3      841.3        4.3     0.0     0.0 
1 1 1   15    0   22 o    210.5    2.7  443.1340  11.4934   443.1340  11.4934   443.1340  11.4934      210.5      2.7      210.5        2.7     0.0     0.0 
1 1 1   15    0   23 o    697.6    3.7 4866.8120  51.0817  4866.8120  51.0817  4866.8120  51.0817      697.6      3.7      697.6        3.7     0.0     0.0 
1 1 1   15    0   24 o    921.5    5.1 8492.3379  93.2242  8492.3379  93.2242  8492.3379  93.2242      921.5      5.1      921.5        5.1     0.0     0.0 
1 1 1   15    0   25 o    818.6    4.2 6701.9229  68.9603  6701.9229  68.9603  6701.9229  68.9603      818.6      4.2      818.6        4.2     0.0     0.0 
1 1 1   15    0   26 o   1220.8    5.9 14905.0107 143.6674 14905.0107 143.6674 14905.0107 143.6674     1220.8      5.9     1220.8        5.9     0.0     0.0 
1 1 1   15    0   27 o   1020.9    5.1 10423.8652 104.7175 10423.8652 104.7175 10423.8652 104.7175     1020.9      5.1     1020.9        5.1     0.0     0.0 
1 1 1   15    0   28 o     44.9   20.5   29.3720  19.7942    29.3720  19.7942    29.3720  19.7942       44.9     20.5       44.9       20.5     0.0     0.0 
1 1 1   15    0   29 o    620.5    3.9 3850.2854  47.8891  3850.2854  47.8891  3850.2854  47.8891      620.5      3.9      620.5        3.9     0.0     0.0 
1 1 1   15    0   30 o   1241.5    6.2 15415.8281 154.5222 15415.8281 154.5222 15415.8281 154.5222     1241.5      6.2     1241.5        6.2     0.0     0.0 
1 1 1   15    0   31 o   1500.6    7.3 22520.6582 219.6514 22520.6582 219.6514 22520.6582 219.6514     1500.6      7.3     1500.6        7.3     0.0     0.0 
1 1 1   15    0   32 o   1341.4    7.0 17997.3711 187.7254 17997.3711 187.7254 17997.3711 187.7254     1341.4      7.0     1341.4        7.0     0.0     0.0 
1 1 1   15    0   33 o    691.2    4.2 4778.0571  58.7440  4778.0571  58.7440  4778.0571  58.7440      691.2      4.2      691.2        4.2     0.0     0.0 
1 1 1   15    0   34 o   1053.4    5.5 11098.1445 116.2109 11098.1445 116.2109 11098.1445 116.2109     1053.4      5.5     1053.4        5.5     0.0     0.0 
1 1 1   15    0   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    0   36 o    245.0    4.6  600.8488  22.3483   600.8488  22.3483   600.8488  22.3483      245.0      4.6      245.0        4.6     0.0     0.0 
1 1 1   15    0   37 o    257.1    4.3  661.5084  22.3483   661.5084  22.3483   661.5084  22.3483      257.1      4.3      257.1        4.3     0.0     0.0 
1 1 1   15    0   38 o    637.7    4.6 4068.0212  58.7440  4068.0212  58.7440  4068.0212  58.7440      637.7      4.6      637.7        4.6     0.0     0.0 
1 1 1   15    0   39 o    591.8    4.0 3502.2910  47.2506  3502.2910  47.2506  3502.2910  47.2506      591.8      4.0      591.8        4.0     0.0     0.0 
1 1 1   15    0   40 o    278.4    4.9  775.8038  27.4564   775.8038  27.4564   775.8038  27.4564      278.4      4.9      278.4        4.9     0.0     0.0 
1 1 1   15    0   41 o    787.1    4.7 6196.2139  74.0685  6196.2139  74.0685  6196.2139  74.0685      787.1      4.7      787.1        4.7     0.0     0.0 
1 1 1   15    0   42 o    276.2    4.7  763.6719  26.1794   763.6719  26.1794   763.6719  26.1794      276.2      4.7      276.2        4.7     0.0     0.0 
1 1 1   15    0   43 o    261.1    5.4  682.5797  28.0950   682.5797  28.0950   682.5797  28.0950      261.1      5.4      261.1        5.4     0.0     0.0 
1 1 1   15    0   44 o    264.0    5.2  697.9042  27.4564   697.9042  27.4564   697.9042  27.4564      264.0      5.2      264.0        5.2     0.0     0.0 
1 1 1   15    0   45 o   1526.7    7.2 23314.3398 220.2900 23314.3398 220.2900 23314.3398 220.2900     1526.7      7.2     1526.7        7.2     0.0     0.0 
1 1 1   15    0   46 o     53.7   26.1   42.7809  32.5646    42.7809  32.5646    42.7809  32.5646       53.7     26.1       53.7       26.1     0.0     0.0 
1 1 1   15    0   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    0   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    0   49 o    415.1    4.0 1724.0084  33.2031  1724.0084  33.2031  1724.0084  33.2031      415.1      4.0      415.1        4.0     0.0     0.0 
1 1 1   15    0   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    0   51 o    465.7    4.4 2169.6963  40.8654  2169.6963  40.8654  2169.6963  40.8654      465.7      4.4      465.7        4.4     0.0     0.0 
1 1 1   15    0   52 o    381.1    4.7 1453.2753  35.7572  1453.2753  35.7572  1453.2753  35.7572      381.1      4.7      381.1        4.7     0.0     0.0 
1 1 1   15    0   53 f     14.6   10.9 -101.5249  27.4564  -101.5249  27.4564  -101.5249  27.4564       14.6     10.9       14.6       10.9     0.0     0.0 
1 1 1   15    0   54 o    339.3    4.8 1152.5315  32.5646  1152.5315  32.5646  1152.5315  32.5646      339.3      4.8      339.3        4.8     0.0     0.0 
1 1 1   15    0   55 o    573.2    3.8 3286.4709  43.4195  3286.4709  43.4195  3286.4709  43.4195      573.2      3.8      573.2        3.8     0.0     0.0 
1 1 1   15    0   56 o    712.4    4.3 5076.8853  61.2981  5076.8853  61.2981  5076.8853  61.2981      712.4      4.3      712.4        4.3     0.0     0.0 
1 1 1   15    0   57 o    357.0    4.5 1275.1277  31.9261  1275.1277  31.9261  1275.1277  31.9261      357.0      4.5      357.0        4.5     0.0     0.0 
1 1 1   15    0   58 o    952.8    4.8 9081.6934  91.3086  9081.6934  91.3086  9081.6934  91.3086      952.8      4.8      952.8        4.8     0.0     0.0 
1 1 1   15    0   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    0   60 o    370.4    4.6 1373.4601  33.8416  1373.4601  33.8416  1373.4601  33.8416      370.4      4.6      370.4        4.6     0.0     0.0 
1 1 1   15    0   61 o    103.0   13.4  111.7413  26.8179   111.7413  26.8179   111.7413  26.8179      103.0     13.4      103.0       13.4     0.0     0.0 
1 1 1   15    0   62 o     15.4   11.5  -76.6226  25.5409   -76.6226  25.5409   -76.6226  25.5409       15.4     11.5       15.4       11.5     0.0     0.0 
1 1 1   15    0   63 o    545.3    3.9 2974.8723  42.1424  2974.8723  42.1424  2974.8723  42.1424      545.3      3.9      545.3        3.9     0.0     0.0 
1 1 1   15    0   64 o     43.0   23.4   26.8179  28.0950    26.8179  28.0950    26.8179  28.0950       43.0     23.4       43.0       23.4     0.0     0.0 
1 1 1   15    0   65 o     30.4   19.9   -1.2770  28.7335    -1.2770  28.7335    -1.2770  28.7335       30.4     19.9       30.4       19.9     0.0     0.0 
1 1 1   15    0   66 o    336.2    4.8 1132.0989  32.5646  1132.0989  32.5646  1132.0989  32.5646      336.2      4.8      336.2        4.8     0.0     0.0 
1 1 1   15    0   67 o    106.8   13.5  120.0421  28.0950   120.0421  28.0950   120.0421  28.0950      106.8     13.5      106.8       13.5     0.0     0.0 
1 1 1   15    0   68 o    272.2    6.0  742.6006  32.5646   742.6006  32.5646   742.6006  32.5646      272.2      6.0      272.2        6.0     0.0     0.0 
1 1 1   15    0   69 o    300.0    5.1  901.5925  30.6490   901.5925  30.6490   901.5925  30.6490      300.0      5.1      300.0        5.1     0.0     0.0 
1 1 1   15    0   70 o    287.4    5.2  827.5240  30.0105   827.5240  30.0105   827.5240  30.0105      287.4      5.2      287.4        5.2     0.0     0.0 
1 1 1   15    0   71 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    0   72 o    353.5    4.6 1251.5024  32.5646  1251.5024  32.5646  1251.5024  32.5646      353.5      4.6      353.5        4.6     0.0     0.0 
1 1 1   15    0   73 o    125.4   12.4  162.8230  30.6490   162.8230  30.6490   162.8230  30.6490      125.4     12.4      125.4       12.4     0.0     0.0 
1 1 1   15    0   74 o    166.8    9.6  282.2266  31.9261   282.2266  31.9261   282.2266  31.9261      166.8      9.6      166.8        9.6     0.0     0.0 
1 1 1   15    0   75 o     73.4   23.7   69.5989  30.6490    69.5989  30.6490    69.5989  30.6490       73.4     23.7       73.4       23.7     0.0     0.0 
1 1 1   15    0   76 o    127.1   12.8  167.9312  31.9261   167.9312  31.9261   167.9312  31.9261      127.1     12.8      127.1       12.8     0.0     0.0 
1 1 1   15    0   77 o     83.6   21.2   83.6463  30.6490    83.6463  30.6490    83.6463  30.6490       83.6     21.2       83.6       21.2     0.0     0.0 
1 1 1   15    0   78 o     33.5   21.5    4.4697  31.9261     4.4697  31.9261     4.4697  31.9261       33.5     21.5       33.5       21.5     0.0     0.0 
1 1 1   15    0   79 o     19.9   14.5  -54.9129  30.0105   -54.9129  30.0105   -54.9129  30.0105       19.9     14.5       19.9       14.5     0.0     0.0 
1 1 1   15    0   80 o     16.9   12.5  -77.8996  28.7335   -77.8996  28.7335   -77.8996  28.7335       16.9     12.5       16.9       12.5     0.0     0.0 
1 1 1   15    1    0 o    241.6    2.0  583.6088   9.5778   583.6088   9.5778   583.6088   9.5778      241.6      2.0      241.6        2.0     0.0     0.0 
1 1 1   15    1    1 o    776.7    2.8    0.0000   0.0000          ?        ?  6032.7524  43.4195          ?        ?      776.7        2.8       ?       ? 
1 1 1   15    1    2 o   1089.0    3.7    0.0000   0.0000          ?        ? 11860.5391  81.0922          ?        ?     1089.0        3.7       ?       ? 
1 1 1   15    1    3 o    653.7    2.4    0.0000   0.0000          ?        ?  4272.9868  31.2876          ?        ?      653.7        2.4       ?       ? 
1 1 1   15    1    4 o    758.0    2.7    0.0000   0.0000          ?        ?  5746.0562  40.8654          ?        ?      758.0        2.7       ?       ? 
1 1 1   15    1    5 o    171.0    1.5    0.0000   0.0000          ?        ?   292.4429   5.1082          ?        ?      171.0        1.5       ?       ? 
1 1 1   15    1    6 o    803.1    2.8    0.0000   0.0000          ?        ?  6449.7070  45.3350          ?        ?      803.1        2.8       ?       ? 
1 1 1   15    1    7 f    937.4    3.2    0.0000   0.0000          ?        ?  8787.3340  60.6596          ?        ?      937.4        3.2       ?       ? 
1 1 1   15    1    8 o    211.0    1.4    0.0000   0.0000          ?        ?   445.0496   5.7467          ?        ?      211.0        1.4       ?       ? 
1 1 1   15    1    9 o    463.0    1.8    0.0000   0.0000          ?        ?  2144.1555  16.6016          ?        ?      463.0        1.8       ?       ? 
1 1 1   15    1   10 o    594.1    2.2    0.0000   0.0000          ?        ?  3529.7476  26.1794          ?        ?      594.1        2.2       ?       ? 
1 1 1   15    1   11 o    763.7    2.7    0.0000   0.0000          ?        ?  5832.2568  40.8654          ?        ?      763.7        2.7       ?       ? 
1 1 1   15    1   12 o   1389.2    4.6    0.0000   0.0000          ?        ? 19299.3164 127.7043          ?        ?     1389.2        4.6       ?       ? 
1 1 1   15    1   13 f    789.4    2.8    0.0000   0.0000          ?        ?  6231.9712  44.0580          ?        ?      789.4        2.8       ?       ? 
1 1 1   15    1   14 o    665.2    2.4    0.0000   0.0000          ?        ?  4425.5933  32.5646          ?        ?      665.2        2.4       ?       ? 
1 1 1   15    1   15 o    542.9    2.1    0.0000   0.0000          ?        ?  2947.4158  22.9868          ?        ?      542.9        2.1       ?       ? 
1 1 1   15    1   16 o    397.6    1.7    0.0000   0.0000          ?        ?  1580.9796  13.4090          ?        ?      397.6        1.7       ?       ? 
1 1 1   15    1   17 o    485.4    2.0    0.0000   0.0000          ?        ?  2356.1448  19.1556          ?        ?      485.4        2.0       ?       ? 
1 1 1   15    1   18 o    517.9    2.2    0.0000   0.0000          ?        ?  2682.4294  22.3483          ?        ?      517.9        2.2       ?       ? 
1 1 1   15    1   19 o    347.8    1.7    0.0000   0.0000          ?        ?  1209.9985  12.1319          ?        ?      347.8        1.7       ?       ? 
1 1 1   15    1   20 o    819.7    2.9    0.0000   0.0000          ?        ?  6719.1636  47.2506          ?        ?      819.7        2.9       ?       ? 
1 1 1   15    1   21 o   1319.7    4.5    0.0000   0.0000          ?        ? 17416.9531 118.7650          ?        ?     1319.7        4.5       ?       ? 
1 1 1   15    1   22 o    501.8    2.1    0.0000   0.0000          ?        ?  2517.6907  21.0712          ?        ?      501.8        2.1       ?       ? 
1 1 1   15    1   23 o   1435.8    4.9    0.0000   0.0000          ?        ? 20617.2246 140.4748          ?        ?     1435.8        4.9       ?       ? 
1 1 1   15    1   24 f    327.1    1.9    0.0000   0.0000          ?        ?  1070.1622  12.1319          ?        ?      327.1        1.9       ?       ? 
1 1 1   15    1   25 o   1595.5    5.3    0.0000   0.0000          ?        ? 25458.4961 168.5697          ?        ?     1595.5        5.3       ?       ? 
1 1 1   15    1   26 o    695.0    2.9    0.0000   0.0000          ?        ?  4831.0547  40.2269          ?        ?      695.0        2.9       ?       ? 
1 1 1   15    1   27 o    984.9    3.5    0.0000   0.0000          ?        ?  9700.4199  68.3218          ?        ?      984.9        3.5       ?       ? 
1 1 1   15    1   28 o   1482.3    5.0    0.0000   0.0000          ?        ? 21973.4453 148.7755          ?        ?     1482.3        5.0       ?       ? 
1 1 1   15    1   29 f   1574.3    5.8    0.0000   0.0000          ?        ? 24788.0488 183.2557          ?        ?     1574.3        5.8       ?       ? 
1 1 1   15    1   30 o     20.5   10.0    0.0000   0.0000          ?        ?   -24.9023  13.4090          ?        ?       20.5       10.0       ?       ? 
1 1 1   15    1   31 o    338.8    2.4    0.0000   0.0000          ?        ?  1148.0619  16.6016          ?        ?      338.8        2.4       ?       ? 
1 1 1   15    1   32 o   1050.9    4.0    0.0000   0.0000          ?        ? 11045.1475  84.9234          ?        ?     1050.9        4.0       ?       ? 
1 1 1   15    1   33 o   1056.3    3.9    0.0000   0.0000          ?        ? 11157.5273  82.3693          ?        ?     1056.3        3.9       ?       ? 
1 1 1   15    1   34 o   1150.4    4.1    0.0000   0.0000          ?        ? 13234.0000  95.1397          ?        ?     1150.4        4.1       ?       ? 
1 1 1   15    1   35 o    951.0    3.5    0.0000   0.0000          ?        ?  9045.2969  67.0448          ?        ?      951.0        3.5       ?       ? 
1 1 1   15    1   36 o    356.6    2.7    0.0000   0.0000          ?        ?  1271.9351  19.1556          ?        ?      356.6        2.7       ?       ? 
1 1 1   15    1   37 o    951.3    3.5    0.0000   0.0000          ?        ?  9050.4053  66.4062          ?        ?      951.3        3.5       ?       ? 
1 1 1   15    1   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    1   39 o   1301.6    4.4    0.0000   0.0000          ?        ? 16943.8105 114.2954          ?        ?     1301.6        4.4       ?       ? 
1 1 1   15    1   40 o   1389.7    4.8    0.0000   0.0000          ?        ? 19315.9180 132.8125          ?        ?     1389.7        4.8       ?       ? 
1 1 1   15    1   41 f   1334.2    4.5    0.0000   0.0000          ?        ? 17803.8984 120.6806          ?        ?     1334.2        4.5       ?       ? 
1 1 1   15    1   42 o    397.4    3.1    0.0000   0.0000          ?        ?  1579.7025  24.2638          ?        ?      397.4        3.1       ?       ? 
1 1 1   15    1   43 o    508.8    2.6    0.0000   0.0000          ?        ?  2588.5667  26.1794          ?        ?      508.8        2.6       ?       ? 
1 1 1   15    1   44 o    179.4    5.3    0.0000   0.0000          ?        ?   321.8149  19.1556          ?        ?      179.4        5.3       ?       ? 
1 1 1   15    1   45 o    266.8    4.1    0.0000   0.0000          ?        ?   711.9516  21.7097          ?        ?      266.8        4.1       ?       ? 
1 1 1   15    1   46 o    767.6    3.1    0.0000   0.0000          ?        ?  5892.9160  47.8891          ?        ?      767.6        3.1       ?       ? 
1 1 1   15    1   47 o    794.5    3.4    0.0000   0.0000          ?        ?  6313.0635  54.2743          ?        ?      794.5        3.4       ?       ? 
1 1 1   15    1   48 o    915.5    3.5    0.0000   0.0000          ?        ?  8382.5127  63.2136          ?        ?      915.5        3.5       ?       ? 
1 1 1   15    1   49 o    511.8    2.9    0.0000   0.0000          ?        ?  2619.8542  29.3720          ?        ?      511.8        2.9       ?       ? 
1 1 1   15    1   50 o    225.7    4.2    0.0000   0.0000          ?        ?   509.5403  19.1556          ?        ?      225.7        4.2       ?       ? 
1 1 1   15    1   51 o    267.3    3.7    0.0000   0.0000          ?        ?   714.5057  19.7942          ?        ?      267.3        3.7       ?       ? 
1 1 1   15    1   52 o    125.0    7.2    0.0000   0.0000          ?        ?   156.4378  17.8786          ?        ?      125.0        7.2       ?       ? 
1 1 1   15    1   53 o    553.3    2.7    0.0000   0.0000          ?        ?  3061.7112  29.3720          ?        ?      553.3        2.7       ?       ? 
1 1 1   15    1   54 o    222.3    4.5    0.0000   0.0000          ?        ?   494.2158  19.7942          ?        ?      222.3        4.5       ?       ? 
1 1 1   15    1   55 o    551.7    2.7    0.0000   0.0000          ?        ?  3043.8328  30.0105          ?        ?      551.7        2.7       ?       ? 
1 1 1   15    1   56 o    640.1    2.7    0.0000   0.0000          ?        ?  4098.0317  35.1187          ?        ?      640.1        2.7       ?       ? 
1 1 1   15    1   57 o    204.8    4.5    0.0000   0.0000          ?        ?   419.5087  18.5171          ?        ?      204.8        4.5       ?       ? 
1 1 1   15    1   58 o    194.5    5.3    0.0000   0.0000          ?        ?   378.6433  20.4327          ?        ?      194.5        5.3       ?       ? 
1 1 1   15    1   59 o    435.1    2.8    0.0000   0.0000          ?        ?  1893.8552  24.2638          ?        ?      435.1        2.8       ?       ? 
1 1 1   15    1   60 o    262.9    3.8    0.0000   0.0000          ?        ?   691.5189  19.7942          ?        ?      262.9        3.8       ?       ? 
1 1 1   15    1   61 o    208.9    4.6    0.0000   0.0000          ?        ?   436.7488  19.1556          ?        ?      208.9        4.6       ?       ? 
1 1 1   15    1   62 o    355.9    3.1    0.0000   0.0000          ?        ?  1266.8269  21.7097          ?        ?      355.9        3.1       ?       ? 
1 1 1   15    1   63 o    154.6    6.2    0.0000   0.0000          ?        ?   239.4456  19.1556          ?        ?      154.6        6.2       ?       ? 
1 1 1   15    1   64 o     70.7   14.5    0.0000   0.0000          ?        ?    52.3588  19.7942          ?        ?       70.7       14.5       ?       ? 
1 1 1   15    1   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    1   66 o     65.2   15.0    0.0000   0.0000          ?        ?    44.6965  19.1556          ?        ?       65.2       15.0       ?       ? 
1 1 1   15    1   67 o    360.0    3.2    0.0000   0.0000          ?        ?  1296.8374  22.9868          ?        ?      360.0        3.2       ?       ? 
1 1 1   15    1   68 o    437.0    2.9    0.0000   0.0000          ?        ?  1911.0951  25.5409          ?        ?      437.0        2.9       ?       ? 
1 1 1   15    1   69 o    101.3   10.4    0.0000   0.0000          ?        ?   103.4405  21.0712          ?        ?      101.3       10.4       ?       ? 
1 1 1   15    1   70 o    117.7    8.7    0.0000   0.0000          ?        ?   139.1977  20.4327          ?        ?      117.7        8.7       ?       ? 
1 1 1   15    1   71 o     31.8   14.5    0.0000   0.0000          ?        ?   -12.7704  20.4327          ?        ?       31.8       14.5       ?       ? 
1 1 1   15    1   72 o    122.9    8.6    0.0000   0.0000          ?        ?   151.9681  21.0712          ?        ?      122.9        8.6       ?       ? 
1 1 1   15    1   73 o    190.8    5.7    0.0000   0.0000          ?        ?   365.2344  21.7097          ?        ?      190.8        5.7       ?       ? 
1 1 1   15    1   74 o    195.9    5.7    0.0000   0.0000          ?        ?   385.0285  22.3483          ?        ?      195.9        5.7       ?       ? 
1 1 1   15    1   75 o    182.9    6.3    0.0000   0.0000          ?        ?   335.8624  22.9868          ?        ?      182.9        6.3       ?       ? 
1 1 1   15    1   76 o    148.2    7.1    0.0000   0.0000          ?        ?   220.9285  21.0712          ?        ?      148.2        7.1       ?       ? 
1 1 1   15    1   77 o    112.6    9.6    0.0000   0.0000          ?        ?   128.3428  21.7097          ?        ?      112.6        9.6       ?       ? 
1 1 1   15    1   78 o     35.5   15.8    0.0000   0.0000          ?        ?    -6.3852  22.3483          ?        ?       35.5       15.8       ?       ? 
1 1 1   15    1   79 o     79.4   14.2    0.0000   0.0000          ?        ?    67.0448  21.7097          ?        ?       79.4       14.2       ?       ? 
1 1 1   15    1   80 o    129.2    8.2    0.0000   0.0000          ?        ?   169.2082  21.0712          ?        ?      129.2        8.2       ?       ? 
1 1 1   15    2    0 o   1672.0    7.8 27960.8613 259.8783 27960.8613 259.8783 27960.8613 259.8783     1672.0      7.8     1672.0        7.8     0.0     0.0 
1 1 1   15    2    1 o    671.6    2.5    0.0000   0.0000          ?        ?  4511.1553  33.2031          ?        ?      671.6        2.5       ?       ? 
1 1 1   15    2    2 o    832.2    2.9    0.0000   0.0000          ?        ?  6926.0439  48.5276          ?        ?      832.2        2.9       ?       ? 
1 1 1   15    2    3 o    318.5    1.4    0.0000   0.0000          ?        ?  1014.6108   8.9393          ?        ?      318.5        1.4       ?       ? 
1 1 1   15    2    4 o   1636.6    5.3    0.0000   0.0000          ?        ? 26786.6211 174.3164          ?        ?     1636.6        5.3       ?       ? 
1 1 1   15    2    5 o   1828.0    5.9    0.0000   0.0000          ?        ? 33418.9453 216.4588          ?        ?     1828.0        5.9       ?       ? 
1 1 1   15    2    6 o    853.3    3.0    0.0000   0.0000          ?        ?  7281.0625  50.4432          ?        ?      853.3        3.0       ?       ? 
1 1 1   15    2    7 o    957.3    3.3    0.0000   0.0000          ?        ?  9164.0625  62.5751          ?        ?      957.3        3.3       ?       ? 
1 1 1   15    2    8 o    659.7    2.4    0.0000   0.0000          ?        ?  4351.5249  31.9261          ?        ?      659.7        2.4       ?       ? 
1 1 1   15    2    9 o    623.2    2.3    0.0000   0.0000          ?        ?  3883.4885  28.7335          ?        ?      623.2        2.3       ?       ? 
1 1 1   15    2   10 o    441.5    1.8    0.0000   0.0000          ?        ?  1949.4065  15.9630          ?        ?      441.5        1.8       ?       ? 
1 1 1   15    2   11 o   1413.1    4.7    0.0000   0.0000          ?        ? 19969.7637 132.1740          ?        ?     1413.1        4.7       ?       ? 
1 1 1   15    2   12 o   1252.4    4.2    0.0000   0.0000          ?        ? 15686.5605 104.7175          ?        ?     1252.4        4.2       ?       ? 
1 1 1   15    2   13 o    680.1    2.5    0.0000   0.0000          ?        ?  4626.0894  33.8416          ?        ?      680.1        2.5       ?       ? 
1 1 1   15    2   14 o   1256.2    4.2    0.0000   0.0000          ?        ? 15781.7012 105.9946          ?        ?     1256.2        4.2       ?       ? 
1 1 1   15    2   15 o    689.6    2.5    0.0000   0.0000          ?        ?  4755.0708  34.4802          ?        ?      689.6        2.5       ?       ? 
1 1 1   15    2   16 o   1357.2    4.5    0.0000   0.0000          ?        ? 18422.6250 122.5962          ?        ?     1357.2        4.5       ?       ? 
1 1 1   15    2   17 o    900.8    3.3    0.0000   0.0000          ?        ?  8114.3330  59.3825          ?        ?      900.8        3.3       ?       ? 
1 1 1   15    2   18 o    993.9    3.5    0.0000   0.0000          ?        ?  9878.5684  68.9603          ?        ?      993.9        3.5       ?       ? 
1 1 1   15    2   19 o   1298.3    4.4    0.0000   0.0000          ?        ? 16856.9707 113.0183          ?        ?     1298.3        4.4       ?       ? 
1 1 1   15    2   20 o    702.2    2.6    0.0000   0.0000          ?        ?  4931.3022  36.3957          ?        ?      702.2        2.6       ?       ? 
1 1 1   15    2   21 o    895.3    3.2    0.0000   0.0000          ?        ?  8015.3623  56.8284          ?        ?      895.3        3.2       ?       ? 
1 1 1   15    2   22 o   1591.6    5.3    0.0000   0.0000          ?        ? 25334.6230 167.2927          ?        ?     1591.6        5.3       ?       ? 
1 1 1   15    2   23 o    718.1    2.7    0.0000   0.0000          ?        ?  5157.3394  38.9498          ?        ?      718.1        2.7       ?       ? 
1 1 1   15    2   24 o     56.5    8.5    0.0000   0.0000          ?        ?    31.9261   9.5778          ?        ?       56.5        8.5       ?       ? 
1 1 1   15    2   25 o    566.1    2.4    0.0000   0.0000          ?        ?  3204.7400  26.8179          ?        ?      566.1        2.4       ?       ? 
1 1 1   15    2   26 o   1574.3    5.3    0.0000   0.0000          ?        ? 24786.7695 166.6541          ?        ?     1574.3        5.3       ?       ? 
1 1 1   15    2   27 o    704.0    2.7    0.0000   0.0000          ?        ?  4955.5664  37.6728          ?        ?      704.0        2.7       ?       ? 
1 1 1   15    2   28 f   1878.8    6.3    0.0000   0.0000          ?        ? 35303.2227 234.9760          ?        ?     1878.8        6.3       ?       ? 
1 1 1   15    2   29 o   1043.6    4.0    0.0000   0.0000          ?        ? 10892.5410  84.2849          ?        ?     1043.6        4.0       ?       ? 
1 1 1   15    2   30 o    776.1    3.1    0.0000   0.0000          ?        ?  6023.1743  47.8891          ?        ?      776.1        3.1       ?       ? 
1 1 1   15    2   31 o    498.5    2.4    0.0000   0.0000          ?        ?  2485.1262  24.2638          ?        ?      498.5        2.4       ?       ? 
1 1 1   15    2   32 o   1461.9    5.0    0.0000   0.0000          ?        ? 21373.8730 144.9444          ?        ?     1461.9        5.0       ?       ? 
1 1 1   15    2   33 o   1214.6    4.4    0.0000   0.0000          ?        ? 14753.6816 107.2716          ?        ?     1214.6        4.4       ?       ? 
1 1 1   15    2   34 o    991.5    3.8    0.0000   0.0000          ?        ?  9831.3174  75.9841          ?        ?      991.5        3.8       ?       ? 
1 1 1   15    2   35 o    858.0    3.3    0.0000   0.0000          ?        ?  7362.7925  57.4669          ?        ?      858.0        3.3       ?       ? 
1 1 1   15    2   36 o    407.4    2.6    0.0000   0.0000          ?        ?  1660.1562  21.0712          ?        ?      407.4        2.6       ?       ? 
1 1 1   15    2   37 o    830.8    3.2    0.0000   0.0000          ?        ?  6903.0571  53.6358          ?        ?      830.8        3.2       ?       ? 
1 1 1   15    2   38 o    837.9    3.2    0.0000   0.0000          ?        ?  7021.8218  52.9973          ?        ?      837.9        3.2       ?       ? 
1 1 1   15    2   39 o    684.0    2.9    0.0000   0.0000          ?        ?  4678.4482  39.5883          ?        ?      684.0        2.9       ?       ? 
1 1 1   15    2   40 o    679.2    2.9    0.0000   0.0000          ?        ?  4613.3188  38.9498          ?        ?      679.2        2.9       ?       ? 
1 1 1   15    2   41 o    657.2    2.8    0.0000   0.0000          ?        ?  4318.9604  36.3957          ?        ?      657.2        2.8       ?       ? 
1 1 1   15    2   42 o    635.5    3.4    0.0000   0.0000          ?        ?  4038.6492  42.7809          ?        ?      635.5        3.4       ?       ? 
1 1 1   15    2   43 f    829.6    3.3    0.0000   0.0000          ?        ?  6883.2632  54.2743          ?        ?      829.6        3.3       ?       ? 
1 1 1   15    2   44 o    316.3    3.1    0.0000   0.0000          ?        ?  1000.5634  19.7942          ?        ?      316.3        3.1       ?       ? 
1 1 1   15    2   45 o    545.8    2.7    0.0000   0.0000          ?        ?  2978.7034  29.3720          ?        ?      545.8        2.7       ?       ? 
1 1 1   15    2   46 o    384.0    3.0    0.0000   0.0000          ?        ?  1474.3464  22.9868          ?        ?      384.0        3.0       ?       ? 
1 1 1   15    2   47 o    542.1    2.7    0.0000   0.0000          ?        ?  2938.4766  28.7335          ?        ?      542.1        2.7       ?       ? 
1 1 1   15    2   48 o    207.6    4.9    0.0000   0.0000          ?        ?   431.0021  20.4327          ?        ?      207.6        4.9       ?       ? 
1 1 1   15    2   49 o    733.9    3.0    0.0000   0.0000          ?        ?  5386.5684  44.0580          ?        ?      733.9        3.0       ?       ? 
1 1 1   15    2   50 o    398.3    3.0    0.0000   0.0000          ?        ?  1586.7262  23.6253          ?        ?      398.3        3.0       ?       ? 
1 1 1   15    2   51 o    531.3    2.9    0.0000   0.0000          ?        ?  2823.5427  30.6490          ?        ?      531.3        2.9       ?       ? 
1 1 1   15    2   52 o    706.2    2.8    0.0000   0.0000          ?        ?  4988.1309  40.2269          ?        ?      706.2        2.8       ?       ? 
1 1 1   15    2   53 o    700.0    2.9    0.0000   0.0000          ?        ?  4900.6533  40.8654          ?        ?      700.0        2.9       ?       ? 
1 1 1   15    2   54 o    366.2    3.0    0.0000   0.0000          ?        ?  1341.5339  21.7097          ?        ?      366.2        3.0       ?       ? 
1 1 1   15    2   55 o    147.7    6.9    0.0000   0.0000          ?        ?   218.3744  20.4327          ?        ?      147.7        6.9       ?       ? 
1 1 1   15    2   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    2   57 o    641.9    2.8    0.0000   0.0000          ?        ?  4121.0186  36.3957          ?        ?      641.9        2.8       ?       ? 
1 1 1   15    2   58 o    407.9    2.9    0.0000   0.0000          ?        ?  1663.9874  23.6253          ?        ?      407.9        2.9       ?       ? 
1 1 1   15    2   59 o    453.4    3.0    0.0000   0.0000          ?        ?  2056.6782  26.8179          ?        ?      453.4        3.0       ?       ? 
1 1 1   15    2   60 o    110.0    8.7    0.0000   0.0000          ?        ?   121.3191  19.1556          ?        ?      110.0        8.7       ?       ? 
1 1 1   15    2   61 o    349.2    3.2    0.0000   0.0000          ?        ?  1219.5763  22.3483          ?        ?      349.2        3.2       ?       ? 
1 1 1   15    2   62 f    112.8    8.5    0.0000   0.0000          ?        ?   127.7043  19.1556          ?        ?      112.8        8.5       ?       ? 
1 1 1   15    2   63 o     29.2   13.6    0.0000   0.0000          ?        ?   -17.2401  19.1556          ?        ?       29.2       13.6       ?       ? 
1 1 1   15    2   64 o    293.0    3.6    0.0000   0.0000          ?        ?   858.8116  21.0712          ?        ?      293.0        3.6       ?       ? 
1 1 1   15    2   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    2   66 o    130.1    8.1    0.0000   0.0000          ?        ?   169.8468  21.0712          ?        ?      130.1        8.1       ?       ? 
1 1 1   15    2   67 o     21.7   10.9    0.0000   0.0000          ?        ?   -59.3825  20.4327          ?        ?       21.7       10.9       ?       ? 
1 1 1   15    2   68 o    226.8    4.8    0.0000   0.0000          ?        ?   515.2869  21.7097          ?        ?      226.8        4.8       ?       ? 
1 1 1   15    2   69 o    125.0    8.4    0.0000   0.0000          ?        ?   157.0763  21.0712          ?        ?      125.0        8.4       ?       ? 
1 1 1   15    2   70 o    322.0    3.6    0.0000   0.0000          ?        ?  1037.5977  22.9868          ?        ?      322.0        3.6       ?       ? 
1 1 1   15    2   71 o    337.4    3.6    0.0000   0.0000          ?        ?  1139.7611  24.2638          ?        ?      337.4        3.6       ?       ? 
1 1 1   15    2   72 o    124.7    8.4    0.0000   0.0000          ?        ?   156.4378  21.0712          ?        ?      124.7        8.4       ?       ? 
1 1 1   15    2   73 o    229.1    5.2    0.0000   0.0000          ?        ?   526.1418  23.6253          ?        ?      229.1        5.2       ?       ? 
1 1 1   15    2   74 o    272.0    4.1    0.0000   0.0000          ?        ?   741.3236  22.3483          ?        ?      272.0        4.1       ?       ? 
1 1 1   15    2   75 o    105.6   10.9    0.0000   0.0000          ?        ?   113.0183  22.9868          ?        ?      105.6       10.9       ?       ? 
1 1 1   15    2   76 o    241.2    4.4    0.0000   0.0000          ?        ?   582.9703  21.0712          ?        ?      241.2        4.4       ?       ? 
1 1 1   15    2   77 o     64.8   16.7    0.0000   0.0000          ?        ?    45.3350  21.7097          ?        ?       64.8       16.7       ?       ? 
1 1 1   15    2   78 o     21.5   10.9    0.0000   0.0000          ?        ?   -68.3218  21.7097          ?        ?       21.5       10.9       ?       ? 
1 1 1   15    2   79 o     76.0   14.8    0.0000   0.0000          ?        ?    61.9366  21.7097          ?        ?       76.0       14.8       ?       ? 
1 1 1   15    2   80 o    101.4   10.7    0.0000   0.0000          ?        ?   105.3561  21.7097          ?        ?      101.4       10.7       ?       ? 
1 1 1   15    3    0 o    102.8    2.8  105.9946   5.7467   105.9946   5.7467   105.9946   5.7467      102.8      2.8      102.8        2.8     0.0     0.0 
1 1 1   15    3    1 o    826.5    2.9    0.0000   0.0000          ?        ?  6830.9048  47.8891          ?        ?      826.5        2.9       ?       ? 
1 1 1   15    3    2 o    483.6    1.9    0.0000   0.0000          ?        ?  2338.2664  18.5171          ?        ?      483.6        1.9       ?       ? 
1 1 1   15    3    3 o    533.8    2.1    0.0000   0.0000          ?        ?  2849.0835  22.3483          ?        ?      533.8        2.1       ?       ? 
1 1 1   15    3    4 o   1055.3    3.6    0.0000   0.0000          ?        ? 11137.0938  75.3456          ?        ?     1055.3        3.6       ?       ? 
1 1 1   15    3    5 o    772.8    2.7    0.0000   0.0000          ?        ?  5972.0928  42.1424          ?        ?      772.8        2.7       ?       ? 
1 1 1   15    3    6 o    636.2    2.3    0.0000   0.0000          ?        ?  4047.5889  29.3720          ?        ?      636.2        2.3       ?       ? 
1 1 1   15    3    7 o    635.5    2.3    0.0000   0.0000          ?        ?  4039.2876  29.3720          ?        ?      635.5        2.3       ?       ? 
1 1 1   15    3    8 o   1006.2    3.3    0.0000   0.0000          ?        ? 10125.6758  67.0448          ?        ?     1006.2        3.3       ?       ? 
1 1 1   15    3    9 o    620.2    2.3    0.0000   0.0000          ?        ?  3846.4543  28.0950          ?        ?      620.2        2.3       ?       ? 
1 1 1   15    3   10 o    544.1    2.1    0.0000   0.0000          ?        ?  2960.1863  22.9868          ?        ?      544.1        2.1       ?       ? 
1 1 1   15    3   11 o    912.6    3.2    0.0000   0.0000          ?        ?  8328.8760  58.1055          ?        ?      912.6        3.2       ?       ? 
1 1 1   15    3   12 o   1376.7    4.6    0.0000   0.0000          ?        ? 18954.5137 125.7888          ?        ?     1376.7        4.6       ?       ? 
1 1 1   15    3   13 o   1132.1    3.8    0.0000   0.0000          ?        ? 12818.3213  86.8389          ?        ?     1132.1        3.8       ?       ? 
1 1 1   15    3   14 o    562.6    2.2    0.0000   0.0000          ?        ?  3165.1519  24.2638          ?        ?      562.6        2.2       ?       ? 
1 1 1   15    3   15 o   1279.2    4.3    0.0000   0.0000          ?        ? 16364.6699 109.1872          ?        ?     1279.2        4.3       ?       ? 
1 1 1   15    3   16 o   1549.2    5.2    0.0000   0.0000          ?        ? 24002.6680 161.5460          ?        ?     1549.2        5.2       ?       ? 
1 1 1   15    3   17 o    125.3    2.3    0.0000   0.0000          ?        ?   157.0763   5.7467          ?        ?      125.3        2.3       ?       ? 
1 1 1   15    3   18 o    834.3    2.9    0.0000   0.0000          ?        ?  6960.5239  49.1662          ?        ?      834.3        2.9       ?       ? 
1 1 1   15    3   19 o    418.2    2.0    0.0000   0.0000          ?        ?  1748.9106  16.6016          ?        ?      418.2        2.0       ?       ? 
1 1 1   15    3   20 o    744.3    2.7    0.0000   0.0000          ?        ?  5539.8135  40.8654          ?        ?      744.3        2.7       ?       ? 
1 1 1   15    3   21 o    792.6    2.9    0.0000   0.0000          ?        ?  6283.0527  45.9736          ?        ?      792.6        2.9       ?       ? 
1 1 1   15    3   22 o    873.9    3.1    0.0000   0.0000          ?        ?  7637.9956  54.2743          ?        ?      873.9        3.1       ?       ? 
1 1 1   15    3   23 o     51.6    9.6    0.0000   0.0000          ?        ?    27.4564   9.5778          ?        ?       51.6        9.6       ?       ? 
1 1 1   15    3   24 o   1148.0    3.9    0.0000   0.0000          ?        ? 13179.7256  90.6701          ?        ?     1148.0        3.9       ?       ? 
1 1 1   15    3   25 o   1241.5    4.6    0.0000   0.0000          ?        ? 15413.2725 114.2954          ?        ?     1241.5        4.6       ?       ? 
1 1 1   15    3   26 o    363.7    2.3    0.0000   0.0000          ?        ?  1323.0168  16.6016          ?        ?      363.7        2.3       ?       ? 
1 1 1   15    3   27 f   1701.6    5.7    0.0000   0.0000          ?        ? 28956.9551 194.1106          ?        ?     1701.6        5.7       ?       ? 
1 1 1   15    3   28 o   2050.7    7.3    0.0000   0.0000          ?        ? 42060.6992 298.8281          ?        ?     2050.7        7.3       ?       ? 
1 1 1   15    3   29 o    488.9    2.4    0.0000   0.0000          ?        ?  2389.9863  22.9868          ?        ?      488.9        2.4       ?       ? 
1 1 1   15    3   30 o   1125.8    4.1    0.0000   0.0000          ?        ? 12675.9307  91.3086          ?        ?     1125.8        4.1       ?       ? 
1 1 1   15    3   31 o    928.7    3.5    0.0000   0.0000          ?        ?  8625.7891  65.7677          ?        ?      928.7        3.5       ?       ? 
1 1 1   15    3   32 o    158.0    5.5    0.0000   0.0000          ?        ?   249.6619  17.2401          ?        ?      158.0        5.5       ?       ? 
1 1 1   15    3   33 o    992.7    3.9    0.0000   0.0000          ?        ?  9855.5811  77.2611          ?        ?      992.7        3.9       ?       ? 
1 1 1   15    3   34 f   1200.8    4.4    0.0000   0.0000          ?        ? 14419.7344 105.9946          ?        ?     1200.8        4.4       ?       ? 
1 1 1   15    3   35 f    855.1    3.4    0.0000   0.0000          ?        ?  7312.3491  57.4669          ?        ?      855.1        3.4       ?       ? 
1 1 1   15    3   36 o   1324.0    4.6    0.0000   0.0000          ?        ? 17532.5273 122.5962          ?        ?     1324.0        4.6       ?       ? 
1 1 1   15    3   37 o   1093.0    3.9    0.0000   0.0000          ?        ? 11946.7393  84.2849          ?        ?     1093.0        3.9       ?       ? 
1 1 1   15    3   38 f    474.1    2.8    0.0000   0.0000          ?        ?  2247.5962  26.8179          ?        ?      474.1        2.8       ?       ? 
1 1 1   15    3   39 o    418.6    2.9    0.0000   0.0000          ?        ?  1752.7418  24.2638          ?        ?      418.6        2.9       ?       ? 
1 1 1   15    3   40 o   1844.4    6.1    0.0000   0.0000          ?        ? 34024.2656 223.4826          ?        ?     1844.4        6.1       ?       ? 
1 1 1   15    3   41 o    548.0    3.0    0.0000   0.0000          ?        ?  3003.6057  32.5646          ?        ?      548.0        3.0       ?       ? 
1 1 1   15    3   42 o    882.0    3.3    0.0000   0.0000          ?        ?  7779.7476  58.1055          ?        ?      882.0        3.3       ?       ? 
1 1 1   15    3   43 o    994.7    3.6    0.0000   0.0000          ?        ?  9895.8086  70.8759          ?        ?      994.7        3.6       ?       ? 
1 1 1   15    3   44 o   1229.2    4.3    0.0000   0.0000          ?        ? 15110.6143 105.9946          ?        ?     1229.2        4.3       ?       ? 
1 1 1   15    3   45 o    315.5    3.4    0.0000   0.0000          ?        ?   995.4552  21.7097          ?        ?      315.5        3.4       ?       ? 
1 1 1   15    3   46 o    323.5    3.3    0.0000   0.0000          ?        ?  1046.5369  21.0712          ?        ?      323.5        3.3       ?       ? 
1 1 1   15    3   47 o    540.2    2.7    0.0000   0.0000          ?        ?  2918.0439  28.7335          ?        ?      540.2        2.7       ?       ? 
1 1 1   15    3   48 o    980.2    3.6    0.0000   0.0000          ?        ?  9610.3887  70.8759          ?        ?      980.2        3.6       ?       ? 
1 1 1   15    3   49 f    240.8    4.1    0.0000   0.0000          ?        ?   579.7776  19.7942          ?        ?      240.8        4.1       ?       ? 
1 1 1   15    3   50 o    952.8    3.6    0.0000   0.0000          ?        ?  9079.7773  67.6833          ?        ?      952.8        3.6       ?       ? 
1 1 1   15    3   51 o    286.0    3.7    0.0000   0.0000          ?        ?   817.9462  21.0712          ?        ?      286.0        3.7       ?       ? 
1 1 1   15    3   52 o    831.2    3.1    0.0000   0.0000          ?        ?  6910.0806  52.3588          ?        ?      831.2        3.1       ?       ? 
1 1 1   15    3   53 o    402.4    3.0    0.0000   0.0000          ?        ?  1619.9293  24.2638          ?        ?      402.4        3.0       ?       ? 
1 1 1   15    3   54 o    125.8    7.1    0.0000   0.0000          ?        ?   158.3534  17.8786          ?        ?      125.8        7.1       ?       ? 
1 1 1   15    3   55 o    281.8    3.5    0.0000   0.0000          ?        ?   794.3209  19.7942          ?        ?      281.8        3.5       ?       ? 
1 1 1   15    3   56 o    283.7    3.6    0.0000   0.0000          ?        ?   805.1758  20.4327          ?        ?      283.7        3.6       ?       ? 
1 1 1   15    3   57 o    430.6    2.7    0.0000   0.0000          ?        ?  1854.2667  23.6253          ?        ?      430.6        2.7       ?       ? 
1 1 1   15    3   58 o     37.8   15.4    0.0000   0.0000          ?        ?     5.1082  18.5171          ?        ?       37.8       15.4       ?       ? 
1 1 1   15    3   59 o    500.2    2.7    0.0000   0.0000          ?        ?  2503.0049  26.8179          ?        ?      500.2        2.7       ?       ? 
1 1 1   15    3   60 o    398.0    2.9    0.0000   0.0000          ?        ?  1584.1722  22.9868          ?        ?      398.0        2.9       ?       ? 
1 1 1   15    3   61 o     44.6   16.6    0.0000   0.0000          ?        ?    15.3245  19.7942          ?        ?       44.6       16.6       ?       ? 
1 1 1   15    3   62 o    226.1    4.2    0.0000   0.0000          ?        ?   511.4558  19.1556          ?        ?      226.1        4.2       ?       ? 
1 1 1   15    3   63 o    204.5    4.8    0.0000   0.0000          ?        ?   418.8702  19.7942          ?        ?      204.5        4.8       ?       ? 
1 1 1   15    3   64 o    189.3    5.1    0.0000   0.0000          ?        ?   358.8492  19.1556          ?        ?      189.3        5.1       ?       ? 
1 1 1   15    3   65 o    277.6    3.6    0.0000   0.0000          ?        ?   771.3342  19.7942          ?        ?      277.6        3.6       ?       ? 
1 1 1   15    3   66 o     27.9   13.4    0.0000   0.0000          ?        ?   -28.7335  21.0712          ?        ?       27.9       13.4       ?       ? 
1 1 1   15    3   67 o    435.7    3.0    0.0000   0.0000          ?        ?  1899.6018  26.1794          ?        ?      435.7        3.0       ?       ? 
1 1 1   15    3   68 o    262.7    4.3    0.0000   0.0000          ?        ?   690.8804  22.3483          ?        ?      262.7        4.3       ?       ? 
1 1 1   15    3   69 o    104.7   10.1    0.0000   0.0000          ?        ?   110.4642  21.0712          ?        ?      104.7       10.1       ?       ? 
1 1 1   15    3   70 o    205.7    5.3    0.0000   0.0000          ?        ?   423.9784  21.7097          ?        ?      205.7        5.3       ?       ? 
1 1 1   15    3   71 o    304.4    3.7    0.0000   0.0000          ?        ?   927.7720  22.3483          ?        ?      304.4        3.7       ?       ? 
1 1 1   15    3   72 o     48.8   17.7    0.0000   0.0000          ?        ?    20.4327  22.3483          ?        ?       48.8       17.7       ?       ? 
1 1 1   15    3   73 o    284.6    3.9    0.0000   0.0000          ?        ?   810.9225  22.3483          ?        ?      284.6        3.9       ?       ? 
1 1 1   15    3   74 o    103.0   10.5    0.0000   0.0000          ?        ?   107.2716  21.7097          ?        ?      103.0       10.5       ?       ? 
1 1 1   15    3   75 o     47.5   17.2    0.0000   0.0000          ?        ?    19.7942  21.0712          ?        ?       47.5       17.2       ?       ? 
1 1 1   15    3   76 o    243.1    4.7    0.0000   0.0000          ?        ?   592.5481  22.9868          ?        ?      243.1        4.7       ?       ? 
1 1 1   15    3   77 o    121.6    8.1    0.0000   0.0000          ?        ?   149.4141  19.7942          ?        ?      121.6        8.1       ?       ? 
1 1 1   15    3   78 o     28.7   13.5    0.0000   0.0000          ?        ?   -19.7942  19.7942          ?        ?       28.7       13.5       ?       ? 
1 1 1   15    3   79 o     87.2   11.7    0.0000   0.0000          ?        ?    77.8996  20.4327          ?        ?       87.2       11.7       ?       ? 
1 1 1   15    3   80 o     49.1   17.5    0.0000   0.0000          ?        ?    22.9868  21.7097          ?        ?       49.1       17.5       ?       ? 
1 1 1   15    4    0 o    300.0    2.1  900.3155  12.7704   900.3155  12.7704   900.3155  12.7704      300.0      2.1      300.0        2.1     0.0     0.0 
1 1 1   15    4    1 o    726.7    2.6    0.0000   0.0000          ?        ?  5281.2124  38.3113          ?        ?      726.7        2.6       ?       ? 
1 1 1   15    4    2 o    934.5    3.2    0.0000   0.0000          ?        ?  8733.6992  60.6596          ?        ?      934.5        3.2       ?       ? 
1 1 1   15    4    3 o   1128.1    3.8    0.0000   0.0000          ?        ? 12725.7363  86.2004          ?        ?     1128.1        3.8       ?       ? 
1 1 1   15    4    4 o    116.6    1.6    0.0000   0.0000          ?        ?   136.0051   3.8311          ?        ?      116.6        1.6       ?       ? 
1 1 1   15    4    5 f    637.7    2.3    0.0000   0.0000          ?        ?  4066.1057  29.3720          ?        ?      637.7        2.3       ?       ? 
1 1 1   15    4    6 o   1252.8    4.2    0.0000   0.0000          ?        ? 15695.5010 104.7175          ?        ?     1252.8        4.2       ?       ? 
1 1 1   15    4    7 o    665.6    2.4    0.0000   0.0000          ?        ?  4430.7017  31.9261          ?        ?      665.6        2.4       ?       ? 
1 1 1   15    4    8 o    547.6    2.0    0.0000   0.0000          ?        ?  2998.4976  22.3483          ?        ?      547.6        2.0       ?       ? 
1 1 1   15    4    9 o    766.0    2.7    0.0000   0.0000          ?        ?  5867.3755  41.5039          ?        ?      766.0        2.7       ?       ? 
1 1 1   15    4   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    4   11 o    584.6    2.2    0.0000   0.0000          ?        ?  3417.3679  26.1794          ?        ?      584.6        2.2       ?       ? 
1 1 1   15    4   12 o    415.7    1.8    0.0000   0.0000          ?        ?  1727.8396  14.6860          ?        ?      415.7        1.8       ?       ? 
1 1 1   15    4   13 o    427.1    1.9    0.0000   0.0000          ?        ?  1824.2563  15.9630          ?        ?      427.1        1.9       ?       ? 
1 1 1   15    4   14 o    961.5    3.3    0.0000   0.0000          ?        ?  9245.7930  63.8522          ?        ?      961.5        3.3       ?       ? 
1 1 1   15    4   15 o    573.4    2.3    0.0000   0.0000          ?        ?  3287.7480  26.1794          ?        ?      573.4        2.3       ?       ? 
1 1 1   15    4   16 o    947.9    3.3    0.0000   0.0000          ?        ?  8986.5537  61.9366          ?        ?      947.9        3.3       ?       ? 
1 1 1   15    4   17 o    541.3    2.1    0.0000   0.0000          ?        ?  2930.1758  22.9868          ?        ?      541.3        2.1       ?       ? 
1 1 1   15    4   18 o    586.0    2.3    0.0000   0.0000          ?        ?  3434.6079  26.8179          ?        ?      586.0        2.3       ?       ? 
1 1 1   15    4   19 o    609.8    2.4    0.0000   0.0000          ?        ?  3718.1113  28.7335          ?        ?      609.8        2.4       ?       ? 
1 1 1   15    4   20 o   1619.3    5.4    0.0000   0.0000          ?        ? 26225.9980 173.6779          ?        ?     1619.3        5.4       ?       ? 
1 1 1   15    4   21 o    596.1    2.5    0.0000   0.0000          ?        ?  3553.3728  29.3720          ?        ?      596.1        2.5       ?       ? 
1 1 1   15    4   22 o    326.0    2.2    0.0000   0.0000          ?        ?  1062.5000  14.0475          ?        ?      326.0        2.2       ?       ? 
1 1 1   15    4   23 o   1551.5    5.2    0.0000   0.0000          ?        ? 24074.8184 160.2689          ?        ?     1551.5        5.2       ?       ? 
1 1 1   15    4   24 o    219.6    2.6    0.0000   0.0000          ?        ?   482.0838  11.4934          ?        ?      219.6        2.6       ?       ? 
1 1 1   15    4   25 o   1272.5    4.5    0.0000   0.0000          ?        ? 16194.8242 114.2954          ?        ?     1272.5        4.5       ?       ? 
1 1 1   15    4   26 o   2164.3    7.1    0.0000   0.0000          ?        ? 46847.6914 307.7674          ?        ?     2164.3        7.1       ?       ? 
1 1 1   15    4   27 o   1337.9    4.7    0.0000   0.0000          ?        ? 17900.3145 126.4273          ?        ?     1337.9        4.7       ?       ? 
1 1 1   15    4   28 o    330.2    2.8    0.0000   0.0000          ?        ?  1090.5950  18.5171          ?        ?      330.2        2.8       ?       ? 
1 1 1   15    4   29 o    748.2    3.0    0.0000   0.0000          ?        ?  5598.5576  44.6965          ?        ?      748.2        3.0       ?       ? 
1 1 1   15    4   30 o   1142.8    4.1    0.0000   0.0000          ?        ? 13060.9600  94.5012          ?        ?     1142.8        4.1       ?       ? 
1 1 1   15    4   31 f   1051.4    3.9    0.0000   0.0000          ?        ? 11054.7256  82.3693          ?        ?     1051.4        3.9       ?       ? 
1 1 1   15    4   32 o   1080.3    3.8    0.0000   0.0000          ?        ? 11670.8984  83.0078          ?        ?     1080.3        3.8       ?       ? 
1 1 1   15    4   33 o   1257.2    4.5    0.0000   0.0000          ?        ? 15807.2422 113.6568          ?        ?     1257.2        4.5       ?       ? 
1 1 1   15    4   34 o    475.4    2.6    0.0000   0.0000          ?        ?  2259.7280  24.2638          ?        ?      475.4        2.6       ?       ? 
1 1 1   15    4   35 o   1193.8    4.6    0.0000   0.0000          ?        ? 14252.4414 109.1872          ?        ?     1193.8        4.6       ?       ? 
1 1 1   15    4   36 o    500.3    2.5    0.0000   0.0000          ?        ?  2503.0049  24.9023          ?        ?      500.3        2.5       ?       ? 
1 1 1   15    4   37 o   1402.3    4.7    0.0000   0.0000          ?        ? 19666.4668 131.5355          ?        ?     1402.3        4.7       ?       ? 
1 1 1   15    4   38 o    761.8    3.2    0.0000   0.0000          ?        ?  5804.1616  48.5276          ?        ?      761.8        3.2       ?       ? 
1 1 1   15    4   39 f    488.7    2.6    0.0000   0.0000          ?        ?  2388.0708  25.5409          ?        ?      488.7        2.6       ?       ? 
1 1 1   15    4   40 o    694.6    2.9    0.0000   0.0000          ?        ?  4824.6694  40.2269          ?        ?      694.6        2.9       ?       ? 
1 1 1   15    4   41 o     20.9   10.6    0.0000   0.0000          ?        ?   -80.4537  22.3483          ?        ?       20.9       10.6       ?       ? 
1 1 1   15    4   42 o    892.0    3.4    0.0000   0.0000          ?        ?  7957.8955  60.0210          ?        ?      892.0        3.4       ?       ? 
1 1 1   15    4   43 o    406.8    2.8    0.0000   0.0000          ?        ?  1655.0481  22.9868          ?        ?      406.8        2.8       ?       ? 
1 1 1   15    4   44 f   1050.1    3.7    0.0000   0.0000          ?        ? 11027.9072  77.8996          ?        ?     1050.1        3.7       ?       ? 
1 1 1   15    4   45 o    900.2    3.4    0.0000   0.0000          ?        ?  8104.1162  61.9366          ?        ?      900.2        3.4       ?       ? 
1 1 1   15    4   46 o    402.0    3.0    0.0000   0.0000          ?        ?  1616.0983  24.2638          ?        ?      402.0        3.0       ?       ? 
1 1 1   15    4   47 o    437.3    2.8    0.0000   0.0000          ?        ?  1912.3723  24.2638          ?        ?      437.3        2.8       ?       ? 
1 1 1   15    4   48 o    633.9    2.8    0.0000   0.0000          ?        ?  4018.8552  35.1187          ?        ?      633.9        2.8       ?       ? 
1 1 1   15    4   49 o     35.0   14.9    0.0000   0.0000          ?        ?    -0.6385  18.5171          ?        ?       35.0       14.9       ?       ? 
1 1 1   15    4   50 o    221.6    4.5    0.0000   0.0000          ?        ?   491.0231  19.7942          ?        ?      221.6        4.5       ?       ? 
1 1 1   15    4   51 o    160.4    6.0    0.0000   0.0000          ?        ?   257.3242  19.1556          ?        ?      160.4        6.0       ?       ? 
1 1 1   15    4   52 o    146.4    7.0    0.0000   0.0000          ?        ?   214.5433  20.4327          ?        ?      146.4        7.0       ?       ? 
1 1 1   15    4   53 o    770.2    3.2    0.0000   0.0000          ?        ?  5933.1431  48.5276          ?        ?      770.2        3.2       ?       ? 
1 1 1   15    4   54 o    257.6    3.8    0.0000   0.0000          ?        ?   664.0625  19.7942          ?        ?      257.6        3.8       ?       ? 
1 1 1   15    4   55 o    503.6    2.7    0.0000   0.0000          ?        ?  2536.2080  27.4564          ?        ?      503.6        2.7       ?       ? 
1 1 1   15    4   56 o    335.3    3.1    0.0000   0.0000          ?        ?  1124.4366  21.0712          ?        ?      335.3        3.1       ?       ? 
1 1 1   15    4   57 f    334.2    3.2    0.0000   0.0000          ?        ?  1117.4128  21.0712          ?        ?      334.2        3.2       ?       ? 
1 1 1   15    4   58 o    412.6    2.8    0.0000   0.0000          ?        ?  1702.9373  22.9868          ?        ?      412.6        2.8       ?       ? 
1 1 1   15    4   59 o    331.1    3.2    0.0000   0.0000          ?        ?  1096.3416  21.0712          ?        ?      331.1        3.2       ?       ? 
1 1 1   15    4   60 o    510.4    2.8    0.0000   0.0000          ?        ?  2605.8069  28.7335          ?        ?      510.4        2.8       ?       ? 
1 1 1   15    4   61 o    266.4    3.7    0.0000   0.0000          ?        ?   710.0360  19.7942          ?        ?      266.4        3.7       ?       ? 
1 1 1   15    4   62 o    645.1    2.9    0.0000   0.0000          ?        ?  4162.5225  37.6728          ?        ?      645.1        2.9       ?       ? 
1 1 1   15    4   63 o    163.4    6.1    0.0000   0.0000          ?        ?   267.5406  19.7942          ?        ?      163.4        6.1       ?       ? 
1 1 1   15    4   64 f    296.8    3.5    0.0000   0.0000          ?        ?   881.7984  21.0712          ?        ?      296.8        3.5       ?       ? 
1 1 1   15    4   65 o    453.8    2.8    0.0000   0.0000          ?        ?  2059.8708  25.5409          ?        ?      453.8        2.8       ?       ? 
1 1 1   15    4   66 o     80.7   12.3    0.0000   0.0000          ?        ?    65.7677  19.7942          ?        ?       80.7       12.3       ?       ? 
1 1 1   15    4   67 o     76.7   13.8    0.0000   0.0000          ?        ?    61.2981  20.4327          ?        ?       76.7       13.8       ?       ? 
1 1 1   15    4   68 o    148.8    7.1    0.0000   0.0000          ?        ?   222.2055  21.0712          ?        ?      148.8        7.1       ?       ? 
1 1 1   15    4   69 o    447.1    3.0    0.0000   0.0000          ?        ?  2000.4882  26.8179          ?        ?      447.1        3.0       ?       ? 
1 1 1   15    4   70 o     27.6   13.2    0.0000   0.0000          ?        ?   -27.4564  20.4327          ?        ?       27.6       13.2       ?       ? 
1 1 1   15    4   71 o    268.9    4.0    0.0000   0.0000          ?        ?   724.0836  21.7097          ?        ?      268.9        4.0       ?       ? 
1 1 1   15    4   72 o     88.4   11.6    0.0000   0.0000          ?        ?    79.1767  20.4327          ?        ?       88.4       11.6       ?       ? 
1 1 1   15    4   73 o    167.3    6.3    0.0000   0.0000          ?        ?   280.9495  21.0712          ?        ?      167.3        6.3       ?       ? 
1 1 1   15    4   74 o    113.2    9.9    0.0000   0.0000          ?        ?   129.6199  22.3483          ?        ?      113.2        9.9       ?       ? 
1 1 1   15    4   75 o    130.8    8.1    0.0000   0.0000          ?        ?   172.4008  21.0712          ?        ?      130.8        8.1       ?       ? 
1 1 1   15    4   76 o    124.9    8.9    0.0000   0.0000          ?        ?   157.7148  22.3483          ?        ?      124.9        8.9       ?       ? 
1 1 1   15    4   77 o     31.0   14.2    0.0000   0.0000          ?        ?   -14.6860  20.4327          ?        ?       31.0       14.2       ?       ? 
1 1 1   15    4   78 o     65.6   16.2    0.0000   0.0000          ?        ?    46.6121  21.0712          ?        ?       65.6       16.2       ?       ? 
1 1 1   15    4   79 o    180.5    6.0    0.0000   0.0000          ?        ?   328.2001  21.7097          ?        ?      180.5        6.0       ?       ? 
1 1 1   15    5    0 o      7.2    5.2   -7.0237   3.8311    -7.0237   3.8311    -7.0237   3.8311        7.2      5.2        7.2        5.2     0.0     0.0 
1 1 1   15    5    1 o   1225.4    4.1    0.0000   0.0000          ?        ? 15016.7520 100.8864          ?        ?     1225.4        4.1       ?       ? 
1 1 1   15    5    2 o   1259.2    4.3    0.0000   0.0000          ?        ? 15856.4082 107.2716          ?        ?     1259.2        4.3       ?       ? 
1 1 1   15    5    3 o   1290.5    4.3    0.0000   0.0000          ?        ? 16654.5605 111.7413          ?        ?     1290.5        4.3       ?       ? 
1 1 1   15    5    4 o    592.3    2.2    0.0000   0.0000          ?        ?  3508.6763  26.1794          ?        ?      592.3        2.2       ?       ? 
1 1 1   15    5    5 o    131.8    1.5    0.0000   0.0000          ?        ?   173.6779   3.8311          ?        ?      131.8        1.5       ?       ? 
1 1 1   15    5    6 o    921.6    3.2    0.0000   0.0000          ?        ?  8493.6143  58.7440          ?        ?      921.6        3.2       ?       ? 
1 1 1   15    5    7 o    697.6    2.6    0.0000   0.0000          ?        ?  4866.1733  35.7572          ?        ?      697.6        2.6       ?       ? 
1 1 1   15    5    8 o    895.2    3.1    0.0000   0.0000          ?        ?  8014.0850  54.9129          ?        ?      895.2        3.1       ?       ? 
1 1 1   15    5    9 o    181.7    1.6    0.0000   0.0000          ?        ?   330.1157   5.7467          ?        ?      181.7        1.6       ?       ? 
1 1 1   15    5   10 o    892.8    3.1    0.0000   0.0000          ?        ?  7971.3042  54.9129          ?        ?      892.8        3.1       ?       ? 
1 1 1   15    5   11 o   1180.4    4.0    0.0000   0.0000          ?        ? 13935.0957  93.8627          ?        ?     1180.4        4.0       ?       ? 
1 1 1   15    5   12 o     87.5    3.3    0.0000   0.0000          ?        ?    76.6226   5.7467          ?        ?       87.5        3.3       ?       ? 
1 1 1   15    5   13 o    943.7    3.3    0.0000   0.0000          ?        ?  8906.7383  61.9366          ?        ?      943.7        3.3       ?       ? 
1 1 1   15    5   14 o     73.7    3.9    0.0000   0.0000          ?        ?    54.2743   5.7467          ?        ?       73.7        3.9       ?       ? 
1 1 1   15    5   15 o    826.9    2.9    0.0000   0.0000          ?        ?  6838.5664  48.5276          ?        ?      826.9        2.9       ?       ? 
1 1 1   15    5   16 o    275.7    1.7    0.0000   0.0000          ?        ?   759.8408   9.5778          ?        ?      275.7        1.7       ?       ? 
1 1 1   15    5   17 o    725.8    2.7    0.0000   0.0000          ?        ?  5267.8032  38.9498          ?        ?      725.8        2.7       ?       ? 
1 1 1   15    5   18 o    150.6    2.3    0.0000   0.0000          ?        ?   226.6752   7.0237          ?        ?      150.6        2.3       ?       ? 
1 1 1   15    5   19 o   1135.5    3.9    0.0000   0.0000          ?        ? 12895.5830  89.3930          ?        ?     1135.5        3.9       ?       ? 
1 1 1   15    5   20 o   1102.1    3.9    0.0000   0.0000          ?        ? 12147.8740  85.5619          ?        ?     1102.1        3.9       ?       ? 
1 1 1   15    5   21 o   1436.3    4.8    0.0000   0.0000          ?        ? 20632.5488 137.9207          ?        ?     1436.3        4.8       ?       ? 
1 1 1   15    5   22 o   1430.2    4.8    0.0000   0.0000          ?        ? 20456.9570 137.2822          ?        ?     1430.2        4.8       ?       ? 
1 1 1   15    5   23 f     68.7    7.0    0.0000   0.0000          ?        ?    47.2506   9.5778          ?        ?       68.7        7.0       ?       ? 
1 1 1   15    5   24 o    791.4    3.0    0.0000   0.0000          ?        ?  6263.8970  47.8891          ?        ?      791.4        3.0       ?       ? 
1 1 1   15    5   25 o    250.8    2.4    0.0000   0.0000          ?        ?   628.9438  12.1319          ?        ?      250.8        2.4       ?       ? 
1 1 1   15    5   26 o   1936.4    6.3    0.0000   0.0000          ?        ? 37501.6523 245.8308          ?        ?     1936.4        6.3       ?       ? 
1 1 1   15    5   27 o   1833.7    6.4    0.0000   0.0000          ?        ? 33630.2930 234.3374          ?        ?     1833.7        6.4       ?       ? 
1 1 1   15    5   28 o   1926.8    7.0    0.0000   0.0000          ?        ? 37130.6719 271.3717          ?        ?     1926.8        7.0       ?       ? 
1 1 1   15    5   29 o   1627.2    5.5    0.0000   0.0000          ?        ? 26479.4922 179.4246          ?        ?     1627.2        5.5       ?       ? 
1 1 1   15    5   30 o   1810.4    6.4    0.0000   0.0000          ?        ? 32781.0625 230.5063          ?        ?     1810.4        6.4       ?       ? 
1 1 1   15    5   31 o   1337.7    4.9    0.0000   0.0000          ?        ? 17896.4844 132.1740          ?        ?     1337.7        4.9       ?       ? 
1 1 1   15    5   32 o   1618.3    5.4    0.0000   0.0000          ?        ? 26190.2422 175.5934          ?        ?     1618.3        5.4       ?       ? 
1 1 1   15    5   33 o    976.4    3.7    0.0000   0.0000          ?        ?  9533.7666  72.7915          ?        ?      976.4        3.7       ?       ? 
1 1 1   15    5   34 o    275.0    2.8    0.0000   0.0000          ?        ?   756.0096  15.3245          ?        ?      275.0        2.8       ?       ? 
1 1 1   15    5   35 o   1099.4    4.2    0.0000   0.0000          ?        ? 12087.8525  92.5856          ?        ?     1099.4        4.2       ?       ? 
1 1 1   15    5   36 o    452.2    2.5    0.0000   0.0000          ?        ?  2045.1847  22.9868          ?        ?      452.2        2.5       ?       ? 
1 1 1   15    5   37 o    326.1    2.8    0.0000   0.0000          ?        ?  1063.7771  18.5171          ?        ?      326.1        2.8       ?       ? 
1 1 1   15    5   38 o    132.3    6.5    0.0000   0.0000          ?        ?   174.9549  17.2401          ?        ?      132.3        6.5       ?       ? 
1 1 1   15    5   39 o    287.7    3.1    0.0000   0.0000          ?        ?   827.5240  17.8786          ?        ?      287.7        3.1       ?       ? 
1 1 1   15    5   40 o   1333.4    4.5    0.0000   0.0000          ?        ? 17780.2734 120.6806          ?        ?     1333.4        4.5       ?       ? 
1 1 1   15    5   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    5   42 o    273.7    3.4    0.0000   0.0000          ?        ?   748.9859  18.5171          ?        ?      273.7        3.4       ?       ? 
1 1 1   15    5   43 o    495.1    2.9    0.0000   0.0000          ?        ?  2451.2844  28.7335          ?        ?      495.1        2.9       ?       ? 
1 1 1   15    5   44 o    764.2    3.1    0.0000   0.0000          ?        ?  5840.5576  47.2506          ?        ?      764.2        3.1       ?       ? 
1 1 1   15    5   45 o   1147.9    4.0    0.0000   0.0000          ?        ? 13178.4473  91.9471          ?        ?     1147.9        4.0       ?       ? 
1 1 1   15    5   46 o    177.9    5.2    0.0000   0.0000          ?        ?   316.7067  18.5171          ?        ?      177.9        5.2       ?       ? 
1 1 1   15    5   47 o    164.9    5.6    0.0000   0.0000          ?        ?   272.0102  18.5171          ?        ?      164.9        5.6       ?       ? 
1 1 1   15    5   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    5   49 o    829.0    3.2    0.0000   0.0000          ?        ?  6873.0469  52.3588          ?        ?      829.0        3.2       ?       ? 
1 1 1   15    5   50 o    314.0    3.4    0.0000   0.0000          ?        ?   985.8774  21.0712          ?        ?      314.0        3.4       ?       ? 
1 1 1   15    5   51 o    930.6    3.5    0.0000   0.0000          ?        ?  8662.1846  65.1292          ?        ?      930.6        3.5       ?       ? 
1 1 1   15    5   52 o    752.2    3.3    0.0000   0.0000          ?        ?  5659.2173  49.1662          ?        ?      752.2        3.3       ?       ? 
1 1 1   15    5   53 o    675.8    2.8    0.0000   0.0000          ?        ?  4567.3452  38.3113          ?        ?      675.8        2.8       ?       ? 
1 1 1   15    5   54 o    452.8    2.7    0.0000   0.0000          ?        ?  2050.9316  24.2638          ?        ?      452.8        2.7       ?       ? 
1 1 1   15    5   55 o    254.7    3.8    0.0000   0.0000          ?        ?   648.7380  19.1556          ?        ?      254.7        3.8       ?       ? 
1 1 1   15    5   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    5   57 o    275.6    3.7    0.0000   0.0000          ?        ?   759.8408  20.4327          ?        ?      275.6        3.7       ?       ? 
1 1 1   15    5   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    5   59 o     78.9   12.1    0.0000   0.0000          ?        ?    62.5751  19.1556          ?        ?       78.9       12.1       ?       ? 
1 1 1   15    5   60 o    196.3    4.9    0.0000   0.0000          ?        ?   385.6671  19.1556          ?        ?      196.3        4.9       ?       ? 
1 1 1   15    5   61 o     20.9   10.5    0.0000   0.0000          ?        ?   -56.1899  19.1556          ?        ?       20.9       10.5       ?       ? 
1 1 1   15    5   62 o    133.1    7.4    0.0000   0.0000          ?        ?   177.5090  19.7942          ?        ?      133.1        7.4       ?       ? 
1 1 1   15    5   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    5   64 f    315.1    3.5    0.0000   0.0000          ?        ?   993.5397  22.3483          ?        ?      315.1        3.5       ?       ? 
1 1 1   15    5   65 o     46.4   16.7    0.0000   0.0000          ?        ?    18.5171  19.7942          ?        ?       46.4       16.7       ?       ? 
1 1 1   15    5   66 o    272.7    4.0    0.0000   0.0000          ?        ?   744.5162  21.7097          ?        ?      272.7        4.0       ?       ? 
1 1 1   15    5   67 o     20.5   10.3    0.0000   0.0000          ?        ?   -68.9603  20.4327          ?        ?       20.5       10.3       ?       ? 
1 1 1   15    5   68 o     72.8   14.6    0.0000   0.0000          ?        ?    55.5514  20.4327          ?        ?       72.8       14.6       ?       ? 
1 1 1   15    5   69 o    261.8    4.1    0.0000   0.0000          ?        ?   686.4108  21.7097          ?        ?      261.8        4.1       ?       ? 
1 1 1   15    5   70 f     45.5   16.7    0.0000   0.0000          ?        ?    17.2401  19.7942          ?        ?       45.5       16.7       ?       ? 
1 1 1   15    5   71 o    151.1    7.2    0.0000   0.0000          ?        ?   229.2293  21.7097          ?        ?      151.1        7.2       ?       ? 
1 1 1   15    5   72 o     21.5   10.9    0.0000   0.0000          ?        ?   -68.9603  21.7097          ?        ?       21.5       10.9       ?       ? 
1 1 1   15    5   73 o    169.2    6.4    0.0000   0.0000          ?        ?   287.3347  21.7097          ?        ?      169.2        6.4       ?       ? 
1 1 1   15    5   74 o    262.2    4.3    0.0000   0.0000          ?        ?   688.9648  22.3483          ?        ?      262.2        4.3       ?       ? 
1 1 1   15    5   75 o     29.3   13.9    0.0000   0.0000          ?        ?   -24.9023  21.7097          ?        ?       29.3       13.9       ?       ? 
1 1 1   15    5   76 o    174.1    6.2    0.0000   0.0000          ?        ?   304.5748  21.7097          ?        ?      174.1        6.2       ?       ? 
1 1 1   15    5   77 o     35.5   15.7    0.0000   0.0000          ?        ?    -5.1082  21.7097          ?        ?       35.5       15.7       ?       ? 
1 1 1   15    5   78 o    107.4   10.1    0.0000   0.0000          ?        ?   117.4880  21.7097          ?        ?      107.4       10.1       ?       ? 
1 1 1   15    5   79 o     71.9   16.0    0.0000   0.0000          ?        ?    56.1899  22.3483          ?        ?       71.9       16.0       ?       ? 
1 1 1   15    6    0 o    745.8    3.8 5562.8003  56.1899  5562.8003  56.1899  5562.8003  56.1899      745.8      3.8      745.8        3.8     0.0     0.0 
1 1 1   15    6    1 f   1771.1    5.9    0.0000   0.0000          ?        ? 31373.1211 208.1580          ?        ?     1771.1        5.9       ?       ? 
1 1 1   15    6    2 o   1754.2    5.7    0.0000   0.0000          ?        ? 30778.0215 200.4958          ?        ?     1754.2        5.7       ?       ? 
1 1 1   15    6    3 o   1073.0    3.7    0.0000   0.0000          ?        ? 11514.4609  78.5382          ?        ?     1073.0        3.7       ?       ? 
1 1 1   15    6    4 o    462.8    1.9    0.0000   0.0000          ?        ?  2142.2400  17.2401          ?        ?      462.8        1.9       ?       ? 
1 1 1   15    6    5 o    925.8    3.2    0.0000   0.0000          ?        ?  8572.1533  59.3825          ?        ?      925.8        3.2       ?       ? 
1 1 1   15    6    6 o    605.7    2.3    0.0000   0.0000          ?        ?  3668.3066  28.0950          ?        ?      605.7        2.3       ?       ? 
1 1 1   15    6    7 o    849.9    3.0    0.0000   0.0000          ?        ?  7222.9565  51.7203          ?        ?      849.9        3.0       ?       ? 
1 1 1   15    6    8 o   1237.5    4.2    0.0000   0.0000          ?        ? 15314.9414 102.8020          ?        ?     1237.5        4.2       ?       ? 
1 1 1   15    6    9 o   1393.3    4.7    0.0000   0.0000          ?        ? 19416.1660 130.8969          ?        ?     1393.3        4.7       ?       ? 
1 1 1   15    6   10 o   1389.7    4.6    0.0000   0.0000          ?        ? 19315.9180 128.3428          ?        ?     1389.7        4.6       ?       ? 
1 1 1   15    6   11 o    880.7    3.1    0.0000   0.0000          ?        ?  7756.1221  54.9129          ?        ?      880.7        3.1       ?       ? 
1 1 1   15    6   12 o    716.9    2.6    0.0000   0.0000          ?        ?  5139.4609  37.0343          ?        ?      716.9        2.6       ?       ? 
1 1 1   15    6   13 o   1265.8    4.3    0.0000   0.0000          ?        ? 16023.7002 109.1872          ?        ?     1265.8        4.3       ?       ? 
1 1 1   15    6   14 o    515.9    2.1    0.0000   0.0000          ?        ?  2661.9966  21.7097          ?        ?      515.9        2.1       ?       ? 
1 1 1   15    6   15 o   1055.3    3.6    0.0000   0.0000          ?        ? 11137.0938  76.6226          ?        ?     1055.3        3.6       ?       ? 
1 1 1   15    6   16 o   1370.7    4.6    0.0000   0.0000          ?        ? 18789.1387 125.7888          ?        ?     1370.7        4.6       ?       ? 
1 1 1   15    6   17 o    639.9    2.5    0.0000   0.0000          ?        ?  4094.8391  31.9261          ?        ?      639.9        2.5       ?       ? 
1 1 1   15    6   18 o   2244.1    7.2    0.0000   0.0000          ?        ? 50371.6914 325.0075          ?        ?     2244.1        7.2       ?       ? 
1 1 1   15    6   19 o    600.2    2.3    0.0000   0.0000          ?        ?  3602.5391  28.0950          ?        ?      600.2        2.3       ?       ? 
1 1 1   15    6   20 o    431.9    2.0    0.0000   0.0000          ?        ?  1865.1217  17.2401          ?        ?      431.9        2.0       ?       ? 
1 1 1   15    6   21 o    652.6    2.8    0.0000   0.0000          ?        ?  4258.9395  37.0343          ?        ?      652.6        2.8       ?       ? 
1 1 1   15    6   22 o    264.8    2.0    0.0000   0.0000          ?        ?   701.0967  10.8549          ?        ?      264.8        2.0       ?       ? 
1 1 1   15    6   23 o   1291.8    4.6    0.0000   0.0000          ?        ? 16689.6777 118.1265          ?        ?     1291.8        4.6       ?       ? 
1 1 1   15    6   24 o   1101.2    3.9    0.0000   0.0000          ?        ? 12126.1641  85.5619          ?        ?     1101.2        3.9       ?       ? 
1 1 1   15    6   25 o   1035.1    3.6    0.0000   0.0000          ?        ? 10714.3926  74.0685          ?        ?     1035.1        3.6       ?       ? 
1 1 1   15    6   26 o    682.3    2.8    0.0000   0.0000          ?        ?  4656.0996  38.3113          ?        ?      682.3        2.8       ?       ? 
1 1 1   15    6   27 o    790.6    3.1    0.0000   0.0000          ?        ?  6251.1270  48.5276          ?        ?      790.6        3.1       ?       ? 
1 1 1   15    6   28 o   1459.4    5.1    0.0000   0.0000          ?        ? 21300.4414 148.1370          ?        ?     1459.4        5.1       ?       ? 
1 1 1   15    6   29 o    963.0    3.7    0.0000   0.0000          ?        ?  9273.2500  71.5144          ?        ?      963.0        3.7       ?       ? 
1 1 1   15    6   30 o    673.5    3.1    0.0000   0.0000          ?        ?  4536.0576  41.5039          ?        ?      673.5        3.1       ?       ? 
1 1 1   15    6   31 o    952.1    3.7    0.0000   0.0000          ?        ?  9065.7305  69.5989          ?        ?      952.1        3.7       ?       ? 
1 1 1   15    6   32 o    321.1    2.9    0.0000   0.0000          ?        ?  1031.2124  18.5171          ?        ?      321.1        2.9       ?       ? 
1 1 1   15    6   33 o    972.3    3.6    0.0000   0.0000          ?        ?  9454.5898  69.5989          ?        ?      972.3        3.6       ?       ? 
1 1 1   15    6   34 o    427.3    2.5    0.0000   0.0000          ?        ?  1825.5333  21.0712          ?        ?      427.3        2.5       ?       ? 
1 1 1   15    6   35 o    286.5    2.9    0.0000   0.0000          ?        ?   821.1389  16.6016          ?        ?      286.5        2.9       ?       ? 
1 1 1   15    6   36 o   1835.7    6.0    0.0000   0.0000          ?        ? 33705.0039 220.2900          ?        ?     1835.7        6.0       ?       ? 
1 1 1   15    6   37 o    585.7    2.6    0.0000   0.0000          ?        ?  3430.7766  30.6490          ?        ?      585.7        2.6       ?       ? 
1 1 1   15    6   38 o    878.2    3.3    0.0000   0.0000          ?        ?  7713.3413  58.1055          ?        ?      878.2        3.3       ?       ? 
1 1 1   15    6   39 o    209.4    3.8    0.0000   0.0000          ?        ?   438.6643  15.9630          ?        ?      209.4        3.8       ?       ? 
1 1 1   15    6   40 o     28.7   13.1    0.0000   0.0000          ?        ?   -10.8549  16.6016          ?        ?       28.7       13.1       ?       ? 
1 1 1   15    6   41 o    376.1    2.7    0.0000   0.0000          ?        ?  1414.3254  20.4327          ?        ?      376.1        2.7       ?       ? 
1 1 1   15    6   42 o    541.5    2.7    0.0000   0.0000          ?        ?  2932.7297  28.7335          ?        ?      541.5        2.7       ?       ? 
1 1 1   15    6   43 f    221.0    4.0    0.0000   0.0000          ?        ?   488.4691  17.8786          ?        ?      221.0        4.0       ?       ? 
1 1 1   15    6   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    6   45 o    327.1    3.1    0.0000   0.0000          ?        ?  1070.1622  20.4327          ?        ?      327.1        3.1       ?       ? 
1 1 1   15    6   46 o   1097.2    3.8    0.0000   0.0000          ?        ? 12039.3252  83.6463          ?        ?     1097.2        3.8       ?       ? 
1 1 1   15    6   47 o    448.7    2.6    0.0000   0.0000          ?        ?  2013.2587  23.6253          ?        ?      448.7        2.6       ?       ? 
1 1 1   15    6   48 o    464.0    2.7    0.0000   0.0000          ?        ?  2153.0950  24.9023          ?        ?      464.0        2.7       ?       ? 
1 1 1   15    6   49 o    146.0    6.1    0.0000   0.0000          ?        ?   213.2662  17.8786          ?        ?      146.0        6.1       ?       ? 
1 1 1   15    6   50 o    290.2    3.2    0.0000   0.0000          ?        ?   842.2100  18.5171          ?        ?      290.2        3.2       ?       ? 
1 1 1   15    6   51 o    431.9    2.7    0.0000   0.0000          ?        ?  1865.7603  23.6253          ?        ?      431.9        2.7       ?       ? 
1 1 1   15    6   52 o    215.1    4.5    0.0000   0.0000          ?        ?   462.9282  19.1556          ?        ?      215.1        4.5       ?       ? 
1 1 1   15    6   53 o    191.7    5.0    0.0000   0.0000          ?        ?   367.7885  19.1556          ?        ?      191.7        5.0       ?       ? 
1 1 1   15    6   54 o     82.5   11.2    0.0000   0.0000          ?        ?    68.3218  18.5171          ?        ?       82.5       11.2       ?       ? 
1 1 1   15    6   55 f    428.9    2.8    0.0000   0.0000          ?        ?  1840.2194  24.2638          ?        ?      428.9        2.8       ?       ? 
1 1 1   15    6   56 o    151.9    6.3    0.0000   0.0000          ?        ?   231.1448  19.1556          ?        ?      151.9        6.3       ?       ? 
1 1 1   15    6   57 o    256.5    4.1    0.0000   0.0000          ?        ?   658.3158  21.0712          ?        ?      256.5        4.1       ?       ? 
1 1 1   15    6   58 o    359.6    3.1    0.0000   0.0000          ?        ?  1293.6449  22.3483          ?        ?      359.6        3.1       ?       ? 
1 1 1   15    6   59 o    485.8    2.9    0.0000   0.0000          ?        ?  2360.6145  28.0950          ?        ?      485.8        2.9       ?       ? 
1 1 1   15    6   60 f    583.1    2.8    0.0000   0.0000          ?        ?  3400.7661  32.5646          ?        ?      583.1        2.8       ?       ? 
1 1 1   15    6   61 f    396.3    2.9    0.0000   0.0000          ?        ?  1570.7632  22.9868          ?        ?      396.3        2.9       ?       ? 
1 1 1   15    6   62 o     65.2   15.0    0.0000   0.0000          ?        ?    44.6965  19.1556          ?        ?       65.2       15.0       ?       ? 
1 1 1   15    6   63 o    414.6    2.9    0.0000   0.0000          ?        ?  1719.5387  24.2638          ?        ?      414.6        2.9       ?       ? 
1 1 1   15    6   64 o    169.5    5.8    0.0000   0.0000          ?        ?   287.9732  19.7942          ?        ?      169.5        5.8       ?       ? 
1 1 1   15    6   65 o     85.7   11.2    0.0000   0.0000          ?        ?    74.0685  19.1556          ?        ?       85.7       11.2       ?       ? 
1 1 1   15    6   66 o    140.3    6.8    0.0000   0.0000          ?        ?   197.3032  19.1556          ?        ?      140.3        6.8       ?       ? 
1 1 1   15    6   67 o     23.4   11.6    0.0000   0.0000          ?        ?   -51.7203  21.0712          ?        ?       23.4       11.6       ?       ? 
1 1 1   15    6   68 o    285.6    3.8    0.0000   0.0000          ?        ?   816.6692  21.7097          ?        ?      285.6        3.8       ?       ? 
1 1 1   15    6   69 o    207.8    5.4    0.0000   0.0000          ?        ?   432.9177  22.3483          ?        ?      207.8        5.4       ?       ? 
1 1 1   15    6   70 o    126.2    8.6    0.0000   0.0000          ?        ?   160.2689  21.7097          ?        ?      126.2        8.6       ?       ? 
1 1 1   15    6   71 o     68.9   16.0    0.0000   0.0000          ?        ?    50.4432  21.7097          ?        ?       68.9       16.0       ?       ? 
1 1 1   15    6   72 o    148.7    7.5    0.0000   0.0000          ?        ?   222.2055  22.3483          ?        ?      148.7        7.5       ?       ? 
1 1 1   15    6   73 o     23.0   11.5    0.0000   0.0000          ?        ?   -53.6358  21.0712          ?        ?       23.0       11.5       ?       ? 
1 1 1   15    6   74 o    168.3    6.6    0.0000   0.0000          ?        ?   284.7806  22.3483          ?        ?      168.3        6.6       ?       ? 
1 1 1   15    6   75 o     42.5   16.4    0.0000   0.0000          ?        ?    12.7704  19.7942          ?        ?       42.5       16.4       ?       ? 
1 1 1   15    6   76 o    125.6    8.9    0.0000   0.0000          ?        ?   159.6304  22.3483          ?        ?      125.6        8.9       ?       ? 
1 1 1   15    6   77 o    136.6    7.7    0.0000   0.0000          ?        ?   188.3639  21.0712          ?        ?      136.6        7.7       ?       ? 
1 1 1   15    6   78 o    254.0    4.3    0.0000   0.0000          ?        ?   647.4609  21.7097          ?        ?      254.0        4.3       ?       ? 
1 1 1   15    6   79 o     20.6   10.4    0.0000   0.0000          ?        ?   -70.8759  21.0712          ?        ?       20.6       10.4       ?       ? 
1 1 1   15    7    0 o     80.5    5.6   65.7677   8.9393    65.7677   8.9393    65.7677   8.9393       80.5      5.6       80.5        5.6     0.0     0.0 
1 1 1   15    7    1 o    979.5    3.5    0.0000   0.0000          ?        ?  9595.7031  68.9603          ?        ?      979.5        3.5       ?       ? 
1 1 1   15    7    2 o   2174.4    7.7    0.0000   0.0000          ?        ? 47293.3828 335.8624          ?        ?     2174.4        7.7       ?       ? 
1 1 1   15    7    3 o    691.1    2.5    0.0000   0.0000          ?        ?  4776.1416  35.1187          ?        ?      691.1        2.5       ?       ? 
1 1 1   15    7    4 o    448.7    1.9    0.0000   0.0000          ?        ?  2013.2587  17.2401          ?        ?      448.7        1.9       ?       ? 
1 1 1   15    7    5 o    738.0    2.7    0.0000   0.0000          ?        ?  5445.9512  39.5883          ?        ?      738.0        2.7       ?       ? 
1 1 1   15    7    6 o    790.7    2.8    0.0000   0.0000          ?        ?  6252.4038  44.0580          ?        ?      790.7        2.8       ?       ? 
1 1 1   15    7    7 o    891.5    3.3    0.0000   0.0000          ?        ?  7948.3174  58.1055          ?        ?      891.5        3.3       ?       ? 
1 1 1   15    7    8 o     85.7    2.6    0.0000   0.0000          ?        ?    73.4300   4.4697          ?        ?       85.7        2.6       ?       ? 
1 1 1   15    7    9 o    989.9    3.6    0.0000   0.0000          ?        ?  9800.0303  70.8759          ?        ?      989.9        3.6       ?       ? 
1 1 1   15    7   10 o   1159.7    3.9    0.0000   0.0000          ?        ? 13449.8193  90.6701          ?        ?     1159.7        3.9       ?       ? 
1 1 1   15    7   11 o   1470.3    4.9    0.0000   0.0000          ?        ? 21620.9805 143.6674          ?        ?     1470.3        4.9       ?       ? 
1 1 1   15    7   12 o    919.8    3.3    0.0000   0.0000          ?        ?  8461.6885  60.0210          ?        ?      919.8        3.3       ?       ? 
1 1 1   15    7   13 o    537.9    2.1    0.0000   0.0000          ?        ?  2893.7800  22.9868          ?        ?      537.9        2.1       ?       ? 
1 1 1   15    7   14 o    775.4    2.8    0.0000   0.0000          ?        ?  6012.9580  44.0580          ?        ?      775.4        2.8       ?       ? 
1 1 1   15    7   15 o    891.2    3.2    0.0000   0.0000          ?        ?  7943.2090  56.1899          ?        ?      891.2        3.2       ?       ? 
1 1 1   15    7   16 o    277.6    1.7    0.0000   0.0000          ?        ?   770.6956   9.5778          ?        ?      277.6        1.7       ?       ? 
1 1 1   15    7   17 o   1286.3    4.3    0.0000   0.0000          ?        ? 16547.9277 111.7413          ?        ?     1286.3        4.3       ?       ? 
1 1 1   15    7   18 o    870.1    3.1    0.0000   0.0000          ?        ?  7571.5898  54.2743          ?        ?      870.1        3.1       ?       ? 
1 1 1   15    7   19 o   1277.5    4.3    0.0000   0.0000          ?        ? 16321.8896 111.1028          ?        ?     1277.5        4.3       ?       ? 
1 1 1   15    7   20 o   1434.2    4.8    0.0000   0.0000          ?        ? 20571.8906 137.9207          ?        ?     1434.2        4.8       ?       ? 
1 1 1   15    7   21 o   2085.9    6.8    0.0000   0.0000          ?        ? 43517.1641 282.8651          ?        ?     2085.9        6.8       ?       ? 
1 1 1   15    7   22 o    679.4    2.8    0.0000   0.0000          ?        ?  4616.5112  38.3113          ?        ?      679.4        2.8       ?       ? 
1 1 1   15    7   23 o    307.2    2.1    0.0000   0.0000          ?        ?   943.7350  12.7704          ?        ?      307.2        2.1       ?       ? 
1 1 1   15    7   24 o   1083.9    3.9    0.0000   0.0000          ?        ? 11748.7979  84.9234          ?        ?     1083.9        3.9       ?       ? 
1 1 1   15    7   25 o    374.1    2.3    0.0000   0.0000          ?        ?  1399.6394  17.2401          ?        ?      374.1        2.3       ?       ? 
1 1 1   15    7   26 o   1385.4    5.0    0.0000   0.0000          ?        ? 19195.2363 137.9207          ?        ?     1385.4        5.0       ?       ? 
1 1 1   15    7   27 o    651.5    2.7    0.0000   0.0000          ?        ?  4244.8916  35.7572          ?        ?      651.5        2.7       ?       ? 
1 1 1   15    7   28 o   1502.3    5.2    0.0000   0.0000          ?        ? 22572.3789 157.7148          ?        ?     1502.3        5.2       ?       ? 
1 1 1   15    7   29 o   1520.6    5.2    0.0000   0.0000          ?        ? 23125.3379 157.7148          ?        ?     1520.6        5.2       ?       ? 
1 1 1   15    7   30 o    344.3    2.5    0.0000   0.0000          ?        ?  1185.7346  17.2401          ?        ?      344.3        2.5       ?       ? 
1 1 1   15    7   31 o   1186.1    4.3    0.0000   0.0000          ?        ? 14069.1846 102.8020          ?        ?     1186.1        4.3       ?       ? 
1 1 1   15    7   32 o    218.5    3.8    0.0000   0.0000          ?        ?   477.6142  16.6016          ?        ?      218.5        3.8       ?       ? 
1 1 1   15    7   33 o    851.0    3.3    0.0000   0.0000          ?        ?  7242.1118  56.1899          ?        ?      851.0        3.3       ?       ? 
1 1 1   15    7   34 o    761.5    3.1    0.0000   0.0000          ?        ?  5799.0537  47.8891          ?        ?      761.5        3.1       ?       ? 
1 1 1   15    7   35 o    615.5    2.7    0.0000   0.0000          ?        ?  3788.9875  33.2031          ?        ?      615.5        2.7       ?       ? 
1 1 1   15    7   36 o    358.2    2.7    0.0000   0.0000          ?        ?  1283.4285  19.1556          ?        ?      358.2        2.7       ?       ? 
1 1 1   15    7   37 o    726.4    2.9    0.0000   0.0000          ?        ?  5276.1040  42.7809          ?        ?      726.4        2.9       ?       ? 
1 1 1   15    7   38 o    955.3    3.5    0.0000   0.0000          ?        ?  9126.3896  67.0448          ?        ?      955.3        3.5       ?       ? 
1 1 1   15    7   39 o    199.6    4.2    0.0000   0.0000          ?        ?   398.4375  16.6016          ?        ?      199.6        4.2       ?       ? 
1 1 1   15    7   40 o    332.0    3.3    0.0000   0.0000          ?        ?  1102.0884  21.7097          ?        ?      332.0        3.3       ?       ? 
1 1 1   15    7   41 o     31.5   14.1    0.0000   0.0000          ?        ?    -8.9393  18.5171          ?        ?       31.5       14.1       ?       ? 
1 1 1   15    7   42 o    328.7    2.9    0.0000   0.0000          ?        ?  1080.3785  19.1556          ?        ?      328.7        2.9       ?       ? 
1 1 1   15    7   43 o    144.5    6.2    0.0000   0.0000          ?        ?   208.7966  17.8786          ?        ?      144.5        6.2       ?       ? 
1 1 1   15    7   44 o    458.5    2.6    0.0000   0.0000          ?        ?  2102.6516  24.2638          ?        ?      458.5        2.6       ?       ? 
1 1 1   15    7   45 o    248.6    3.6    0.0000   0.0000          ?        ?   618.0889  17.8786          ?        ?      248.6        3.6       ?       ? 
1 1 1   15    7   46 o    349.4    2.8    0.0000   0.0000          ?        ?  1220.8533  19.7942          ?        ?      349.4        2.8       ?       ? 
1 1 1   15    7   47 o    381.8    2.8    0.0000   0.0000          ?        ?  1457.7449  21.0712          ?        ?      381.8        2.8       ?       ? 
1 1 1   15    7   48 o    542.2    2.6    0.0000   0.0000          ?        ?  2939.7534  28.7335          ?        ?      542.2        2.6       ?       ? 
1 1 1   15    7   49 f    691.0    3.0    0.0000   0.0000          ?        ?  4774.8647  42.1424          ?        ?      691.0        3.0       ?       ? 
1 1 1   15    7   50 o    352.2    3.2    0.0000   0.0000          ?        ?  1240.6476  22.3483          ?        ?      352.2        3.2       ?       ? 
1 1 1   15    7   51 o    173.5    5.7    0.0000   0.0000          ?        ?   301.3822  19.7942          ?        ?      173.5        5.7       ?       ? 
1 1 1   15    7   52 o    347.9    3.0    0.0000   0.0000          ?        ?  1210.6371  21.0712          ?        ?      347.9        3.0       ?       ? 
1 1 1   15    7   53 o    236.2    4.2    0.0000   0.0000          ?        ?   558.0679  19.7942          ?        ?      236.2        4.2       ?       ? 
1 1 1   15    7   54 o    257.3    3.7    0.0000   0.0000          ?        ?   662.1469  19.1556          ?        ?      257.3        3.7       ?       ? 
1 1 1   15    7   55 o    458.1    2.7    0.0000   0.0000          ?        ?  2099.4590  24.9023          ?        ?      458.1        2.7       ?       ? 
1 1 1   15    7   56 o     72.3   13.7    0.0000   0.0000          ?        ?    54.2743  19.1556          ?        ?       72.3       13.7       ?       ? 
1 1 1   15    7   57 o    318.4    3.2    0.0000   0.0000          ?        ?  1013.9724  20.4327          ?        ?      318.4        3.2       ?       ? 
1 1 1   15    7   58 o    535.4    2.7    0.0000   0.0000          ?        ?  2867.6006  29.3720          ?        ?      535.4        2.7       ?       ? 
1 1 1   15    7   59 o    267.5    3.8    0.0000   0.0000          ?        ?   715.7827  20.4327          ?        ?      267.5        3.8       ?       ? 
1 1 1   15    7   60 o    396.8    2.9    0.0000   0.0000          ?        ?  1575.2328  22.9868          ?        ?      396.8        2.9       ?       ? 
1 1 1   15    7   61 o    131.1    7.5    0.0000   0.0000          ?        ?   172.4008  19.7942          ?        ?      131.1        7.5       ?       ? 
1 1 1   15    7   62 o    571.8    2.8    0.0000   0.0000          ?        ?  3271.1462  32.5646          ?        ?      571.8        2.8       ?       ? 
1 1 1   15    7   63 o    245.0    3.8    0.0000   0.0000          ?        ?   600.8488  18.5171          ?        ?      245.0        3.8       ?       ? 
1 1 1   15    7   64 o    325.7    3.3    0.0000   0.0000          ?        ?  1061.2229  21.7097          ?        ?      325.7        3.3       ?       ? 
1 1 1   15    7   65 o    121.2    8.2    0.0000   0.0000          ?        ?   147.4985  19.7942          ?        ?      121.2        8.2       ?       ? 
1 1 1   15    7   66 o    250.4    4.2    0.0000   0.0000          ?        ?   627.6667  21.0712          ?        ?      250.4        4.2       ?       ? 
1 1 1   15    7   67 o    339.1    3.3    0.0000   0.0000          ?        ?  1150.6160  22.3483          ?        ?      339.1        3.3       ?       ? 
1 1 1   15    7   68 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    7   69 o    363.8    3.2    0.0000   0.0000          ?        ?  1324.2938  23.6253          ?        ?      363.8        3.2       ?       ? 
1 1 1   15    7   70 o    231.4    4.7    0.0000   0.0000          ?        ?   536.3582  21.7097          ?        ?      231.4        4.7       ?       ? 
1 1 1   15    7   71 o     95.0   11.1    0.0000   0.0000          ?        ?    91.3086  21.0712          ?        ?       95.0       11.1       ?       ? 
1 1 1   15    7   72 o    203.0    5.2    0.0000   0.0000          ?        ?   413.1235  21.0712          ?        ?      203.0        5.2       ?       ? 
1 1 1   15    7   73 o    247.7    4.5    0.0000   0.0000          ?        ?   614.8964  22.3483          ?        ?      247.7        4.5       ?       ? 
1 1 1   15    7   74 o     40.0   16.6    0.0000   0.0000          ?        ?     5.1082  21.7097          ?        ?       40.0       16.6       ?       ? 
1 1 1   15    7   75 o    265.6    4.2    0.0000   0.0000          ?        ?   706.8434  22.3483          ?        ?      265.6        4.2       ?       ? 
1 1 1   15    7   76 o     38.7   16.2    0.0000   0.0000          ?        ?     3.8311  21.0712          ?        ?       38.7       16.2       ?       ? 
1 1 1   15    7   77 o    230.9    4.8    0.0000   0.0000          ?        ?   535.0811  22.3483          ?        ?      230.9        4.8       ?       ? 
1 1 1   15    7   78 o    123.3    8.0    0.0000   0.0000          ?        ?   153.8837  19.7942          ?        ?      123.3        8.0       ?       ? 
1 1 1   15    7   79 o     80.0   14.9    0.0000   0.0000          ?        ?    68.9603  22.9868          ?        ?       80.0       14.9       ?       ? 
1 1 1   15    8    0 o    643.9    3.8 4146.5596  48.5276  4146.5596  48.5276  4146.5596  48.5276      643.9      3.8      643.9        3.8     0.0     0.0 
1 1 1   15    8    1 o    361.9    1.8    0.0000   0.0000          ?        ?  1309.6079  12.7704          ?        ?      361.9        1.8       ?       ? 
1 1 1   15    8    2 o    377.2    1.8    0.0000   0.0000          ?        ?  1422.6262  13.4090          ?        ?      377.2        1.8       ?       ? 
1 1 1   15    8    3 o   1264.8    4.3    0.0000   0.0000          ?        ? 15998.1592 109.1872          ?        ?     1264.8        4.3       ?       ? 
1 1 1   15    8    4 o    240.7    1.7    0.0000   0.0000          ?        ?   579.1391   8.3008          ?        ?      240.7        1.7       ?       ? 
1 1 1   15    8    5 o    627.9    2.4    0.0000   0.0000          ?        ?  3942.2327  30.0105          ?        ?      627.9        2.4       ?       ? 
1 1 1   15    8    6 o    693.5    2.5    0.0000   0.0000          ?        ?  4809.9834  35.1187          ?        ?      693.5        2.5       ?       ? 
1 1 1   15    8    7 o    361.0    1.8    0.0000   0.0000          ?        ?  1303.2227  12.7704          ?        ?      361.0        1.8       ?       ? 
1 1 1   15    8    8 o    949.0    3.3    0.0000   0.0000          ?        ?  9006.3477  62.5751          ?        ?      949.0        3.3       ?       ? 
1 1 1   15    8    9 o    513.0    2.0    0.0000   0.0000          ?        ?  2631.3477  20.4327          ?        ?      513.0        2.0       ?       ? 
1 1 1   15    8   10 o   1144.1    4.0    0.0000   0.0000          ?        ? 13090.3320  90.6701          ?        ?     1144.1        4.0       ?       ? 
1 1 1   15    8   11 o    655.3    2.4    0.0000   0.0000          ?        ?  4294.6963  31.9261          ?        ?      655.3        2.4       ?       ? 
1 1 1   15    8   12 o   1072.6    3.8    0.0000   0.0000          ?        ? 11504.8828  81.0922          ?        ?     1072.6        3.8       ?       ? 
1 1 1   15    8   13 o   1729.7    5.7    0.0000   0.0000          ?        ? 29922.4023 196.0261          ?        ?     1729.7        5.7       ?       ? 
1 1 1   15    8   14 o    792.3    2.9    0.0000   0.0000          ?        ?  6277.9448  45.3350          ?        ?      792.3        2.9       ?       ? 
1 1 1   15    8   15 f    810.1    2.9    0.0000   0.0000          ?        ?  6562.0864  47.2506          ?        ?      810.1        2.9       ?       ? 
1 1 1   15    8   16 o    573.3    2.3    0.0000   0.0000          ?        ?  3286.4709  26.8179          ?        ?      573.3        2.3       ?       ? 
1 1 1   15    8   17 o    290.6    2.0    0.0000   0.0000          ?        ?   844.7642  11.4934          ?        ?      290.6        2.0       ?       ? 
1 1 1   15    8   18 o   1244.8    4.3    0.0000   0.0000          ?        ? 15495.6436 106.6331          ?        ?     1244.8        4.3       ?       ? 
1 1 1   15    8   19 o   1371.9    4.6    0.0000   0.0000          ?        ? 18822.3398 126.4273          ?        ?     1371.9        4.6       ?       ? 
1 1 1   15    8   20 o   1870.1    6.1    0.0000   0.0000          ?        ? 34978.2148 228.5907          ?        ?     1870.1        6.1       ?       ? 
1 1 1   15    8   21 o   1281.8    4.5    0.0000   0.0000          ?        ? 16431.7148 115.5724          ?        ?     1281.8        4.5       ?       ? 
1 1 1   15    8   22 o     86.1    5.9    0.0000   0.0000          ?        ?    74.0685  10.2163          ?        ?       86.1        5.9       ?       ? 
1 1 1   15    8   23 o    947.7    3.3    0.0000   0.0000          ?        ?  8982.0830  63.2136          ?        ?      947.7        3.3       ?       ? 
1 1 1   15    8   24 o    867.3    3.3    0.0000   0.0000          ?        ?  7522.4233  57.4669          ?        ?      867.3        3.3       ?       ? 
1 1 1   15    8   25 o   1178.3    4.3    0.0000   0.0000          ?        ? 13885.2920 100.8864          ?        ?     1178.3        4.3       ?       ? 
1 1 1   15    8   26 o    932.9    3.8    0.0000   0.0000          ?        ?  8703.6885  71.5144          ?        ?      932.9        3.8       ?       ? 
1 1 1   15    8   27 o   1127.8    4.1    0.0000   0.0000          ?        ? 12719.9893  91.9471          ?        ?     1127.8        4.1       ?       ? 
1 1 1   15    8   28 o    842.8    3.3    0.0000   0.0000          ?        ?  7104.1914  56.1899          ?        ?      842.8        3.3       ?       ? 
1 1 1   15    8   29 o   1219.4    4.3    0.0000   0.0000          ?        ? 14869.8916 104.7175          ?        ?     1219.4        4.3       ?       ? 
1 1 1   15    8   30 o   1413.0    4.8    0.0000   0.0000          ?        ? 19966.5703 136.6436          ?        ?     1413.0        4.8       ?       ? 
1 1 1   15    8   31 o    319.4    2.8    0.0000   0.0000          ?        ?  1020.3576  17.8786          ?        ?      319.4        2.8       ?       ? 
1 1 1   15    8   32 o    851.4    3.1    0.0000   0.0000          ?        ?  7248.4971  53.6358          ?        ?      851.4        3.1       ?       ? 
1 1 1   15    8   33 o   1557.0    5.6    0.0000   0.0000          ?        ? 24245.9434 173.6779          ?        ?     1557.0        5.6       ?       ? 
1 1 1   15    8   34 o    475.4    2.7    0.0000   0.0000          ?        ?  2259.7280  25.5409          ?        ?      475.4        2.7       ?       ? 
1 1 1   15    8   35 o   1284.3    4.4    0.0000   0.0000          ?        ? 16494.9297 113.6568          ?        ?     1284.3        4.4       ?       ? 
1 1 1   15    8   36 o    848.3    3.2    0.0000   0.0000          ?        ?  7196.1387  54.9129          ?        ?      848.3        3.2       ?       ? 
1 1 1   15    8   37 o    290.9    2.9    0.0000   0.0000          ?        ?   846.0411  16.6016          ?        ?      290.9        2.9       ?       ? 
1 1 1   15    8   38 o    486.8    2.8    0.0000   0.0000          ?        ?  2370.1924  26.8179          ?        ?      486.8        2.8       ?       ? 
1 1 1   15    8   39 o   1244.0    4.3    0.0000   0.0000          ?        ? 15477.1250 107.2716          ?        ?     1244.0        4.3       ?       ? 
1 1 1   15    8   40 o    333.3    3.2    0.0000   0.0000          ?        ?  1111.0276  21.0712          ?        ?      333.3        3.2       ?       ? 
1 1 1   15    8   41 o   1182.2    4.2    0.0000   0.0000          ?        ? 13977.2383  98.3323          ?        ?     1182.2        4.2       ?       ? 
1 1 1   15    8   42 o    922.0    3.4    0.0000   0.0000          ?        ?  8501.9150  63.2136          ?        ?      922.0        3.4       ?       ? 
1 1 1   15    8   43 o   1494.2    5.0    0.0000   0.0000          ?        ? 22330.3789 150.0526          ?        ?     1494.2        5.0       ?       ? 
1 1 1   15    8   44 o    175.2    5.1    0.0000   0.0000          ?        ?   307.1289  17.8786          ?        ?      175.2        5.1       ?       ? 
1 1 1   15    8   45 o     45.2   16.1    0.0000   0.0000          ?        ?    17.2401  18.5171          ?        ?       45.2       16.1       ?       ? 
1 1 1   15    8   46 o    712.8    3.0    0.0000   0.0000          ?        ?  5080.7168  42.7809          ?        ?      712.8        3.0       ?       ? 
1 1 1   15    8   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    8   48 o    526.9    2.7    0.0000   0.0000          ?        ?  2776.2920  28.0950          ?        ?      526.9        2.7       ?       ? 
1 1 1   15    8   49 o    510.5    2.7    0.0000   0.0000          ?        ?  2606.4453  27.4564          ?        ?      510.5        2.7       ?       ? 
1 1 1   15    8   50 f    515.5    2.7    0.0000   0.0000          ?        ?  2658.1655  27.4564          ?        ?      515.5        2.7       ?       ? 
1 1 1   15    8   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    8   52 o    531.3    2.7    0.0000   0.0000          ?        ?  2823.5427  28.7335          ?        ?      531.3        2.7       ?       ? 
1 1 1   15    8   53 o    592.9    2.7    0.0000   0.0000          ?        ?  3515.7000  31.9261          ?        ?      592.9        2.7       ?       ? 
1 1 1   15    8   54 o    288.6    3.4    0.0000   0.0000          ?        ?   833.2708  19.7942          ?        ?      288.6        3.4       ?       ? 
1 1 1   15    8   55 o    212.0    4.2    0.0000   0.0000          ?        ?   449.5192  17.8786          ?        ?      212.0        4.2       ?       ? 
1 1 1   15    8   56 o    265.7    3.6    0.0000   0.0000          ?        ?   706.2049  19.1556          ?        ?      265.7        3.6       ?       ? 
1 1 1   15    8   57 o    261.8    3.8    0.0000   0.0000          ?        ?   685.7722  19.7942          ?        ?      261.8        3.8       ?       ? 
1 1 1   15    8   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    8   59 o    600.2    2.8    0.0000   0.0000          ?        ?  3603.8162  33.2031          ?        ?      600.2        2.8       ?       ? 
1 1 1   15    8   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    8   61 o    333.1    3.2    0.0000   0.0000          ?        ?  1110.3890  21.0712          ?        ?      333.1        3.2       ?       ? 
1 1 1   15    8   62 o    158.5    6.2    0.0000   0.0000          ?        ?   251.5775  19.7942          ?        ?      158.5        6.2       ?       ? 
1 1 1   15    8   63 o     21.5   10.7    0.0000   0.0000          ?        ?   -48.5276  18.5171          ?        ?       21.5       10.7       ?       ? 
1 1 1   15    8   64 o     19.6    9.9    0.0000   0.0000          ?        ?   -61.9366  18.5171          ?        ?       19.6        9.9       ?       ? 
1 1 1   15    8   65 o     23.4   11.5    0.0000   0.0000          ?        ?   -44.6965  19.7942          ?        ?       23.4       11.5       ?       ? 
1 1 1   15    8   66 o     25.0   12.1    0.0000   0.0000          ?        ?   -33.2031  19.1556          ?        ?       25.0       12.1       ?       ? 
1 1 1   15    8   67 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    8   68 o    393.6    3.2    0.0000   0.0000          ?        ?  1550.3306  24.9023          ?        ?      393.6        3.2       ?       ? 
1 1 1   15    8   69 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    8   70 o    464.6    2.9    0.0000   0.0000          ?        ?  2160.1187  26.8179          ?        ?      464.6        2.9       ?       ? 
1 1 1   15    8   71 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    8   72 o     24.0   11.9    0.0000   0.0000          ?        ?   -54.9129  22.3483          ?        ?       24.0       11.9       ?       ? 
1 1 1   15    8   73 o    167.6    6.5    0.0000   0.0000          ?        ?   282.2266  21.7097          ?        ?      167.6        6.5       ?       ? 
1 1 1   15    8   74 o     62.3   17.0    0.0000   0.0000          ?        ?    41.5039  21.7097          ?        ?       62.3       17.0       ?       ? 
1 1 1   15    8   75 o     32.4   14.9    0.0000   0.0000          ?        ?   -15.9630  22.3483          ?        ?       32.4       14.9       ?       ? 
1 1 1   15    8   76 o     30.1   14.1    0.0000   0.0000          ?        ?   -21.7097  21.7097          ?        ?       30.1       14.1       ?       ? 
1 1 1   15    8   77 o     31.1   14.4    0.0000   0.0000          ?        ?   -15.9630  21.0712          ?        ?       31.1       14.4       ?       ? 
1 1 1   15    8   78 o    196.6    5.5    0.0000   0.0000          ?        ?   388.8597  21.7097          ?        ?      196.6        5.5       ?       ? 
1 1 1   15    9    0 o    637.9    3.8 4069.2983  47.8891  4069.2983  47.8891  4069.2983  47.8891      637.9      3.8      637.9        3.8     0.0     0.0 
1 1 1   15    9    1 o     95.6    2.7    0.0000   0.0000          ?        ?    91.3086   5.1082          ?        ?       95.6        2.7       ?       ? 
1 1 1   15    9    2 o   1152.6    4.2    0.0000   0.0000          ?        ? 13286.3584  96.4168          ?        ?     1152.6        4.2       ?       ? 
1 1 1   15    9    3 o    343.3    1.7    0.0000   0.0000          ?        ?  1178.7109  11.4934          ?        ?      343.3        1.7       ?       ? 
1 1 1   15    9    4 o    402.7    1.7    0.0000   0.0000          ?        ?  1621.8450  14.0475          ?        ?      402.7        1.7       ?       ? 
1 1 1   15    9    5 o    526.5    2.1    0.0000   0.0000          ?        ?  2772.4609  21.7097          ?        ?      526.5        2.1       ?       ? 
1 1 1   15    9    6 o    128.8    2.0    0.0000   0.0000          ?        ?   166.0156   5.1082          ?        ?      128.8        2.0       ?       ? 
1 1 1   15    9    7 o    794.7    2.8    0.0000   0.0000          ?        ?  6314.9790  44.6965          ?        ?      794.7        2.8       ?       ? 
1 1 1   15    9    8 o    103.0    2.5    0.0000   0.0000          ?        ?   105.9946   5.1082          ?        ?      103.0        2.5       ?       ? 
1 1 1   15    9    9 o    441.7    2.0    0.0000   0.0000          ?        ?  1951.3221  17.2401          ?        ?      441.7        2.0       ?       ? 
1 1 1   15    9   10 o   1160.7    3.9    0.0000   0.0000          ?        ? 13474.0830  91.3086          ?        ?     1160.7        3.9       ?       ? 
1 1 1   15    9   11 o    418.2    1.9    0.0000   0.0000          ?        ?  1748.9106  15.9630          ?        ?      418.2        1.9       ?       ? 
1 1 1   15    9   12 o    847.9    3.0    0.0000   0.0000          ?        ?  7189.1152  51.0817          ?        ?      847.9        3.0       ?       ? 
1 1 1   15    9   13 o    466.4    2.0    0.0000   0.0000          ?        ?  2175.4434  18.5171          ?        ?      466.4        2.0       ?       ? 
1 1 1   15    9   14 o    653.8    2.5    0.0000   0.0000          ?        ?  4274.2642  32.5646          ?        ?      653.8        2.5       ?       ? 
1 1 1   15    9   15 o    499.8    2.1    0.0000   0.0000          ?        ?  2497.8967  21.0712          ?        ?      499.8        2.1       ?       ? 
1 1 1   15    9   16 o   1389.1    4.6    0.0000   0.0000          ?        ? 19298.6777 128.3428          ?        ?     1389.1        4.6       ?       ? 
1 1 1   15    9   17 o   1476.8    4.9    0.0000   0.0000          ?        ? 21809.9824 145.5829          ?        ?     1476.8        4.9       ?       ? 
1 1 1   15    9   18 f   1420.7    4.8    0.0000   0.0000          ?        ? 20184.3086 136.0051          ?        ?     1420.7        4.8       ?       ? 
1 1 1   15    9   19 o   1089.9    3.8    0.0000   0.0000          ?        ? 11879.6953  83.0078          ?        ?     1089.9        3.8       ?       ? 
1 1 1   15    9   20 o    217.2    2.4    0.0000   0.0000          ?        ?   471.8675  10.2163          ?        ?      217.2        2.4       ?       ? 
1 1 1   15    9   21 o    954.2    3.4    0.0000   0.0000          ?        ?  9104.6797  65.7677          ?        ?      954.2        3.4       ?       ? 
1 1 1   15    9   22 o   1608.1    5.5    0.0000   0.0000          ?        ? 25862.0410 175.5934          ?        ?     1608.1        5.5       ?       ? 
1 1 1   15    9   23 o    456.1    2.4    0.0000   0.0000          ?        ?  2080.3035  22.3483          ?        ?      456.1        2.4       ?       ? 
1 1 1   15    9   24 o    694.5    2.9    0.0000   0.0000          ?        ?  4822.7539  40.8654          ?        ?      694.5        2.9       ?       ? 
1 1 1   15    9   25 o   1094.3    4.1    0.0000   0.0000          ?        ? 11975.4727  88.7545          ?        ?     1094.3        4.1       ?       ? 
1 1 1   15    9   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    9   27 o   1180.1    4.1    0.0000   0.0000          ?        ? 13927.4336  97.6938          ?        ?     1180.1        4.1       ?       ? 
1 1 1   15    9   28 o    432.5    2.4    0.0000   0.0000          ?        ?  1870.8684  21.0712          ?        ?      432.5        2.4       ?       ? 
1 1 1   15    9   29 o    568.6    2.4    0.0000   0.0000          ?        ?  3232.8350  27.4564          ?        ?      568.6        2.4       ?       ? 
1 1 1   15    9   30 o    645.5    2.8    0.0000   0.0000          ?        ?  4166.3535  36.3957          ?        ?      645.5        2.8       ?       ? 
1 1 1   15    9   31 o    749.0    2.9    0.0000   0.0000          ?        ?  5610.0508  44.0580          ?        ?      749.0        2.9       ?       ? 
1 1 1   15    9   32 o   1328.1    4.5    0.0000   0.0000          ?        ? 17640.4375 120.0421          ?        ?     1328.1        4.5       ?       ? 
1 1 1   15    9   33 o    482.2    3.0    0.0000   0.0000          ?        ?  2324.8572  28.7335          ?        ?      482.2        3.0       ?       ? 
1 1 1   15    9   34 o    391.2    2.8    0.0000   0.0000          ?        ?  1530.5364  21.7097          ?        ?      391.2        2.8       ?       ? 
1 1 1   15    9   35 o    574.7    3.2    0.0000   0.0000          ?        ?  3303.0723  37.0343          ?        ?      574.7        3.2       ?       ? 
1 1 1   15    9   36 o    775.9    3.1    0.0000   0.0000          ?        ?  6021.2588  48.5276          ?        ?      775.9        3.1       ?       ? 
1 1 1   15    9   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15    9   38 o    410.6    2.7    0.0000   0.0000          ?        ?  1686.3357  22.3483          ?        ?      410.6        2.7       ?       ? 
1 1 1   15    9   39 o    440.2    2.6    0.0000   0.0000          ?        ?  1937.9131  22.9868          ?        ?      440.2        2.6       ?       ? 
1 1 1   15    9   40 o    914.5    3.4    0.0000   0.0000          ?        ?  8363.3564  62.5751          ?        ?      914.5        3.4       ?       ? 
1 1 1   15    9   41 o     74.1   13.9    0.0000   0.0000          ?        ?    56.8284  19.7942          ?        ?       74.1       13.9       ?       ? 
1 1 1   15    9   42 o    168.0    5.3    0.0000   0.0000          ?        ?   282.2266  17.8786          ?        ?      168.0        5.3       ?       ? 
1 1 1   15    9   43 o    416.7    2.7    0.0000   0.0000          ?        ?  1736.1403  22.3483          ?        ?      416.7        2.7       ?       ? 
1 1 1   15    9   44 o    592.7    2.7    0.0000   0.0000          ?        ?  3513.7844  31.9261          ?        ?      592.7        2.7       ?       ? 
1 1 1   15    9   45 o    684.5    2.9    0.0000   0.0000          ?        ?  4686.1104  39.5883          ?        ?      684.5        2.9       ?       ? 
1 1 1   15    9   46 o    185.7    5.0    0.0000   0.0000          ?        ?   344.8017  18.5171          ?        ?      185.7        5.0       ?       ? 
1 1 1   15    9   47 f    455.8    2.8    0.0000   0.0000          ?        ?  2077.7493  25.5409          ?        ?      455.8        2.8       ?       ? 
1 1 1   15    9   48 o    482.7    2.6    0.0000   0.0000          ?        ?  2330.6040  25.5409          ?        ?      482.7        2.6       ?       ? 
1 1 1   15    9   49 o    603.2    2.8    0.0000   0.0000          ?        ?  3638.9348  33.2031          ?        ?      603.2        2.8       ?       ? 
1 1 1   15    9   50 o     22.8   11.3    0.0000   0.0000          ?        ?   -48.5276  19.7942          ?        ?       22.8       11.3       ?       ? 
1 1 1   15    9   51 o    430.0    2.7    0.0000   0.0000          ?        ?  1849.1587  23.6253          ?        ?      430.0        2.7       ?       ? 
1 1 1   15    9   52 o    359.2    2.9    0.0000   0.0000          ?        ?  1290.4523  21.0712          ?        ?      359.2        2.9       ?       ? 
1 1 1   15    9   53 o    254.4    3.8    0.0000   0.0000          ?        ?   647.4609  19.1556          ?        ?      254.4        3.8       ?       ? 
1 1 1   15    9   54 o    159.3    5.8    0.0000   0.0000          ?        ?   254.1316  18.5171          ?        ?      159.3        5.8       ?       ? 
1 1 1   15    9   55 o    273.7    3.6    0.0000   0.0000          ?        ?   749.6244  19.7942          ?        ?      273.7        3.6       ?       ? 
1 1 1   15    9   56 o     98.1    9.4    0.0000   0.0000          ?        ?    96.4168  18.5171          ?        ?       98.1        9.4       ?       ? 
1 1 1   15    9   57 o    114.3    8.1    0.0000   0.0000          ?        ?   130.8969  18.5171          ?        ?      114.3        8.1       ?       ? 
1 1 1   15    9   58 o    326.2    3.2    0.0000   0.0000          ?        ?  1064.4155  21.0712          ?        ?      326.2        3.2       ?       ? 
1 1 1   15    9   59 o    154.0    6.2    0.0000   0.0000          ?        ?   237.5300  19.1556          ?        ?      154.0        6.2       ?       ? 
1 1 1   15    9   60 o    330.7    3.2    0.0000   0.0000          ?        ?  1093.7876  21.0712          ?        ?      330.7        3.2       ?       ? 
1 1 1   15    9   61 o    277.2    3.6    0.0000   0.0000          ?        ?   768.7800  19.7942          ?        ?      277.2        3.6       ?       ? 
1 1 1   15    9   62 o    320.2    3.3    0.0000   0.0000          ?        ?  1026.1042  21.0712          ?        ?      320.2        3.3       ?       ? 
1 1 1   15    9   63 o    219.1    4.5    0.0000   0.0000          ?        ?   480.8068  19.7942          ?        ?      219.1        4.5       ?       ? 
1 1 1   15    9   64 o    297.3    3.8    0.0000   0.0000          ?        ?   884.3525  22.3483          ?        ?      297.3        3.8       ?       ? 
1 1 1   15    9   65 o     53.8   16.7    0.0000   0.0000          ?        ?    29.3720  19.7942          ?        ?       53.8       16.7       ?       ? 
1 1 1   15    9   66 o     30.2   14.0    0.0000   0.0000          ?        ?   -17.8786  20.4327          ?        ?       30.2       14.0       ?       ? 
1 1 1   15    9   67 o     23.1   11.5    0.0000   0.0000          ?        ?   -49.8047  20.4327          ?        ?       23.1       11.5       ?       ? 
1 1 1   15    9   68 o     40.3   16.5    0.0000   0.0000          ?        ?     6.3852  21.0712          ?        ?       40.3       16.5       ?       ? 
1 1 1   15    9   69 o    237.0    4.9    0.0000   0.0000          ?        ?   562.5375  22.9868          ?        ?      237.0        4.9       ?       ? 
1 1 1   15    9   70 o    141.0    7.7    0.0000   0.0000          ?        ?   199.8573  21.7097          ?        ?      141.0        7.7       ?       ? 
1 1 1   15    9   71 o    177.1    6.1    0.0000   0.0000          ?        ?   314.7912  21.7097          ?        ?      177.1        6.1       ?       ? 
1 1 1   15    9   72 o    246.8    4.7    0.0000   0.0000          ?        ?   610.4266  22.9868          ?        ?      246.8        4.7       ?       ? 
1 1 1   15    9   73 o    102.6   10.3    0.0000   0.0000          ?        ?   106.6331  21.0712          ?        ?      102.6       10.3       ?       ? 
1 1 1   15    9   74 o     50.1   17.5    0.0000   0.0000          ?        ?    23.6253  21.7097          ?        ?       50.1       17.5       ?       ? 
1 1 1   15    9   75 o     32.9   14.9    0.0000   0.0000          ?        ?   -10.8549  21.0712          ?        ?       32.9       14.9       ?       ? 
1 1 1   15    9   76 o    120.6    7.9    0.0000   0.0000          ?        ?   146.8600  19.1556          ?        ?      120.6        7.9       ?       ? 
1 1 1   15    9   77 o    165.4    5.6    0.0000   0.0000          ?        ?   275.2028  18.5171          ?        ?      165.4        5.6       ?       ? 
1 1 1   15    9   78 o     55.7   16.9    0.0000   0.0000          ?        ?    33.2031  20.4327          ?        ?       55.7       16.9       ?       ? 
1 1 1   15   10    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15   10    1 o    901.1    3.4    0.0000   0.0000          ?        ?  8120.7183  61.9366          ?        ?      901.1        3.4       ?       ? 
1 1 1   15   10    2 o    609.2    2.5    0.0000   0.0000          ?        ?  3711.7261  30.0105          ?        ?      609.2        2.5       ?       ? 
1 1 1   15   10    3 o   1143.8    4.1    0.0000   0.0000          ?        ? 13083.3086  94.5012          ?        ?     1143.8        4.1       ?       ? 
1 1 1   15   10    4 o   1262.9    4.2    0.0000   0.0000          ?        ? 15950.2705 106.6331          ?        ?     1262.9        4.2       ?       ? 
1 1 1   15   10    5 o    594.6    2.3    0.0000   0.0000          ?        ?  3536.1326  27.4564          ?        ?      594.6        2.3       ?       ? 
1 1 1   15   10    6 o   1029.2    3.5    0.0000   0.0000          ?        ? 10593.0742  72.7915          ?        ?     1029.2        3.5       ?       ? 
1 1 1   15   10    7 o   1139.3    3.9    0.0000   0.0000          ?        ? 12980.5059  88.7545          ?        ?     1139.3        3.9       ?       ? 
1 1 1   15   10    8 o   1647.3    5.5    0.0000   0.0000          ?        ? 27140.3613 182.6172          ?        ?     1647.3        5.5       ?       ? 
1 1 1   15   10    9 o    215.5    1.9    0.0000   0.0000          ?        ?   464.2052   8.3008          ?        ?      215.5        1.9       ?       ? 
1 1 1   15   10   10 o    517.4    2.1    0.0000   0.0000          ?        ?  2676.6826  21.7097          ?        ?      517.4        2.1       ?       ? 
1 1 1   15   10   11 o    670.5    2.5    0.0000   0.0000          ?        ?  4495.8306  33.8416          ?        ?      670.5        2.5       ?       ? 
1 1 1   15   10   12 o    494.1    2.0    0.0000   0.0000          ?        ?  2441.0681  19.7942          ?        ?      494.1        2.0       ?       ? 
1 1 1   15   10   13 o    250.4    1.8    0.0000   0.0000          ?        ?   627.0282   8.9393          ?        ?      250.4        1.8       ?       ? 
1 1 1   15   10   14 o   1154.2    3.9    0.0000   0.0000          ?        ? 13323.3926  90.6701          ?        ?     1154.2        3.9       ?       ? 
1 1 1   15   10   15 o    313.0    1.8    0.0000   0.0000          ?        ?   979.4921  11.4934          ?        ?      313.0        1.8       ?       ? 
1 1 1   15   10   16 o    478.8    2.1    0.0000   0.0000          ?        ?  2292.9312  19.7942          ?        ?      478.8        2.1       ?       ? 
1 1 1   15   10   17 o    430.4    2.0    0.0000   0.0000          ?        ?  1852.3513  17.2401          ?        ?      430.4        2.0       ?       ? 
1 1 1   15   10   18 o   1456.0    5.0    0.0000   0.0000          ?        ? 21202.1113 144.9444          ?        ?     1456.0        5.0       ?       ? 
1 1 1   15   10   19 o    369.0    2.2    0.0000   0.0000          ?        ?  1361.9667  15.9630          ?        ?      369.0        2.2       ?       ? 
1 1 1   15   10   20 o   1598.3    5.4    0.0000   0.0000          ?        ? 25546.6113 173.0394          ?        ?     1598.3        5.4       ?       ? 
1 1 1   15   10   21 o    733.1    2.9    0.0000   0.0000          ?        ?  5375.0752  42.7809          ?        ?      733.1        2.9       ?       ? 
1 1 1   15   10   22 o   1613.7    5.5    0.0000   0.0000          ?        ? 26043.3809 176.2320          ?        ?     1613.7        5.5       ?       ? 
1 1 1   15   10   23 o   1132.7    4.2    0.0000   0.0000          ?        ? 12829.8154  94.5012          ?        ?     1132.7        4.2       ?       ? 
1 1 1   15   10   24 o    451.3    2.3    0.0000   0.0000          ?        ?  2036.8840  21.0712          ?        ?      451.3        2.3       ?       ? 
1 1 1   15   10   25 o    602.3    2.6    0.0000   0.0000          ?        ?  3627.4412  31.2876          ?        ?      602.3        2.6       ?       ? 
1 1 1   15   10   26 o    266.8    2.8    0.0000   0.0000          ?        ?   711.9516  14.6860          ?        ?      266.8        2.8       ?       ? 
1 1 1   15   10   27 o   1179.7    4.2    0.0000   0.0000          ?        ? 13916.5791  99.6094          ?        ?     1179.7        4.2       ?       ? 
1 1 1   15   10   28 o   1058.1    3.7    0.0000   0.0000          ?        ? 11197.1152  77.8996          ?        ?     1058.1        3.7       ?       ? 
1 1 1   15   10   29 o    631.2    2.7    0.0000   0.0000          ?        ?  3983.7366  34.4802          ?        ?      631.2        2.7       ?       ? 
1 1 1   15   10   30 o    533.8    2.4    0.0000   0.0000          ?        ?  2849.7219  25.5409          ?        ?      533.8        2.4       ?       ? 
1 1 1   15   10   31 o   1261.2    4.4    0.0000   0.0000          ?        ? 15906.8506 111.1028          ?        ?     1261.2        4.4       ?       ? 
1 1 1   15   10   32 o    639.3    2.8    0.0000   0.0000          ?        ?  4087.8154  36.3957          ?        ?      639.3        2.8       ?       ? 
1 1 1   15   10   33 o   1049.8    4.0    0.0000   0.0000          ?        ? 11020.8828  83.0078          ?        ?     1049.8        4.0       ?       ? 
1 1 1   15   10   34 o   1955.8    6.4    0.0000   0.0000          ?        ? 38257.0234 250.3005          ?        ?     1955.8        6.4       ?       ? 
1 1 1   15   10   35 o    521.9    3.1    0.0000   0.0000          ?        ?  2723.9333  31.9261          ?        ?      521.9        3.1       ?       ? 
1 1 1   15   10   36 o   1160.8    4.3    0.0000   0.0000          ?        ? 13475.3594 100.8864          ?        ?     1160.8        4.3       ?       ? 
1 1 1   15   10   37 o    991.7    3.8    0.0000   0.0000          ?        ?  9836.4258  75.3456          ?        ?      991.7        3.8       ?       ? 
1 1 1   15   10   38 o    403.8    2.8    0.0000   0.0000          ?        ?  1630.7842  22.9868          ?        ?      403.8        2.8       ?       ? 
1 1 1   15   10   39 o     70.1   14.6    0.0000   0.0000          ?        ?    51.0817  19.7942          ?        ?       70.1       14.6       ?       ? 
1 1 1   15   10   40 f    886.7    3.5    0.0000   0.0000          ?        ?  7863.3940  62.5751          ?        ?      886.7        3.5       ?       ? 
1 1 1   15   10   41 o    961.4    3.5    0.0000   0.0000          ?        ?  9244.5166  67.0448          ?        ?      961.4        3.5       ?       ? 
1 1 1   15   10   42 o    634.3    2.8    0.0000   0.0000          ?        ?  4023.3247  35.1187          ?        ?      634.3        2.8       ?       ? 
1 1 1   15   10   43 o    484.7    2.6    0.0000   0.0000          ?        ?  2349.7595  25.5409          ?        ?      484.7        2.6       ?       ? 
1 1 1   15   10   44 o    808.9    3.1    0.0000   0.0000          ?        ?  6544.2085  49.8047          ?        ?      808.9        3.1       ?       ? 
1 1 1   15   10   45 o    179.5    5.0    0.0000   0.0000          ?        ?   322.4534  17.8786          ?        ?      179.5        5.0       ?       ? 
1 1 1   15   10   46 o    417.6    2.8    0.0000   0.0000          ?        ?  1744.4412  22.9868          ?        ?      417.6        2.8       ?       ? 
1 1 1   15   10   47 o   1009.9    3.6    0.0000   0.0000          ?        ? 10200.3828  73.4300          ?        ?     1009.9        3.6       ?       ? 
1 1 1   15   10   48 o    328.9    3.4    0.0000   0.0000          ?        ?  1082.2942  22.3483          ?        ?      328.9        3.4       ?       ? 
1 1 1   15   10   49 o    788.8    3.0    0.0000   0.0000          ?        ?  6222.3931  47.8891          ?        ?      788.8        3.0       ?       ? 
1 1 1   15   10   50 o    477.5    2.7    0.0000   0.0000          ?        ?  2280.1609  26.1794          ?        ?      477.5        2.7       ?       ? 
1 1 1   15   10   51 o    602.8    2.7    0.0000   0.0000          ?        ?  3633.8264  32.5646          ?        ?      602.8        2.7       ?       ? 
1 1 1   15   10   52 o    356.1    2.9    0.0000   0.0000          ?        ?  1268.1040  20.4327          ?        ?      356.1        2.9       ?       ? 
1 1 1   15   10   53 o     24.1   11.7    0.0000   0.0000          ?        ?   -31.2876  17.8786          ?        ?       24.1       11.7       ?       ? 
1 1 1   15   10   54 o    313.9    3.4    0.0000   0.0000          ?        ?   985.8774  21.0712          ?        ?      313.9        3.4       ?       ? 
1 1 1   15   10   55 o    737.3    2.9    0.0000   0.0000          ?        ?  5438.2886  43.4195          ?        ?      737.3        2.9       ?       ? 
1 1 1   15   10   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15   10   57 o    233.8    4.5    0.0000   0.0000          ?        ?   547.2130  21.0712          ?        ?      233.8        4.5       ?       ? 
1 1 1   15   10   58 o    453.0    2.8    0.0000   0.0000          ?        ?  2052.8469  25.5409          ?        ?      453.0        2.8       ?       ? 
1 1 1   15   10   59 o    190.8    5.0    0.0000   0.0000          ?        ?   364.5958  19.1556          ?        ?      190.8        5.0       ?       ? 
1 1 1   15   10   60 o     55.2   16.3    0.0000   0.0000          ?        ?    31.2876  19.1556          ?        ?       55.2       16.3       ?       ? 
1 1 1   15   10   61 o    197.1    5.0    0.0000   0.0000          ?        ?   388.8597  19.7942          ?        ?      197.1        5.0       ?       ? 
1 1 1   15   10   62 o    189.3    5.2    0.0000   0.0000          ?        ?   358.8492  19.7942          ?        ?      189.3        5.2       ?       ? 
1 1 1   15   10   63 o    485.9    2.8    0.0000   0.0000          ?        ?  2361.8914  27.4564          ?        ?      485.9        2.8       ?       ? 
1 1 1   15   10   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15   10   65 o    279.3    3.8    0.0000   0.0000          ?        ?   780.9120  21.0712          ?        ?      279.3        3.8       ?       ? 
1 1 1   15   10   66 o     58.4   16.3    0.0000   0.0000          ?        ?    35.7572  19.7942          ?        ?       58.4       16.3       ?       ? 
1 1 1   15   10   67 o    226.4    4.7    0.0000   0.0000          ?        ?   513.3714  21.0712          ?        ?      226.4        4.7       ?       ? 
1 1 1   15   10   68 o     51.4   16.8    0.0000   0.0000          ?        ?    26.1794  19.7942          ?        ?       51.4       16.8       ?       ? 
1 1 1   15   10   69 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15   10   70 o    218.9    5.0    0.0000   0.0000          ?        ?   480.1682  21.7097          ?        ?      218.9        5.0       ?       ? 
1 1 1   15   10   71 o    180.8    6.0    0.0000   0.0000          ?        ?   328.2001  21.7097          ?        ?      180.8        6.0       ?       ? 
1 1 1   15   10   72 o    251.2    4.3    0.0000   0.0000          ?        ?   632.1364  21.7097          ?        ?      251.2        4.3       ?       ? 
1 1 1   15   10   73 o    279.5    4.1    0.0000   0.0000          ?        ?   782.8275  22.9868          ?        ?      279.5        4.1       ?       ? 
1 1 1   15   10   74 o    169.6    6.2    0.0000   0.0000          ?        ?   289.2503  21.0712          ?        ?      169.6        6.2       ?       ? 
1 1 1   15   10   75 o     29.5   13.7    0.0000   0.0000          ?        ?   -15.3245  19.1556          ?        ?       29.5       13.7       ?       ? 
1 1 1   15   10   76 o     48.7   17.5    0.0000   0.0000          ?        ?    21.7097  21.7097          ?        ?       48.7       17.5       ?       ? 
1 1 1   15   10   77 o    114.0    9.8    0.0000   0.0000          ?        ?   132.1740  22.3483          ?        ?      114.0        9.8       ?       ? 
1 1 1   15   10   78 o    239.0    4.8    0.0000   0.0000          ?        ?   574.0309  22.9868          ?        ?      239.0        4.8       ?       ? 
1 1 1   15   11    0 o    459.8    3.1 2114.7837  28.7335  2114.7837  28.7335  2114.7837  28.7335      459.8      3.1      459.8        3.1     0.0     0.0 
1 1 1   15   11    1 o   1485.6    5.5    0.0000   0.0000          ?        ? 22071.7773 162.8230          ?        ?     1485.6        5.5       ?       ? 
1 1 1   15   11    2 o   1254.7    4.7    0.0000   0.0000          ?        ? 15744.6670 116.8494          ?        ?     1254.7        4.7       ?       ? 
1 1 1   15   11    3 o    965.5    3.6    0.0000   0.0000          ?        ?  9322.4160  70.2374          ?        ?      965.5        3.6       ?       ? 
1 1 1   15   11    4 o    336.4    1.6    0.0000   0.0000          ?        ?  1131.4603  10.8549          ?        ?      336.4        1.6       ?       ? 
1 1 1   15   11    5 o   1056.4    3.6    0.0000   0.0000          ?        ? 11160.7197  75.9841          ?        ?     1056.4        3.6       ?       ? 
1 1 1   15   11    6 o    902.3    3.2    0.0000   0.0000          ?        ?  8142.4272  58.1055          ?        ?      902.3        3.2       ?       ? 
1 1 1   15   11    7 o    856.6    3.0    0.0000   0.0000          ?        ?  7337.8901  51.7203          ?        ?      856.6        3.0       ?       ? 
1 1 1   15   11    8 o   1382.5    4.7    0.0000   0.0000          ?        ? 19116.0605 130.2584          ?        ?     1382.5        4.7       ?       ? 
1 1 1   15   11    9 o    469.7    2.0    0.0000   0.0000          ?        ?  2206.0923  18.5171          ?        ?      469.7        2.0       ?       ? 
1 1 1   15   11   10 o    527.7    2.1    0.0000   0.0000          ?        ?  2784.5928  21.7097          ?        ?      527.7        2.1       ?       ? 
1 1 1   15   11   11 o    385.3    1.8    0.0000   0.0000          ?        ?  1484.5627  14.0475          ?        ?      385.3        1.8       ?       ? 
1 1 1   15   11   12 o    895.9    3.2    0.0000   0.0000          ?        ?  8027.4937  56.8284          ?        ?      895.9        3.2       ?       ? 
1 1 1   15   11   13 o    926.5    3.3    0.0000   0.0000          ?        ?  8584.2852  60.6596          ?        ?      926.5        3.3       ?       ? 
1 1 1   15   11   14 o    650.8    2.5    0.0000   0.0000          ?        ?  4235.3140  32.5646          ?        ?      650.8        2.5       ?       ? 
1 1 1   15   11   15 f    684.8    2.6    0.0000   0.0000          ?        ?  4689.3032  35.1187          ?        ?      684.8        2.6       ?       ? 
1 1 1   15   11   16 o    851.2    3.1    0.0000   0.0000          ?        ?  7245.3047  52.3588          ?        ?      851.2        3.1       ?       ? 
1 1 1   15   11   17 f   1005.7    3.5    0.0000   0.0000          ?        ? 10114.8213  70.2374          ?        ?     1005.7        3.5       ?       ? 
1 1 1   15   11   18 o   1931.6    6.4    0.0000   0.0000          ?        ? 37313.9258 248.3849          ?        ?     1931.6        6.4       ?       ? 
1 1 1   15   11   19 o   1091.7    3.8    0.0000   0.0000          ?        ? 11918.6445  83.6463          ?        ?     1091.7        3.8       ?       ? 
1 1 1   15   11   20 o    983.0    3.5    0.0000   0.0000          ?        ?  9664.0244  69.5989          ?        ?      983.0        3.5       ?       ? 
1 1 1   15   11   21 o    429.1    2.4    0.0000   0.0000          ?        ?  1841.4963  20.4327          ?        ?      429.1        2.4       ?       ? 
1 1 1   15   11   22 o     96.2    6.3    0.0000   0.0000          ?        ?    92.5856  12.1319          ?        ?       96.2        6.3       ?       ? 
1 1 1   15   11   23 o   1567.6    5.6    0.0000   0.0000          ?        ? 24576.6973 174.3164          ?        ?     1567.6        5.6       ?       ? 
1 1 1   15   11   24 o    263.8    2.7    0.0000   0.0000          ?        ?   695.9886  14.0475          ?        ?      263.8        2.7       ?       ? 
1 1 1   15   11   25 f    531.5    2.5    0.0000   0.0000          ?        ?  2825.4583  26.1794          ?        ?      531.5        2.5       ?       ? 
1 1 1   15   11   26 o   1344.8    4.7    0.0000   0.0000          ?        ? 18084.8477 125.1502          ?        ?     1344.8        4.7       ?       ? 
1 1 1   15   11   27 o    584.4    2.7    0.0000   0.0000          ?        ?  3414.8135  31.2876          ?        ?      584.4        2.7       ?       ? 
1 1 1   15   11   28 o    758.0    3.0    0.0000   0.0000          ?        ?  5745.4175  45.9736          ?        ?      758.0        3.0       ?       ? 
1 1 1   15   11   29 o   1039.2    3.8    0.0000   0.0000          ?        ? 10799.9551  79.1767          ?        ?     1039.2        3.8       ?       ? 
1 1 1   15   11   30 o    661.9    2.7    0.0000   0.0000          ?        ?  4380.8965  35.7572          ?        ?      661.9        2.7       ?       ? 
1 1 1   15   11   31 f    330.0    2.6    0.0000   0.0000          ?        ?  1089.3180  17.2401          ?        ?      330.0        2.6       ?       ? 
1 1 1   15   11   32 o    771.5    3.4    0.0000   0.0000          ?        ?  5952.2988  51.7203          ?        ?      771.5        3.4       ?       ? 
1 1 1   15   11   33 f    835.5    3.4    0.0000   0.0000          ?        ?  6981.5957  57.4669          ?        ?      835.5        3.4       ?       ? 
1 1 1   15   11   34 o    473.5    2.7    0.0000   0.0000          ?        ?  2242.4880  25.5409          ?        ?      473.5        2.7       ?       ? 
1 1 1   15   11   35 o   2043.6    7.0    0.0000   0.0000          ?        ? 41774.0000 285.4192          ?        ?     2043.6        7.0       ?       ? 
1 1 1   15   11   36 o   1197.9    4.5    0.0000   0.0000          ?        ? 14350.1348 108.5487          ?        ?     1197.9        4.5       ?       ? 
1 1 1   15   11   37 o   1481.6    5.1    0.0000   0.0000          ?        ? 21954.9277 150.0526          ?        ?     1481.6        5.1       ?       ? 
1 1 1   15   11   38 o   1419.1    5.0    0.0000   0.0000          ?        ? 20140.2480 143.0288          ?        ?     1419.1        5.0       ?       ? 
1 1 1   15   11   39 o   1437.6    4.9    0.0000   0.0000          ?        ? 20668.9453 139.8362          ?        ?     1437.6        4.9       ?       ? 
1 1 1   15   11   40 o    159.4    6.8    0.0000   0.0000          ?        ?   254.1316  21.7097          ?        ?      159.4        6.8       ?       ? 
1 1 1   15   11   41 o   1212.9    4.3    0.0000   0.0000          ?        ? 14714.7305 105.3561          ?        ?     1212.9        4.3       ?       ? 
1 1 1   15   11   42 o    387.3    2.7    0.0000   0.0000          ?        ?  1499.8872  21.0712          ?        ?      387.3        2.7       ?       ? 
1 1 1   15   11   43 o   1210.0    4.2    0.0000   0.0000          ?        ? 14643.8545 102.1635          ?        ?     1210.0        4.2       ?       ? 
1 1 1   15   11   44 o    617.2    2.9    0.0000   0.0000          ?        ?  3810.0586  35.7572          ?        ?      617.2        2.9       ?       ? 
1 1 1   15   11   45 o    401.8    2.9    0.0000   0.0000          ?        ?  1614.8212  22.9868          ?        ?      401.8        2.9       ?       ? 
1 1 1   15   11   46 o    614.4    3.0    0.0000   0.0000          ?        ?  3775.5784  36.3957          ?        ?      614.4        3.0       ?       ? 
1 1 1   15   11   47 o    520.0    2.8    0.0000   0.0000          ?        ?  2704.7776  28.7335          ?        ?      520.0        2.8       ?       ? 
1 1 1   15   11   48 o    503.4    2.7    0.0000   0.0000          ?        ?  2534.9309  27.4564          ?        ?      503.4        2.7       ?       ? 
1 1 1   15   11   49 o    450.8    3.0    0.0000   0.0000          ?        ?  2032.4143  26.8179          ?        ?      450.8        3.0       ?       ? 
1 1 1   15   11   50 o    525.3    2.8    0.0000   0.0000          ?        ?  2760.3289  29.3720          ?        ?      525.3        2.8       ?       ? 
1 1 1   15   11   51 o    541.3    2.7    0.0000   0.0000          ?        ?  2930.8142  29.3720          ?        ?      541.3        2.7       ?       ? 
1 1 1   15   11   52 o    294.0    3.4    0.0000   0.0000          ?        ?   864.5582  19.7942          ?        ?      294.0        3.4       ?       ? 
1 1 1   15   11   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15   11   54 o    355.9    2.9    0.0000   0.0000          ?        ?  1266.8269  20.4327          ?        ?      355.9        2.9       ?       ? 
1 1 1   15   11   55 o    209.5    4.4    0.0000   0.0000          ?        ?   439.3029  18.5171          ?        ?      209.5        4.4       ?       ? 
1 1 1   15   11   56 o    224.2    4.1    0.0000   0.0000          ?        ?   503.1551  18.5171          ?        ?      224.2        4.1       ?       ? 
1 1 1   15   11   57 o    268.1    3.6    0.0000   0.0000          ?        ?   718.9753  19.1556          ?        ?      268.1        3.6       ?       ? 
1 1 1   15   11   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15   11   59 o    396.9    3.0    0.0000   0.0000          ?        ?  1575.8713  23.6253          ?        ?      396.9        3.0       ?       ? 
1 1 1   15   11   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15   11   61 o     93.6   10.2    0.0000   0.0000          ?        ?    88.1160  19.1556          ?        ?       93.6       10.2       ?       ? 
1 1 1   15   11   62 o    326.0    3.2    0.0000   0.0000          ?        ?  1063.1385  21.0712          ?        ?      326.0        3.2       ?       ? 
1 1 1   15   11   63 o    204.1    4.9    0.0000   0.0000          ?        ?   416.9547  19.7942          ?        ?      204.1        4.9       ?       ? 
1 1 1   15   11   64 o     68.4   14.4    0.0000   0.0000          ?        ?    49.1662  19.1556          ?        ?       68.4       14.4       ?       ? 
1 1 1   15   11   65 o     72.0   14.3    0.0000   0.0000          ?        ?    54.2743  19.7942          ?        ?       72.0       14.3       ?       ? 
1 1 1   15   11   66 o     21.1   10.6    0.0000   0.0000          ?        ?   -58.7440  19.7942          ?        ?       21.1       10.6       ?       ? 
1 1 1   15   11   67 o    152.0    6.7    0.0000   0.0000          ?        ?   231.7833  20.4327          ?        ?      152.0        6.7       ?       ? 
1 1 1   15   11   68 o    337.8    3.4    0.0000   0.0000          ?        ?  1142.3152  22.9868          ?        ?      337.8        3.4       ?       ? 
1 1 1   15   11   69 o    330.1    3.5    0.0000   0.0000          ?        ?  1090.5950  22.9868          ?        ?      330.1        3.5       ?       ? 
1 1 1   15   11   70 f    139.6    7.8    0.0000   0.0000          ?        ?   196.0261  21.7097          ?        ?      139.6        7.8       ?       ? 
1 1 1   15   11   71 o    207.6    5.4    0.0000   0.0000          ?        ?   432.2791  22.3483          ?        ?      207.6        5.4       ?       ? 
1 1 1   15   11   72 o     60.6   17.5    0.0000   0.0000          ?        ?    38.9498  22.3483          ?        ?       60.6       17.5       ?       ? 
1 1 1   15   11   73 o     48.5   17.9    0.0000   0.0000          ?        ?    19.7942  22.9868          ?        ?       48.5       17.9       ?       ? 
1 1 1   15   11   74 o    119.0    8.6    0.0000   0.0000          ?        ?   143.0288  20.4327          ?        ?      119.0        8.6       ?       ? 
1 1 1   15   11   75 o    317.6    3.6    0.0000   0.0000          ?        ?  1010.7797  22.9868          ?        ?      317.6        3.6       ?       ? 
1 1 1   15   11   76 o    135.9    7.5    0.0000   0.0000          ?        ?   186.4483  20.4327          ?        ?      135.9        7.5       ?       ? 
1 1 1   15   11   77 f     36.6   15.5    0.0000   0.0000          ?        ?     1.9156  19.7942          ?        ?       36.6       15.5       ?       ? 
1 1 1   15   12    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15   12    1 o    104.2    3.4    0.0000   0.0000          ?        ?   108.5487   7.0237          ?        ?      104.2        3.4       ?       ? 
1 1 1   15   12    2 o   1155.3    4.3    0.0000   0.0000          ?        ? 13348.9336  99.6094          ?        ?     1155.3        4.3       ?       ? 
1 1 1   15   12    3 o    532.3    2.5    0.0000   0.0000          ?        ?  2833.1206  26.1794          ?        ?      532.3        2.5       ?       ? 
1 1 1   15   12    4 o    680.3    2.5    0.0000   0.0000          ?        ?  4628.0049  34.4802          ?        ?      680.3        2.5       ?       ? 
1 1 1   15   12    5 o    411.7    1.9    0.0000   0.0000          ?        ?  1695.2749  15.3245          ?        ?      411.7        1.9       ?       ? 
1 1 1   15   12    6 o    519.6    2.1    0.0000   0.0000          ?        ?  2699.6694  21.7097          ?        ?      519.6        2.1       ?       ? 
1 1 1   15   12    7 o    545.5    2.2    0.0000   0.0000          ?        ?  2976.1494  24.2638          ?        ?      545.5        2.2       ?       ? 
1 1 1   15   12    8 o    956.5    3.3    0.0000   0.0000          ?        ?  9150.0146  63.8522          ?        ?      956.5        3.3       ?       ? 
1 1 1   15   12    9 o   1275.7    4.3    0.0000   0.0000          ?        ? 16274.6396 109.1872          ?        ?     1275.7        4.3       ?       ? 
1 1 1   15   12   10 o    322.5    1.9    0.0000   0.0000          ?        ?  1040.1517  12.1319          ?        ?      322.5        1.9       ?       ? 
1 1 1   15   12   11 o    436.6    2.0    0.0000   0.0000          ?        ?  1905.9871  17.8786          ?        ?      436.6        2.0       ?       ? 
1 1 1   15   12   12 o    512.7    2.2    0.0000   0.0000          ?        ?  2628.7937  22.9868          ?        ?      512.7        2.2       ?       ? 
1 1 1   15   12   13 o    638.2    2.5    0.0000   0.0000          ?        ?  4072.4910  31.2876          ?        ?      638.2        2.5       ?       ? 
1 1 1   15   12   14 o   1038.9    3.6    0.0000   0.0000          ?        ? 10794.2080  75.3456          ?        ?     1038.9        3.6       ?       ? 
1 1 1   15   12   15 o   1513.9    5.0    0.0000   0.0000          ?        ? 22919.7344 151.9681          ?        ?     1513.9        5.0       ?       ? 
1 1 1   15   12   16 o    634.1    2.5    0.0000   0.0000          ?        ?  4020.7708  31.9261          ?        ?      634.1        2.5       ?       ? 
1 1 1   15   12   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15   12   18 o    582.7    2.5    0.0000   0.0000          ?        ?  3395.0195  29.3720          ?        ?      582.7        2.5       ?       ? 
1 1 1   15   12   19 o   1148.5    4.1    0.0000   0.0000          ?        ? 13191.8564  93.2242          ?        ?     1148.5        4.1       ?       ? 
1 1 1   15   12   20 o    940.5    3.5    0.0000   0.0000          ?        ?  8845.4404  65.7677          ?        ?      940.5        3.5       ?       ? 
1 1 1   15   12   21 o   2760.1   15.3    0.0000   0.0000          ?        ? 76235.6562 846.0411          ?        ?     2760.1       15.3       ?       ? 
1 1 1   15   12   22 o   1827.8    9.8    0.0000   0.0000          ?        ? 33416.3906 359.4877          ?        ?     1827.8        9.8       ?       ? 
1 1 1   15   12   23 o    768.5    3.0    0.0000   0.0000          ?        ?  5906.3252  46.6121          ?        ?      768.5        3.0       ?       ? 
1 1 1   15   12   24 o   2028.3    7.0    0.0000   0.0000          ?        ? 41147.6133 282.8651          ?        ?     2028.3        7.0       ?       ? 
1 1 1   15   12   25 o    564.1    2.5    0.0000   0.0000          ?        ?  3182.3918  28.7335          ?        ?      564.1        2.5       ?       ? 
1 1 1   15   12   26 f   1169.0    4.0    0.0000   0.0000          ?        ? 13665.6396  93.8627          ?        ?     1169.0        4.0       ?       ? 
1 1 1   15   12   27 o   1418.6    4.9    0.0000   0.0000          ?        ? 20125.5625 138.5592          ?        ?     1418.6        4.9       ?       ? 
1 1 1   15   12   28 o    904.4    3.4    0.0000   0.0000          ?        ?  8180.1006  61.9366          ?        ?      904.4        3.4       ?       ? 
1 1 1   15   12   29 f    427.6    2.5    0.0000   0.0000          ?        ?  1828.0873  21.7097          ?        ?      427.6        2.5       ?       ? 
1 1 1   15   12   30 o    198.8    3.7    0.0000   0.0000          ?        ?   395.2449  14.6860          ?        ?      198.8        3.7       ?       ? 
1 1 1   15   12   31 o    432.9    2.5    0.0000   0.0000          ?        ?  1874.0609  21.7097          ?        ?      432.9        2.5       ?       ? 
1 1 1   15   12   32 o   1276.1    4.7    0.0000   0.0000          ?        ? 16286.7705 120.6806          ?        ?     1276.1        4.7       ?       ? 
1 1 1   15   12   33 o    289.5    4.0    0.0000   0.0000          ?        ?   838.3789  22.9868          ?        ?      289.5        4.0       ?       ? 
1 1 1   15   12   34 o    977.8    4.0    0.0000   0.0000          ?        ?  9561.2227  78.5382          ?        ?      977.8        4.0       ?       ? 
1 1 1   15   12   35 o    771.0    3.2    0.0000   0.0000          ?        ?  5943.9980  49.8047          ?        ?      771.0        3.2       ?       ? 
1 1 1   15   12   36 o    712.5    3.1    0.0000   0.0000          ?        ?  5077.5239  44.6965          ?        ?      712.5        3.1       ?       ? 
1 1 1   15   12   37 o    825.8    3.5    0.0000   0.0000          ?        ?  6820.0493  58.1055          ?        ?      825.8        3.5       ?       ? 
1 1 1   15   12   38 o    144.7    6.8    0.0000   0.0000          ?        ?   209.4351  19.7942          ?        ?      144.7        6.8       ?       ? 
1 1 1   15   12   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15   12   40 o    424.6    2.9    0.0000   0.0000          ?        ?  1803.1851  24.9023          ?        ?      424.6        2.9       ?       ? 
1 1 1   15   12   41 o    734.6    3.0    0.0000   0.0000          ?        ?  5396.1460  44.0580          ?        ?      734.6        3.0       ?       ? 
1 1 1   15   12   42 o    735.2    3.3    0.0000   0.0000          ?        ?  5405.0854  49.1662          ?        ?      735.2        3.3       ?       ? 
1 1 1   15   12   43 o    652.3    3.0    0.0000   0.0000          ?        ?  4255.1084  38.9498          ?        ?      652.3        3.0       ?       ? 
1 1 1   15   12   44 o   1095.6    3.8    0.0000   0.0000          ?        ? 12005.4834  83.6463          ?        ?     1095.6        3.8       ?       ? 
1 1 1   15   12   45 o    436.8    2.8    0.0000   0.0000          ?        ?  1908.5411  24.2638          ?        ?      436.8        2.8       ?       ? 
1 1 1   15   12   46 o    563.4    2.7    0.0000   0.0000          ?        ?  3174.0911  30.0105          ?        ?      563.4        2.7       ?       ? 
1 1 1   15   12   47 o    638.6    2.7    0.0000   0.0000          ?        ?  4078.8760  35.1187          ?        ?      638.6        2.7       ?       ? 
1 1 1   15   12   48 f    803.3    3.1    0.0000   0.0000          ?        ?  6453.5381  50.4432          ?        ?      803.3        3.1       ?       ? 
1 1 1   15   12   49 o    214.5    4.2    0.0000   0.0000          ?        ?   460.3741  17.8786          ?        ?      214.5        4.2       ?       ? 
1 1 1   15   12   50 o    293.1    3.3    0.0000   0.0000          ?        ?   859.4501  19.1556          ?        ?      293.1        3.3       ?       ? 
1 1 1   15   12   51 o    164.9    5.2    0.0000   0.0000          ?        ?   272.0102  17.2401          ?        ?      164.9        5.2       ?       ? 
1 1 1   15   12   52 o    238.6    3.7    0.0000   0.0000          ?        ?   569.5613  17.8786          ?        ?      238.6        3.7       ?       ? 
1 1 1   15   12   53 o    149.6    5.8    0.0000   0.0000          ?        ?   224.1211  17.2401          ?        ?      149.6        5.8       ?       ? 
1 1 1   15   12   54 o    213.9    4.2    0.0000   0.0000          ?        ?   457.8200  17.8786          ?        ?      213.9        4.2       ?       ? 
1 1 1   15   12   55 o    253.4    3.5    0.0000   0.0000          ?        ?   642.3527  17.8786          ?        ?      253.4        3.5       ?       ? 
1 1 1   15   12   56 o     36.2   15.0    0.0000   0.0000          ?        ?     3.1926  17.8786          ?        ?       36.2       15.0       ?       ? 
1 1 1   15   12   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15   12   58 o    416.9    2.8    0.0000   0.0000          ?        ?  1738.6943  22.9868          ?        ?      416.9        2.8       ?       ? 
1 1 1   15   12   59 o    248.0    3.9    0.0000   0.0000          ?        ?   615.5349  19.1556          ?        ?      248.0        3.9       ?       ? 
1 1 1   15   12   60 o    426.2    2.8    0.0000   0.0000          ?        ?  1817.2325  24.2638          ?        ?      426.2        2.8       ?       ? 
1 1 1   15   12   61 f    396.7    3.1    0.0000   0.0000          ?        ?  1574.5944  24.2638          ?        ?      396.7        3.1       ?       ? 
1 1 1   15   12   62 o    295.7    3.6    0.0000   0.0000          ?        ?   874.7747  21.0712          ?        ?      295.7        3.6       ?       ? 
1 1 1   15   12   63 o    196.4    5.2    0.0000   0.0000          ?        ?   386.3056  20.4327          ?        ?      196.4        5.2       ?       ? 
1 1 1   15   12   64 o    173.6    6.1    0.0000   0.0000          ?        ?   302.0207  21.0712          ?        ?      173.6        6.1       ?       ? 
1 1 1   15   12   65 f    164.5    6.2    0.0000   0.0000          ?        ?   271.3717  20.4327          ?        ?      164.5        6.2       ?       ? 
1 1 1   15   12   66 o    138.4    7.4    0.0000   0.0000          ?        ?   192.1950  20.4327          ?        ?      138.4        7.4       ?       ? 
1 1 1   15   12   67 o    136.2    7.7    0.0000   0.0000          ?        ?   186.4483  21.0712          ?        ?      136.2        7.7       ?       ? 
1 1 1   15   12   68 o    145.3    7.5    0.0000   0.0000          ?        ?   211.9892  21.7097          ?        ?      145.3        7.5       ?       ? 
1 1 1   15   12   69 o    149.4    7.1    0.0000   0.0000          ?        ?   224.1211  21.0712          ?        ?      149.4        7.1       ?       ? 
1 1 1   15   12   70 o     26.6   12.9    0.0000   0.0000          ?        ?   -37.0343  21.7097          ?        ?       26.6       12.9       ?       ? 
1 1 1   15   12   71 o    238.4    4.6    0.0000   0.0000          ?        ?   569.5613  21.7097          ?        ?      238.4        4.6       ?       ? 
1 1 1   15   12   72 o     84.2   12.5    0.0000   0.0000          ?        ?    72.1529  21.0712          ?        ?       84.2       12.5       ?       ? 
1 1 1   15   12   73 o    248.7    4.6    0.0000   0.0000          ?        ?   620.0045  22.9868          ?        ?      248.7        4.6       ?       ? 
1 1 1   15   12   74 o     81.4   12.2    0.0000   0.0000          ?        ?    67.6833  19.7942          ?        ?       81.4       12.2       ?       ? 
1 1 1   15   12   75 o    142.1    7.2    0.0000   0.0000          ?        ?   203.6884  20.4327          ?        ?      142.1        7.2       ?       ? 
1 1 1   15   12   76 o    146.9    7.2    0.0000   0.0000          ?        ?   217.7359  21.0712          ?        ?      146.9        7.2       ?       ? 
1 1 1   15   12   77 o    140.6    7.3    0.0000   0.0000          ?        ?   199.8573  20.4327          ?        ?      140.6        7.3       ?       ? 
1 1 1   15   13    0 o   1035.7    5.9 10727.8018 122.5962 10727.8018 122.5962 10727.8018 122.5962     1035.7      5.9     1035.7        5.9     0.0     0.0 
1 1 1   15   13    1 o   1122.8    4.5    0.0000   0.0000          ?        ? 12606.9707 100.8864          ?        ?     1122.8        4.5       ?       ? 
1 1 1   15   13    2 o    247.8    1.9    0.0000   0.0000          ?        ?   614.2578   9.5778          ?        ?      247.8        1.9       ?       ? 
1 1 1   15   13    3 o   1968.1    7.5    0.0000   0.0000          ?        ? 38744.2148 294.3585          ?        ?     1968.1        7.5       ?       ? 
1 1 1   15   13    4 o    709.3    2.7    0.0000   0.0000          ?        ?  5030.9121  38.9498          ?        ?      709.3        2.7       ?       ? 
1 1 1   15   13    5 o   1124.2    3.8    0.0000   0.0000          ?        ? 12638.2588  86.2004          ?        ?     1124.2        3.8       ?       ? 
1 1 1   15   13    6 o   1109.7    3.8    0.0000   0.0000          ?        ? 12315.8057  83.6463          ?        ?     1109.7        3.8       ?       ? 
1 1 1   15   13    7 f   1357.0    4.5    0.0000   0.0000          ?        ? 18415.6035 123.2347          ?        ?     1357.0        4.5       ?       ? 
1 1 1   15   13    8 o   1218.7    4.1    0.0000   0.0000          ?        ? 14853.9287 100.8864          ?        ?     1218.7        4.1       ?       ? 
1 1 1   15   13    9 o   1451.1    4.8    0.0000   0.0000          ?        ? 21059.0820 139.8362          ?        ?     1451.1        4.8       ?       ? 
1 1 1   15   13   10 o   1936.3    6.3    0.0000   0.0000          ?        ? 37496.5430 243.2767          ?        ?     1936.3        6.3       ?       ? 
1 1 1   15   13   11 o    227.3    1.7    0.0000   0.0000          ?        ?   516.5640   7.6623          ?        ?      227.3        1.7       ?       ? 
1 1 1   15   13   12 o    560.4    2.3    0.0000   0.0000          ?        ?  3140.8879  25.5409          ?        ?      560.4        2.3       ?       ? 
1 1 1   15   13   13 o   1246.7    4.3    0.0000   0.0000          ?        ? 15544.1699 107.2716          ?        ?     1246.7        4.3       ?       ? 
1 1 1   15   13   14 o    990.9    3.4    0.0000   0.0000          ?        ?  9819.1855  68.3218          ?        ?      990.9        3.4       ?       ? 
1 1 1   15   13   15 f    391.5    2.0    0.0000   0.0000          ?        ?  1532.4519  15.3245          ?        ?      391.5        2.0       ?       ? 
1 1 1   15   13   16 o   1879.7    6.7    0.0000   0.0000          ?        ? 35338.3398 253.4931          ?        ?     1879.7        6.7       ?       ? 
1 1 1   15   13   17 o   1656.0    6.1    0.0000   0.0000          ?        ? 27427.6973 203.0499          ?        ?     1656.0        6.1       ?       ? 
1 1 1   15   13   18 o   1275.1    4.4    0.0000   0.0000          ?        ? 16259.9531 113.0183          ?        ?     1275.1        4.4       ?       ? 
1 1 1   15   13   19 o    754.9    3.0    0.0000   0.0000          ?        ?  5698.1670  45.3350          ?        ?      754.9        3.0       ?       ? 
1 1 1   15   13   20 o    624.7    2.7    0.0000   0.0000          ?        ?  3902.0056  33.8416          ?        ?      624.7        2.7       ?       ? 
1 1 1   15   13   21 o   1195.9    4.8    0.0000   0.0000          ?        ? 14301.6074 113.6568          ?        ?     1195.9        4.8       ?       ? 
1 1 1   15   13   22 f   1100.6    4.0    0.0000   0.0000          ?        ? 12114.6709  88.1160          ?        ?     1100.6        4.0       ?       ? 
1 1 1   15   13   23 o    794.3    3.2    0.0000   0.0000          ?        ?  6309.8706  51.0817          ?        ?      794.3        3.2       ?       ? 
1 1 1   15   13   24 o   1088.2    4.3    0.0000   0.0000          ?        ? 11842.0215  92.5856          ?        ?     1088.2        4.3       ?       ? 
1 1 1   15   13   25 o    893.4    3.4    0.0000   0.0000          ?        ?  7982.7969  60.6596          ?        ?      893.4        3.4       ?       ? 
1 1 1   15   13   26 o   1105.1    4.2    0.0000   0.0000          ?        ? 12212.3643  92.5856          ?        ?     1105.1        4.2       ?       ? 
1 1 1   15   13   27 o   1402.1    4.9    0.0000   0.0000          ?        ? 19661.9961 138.5592          ?        ?     1402.1        4.9       ?       ? 
1 1 1   15   13   28 o   1518.5    5.7    0.0000   0.0000          ?        ? 23060.8477 173.6779          ?        ?     1518.5        5.7       ?       ? 
1 1 1   15   13   29 o    171.0    4.5    0.0000   0.0000          ?        ?   292.4429  15.3245          ?        ?      171.0        4.5       ?       ? 
1 1 1   15   13   30 o    878.7    3.8    0.0000   0.0000          ?        ?  7722.2808  66.4062          ?        ?      878.7        3.8       ?       ? 
1 1 1   15   13   31 o    575.6    2.7    0.0000   0.0000          ?        ?  3313.2888  31.2876          ?        ?      575.6        2.7       ?       ? 
1 1 1   15   13   32 o   1709.1    6.0    0.0000   0.0000          ?        ? 29214.9180 204.3269          ?        ?     1709.1        6.0       ?       ? 
1 1 1   15   13   33 o    250.0    4.3    0.0000   0.0000          ?        ?   625.1127  21.7097          ?        ?      250.0        4.3       ?       ? 
1 1 1   15   13   34 o    592.2    2.7    0.0000   0.0000          ?        ?  3506.7607  31.9261          ?        ?      592.2        2.7       ?       ? 
1 1 1   15   13   35 o   1143.0    4.4    0.0000   0.0000          ?        ? 13066.7070 101.5249          ?        ?     1143.0        4.4       ?       ? 
1 1 1   15   13   36 o   1226.7    4.8    0.0000   0.0000          ?        ? 15049.9551 118.7650          ?        ?     1226.7        4.8       ?       ? 
1 1 1   15   13   37 o    524.5    2.9    0.0000   0.0000          ?        ?  2751.3896  30.6490          ?        ?      524.5        2.9       ?       ? 
1 1 1   15   13   38 o    645.0    3.0    0.0000   0.0000          ?        ?  4160.6069  38.3113          ?        ?      645.0        3.0       ?       ? 
1 1 1   15   13   39 o    291.8    3.1    0.0000   0.0000          ?        ?   851.7878  17.8786          ?        ?      291.8        3.1       ?       ? 
1 1 1   15   13   40 o    243.5    3.5    0.0000   0.0000          ?        ?   593.1866  17.2401          ?        ?      243.5        3.5       ?       ? 
1 1 1   15   13   41 o    435.9    2.6    0.0000   0.0000          ?        ?  1900.2404  22.9868          ?        ?      435.9        2.6       ?       ? 
1 1 1   15   13   42 o    290.8    3.5    0.0000   0.0000          ?        ?   846.0411  20.4327          ?        ?      290.8        3.5       ?       ? 
1 1 1   15   13   43 o    499.8    2.7    0.0000   0.0000          ?        ?  2498.5352  27.4564          ?        ?      499.8        2.7       ?       ? 
1 1 1   15   13   44 o   1060.8    3.8    0.0000   0.0000          ?        ? 11255.2207  81.0922          ?        ?     1060.8        3.8       ?       ? 
1 1 1   15   13   45 o    680.0    2.8    0.0000   0.0000          ?        ?  4624.8120  37.6728          ?        ?      680.0        2.8       ?       ? 
1 1 1   15   13   46 o    822.2    3.2    0.0000   0.0000          ?        ?  6760.6675  52.3588          ?        ?      822.2        3.2       ?       ? 
1 1 1   15   13   47 o    263.7    3.6    0.0000   0.0000          ?        ?   695.3500  19.1556          ?        ?      263.7        3.6       ?       ? 
1 1 1   15   13   48 o     56.1   15.5    0.0000   0.0000          ?        ?    32.5646  17.8786          ?        ?       56.1       15.5       ?       ? 
1 1 1   15   13   49 o    346.5    3.0    0.0000   0.0000          ?        ?  1201.0592  21.0712          ?        ?      346.5        3.0       ?       ? 
1 1 1   15   13   50 f    559.9    2.6    0.0000   0.0000          ?        ?  3135.1411  29.3720          ?        ?      559.9        2.6       ?       ? 
1 1 1   15   13   51 o    381.4    2.8    0.0000   0.0000          ?        ?  1455.1908  21.0712          ?        ?      381.4        2.8       ?       ? 
1 1 1   15   13   52 o    288.2    3.3    0.0000   0.0000          ?        ?   830.7167  19.1556          ?        ?      288.2        3.3       ?       ? 
1 1 1   15   13   53 o    147.0    6.1    0.0000   0.0000          ?        ?   216.4588  17.8786          ?        ?      147.0        6.1       ?       ? 
1 1 1   15   13   54 o    141.3    6.3    0.0000   0.0000          ?        ?   199.8573  17.8786          ?        ?      141.3        6.3       ?       ? 
1 1 1   15   13   55 o    261.1    3.8    0.0000   0.0000          ?        ?   681.9411  19.7942          ?        ?      261.1        3.8       ?       ? 
1 1 1   15   13   56 o    122.6    7.8    0.0000   0.0000          ?        ?   150.6911  19.1556          ?        ?      122.6        7.8       ?       ? 
1 1 1   15   13   57 o    276.3    3.7    0.0000   0.0000          ?        ?   763.6719  20.4327          ?        ?      276.3        3.7       ?       ? 
1 1 1   15   13   58 o    129.0    7.2    0.0000   0.0000          ?        ?   166.6541  18.5171          ?        ?      129.0        7.2       ?       ? 
1 1 1   15   13   59 o    426.2    2.9    0.0000   0.0000          ?        ?  1817.2325  24.9023          ?        ?      426.2        2.9       ?       ? 
1 1 1   15   13   60 o    128.9    7.4    0.0000   0.0000          ?        ?   166.6541  19.1556          ?        ?      128.9        7.4       ?       ? 
1 1 1   15   13   61 o    223.6    4.4    0.0000   0.0000          ?        ?   500.6010  19.7942          ?        ?      223.6        4.4       ?       ? 
1 1 1   15   13   62 o     28.5   13.4    0.0000   0.0000          ?        ?   -19.1556  19.1556          ?        ?       28.5       13.4       ?       ? 
1 1 1   15   13   63 o    584.0    2.7    0.0000   0.0000          ?        ?  3412.2598  31.9261          ?        ?      584.0        2.7       ?       ? 
1 1 1   15   13   64 o    261.3    4.0    0.0000   0.0000          ?        ?   683.2181  21.0712          ?        ?      261.3        4.0       ?       ? 
1 1 1   15   13   65 o    109.8    9.0    0.0000   0.0000          ?        ?   121.3191  19.7942          ?        ?      109.8        9.0       ?       ? 
1 1 1   15   13   66 o    304.0    3.6    0.0000   0.0000          ?        ?   925.2178  21.7097          ?        ?      304.0        3.6       ?       ? 
1 1 1   15   13   67 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15   13   68 o     23.1   11.5    0.0000   0.0000          ?        ?   -49.8047  20.4327          ?        ?       23.1       11.5       ?       ? 
1 1 1   15   13   69 o     25.5   12.5    0.0000   0.0000          ?        ?   -42.7809  21.7097          ?        ?       25.5       12.5       ?       ? 
1 1 1   15   13   70 o    175.1    6.0    0.0000   0.0000          ?        ?   307.7674  21.0712          ?        ?      175.1        6.0       ?       ? 
1 1 1   15   13   71 o    440.1    3.0    0.0000   0.0000          ?        ?  1938.5518  26.8179          ?        ?      440.1        3.0       ?       ? 
1 1 1   15   13   72 o    235.0    4.8    0.0000   0.0000          ?        ?   553.5982  22.3483          ?        ?      235.0        4.8       ?       ? 
1 1 1   15   13   73 f     77.3   14.1    0.0000   0.0000          ?        ?    63.2136  21.0712          ?        ?       77.3       14.1       ?       ? 
1 1 1   15   13   74 o    170.9    6.4    0.0000   0.0000          ?        ?   293.7199  21.7097          ?        ?      170.9        6.4       ?       ? 
1 1 1   15   13   75 o    292.6    3.9    0.0000   0.0000          ?        ?   858.1730  22.9868          ?        ?      292.6        3.9       ?       ? 
1 1 1   15   13   76 o     22.2   11.1    0.0000   0.0000          ?        ?   -58.7440  21.0712          ?        ?       22.2       11.1       ?       ? 
1 1 1   15   13   77 o    121.0    8.7    0.0000   0.0000          ?        ?   148.7755  21.0712          ?        ?      121.0        8.7       ?       ? 
1 1 1   15   14    0 o   1012.9    5.8 10262.3193 118.1265 10262.3193 118.1265 10262.3193 118.1265     1012.9      5.8     1012.9        5.8     0.0     0.0 
1 1 1   15   14    1 o    410.9    2.5    0.0000   0.0000          ?        ?  1688.2511  20.4327          ?        ?      410.9        2.5       ?       ? 
1 1 1   15   14    2 o    547.0    2.6    0.0000   0.0000          ?        ?  2992.1123  28.7335          ?        ?      547.0        2.6       ?       ? 
1 1 1   15   14    3 o   1359.1    4.9    0.0000   0.0000          ?        ? 18471.7910 132.8125          ?        ?     1359.1        4.9       ?       ? 
1 1 1   15   14    4 o   1141.7    4.1    0.0000   0.0000          ?        ? 13036.6953  93.2242          ?        ?     1141.7        4.1       ?       ? 
1 1 1   15   14    5 o   1180.8    4.3    0.0000   0.0000          ?        ? 13942.7588 101.5249          ?        ?     1180.8        4.3       ?       ? 
1 1 1   15   14    6 o    337.3    2.3    0.0000   0.0000          ?        ?  1137.8455  15.3245          ?        ?      337.3        2.3       ?       ? 
1 1 1   15   14    7 o    914.0    3.6    0.0000   0.0000          ?        ?  8353.7783  66.4062          ?        ?      914.0        3.6       ?       ? 
1 1 1   15   14    8 o    720.0    2.9    0.0000   0.0000          ?        ?  5183.5186  42.1424          ?        ?      720.0        2.9       ?       ? 
1 1 1   15   14    9 o    407.3    2.3    0.0000   0.0000          ?        ?  1658.8792  18.5171          ?        ?      407.3        2.3       ?       ? 
1 1 1   15   14   10 o   1750.3    6.3    0.0000   0.0000          ?        ? 30640.7383 220.9285          ?        ?     1750.3        6.3       ?       ? 
1 1 1   15   14   11 o    638.6    2.7    0.0000   0.0000          ?        ?  4078.2378  34.4802          ?        ?      638.6        2.7       ?       ? 
1 1 1   15   14   12 o   1361.9    5.0    0.0000   0.0000          ?        ? 18550.3301 137.2822          ?        ?     1361.9        5.0       ?       ? 
1 1 1   15   14   13 o    171.9    3.2    0.0000   0.0000          ?        ?   295.6355  10.8549          ?        ?      171.9        3.2       ?       ? 
1 1 1   15   14   14 o    306.7    2.2    0.0000   0.0000          ?        ?   940.5424  13.4090          ?        ?      306.7        2.2       ?       ? 
1 1 1   15   14   15 o    178.0    2.5    0.0000   0.0000          ?        ?   316.7067   8.9393          ?        ?      178.0        2.5       ?       ? 
1 1 1   15   14   16 o    547.1    2.5    0.0000   0.0000          ?        ?  2993.3894  27.4564          ?        ?      547.1        2.5       ?       ? 
1 1 1   15   14   17 o    616.5    3.0    0.0000   0.0000          ?        ?  3800.4807  36.3957          ?        ?      616.5        3.0       ?       ? 
1 1 1   15   14   18 o   1527.6    5.2    0.0000   0.0000          ?        ? 23338.6055 158.9919          ?        ?     1527.6        5.2       ?       ? 
1 1 1   15   14   19 o    920.7    3.6    0.0000   0.0000          ?        ?  8477.0127  65.7677          ?        ?      920.7        3.6       ?       ? 
1 1 1   15   14   20 o    652.2    2.8    0.0000   0.0000          ?        ?  4253.1924  37.0343          ?        ?      652.2        2.8       ?       ? 
1 1 1   15   14   21 o    885.2    3.4    0.0000   0.0000          ?        ?  7835.2988  60.0210          ?        ?      885.2        3.4       ?       ? 
1 1 1   15   14   22 o   1536.4    5.2    0.0000   0.0000          ?        ? 23608.0605 160.2689          ?        ?     1536.4        5.2       ?       ? 
1 1 1   15   14   23 o   1612.3    5.9    0.0000   0.0000          ?        ? 25998.0469 189.0024          ?        ?     1612.3        5.9       ?       ? 
1 1 1   15   14   24 o   1368.5    4.8    0.0000   0.0000          ?        ? 18728.4785 130.2584          ?        ?     1368.5        4.8       ?       ? 
1 1 1   15   14   25 o    436.2    2.3    0.0000   0.0000          ?        ?  1902.7944  19.7942          ?        ?      436.2        2.3       ?       ? 
1 1 1   15   14   26 o    386.1    2.2    0.0000   0.0000          ?        ?  1490.9480  17.2401          ?        ?      386.1        2.2       ?       ? 
1 1 1   15   14   27 o    251.4    2.9    0.0000   0.0000          ?        ?   632.1364  14.6860          ?        ?      251.4        2.9       ?       ? 
1 1 1   15   14   28 o   1285.0    4.7    0.0000   0.0000          ?        ? 16513.4453 121.9576          ?        ?     1285.0        4.7       ?       ? 
1 1 1   15   14   29 f   1248.0    4.5    0.0000   0.0000          ?        ? 15576.7354 113.0183          ?        ?     1248.0        4.5       ?       ? 
1 1 1   15   14   30 o    292.3    2.6    0.0000   0.0000          ?        ?   854.3420  15.3245          ?        ?      292.3        2.6       ?       ? 
1 1 1   15   14   31 o    537.6    2.8    0.0000   0.0000          ?        ?  2889.9490  30.0105          ?        ?      537.6        2.8       ?       ? 
1 1 1   15   14   32 o    720.9    2.9    0.0000   0.0000          ?        ?  5196.9277  42.1424          ?        ?      720.9        2.9       ?       ? 
1 1 1   15   14   33 o    629.6    2.8    0.0000   0.0000          ?        ?  3964.5811  35.7572          ?        ?      629.6        2.8       ?       ? 
1 1 1   15   14   34 o   1254.1    4.6    0.0000   0.0000          ?        ? 15728.7031 115.5724          ?        ?     1254.1        4.6       ?       ? 
1 1 1   15   14   35 o    133.2    7.2    0.0000   0.0000          ?        ?   177.5090  19.1556          ?        ?      133.2        7.2       ?       ? 
1 1 1   15   14   36 o    734.5    3.2    0.0000   0.0000          ?        ?  5395.5078  46.6121          ?        ?      734.5        3.2       ?       ? 
1 1 1   15   14   37 o    771.8    3.1    0.0000   0.0000          ?        ?  5957.4067  47.2506          ?        ?      771.8        3.1       ?       ? 
1 1 1   15   14   38 o    190.6    4.5    0.0000   0.0000          ?        ?   363.3188  17.2401          ?        ?      190.6        4.5       ?       ? 
1 1 1   15   14   39 o    589.0    2.8    0.0000   0.0000          ?        ?  3469.0879  33.2031          ?        ?      589.0        2.8       ?       ? 
1 1 1   15   14   40 o    628.1    2.7    0.0000   0.0000          ?        ?  3944.7866  34.4802          ?        ?      628.1        2.7       ?       ? 
1 1 1   15   14   41 o    250.6    3.9    0.0000   0.0000          ?        ?   628.3053  19.7942          ?        ?      250.6        3.9       ?       ? 
1 1 1   15   14   42 o    474.4    2.6    0.0000   0.0000          ?        ?  2250.7888  24.9023          ?        ?      474.4        2.6       ?       ? 
1 1 1   15   14   43 o    716.0    3.0    0.0000   0.0000          ?        ?  5127.3286  43.4195          ?        ?      716.0        3.0       ?       ? 
1 1 1   15   14   44 o    543.1    2.8    0.0000   0.0000          ?        ?  2949.9700  30.6490          ?        ?      543.1        2.8       ?       ? 
1 1 1   15   14   45 o    132.5    6.5    0.0000   0.0000          ?        ?   175.5934  17.2401          ?        ?      132.5        6.5       ?       ? 
1 1 1   15   14   46 o    146.4    5.9    0.0000   0.0000          ?        ?   214.5433  17.2401          ?        ?      146.4        5.9       ?       ? 
1 1 1   15   14   47 o    220.1    3.9    0.0000   0.0000          ?        ?   484.6379  17.2401          ?        ?      220.1        3.9       ?       ? 
1 1 1   15   14   48 o    351.6    3.2    0.0000   0.0000          ?        ?  1236.1779  22.3483          ?        ?      351.6        3.2       ?       ? 
1 1 1   15   14   49 o    386.0    2.9    0.0000   0.0000          ?        ?  1490.3094  22.3483          ?        ?      386.0        2.9       ?       ? 
1 1 1   15   14   50 o    669.4    2.9    0.0000   0.0000          ?        ?  4481.7837  38.9498          ?        ?      669.4        2.9       ?       ? 
1 1 1   15   14   51 o    538.0    3.0    0.0000   0.0000          ?        ?  2895.6956  31.9261          ?        ?      538.0        3.0       ?       ? 
1 1 1   15   14   52 o    284.7    3.4    0.0000   0.0000          ?        ?   810.9225  19.1556          ?        ?      284.7        3.4       ?       ? 
1 1 1   15   14   53 o    254.8    3.8    0.0000   0.0000          ?        ?   649.3765  19.1556          ?        ?      254.8        3.8       ?       ? 
1 1 1   15   14   54 o    147.5    5.8    0.0000   0.0000          ?        ?   217.7359  17.2401          ?        ?      147.5        5.8       ?       ? 
1 1 1   15   14   55 o     19.8    9.9    0.0000   0.0000          ?        ?   -51.0817  17.2401          ?        ?       19.8        9.9       ?       ? 
1 1 1   15   14   56 o    282.1    3.4    0.0000   0.0000          ?        ?   796.2365  19.1556          ?        ?      282.1        3.4       ?       ? 
1 1 1   15   14   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15   14   58 o     26.7   12.6    0.0000   0.0000          ?        ?   -21.0712  17.8786          ?        ?       26.7       12.6       ?       ? 
1 1 1   15   14   59 o    300.6    3.3    0.0000   0.0000          ?        ?   904.1467  19.7942          ?        ?      300.6        3.3       ?       ? 
1 1 1   15   14   60 o    179.6    5.3    0.0000   0.0000          ?        ?   323.0919  19.1556          ?        ?      179.6        5.3       ?       ? 
1 1 1   15   14   61 o    225.9    4.2    0.0000   0.0000          ?        ?   510.8173  19.1556          ?        ?      225.9        4.2       ?       ? 
1 1 1   15   14   62 o    106.7    8.7    0.0000   0.0000          ?        ?   114.2954  18.5171          ?        ?      106.7        8.7       ?       ? 
1 1 1   15   14   63 o    189.6    5.4    0.0000   0.0000          ?        ?   360.1262  20.4327          ?        ?      189.6        5.4       ?       ? 
1 1 1   15   14   64 o     68.8   14.8    0.0000   0.0000          ?        ?    49.8047  19.7942          ?        ?       68.8       14.8       ?       ? 
1 1 1   15   14   65 o     22.2   11.1    0.0000   0.0000          ?        ?   -51.7203  19.7942          ?        ?       22.2       11.1       ?       ? 
1 1 1   15   14   66 o     94.9   10.1    0.0000   0.0000          ?        ?    90.6701  19.1556          ?        ?       94.9       10.1       ?       ? 
1 1 1   15   14   67 o    181.6    5.4    0.0000   0.0000          ?        ?   330.7542  19.7942          ?        ?      181.6        5.4       ?       ? 
1 1 1   15   14   68 o     45.1   16.8    0.0000   0.0000          ?        ?    15.9630  20.4327          ?        ?       45.1       16.8       ?       ? 
1 1 1   15   14   69 o    316.4    3.6    0.0000   0.0000          ?        ?  1002.4789  22.9868          ?        ?      316.4        3.6       ?       ? 
1 1 1   15   14   70 o    241.4    4.6    0.0000   0.0000          ?        ?   584.2473  22.3483          ?        ?      241.4        4.6       ?       ? 
1 1 1   15   14   71 o    255.8    4.6    0.0000   0.0000          ?        ?   655.7617  23.6253          ?        ?      255.8        4.6       ?       ? 
1 1 1   15   14   72 o    132.9    8.2    0.0000   0.0000          ?        ?   178.1475  21.7097          ?        ?      132.9        8.2       ?       ? 
1 1 1   15   14   73 o    181.8    5.8    0.0000   0.0000          ?        ?   332.0312  21.0712          ?        ?      181.8        5.8       ?       ? 
1 1 1   15   14   74 o     24.0   11.9    0.0000   0.0000          ?        ?   -50.4432  21.7097          ?        ?       24.0       11.9       ?       ? 
1 1 1   15   14   75 o    181.4    5.6    0.0000   0.0000          ?        ?   330.7542  20.4327          ?        ?      181.4        5.6       ?       ? 
1 1 1   15   14   76 o     24.8   12.2    0.0000   0.0000          ?        ?   -42.1424  21.0712          ?        ?       24.8       12.2       ?       ? 
1 1 1   15   15    0 o    491.9    5.3 2420.6355  51.7203  2420.6355  51.7203  2420.6355  51.7203      491.9      5.3      491.9        5.3     0.0     0.0 
1 1 1   15   15    1 o   1082.0    6.1 11709.8486 132.1740 11709.8486 132.1740 11709.8486 132.1740     1082.0      6.1     1082.0        6.1     0.0     0.0 
1 1 1   15   15    2 o    349.5    3.5 1222.1304  24.2638  1222.1304  24.2638  1222.1304  24.2638      349.5      3.5      349.5        3.5     0.0     0.0 
1 1 1   15   15    3 o    230.9    3.9  533.8041  17.8786   533.8041  17.8786   533.8041  17.8786      230.9      3.9      230.9        3.9     0.0     0.0 
1 1 1   15   15    4 o   1192.5    6.3 14221.7930 149.4141 14221.7930 149.4141 14221.7930 149.4141     1192.5      6.3     1192.5        6.3     0.0     0.0 
1 1 1   15   15    5 f    398.0    2.8 1584.1722  22.3483  1584.1722  22.3483  1584.1722  22.3483      398.0      2.8      398.0        2.8     0.0     0.0 
1 1 1   15   15    6 o     35.9   12.0   16.6016   7.6623    16.6016   7.6623    16.6016   7.6623       35.9     12.0       35.9       12.0     0.0     0.0 
1 1 1   15   15    7 o     10.6    7.8  -17.8786   8.9393   -17.8786   8.9393   -17.8786   8.9393       10.6      7.8       10.6        7.8     0.0     0.0 
1 1 1   15   15    8 o    575.5    3.9 3312.6501  44.6965  3312.6501  44.6965  3312.6501  44.6965      575.5      3.9      575.5        3.9     0.0     0.0 
1 1 1   15   15    9 o    550.4    3.7 3029.7852  40.8654  3029.7852  40.8654  3029.7852  40.8654      550.4      3.7      550.4        3.7     0.0     0.0 
1 1 1   15   15   10 o   2005.4   10.2 40227.5000 407.3768 40227.5000 407.3768 40227.5000 407.3768     2005.4     10.2     2005.4       10.2     0.0     0.0 
1 1 1   15   15   11 o   1034.2    5.3 10697.1533 109.1872 10697.1533 109.1872 10697.1533 109.1872     1034.2      5.3     1034.2        5.3     0.0     0.0 
1 1 1   15   15   12 o    783.4    4.4 6138.1084  68.9603  6138.1084  68.9603  6138.1084  68.9603      783.4      4.4      783.4        4.4     0.0     0.0 
1 1 1   15   15   13 o   1727.9    9.9 29862.3789 342.8861 29862.3789 342.8861 29862.3789 342.8861     1727.9      9.9     1727.9        9.9     0.0     0.0 
1 1 1   15   15   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15   15   15 o    880.8    4.8 7758.6763  84.2849  7758.6763  84.2849  7758.6763  84.2849      880.8      4.8      880.8        4.8     0.0     0.0 
1 1 1   15   15   16 o     12.0    9.0  -58.7440  17.2401   -58.7440  17.2401   -58.7440  17.2401       12.0      9.0       12.0        9.0     0.0     0.0 
1 1 1   15   15   17 o    893.1    5.0 7977.6895  89.3930  7977.6895  89.3930  7977.6895  89.3930      893.1      5.0      893.1        5.0     0.0     0.0 
1 1 1   15   15   18 o   1562.6    9.8 24424.7285 306.4904 24424.7285 306.4904 24424.7285 306.4904     1562.6      9.8     1562.6        9.8     0.0     0.0 
1 1 1   15   15   19 o    553.3    4.3 3061.7112  47.8891  3061.7112  47.8891  3061.7112  47.8891      553.3      4.3      553.3        4.3     0.0     0.0 
1 1 1   15   15   20 o    699.5    4.1 4894.2681  57.4669  4894.2681  57.4669  4894.2681  57.4669      699.5      4.1      699.5        4.1     0.0     0.0 
1 1 1   15   15   21 o    167.9    5.3  282.8651  17.8786   282.8651  17.8786   282.8651  17.8786      167.9      5.3      167.9        5.3     0.0     0.0 
1 1 1   15   15   22 f   1641.5    8.1 26951.3594 265.6250 26951.3594 265.6250 26951.3594 265.6250     1641.5      8.1     1641.5        8.1     0.0     0.0 
1 1 1   15   15   23 o     51.8   23.2   38.9498  25.5409    38.9498  25.5409    38.9498  25.5409       51.8     23.2       51.8       23.2     0.0     0.0 
1 1 1   15   15   24 o   2009.8    9.6 40403.7344 387.5826 40403.7344 387.5826 40403.7344 387.5826     2009.8      9.6     2009.8        9.6     0.0     0.0 
1 1 1   15   15   25 o     83.7   10.6   70.8759  17.8786    70.8759  17.8786    70.8759  17.8786       83.7     10.6       83.7       10.6     0.0     0.0 
1 1 1   15   15   26 o     71.8   13.9   56.8284  17.8786    56.8284  17.8786    56.8284  17.8786       71.8     13.9       71.8       13.9     0.0     0.0 
1 1 1   15   15   27 o   1277.9    6.2 16332.1064 158.3534 16332.1064 158.3534 16332.1064 158.3534     1277.9      6.2     1277.9        6.2     0.0     0.0 
1 1 1   15   15   28 o    913.4    5.0 8344.8389  90.6701  8344.8389  90.6701  8344.8389  90.6701      913.4      5.0      913.4        5.0     0.0     0.0 
1 1 1   15   15   29 o    352.9    3.6 1245.7557  25.5409  1245.7557  25.5409  1245.7557  25.5409      352.9      3.6      352.9        3.6     0.0     0.0 
1 1 1   15   15   30 f    395.0    4.2 1561.1854  33.2031  1561.1854  33.2031  1561.1854  33.2031      395.0      4.2      395.0        4.2     0.0     0.0 
1 1 1   15   15   31 o    824.0    4.8 6790.0391  78.5382  6790.0391  78.5382  6790.0391  78.5382      824.0      4.8      824.0        4.8     0.0     0.0 
1 1 1   15   15   32 o   1603.3    8.4 25711.3496 269.4561 25711.3496 269.4561 25711.3496 269.4561     1603.3      8.4     1603.3        8.4     0.0     0.0 
1 1 1   15   15   33 o   2183.4   11.7 47692.4570 510.1788 47692.4570 510.1788 47692.4570 510.1788     2183.4     11.7     2183.4       11.7     0.0     0.0 
1 1 1   15   15   34 o    342.5    5.1 1174.2412  35.1187  1174.2412  35.1187  1174.2412  35.1187      342.5      5.1      342.5        5.1     0.0     0.0 
1 1 1   15   15   35 o   2098.1   10.2 44036.9219 427.1710 44036.9219 427.1710 44036.9219 427.1710     2098.1     10.2     2098.1       10.2     0.0     0.0 
1 1 1   15   15   36 o     37.0   22.1   15.3245  28.0950    15.3245  28.0950    15.3245  28.0950       37.0     22.1       37.0       22.1     0.0     0.0 
1 1 1   15   15   37 o   1497.7    7.4 22438.2891 221.5670 22438.2891 221.5670 22438.2891 221.5670     1497.7      7.4     1497.7        7.4     0.0     0.0 
1 1 1   15   15   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15   15   39 o    650.4    4.4 4230.8442  57.4669  4230.8442  57.4669  4230.8442  57.4669      650.4      4.4      650.4        4.4     0.0     0.0 
1 1 1   15   15   40 o    280.9    4.4  789.8513  24.9023   789.8513  24.9023   789.8513  24.9023      280.9      4.4      280.9        4.4     0.0     0.0 
1 1 1   15   15   41 o    133.6    9.7  181.3401  25.5409   181.3401  25.5409   181.3401  25.5409      133.6      9.7      133.6        9.7     0.0     0.0 
1 1 1   15   15   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15   15   43 o    934.9    4.9 8742.6377  91.9471  8742.6377  91.9471  8742.6377  91.9471      934.9      4.9      934.9        4.9     0.0     0.0 
1 1 1   15   15   44 o    267.3    5.0  715.1442  26.8179   715.1442  26.8179   715.1442  26.8179      267.3      5.0      267.3        5.0     0.0     0.0 
1 1 1   15   15   45 o    227.5    5.5  518.4796  24.9023   518.4796  24.9023   518.4796  24.9023      227.5      5.5      227.5        5.5     0.0     0.0 
1 1 1   15   15   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15   15   47 o    618.8    4.3 3830.4915  53.6358  3830.4915  53.6358  3830.4915  53.6358      618.8      4.3      618.8        4.3     0.0     0.0 
1 1 1   15   15   48 o    176.9    7.4  314.7912  26.1794   314.7912  26.1794   314.7912  26.1794      176.9      7.4      176.9        7.4     0.0     0.0 
1 1 1   15   15   49 o   1132.4    5.8 12831.0918 132.1740 12831.0918 132.1740 12831.0918 132.1740     1132.4      5.8     1132.4        5.8     0.0     0.0 
1 1 1   15   15   50 o     17.6   13.1  -74.7070  29.3720   -74.7070  29.3720   -74.7070  29.3720       17.6     13.1       17.6       13.1     0.0     0.0 
1 1 1   15   15   51 o     41.2   29.1  -88.1160  89.3930   -88.1160  89.3930   -88.1160  89.3930       41.2     29.1       41.2       29.1     0.0     0.0 
1 1 1   15   15   52 o    744.7    4.2 5548.1147  61.9366  5548.1147  61.9366  5548.1147  61.9366      744.7      4.2      744.7        4.2     0.0     0.0 
1 1 1   15   15   53 o    355.7    4.6 1266.1884  32.5646  1266.1884  32.5646  1266.1884  32.5646      355.7      4.6      355.7        4.6     0.0     0.0 
1 1 1   15   15   54 o    713.5    4.5 5093.4873  63.8522  5093.4873  63.8522  5093.4873  63.8522      713.5      4.5      713.5        4.5     0.0     0.0 
1 1 1   15   15   55 o    140.3    9.7  199.8573  26.8179   199.8573  26.8179   199.8573  26.8179      140.3      9.7      140.3        9.7     0.0     0.0 
1 1 1   15   15   56 o    713.4    4.3 5092.2100  60.6596  5092.2100  60.6596  5092.2100  60.6596      713.4      4.3      713.4        4.3     0.0     0.0 
1 1 1   15   15   57 f    353.9    4.2 1253.4180  30.0105  1253.4180  30.0105  1253.4180  30.0105      353.9      4.2      353.9        4.2     0.0     0.0 
1 1 1   15   15   58 o     29.1   19.2   -3.1926  27.4564    -3.1926  27.4564    -3.1926  27.4564       29.1     19.2       29.1       19.2     0.0     0.0 
1 1 1   15   15   59 o    140.7    9.6  201.1343  26.8179   201.1343  26.8179   201.1343  26.8179      140.7      9.6      140.7        9.6     0.0     0.0 
1 1 1   15   15   60 o    186.0    7.2  347.9943  26.8179   347.9943  26.8179   347.9943  26.8179      186.0      7.2      186.0        7.2     0.0     0.0 
1 1 1   15   15   61 o     19.3   14.0  -44.0580  26.1794   -44.0580  26.1794   -44.0580  26.1794       19.3     14.0       19.3       14.0     0.0     0.0 
1 1 1   15   15   62 o    401.4    4.2 1612.9056  33.8416  1612.9056  33.8416  1612.9056  33.8416      401.4      4.2      401.4        4.2     0.0     0.0 
1 1 1   15   15   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   15   15   64 o    130.0   11.5  173.6779  29.3720   173.6779  29.3720   173.6779  29.3720      130.0     11.5      130.0       11.5     0.0     0.0 
1 1 1   15   15   65 o     27.0   18.4  -14.0475  29.3720   -14.0475  29.3720   -14.0475  29.3720       27.0     18.4       27.0       18.4     0.0     0.0 
1 1 1   15   15   66 o     35.4   21.8   11.4934  29.3720    11.4934  29.3720    11.4934  29.3720       35.4     21.8       35.4       21.8     0.0     0.0 
1 1 1   15   15   67 o     43.9   24.1   28.0950  30.0105    28.0950  30.0105    28.0950  30.0105       43.9     24.1       43.9       24.1     0.0     0.0 
1 1 1   15   15   68 o     22.9   16.3  -32.5646  29.3720   -32.5646  29.3720   -32.5646  29.3720       22.9     16.3       22.9       16.3     0.0     0.0 
1 1 1   15   15   69 o    134.4   10.8  185.1713  28.7335   185.1713  28.7335   185.1713  28.7335      134.4     10.8      134.4       10.8     0.0     0.0 
1 1 1   15   15   70 o    187.2    8.4  353.7410  31.2876   353.7410  31.2876   353.7410  31.2876      187.2      8.4      187.2        8.4     0.0     0.0 
1 1 1   15   15   71 o     16.5   12.3 -100.2479  31.2876  -100.2479  31.2876  -100.2479  31.2876       16.5     12.3       16.5       12.3     0.0     0.0 
1 1 1   15   15   72 o    234.5    6.8  552.9597  31.9261   552.9597  31.9261   552.9597  31.9261      234.5      6.8      234.5        6.8     0.0     0.0 
1 1 1   15   15   73 o     18.5   13.7  -70.8759  30.6490   -70.8759  30.6490   -70.8759  30.6490       18.5     13.7       18.5       13.7     0.0     0.0 
1 1 1   15   15   74 o    143.6   11.3  211.9892  31.9261   211.9892  31.9261   211.9892  31.9261      143.6     11.3      143.6       11.3     0.0     0.0 
1 1 1   15   15   75 o    133.1   12.2  183.8942  31.9261   183.8942  31.9261   183.8942  31.9261      133.1     12.2      133.1       12.2     0.0     0.0 
1 1 1   15   15   76 o     68.5   23.0   62.5751  28.0950    62.5751  28.0950    62.5751  28.0950       68.5     23.0       68.5       23.0     0.0     0.0 
1 1 1   16    0    0 o    235.4    2.7  554.2368  12.7704   554.2368  12.7704   554.2368  12.7704      235.4      2.7      235.4        2.7     0.0     0.0 
1 1 1   16    0    1 o    399.0    2.4 1592.4729  19.1556  1592.4729  19.1556  1592.4729  19.1556      399.0      2.4      399.0        2.4     0.0     0.0 
1 1 1   16    0    2 o     96.4    2.7   93.2242   5.1082    93.2242   5.1082    93.2242   5.1082       96.4      2.7       96.4        2.7     0.0     0.0 
1 1 1   16    0    3 o   1626.8    7.6 26470.5527 247.7464 26470.5527 247.7464 26470.5527 247.7464     1626.8      7.6     1626.8        7.6     0.0     0.0 
1 1 1   16    0    4 o   1406.4    6.7 19782.6758 187.0868 19782.6758 187.0868 19782.6758 187.0868     1406.4      6.7     1406.4        6.7     0.0     0.0 
1 1 1   16    0    5 o    168.7    1.9  284.7806   6.3852   284.7806   6.3852   284.7806   6.3852      168.7      1.9      168.7        1.9     0.0     0.0 
1 1 1   16    0    6 o    264.6    2.1  700.4582  10.8549   700.4582  10.8549   700.4582  10.8549      264.6      2.1      264.6        2.1     0.0     0.0 
1 1 1   16    0    7 o    388.9    2.5 1512.6577  19.1556  1512.6577  19.1556  1512.6577  19.1556      388.9      2.5      388.9        2.5     0.0     0.0 
1 1 1   16    0    8 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    0    9 o    591.0    3.2 3493.3516  37.6728  3493.3516  37.6728  3493.3516  37.6728      591.0      3.2      591.0        3.2     0.0     0.0 
1 1 1   16    0   10 o    246.4    2.1  607.2341  10.2163   607.2341  10.2163   607.2341  10.2163      246.4      2.1      246.4        2.1     0.0     0.0 
1 1 1   16    0   11 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    0   12 o   1149.0    5.5 13204.6270 126.4273 13204.6270 126.4273 13204.6270 126.4273     1149.0      5.5     1149.0        5.5     0.0     0.0 
1 1 1   16    0   13 o   1695.7    7.8 28760.9277 265.6250 28760.9277 265.6250 28760.9277 265.6250     1695.7      7.8     1695.7        7.8     0.0     0.0 
1 1 1   16    0   14 o   1530.5    7.1 23427.9980 217.0974 23427.9980 217.0974 23427.9980 217.0974     1530.5      7.1     1530.5        7.1     0.0     0.0 
1 1 1   16    0   15 o    593.3    3.3 3520.8083  39.5883  3520.8083  39.5883  3520.8083  39.5883      593.3      3.3      593.3        3.3     0.0     0.0 
1 1 1   16    0   16 o    217.0    2.4  471.2290  10.2163   471.2290  10.2163   471.2290  10.2163      217.0      2.4      217.0        2.4     0.0     0.0 
1 1 1   16    0   17 o    424.2    2.6 1799.9924  21.7097  1799.9924  21.7097  1799.9924  21.7097      424.2      2.6      424.2        2.6     0.0     0.0 
1 1 1   16    0   18 o   1815.1    8.3 32955.3789 302.6593 32955.3789 302.6593 32955.3789 302.6593     1815.1      8.3     1815.1        8.3     0.0     0.0 
1 1 1   16    0   19 o    193.0    2.8  372.8966  10.8549   372.8966  10.8549   372.8966  10.8549      193.0      2.8      193.0        2.8     0.0     0.0 
1 1 1   16    0   20 o    969.3    4.9 9396.4844  95.7782  9396.4844  95.7782  9396.4844  95.7782      969.3      4.9      969.3        4.9     0.0     0.0 
1 1 1   16    0   21 o     52.2   11.2   30.6490  10.2163    30.6490  10.2163    30.6490  10.2163       52.2     11.2       52.2       11.2     0.0     0.0 
1 1 1   16    0   22 o    856.2    4.3 7332.1440  74.0685  7332.1440  74.0685  7332.1440  74.0685      856.2      4.3      856.2        4.3     0.0     0.0 
1 1 1   16    0   23 o    792.6    4.7 6283.6914  74.7070  6283.6914  74.7070  6283.6914  74.7070      792.6      4.7      792.6        4.7     0.0     0.0 
1 1 1   16    0   24 o    845.4    4.3 7147.6113  72.7915  7147.6113  72.7915  7147.6113  72.7915      845.4      4.3      845.4        4.3     0.0     0.0 
1 1 1   16    0   25 o   1911.4    9.2 36541.9531 353.1024 36541.9531 353.1024 36541.9531 353.1024     1911.4      9.2     1911.4        9.2     0.0     0.0 
1 1 1   16    0   26 o   1913.0    9.1 36604.5312 349.2713 36604.5312 349.2713 36604.5312 349.2713     1913.0      9.1     1913.0        9.1     0.0     0.0 
1 1 1   16    0   27 o    693.6    3.8 4811.2603  52.3588  4811.2603  52.3588  4811.2603  52.3588      693.6      3.8      693.6        3.8     0.0     0.0 
1 1 1   16    0   28 o    231.8    3.3  537.6352  15.3245   537.6352  15.3245   537.6352  15.3245      231.8      3.3      231.8        3.3     0.0     0.0 
1 1 1   16    0   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    0   30 o     15.3   11.4  -61.2981  22.9868   -61.2981  22.9868   -61.2981  22.9868       15.3     11.4       15.3       11.4     0.0     0.0 
1 1 1   16    0   31 o    965.7    5.1 9327.5244  97.6938  9327.5244  97.6938  9327.5244  97.6938      965.7      5.1      965.7        5.1     0.0     0.0 
1 1 1   16    0   32 o   1030.7    5.6 10624.3613 116.2109 10624.3613 116.2109 10624.3613 116.2109     1030.7      5.6     1030.7        5.6     0.0     0.0 
1 1 1   16    0   33 o    829.9    4.4 6888.3716  73.4300  6888.3716  73.4300  6888.3716  73.4300      829.9      4.4      829.9        4.4     0.0     0.0 
1 1 1   16    0   34 o    466.5    3.4 2176.7202  31.9261  2176.7202  31.9261  2176.7202  31.9261      466.5      3.4      466.5        3.4     0.0     0.0 
1 1 1   16    0   35 f    868.5    4.6 7544.1328  80.4537  7544.1328  80.4537  7544.1328  80.4537      868.5      4.6      868.5        4.6     0.0     0.0 
1 1 1   16    0   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    0   37 o    643.1    3.8 4135.7046  48.5276  4135.7046  48.5276  4135.7046  48.5276      643.1      3.8      643.1        3.8     0.0     0.0 
1 1 1   16    0   38 o    483.3    3.6 2336.3506  35.1187  2336.3506  35.1187  2336.3506  35.1187      483.3      3.6      483.3        3.6     0.0     0.0 
1 1 1   16    0   39 o    956.3    5.2 9147.4609 100.2479  9147.4609 100.2479  9147.4609 100.2479      956.3      5.2      956.3        5.2     0.0     0.0 
1 1 1   16    0   40 o    270.0    5.7  729.8303  30.6490   729.8303  30.6490   729.8303  30.6490      270.0      5.7      270.0        5.7     0.0     0.0 
1 1 1   16    0   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    0   42 o    861.0    4.7 7414.5127  80.4537  7414.5127  80.4537  7414.5127  80.4537      861.0      4.7      861.0        4.7     0.0     0.0 
1 1 1   16    0   43 o    673.4    4.3 4536.0576  57.4669  4536.0576  57.4669  4536.0576  57.4669      673.4      4.3      673.4        4.3     0.0     0.0 
1 1 1   16    0   44 o    722.0    4.2 5213.5293  61.2981  5213.5293  61.2981  5213.5293  61.2981      722.0      4.2      722.0        4.2     0.0     0.0 
1 1 1   16    0   45 o    327.5    4.6 1073.3549  30.0105  1073.3549  30.0105  1073.3549  30.0105      327.5      4.6      327.5        4.6     0.0     0.0 
1 1 1   16    0   46 o     30.6   22.7 -262.4324  94.5012  -262.4324  94.5012  -262.4324  94.5012       30.6     22.7       30.6       22.7     0.0     0.0 
1 1 1   16    0   47 o    180.3    7.6  326.9231  27.4564   326.9231  27.4564   326.9231  27.4564      180.3      7.6      180.3        7.6     0.0     0.0 
1 1 1   16    0   48 o   1222.5    6.1 14950.3447 148.1370 14950.3447 148.1370 14950.3447 148.1370     1222.5      6.1     1222.5        6.1     0.0     0.0 
1 1 1   16    0   49 o    800.7    4.5 6412.6729  72.1529  6412.6729  72.1529  6412.6729  72.1529      800.7      4.5      800.7        4.5     0.0     0.0 
1 1 1   16    0   50 o    365.6    4.3 1337.7028  31.2876  1337.7028  31.2876  1337.7028  31.2876      365.6      4.3      365.6        4.3     0.0     0.0 
1 1 1   16    0   51 o     15.3   11.4  -81.7308  26.1794   -81.7308  26.1794   -81.7308  26.1794       15.3     11.4       15.3       11.4     0.0     0.0 
1 1 1   16    0   52 o     33.2   20.9    7.0237  28.0950     7.0237  28.0950     7.0237  28.0950       33.2     20.9       33.2       20.9     0.0     0.0 
1 1 1   16    0   53 o    637.3    3.9 4062.9131  49.8047  4062.9131  49.8047  4062.9131  49.8047      637.3      3.9      637.3        3.9     0.0     0.0 
1 1 1   16    0   54 o    482.5    4.0 2328.6885  38.9498  2328.6885  38.9498  2328.6885  38.9498      482.5      4.0      482.5        4.0     0.0     0.0 
1 1 1   16    0   55 o    288.8    4.9  835.1863  28.0950   835.1863  28.0950   835.1863  28.0950      288.8      4.9      288.8        4.9     0.0     0.0 
1 1 1   16    0   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    0   57 o    281.0    5.2  790.4898  29.3720   790.4898  29.3720   790.4898  29.3720      281.0      5.2      281.0        5.2     0.0     0.0 
1 1 1   16    0   58 o     15.9   11.9  -91.9471  28.7335   -91.9471  28.7335   -91.9471  28.7335       15.9     11.9       15.9       11.9     0.0     0.0 
1 1 1   16    0   59 o    180.3    7.5  326.9231  26.8179   326.9231  26.8179   326.9231  26.8179      180.3      7.5      180.3        7.5     0.0     0.0 
1 1 1   16    0   60 o    190.4    7.6  364.5958  28.7335   364.5958  28.7335   364.5958  28.7335      190.4      7.6      190.4        7.6     0.0     0.0 
1 1 1   16    0   61 o    360.1    3.9 1297.4760  28.0950  1297.4760  28.0950  1297.4760  28.0950      360.1      3.9      360.1        3.9     0.0     0.0 
1 1 1   16    0   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    0   63 o    189.4    7.4  360.7647  28.0950   360.7647  28.0950   360.7647  28.0950      189.4      7.4      189.4        7.4     0.0     0.0 
1 1 1   16    0   64 o    233.7    6.2  547.8516  28.7335   547.8516  28.7335   547.8516  28.7335      233.7      6.2      233.7        6.2     0.0     0.0 
1 1 1   16    0   65 o    170.7    8.1  293.7199  27.4564   293.7199  27.4564   293.7199  27.4564      170.7      8.1      170.7        8.1     0.0     0.0 
1 1 1   16    0   66 o     26.9   18.0   -7.6623  26.1794    -7.6623  26.1794    -7.6623  26.1794       26.9     18.0       26.9       18.0     0.0     0.0 
1 1 1   16    0   67 o    322.6    4.7 1042.0673  30.0105  1042.0673  30.0105  1042.0673  30.0105      322.6      4.7      322.6        4.7     0.0     0.0 
1 1 1   16    0   68 o    107.9   14.3  123.2347  30.0105   123.2347  30.0105   123.2347  30.0105      107.9     14.3      107.9       14.3     0.0     0.0 
1 1 1   16    0   69 o    423.6    4.0 1795.5229  33.8416  1795.5229  33.8416  1795.5229  33.8416      423.6      4.0      423.6        4.0     0.0     0.0 
1 1 1   16    0   70 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    0   71 o     31.2   20.3   -0.6385  30.0105    -0.6385  30.0105    -0.6385  30.0105       31.2     20.3       31.2       20.3     0.0     0.0 
1 1 1   16    0   72 o     42.7   23.7   26.1794  29.3720    26.1794  29.3720    26.1794  29.3720       42.7     23.7       42.7       23.7     0.0     0.0 
1 1 1   16    0   73 o     48.1   24.7   35.1187  30.0105    35.1187  30.0105    35.1187  30.0105       48.1     24.7       48.1       24.7     0.0     0.0 
1 1 1   16    0   74 f     40.7   23.7   21.7097  31.2876    21.7097  31.2876    21.7097  31.2876       40.7     23.7       40.7       23.7     0.0     0.0 
1 1 1   16    0   75 f    154.9    9.6  243.9153  29.3720   243.9153  29.3720   243.9153  29.3720      154.9      9.6      154.9        9.6     0.0     0.0 
1 1 1   16    0   76 o    178.6    8.3  322.4534  29.3720   322.4534  29.3720   322.4534  29.3720      178.6      8.3      178.6        8.3     0.0     0.0 
1 1 1   16    0   77 o    148.0   10.0  223.4826  29.3720   223.4826  29.3720   223.4826  29.3720      148.0     10.0      148.0       10.0     0.0     0.0 
1 1 1   16    0   78 o    129.0   11.8  172.4008  30.0105   172.4008  30.0105   172.4008  30.0105      129.0     11.8      129.0       11.8     0.0     0.0 
1 1 1   16    0   79 o    242.4    6.6  591.2710  31.9261   591.2710  31.9261   591.2710  31.9261      242.4      6.6      242.4        6.6     0.0     0.0 
1 1 1   16    0   80 o     14.5   10.9  -95.7782  26.8179   -95.7782  26.8179   -95.7782  26.8179       14.5     10.9       14.5       10.9     0.0     0.0 
1 1 1   16    1    0 o    725.9    3.7 5270.3574  53.6358  5270.3574  53.6358  5270.3574  53.6358      725.9      3.7      725.9        3.7     0.0     0.0 
1 1 1   16    1    1 o    710.4    2.6    0.0000   0.0000          ?        ?  5046.2363  36.3957          ?        ?      710.4        2.6       ?       ? 
1 1 1   16    1    2 o   1344.8    4.5    0.0000   0.0000          ?        ? 18086.7637 120.6806          ?        ?     1344.8        4.5       ?       ? 
1 1 1   16    1    3 o   1022.2    3.5    0.0000   0.0000          ?        ? 10448.7676  71.5144          ?        ?     1022.2        3.5       ?       ? 
1 1 1   16    1    4 o    222.3    1.4    0.0000   0.0000          ?        ?   494.2158   6.3852          ?        ?      222.3        1.4       ?       ? 
1 1 1   16    1    5 o    663.3    2.4    0.0000   0.0000          ?        ?  4400.0522  31.9261          ?        ?      663.3        2.4       ?       ? 
1 1 1   16    1    6 o    528.5    2.0    0.0000   0.0000          ?        ?  2793.5322  21.0712          ?        ?      528.5        2.0       ?       ? 
1 1 1   16    1    7 o    311.5    1.5    0.0000   0.0000          ?        ?   970.5529   9.5778          ?        ?      311.5        1.5       ?       ? 
1 1 1   16    1    8 o   1228.8    4.1    0.0000   0.0000          ?        ? 15100.3975 101.5249          ?        ?     1228.8        4.1       ?       ? 
1 1 1   16    1    9 o    863.5    3.0    0.0000   0.0000          ?        ?  7456.0166  51.7203          ?        ?      863.5        3.0       ?       ? 
1 1 1   16    1   10 o    934.9    3.2    0.0000   0.0000          ?        ?  8741.3613  60.0210          ?        ?      934.9        3.2       ?       ? 
1 1 1   16    1   11 o    617.7    2.3    0.0000   0.0000          ?        ?  3815.8052  28.7335          ?        ?      617.7        2.3       ?       ? 
1 1 1   16    1   12 o   1207.7    4.0    0.0000   0.0000          ?        ? 14587.6660  97.6938          ?        ?     1207.7        4.0       ?       ? 
1 1 1   16    1   13 o   1570.0    5.1    0.0000   0.0000          ?        ? 24651.4043 160.9075          ?        ?     1570.0        5.1       ?       ? 
1 1 1   16    1   14 o    739.9    2.7    0.0000   0.0000          ?        ?  5475.3228  39.5883          ?        ?      739.9        2.7       ?       ? 
1 1 1   16    1   15 o    601.4    2.3    0.0000   0.0000          ?        ?  3617.2251  27.4564          ?        ?      601.4        2.3       ?       ? 
1 1 1   16    1   16 o    514.5    2.1    0.0000   0.0000          ?        ?  2646.6721  21.7097          ?        ?      514.5        2.1       ?       ? 
1 1 1   16    1   17 o    971.8    3.4    0.0000   0.0000          ?        ?  9443.7344  65.7677          ?        ?      971.8        3.4       ?       ? 
1 1 1   16    1   18 o   1094.7    3.8    0.0000   0.0000          ?        ? 11984.4121  82.3693          ?        ?     1094.7        3.8       ?       ? 
1 1 1   16    1   19 o    132.3    2.7    0.0000   0.0000          ?        ?   174.9549   7.0237          ?        ?      132.3        2.7       ?       ? 
1 1 1   16    1   20 o   1331.2    4.5    0.0000   0.0000          ?        ? 17722.1680 118.7650          ?        ?     1331.2        4.5       ?       ? 
1 1 1   16    1   21 o    677.5    2.6    0.0000   0.0000          ?        ?  4590.3320  35.1187          ?        ?      677.5        2.6       ?       ? 
1 1 1   16    1   22 o    824.3    3.2    0.0000   0.0000          ?        ?  6795.7861  52.3588          ?        ?      824.3        3.2       ?       ? 
1 1 1   16    1   23 o   1250.1    4.2    0.0000   0.0000          ?        ? 15628.4561 105.9946          ?        ?     1250.1        4.2       ?       ? 
1 1 1   16    1   24 o    746.1    2.9    0.0000   0.0000          ?        ?  5567.2700  42.7809          ?        ?      746.1        2.9       ?       ? 
1 1 1   16    1   25 o   1549.7    5.6    0.0000   0.0000          ?        ? 24018.6309 174.3164          ?        ?     1549.7        5.6       ?       ? 
1 1 1   16    1   26 o    918.7    3.3    0.0000   0.0000          ?        ?  8439.9795  60.6596          ?        ?      918.7        3.3       ?       ? 
1 1 1   16    1   27 o    142.5    3.8    0.0000   0.0000          ?        ?   203.0499  10.8549          ?        ?      142.5        3.8       ?       ? 
1 1 1   16    1   28 o    543.4    2.5    0.0000   0.0000          ?        ?  2952.5239  27.4564          ?        ?      543.4        2.5       ?       ? 
1 1 1   16    1   29 o     70.6    8.1    0.0000   0.0000          ?        ?    49.8047  11.4934          ?        ?       70.6        8.1       ?       ? 
1 1 1   16    1   30 o    323.1    2.3    0.0000   0.0000          ?        ?  1043.9829  14.6860          ?        ?      323.1        2.3       ?       ? 
1 1 1   16    1   31 o    664.4    2.7    0.0000   0.0000          ?        ?  4414.7388  36.3957          ?        ?      664.4        2.7       ?       ? 
1 1 1   16    1   32 o    732.4    3.2    0.0000   0.0000          ?        ?  5364.8589  47.2506          ?        ?      732.4        3.2       ?       ? 
1 1 1   16    1   33 o    954.5    3.5    0.0000   0.0000          ?        ?  9111.7031  67.6833          ?        ?      954.5        3.5       ?       ? 
1 1 1   16    1   34 o   1013.0    3.7    0.0000   0.0000          ?        ? 10262.9580  75.3456          ?        ?     1013.0        3.7       ?       ? 
1 1 1   16    1   35 f   1387.5    4.6    0.0000   0.0000          ?        ? 19252.0664 128.3428          ?        ?     1387.5        4.6       ?       ? 
1 1 1   16    1   36 o    535.5    2.5    0.0000   0.0000          ?        ?  2867.6006  26.8179          ?        ?      535.5        2.5       ?       ? 
1 1 1   16    1   37 o   1683.3    5.6    0.0000   0.0000          ?        ? 28337.5898 187.0868          ?        ?     1683.3        5.6       ?       ? 
1 1 1   16    1   38 o    860.9    3.3    0.0000   0.0000          ?        ?  7411.9595  56.1899          ?        ?      860.9        3.3       ?       ? 
1 1 1   16    1   39 o   1305.2    4.5    0.0000   0.0000          ?        ? 17038.3105 116.8494          ?        ?     1305.2        4.5       ?       ? 
1 1 1   16    1   40 o   1070.1    4.0    0.0000   0.0000          ?        ? 11451.2471  84.9234          ?        ?     1070.1        4.0       ?       ? 
1 1 1   16    1   41 o   2119.2    7.0    0.0000   0.0000          ?        ? 44921.2734 297.5511          ?        ?     2119.2        7.0       ?       ? 
1 1 1   16    1   42 o   1005.2    3.7    0.0000   0.0000          ?        ? 10105.8818  74.7070          ?        ?     1005.2        3.7       ?       ? 
1 1 1   16    1   43 o    798.8    3.3    0.0000   0.0000          ?        ?  6382.0234  52.9973          ?        ?      798.8        3.3       ?       ? 
1 1 1   16    1   44 o    774.6    3.1    0.0000   0.0000          ?        ?  6000.1880  48.5276          ?        ?      774.6        3.1       ?       ? 
1 1 1   16    1   45 o    895.6    3.3    0.0000   0.0000          ?        ?  8021.1084  59.3825          ?        ?      895.6        3.3       ?       ? 
1 1 1   16    1   46 o    714.5    2.9    0.0000   0.0000          ?        ?  5105.6187  42.1424          ?        ?      714.5        2.9       ?       ? 
1 1 1   16    1   47 o    811.1    3.1    0.0000   0.0000          ?        ?  6579.9653  50.4432          ?        ?      811.1        3.1       ?       ? 
1 1 1   16    1   48 o    943.6    3.4    0.0000   0.0000          ?        ?  8904.8223  64.4907          ?        ?      943.6        3.4       ?       ? 
1 1 1   16    1   49 o    233.9    4.1    0.0000   0.0000          ?        ?   547.2130  19.1556          ?        ?      233.9        4.1       ?       ? 
1 1 1   16    1   50 o    587.4    2.7    0.0000   0.0000          ?        ?  3450.5710  31.9261          ?        ?      587.4        2.7       ?       ? 
1 1 1   16    1   51 o    159.8    5.6    0.0000   0.0000          ?        ?   255.4086  17.8786          ?        ?      159.8        5.6       ?       ? 
1 1 1   16    1   52 o    384.4    2.8    0.0000   0.0000          ?        ?  1478.1776  21.7097          ?        ?      384.4        2.8       ?       ? 
1 1 1   16    1   53 o    201.2    4.8    0.0000   0.0000          ?        ?   404.8227  19.1556          ?        ?      201.2        4.8       ?       ? 
1 1 1   16    1   54 o    119.5    8.0    0.0000   0.0000          ?        ?   143.0288  19.1556          ?        ?      119.5        8.0       ?       ? 
1 1 1   16    1   55 o    420.1    2.9    0.0000   0.0000          ?        ?  1765.5123  24.2638          ?        ?      420.1        2.9       ?       ? 
1 1 1   16    1   56 o    281.1    3.6    0.0000   0.0000          ?        ?   790.4898  20.4327          ?        ?      281.1        3.6       ?       ? 
1 1 1   16    1   57 o    452.8    2.8    0.0000   0.0000          ?        ?  2050.9316  25.5409          ?        ?      452.8        2.8       ?       ? 
1 1 1   16    1   58 o    172.4    5.9    0.0000   0.0000          ?        ?   297.5511  20.4327          ?        ?      172.4        5.9       ?       ? 
1 1 1   16    1   59 o    500.7    2.7    0.0000   0.0000          ?        ?  2508.1128  26.8179          ?        ?      500.7        2.7       ?       ? 
1 1 1   16    1   60 o     37.3   15.7    0.0000   0.0000          ?        ?     1.9156  19.7942          ?        ?       37.3       15.7       ?       ? 
1 1 1   16    1   61 o    138.3    6.7    0.0000   0.0000          ?        ?   191.5565  18.5171          ?        ?      138.3        6.7       ?       ? 
1 1 1   16    1   62 o    195.5    4.7    0.0000   0.0000          ?        ?   382.4745  18.5171          ?        ?      195.5        4.7       ?       ? 
1 1 1   16    1   63 o    264.1    4.0    0.0000   0.0000          ?        ?   697.9042  21.0712          ?        ?      264.1        4.0       ?       ? 
1 1 1   16    1   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    1   65 o    107.2    9.5    0.0000   0.0000          ?        ?   115.5724  20.4327          ?        ?      107.2        9.5       ?       ? 
1 1 1   16    1   66 o    275.9    3.9    0.0000   0.0000          ?        ?   761.7563  21.7097          ?        ?      275.9        3.9       ?       ? 
1 1 1   16    1   67 f    251.3    4.4    0.0000   0.0000          ?        ?   632.1364  22.3483          ?        ?      251.3        4.4       ?       ? 
1 1 1   16    1   68 o     74.0   14.8    0.0000   0.0000          ?        ?    57.4669  21.0712          ?        ?       74.0       14.8       ?       ? 
1 1 1   16    1   69 o    399.2    3.2    0.0000   0.0000          ?        ?  1594.3884  25.5409          ?        ?      399.2        3.2       ?       ? 
1 1 1   16    1   70 o    146.0    7.4    0.0000   0.0000          ?        ?   213.9047  21.7097          ?        ?      146.0        7.4       ?       ? 
1 1 1   16    1   71 o     27.1   13.1    0.0000   0.0000          ?        ?   -37.6728  22.3483          ?        ?       27.1       13.1       ?       ? 
1 1 1   16    1   72 o    207.3    5.4    0.0000   0.0000          ?        ?   431.0021  22.3483          ?        ?      207.3        5.4       ?       ? 
1 1 1   16    1   73 o    127.1    9.0    0.0000   0.0000          ?        ?   162.8230  22.9868          ?        ?      127.1        9.0       ?       ? 
1 1 1   16    1   74 o     38.8   16.5    0.0000   0.0000          ?        ?     1.2770  22.3483          ?        ?       38.8       16.5       ?       ? 
1 1 1   16    1   75 o     90.9   13.0    0.0000   0.0000          ?        ?    84.2849  23.6253          ?        ?       90.9       13.0       ?       ? 
1 1 1   16    1   76 o    253.8    4.7    0.0000   0.0000          ?        ?   646.1838  23.6253          ?        ?      253.8        4.7       ?       ? 
1 1 1   16    1   77 o     68.4   16.5    0.0000   0.0000          ?        ?    50.4432  22.3483          ?        ?       68.4       16.5       ?       ? 
1 1 1   16    1   78 o     76.3   14.3    0.0000   0.0000          ?        ?    61.9366  21.0712          ?        ?       76.3       14.3       ?       ? 
1 1 1   16    1   79 o     51.7   17.6    0.0000   0.0000          ?        ?    26.8179  21.7097          ?        ?       51.7       17.6       ?       ? 
1 1 1   16    1   80 o    181.3    6.3    0.0000   0.0000          ?        ?   331.3927  22.9868          ?        ?      181.3        6.3       ?       ? 
1 1 1   16    2    0 o   1935.8    8.9 37481.2188 344.8017 37481.2188 344.8017 37481.2188 344.8017     1935.8      8.9     1935.8        8.9     0.0     0.0 
1 1 1   16    2    1 o    871.1    3.0    0.0000   0.0000          ?        ?  7588.1914  52.3588          ?        ?      871.1        3.0       ?       ? 
1 1 1   16    2    2 o    293.3    1.5    0.0000   0.0000          ?        ?   860.0886   8.9393          ?        ?      293.3        1.5       ?       ? 
1 1 1   16    2    3 o    351.2    1.6    0.0000   0.0000          ?        ?  1233.6238  11.4934          ?        ?      351.2        1.6       ?       ? 
1 1 1   16    2    4 o    509.6    2.0    0.0000   0.0000          ?        ?  2596.8674  20.4327          ?        ?      509.6        2.0       ?       ? 
1 1 1   16    2    5 o   1113.4    3.8    0.0000   0.0000          ?        ? 12396.8975  84.2849          ?        ?     1113.4        3.8       ?       ? 
1 1 1   16    2    6 o    539.7    2.1    0.0000   0.0000          ?        ?  2912.2971  22.3483          ?        ?      539.7        2.1       ?       ? 
1 1 1   16    2    7 o    248.1    1.4    0.0000   0.0000          ?        ?   615.5349   7.0237          ?        ?      248.1        1.4       ?       ? 
1 1 1   16    2    8 f    525.0    2.0    0.0000   0.0000          ?        ?  2756.4980  21.0712          ?        ?      525.0        2.0       ?       ? 
1 1 1   16    2    9 o    659.7    2.4    0.0000   0.0000          ?        ?  4351.5249  31.9261          ?        ?      659.7        2.4       ?       ? 
1 1 1   16    2   10 o    936.2    3.2    0.0000   0.0000          ?        ?  8764.3477  60.6596          ?        ?      936.2        3.2       ?       ? 
1 1 1   16    2   11 o    750.7    2.7    0.0000   0.0000          ?        ?  5636.2305  40.2269          ?        ?      750.7        2.7       ?       ? 
1 1 1   16    2   12 o    538.4    2.1    0.0000   0.0000          ?        ?  2898.8882  22.3483          ?        ?      538.4        2.1       ?       ? 
1 1 1   16    2   13 o    319.3    1.6    0.0000   0.0000          ?        ?  1019.7190  10.2163          ?        ?      319.3        1.6       ?       ? 
1 1 1   16    2   14 o    903.5    3.1    0.0000   0.0000          ?        ?  8164.1372  56.8284          ?        ?      903.5        3.1       ?       ? 
1 1 1   16    2   15 o    316.7    1.7    0.0000   0.0000          ?        ?  1003.1175  10.8549          ?        ?      316.7        1.7       ?       ? 
1 1 1   16    2   16 o    244.7    1.7    0.0000   0.0000          ?        ?   598.9333   8.3008          ?        ?      244.7        1.7       ?       ? 
1 1 1   16    2   17 o   1878.5    6.1    0.0000   0.0000          ?        ? 35294.9219 229.8678          ?        ?     1878.5        6.1       ?       ? 
1 1 1   16    2   18 o   1184.3    4.1    0.0000   0.0000          ?        ? 14027.6807  97.6938          ?        ?     1184.3        4.1       ?       ? 
1 1 1   16    2   19 o   1410.1    4.7    0.0000   0.0000          ?        ? 19886.7559 132.1740          ?        ?     1410.1        4.7       ?       ? 
1 1 1   16    2   20 o    582.1    2.3    0.0000   0.0000          ?        ?  3387.9956  26.8179          ?        ?      582.1        2.3       ?       ? 
1 1 1   16    2   21 o   1076.8    3.7    0.0000   0.0000          ?        ? 11594.9141  79.8152          ?        ?     1076.8        3.7       ?       ? 
1 1 1   16    2   22 o    450.2    2.0    0.0000   0.0000          ?        ?  2026.6676  17.8786          ?        ?      450.2        2.0       ?       ? 
1 1 1   16    2   23 o    165.7    2.9    0.0000   0.0000          ?        ?   274.5643   9.5778          ?        ?      165.7        2.9       ?       ? 
1 1 1   16    2   24 o   1913.3    6.7    0.0000   0.0000          ?        ? 36610.9141 254.7701          ?        ?     1913.3        6.7       ?       ? 
1 1 1   16    2   25 o    482.8    2.2    0.0000   0.0000          ?        ?  2331.2424  21.7097          ?        ?      482.8        2.2       ?       ? 
1 1 1   16    2   26 o    957.3    3.4    0.0000   0.0000          ?        ?  9165.3398  64.4907          ?        ?      957.3        3.4       ?       ? 
1 1 1   16    2   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    2   28 o   1497.6    5.2    0.0000   0.0000          ?        ? 22430.6250 155.1608          ?        ?     1497.6        5.2       ?       ? 
1 1 1   16    2   29 o    690.7    2.9    0.0000   0.0000          ?        ?  4771.0337  40.2269          ?        ?      690.7        2.9       ?       ? 
1 1 1   16    2   30 o   1742.0    5.8    0.0000   0.0000          ?        ? 30347.6543 202.4114          ?        ?     1742.0        5.8       ?       ? 
1 1 1   16    2   31 o   1170.3    4.1    0.0000   0.0000          ?        ? 13697.5654  95.7782          ?        ?     1170.3        4.1       ?       ? 
1 1 1   16    2   32 o    531.1    2.5    0.0000   0.0000          ?        ?  2820.9885  26.1794          ?        ?      531.1        2.5       ?       ? 
1 1 1   16    2   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    2   34 o   1094.3    4.1    0.0000   0.0000          ?        ? 11975.4727  89.3930          ?        ?     1094.3        4.1       ?       ? 
1 1 1   16    2   35 o    530.2    2.6    0.0000   0.0000          ?        ?  2811.4106  27.4564          ?        ?      530.2        2.6       ?       ? 
1 1 1   16    2   36 o   1145.6    4.0    0.0000   0.0000          ?        ? 13124.8125  91.9471          ?        ?     1145.6        4.0       ?       ? 
1 1 1   16    2   37 o    858.2    3.3    0.0000   0.0000          ?        ?  7365.9854  56.1899          ?        ?      858.2        3.3       ?       ? 
1 1 1   16    2   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    2   39 o   1006.4    3.8    0.0000   0.0000          ?        ? 10128.2295  76.6226          ?        ?     1006.4        3.8       ?       ? 
1 1 1   16    2   40 f    622.9    2.8    0.0000   0.0000          ?        ?  3880.2959  35.1187          ?        ?      622.9        2.8       ?       ? 
1 1 1   16    2   41 o   1025.3    3.9    0.0000   0.0000          ?        ? 10513.2588  79.8152          ?        ?     1025.3        3.9       ?       ? 
1 1 1   16    2   42 o    690.5    3.0    0.0000   0.0000          ?        ?  4768.4795  41.5039          ?        ?      690.5        3.0       ?       ? 
1 1 1   16    2   43 o    481.9    2.8    0.0000   0.0000          ?        ?  2322.3032  26.8179          ?        ?      481.9        2.8       ?       ? 
1 1 1   16    2   44 o    167.2    5.3    0.0000   0.0000          ?        ?   279.6725  17.8786          ?        ?      167.2        5.3       ?       ? 
1 1 1   16    2   45 o     64.1   14.3    0.0000   0.0000          ?        ?    42.7809  17.8786          ?        ?       64.1       14.3       ?       ? 
1 1 1   16    2   46 o    146.9    6.7    0.0000   0.0000          ?        ?   215.8203  19.7942          ?        ?      146.9        6.7       ?       ? 
1 1 1   16    2   47 o    540.5    2.8    0.0000   0.0000          ?        ?  2921.8750  30.0105          ?        ?      540.5        2.8       ?       ? 
1 1 1   16    2   48 o    128.8    7.7    0.0000   0.0000          ?        ?   166.0156  19.7942          ?        ?      128.8        7.7       ?       ? 
1 1 1   16    2   49 o     22.6   11.3    0.0000   0.0000          ?        ?   -53.6358  20.4327          ?        ?       22.6       11.3       ?       ? 
1 1 1   16    2   50 o    481.4    2.8    0.0000   0.0000          ?        ?  2317.8335  26.8179          ?        ?      481.4        2.8       ?       ? 
1 1 1   16    2   51 o    252.7    3.8    0.0000   0.0000          ?        ?   638.5216  19.1556          ?        ?      252.7        3.8       ?       ? 
1 1 1   16    2   52 o    109.5    8.5    0.0000   0.0000          ?        ?   120.0421  18.5171          ?        ?      109.5        8.5       ?       ? 
1 1 1   16    2   53 o    341.7    3.1    0.0000   0.0000          ?        ?  1167.8560  21.0712          ?        ?      341.7        3.1       ?       ? 
1 1 1   16    2   54 o    277.7    3.4    0.0000   0.0000          ?        ?   771.3342  19.1556          ?        ?      277.7        3.4       ?       ? 
1 1 1   16    2   55 o    244.7    4.0    0.0000   0.0000          ?        ?   598.9333  19.7942          ?        ?      244.7        4.0       ?       ? 
1 1 1   16    2   56 o    520.2    2.9    0.0000   0.0000          ?        ?  2706.6931  30.0105          ?        ?      520.2        2.9       ?       ? 
1 1 1   16    2   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    2   58 o    489.4    2.7    0.0000   0.0000          ?        ?  2395.7332  26.8179          ?        ?      489.4        2.7       ?       ? 
1 1 1   16    2   59 o     23.6   11.6    0.0000   0.0000          ?        ?   -40.2269  19.1556          ?        ?       23.6       11.6       ?       ? 
1 1 1   16    2   60 o    229.0    4.3    0.0000   0.0000          ?        ?   524.8647  19.7942          ?        ?      229.0        4.3       ?       ? 
1 1 1   16    2   61 o     39.3   15.8    0.0000   0.0000          ?        ?     7.0237  19.1556          ?        ?       39.3       15.8       ?       ? 
1 1 1   16    2   62 o    251.6    3.8    0.0000   0.0000          ?        ?   633.4135  19.1556          ?        ?      251.6        3.8       ?       ? 
1 1 1   16    2   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    2   64 o    174.2    5.7    0.0000   0.0000          ?        ?   303.9363  19.7942          ?        ?      174.2        5.7       ?       ? 
1 1 1   16    2   65 o    228.6    4.3    0.0000   0.0000          ?        ?   522.9492  19.7942          ?        ?      228.6        4.3       ?       ? 
1 1 1   16    2   66 o    482.3    2.8    0.0000   0.0000          ?        ?  2326.7727  26.8179          ?        ?      482.3        2.8       ?       ? 
1 1 1   16    2   67 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    2   68 o     20.4   10.3    0.0000   0.0000          ?        ?   -74.0685  21.0712          ?        ?       20.4       10.3       ?       ? 
1 1 1   16    2   69 o    421.9    3.0    0.0000   0.0000          ?        ?  1781.4753  24.9023          ?        ?      421.9        3.0       ?       ? 
1 1 1   16    2   70 o    153.7    6.6    0.0000   0.0000          ?        ?   236.8915  20.4327          ?        ?      153.7        6.6       ?       ? 
1 1 1   16    2   71 o     54.9   17.2    0.0000   0.0000          ?        ?    30.6490  21.0712          ?        ?       54.9       17.2       ?       ? 
1 1 1   16    2   72 o     45.8   16.9    0.0000   0.0000          ?        ?    17.2401  20.4327          ?        ?       45.8       16.9       ?       ? 
1 1 1   16    2   73 o    271.9    4.1    0.0000   0.0000          ?        ?   740.6851  22.3483          ?        ?      271.9        4.1       ?       ? 
1 1 1   16    2   74 o    119.9    9.1    0.0000   0.0000          ?        ?   144.9444  21.7097          ?        ?      119.9        9.1       ?       ? 
1 1 1   16    2   75 o     43.5   17.1    0.0000   0.0000          ?        ?    12.1319  21.7097          ?        ?       43.5       17.1       ?       ? 
1 1 1   16    2   76 o    192.3    5.8    0.0000   0.0000          ?        ?   371.6196  22.3483          ?        ?      192.3        5.8       ?       ? 
1 1 1   16    2   77 o    161.7    6.1    0.0000   0.0000          ?        ?   263.0709  19.7942          ?        ?      161.7        6.1       ?       ? 
1 1 1   16    2   78 o     28.1   13.4    0.0000   0.0000          ?        ?   -26.8179  21.0712          ?        ?       28.1       13.4       ?       ? 
1 1 1   16    2   79 o    176.4    5.6    0.0000   0.0000          ?        ?   312.8756  19.7942          ?        ?      176.4        5.6       ?       ? 
1 1 1   16    2   80 o     61.1   16.8    0.0000   0.0000          ?        ?    40.8654  21.0712          ?        ?       61.1       16.8       ?       ? 
1 1 1   16    3    0 o    471.4    2.6 2222.0552  24.9023  2222.0552  24.9023  2222.0552  24.9023      471.4      2.6      471.4        2.6     0.0     0.0 
1 1 1   16    3    1 o    252.8    1.4    0.0000   0.0000          ?        ?   639.1602   7.0237          ?        ?      252.8        1.4       ?       ? 
1 1 1   16    3    2 o   1266.3    4.2    0.0000   0.0000          ?        ? 16036.4707 107.2716          ?        ?     1266.3        4.2       ?       ? 
1 1 1   16    3    3 f   1287.7    4.3    0.0000   0.0000          ?        ? 16583.0449 109.8257          ?        ?     1287.7        4.3       ?       ? 
1 1 1   16    3    4 o    802.9    2.9    0.0000   0.0000          ?        ?  6447.1528  45.9736          ?        ?      802.9        2.9       ?       ? 
1 1 1   16    3    5 o    793.2    2.8    0.0000   0.0000          ?        ?  6291.3535  44.6965          ?        ?      793.2        2.8       ?       ? 
1 1 1   16    3    6 o   1255.4    4.2    0.0000   0.0000          ?        ? 15760.6299 104.7175          ?        ?     1255.4        4.2       ?       ? 
1 1 1   16    3    7 o   1161.0    3.9    0.0000   0.0000          ?        ? 13479.1914  90.6701          ?        ?     1161.0        3.9       ?       ? 
1 1 1   16    3    8 o    599.0    2.2    0.0000   0.0000          ?        ?  3587.8533  26.8179          ?        ?      599.0        2.2       ?       ? 
1 1 1   16    3    9 o   1007.9    3.4    0.0000   0.0000          ?        ? 10159.5176  68.9603          ?        ?     1007.9        3.4       ?       ? 
1 1 1   16    3   10 o   1356.0    4.5    0.0000   0.0000          ?        ? 18388.7832 123.2347          ?        ?     1356.0        4.5       ?       ? 
1 1 1   16    3   11 o   1476.6    4.9    0.0000   0.0000          ?        ? 21804.8750 144.3059          ?        ?     1476.6        4.9       ?       ? 
1 1 1   16    3   12 o   1538.8    5.1    0.0000   0.0000          ?        ? 23681.4902 156.4378          ?        ?     1538.8        5.1       ?       ? 
1 1 1   16    3   13 o    977.5    3.4    0.0000   0.0000          ?        ?  9555.4766  65.7677          ?        ?      977.5        3.4       ?       ? 
1 1 1   16    3   14 o   1599.0    5.3    0.0000   0.0000          ?        ? 25570.2383 167.9312          ?        ?     1599.0        5.3       ?       ? 
1 1 1   16    3   15 o   1687.0    5.5    0.0000   0.0000          ?        ? 28465.2949 186.4483          ?        ?     1687.0        5.5       ?       ? 
1 1 1   16    3   16 o    411.2    1.9    0.0000   0.0000          ?        ?  1690.8052  15.3245          ?        ?      411.2        1.9       ?       ? 
1 1 1   16    3   17 o    838.9    3.1    0.0000   0.0000          ?        ?  7037.1465  52.3588          ?        ?      838.9        3.1       ?       ? 
1 1 1   16    3   18 o    717.3    2.7    0.0000   0.0000          ?        ?  5145.2070  38.9498          ?        ?      717.3        2.7       ?       ? 
1 1 1   16    3   19 o   1275.1    4.3    0.0000   0.0000          ?        ? 16260.5928 109.1872          ?        ?     1275.1        4.3       ?       ? 
1 1 1   16    3   20 o    912.6    3.2    0.0000   0.0000          ?        ?  8329.5146  58.7440          ?        ?      912.6        3.2       ?       ? 
1 1 1   16    3   21 o   2446.0    7.9    0.0000   0.0000          ?        ? 59843.5234 384.3900          ?        ?     2446.0        7.9       ?       ? 
1 1 1   16    3   22 o    477.0    2.1    0.0000   0.0000          ?        ?  2275.6909  20.4327          ?        ?      477.0        2.1       ?       ? 
1 1 1   16    3   23 o   1664.4    5.4    0.0000   0.0000          ?        ? 27704.8145 181.3401          ?        ?     1664.4        5.4       ?       ? 
1 1 1   16    3   24 o   1241.4    4.5    0.0000   0.0000          ?        ? 15410.7197 111.7413          ?        ?     1241.4        4.5       ?       ? 
1 1 1   16    3   25 o   1259.7    4.3    0.0000   0.0000          ?        ? 15870.4551 107.9102          ?        ?     1259.7        4.3       ?       ? 
1 1 1   16    3   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    3   27 o    827.6    3.3    0.0000   0.0000          ?        ?  6850.0605  54.9129          ?        ?      827.6        3.3       ?       ? 
1 1 1   16    3   28 o    860.3    3.5    0.0000   0.0000          ?        ?  7401.7422  59.3825          ?        ?      860.3        3.5       ?       ? 
1 1 1   16    3   29 o   1214.5    4.4    0.0000   0.0000          ?        ? 14750.4883 105.9946          ?        ?     1214.5        4.4       ?       ? 
1 1 1   16    3   30 o   1351.0    4.7    0.0000   0.0000          ?        ? 18253.4180 126.4273          ?        ?     1351.0        4.7       ?       ? 
1 1 1   16    3   31 o    905.4    3.4    0.0000   0.0000          ?        ?  8197.3408  61.2981          ?        ?      905.4        3.4       ?       ? 
1 1 1   16    3   32 o    817.2    3.1    0.0000   0.0000          ?        ?  6678.2979  51.0817          ?        ?      817.2        3.1       ?       ? 
1 1 1   16    3   33 o   1024.8    3.9    0.0000   0.0000          ?        ? 10503.6807  79.8152          ?        ?     1024.8        3.9       ?       ? 
1 1 1   16    3   34 o    654.6    2.7    0.0000   0.0000          ?        ?  4285.7573  35.7572          ?        ?      654.6        2.7       ?       ? 
1 1 1   16    3   35 o    774.0    3.1    0.0000   0.0000          ?        ?  5990.6099  48.5276          ?        ?      774.0        3.1       ?       ? 
1 1 1   16    3   36 o    776.8    3.1    0.0000   0.0000          ?        ?  6034.6680  47.8891          ?        ?      776.8        3.1       ?       ? 
1 1 1   16    3   37 f    765.8    3.0    0.0000   0.0000          ?        ?  5864.1826  45.9736          ?        ?      765.8        3.0       ?       ? 
1 1 1   16    3   38 o    698.7    2.9    0.0000   0.0000          ?        ?  4882.1362  40.8654          ?        ?      698.7        2.9       ?       ? 
1 1 1   16    3   39 o   1985.6    6.6    0.0000   0.0000          ?        ? 39433.1797 261.7939          ?        ?     1985.6        6.6       ?       ? 
1 1 1   16    3   40 o   1345.2    4.6    0.0000   0.0000          ?        ? 18096.9805 122.5962          ?        ?     1345.2        4.6       ?       ? 
1 1 1   16    3   41 o    752.4    3.1    0.0000   0.0000          ?        ?  5661.1328  47.2506          ?        ?      752.4        3.1       ?       ? 
1 1 1   16    3   42 f    823.6    3.1    0.0000   0.0000          ?        ?  6784.2925  51.0817          ?        ?      823.6        3.1       ?       ? 
1 1 1   16    3   43 o    197.3    5.0    0.0000   0.0000          ?        ?   389.4982  19.7942          ?        ?      197.3        5.0       ?       ? 
1 1 1   16    3   44 o    712.6    3.1    0.0000   0.0000          ?        ?  5078.1626  44.0580          ?        ?      712.6        3.1       ?       ? 
1 1 1   16    3   45 o    447.4    2.8    0.0000   0.0000          ?        ?  2001.7653  24.9023          ?        ?      447.4        2.8       ?       ? 
1 1 1   16    3   46 o    755.0    3.1    0.0000   0.0000          ?        ?  5701.3599  46.6121          ?        ?      755.0        3.1       ?       ? 
1 1 1   16    3   47 o    805.0    3.1    0.0000   0.0000          ?        ?  6481.6328  49.1662          ?        ?      805.0        3.1       ?       ? 
1 1 1   16    3   48 o    153.9    6.4    0.0000   0.0000          ?        ?   236.8915  19.7942          ?        ?      153.9        6.4       ?       ? 
1 1 1   16    3   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    3   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    3   51 o    407.3    2.8    0.0000   0.0000          ?        ?  1658.8792  22.9868          ?        ?      407.3        2.8       ?       ? 
1 1 1   16    3   52 o    264.3    3.6    0.0000   0.0000          ?        ?   698.5427  19.1556          ?        ?      264.3        3.6       ?       ? 
1 1 1   16    3   53 o    269.4    3.6    0.0000   0.0000          ?        ?   725.9991  19.1556          ?        ?      269.4        3.6       ?       ? 
1 1 1   16    3   54 o    339.4    3.0    0.0000   0.0000          ?        ?  1151.8929  20.4327          ?        ?      339.4        3.0       ?       ? 
1 1 1   16    3   55 o    516.7    2.7    0.0000   0.0000          ?        ?  2670.2976  28.0950          ?        ?      516.7        2.7       ?       ? 
1 1 1   16    3   56 o    619.0    2.7    0.0000   0.0000          ?        ?  3833.0452  33.8416          ?        ?      619.0        2.7       ?       ? 
1 1 1   16    3   57 o    299.1    3.3    0.0000   0.0000          ?        ?   895.2073  19.7942          ?        ?      299.1        3.3       ?       ? 
1 1 1   16    3   58 o     20.2   10.2    0.0000   0.0000          ?        ?   -71.5144  20.4327          ?        ?       20.2       10.2       ?       ? 
1 1 1   16    3   59 o    464.1    2.8    0.0000   0.0000          ?        ?  2154.3718  26.1794          ?        ?      464.1        2.8       ?       ? 
1 1 1   16    3   60 o    510.5    2.8    0.0000   0.0000          ?        ?  2607.0837  28.0950          ?        ?      510.5        2.8       ?       ? 
1 1 1   16    3   61 o    416.2    2.8    0.0000   0.0000          ?        ?  1732.9476  23.6253          ?        ?      416.2        2.8       ?       ? 
1 1 1   16    3   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    3   63 o    125.1    7.9    0.0000   0.0000          ?        ?   157.0763  19.7942          ?        ?      125.1        7.9       ?       ? 
1 1 1   16    3   64 o    259.1    3.9    0.0000   0.0000          ?        ?   671.7247  20.4327          ?        ?      259.1        3.9       ?       ? 
1 1 1   16    3   65 o    156.8    5.9    0.0000   0.0000          ?        ?   246.4693  18.5171          ?        ?      156.8        5.9       ?       ? 
1 1 1   16    3   66 o    323.5    3.5    0.0000   0.0000          ?        ?  1047.1754  22.3483          ?        ?      323.5        3.5       ?       ? 
1 1 1   16    3   67 o    173.2    6.1    0.0000   0.0000          ?        ?   300.7437  21.0712          ?        ?      173.2        6.1       ?       ? 
1 1 1   16    3   68 o    448.3    2.9    0.0000   0.0000          ?        ?  2010.7046  26.1794          ?        ?      448.3        2.9       ?       ? 
1 1 1   16    3   69 o     30.8   14.3    0.0000   0.0000          ?        ?   -17.8786  21.0712          ?        ?       30.8       14.3       ?       ? 
1 1 1   16    3   70 o    160.5    6.6    0.0000   0.0000          ?        ?   258.6013  21.0712          ?        ?      160.5        6.6       ?       ? 
1 1 1   16    3   71 o    220.8    4.6    0.0000   0.0000          ?        ?   488.4691  20.4327          ?        ?      220.8        4.6       ?       ? 
1 1 1   16    3   72 o    157.1    6.9    0.0000   0.0000          ?        ?   247.7464  21.7097          ?        ?      157.1        6.9       ?       ? 
1 1 1   16    3   73 o    166.1    6.3    0.0000   0.0000          ?        ?   277.1184  21.0712          ?        ?      166.1        6.3       ?       ? 
1 1 1   16    3   74 o     33.5   14.9    0.0000   0.0000          ?        ?    -7.6623  20.4327          ?        ?       33.5       14.9       ?       ? 
1 1 1   16    3   75 f     35.5   15.4    0.0000   0.0000          ?        ?    -2.5541  20.4327          ?        ?       35.5       15.4       ?       ? 
1 1 1   16    3   76 o    204.3    5.5    0.0000   0.0000          ?        ?   418.8702  22.3483          ?        ?      204.3        5.5       ?       ? 
1 1 1   16    3   77 f    156.2    6.9    0.0000   0.0000          ?        ?   245.8308  21.7097          ?        ?      156.2        6.9       ?       ? 
1 1 1   16    3   78 o    118.8    8.9    0.0000   0.0000          ?        ?   143.0288  21.0712          ?        ?      118.8        8.9       ?       ? 
1 1 1   16    3   79 o     65.3   16.6    0.0000   0.0000          ?        ?    46.6121  21.7097          ?        ?       65.3       16.6       ?       ? 
1 1 1   16    4    0 o    110.1    2.3  121.3191   5.1082   121.3191   5.1082   121.3191   5.1082      110.1      2.3      110.1        2.3     0.0     0.0 
1 1 1   16    4    1 f    439.2    1.8    0.0000   0.0000          ?        ?  1928.9739  15.9630          ?        ?      439.2        1.8       ?       ? 
1 1 1   16    4    2 o    723.7    2.6    0.0000   0.0000          ?        ?  5237.1543  37.6728          ?        ?      723.7        2.6       ?       ? 
1 1 1   16    4    3 o    811.5    2.9    0.0000   0.0000          ?        ?  6586.3506  46.6121          ?        ?      811.5        2.9       ?       ? 
1 1 1   16    4    4 o   1622.0    5.4    0.0000   0.0000          ?        ? 26311.5625 173.6779          ?        ?     1622.0        5.4       ?       ? 
1 1 1   16    4    5 o   1133.4    3.9    0.0000   0.0000          ?        ? 12847.6934  88.7545          ?        ?     1133.4        3.9       ?       ? 
1 1 1   16    4    6 o    776.4    2.8    0.0000   0.0000          ?        ?  6027.6440  44.0580          ?        ?      776.4        2.8       ?       ? 
1 1 1   16    4    7 o    393.3    1.7    0.0000   0.0000          ?        ?  1547.1379  13.4090          ?        ?      393.3        1.7       ?       ? 
1 1 1   16    4    8 o    362.3    1.7    0.0000   0.0000          ?        ?  1312.8005  12.1319          ?        ?      362.3        1.7       ?       ? 
1 1 1   16    4    9 o   1448.9    4.8    0.0000   0.0000          ?        ? 20994.5918 138.5592          ?        ?     1448.9        4.8       ?       ? 
1 1 1   16    4   10 o    874.4    3.1    0.0000   0.0000          ?        ?  7646.2964  53.6358          ?        ?      874.4        3.1       ?       ? 
1 1 1   16    4   11 o   1389.7    4.6    0.0000   0.0000          ?        ? 19315.9180 127.7043          ?        ?     1389.7        4.6       ?       ? 
1 1 1   16    4   12 f   2012.7    6.5    0.0000   0.0000          ?        ? 40518.0273 261.7939          ?        ?     2012.7        6.5       ?       ? 
1 1 1   16    4   13 f    495.7    2.1    0.0000   0.0000          ?        ?  2457.6697  20.4327          ?        ?      495.7        2.1       ?       ? 
1 1 1   16    4   14 o    641.4    2.4    0.0000   0.0000          ?        ?  4114.6333  30.6490          ?        ?      641.4        2.4       ?       ? 
1 1 1   16    4   15 o   1420.0    4.7    0.0000   0.0000          ?        ? 20166.4297 134.0895          ?        ?     1420.0        4.7       ?       ? 
1 1 1   16    4   16 o    923.3    3.3    0.0000   0.0000          ?        ?  8526.1797  61.2981          ?        ?      923.3        3.3       ?       ? 
1 1 1   16    4   17 o    477.2    2.0    0.0000   0.0000          ?        ?  2277.6067  19.1556          ?        ?      477.2        2.0       ?       ? 
1 1 1   16    4   18 o    897.7    3.2    0.0000   0.0000          ?        ?  8058.7812  56.8284          ?        ?      897.7        3.2       ?       ? 
1 1 1   16    4   19 o    540.7    2.2    0.0000   0.0000          ?        ?  2923.1519  24.2638          ?        ?      540.7        2.2       ?       ? 
1 1 1   16    4   20 o    644.9    2.5    0.0000   0.0000          ?        ?  4159.3301  31.9261          ?        ?      644.9        2.5       ?       ? 
1 1 1   16    4   21 o    581.2    2.4    0.0000   0.0000          ?        ?  3377.7793  28.0950          ?        ?      581.2        2.4       ?       ? 
1 1 1   16    4   22 o   1791.9    5.9    0.0000   0.0000          ?        ? 32114.4453 210.7121          ?        ?     1791.9        5.9       ?       ? 
1 1 1   16    4   23 o    913.9    3.5    0.0000   0.0000          ?        ?  8351.8633  63.2136          ?        ?      913.9        3.5       ?       ? 
1 1 1   16    4   24 o   1185.8    4.1    0.0000   0.0000          ?        ? 14062.7998  97.6938          ?        ?     1185.8        4.1       ?       ? 
1 1 1   16    4   25 o    732.4    2.7    0.0000   0.0000          ?        ?  5364.2202  40.2269          ?        ?      732.4        2.7       ?       ? 
1 1 1   16    4   26 o    640.4    2.6    0.0000   0.0000          ?        ?  4100.5859  33.8416          ?        ?      640.4        2.6       ?       ? 
1 1 1   16    4   27 o    611.1    2.8    0.0000   0.0000          ?        ?  3734.0745  33.8416          ?        ?      611.1        2.8       ?       ? 
1 1 1   16    4   28 o    974.6    3.6    0.0000   0.0000          ?        ?  9498.0088  69.5989          ?        ?      974.6        3.6       ?       ? 
1 1 1   16    4   29 o   1468.4    4.9    0.0000   0.0000          ?        ? 21562.8750 143.0288          ?        ?     1468.4        4.9       ?       ? 
1 1 1   16    4   30 o   1298.7    4.7    0.0000   0.0000          ?        ? 16866.5488 122.5962          ?        ?     1298.7        4.7       ?       ? 
1 1 1   16    4   31 o    782.7    3.2    0.0000   0.0000          ?        ?  6126.6152  50.4432          ?        ?      782.7        3.2       ?       ? 
1 1 1   16    4   32 o   1101.1    4.0    0.0000   0.0000          ?        ? 12124.8877  88.7545          ?        ?     1101.1        4.0       ?       ? 
1 1 1   16    4   33 o    617.0    2.8    0.0000   0.0000          ?        ?  3807.5044  34.4802          ?        ?      617.0        2.8       ?       ? 
1 1 1   16    4   34 o     89.7    9.6    0.0000   0.0000          ?        ?    80.4537  17.2401          ?        ?       89.7        9.6       ?       ? 
1 1 1   16    4   35 o    178.9    4.1    0.0000   0.0000          ?        ?   319.8993  14.6860          ?        ?      178.9        4.1       ?       ? 
1 1 1   16    4   36 o     21.7   10.9    0.0000   0.0000          ?        ?   -68.9603  21.7097          ?        ?       21.7       10.9       ?       ? 
1 1 1   16    4   37 o   1044.5    3.8    0.0000   0.0000          ?        ? 10910.4189  79.8152          ?        ?     1044.5        3.8       ?       ? 
1 1 1   16    4   38 o    404.5    2.7    0.0000   0.0000          ?        ?  1635.8925  21.7097          ?        ?      404.5        2.7       ?       ? 
1 1 1   16    4   39 o    802.7    3.1    0.0000   0.0000          ?        ?  6443.9604  49.8047          ?        ?      802.7        3.1       ?       ? 
1 1 1   16    4   40 o    695.2    2.9    0.0000   0.0000          ?        ?  4832.9702  40.2269          ?        ?      695.2        2.9       ?       ? 
1 1 1   16    4   41 o   1436.9    5.0    0.0000   0.0000          ?        ? 20648.5117 142.3903          ?        ?     1436.9        5.0       ?       ? 
1 1 1   16    4   42 o    680.9    3.0    0.0000   0.0000          ?        ?  4636.3052  40.8654          ?        ?      680.9        3.0       ?       ? 
1 1 1   16    4   43 o    200.4    4.8    0.0000   0.0000          ?        ?   401.6301  19.1556          ?        ?      200.4        4.8       ?       ? 
1 1 1   16    4   44 o    615.3    3.0    0.0000   0.0000          ?        ?  3785.7949  36.3957          ?        ?      615.3        3.0       ?       ? 
1 1 1   16    4   45 o    329.9    3.1    0.0000   0.0000          ?        ?  1088.6793  20.4327          ?        ?      329.9        3.1       ?       ? 
1 1 1   16    4   46 o    864.5    3.4    0.0000   0.0000          ?        ?  7475.1724  58.7440          ?        ?      864.5        3.4       ?       ? 
1 1 1   16    4   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    4   48 o    495.5    2.8    0.0000   0.0000          ?        ?  2455.1157  27.4564          ?        ?      495.5        2.8       ?       ? 
1 1 1   16    4   49 o    874.5    3.2    0.0000   0.0000          ?        ?  7649.4893  56.8284          ?        ?      874.5        3.2       ?       ? 
1 1 1   16    4   50 o    284.8    3.6    0.0000   0.0000          ?        ?   811.5610  20.4327          ?        ?      284.8        3.6       ?       ? 
1 1 1   16    4   51 o    747.2    3.0    0.0000   0.0000          ?        ?  5584.5098  44.6965          ?        ?      747.2        3.0       ?       ? 
1 1 1   16    4   52 o    282.8    3.5    0.0000   0.0000          ?        ?   800.0676  19.7942          ?        ?      282.8        3.5       ?       ? 
1 1 1   16    4   53 o    144.2    6.6    0.0000   0.0000          ?        ?   208.1580  19.1556          ?        ?      144.2        6.6       ?       ? 
1 1 1   16    4   54 o    607.3    2.9    0.0000   0.0000          ?        ?  3688.7395  35.1187          ?        ?      607.3        2.9       ?       ? 
1 1 1   16    4   55 o    408.3    2.9    0.0000   0.0000          ?        ?  1667.8186  23.6253          ?        ?      408.3        2.9       ?       ? 
1 1 1   16    4   56 o    409.4    2.8    0.0000   0.0000          ?        ?  1676.1193  22.9868          ?        ?      409.4        2.8       ?       ? 
1 1 1   16    4   57 o    473.2    2.8    0.0000   0.0000          ?        ?  2239.2954  26.1794          ?        ?      473.2        2.8       ?       ? 
1 1 1   16    4   58 o    389.0    3.0    0.0000   0.0000          ?        ?  1513.9348  23.6253          ?        ?      389.0        3.0       ?       ? 
1 1 1   16    4   59 o    677.0    2.9    0.0000   0.0000          ?        ?  4585.2236  39.5883          ?        ?      677.0        2.9       ?       ? 
1 1 1   16    4   60 o    476.6    2.9    0.0000   0.0000          ?        ?  2272.4985  28.0950          ?        ?      476.6        2.9       ?       ? 
1 1 1   16    4   61 o    229.7    4.4    0.0000   0.0000          ?        ?   528.0574  20.4327          ?        ?      229.7        4.4       ?       ? 
1 1 1   16    4   62 o     20.5   10.4    0.0000   0.0000          ?        ?   -68.9603  20.4327          ?        ?       20.5       10.4       ?       ? 
1 1 1   16    4   63 o    469.0    2.9    0.0000   0.0000          ?        ?  2200.3455  26.8179          ?        ?      469.0        2.9       ?       ? 
1 1 1   16    4   64 o     60.8   15.7    0.0000   0.0000          ?        ?    38.9498  19.1556          ?        ?       60.8       15.7       ?       ? 
1 1 1   16    4   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    4   66 o    298.5    3.6    0.0000   0.0000          ?        ?   892.0147  21.7097          ?        ?      298.5        3.6       ?       ? 
1 1 1   16    4   67 o    191.5    5.2    0.0000   0.0000          ?        ?   367.1499  19.7942          ?        ?      191.5        5.2       ?       ? 
1 1 1   16    4   68 o    338.9    3.4    0.0000   0.0000          ?        ?  1149.3389  22.9868          ?        ?      338.9        3.4       ?       ? 
1 1 1   16    4   69 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    4   70 o    271.0    4.2    0.0000   0.0000          ?        ?   735.5769  22.9868          ?        ?      271.0        4.2       ?       ? 
1 1 1   16    4   71 o     84.4   12.5    0.0000   0.0000          ?        ?    72.1529  21.0712          ?        ?       84.4       12.5       ?       ? 
1 1 1   16    4   72 o    257.7    4.6    0.0000   0.0000          ?        ?   665.3395  23.6253          ?        ?      257.7        4.6       ?       ? 
1 1 1   16    4   73 o    242.9    4.7    0.0000   0.0000          ?        ?   591.2710  22.9868          ?        ?      242.9        4.7       ?       ? 
1 1 1   16    4   74 o     23.1   11.5    0.0000   0.0000          ?        ?   -52.9973  21.0712          ?        ?       23.1       11.5       ?       ? 
1 1 1   16    4   75 o    178.1    6.1    0.0000   0.0000          ?        ?   318.6223  21.7097          ?        ?      178.1        6.1       ?       ? 
1 1 1   16    4   76 o     39.3   16.0    0.0000   0.0000          ?        ?     7.0237  19.7942          ?        ?       39.3       16.0       ?       ? 
1 1 1   16    4   77 o     33.5   14.8    0.0000   0.0000          ?        ?    -5.7467  19.7942          ?        ?       33.5       14.8       ?       ? 
1 1 1   16    4   78 o    144.4    6.6    0.0000   0.0000          ?        ?   210.0736  19.1556          ?        ?      144.4        6.6       ?       ? 
1 1 1   16    4   79 o     50.0   17.5    0.0000   0.0000          ?        ?    24.2638  21.7097          ?        ?       50.0       17.5       ?       ? 
1 1 1   16    5    0 o    171.2    2.1  293.0815   7.0237   293.0815   7.0237   293.0815   7.0237      171.2      2.1      171.2        2.1     0.0     0.0 
1 1 1   16    5    1 o    335.0    1.5    0.0000   0.0000          ?        ?  1122.5210  10.2163          ?        ?      335.0        1.5       ?       ? 
1 1 1   16    5    2 o    698.5    2.5    0.0000   0.0000          ?        ?  4878.9434  35.1187          ?        ?      698.5        2.5       ?       ? 
1 1 1   16    5    3 f    797.5    2.8    0.0000   0.0000          ?        ?  6359.6753  45.3350          ?        ?      797.5        2.8       ?       ? 
1 1 1   16    5    4 o    557.8    2.1    0.0000   0.0000          ?        ?  3111.5159  23.6253          ?        ?      557.8        2.1       ?       ? 
1 1 1   16    5    5 o    386.0    1.7    0.0000   0.0000          ?        ?  1489.6710  12.7704          ?        ?      386.0        1.7       ?       ? 
1 1 1   16    5    6 o    459.1    1.9    0.0000   0.0000          ?        ?  2107.7600  17.2401          ?        ?      459.1        1.9       ?       ? 
1 1 1   16    5    7 f    874.4    3.0    0.0000   0.0000          ?        ?  7645.6582  52.9973          ?        ?      874.4        3.0       ?       ? 
1 1 1   16    5    8 o    322.4    1.6    0.0000   0.0000          ?        ?  1039.5132  10.2163          ?        ?      322.4        1.6       ?       ? 
1 1 1   16    5    9 o    416.4    1.8    0.0000   0.0000          ?        ?  1733.5862  15.3245          ?        ?      416.4        1.8       ?       ? 
1 1 1   16    5   10 o    614.6    2.3    0.0000   0.0000          ?        ?  3776.8555  28.7335          ?        ?      614.6        2.3       ?       ? 
1 1 1   16    5   11 o    665.4    2.5    0.0000   0.0000          ?        ?  4427.5093  33.2031          ?        ?      665.4        2.5       ?       ? 
1 1 1   16    5   12 o   1624.1    5.3    0.0000   0.0000          ?        ? 26380.5215 173.6779          ?        ?     1624.1        5.3       ?       ? 
1 1 1   16    5   13 f    857.1    3.1    0.0000   0.0000          ?        ?  7346.8296  52.3588          ?        ?      857.1        3.1       ?       ? 
1 1 1   16    5   14 o    969.7    3.4    0.0000   0.0000          ?        ?  9404.1465  65.7677          ?        ?      969.7        3.4       ?       ? 
1 1 1   16    5   15 o    512.3    2.1    0.0000   0.0000          ?        ?  2624.9624  21.7097          ?        ?      512.3        2.1       ?       ? 
1 1 1   16    5   16 o    967.6    3.4    0.0000   0.0000          ?        ?  9362.6426  65.1292          ?        ?      967.6        3.4       ?       ? 
1 1 1   16    5   17 o    969.2    3.4    0.0000   0.0000          ?        ?  9394.5693  65.1292          ?        ?      969.2        3.4       ?       ? 
1 1 1   16    5   18 f    681.5    2.5    0.0000   0.0000          ?        ?  4643.9678  34.4802          ?        ?      681.5        2.5       ?       ? 
1 1 1   16    5   19 o    639.7    2.4    0.0000   0.0000          ?        ?  4092.2852  31.2876          ?        ?      639.7        2.4       ?       ? 
1 1 1   16    5   20 o     86.1    5.6    0.0000   0.0000          ?        ?    74.0685   9.5778          ?        ?       86.1        5.6       ?       ? 
1 1 1   16    5   21 o   1091.2    3.8    0.0000   0.0000          ?        ? 11908.4287  82.3693          ?        ?     1091.2        3.8       ?       ? 
1 1 1   16    5   22 o    882.5    3.2    0.0000   0.0000          ?        ?  7788.0479  56.8284          ?        ?      882.5        3.2       ?       ? 
1 1 1   16    5   23 o   1132.3    4.0    0.0000   0.0000          ?        ? 12820.8760  90.0316          ?        ?     1132.3        4.0       ?       ? 
1 1 1   16    5   24 o    691.1    2.8    0.0000   0.0000          ?        ?  4776.7803  38.3113          ?        ?      691.1        2.8       ?       ? 
1 1 1   16    5   25 o   1109.1    3.8    0.0000   0.0000          ?        ? 12300.4805  84.9234          ?        ?     1109.1        3.8       ?       ? 
1 1 1   16    5   26 o     87.2    7.7    0.0000   0.0000          ?        ?    75.9841  13.4090          ?        ?       87.2        7.7       ?       ? 
1 1 1   16    5   27 o   1543.1    5.6    0.0000   0.0000          ?        ? 23813.6641 173.0394          ?        ?     1543.1        5.6       ?       ? 
1 1 1   16    5   28 o    602.0    2.7    0.0000   0.0000          ?        ?  3623.6104  31.9261          ?        ?      602.0        2.7       ?       ? 
1 1 1   16    5   29 o   1192.0    4.2    0.0000   0.0000          ?        ? 14209.0225  98.9709          ?        ?     1192.0        4.2       ?       ? 
1 1 1   16    5   30 o   1056.3    4.1    0.0000   0.0000          ?        ? 11158.1650  86.2004          ?        ?     1056.3        4.1       ?       ? 
1 1 1   16    5   31 o   2258.4    7.3    0.0000   0.0000          ?        ? 51014.6836 329.4771          ?        ?     2258.4        7.3       ?       ? 
1 1 1   16    5   32 o    177.8    5.4    0.0000   0.0000          ?        ?   316.0682  19.1556          ?        ?      177.8        5.4       ?       ? 
1 1 1   16    5   33 o    267.7    3.6    0.0000   0.0000          ?        ?   716.4213  19.1556          ?        ?      267.7        3.6       ?       ? 
1 1 1   16    5   34 o    548.0    2.6    0.0000   0.0000          ?        ?  3002.9670  28.0950          ?        ?      548.0        2.6       ?       ? 
1 1 1   16    5   35 o   1283.8    4.5    0.0000   0.0000          ?        ? 16484.0742 114.9339          ?        ?     1283.8        4.5       ?       ? 
1 1 1   16    5   36 o    755.8    3.1    0.0000   0.0000          ?        ?  5712.8530  46.6121          ?        ?      755.8        3.1       ?       ? 
1 1 1   16    5   37 o   1701.4    5.6    0.0000   0.0000          ?        ? 28952.4844 189.6409          ?        ?     1701.4        5.6       ?       ? 
1 1 1   16    5   38 o    786.5    3.0    0.0000   0.0000          ?        ?  6185.3589  47.2506          ?        ?      786.5        3.0       ?       ? 
1 1 1   16    5   39 o    419.3    3.0    0.0000   0.0000          ?        ?  1757.8500  24.9023          ?        ?      419.3        3.0       ?       ? 
1 1 1   16    5   40 o    658.7    2.8    0.0000   0.0000          ?        ?  4339.3926  37.0343          ?        ?      658.7        2.8       ?       ? 
1 1 1   16    5   41 o   1215.6    4.2    0.0000   0.0000          ?        ? 14778.5830 102.1635          ?        ?     1215.6        4.2       ?       ? 
1 1 1   16    5   42 o    253.6    3.9    0.0000   0.0000          ?        ?   642.9913  19.7942          ?        ?      253.6        3.9       ?       ? 
1 1 1   16    5   43 o   1291.9    4.5    0.0000   0.0000          ?        ? 16693.5078 116.8494          ?        ?     1291.9        4.5       ?       ? 
1 1 1   16    5   44 o    660.7    2.9    0.0000   0.0000          ?        ?  4366.2109  38.9498          ?        ?      660.7        2.9       ?       ? 
1 1 1   16    5   45 o   1065.8    3.8    0.0000   0.0000          ?        ? 11360.5762  81.0922          ?        ?     1065.8        3.8       ?       ? 
1 1 1   16    5   46 o    280.3    3.6    0.0000   0.0000          ?        ?   786.0201  20.4327          ?        ?      280.3        3.6       ?       ? 
1 1 1   16    5   47 o    554.8    2.6    0.0000   0.0000          ?        ?  3078.3127  29.3720          ?        ?      554.8        2.6       ?       ? 
1 1 1   16    5   48 o    611.9    2.7    0.0000   0.0000          ?        ?  3744.2910  32.5646          ?        ?      611.9        2.7       ?       ? 
1 1 1   16    5   49 o    665.5    2.8    0.0000   0.0000          ?        ?  4428.7856  37.0343          ?        ?      665.5        2.8       ?       ? 
1 1 1   16    5   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    5   51 o    453.6    2.9    0.0000   0.0000          ?        ?  2057.9551  26.1794          ?        ?      453.6        2.9       ?       ? 
1 1 1   16    5   52 o    571.3    2.9    0.0000   0.0000          ?        ?  3264.1226  32.5646          ?        ?      571.3        2.9       ?       ? 
1 1 1   16    5   53 o    293.3    3.6    0.0000   0.0000          ?        ?   860.7272  21.0712          ?        ?      293.3        3.6       ?       ? 
1 1 1   16    5   54 o    498.7    2.7    0.0000   0.0000          ?        ?  2487.0417  26.8179          ?        ?      498.7        2.7       ?       ? 
1 1 1   16    5   55 o     29.9   14.1    0.0000   0.0000          ?        ?   -23.6253  21.7097          ?        ?       29.9       14.1       ?       ? 
1 1 1   16    5   56 o    580.5    2.9    0.0000   0.0000          ?        ?  3370.7559  33.2031          ?        ?      580.5        2.9       ?       ? 
1 1 1   16    5   57 o    613.6    2.7    0.0000   0.0000          ?        ?  3766.0005  33.2031          ?        ?      613.6        2.7       ?       ? 
1 1 1   16    5   58 o    449.0    2.8    0.0000   0.0000          ?        ?  2016.4512  24.9023          ?        ?      449.0        2.8       ?       ? 
1 1 1   16    5   59 o    270.9    3.8    0.0000   0.0000          ?        ?   734.2999  20.4327          ?        ?      270.9        3.8       ?       ? 
1 1 1   16    5   60 o     94.0   10.2    0.0000   0.0000          ?        ?    88.7545  19.1556          ?        ?       94.0       10.2       ?       ? 
1 1 1   16    5   61 o     25.9   12.5    0.0000   0.0000          ?        ?   -29.3720  19.1556          ?        ?       25.9       12.5       ?       ? 
1 1 1   16    5   62 o    327.3    3.1    0.0000   0.0000          ?        ?  1071.4393  20.4327          ?        ?      327.3        3.1       ?       ? 
1 1 1   16    5   63 o    614.2    2.8    0.0000   0.0000          ?        ?  3773.6628  33.8416          ?        ?      614.2        2.8       ?       ? 
1 1 1   16    5   64 o    286.8    3.6    0.0000   0.0000          ?        ?   823.0543  20.4327          ?        ?      286.8        3.6       ?       ? 
1 1 1   16    5   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    5   66 o    244.6    4.2    0.0000   0.0000          ?        ?   598.9333  20.4327          ?        ?      244.6        4.2       ?       ? 
1 1 1   16    5   67 o    246.4    4.4    0.0000   0.0000          ?        ?   607.8726  21.7097          ?        ?      246.4        4.4       ?       ? 
1 1 1   16    5   68 o    233.4    4.4    0.0000   0.0000          ?        ?   545.2975  20.4327          ?        ?      233.4        4.4       ?       ? 
1 1 1   16    5   69 o    408.3    3.2    0.0000   0.0000          ?        ?  1668.4569  26.1794          ?        ?      408.3        3.2       ?       ? 
1 1 1   16    5   70 o    325.7    3.6    0.0000   0.0000          ?        ?  1061.8615  23.6253          ?        ?      325.7        3.6       ?       ? 
1 1 1   16    5   71 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    5   72 o    374.8    3.2    0.0000   0.0000          ?        ?  1406.0247  24.2638          ?        ?      374.8        3.2       ?       ? 
1 1 1   16    5   73 o     22.5   11.2    0.0000   0.0000          ?        ?   -52.9973  20.4327          ?        ?       22.5       11.2       ?       ? 
1 1 1   16    5   74 o    106.6   10.2    0.0000   0.0000          ?        ?   114.9339  21.7097          ?        ?      106.6       10.2       ?       ? 
1 1 1   16    5   75 o    122.9    8.8    0.0000   0.0000          ?        ?   152.6067  21.7097          ?        ?      122.9        8.8       ?       ? 
1 1 1   16    5   76 o     29.3   13.8    0.0000   0.0000          ?        ?   -22.3483  21.0712          ?        ?       29.3       13.8       ?       ? 
1 1 1   16    5   77 f     33.2   15.0    0.0000   0.0000          ?        ?    -9.5778  21.0712          ?        ?       33.2       15.0       ?       ? 
1 1 1   16    5   78 o    243.8    4.3    0.0000   0.0000          ?        ?   596.3792  21.0712          ?        ?      243.8        4.3       ?       ? 
1 1 1   16    5   79 o    143.5    7.3    0.0000   0.0000          ?        ?   208.1580  21.0712          ?        ?      143.5        7.3       ?       ? 
1 1 1   16    6    0 o   2262.5   11.4 51209.4336 515.9255 51209.4336 515.9255 51209.4336 515.9255     2262.5     11.4     2262.5       11.4     0.0     0.0 
1 1 1   16    6    1 o   1034.1    3.6    0.0000   0.0000          ?        ? 10695.2373  73.4300          ?        ?     1034.1        3.6       ?       ? 
1 1 1   16    6    2 o    739.0    2.7    0.0000   0.0000          ?        ?  5461.2754  39.5883          ?        ?      739.0        2.7       ?       ? 
1 1 1   16    6    3 o    423.3    1.7    0.0000   0.0000          ?        ?  1791.6918  14.6860          ?        ?      423.3        1.7       ?       ? 
1 1 1   16    6    4 o    755.4    2.8    0.0000   0.0000          ?        ?  5707.1064  42.1424          ?        ?      755.4        2.8       ?       ? 
1 1 1   16    6    5 o   1077.2    3.7    0.0000   0.0000          ?        ? 11604.4922  80.4537          ?        ?     1077.2        3.7       ?       ? 
1 1 1   16    6    6 o    550.5    2.1    0.0000   0.0000          ?        ?  3030.4236  23.6253          ?        ?      550.5        2.1       ?       ? 
1 1 1   16    6    7 o   1084.1    3.7    0.0000   0.0000          ?        ? 11752.6289  79.8152          ?        ?     1084.1        3.7       ?       ? 
1 1 1   16    6    8 o    536.4    2.1    0.0000   0.0000          ?        ?  2877.8171  22.3483          ?        ?      536.4        2.1       ?       ? 
1 1 1   16    6    9 o    169.7    1.9    0.0000   0.0000          ?        ?   287.9732   6.3852          ?        ?      169.7        1.9       ?       ? 
1 1 1   16    6   10 f   1562.3    5.1    0.0000   0.0000          ?        ? 24411.3203 160.9075          ?        ?     1562.3        5.1       ?       ? 
1 1 1   16    6   11 o   1066.8    3.6    0.0000   0.0000          ?        ? 11381.6484  77.2611          ?        ?     1066.8        3.6       ?       ? 
1 1 1   16    6   12 o    116.3    2.7    0.0000   0.0000          ?        ?   135.3666   6.3852          ?        ?      116.3        2.7       ?       ? 
1 1 1   16    6   13 o   1230.0    4.2    0.0000   0.0000          ?        ? 15130.4092 102.1635          ?        ?     1230.0        4.2       ?       ? 
1 1 1   16    6   14 o   1446.9    4.8    0.0000   0.0000          ?        ? 20937.1250 139.1977          ?        ?     1446.9        4.8       ?       ? 
1 1 1   16    6   15 o    554.2    2.2    0.0000   0.0000          ?        ?  3071.2891  24.2638          ?        ?      554.2        2.2       ?       ? 
1 1 1   16    6   16 o    915.0    3.2    0.0000   0.0000          ?        ?  8372.2949  59.3825          ?        ?      915.0        3.2       ?       ? 
1 1 1   16    6   17 o   1019.7    3.6    0.0000   0.0000          ?        ? 10397.6865  72.7915          ?        ?     1019.7        3.6       ?       ? 
1 1 1   16    6   18 o    746.5    2.7    0.0000   0.0000          ?        ?  5572.3784  40.8654          ?        ?      746.5        2.7       ?       ? 
1 1 1   16    6   19 o    480.6    2.2    0.0000   0.0000          ?        ?  2310.1711  21.0712          ?        ?      480.6        2.2       ?       ? 
1 1 1   16    6   20 o    864.8    3.1    0.0000   0.0000          ?        ?  7479.0039  54.2743          ?        ?      864.8        3.1       ?       ? 
1 1 1   16    6   21 o    801.9    3.0    0.0000   0.0000          ?        ?  6429.9126  47.8891          ?        ?      801.9        3.0       ?       ? 
1 1 1   16    6   22 o    188.1    2.9    0.0000   0.0000          ?        ?   353.7410  10.8549          ?        ?      188.1        2.9       ?       ? 
1 1 1   16    6   23 o    567.4    2.6    0.0000   0.0000          ?        ?  3219.4260  30.0105          ?        ?      567.4        2.6       ?       ? 
1 1 1   16    6   24 o    837.5    3.1    0.0000   0.0000          ?        ?  7014.7983  52.3588          ?        ?      837.5        3.1       ?       ? 
1 1 1   16    6   25 f   1880.3    6.4    0.0000   0.0000          ?        ? 35360.0508 240.7227          ?        ?     1880.3        6.4       ?       ? 
1 1 1   16    6   26 o   1473.4    5.0    0.0000   0.0000          ?        ? 21711.0117 148.7755          ?        ?     1473.4        5.0       ?       ? 
1 1 1   16    6   27 o    725.2    3.0    0.0000   0.0000          ?        ?  5259.5029  44.0580          ?        ?      725.2        3.0       ?       ? 
1 1 1   16    6   28 o    816.2    3.1    0.0000   0.0000          ?        ?  6661.6963  49.8047          ?        ?      816.2        3.1       ?       ? 
1 1 1   16    6   29 o   1293.6    4.5    0.0000   0.0000          ?        ? 16734.3750 117.4880          ?        ?     1293.6        4.5       ?       ? 
1 1 1   16    6   30 o    619.2    2.7    0.0000   0.0000          ?        ?  3834.3223  33.8416          ?        ?      619.2        2.7       ?       ? 
1 1 1   16    6   31 o    300.7    2.9    0.0000   0.0000          ?        ?   904.1467  17.2401          ?        ?      300.7        2.9       ?       ? 
1 1 1   16    6   32 f    945.5    4.1    0.0000   0.0000          ?        ?  8939.9414  76.6226          ?        ?      945.5        4.1       ?       ? 
1 1 1   16    6   33 o    699.3    3.0    0.0000   0.0000          ?        ?  4891.0757  41.5039          ?        ?      699.3        3.0       ?       ? 
1 1 1   16    6   34 o   1274.5    4.5    0.0000   0.0000          ?        ? 16245.9062 115.5724          ?        ?     1274.5        4.5       ?       ? 
1 1 1   16    6   35 o    481.3    2.5    0.0000   0.0000          ?        ?  2316.5564  24.2638          ?        ?      481.3        2.5       ?       ? 
1 1 1   16    6   36 f   1073.3    3.8    0.0000   0.0000          ?        ? 11519.5684  81.0922          ?        ?     1073.3        3.8       ?       ? 
1 1 1   16    6   37 o   1025.7    3.6    0.0000   0.0000          ?        ? 10520.9209  74.7070          ?        ?     1025.7        3.6       ?       ? 
1 1 1   16    6   38 o    754.9    3.1    0.0000   0.0000          ?        ?  5698.8057  46.6121          ?        ?      754.9        3.1       ?       ? 
1 1 1   16    6   39 o    630.9    2.7    0.0000   0.0000          ?        ?  3979.9053  33.8416          ?        ?      630.9        2.7       ?       ? 
1 1 1   16    6   40 o    758.3    3.1    0.0000   0.0000          ?        ?  5749.8872  46.6121          ?        ?      758.3        3.1       ?       ? 
1 1 1   16    6   41 o    411.3    2.9    0.0000   0.0000          ?        ?  1691.4437  23.6253          ?        ?      411.3        2.9       ?       ? 
1 1 1   16    6   42 o     63.1   15.3    0.0000   0.0000          ?        ?    41.5039  19.1556          ?        ?       63.1       15.3       ?       ? 
1 1 1   16    6   43 o    699.8    3.0    0.0000   0.0000          ?        ?  4897.4609  41.5039          ?        ?      699.8        3.0       ?       ? 
1 1 1   16    6   44 o    289.1    4.2    0.0000   0.0000          ?        ?   835.8248  24.2638          ?        ?      289.1        4.2       ?       ? 
1 1 1   16    6   45 o    754.3    3.0    0.0000   0.0000          ?        ?  5690.5049  44.6965          ?        ?      754.3        3.0       ?       ? 
1 1 1   16    6   46 o    625.7    2.8    0.0000   0.0000          ?        ?  3914.7759  35.1187          ?        ?      625.7        2.8       ?       ? 
1 1 1   16    6   47 o    274.5    3.6    0.0000   0.0000          ?        ?   753.4555  19.7942          ?        ?      274.5        3.6       ?       ? 
1 1 1   16    6   48 o    153.3    5.8    0.0000   0.0000          ?        ?   234.9760  17.8786          ?        ?      153.3        5.8       ?       ? 
1 1 1   16    6   49 o    293.9    3.3    0.0000   0.0000          ?        ?   863.9198  19.1556          ?        ?      293.9        3.3       ?       ? 
1 1 1   16    6   50 o    475.7    2.9    0.0000   0.0000          ?        ?  2262.9207  27.4564          ?        ?      475.7        2.9       ?       ? 
1 1 1   16    6   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    6   52 o    748.9    3.1    0.0000   0.0000          ?        ?  5610.0508  45.9736          ?        ?      748.9        3.1       ?       ? 
1 1 1   16    6   53 o    181.3    5.3    0.0000   0.0000          ?        ?   328.8386  19.1556          ?        ?      181.3        5.3       ?       ? 
1 1 1   16    6   54 o     51.1   15.9    0.0000   0.0000          ?        ?    26.1794  17.8786          ?        ?       51.1       15.9       ?       ? 
1 1 1   16    6   55 o    112.9    8.5    0.0000   0.0000          ?        ?   127.7043  19.1556          ?        ?      112.9        8.5       ?       ? 
1 1 1   16    6   56 o     29.8   13.7    0.0000   0.0000          ?        ?   -13.4090  18.5171          ?        ?       29.8       13.7       ?       ? 
1 1 1   16    6   57 o    232.5    4.1    0.0000   0.0000          ?        ?   540.8278  19.1556          ?        ?      232.5        4.1       ?       ? 
1 1 1   16    6   58 o    196.6    5.2    0.0000   0.0000          ?        ?   386.9441  20.4327          ?        ?      196.6        5.2       ?       ? 
1 1 1   16    6   59 o    453.4    3.0    0.0000   0.0000          ?        ?  2056.6782  26.8179          ?        ?      453.4        3.0       ?       ? 
1 1 1   16    6   60 o    349.7    3.1    0.0000   0.0000          ?        ?  1223.4075  21.7097          ?        ?      349.7        3.1       ?       ? 
1 1 1   16    6   61 o    291.0    3.4    0.0000   0.0000          ?        ?   847.3182  19.7942          ?        ?      291.0        3.4       ?       ? 
1 1 1   16    6   62 o    578.0    2.8    0.0000   0.0000          ?        ?  3342.6606  32.5646          ?        ?      578.0        2.8       ?       ? 
1 1 1   16    6   63 o     20.8   10.5    0.0000   0.0000          ?        ?   -70.8759  21.0712          ?        ?       20.8       10.5       ?       ? 
1 1 1   16    6   64 o    194.6    5.4    0.0000   0.0000          ?        ?   379.2819  21.0712          ?        ?      194.6        5.4       ?       ? 
1 1 1   16    6   65 o     44.8   16.4    0.0000   0.0000          ?        ?    16.6016  19.1556          ?        ?       44.8       16.4       ?       ? 
1 1 1   16    6   66 o    182.4    5.6    0.0000   0.0000          ?        ?   333.3083  20.4327          ?        ?      182.4        5.6       ?       ? 
1 1 1   16    6   67 o    334.0    3.3    0.0000   0.0000          ?        ?  1116.1359  22.3483          ?        ?      334.0        3.3       ?       ? 
1 1 1   16    6   68 o    112.4    9.1    0.0000   0.0000          ?        ?   127.0658  20.4327          ?        ?      112.4        9.1       ?       ? 
1 1 1   16    6   69 o    284.6    4.0    0.0000   0.0000          ?        ?   810.9225  22.9868          ?        ?      284.6        4.0       ?       ? 
1 1 1   16    6   70 o     51.9   17.3    0.0000   0.0000          ?        ?    26.1794  21.0712          ?        ?       51.9       17.3       ?       ? 
1 1 1   16    6   71 o    309.4    3.7    0.0000   0.0000          ?        ?   958.4210  22.9868          ?        ?      309.4        3.7       ?       ? 
1 1 1   16    6   72 o    201.4    5.1    0.0000   0.0000          ?        ?   406.7383  20.4327          ?        ?      201.4        5.1       ?       ? 
1 1 1   16    6   73 o     24.8   12.2    0.0000   0.0000          ?        ?   -46.6121  21.7097          ?        ?       24.8       12.2       ?       ? 
1 1 1   16    6   74 o    132.0    8.2    0.0000   0.0000          ?        ?   175.5934  21.7097          ?        ?      132.0        8.2       ?       ? 
1 1 1   16    6   75 o    176.2    6.3    0.0000   0.0000          ?        ?   312.2371  22.3483          ?        ?      176.2        6.3       ?       ? 
1 1 1   16    6   76 o    140.9    7.9    0.0000   0.0000          ?        ?   200.4958  22.3483          ?        ?      140.9        7.9       ?       ? 
1 1 1   16    6   77 o     37.5   15.8    0.0000   0.0000          ?        ?     2.5541  20.4327          ?        ?       37.5       15.8       ?       ? 
1 1 1   16    6   78 f    127.1    8.0    0.0000   0.0000          ?        ?   163.4615  20.4327          ?        ?      127.1        8.0       ?       ? 
1 1 1   16    6   79 o     41.5   16.7    0.0000   0.0000          ?        ?    10.2163  21.0712          ?        ?       41.5       16.7       ?       ? 
1 1 1   16    7    0 o   1144.9    5.7 13109.4883 131.5355 13109.4883 131.5355 13109.4883 131.5355     1144.9      5.7     1144.9        5.7     0.0     0.0 
1 1 1   16    7    1 o   1084.1    3.7    0.0000   0.0000          ?        ? 11754.5449  81.0922          ?        ?     1084.1        3.7       ?       ? 
1 1 1   16    7    2 o    903.8    3.2    0.0000   0.0000          ?        ?  8169.2456  58.1055          ?        ?      903.8        3.2       ?       ? 
1 1 1   16    7    3 o    490.0    2.0    0.0000   0.0000          ?        ?  2401.4800  19.7942          ?        ?      490.0        2.0       ?       ? 
1 1 1   16    7    4 o   1426.1    4.7    0.0000   0.0000          ?        ? 20338.8301 134.7281          ?        ?     1426.1        4.7       ?       ? 
1 1 1   16    7    5 o    590.3    2.3    0.0000   0.0000          ?        ?  3485.0510  27.4564          ?        ?      590.3        2.3       ?       ? 
1 1 1   16    7    6 o    216.5    1.5    0.0000   0.0000          ?        ?   468.6749   6.3852          ?        ?      216.5        1.5       ?       ? 
1 1 1   16    7    7 o   1169.3    4.0    0.0000   0.0000          ?        ? 13673.3018  92.5856          ?        ?     1169.3        4.0       ?       ? 
1 1 1   16    7    8 o    730.8    2.6    0.0000   0.0000          ?        ?  5341.2334  38.3113          ?        ?      730.8        2.6       ?       ? 
1 1 1   16    7    9 o    443.2    1.9    0.0000   0.0000          ?        ?  1964.7311  16.6016          ?        ?      443.2        1.9       ?       ? 
1 1 1   16    7   10 o    677.6    2.5    0.0000   0.0000          ?        ?  4591.6089  33.8416          ?        ?      677.6        2.5       ?       ? 
1 1 1   16    7   11 o    783.4    2.8    0.0000   0.0000          ?        ?  6136.8311  44.0580          ?        ?      783.4        2.8       ?       ? 
1 1 1   16    7   12 o   1210.5    4.1    0.0000   0.0000          ?        ? 14654.7109  99.6094          ?        ?     1210.5        4.1       ?       ? 
1 1 1   16    7   13 o   1302.7    4.5    0.0000   0.0000          ?        ? 16970.6289 116.2109          ?        ?     1302.7        4.5       ?       ? 
1 1 1   16    7   14 o    944.7    3.3    0.0000   0.0000          ?        ?  8925.8936  62.5751          ?        ?      944.7        3.3       ?       ? 
1 1 1   16    7   15 o   1267.0    4.3    0.0000   0.0000          ?        ? 16054.3496 107.9102          ?        ?     1267.0        4.3       ?       ? 
1 1 1   16    7   16 o   1837.7    6.0    0.0000   0.0000          ?        ? 33777.7930 221.5670          ?        ?     1837.7        6.0       ?       ? 
1 1 1   16    7   17 o    404.6    1.9    0.0000   0.0000          ?        ?  1637.1694  15.3245          ?        ?      404.6        1.9       ?       ? 
1 1 1   16    7   18 o   2715.8    8.7    0.0000   0.0000          ?        ? 73778.6172 470.5904          ?        ?     2715.8        8.7       ?       ? 
1 1 1   16    7   19 o    259.5    2.0    0.0000   0.0000          ?        ?   673.6403  10.2163          ?        ?      259.5        2.0       ?       ? 
1 1 1   16    7   20 o   2023.4    6.7    0.0000   0.0000          ?        ? 40947.7539 272.6487          ?        ?     2023.4        6.7       ?       ? 
1 1 1   16    7   21 o   1769.9    5.9    0.0000   0.0000          ?        ? 31330.3418 209.4351          ?        ?     1769.9        5.9       ?       ? 
1 1 1   16    7   22 o   1725.4    5.8    0.0000   0.0000          ?        ? 29772.3496 200.4958          ?        ?     1725.4        5.8       ?       ? 
1 1 1   16    7   23 o    179.9    2.8    0.0000   0.0000          ?        ?   323.7305  10.2163          ?        ?      179.9        2.8       ?       ? 
1 1 1   16    7   24 o   1755.9    5.9    0.0000   0.0000          ?        ? 30834.8477 205.6040          ?        ?     1755.9        5.9       ?       ? 
1 1 1   16    7   25 o   1274.9    4.4    0.0000   0.0000          ?        ? 16255.4834 113.0183          ?        ?     1274.9        4.4       ?       ? 
1 1 1   16    7   26 o    641.6    2.8    0.0000   0.0000          ?        ?  4116.5488  35.7572          ?        ?      641.6        2.8       ?       ? 
1 1 1   16    7   27 o    226.0    2.8    0.0000   0.0000          ?        ?   510.8173  12.7704          ?        ?      226.0        2.8       ?       ? 
1 1 1   16    7   28 o   1306.9    4.5    0.0000   0.0000          ?        ? 17080.4531 118.7650          ?        ?     1306.9        4.5       ?       ? 
1 1 1   16    7   29 o    752.2    3.1    0.0000   0.0000          ?        ?  5657.9399  46.6121          ?        ?      752.2        3.1       ?       ? 
1 1 1   16    7   30 o    944.8    3.5    0.0000   0.0000          ?        ?  8926.5322  67.0448          ?        ?      944.8        3.5       ?       ? 
1 1 1   16    7   31 o    392.0    2.9    0.0000   0.0000          ?        ?  1536.9215  22.3483          ?        ?      392.0        2.9       ?       ? 
1 1 1   16    7   32 o   1569.8    5.4    0.0000   0.0000          ?        ? 24645.0195 169.2082          ?        ?     1569.8        5.4       ?       ? 
1 1 1   16    7   33 o     18.3    9.2    0.0000   0.0000          ?        ?   -43.4195  14.6860          ?        ?       18.3        9.2       ?       ? 
1 1 1   16    7   34 o   1390.8    4.7    0.0000   0.0000          ?        ? 19345.9277 130.8969          ?        ?     1390.8        4.7       ?       ? 
1 1 1   16    7   35 o    135.6    6.4    0.0000   0.0000          ?        ?   183.8942  17.2401          ?        ?      135.6        6.4       ?       ? 
1 1 1   16    7   36 o    526.2    2.5    0.0000   0.0000          ?        ?  2768.6299  26.8179          ?        ?      526.2        2.5       ?       ? 
1 1 1   16    7   37 o    509.0    2.6    0.0000   0.0000          ?        ?  2591.1206  26.1794          ?        ?      509.0        2.6       ?       ? 
1 1 1   16    7   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    7   39 o    859.0    3.3    0.0000   0.0000          ?        ?  7380.0332  56.1899          ?        ?      859.0        3.3       ?       ? 
1 1 1   16    7   40 o    775.6    3.2    0.0000   0.0000          ?        ?  6015.5122  49.1662          ?        ?      775.6        3.2       ?       ? 
1 1 1   16    7   41 o    871.0    3.2    0.0000   0.0000          ?        ?  7587.5527  55.5514          ?        ?      871.0        3.2       ?       ? 
1 1 1   16    7   42 o     86.0   11.5    0.0000   0.0000          ?        ?    74.0685  19.7942          ?        ?       86.0       11.5       ?       ? 
1 1 1   16    7   43 o    430.2    2.7    0.0000   0.0000          ?        ?  1851.0741  23.6253          ?        ?      430.2        2.7       ?       ? 
1 1 1   16    7   44 o    328.2    3.1    0.0000   0.0000          ?        ?  1077.1859  20.4327          ?        ?      328.2        3.1       ?       ? 
1 1 1   16    7   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    7   46 o    247.9    3.7    0.0000   0.0000          ?        ?   614.8964  18.5171          ?        ?      247.9        3.7       ?       ? 
1 1 1   16    7   47 o    735.9    2.9    0.0000   0.0000          ?        ?  5416.5791  43.4195          ?        ?      735.9        2.9       ?       ? 
1 1 1   16    7   48 o    353.0    2.9    0.0000   0.0000          ?        ?  1246.3942  20.4327          ?        ?      353.0        2.9       ?       ? 
1 1 1   16    7   49 o    231.7    4.4    0.0000   0.0000          ?        ?   536.9967  20.4327          ?        ?      231.7        4.4       ?       ? 
1 1 1   16    7   50 o    308.7    3.1    0.0000   0.0000          ?        ?   953.3128  19.1556          ?        ?      308.7        3.1       ?       ? 
1 1 1   16    7   51 o    227.2    4.1    0.0000   0.0000          ?        ?   516.5640  18.5171          ?        ?      227.2        4.1       ?       ? 
1 1 1   16    7   52 o    433.5    2.7    0.0000   0.0000          ?        ?  1879.8076  22.9868          ?        ?      433.5        2.7       ?       ? 
1 1 1   16    7   53 o    864.4    3.3    0.0000   0.0000          ?        ?  7473.2573  56.1899          ?        ?      864.4        3.3       ?       ? 
1 1 1   16    7   54 o    479.6    2.6    0.0000   0.0000          ?        ?  2300.5933  24.9023          ?        ?      479.6        2.6       ?       ? 
1 1 1   16    7   55 o    167.3    5.5    0.0000   0.0000          ?        ?   280.3110  18.5171          ?        ?      167.3        5.5       ?       ? 
1 1 1   16    7   56 o    204.4    4.7    0.0000   0.0000          ?        ?   418.2317  19.1556          ?        ?      204.4        4.7       ?       ? 
1 1 1   16    7   57 o    195.3    4.7    0.0000   0.0000          ?        ?   381.8359  18.5171          ?        ?      195.3        4.7       ?       ? 
1 1 1   16    7   58 o    279.5    3.4    0.0000   0.0000          ?        ?   781.5505  19.1556          ?        ?      279.5        3.4       ?       ? 
1 1 1   16    7   59 o    451.3    2.8    0.0000   0.0000          ?        ?  2036.8840  24.9023          ?        ?      451.3        2.8       ?       ? 
1 1 1   16    7   60 o    361.4    3.1    0.0000   0.0000          ?        ?  1306.4153  22.3483          ?        ?      361.4        3.1       ?       ? 
1 1 1   16    7   61 o    157.1    6.1    0.0000   0.0000          ?        ?   247.1079  19.1556          ?        ?      157.1        6.1       ?       ? 
1 1 1   16    7   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    7   63 o    641.1    2.8    0.0000   0.0000          ?        ?  4111.4409  35.7572          ?        ?      641.1        2.8       ?       ? 
1 1 1   16    7   64 o    227.9    4.2    0.0000   0.0000          ?        ?   519.7566  19.1556          ?        ?      227.9        4.2       ?       ? 
1 1 1   16    7   65 o    450.5    2.8    0.0000   0.0000          ?        ?  2030.4988  25.5409          ?        ?      450.5        2.8       ?       ? 
1 1 1   16    7   66 o    285.8    3.6    0.0000   0.0000          ?        ?   817.3077  20.4327          ?        ?      285.8        3.6       ?       ? 
1 1 1   16    7   67 o    165.1    6.4    0.0000   0.0000          ?        ?   273.2873  21.0712          ?        ?      165.1        6.4       ?       ? 
1 1 1   16    7   68 o    329.5    3.5    0.0000   0.0000          ?        ?  1086.7638  22.9868          ?        ?      329.5        3.5       ?       ? 
1 1 1   16    7   69 o    129.7    8.1    0.0000   0.0000          ?        ?   169.2082  21.0712          ?        ?      129.7        8.1       ?       ? 
1 1 1   16    7   70 o    288.9    4.0    0.0000   0.0000          ?        ?   835.8248  22.9868          ?        ?      288.9        4.0       ?       ? 
1 1 1   16    7   71 o    108.5    9.7    0.0000   0.0000          ?        ?   118.7650  21.0712          ?        ?      108.5        9.7       ?       ? 
1 1 1   16    7   72 o     98.2   11.1    0.0000   0.0000          ?        ?    97.6938  21.7097          ?        ?       98.2       11.1       ?       ? 
1 1 1   16    7   73 o     91.1   11.9    0.0000   0.0000          ?        ?    84.2849  21.7097          ?        ?       91.1       11.9       ?       ? 
1 1 1   16    7   74 o     71.0   14.9    0.0000   0.0000          ?        ?    53.6358  20.4327          ?        ?       71.0       14.9       ?       ? 
1 1 1   16    7   75 o     31.8   14.5    0.0000   0.0000          ?        ?   -12.1319  20.4327          ?        ?       31.8       14.5       ?       ? 
1 1 1   16    7   76 o    171.4    6.3    0.0000   0.0000          ?        ?   295.6355  21.7097          ?        ?      171.4        6.3       ?       ? 
1 1 1   16    7   77 o    175.0    6.2    0.0000   0.0000          ?        ?   308.4059  21.7097          ?        ?      175.0        6.2       ?       ? 
1 1 1   16    7   78 o     23.7   11.7    0.0000   0.0000          ?        ?   -48.5276  21.0712          ?        ?       23.7       11.7       ?       ? 
1 1 1   16    8    0 o    935.9    5.1 8761.1553  95.7782  8761.1553  95.7782  8761.1553  95.7782      935.9      5.1      935.9        5.1     0.0     0.0 
1 1 1   16    8    1 o    720.9    2.7    0.0000   0.0000          ?        ?  5196.9277  39.5883          ?        ?      720.9        2.7       ?       ? 
1 1 1   16    8    2 o    483.7    2.0    0.0000   0.0000          ?        ?  2340.1816  19.1556          ?        ?      483.7        2.0       ?       ? 
1 1 1   16    8    3 o    760.0    2.9    0.0000   0.0000          ?        ?  5776.7051  44.0580          ?        ?      760.0        2.9       ?       ? 
1 1 1   16    8    4 o    630.3    2.5    0.0000   0.0000          ?        ?  3972.8816  31.2876          ?        ?      630.3        2.5       ?       ? 
1 1 1   16    8    5 o    850.2    3.0    0.0000   0.0000          ?        ?  7229.3413  51.7203          ?        ?      850.2        3.0       ?       ? 
1 1 1   16    8    6 o   1681.0    5.5    0.0000   0.0000          ?        ? 28262.2461 185.1713          ?        ?     1681.0        5.5       ?       ? 
1 1 1   16    8    7 o   1234.4    4.2    0.0000   0.0000          ?        ? 15239.5957 104.7175          ?        ?     1234.4        4.2       ?       ? 
1 1 1   16    8    8 o    901.4    3.2    0.0000   0.0000          ?        ?  8125.8262  56.8284          ?        ?      901.4        3.2       ?       ? 
1 1 1   16    8    9 o   1125.1    3.8    0.0000   0.0000          ?        ? 12659.9678  86.2004          ?        ?     1125.1        3.8       ?       ? 
1 1 1   16    8   10 o    504.9    2.0    0.0000   0.0000          ?        ?  2548.9785  20.4327          ?        ?      504.9        2.0       ?       ? 
1 1 1   16    8   11 o    638.0    2.5    0.0000   0.0000          ?        ?  4069.9370  31.2876          ?        ?      638.0        2.5       ?       ? 
1 1 1   16    8   12 o    993.0    3.4    0.0000   0.0000          ?        ?  9860.6895  68.3218          ?        ?      993.0        3.4       ?       ? 
1 1 1   16    8   13 o    553.2    2.2    0.0000   0.0000          ?        ?  3060.4341  24.2638          ?        ?      553.2        2.2       ?       ? 
1 1 1   16    8   14 o    945.1    3.3    0.0000   0.0000          ?        ?  8932.9180  62.5751          ?        ?      945.1        3.3       ?       ? 
1 1 1   16    8   15 o   1021.3    3.6    0.0000   0.0000          ?        ? 10430.8887  72.7915          ?        ?     1021.3        3.6       ?       ? 
1 1 1   16    8   16 o   1396.9    4.7    0.0000   0.0000          ?        ? 19515.7734 130.2584          ?        ?     1396.9        4.7       ?       ? 
1 1 1   16    8   17 o    554.5    2.2    0.0000   0.0000          ?        ?  3075.1201  24.9023          ?        ?      554.5        2.2       ?       ? 
1 1 1   16    8   18 o   1633.6    5.4    0.0000   0.0000          ?        ? 26690.2031 176.8705          ?        ?     1633.6        5.4       ?       ? 
1 1 1   16    8   19 o   1372.8    4.7    0.0000   0.0000          ?        ? 18846.6055 128.9814          ?        ?     1372.8        4.7       ?       ? 
1 1 1   16    8   20 o    381.8    2.3    0.0000   0.0000          ?        ?  1457.7449  17.8786          ?        ?      381.8        2.3       ?       ? 
1 1 1   16    8   21 o    470.8    2.2    0.0000   0.0000          ?        ?  2216.9473  21.0712          ?        ?      470.8        2.2       ?       ? 
1 1 1   16    8   22 o   1120.5    3.9    0.0000   0.0000          ?        ? 12555.8896  88.1160          ?        ?     1120.5        3.9       ?       ? 
1 1 1   16    8   23 o   1215.8    4.3    0.0000   0.0000          ?        ? 14783.6914 104.7175          ?        ?     1215.8        4.3       ?       ? 
1 1 1   16    8   24 o    539.2    2.4    0.0000   0.0000          ?        ?  2907.8274  25.5409          ?        ?      539.2        2.4       ?       ? 
1 1 1   16    8   25 o   1862.1    6.2    0.0000   0.0000          ?        ? 34678.1094 231.7833          ?        ?     1862.1        6.2       ?       ? 
1 1 1   16    8   26 o    996.1    3.6    0.0000   0.0000          ?        ?  9921.9873  72.1529          ?        ?      996.1        3.6       ?       ? 
1 1 1   16    8   27 o    562.7    2.4    0.0000   0.0000          ?        ?  3166.4287  27.4564          ?        ?      562.7        2.4       ?       ? 
1 1 1   16    8   28 o    978.5    3.7    0.0000   0.0000          ?        ?  9575.2705  72.7915          ?        ?      978.5        3.7       ?       ? 
1 1 1   16    8   29 o    428.6    2.5    0.0000   0.0000          ?        ?  1837.0269  21.7097          ?        ?      428.6        2.5       ?       ? 
1 1 1   16    8   30 o   1301.3    4.8    0.0000   0.0000          ?        ? 16936.1465 125.1502          ?        ?     1301.3        4.8       ?       ? 
1 1 1   16    8   31 o    747.8    3.0    0.0000   0.0000          ?        ?  5592.8110  45.3350          ?        ?      747.8        3.0       ?       ? 
1 1 1   16    8   32 o    270.0    3.1    0.0000   0.0000          ?        ?   729.1917  16.6016          ?        ?      270.0        3.1       ?       ? 
1 1 1   16    8   33 f    931.6    3.5    0.0000   0.0000          ?        ?  8678.7852  65.1292          ?        ?      931.6        3.5       ?       ? 
1 1 1   16    8   34 o    553.4    2.7    0.0000   0.0000          ?        ?  3062.9883  30.0105          ?        ?      553.4        2.7       ?       ? 
1 1 1   16    8   35 o    619.6    2.7    0.0000   0.0000          ?        ?  3838.7920  33.8416          ?        ?      619.6        2.7       ?       ? 
1 1 1   16    8   36 o    830.2    3.3    0.0000   0.0000          ?        ?  6893.4795  54.9129          ?        ?      830.2        3.3       ?       ? 
1 1 1   16    8   37 o   1046.8    3.7    0.0000   0.0000          ?        ? 10958.9473  77.2611          ?        ?     1046.8        3.7       ?       ? 
1 1 1   16    8   38 o    631.9    3.0    0.0000   0.0000          ?        ?  3992.6755  37.6728          ?        ?      631.9        3.0       ?       ? 
1 1 1   16    8   39 o    642.0    2.8    0.0000   0.0000          ?        ?  4122.2954  35.7572          ?        ?      642.0        2.8       ?       ? 
1 1 1   16    8   40 o    624.6    3.0    0.0000   0.0000          ?        ?  3901.3672  37.6728          ?        ?      624.6        3.0       ?       ? 
1 1 1   16    8   41 o    307.1    3.3    0.0000   0.0000          ?        ?   943.0964  20.4327          ?        ?      307.1        3.3       ?       ? 
1 1 1   16    8   42 o    963.2    3.6    0.0000   0.0000          ?        ?  9277.7188  70.2374          ?        ?      963.2        3.6       ?       ? 
1 1 1   16    8   43 o    463.6    2.6    0.0000   0.0000          ?        ?  2149.2639  24.2638          ?        ?      463.6        2.6       ?       ? 
1 1 1   16    8   44 o    707.4    2.9    0.0000   0.0000          ?        ?  5004.7324  41.5039          ?        ?      707.4        2.9       ?       ? 
1 1 1   16    8   45 o    445.6    2.7    0.0000   0.0000          ?        ?  1985.8022  23.6253          ?        ?      445.6        2.7       ?       ? 
1 1 1   16    8   46 o    241.2    3.7    0.0000   0.0000          ?        ?   581.6932  17.8786          ?        ?      241.2        3.7       ?       ? 
1 1 1   16    8   47 o     32.9   14.2    0.0000   0.0000          ?        ?    -2.5541  17.2401          ?        ?       32.9       14.2       ?       ? 
1 1 1   16    8   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    8   49 o    140.6    6.1    0.0000   0.0000          ?        ?   197.9417  17.2401          ?        ?      140.6        6.1       ?       ? 
1 1 1   16    8   50 o    205.9    4.5    0.0000   0.0000          ?        ?   423.9784  18.5171          ?        ?      205.9        4.5       ?       ? 
1 1 1   16    8   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    8   52 o    246.5    3.8    0.0000   0.0000          ?        ?   607.8726  18.5171          ?        ?      246.5        3.8       ?       ? 
1 1 1   16    8   53 o    283.0    3.4    0.0000   0.0000          ?        ?   801.3447  19.1556          ?        ?      283.0        3.4       ?       ? 
1 1 1   16    8   54 o    620.4    2.8    0.0000   0.0000          ?        ?  3850.2854  35.1187          ?        ?      620.4        2.8       ?       ? 
1 1 1   16    8   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    8   56 o    272.3    3.5    0.0000   0.0000          ?        ?   741.9621  19.1556          ?        ?      272.3        3.5       ?       ? 
1 1 1   16    8   57 o    543.7    2.7    0.0000   0.0000          ?        ?  2956.9937  29.3720          ?        ?      543.7        2.7       ?       ? 
1 1 1   16    8   58 o    277.8    3.6    0.0000   0.0000          ?        ?   771.9727  19.7942          ?        ?      277.8        3.6       ?       ? 
1 1 1   16    8   59 o    781.3    3.1    0.0000   0.0000          ?        ?  6106.1821  49.1662          ?        ?      781.3        3.1       ?       ? 
1 1 1   16    8   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    8   61 o     77.6   11.9    0.0000   0.0000          ?        ?    60.6596  18.5171          ?        ?       77.6       11.9       ?       ? 
1 1 1   16    8   62 o     56.1   16.2    0.0000   0.0000          ?        ?    32.5646  19.1556          ?        ?       56.1       16.2       ?       ? 
1 1 1   16    8   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    8   64 o    252.1    4.2    0.0000   0.0000          ?        ?   635.9675  21.0712          ?        ?      252.1        4.2       ?       ? 
1 1 1   16    8   65 o    176.9    5.6    0.0000   0.0000          ?        ?   313.5141  19.7942          ?        ?      176.9        5.6       ?       ? 
1 1 1   16    8   66 o    201.4    5.1    0.0000   0.0000          ?        ?   406.0997  20.4327          ?        ?      201.4        5.1       ?       ? 
1 1 1   16    8   67 o    163.9    6.2    0.0000   0.0000          ?        ?   269.4561  20.4327          ?        ?      163.9        6.2       ?       ? 
1 1 1   16    8   68 o    297.2    3.8    0.0000   0.0000          ?        ?   884.3525  22.3483          ?        ?      297.2        3.8       ?       ? 
1 1 1   16    8   69 o     22.8   11.4    0.0000   0.0000          ?        ?   -63.8522  22.3483          ?        ?       22.8       11.4       ?       ? 
1 1 1   16    8   70 o     83.6   13.0    0.0000   0.0000          ?        ?    70.8759  21.7097          ?        ?       83.6       13.0       ?       ? 
1 1 1   16    8   71 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    8   72 o     49.5   17.5    0.0000   0.0000          ?        ?    22.3483  21.7097          ?        ?       49.5       17.5       ?       ? 
1 1 1   16    8   73 o    111.6    9.4    0.0000   0.0000          ?        ?   125.7888  21.0712          ?        ?      111.6        9.4       ?       ? 
1 1 1   16    8   74 o    195.8    5.9    0.0000   0.0000          ?        ?   385.0285  22.9868          ?        ?      195.8        5.9       ?       ? 
1 1 1   16    8   75 o    149.0    7.1    0.0000   0.0000          ?        ?   223.4826  21.0712          ?        ?      149.0        7.1       ?       ? 
1 1 1   16    8   76 o    265.5    4.1    0.0000   0.0000          ?        ?   706.8434  21.7097          ?        ?      265.5        4.1       ?       ? 
1 1 1   16    8   77 o    163.2    6.3    0.0000   0.0000          ?        ?   268.1791  20.4327          ?        ?      163.2        6.3       ?       ? 
1 1 1   16    8   78 o    143.1    7.1    0.0000   0.0000          ?        ?   206.8810  20.4327          ?        ?      143.1        7.1       ?       ? 
1 1 1   16    9    0 o   1085.4    5.8 11783.9170 126.4273 11783.9170 126.4273 11783.9170 126.4273     1085.4      5.8     1085.4        5.8     0.0     0.0 
1 1 1   16    9    1 o   1124.0    4.2    0.0000   0.0000          ?        ? 12634.4268  95.1397          ?        ?     1124.0        4.2       ?       ? 
1 1 1   16    9    2 o   1036.0    3.8    0.0000   0.0000          ?        ? 10733.5488  79.1767          ?        ?     1036.0        3.8       ?       ? 
1 1 1   16    9    3 o    165.1    1.5    0.0000   0.0000          ?        ?   272.6487   5.1082          ?        ?      165.1        1.5       ?       ? 
1 1 1   16    9    4 o    929.7    3.2    0.0000   0.0000          ?        ?  8643.6670  60.0210          ?        ?      929.7        3.2       ?       ? 
1 1 1   16    9    5 o   1750.9    5.9    0.0000   0.0000          ?        ? 30661.8086 205.6040          ?        ?     1750.9        5.9       ?       ? 
1 1 1   16    9    6 o    188.1    1.5    0.0000   0.0000          ?        ?   353.7410   5.7467          ?        ?      188.1        1.5       ?       ? 
1 1 1   16    9    7 o   1448.7    4.8    0.0000   0.0000          ?        ? 20988.2051 138.5592          ?        ?     1448.7        4.8       ?       ? 
1 1 1   16    9    8 o    557.4    2.2    0.0000   0.0000          ?        ?  3107.0464  24.2638          ?        ?      557.4        2.2       ?       ? 
1 1 1   16    9    9 o   1395.3    4.6    0.0000   0.0000          ?        ? 19469.8008 129.6199          ?        ?     1395.3        4.6       ?       ? 
1 1 1   16    9   10 o    429.9    1.9    0.0000   0.0000          ?        ?  1848.5201  16.6016          ?        ?      429.9        1.9       ?       ? 
1 1 1   16    9   11 o   1357.8    4.6    0.0000   0.0000          ?        ? 18436.6719 124.5117          ?        ?     1357.8        4.6       ?       ? 
1 1 1   16    9   12 o    593.3    2.3    0.0000   0.0000          ?        ?  3520.1697  27.4564          ?        ?      593.3        2.3       ?       ? 
1 1 1   16    9   13 o   1273.4    4.3    0.0000   0.0000          ?        ? 16217.8105 109.8257          ?        ?     1273.4        4.3       ?       ? 
1 1 1   16    9   14 o   1197.4    4.1    0.0000   0.0000          ?        ? 14338.6426  97.6938          ?        ?     1197.4        4.1       ?       ? 
1 1 1   16    9   15 o    687.9    2.6    0.0000   0.0000          ?        ?  4732.7222  35.7572          ?        ?      687.9        2.6       ?       ? 
1 1 1   16    9   16 o    204.7    2.3    0.0000   0.0000          ?        ?   418.8702   9.5778          ?        ?      204.7        2.3       ?       ? 
1 1 1   16    9   17 o    771.5    2.9    0.0000   0.0000          ?        ?  5952.9370  44.0580          ?        ?      771.5        2.9       ?       ? 
1 1 1   16    9   18 o    507.5    2.2    0.0000   0.0000          ?        ?  2575.7961  22.3483          ?        ?      507.5        2.2       ?       ? 
1 1 1   16    9   19 o   1096.6    3.9    0.0000   0.0000          ?        ? 12026.5547  84.9234          ?        ?     1096.6        3.9       ?       ? 
1 1 1   16    9   20 o    703.4    2.8    0.0000   0.0000          ?        ?  4947.2656  39.5883          ?        ?      703.4        2.8       ?       ? 
1 1 1   16    9   21 o   2310.3    7.4    0.0000   0.0000          ?        ? 53381.6875 343.5246          ?        ?     2310.3        7.4       ?       ? 
1 1 1   16    9   22 f    941.6    3.6    0.0000   0.0000          ?        ?  8865.8730  67.6833          ?        ?      941.6        3.6       ?       ? 
1 1 1   16    9   23 o    207.9    3.2    0.0000   0.0000          ?        ?   432.2791  13.4090          ?        ?      207.9        3.2       ?       ? 
1 1 1   16    9   24 o   1682.4    5.8    0.0000   0.0000          ?        ? 28306.9414 196.0261          ?        ?     1682.4        5.8       ?       ? 
1 1 1   16    9   25 f    955.1    3.6    0.0000   0.0000          ?        ?  9121.9199  69.5989          ?        ?      955.1        3.6       ?       ? 
1 1 1   16    9   26 o   1557.5    5.4    0.0000   0.0000          ?        ? 24258.7129 166.6541          ?        ?     1557.5        5.4       ?       ? 
1 1 1   16    9   27 o   1223.4    4.4    0.0000   0.0000          ?        ? 14967.5859 108.5487          ?        ?     1223.4        4.4       ?       ? 
1 1 1   16    9   28 o   1549.8    5.4    0.0000   0.0000          ?        ? 24021.8223 166.0156          ?        ?     1549.8        5.4       ?       ? 
1 1 1   16    9   29 o    664.4    2.8    0.0000   0.0000          ?        ?  4414.1001  37.0343          ?        ?      664.4        2.8       ?       ? 
1 1 1   16    9   30 o   1271.2    4.4    0.0000   0.0000          ?        ? 16160.3428 113.0183          ?        ?     1271.2        4.4       ?       ? 
1 1 1   16    9   31 o   1622.0    5.5    0.0000   0.0000          ?        ? 26313.4766 177.5090          ?        ?     1622.0        5.5       ?       ? 
1 1 1   16    9   32 o     64.6   15.9    0.0000   0.0000          ?        ?    43.4195  20.4327          ?        ?       64.6       15.9       ?       ? 
1 1 1   16    9   33 o    703.9    2.9    0.0000   0.0000          ?        ?  4954.9277  41.5039          ?        ?      703.9        2.9       ?       ? 
1 1 1   16    9   34 o   1154.5    4.2    0.0000   0.0000          ?        ? 13329.7783  96.4168          ?        ?     1154.5        4.2       ?       ? 
1 1 1   16    9   35 o   1442.0    5.1    0.0000   0.0000          ?        ? 20795.3730 146.2215          ?        ?     1442.0        5.1       ?       ? 
1 1 1   16    9   36 o     62.1   15.0    0.0000   0.0000          ?        ?    40.2269  18.5171          ?        ?       62.1       15.0       ?       ? 
1 1 1   16    9   37 o    563.3    2.8    0.0000   0.0000          ?        ?  3172.8140  31.9261          ?        ?      563.3        2.8       ?       ? 
1 1 1   16    9   38 f   1295.2    4.4    0.0000   0.0000          ?        ? 16776.5156 114.2954          ?        ?     1295.2        4.4       ?       ? 
1 1 1   16    9   39 o   1125.3    3.9    0.0000   0.0000          ?        ? 12663.1602  88.1160          ?        ?     1125.3        3.9       ?       ? 
1 1 1   16    9   40 o    843.2    3.2    0.0000   0.0000          ?        ?  7110.5767  54.2743          ?        ?      843.2        3.2       ?       ? 
1 1 1   16    9   41 o   1555.5    5.4    0.0000   0.0000          ?        ? 24201.2461 169.2082          ?        ?     1555.5        5.4       ?       ? 
1 1 1   16    9   42 o    186.9    5.0    0.0000   0.0000          ?        ?   349.2713  18.5171          ?        ?      186.9        5.0       ?       ? 
1 1 1   16    9   43 o    655.0    2.9    0.0000   0.0000          ?        ?  4290.8652  37.6728          ?        ?      655.0        2.9       ?       ? 
1 1 1   16    9   44 o    318.8    3.1    0.0000   0.0000          ?        ?  1016.5264  19.7942          ?        ?      318.8        3.1       ?       ? 
1 1 1   16    9   45 o    429.7    2.9    0.0000   0.0000          ?        ?  1846.6046  24.9023          ?        ?      429.7        2.9       ?       ? 
1 1 1   16    9   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    9   47 o    314.3    3.1    0.0000   0.0000          ?        ?   987.7929  19.7942          ?        ?      314.3        3.1       ?       ? 
1 1 1   16    9   48 o    779.3    3.2    0.0000   0.0000          ?        ?  6074.8950  49.8047          ?        ?      779.3        3.2       ?       ? 
1 1 1   16    9   49 o    103.2    9.3    0.0000   0.0000          ?        ?   106.6331  19.1556          ?        ?      103.2        9.3       ?       ? 
1 1 1   16    9   50 o    804.5    3.1    0.0000   0.0000          ?        ?  6473.9707  50.4432          ?        ?      804.5        3.1       ?       ? 
1 1 1   16    9   51 o    453.9    2.7    0.0000   0.0000          ?        ?  2060.5093  24.2638          ?        ?      453.9        2.7       ?       ? 
1 1 1   16    9   52 o    422.6    2.7    0.0000   0.0000          ?        ?  1785.9451  22.9868          ?        ?      422.6        2.7       ?       ? 
1 1 1   16    9   53 o    477.4    2.7    0.0000   0.0000          ?        ?  2279.5222  26.1794          ?        ?      477.4        2.7       ?       ? 
1 1 1   16    9   54 o    320.8    3.2    0.0000   0.0000          ?        ?  1029.2969  20.4327          ?        ?      320.8        3.2       ?       ? 
1 1 1   16    9   55 o    250.7    3.9    0.0000   0.0000          ?        ?   628.9438  19.7942          ?        ?      250.7        3.9       ?       ? 
1 1 1   16    9   56 o    251.2    3.8    0.0000   0.0000          ?        ?   631.4979  19.1556          ?        ?      251.2        3.8       ?       ? 
1 1 1   16    9   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    9   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    9   59 o    174.2    5.7    0.0000   0.0000          ?        ?   303.9363  19.7942          ?        ?      174.2        5.7       ?       ? 
1 1 1   16    9   60 o    488.5    2.7    0.0000   0.0000          ?        ?  2386.7937  26.8179          ?        ?      488.5        2.7       ?       ? 
1 1 1   16    9   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    9   62 o    392.9    3.0    0.0000   0.0000          ?        ?  1544.5837  23.6253          ?        ?      392.9        3.0       ?       ? 
1 1 1   16    9   63 o    122.8    8.1    0.0000   0.0000          ?        ?   151.3296  19.7942          ?        ?      122.8        8.1       ?       ? 
1 1 1   16    9   64 o     94.9   10.4    0.0000   0.0000          ?        ?    90.6701  19.7942          ?        ?       94.9       10.4       ?       ? 
1 1 1   16    9   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16    9   66 o    179.4    5.7    0.0000   0.0000          ?        ?   322.4534  20.4327          ?        ?      179.4        5.7       ?       ? 
1 1 1   16    9   67 o    190.6    5.2    0.0000   0.0000          ?        ?   363.9573  19.7942          ?        ?      190.6        5.2       ?       ? 
1 1 1   16    9   68 o    170.2    6.2    0.0000   0.0000          ?        ?   290.5273  21.0712          ?        ?      170.2        6.2       ?       ? 
1 1 1   16    9   69 o    123.4    8.3    0.0000   0.0000          ?        ?   153.2452  20.4327          ?        ?      123.4        8.3       ?       ? 
1 1 1   16    9   70 o    195.9    5.5    0.0000   0.0000          ?        ?   385.0285  21.7097          ?        ?      195.9        5.5       ?       ? 
1 1 1   16    9   71 o    274.2    4.0    0.0000   0.0000          ?        ?   752.8170  21.7097          ?        ?      274.2        4.0       ?       ? 
1 1 1   16    9   72 o    326.5    3.5    0.0000   0.0000          ?        ?  1067.6082  22.9868          ?        ?      326.5        3.5       ?       ? 
1 1 1   16    9   73 f    344.9    3.6    0.0000   0.0000          ?        ?  1191.4814  24.9023          ?        ?      344.9        3.6       ?       ? 
1 1 1   16    9   74 o    124.7    8.7    0.0000   0.0000          ?        ?   157.0763  21.7097          ?        ?      124.7        8.7       ?       ? 
1 1 1   16    9   75 o     32.4   14.5    0.0000   0.0000          ?        ?    -7.0237  19.1556          ?        ?       32.4       14.5       ?       ? 
1 1 1   16    9   76 o    177.0    6.3    0.0000   0.0000          ?        ?   315.4297  22.3483          ?        ?      177.0        6.3       ?       ? 
1 1 1   16    9   77 o    213.4    5.2    0.0000   0.0000          ?        ?   457.8200  22.3483          ?        ?      213.4        5.2       ?       ? 
1 1 1   16    9   78 o     36.6   15.4    0.0000   0.0000          ?        ?     3.1926  19.1556          ?        ?       36.6       15.4       ?       ? 
1 1 1   16   10    0 o   1519.9    7.8 23107.4590 237.5300 23107.4590 237.5300 23107.4590 237.5300     1519.9      7.8     1519.9        7.8     0.0     0.0 
1 1 1   16   10    1 o    163.8    1.9    0.0000   0.0000          ?        ?   268.1791   6.3852          ?        ?      163.8        1.9       ?       ? 
1 1 1   16   10    2 o    784.7    3.0    0.0000   0.0000          ?        ?  6158.5410  46.6121          ?        ?      784.7        3.0       ?       ? 
1 1 1   16   10    3 o    716.8    2.8    0.0000   0.0000          ?        ?  5138.8218  39.5883          ?        ?      716.8        2.8       ?       ? 
1 1 1   16   10    4 o   1767.8    6.2    0.0000   0.0000          ?        ? 31255.6328 219.0129          ?        ?     1767.8        6.2       ?       ? 
1 1 1   16   10    5 o   1203.2    4.2    0.0000   0.0000          ?        ? 14478.4775 100.2479          ?        ?     1203.2        4.2       ?       ? 
1 1 1   16   10    6 o    884.9    3.1    0.0000   0.0000          ?        ?  7831.4678  54.9129          ?        ?      884.9        3.1       ?       ? 
1 1 1   16   10    7 o    583.9    2.4    0.0000   0.0000          ?        ?  3409.7056  28.0950          ?        ?      583.9        2.4       ?       ? 
1 1 1   16   10    8 o    542.1    2.2    0.0000   0.0000          ?        ?  2939.1150  23.6253          ?        ?      542.1        2.2       ?       ? 
1 1 1   16   10    9 o    735.9    2.8    0.0000   0.0000          ?        ?  5415.3018  40.8654          ?        ?      735.9        2.8       ?       ? 
1 1 1   16   10   10 o    404.7    1.8    0.0000   0.0000          ?        ?  1637.8080  14.6860          ?        ?      404.7        1.8       ?       ? 
1 1 1   16   10   11 o    308.7    1.9    0.0000   0.0000          ?        ?   952.6743  11.4934          ?        ?      308.7        1.9       ?       ? 
1 1 1   16   10   12 o    712.0    2.6    0.0000   0.0000          ?        ?  5069.2231  37.6728          ?        ?      712.0        2.6       ?       ? 
1 1 1   16   10   13 o   1447.7    4.8    0.0000   0.0000          ?        ? 20960.1113 139.1977          ?        ?     1447.7        4.8       ?       ? 
1 1 1   16   10   14 o    858.4    3.0    0.0000   0.0000          ?        ?  7367.9014  52.3588          ?        ?      858.4        3.0       ?       ? 
1 1 1   16   10   15 o   1842.3    6.0    0.0000   0.0000          ?        ? 33946.3633 222.2055          ?        ?     1842.3        6.0       ?       ? 
1 1 1   16   10   16 f    642.7    2.5    0.0000   0.0000          ?        ?  4131.2349  31.9261          ?        ?      642.7        2.5       ?       ? 
1 1 1   16   10   17 o    906.1    3.3    0.0000   0.0000          ?        ?  8210.1113  60.0210          ?        ?      906.1        3.3       ?       ? 
1 1 1   16   10   18 o   1077.8    3.8    0.0000   0.0000          ?        ? 11617.9014  81.7308          ?        ?     1077.8        3.8       ?       ? 
1 1 1   16   10   19 o   1495.7    5.0    0.0000   0.0000          ?        ? 22373.7969 149.4141          ?        ?     1495.7        5.0       ?       ? 
1 1 1   16   10   20 o    363.8    2.0    0.0000   0.0000          ?        ?  1323.6554  14.6860          ?        ?      363.8        2.0       ?       ? 
1 1 1   16   10   21 f    365.7    3.1    0.0000   0.0000          ?        ?  1337.0642  22.9868          ?        ?      365.7        3.1       ?       ? 
1 1 1   16   10   22 o   1177.3    4.2    0.0000   0.0000          ?        ? 13861.6650  98.9709          ?        ?     1177.3        4.2       ?       ? 
1 1 1   16   10   23 o    421.5    2.5    0.0000   0.0000          ?        ?  1777.0056  21.0712          ?        ?      421.5        2.5       ?       ? 
1 1 1   16   10   24 o   1516.3    5.3    0.0000   0.0000          ?        ? 22993.8027 159.6304          ?        ?     1516.3        5.3       ?       ? 
1 1 1   16   10   25 o   1489.9    5.0    0.0000   0.0000          ?        ? 22199.4805 148.1370          ?        ?     1489.9        5.0       ?       ? 
1 1 1   16   10   26 o    819.3    3.4    0.0000   0.0000          ?        ?  6713.4165  54.9129          ?        ?      819.3        3.4       ?       ? 
1 1 1   16   10   27 o    953.9    3.6    0.0000   0.0000          ?        ?  9100.2100  69.5989          ?        ?      953.9        3.6       ?       ? 
1 1 1   16   10   28 o    998.0    3.7    0.0000   0.0000          ?        ?  9960.2988  73.4300          ?        ?      998.0        3.7       ?       ? 
1 1 1   16   10   29 o    868.6    3.2    0.0000   0.0000          ?        ?  7544.1328  56.1899          ?        ?      868.6        3.2       ?       ? 
1 1 1   16   10   30 o   1113.4    4.3    0.0000   0.0000          ?        ? 12396.8975  95.1397          ?        ?     1113.4        4.3       ?       ? 
1 1 1   16   10   31 o    230.3    3.9    0.0000   0.0000          ?        ?   530.6115  17.8786          ?        ?      230.3        3.9       ?       ? 
1 1 1   16   10   32 o    796.8    3.0    0.0000   0.0000          ?        ?  6348.8203  47.8891          ?        ?      796.8        3.0       ?       ? 
1 1 1   16   10   33 o    848.2    3.3    0.0000   0.0000          ?        ?  7194.8618  56.8284          ?        ?      848.2        3.3       ?       ? 
1 1 1   16   10   34 o    864.4    3.3    0.0000   0.0000          ?        ?  7471.9800  56.8284          ?        ?      864.4        3.3       ?       ? 
1 1 1   16   10   35 o   1158.9    4.1    0.0000   0.0000          ?        ? 13431.9414  95.1397          ?        ?     1158.9        4.1       ?       ? 
1 1 1   16   10   36 o   1178.7    4.1    0.0000   0.0000          ?        ? 13893.5918  97.6938          ?        ?     1178.7        4.1       ?       ? 
1 1 1   16   10   37 o    973.8    3.8    0.0000   0.0000          ?        ?  9483.3232  74.0685          ?        ?      973.8        3.8       ?       ? 
1 1 1   16   10   38 o   1176.9    4.2    0.0000   0.0000          ?        ? 13852.7266  97.6938          ?        ?     1176.9        4.2       ?       ? 
1 1 1   16   10   39 o     23.2   11.6    0.0000   0.0000          ?        ?   -61.2981  22.3483          ?        ?       23.2       11.6       ?       ? 
1 1 1   16   10   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   10   41 o     80.7   11.5    0.0000   0.0000          ?        ?    65.1292  18.5171          ?        ?       80.7       11.5       ?       ? 
1 1 1   16   10   42 o    890.0    3.4    0.0000   0.0000          ?        ?  7922.1377  60.6596          ?        ?      890.0        3.4       ?       ? 
1 1 1   16   10   43 o    482.5    2.6    0.0000   0.0000          ?        ?  2328.0498  25.5409          ?        ?      482.5        2.6       ?       ? 
1 1 1   16   10   44 o    528.5    2.7    0.0000   0.0000          ?        ?  2792.8936  28.0950          ?        ?      528.5        2.7       ?       ? 
1 1 1   16   10   45 f    553.7    2.9    0.0000   0.0000          ?        ?  3066.1809  31.9261          ?        ?      553.7        2.9       ?       ? 
1 1 1   16   10   46 o    496.8    2.7    0.0000   0.0000          ?        ?  2468.5247  26.8179          ?        ?      496.8        2.7       ?       ? 
1 1 1   16   10   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   10   48 o    459.7    2.7    0.0000   0.0000          ?        ?  2113.5066  24.9023          ?        ?      459.7        2.7       ?       ? 
1 1 1   16   10   49 o    476.2    2.7    0.0000   0.0000          ?        ?  2268.0288  25.5409          ?        ?      476.2        2.7       ?       ? 
1 1 1   16   10   50 o     29.1   13.5    0.0000   0.0000          ?        ?   -17.8786  19.1556          ?        ?       29.1       13.5       ?       ? 
1 1 1   16   10   51 o     19.5    9.8    0.0000   0.0000          ?        ?   -52.9973  17.2401          ?        ?       19.5        9.8       ?       ? 
1 1 1   16   10   52 o    246.0    4.0    0.0000   0.0000          ?        ?   605.3185  19.7942          ?        ?      246.0        4.0       ?       ? 
1 1 1   16   10   53 o    332.0    3.2    0.0000   0.0000          ?        ?  1102.7268  21.0712          ?        ?      332.0        3.2       ?       ? 
1 1 1   16   10   54 o    365.3    3.0    0.0000   0.0000          ?        ?  1334.5103  21.7097          ?        ?      365.3        3.0       ?       ? 
1 1 1   16   10   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   10   56 o    361.7    2.9    0.0000   0.0000          ?        ?  1308.9694  21.0712          ?        ?      361.7        2.9       ?       ? 
1 1 1   16   10   57 o    167.9    5.5    0.0000   0.0000          ?        ?   282.2266  18.5171          ?        ?      167.9        5.5       ?       ? 
1 1 1   16   10   58 f    107.6    8.6    0.0000   0.0000          ?        ?   116.2109  18.5171          ?        ?      107.6        8.6       ?       ? 
1 1 1   16   10   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   10   60 o    416.1    2.8    0.0000   0.0000          ?        ?  1731.6708  23.6253          ?        ?      416.1        2.8       ?       ? 
1 1 1   16   10   61 o    189.3    4.9    0.0000   0.0000          ?        ?   358.8492  18.5171          ?        ?      189.3        4.9       ?       ? 
1 1 1   16   10   62 o    329.9    3.2    0.0000   0.0000          ?        ?  1088.6793  21.0712          ?        ?      329.9        3.2       ?       ? 
1 1 1   16   10   63 o    201.2    4.9    0.0000   0.0000          ?        ?   405.4612  19.7942          ?        ?      201.2        4.9       ?       ? 
1 1 1   16   10   64 o    522.0    2.8    0.0000   0.0000          ?        ?  2726.4873  28.7335          ?        ?      522.0        2.8       ?       ? 
1 1 1   16   10   65 o    201.5    4.9    0.0000   0.0000          ?        ?   406.7383  19.7942          ?        ?      201.5        4.9       ?       ? 
1 1 1   16   10   66 o    350.2    3.2    0.0000   0.0000          ?        ?  1227.2385  22.3483          ?        ?      350.2        3.2       ?       ? 
1 1 1   16   10   67 o     22.0   11.0    0.0000   0.0000          ?        ?   -56.8284  20.4327          ?        ?       22.0       11.0       ?       ? 
1 1 1   16   10   68 o    243.4    4.6    0.0000   0.0000          ?        ?   593.1866  22.3483          ?        ?      243.4        4.6       ?       ? 
1 1 1   16   10   69 o     25.5   12.5    0.0000   0.0000          ?        ?   -39.5883  21.0712          ?        ?       25.5       12.5       ?       ? 
1 1 1   16   10   70 o    101.2   10.4    0.0000   0.0000          ?        ?   103.4405  21.0712          ?        ?      101.2       10.4       ?       ? 
1 1 1   16   10   71 o     25.5   12.5    0.0000   0.0000          ?        ?   -42.7809  21.7097          ?        ?       25.5       12.5       ?       ? 
1 1 1   16   10   72 o     44.2   16.9    0.0000   0.0000          ?        ?    14.0475  21.0712          ?        ?       44.2       16.9       ?       ? 
1 1 1   16   10   73 o     73.0   15.4    0.0000   0.0000          ?        ?    56.8284  21.7097          ?        ?       73.0       15.4       ?       ? 
1 1 1   16   10   74 o     32.9   14.9    0.0000   0.0000          ?        ?   -10.8549  21.0712          ?        ?       32.9       14.9       ?       ? 
1 1 1   16   10   75 f    160.5    6.6    0.0000   0.0000          ?        ?   259.2398  21.0712          ?        ?      160.5        6.6       ?       ? 
1 1 1   16   10   76 o     95.3   10.7    0.0000   0.0000          ?        ?    92.5856  20.4327          ?        ?       95.3       10.7       ?       ? 
1 1 1   16   10   77 o    170.9    6.5    0.0000   0.0000          ?        ?   294.3585  22.3483          ?        ?      170.9        6.5       ?       ? 
1 1 1   16   11    0 o     87.7    7.4   78.5382  12.7704    78.5382  12.7704    78.5382  12.7704       87.7      7.4       87.7        7.4     0.0     0.0 
1 1 1   16   11    1 o    594.6    2.5    0.0000   0.0000          ?        ?  3535.4944  30.0105          ?        ?      594.6        2.5       ?       ? 
1 1 1   16   11    2 o    823.7    3.1    0.0000   0.0000          ?        ?  6785.5688  51.7203          ?        ?      823.7        3.1       ?       ? 
1 1 1   16   11    3 o   1838.4    6.4    0.0000   0.0000          ?        ? 33804.6133 235.6145          ?        ?     1838.4        6.4       ?       ? 
1 1 1   16   11    4 o    423.4    2.0    0.0000   0.0000          ?        ?  1792.3303  16.6016          ?        ?      423.4        2.0       ?       ? 
1 1 1   16   11    5 o   1451.9    4.8    0.0000   0.0000          ?        ? 21080.7910 139.8362          ?        ?     1451.9        4.8       ?       ? 
1 1 1   16   11    6 o    652.4    2.7    0.0000   0.0000          ?        ?  4256.3848  35.1187          ?        ?      652.4        2.7       ?       ? 
1 1 1   16   11    7 o    428.6    1.9    0.0000   0.0000          ?        ?  1837.0269  16.6016          ?        ?      428.6        1.9       ?       ? 
1 1 1   16   11    8 o    732.9    2.7    0.0000   0.0000          ?        ?  5371.2441  40.2269          ?        ?      732.9        2.7       ?       ? 
1 1 1   16   11    9 o    567.2    2.3    0.0000   0.0000          ?        ?  3216.8718  25.5409          ?        ?      567.2        2.3       ?       ? 
1 1 1   16   11   10 o    352.6    1.8    0.0000   0.0000          ?        ?  1243.2015  12.7704          ?        ?      352.6        1.8       ?       ? 
1 1 1   16   11   11 o   1086.5    3.7    0.0000   0.0000          ?        ? 11804.9883  81.0922          ?        ?     1086.5        3.7       ?       ? 
1 1 1   16   11   12 f    893.1    3.2    0.0000   0.0000          ?        ?  7976.4116  56.8284          ?        ?      893.1        3.2       ?       ? 
1 1 1   16   11   13 o    773.4    2.8    0.0000   0.0000          ?        ?  5982.3091  43.4195          ?        ?      773.4        2.8       ?       ? 
1 1 1   16   11   14 o   1229.1    4.2    0.0000   0.0000          ?        ? 15106.7822 102.1635          ?        ?     1229.1        4.2       ?       ? 
1 1 1   16   11   15 o   1270.8    4.3    0.0000   0.0000          ?        ? 16149.4883 109.1872          ?        ?     1270.8        4.3       ?       ? 
1 1 1   16   11   16 o    341.9    1.9    0.0000   0.0000          ?        ?  1169.1332  12.7704          ?        ?      341.9        1.9       ?       ? 
1 1 1   16   11   17 o   1355.4    4.7    0.0000   0.0000          ?        ? 18373.4590 126.4273          ?        ?     1355.4        4.7       ?       ? 
1 1 1   16   11   18 o    735.8    2.7    0.0000   0.0000          ?        ?  5414.6636  40.2269          ?        ?      735.8        2.7       ?       ? 
1 1 1   16   11   19 o    644.9    2.6    0.0000   0.0000          ?        ?  4158.6914  33.8416          ?        ?      644.9        2.6       ?       ? 
1 1 1   16   11   20 o    831.5    3.2    0.0000   0.0000          ?        ?  6914.5508  52.9973          ?        ?      831.5        3.2       ?       ? 
1 1 1   16   11   21 o   1131.6    4.0    0.0000   0.0000          ?        ? 12805.5508  91.3086          ?        ?     1131.6        4.0       ?       ? 
1 1 1   16   11   22 o   1797.1    6.3    0.0000   0.0000          ?        ? 32299.6172 226.0367          ?        ?     1797.1        6.3       ?       ? 
1 1 1   16   11   23 o   1323.5    4.8    0.0000   0.0000          ?        ? 17517.8418 125.7888          ?        ?     1323.5        4.8       ?       ? 
1 1 1   16   11   24 f    524.2    2.4    0.0000   0.0000          ?        ?  2748.1970  24.9023          ?        ?      524.2        2.4       ?       ? 
1 1 1   16   11   25 o   1379.9    5.0    0.0000   0.0000          ?        ? 19043.9082 137.2822          ?        ?     1379.9        5.0       ?       ? 
1 1 1   16   11   26 o   1407.2    4.9    0.0000   0.0000          ?        ? 19802.4707 138.5592          ?        ?     1407.2        4.9       ?       ? 
1 1 1   16   11   27 o    788.7    3.0    0.0000   0.0000          ?        ?  6221.1162  47.8891          ?        ?      788.7        3.0       ?       ? 
1 1 1   16   11   28 o    108.7    7.3    0.0000   0.0000          ?        ?   118.1265  15.9630          ?        ?      108.7        7.3       ?       ? 
1 1 1   16   11   29 o   1345.4    4.7    0.0000   0.0000          ?        ? 18103.3652 127.7043          ?        ?     1345.4        4.7       ?       ? 
1 1 1   16   11   30 o    540.6    2.5    0.0000   0.0000          ?        ?  2922.5137  27.4564          ?        ?      540.6        2.5       ?       ? 
1 1 1   16   11   31 o    787.3    3.2    0.0000   0.0000          ?        ?  6199.4067  49.8047          ?        ?      787.3        3.2       ?       ? 
1 1 1   16   11   32 o    630.4    3.0    0.0000   0.0000          ?        ?  3974.1587  38.3113          ?        ?      630.4        3.0       ?       ? 
1 1 1   16   11   33 o    802.2    3.4    0.0000   0.0000          ?        ?  6435.0210  54.2743          ?        ?      802.2        3.4       ?       ? 
1 1 1   16   11   34 o    631.9    2.9    0.0000   0.0000          ?        ?  3992.6755  37.0343          ?        ?      631.9        2.9       ?       ? 
1 1 1   16   11   35 o   1306.7    4.7    0.0000   0.0000          ?        ? 17077.2617 121.9576          ?        ?     1306.7        4.7       ?       ? 
1 1 1   16   11   36 o    300.9    3.4    0.0000   0.0000          ?        ?   905.4237  20.4327          ?        ?      300.9        3.4       ?       ? 
1 1 1   16   11   37 o    377.1    3.1    0.0000   0.0000          ?        ?  1421.9877  23.6253          ?        ?      377.1        3.1       ?       ? 
1 1 1   16   11   38 o    594.9    3.0    0.0000   0.0000          ?        ?  3538.6870  35.1187          ?        ?      594.9        3.0       ?       ? 
1 1 1   16   11   39 o    461.7    2.8    0.0000   0.0000          ?        ?  2132.0237  26.1794          ?        ?      461.7        2.8       ?       ? 
1 1 1   16   11   40 f    879.2    3.4    0.0000   0.0000          ?        ?  7729.9429  60.0210          ?        ?      879.2        3.4       ?       ? 
1 1 1   16   11   41 f    621.6    2.8    0.0000   0.0000          ?        ?  3864.3330  34.4802          ?        ?      621.6        2.8       ?       ? 
1 1 1   16   11   42 o    248.2    3.7    0.0000   0.0000          ?        ?   616.1733  18.5171          ?        ?      248.2        3.7       ?       ? 
1 1 1   16   11   43 o    147.7    6.1    0.0000   0.0000          ?        ?   218.3744  17.8786          ?        ?      147.7        6.1       ?       ? 
1 1 1   16   11   44 o    166.4    5.6    0.0000   0.0000          ?        ?   277.1184  18.5171          ?        ?      166.4        5.6       ?       ? 
1 1 1   16   11   45 o    895.8    3.3    0.0000   0.0000          ?        ?  8026.2168  59.3825          ?        ?      895.8        3.3       ?       ? 
1 1 1   16   11   46 o    857.6    3.2    0.0000   0.0000          ?        ?  7356.4077  55.5514          ?        ?      857.6        3.2       ?       ? 
1 1 1   16   11   47 o    645.4    2.9    0.0000   0.0000          ?        ?  4165.7153  37.6728          ?        ?      645.4        2.9       ?       ? 
1 1 1   16   11   48 o    160.0    5.6    0.0000   0.0000          ?        ?   256.0471  17.8786          ?        ?      160.0        5.6       ?       ? 
1 1 1   16   11   49 o     33.4   14.4    0.0000   0.0000          ?        ?    -1.2770  17.2401          ?        ?       33.4       14.4       ?       ? 
1 1 1   16   11   50 o    289.4    3.2    0.0000   0.0000          ?        ?   837.7404  18.5171          ?        ?      289.4        3.2       ?       ? 
1 1 1   16   11   51 o    132.7    6.7    0.0000   0.0000          ?        ?   176.2320  17.8786          ?        ?      132.7        6.7       ?       ? 
1 1 1   16   11   52 o    292.2    3.4    0.0000   0.0000          ?        ?   854.3420  19.7942          ?        ?      292.2        3.4       ?       ? 
1 1 1   16   11   53 f    268.1    3.5    0.0000   0.0000          ?        ?   718.9753  18.5171          ?        ?      268.1        3.5       ?       ? 
1 1 1   16   11   54 o    366.7    2.8    0.0000   0.0000          ?        ?  1345.3650  20.4327          ?        ?      366.7        2.8       ?       ? 
1 1 1   16   11   55 o     76.5   11.7    0.0000   0.0000          ?        ?    58.7440  17.8786          ?        ?       76.5       11.7       ?       ? 
1 1 1   16   11   56 o    125.0    7.2    0.0000   0.0000          ?        ?   156.4378  17.8786          ?        ?      125.0        7.2       ?       ? 
1 1 1   16   11   57 o     99.0    9.4    0.0000   0.0000          ?        ?    98.3323  18.5171          ?        ?       99.0        9.4       ?       ? 
1 1 1   16   11   58 o    154.0    6.0    0.0000   0.0000          ?        ?   237.5300  18.5171          ?        ?      154.0        6.0       ?       ? 
1 1 1   16   11   59 o    479.0    2.6    0.0000   0.0000          ?        ?  2295.4854  24.9023          ?        ?      479.0        2.6       ?       ? 
1 1 1   16   11   60 o     83.1   11.5    0.0000   0.0000          ?        ?    69.5989  19.1556          ?        ?       83.1       11.5       ?       ? 
1 1 1   16   11   61 o     96.6    9.9    0.0000   0.0000          ?        ?    93.8627  19.1556          ?        ?       96.6        9.9       ?       ? 
1 1 1   16   11   62 o    375.6    3.1    0.0000   0.0000          ?        ?  1411.7714  23.6253          ?        ?      375.6        3.1       ?       ? 
1 1 1   16   11   63 f    204.2    5.2    0.0000   0.0000          ?        ?   417.5931  21.0712          ?        ?      204.2        5.2       ?       ? 
1 1 1   16   11   64 o    304.3    3.8    0.0000   0.0000          ?        ?   926.4949  22.9868          ?        ?      304.3        3.8       ?       ? 
1 1 1   16   11   65 o    267.3    3.9    0.0000   0.0000          ?        ?   715.1442  21.0712          ?        ?      267.3        3.9       ?       ? 
1 1 1   16   11   66 o     71.6   13.9    0.0000   0.0000          ?        ?    53.6358  19.1556          ?        ?       71.6       13.9       ?       ? 
1 1 1   16   11   67 o     88.5   11.9    0.0000   0.0000          ?        ?    79.1767  21.0712          ?        ?       88.5       11.9       ?       ? 
1 1 1   16   11   68 o    106.5    9.3    0.0000   0.0000          ?        ?   114.2954  19.7942          ?        ?      106.5        9.3       ?       ? 
1 1 1   16   11   69 o    174.8    6.0    0.0000   0.0000          ?        ?   306.4904  21.0712          ?        ?      174.8        6.0       ?       ? 
1 1 1   16   11   70 o     34.8   15.5    0.0000   0.0000          ?        ?    -7.6623  21.7097          ?        ?       34.8       15.5       ?       ? 
1 1 1   16   11   71 o     25.8   12.6    0.0000   0.0000          ?        ?   -37.6728  21.0712          ?        ?       25.8       12.6       ?       ? 
1 1 1   16   11   72 o    198.8    5.3    0.0000   0.0000          ?        ?   396.5219  21.0712          ?        ?      198.8        5.3       ?       ? 
1 1 1   16   11   73 o    145.3    7.2    0.0000   0.0000          ?        ?   212.6277  21.0712          ?        ?      145.3        7.2       ?       ? 
1 1 1   16   11   74 o     33.2   14.9    0.0000   0.0000          ?        ?    -8.3008  20.4327          ?        ?       33.2       14.9       ?       ? 
1 1 1   16   11   75 o    120.2    8.5    0.0000   0.0000          ?        ?   146.2215  20.4327          ?        ?      120.2        8.5       ?       ? 
1 1 1   16   11   76 o    137.2    7.7    0.0000   0.0000          ?        ?   190.2794  21.0712          ?        ?      137.2        7.7       ?       ? 
1 1 1   16   11   77 o     81.7   12.5    0.0000   0.0000          ?        ?    68.9603  20.4327          ?        ?       81.7       12.5       ?       ? 
1 1 1   16   12    0 o   1718.4    8.9 29537.3711 304.5748 29537.3711 304.5748 29537.3711 304.5748     1718.4      8.9     1718.4        8.9     0.0     0.0 
1 1 1   16   12    1 o   1470.0    5.6    0.0000   0.0000          ?        ? 21612.0410 164.1001          ?        ?     1470.0        5.6       ?       ? 
1 1 1   16   12    2 o    606.0    2.6    0.0000   0.0000          ?        ?  3672.1377  31.9261          ?        ?      606.0        2.6       ?       ? 
1 1 1   16   12    3 o    282.7    2.0    0.0000   0.0000          ?        ?   799.4291  11.4934          ?        ?      282.7        2.0       ?       ? 
1 1 1   16   12    4 o   1329.3    4.7    0.0000   0.0000          ?        ? 17671.0859 124.5117          ?        ?     1329.3        4.7       ?       ? 
1 1 1   16   12    5 o    780.9    2.7    0.0000   0.0000          ?        ?  6097.8813  42.7809          ?        ?      780.9        2.7       ?       ? 
1 1 1   16   12    6 o   1098.4    3.9    0.0000   0.0000          ?        ? 12065.5049  84.9234          ?        ?     1098.4        3.9       ?       ? 
1 1 1   16   12    7 o    827.8    3.0    0.0000   0.0000          ?        ?  6851.9756  49.1662          ?        ?      827.8        3.0       ?       ? 
1 1 1   16   12    8 o    163.4    3.3    0.0000   0.0000          ?        ?   266.9020  10.8549          ?        ?      163.4        3.3       ?       ? 
1 1 1   16   12    9 o    847.0    3.1    0.0000   0.0000          ?        ?  7174.4287  52.3588          ?        ?      847.0        3.1       ?       ? 
1 1 1   16   12   10 o    852.9    3.1    0.0000   0.0000          ?        ?  7275.3154  52.9973          ?        ?      852.9        3.1       ?       ? 
1 1 1   16   12   11 o   1134.6    3.9    0.0000   0.0000          ?        ? 12873.8730  87.4775          ?        ?     1134.6        3.9       ?       ? 
1 1 1   16   12   12 o    980.1    3.4    0.0000   0.0000          ?        ?  9605.9199  67.0448          ?        ?      980.1        3.4       ?       ? 
1 1 1   16   12   13 o   1803.5    5.9    0.0000   0.0000          ?        ? 32528.8457 213.2662          ?        ?     1803.5        5.9       ?       ? 
1 1 1   16   12   14 o    858.8    3.0    0.0000   0.0000          ?        ?  7375.5630  52.3588          ?        ?      858.8        3.0       ?       ? 
1 1 1   16   12   15 o    972.0    3.5    0.0000   0.0000          ?        ?  9447.5654  68.3218          ?        ?      972.0        3.5       ?       ? 
1 1 1   16   12   16 o   1046.0    3.7    0.0000   0.0000          ?        ? 10941.0684  77.2611          ?        ?     1046.0        3.7       ?       ? 
1 1 1   16   12   17 o    314.9    2.1    0.0000   0.0000          ?        ?   991.6241  13.4090          ?        ?      314.9        2.1       ?       ? 
1 1 1   16   12   18 o    844.4    3.2    0.0000   0.0000          ?        ?  7129.7324  54.2743          ?        ?      844.4        3.2       ?       ? 
1 1 1   16   12   19 o    879.3    3.4    0.0000   0.0000          ?        ?  7732.4971  60.0210          ?        ?      879.3        3.4       ?       ? 
1 1 1   16   12   20 o    519.2    2.5    0.0000   0.0000          ?        ?  2695.8384  26.1794          ?        ?      519.2        2.5       ?       ? 
1 1 1   16   12   21 f    909.8    3.6    0.0000   0.0000          ?        ?  8277.1562  65.7677          ?        ?      909.8        3.6       ?       ? 
1 1 1   16   12   22 o   2683.9    9.9    0.0000   0.0000          ?        ? 72056.5312 532.5270          ?        ?     2683.9        9.9       ?       ? 
1 1 1   16   12   23 o    808.9    3.2    0.0000   0.0000          ?        ?  6544.2085  51.7203          ?        ?      808.9        3.2       ?       ? 
1 1 1   16   12   24 o    741.0    3.0    0.0000   0.0000          ?        ?  5491.2861  44.0580          ?        ?      741.0        3.0       ?       ? 
1 1 1   16   12   25 o    490.5    2.7    0.0000   0.0000          ?        ?  2405.9495  26.8179          ?        ?      490.5        2.7       ?       ? 
1 1 1   16   12   26 o    603.8    2.7    0.0000   0.0000          ?        ?  3645.9585  33.2031          ?        ?      603.8        2.7       ?       ? 
1 1 1   16   12   27 o    234.2    4.1    0.0000   0.0000          ?        ?   548.4901  19.1556          ?        ?      234.2        4.1       ?       ? 
1 1 1   16   12   28 o   1046.8    4.0    0.0000   0.0000          ?        ? 10959.5850  83.6463          ?        ?     1046.8        4.0       ?       ? 
1 1 1   16   12   29 o   1749.4    6.2    0.0000   0.0000          ?        ? 30607.5332 216.4588          ?        ?     1749.4        6.2       ?       ? 
1 1 1   16   12   30 o   1084.6    4.1    0.0000   0.0000          ?        ? 11764.1230  88.7545          ?        ?     1084.6        4.1       ?       ? 
1 1 1   16   12   31 o    435.0    2.7    0.0000   0.0000          ?        ?  1892.5780  23.6253          ?        ?      435.0        2.7       ?       ? 
1 1 1   16   12   32 o    264.1    3.3    0.0000   0.0000          ?        ?   697.2656  17.2401          ?        ?      264.1        3.3       ?       ? 
1 1 1   16   12   33 o     20.1   10.1    0.0000   0.0000          ?        ?   -49.1662  17.2401          ?        ?       20.1       10.1       ?       ? 
1 1 1   16   12   34 o    768.3    3.2    0.0000   0.0000          ?        ?  5903.1323  49.1662          ?        ?      768.3        3.2       ?       ? 
1 1 1   16   12   35 o    947.3    3.9    0.0000   0.0000          ?        ?  8974.4219  73.4300          ?        ?      947.3        3.9       ?       ? 
1 1 1   16   12   36 o    833.2    3.5    0.0000   0.0000          ?        ?  6943.2842  58.1055          ?        ?      833.2        3.5       ?       ? 
1 1 1   16   12   37 o    557.6    2.9    0.0000   0.0000          ?        ?  3109.6003  31.9261          ?        ?      557.6        2.9       ?       ? 
1 1 1   16   12   38 o   1013.0    3.7    0.0000   0.0000          ?        ? 10263.5967  75.3456          ?        ?     1013.0        3.7       ?       ? 
1 1 1   16   12   39 o    300.7    3.3    0.0000   0.0000          ?        ?   904.1467  19.7942          ?        ?      300.7        3.3       ?       ? 
1 1 1   16   12   40 o    929.9    3.6    0.0000   0.0000          ?        ?  8648.7754  66.4062          ?        ?      929.9        3.6       ?       ? 
1 1 1   16   12   41 o    561.8    2.7    0.0000   0.0000          ?        ?  3156.8508  30.0105          ?        ?      561.8        2.7       ?       ? 
1 1 1   16   12   42 o   1001.7    3.7    0.0000   0.0000          ?        ? 10036.2832  73.4300          ?        ?     1001.7        3.7       ?       ? 
1 1 1   16   12   43 o    203.7    4.5    0.0000   0.0000          ?        ?   415.0391  18.5171          ?        ?      203.7        4.5       ?       ? 
1 1 1   16   12   44 o    193.2    5.0    0.0000   0.0000          ?        ?   373.5352  19.1556          ?        ?      193.2        5.0       ?       ? 
1 1 1   16   12   45 o    388.8    2.9    0.0000   0.0000          ?        ?  1512.0193  22.3483          ?        ?      388.8        2.9       ?       ? 
1 1 1   16   12   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   12   47 o    680.9    2.8    0.0000   0.0000          ?        ?  4637.5825  38.3113          ?        ?      680.9        2.8       ?       ? 
1 1 1   16   12   48 o    381.2    2.8    0.0000   0.0000          ?        ?  1453.2753  21.0712          ?        ?      381.2        2.8       ?       ? 
1 1 1   16   12   49 o    232.8    3.8    0.0000   0.0000          ?        ?   542.1049  17.8786          ?        ?      232.8        3.8       ?       ? 
1 1 1   16   12   50 o    364.7    2.8    0.0000   0.0000          ?        ?  1330.6791  20.4327          ?        ?      364.7        2.8       ?       ? 
1 1 1   16   12   51 o    220.8    4.0    0.0000   0.0000          ?        ?   487.8305  17.8786          ?        ?      220.8        4.0       ?       ? 
1 1 1   16   12   52 o     36.5   15.2    0.0000   0.0000          ?        ?     2.5541  18.5171          ?        ?       36.5       15.2       ?       ? 
1 1 1   16   12   53 o    535.7    2.7    0.0000   0.0000          ?        ?  2870.1548  28.7335          ?        ?      535.7        2.7       ?       ? 
1 1 1   16   12   54 o    254.4    4.0    0.0000   0.0000          ?        ?   647.4609  20.4327          ?        ?      254.4        4.0       ?       ? 
1 1 1   16   12   55 o    509.5    2.7    0.0000   0.0000          ?        ?  2596.2290  27.4564          ?        ?      509.5        2.7       ?       ? 
1 1 1   16   12   56 o    230.6    4.2    0.0000   0.0000          ?        ?   531.8885  19.1556          ?        ?      230.6        4.2       ?       ? 
1 1 1   16   12   57 o    431.2    2.8    0.0000   0.0000          ?        ?  1860.0134  24.2638          ?        ?      431.2        2.8       ?       ? 
1 1 1   16   12   58 o    160.5    6.2    0.0000   0.0000          ?        ?   257.9627  19.7942          ?        ?      160.5        6.2       ?       ? 
1 1 1   16   12   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   12   60 o    339.8    3.2    0.0000   0.0000          ?        ?  1155.0856  21.7097          ?        ?      339.8        3.2       ?       ? 
1 1 1   16   12   61 o    274.4    3.8    0.0000   0.0000          ?        ?   753.4555  21.0712          ?        ?      274.4        3.8       ?       ? 
1 1 1   16   12   62 o    353.6    3.1    0.0000   0.0000          ?        ?  1250.8638  21.7097          ?        ?      353.6        3.1       ?       ? 
1 1 1   16   12   63 o     96.9   10.2    0.0000   0.0000          ?        ?    94.5012  19.7942          ?        ?       96.9       10.2       ?       ? 
1 1 1   16   12   64 o    128.9    7.4    0.0000   0.0000          ?        ?   166.6541  19.1556          ?        ?      128.9        7.4       ?       ? 
1 1 1   16   12   65 f     92.8   10.7    0.0000   0.0000          ?        ?    86.8389  19.7942          ?        ?       92.8       10.7       ?       ? 
1 1 1   16   12   66 o     23.0   11.4    0.0000   0.0000          ?        ?   -50.4432  20.4327          ?        ?       23.0       11.4       ?       ? 
1 1 1   16   12   67 o     31.2   14.2    0.0000   0.0000          ?        ?   -12.7704  19.7942          ?        ?       31.2       14.2       ?       ? 
1 1 1   16   12   68 o    160.6    6.2    0.0000   0.0000          ?        ?   258.6013  19.7942          ?        ?      160.6        6.2       ?       ? 
1 1 1   16   12   69 o     44.7   17.0    0.0000   0.0000          ?        ?    14.6860  21.0712          ?        ?       44.7       17.0       ?       ? 
1 1 1   16   12   70 o    243.2    4.5    0.0000   0.0000          ?        ?   592.5481  21.7097          ?        ?      243.2        4.5       ?       ? 
1 1 1   16   12   71 o    319.7    3.5    0.0000   0.0000          ?        ?  1023.5502  22.3483          ?        ?      319.7        3.5       ?       ? 
1 1 1   16   12   72 o    100.7   10.8    0.0000   0.0000          ?        ?   102.8020  21.7097          ?        ?      100.7       10.8       ?       ? 
1 1 1   16   12   73 o    203.8    5.3    0.0000   0.0000          ?        ?   416.9547  21.7097          ?        ?      203.8        5.3       ?       ? 
1 1 1   16   12   74 o    232.0    4.8    0.0000   0.0000          ?        ?   540.1893  22.3483          ?        ?      232.0        4.8       ?       ? 
1 1 1   16   12   75 o    127.9    8.0    0.0000   0.0000          ?        ?   165.3771  20.4327          ?        ?      127.9        8.0       ?       ? 
1 1 1   16   12   76 o    119.0    8.9    0.0000   0.0000          ?        ?   143.6674  21.0712          ?        ?      119.0        8.9       ?       ? 
1 1 1   16   12   77 f    136.4    7.5    0.0000   0.0000          ?        ?   188.3639  20.4327          ?        ?      136.4        7.5       ?       ? 
1 1 1   16   13    0 o    190.2    3.5  362.0418  13.4090   362.0418  13.4090   362.0418  13.4090      190.2      3.5      190.2        3.5     0.0     0.0 
1 1 1   16   13    1 o    696.2    3.1    0.0000   0.0000          ?        ?  4847.0176  42.7809          ?        ?      696.2        3.1       ?       ? 
1 1 1   16   13    2 o    585.2    2.6    0.0000   0.0000          ?        ?  3425.0303  30.6490          ?        ?      585.2        2.6       ?       ? 
1 1 1   16   13    3 o   1164.3    4.4    0.0000   0.0000          ?        ? 13557.7305 101.5249          ?        ?     1164.3        4.4       ?       ? 
1 1 1   16   13    4 o    523.0    2.3    0.0000   0.0000          ?        ?  2735.4265  23.6253          ?        ?      523.0        2.3       ?       ? 
1 1 1   16   13    5 o    749.3    3.0    0.0000   0.0000          ?        ?  5614.5205  44.6965          ?        ?      749.3        3.0       ?       ? 
1 1 1   16   13    6 o   1685.2    5.9    0.0000   0.0000          ?        ? 28401.4414 200.4958          ?        ?     1685.2        5.9       ?       ? 
1 1 1   16   13    7 o    369.7    2.1    0.0000   0.0000          ?        ?  1367.0748  15.3245          ?        ?      369.7        2.1       ?       ? 
1 1 1   16   13    8 o   2032.3    7.3    0.0000   0.0000          ?        ? 41311.7109 294.9970          ?        ?     2032.3        7.3       ?       ? 
1 1 1   16   13    9 o    555.1    2.5    0.0000   0.0000          ?        ?  3081.5054  27.4564          ?        ?      555.1        2.5       ?       ? 
1 1 1   16   13   10 o    507.0    2.4    0.0000   0.0000          ?        ?  2570.0496  24.2638          ?        ?      507.0        2.4       ?       ? 
1 1 1   16   13   11 o    976.1    3.8    0.0000   0.0000          ?        ?  9528.0195  73.4300          ?        ?      976.1        3.8       ?       ? 
1 1 1   16   13   12 o    427.4    2.2    0.0000   0.0000          ?        ?  1826.8104  19.1556          ?        ?      427.4        2.2       ?       ? 
1 1 1   16   13   13 o    817.1    3.3    0.0000   0.0000          ?        ?  6676.3818  53.6358          ?        ?      817.1        3.3       ?       ? 
1 1 1   16   13   14 o   1144.9    4.2    0.0000   0.0000          ?        ? 13107.5723  96.4168          ?        ?     1144.9        4.2       ?       ? 
1 1 1   16   13   15 o   1195.5    4.4    0.0000   0.0000          ?        ? 14292.6670 104.0790          ?        ?     1195.5        4.4       ?       ? 
1 1 1   16   13   16 o   1589.2    5.6    0.0000   0.0000          ?        ? 25258.0000 178.7861          ?        ?     1589.2        5.6       ?       ? 
1 1 1   16   13   17 o    741.8    3.1    0.0000   0.0000          ?        ?  5502.1411  45.3350          ?        ?      741.8        3.1       ?       ? 
1 1 1   16   13   18 f   1621.2    5.9    0.0000   0.0000          ?        ? 26285.3828 190.9180          ?        ?     1621.2        5.9       ?       ? 
1 1 1   16   13   19 o    251.4    2.4    0.0000   0.0000          ?        ?   632.1364  12.1319          ?        ?      251.4        2.4       ?       ? 
1 1 1   16   13   20 o   2037.0    7.4    0.0000   0.0000          ?        ? 41498.7969 302.6593          ?        ?     2037.0        7.4       ?       ? 
1 1 1   16   13   21 o   1513.3    5.2    0.0000   0.0000          ?        ? 22901.8555 156.4378          ?        ?     1513.3        5.2       ?       ? 
1 1 1   16   13   22 o    796.3    3.1    0.0000   0.0000          ?        ?  6341.1582  49.8047          ?        ?      796.3        3.1       ?       ? 
1 1 1   16   13   23 o    456.5    2.4    0.0000   0.0000          ?        ?  2084.1345  22.3483          ?        ?      456.5        2.4       ?       ? 
1 1 1   16   13   24 o    526.1    2.4    0.0000   0.0000          ?        ?  2767.3528  25.5409          ?        ?      526.1        2.4       ?       ? 
1 1 1   16   13   25 f   1251.2    4.4    0.0000   0.0000          ?        ? 15656.5498 109.1872          ?        ?     1251.2        4.4       ?       ? 
1 1 1   16   13   26 o   1189.1    4.2    0.0000   0.0000          ?        ? 14140.0615  99.6094          ?        ?     1189.1        4.2       ?       ? 
1 1 1   16   13   27 o    911.2    3.9    0.0000   0.0000          ?        ?  8302.6973  70.2374          ?        ?      911.2        3.9       ?       ? 
1 1 1   16   13   28 o    817.0    3.2    0.0000   0.0000          ?        ?  6675.1055  51.7203          ?        ?      817.0        3.2       ?       ? 
1 1 1   16   13   29 o   1105.4    4.3    0.0000   0.0000          ?        ? 12220.6660  94.5012          ?        ?     1105.4        4.3       ?       ? 
1 1 1   16   13   30 o   1037.5    4.0    0.0000   0.0000          ?        ? 10764.8359  83.6463          ?        ?     1037.5        4.0       ?       ? 
1 1 1   16   13   31 o   1701.8    6.0    0.0000   0.0000          ?        ? 28965.8945 204.9654          ?        ?     1701.8        6.0       ?       ? 
1 1 1   16   13   32 o   1233.8    4.6    0.0000   0.0000          ?        ? 15223.6318 112.3798          ?        ?     1233.8        4.6       ?       ? 
1 1 1   16   13   33 o   1086.4    4.3    0.0000   0.0000          ?        ? 11804.3486  93.8627          ?        ?     1086.4        4.3       ?       ? 
1 1 1   16   13   34 o    782.7    3.2    0.0000   0.0000          ?        ?  6125.9766  50.4432          ?        ?      782.7        3.2       ?       ? 
1 1 1   16   13   35 o    884.7    3.6    0.0000   0.0000          ?        ?  7828.2749  63.8522          ?        ?      884.7        3.6       ?       ? 
1 1 1   16   13   36 o    857.7    3.5    0.0000   0.0000          ?        ?  7357.0459  60.6596          ?        ?      857.7        3.5       ?       ? 
1 1 1   16   13   37 o    580.0    2.8    0.0000   0.0000          ?        ?  3363.7319  31.9261          ?        ?      580.0        2.8       ?       ? 
1 1 1   16   13   38 o     46.6   15.1    0.0000   0.0000          ?        ?    21.0712  15.9630          ?        ?       46.6       15.1       ?       ? 
1 1 1   16   13   39 o    252.4    3.7    0.0000   0.0000          ?        ?   637.2446  18.5171          ?        ?      252.4        3.7       ?       ? 
1 1 1   16   13   40 o    415.4    2.8    0.0000   0.0000          ?        ?  1725.9238  22.9868          ?        ?      415.4        2.8       ?       ? 
1 1 1   16   13   41 o    877.6    3.3    0.0000   0.0000          ?        ?  7702.4868  57.4669          ?        ?      877.6        3.3       ?       ? 
1 1 1   16   13   42 o    330.3    2.9    0.0000   0.0000          ?        ?  1091.2334  19.1556          ?        ?      330.3        2.9       ?       ? 
1 1 1   16   13   43 o    576.3    2.7    0.0000   0.0000          ?        ?  3321.5896  31.2876          ?        ?      576.3        2.7       ?       ? 
1 1 1   16   13   44 o    255.4    3.6    0.0000   0.0000          ?        ?   652.5691  18.5171          ?        ?      255.4        3.6       ?       ? 
1 1 1   16   13   45 o    197.8    4.5    0.0000   0.0000          ?        ?   391.4138  17.8786          ?        ?      197.8        4.5       ?       ? 
1 1 1   16   13   46 o     43.5   16.1    0.0000   0.0000          ?        ?    14.6860  18.5171          ?        ?       43.5       16.1       ?       ? 
1 1 1   16   13   47 o    513.9    2.8    0.0000   0.0000          ?        ?  2640.9255  28.7335          ?        ?      513.9        2.8       ?       ? 
1 1 1   16   13   48 o    520.0    2.7    0.0000   0.0000          ?        ?  2704.7776  28.0950          ?        ?      520.0        2.7       ?       ? 
1 1 1   16   13   49 o    158.2    5.5    0.0000   0.0000          ?        ?   250.3005  17.2401          ?        ?      158.2        5.5       ?       ? 
1 1 1   16   13   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   13   51 o    655.1    2.8    0.0000   0.0000          ?        ?  4292.1426  37.0343          ?        ?      655.1        2.8       ?       ? 
1 1 1   16   13   52 o    299.4    3.2    0.0000   0.0000          ?        ?   896.4843  19.1556          ?        ?      299.4        3.2       ?       ? 
1 1 1   16   13   53 f    504.1    2.7    0.0000   0.0000          ?        ?  2541.9546  27.4564          ?        ?      504.1        2.7       ?       ? 
1 1 1   16   13   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   13   55 o    381.9    2.8    0.0000   0.0000          ?        ?  1459.0220  21.7097          ?        ?      381.9        2.8       ?       ? 
1 1 1   16   13   56 o    306.5    3.3    0.0000   0.0000          ?        ?   939.9038  20.4327          ?        ?      306.5        3.3       ?       ? 
1 1 1   16   13   57 o    562.3    2.7    0.0000   0.0000          ?        ?  3163.2361  30.0105          ?        ?      562.3        2.7       ?       ? 
1 1 1   16   13   58 o    219.6    4.2    0.0000   0.0000          ?        ?   482.7224  18.5171          ?        ?      219.6        4.2       ?       ? 
1 1 1   16   13   59 o    188.1    4.8    0.0000   0.0000          ?        ?   354.3795  17.8786          ?        ?      188.1        4.8       ?       ? 
1 1 1   16   13   60 o    187.3    4.9    0.0000   0.0000          ?        ?   351.1869  18.5171          ?        ?      187.3        4.9       ?       ? 
1 1 1   16   13   61 o    378.4    2.9    0.0000   0.0000          ?        ?  1432.8425  21.7097          ?        ?      378.4        2.9       ?       ? 
1 1 1   16   13   62 o     87.6   10.9    0.0000   0.0000          ?        ?    77.2611  19.1556          ?        ?       87.6       10.9       ?       ? 
1 1 1   16   13   63 o     77.5   12.8    0.0000   0.0000          ?        ?    60.6596  19.7942          ?        ?       77.5       12.8       ?       ? 
1 1 1   16   13   64 o     41.3   16.1    0.0000   0.0000          ?        ?    10.8549  19.1556          ?        ?       41.3       16.1       ?       ? 
1 1 1   16   13   65 f    116.0    8.5    0.0000   0.0000          ?        ?   135.3666  19.7942          ?        ?      116.0        8.5       ?       ? 
1 1 1   16   13   66 o    257.7    4.0    0.0000   0.0000          ?        ?   664.7010  20.4327          ?        ?      257.7        4.0       ?       ? 
1 1 1   16   13   67 o    287.4    3.7    0.0000   0.0000          ?        ?   826.8855  21.0712          ?        ?      287.4        3.7       ?       ? 
1 1 1   16   13   68 f    129.7    8.1    0.0000   0.0000          ?        ?   169.2082  21.0712          ?        ?      129.7        8.1       ?       ? 
1 1 1   16   13   69 o     37.9   15.9    0.0000   0.0000          ?        ?     2.5541  20.4327          ?        ?       37.9       15.9       ?       ? 
1 1 1   16   13   70 o    228.5    4.7    0.0000   0.0000          ?        ?   523.5877  21.7097          ?        ?      228.5        4.7       ?       ? 
1 1 1   16   13   71 o     84.5   13.2    0.0000   0.0000          ?        ?    72.7915  22.3483          ?        ?       84.5       13.2       ?       ? 
1 1 1   16   13   72 o    302.8    3.7    0.0000   0.0000          ?        ?   918.1941  22.3483          ?        ?      302.8        3.7       ?       ? 
1 1 1   16   13   73 f    114.6    9.2    0.0000   0.0000          ?        ?   132.8125  21.0712          ?        ?      114.6        9.2       ?       ? 
1 1 1   16   13   74 o     71.5   15.2    0.0000   0.0000          ?        ?    54.9129  21.0712          ?        ?       71.5       15.2       ?       ? 
1 1 1   16   13   75 o    122.8    8.3    0.0000   0.0000          ?        ?   152.6067  20.4327          ?        ?      122.8        8.3       ?       ? 
1 1 1   16   13   76 o    183.4    5.6    0.0000   0.0000          ?        ?   338.4165  20.4327          ?        ?      183.4        5.6       ?       ? 
1 1 1   16   14    0 o   1213.4    6.8 14724.9482 166.0156 14724.9482 166.0156 14724.9482 166.0156     1213.4      6.8     1213.4        6.8     0.0     0.0 
1 1 1   16   14    1 o    588.1    2.8    0.0000   0.0000          ?        ?  3458.8718  32.5646          ?        ?      588.1        2.8       ?       ? 
1 1 1   16   14    2 o   1951.6    7.9    0.0000   0.0000          ?        ? 38094.1992 309.6830          ?        ?     1951.6        7.9       ?       ? 
1 1 1   16   14    3 o    379.2    2.2    0.0000   0.0000          ?        ?  1437.9507  16.6016          ?        ?      379.2        2.2       ?       ? 
1 1 1   16   14    4 o   1163.1    4.4    0.0000   0.0000          ?        ? 13528.3574 102.8020          ?        ?     1163.1        4.4       ?       ? 
1 1 1   16   14    5 o    496.0    2.1    0.0000   0.0000          ?        ?  2460.2236  20.4327          ?        ?      496.0        2.1       ?       ? 
1 1 1   16   14    6 o    441.5    2.2    0.0000   0.0000          ?        ?  1949.4065  19.1556          ?        ?      441.5        2.2       ?       ? 
1 1 1   16   14    7 o    673.3    2.6    0.0000   0.0000          ?        ?  4532.8652  35.1187          ?        ?      673.3        2.6       ?       ? 
1 1 1   16   14    8 o    757.0    3.0    0.0000   0.0000          ?        ?  5730.7314  45.3350          ?        ?      757.0        3.0       ?       ? 
1 1 1   16   14    9 o   1144.5    4.1    0.0000   0.0000          ?        ? 13098.6318  93.2242          ?        ?     1144.5        4.1       ?       ? 
1 1 1   16   14   10 o   1072.9    3.9    0.0000   0.0000          ?        ? 11511.9062  83.6463          ?        ?     1072.9        3.9       ?       ? 
1 1 1   16   14   11 o    189.3    2.7    0.0000   0.0000          ?        ?   358.2106  10.2163          ?        ?      189.3        2.7       ?       ? 
1 1 1   16   14   12 o    737.0    3.1    0.0000   0.0000          ?        ?  5431.9033  45.3350          ?        ?      737.0        3.1       ?       ? 
1 1 1   16   14   13 o    819.3    3.2    0.0000   0.0000          ?        ?  6712.1392  51.7203          ?        ?      819.3        3.2       ?       ? 
1 1 1   16   14   14 o   1769.9    6.4    0.0000   0.0000          ?        ? 31327.7852 226.0367          ?        ?     1769.9        6.4       ?       ? 
1 1 1   16   14   15 o    914.1    3.7    0.0000   0.0000          ?        ?  8356.9717  67.0448          ?        ?      914.1        3.7       ?       ? 
1 1 1   16   14   16 o    570.1    2.6    0.0000   0.0000          ?        ?  3250.0752  30.0105          ?        ?      570.1        2.6       ?       ? 
1 1 1   16   14   17 o   1868.1    6.7    0.0000   0.0000          ?        ? 34904.1445 249.6619          ?        ?     1868.1        6.7       ?       ? 
1 1 1   16   14   18 o    188.1    3.1    0.0000   0.0000          ?        ?   353.7410  11.4934          ?        ?      188.1        3.1       ?       ? 
1 1 1   16   14   19 o   1518.0    5.4    0.0000   0.0000          ?        ? 23044.8848 164.7386          ?        ?     1518.0        5.4       ?       ? 
1 1 1   16   14   20 o    673.2    2.9    0.0000   0.0000          ?        ?  4531.5879  39.5883          ?        ?      673.2        2.9       ?       ? 
1 1 1   16   14   21 o    129.1    5.4    0.0000   0.0000          ?        ?   166.6541  14.0475          ?        ?      129.1        5.4       ?       ? 
1 1 1   16   14   22 o    690.8    3.1    0.0000   0.0000          ?        ?  4772.3110  42.1424          ?        ?      690.8        3.1       ?       ? 
1 1 1   16   14   23 o   1130.7    4.1    0.0000   0.0000          ?        ? 12786.3955  93.2242          ?        ?     1130.7        4.1       ?       ? 
1 1 1   16   14   24 o    666.3    3.0    0.0000   0.0000          ?        ?  4439.6406  39.5883          ?        ?      666.3        3.0       ?       ? 
1 1 1   16   14   25 o    673.5    2.8    0.0000   0.0000          ?        ?  4536.0576  37.6728          ?        ?      673.5        2.8       ?       ? 
1 1 1   16   14   26 o    136.5    4.7    0.0000   0.0000          ?        ?   186.4483  12.7704          ?        ?      136.5        4.7       ?       ? 
1 1 1   16   14   27 o    681.0    2.9    0.0000   0.0000          ?        ?  4637.5825  39.5883          ?        ?      681.0        2.9       ?       ? 
1 1 1   16   14   28 o    190.6    4.0    0.0000   0.0000          ?        ?   363.3188  15.3245          ?        ?      190.6        4.0       ?       ? 
1 1 1   16   14   29 o    579.5    2.7    0.0000   0.0000          ?        ?  3357.9854  31.2876          ?        ?      579.5        2.7       ?       ? 
1 1 1   16   14   30 o    555.4    2.7    0.0000   0.0000          ?        ?  3084.6980  30.0105          ?        ?      555.4        2.7       ?       ? 
1 1 1   16   14   31 o    427.1    2.6    0.0000   0.0000          ?        ?  1824.2563  22.3483          ?        ?      427.1        2.6       ?       ? 
1 1 1   16   14   32 o    796.9    3.2    0.0000   0.0000          ?        ?  6351.3745  51.0817          ?        ?      796.9        3.2       ?       ? 
1 1 1   16   14   33 o   1002.6    3.9    0.0000   0.0000          ?        ? 10052.8848  79.1767          ?        ?     1002.6        3.9       ?       ? 
1 1 1   16   14   34 o    968.6    4.0    0.0000   0.0000          ?        ?  9383.0752  76.6226          ?        ?      968.6        4.0       ?       ? 
1 1 1   16   14   35 o    678.3    3.0    0.0000   0.0000          ?        ?  4601.8257  40.2269          ?        ?      678.3        3.0       ?       ? 
1 1 1   16   14   36 o    476.7    2.9    0.0000   0.0000          ?        ?  2272.4985  28.0950          ?        ?      476.7        2.9       ?       ? 
1 1 1   16   14   37 o     34.1   15.0    0.0000   0.0000          ?        ?    -5.7467  19.7942          ?        ?       34.1       15.0       ?       ? 
1 1 1   16   14   38 o    730.0    3.1    0.0000   0.0000          ?        ?  5329.7402  44.6965          ?        ?      730.0        3.1       ?       ? 
1 1 1   16   14   39 f    667.3    2.9    0.0000   0.0000          ?        ?  4453.0498  38.3113          ?        ?      667.3        2.9       ?       ? 
1 1 1   16   14   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   14   41 o    206.0    4.0    0.0000   0.0000          ?        ?   424.6169  16.6016          ?        ?      206.0        4.0       ?       ? 
1 1 1   16   14   42 o    100.7    7.9    0.0000   0.0000          ?        ?   101.5249  15.9630          ?        ?      100.7        7.9       ?       ? 
1 1 1   16   14   43 o    242.0    3.6    0.0000   0.0000          ?        ?   585.5243  17.2401          ?        ?      242.0        3.6       ?       ? 
1 1 1   16   14   44 o    212.4    4.1    0.0000   0.0000          ?        ?   451.4348  17.2401          ?        ?      212.4        4.1       ?       ? 
1 1 1   16   14   45 o    459.1    2.8    0.0000   0.0000          ?        ?  2108.3984  25.5409          ?        ?      459.1        2.8       ?       ? 
1 1 1   16   14   46 o    270.6    3.4    0.0000   0.0000          ?        ?   732.3843  18.5171          ?        ?      270.6        3.4       ?       ? 
1 1 1   16   14   47 o    568.4    2.6    0.0000   0.0000          ?        ?  3230.9194  30.0105          ?        ?      568.4        2.6       ?       ? 
1 1 1   16   14   48 o    258.9    3.6    0.0000   0.0000          ?        ?   670.4477  18.5171          ?        ?      258.9        3.6       ?       ? 
1 1 1   16   14   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   14   50 o    192.9    4.6    0.0000   0.0000          ?        ?   372.2581  17.8786          ?        ?      192.9        4.6       ?       ? 
1 1 1   16   14   51 o     22.7   11.3    0.0000   0.0000          ?        ?   -49.1662  19.7942          ?        ?       22.7       11.3       ?       ? 
1 1 1   16   14   52 o     20.8   10.4    0.0000   0.0000          ?        ?   -48.5276  17.8786          ?        ?       20.8       10.4       ?       ? 
1 1 1   16   14   53 o    361.6    2.8    0.0000   0.0000          ?        ?  1307.6923  20.4327          ?        ?      361.6        2.8       ?       ? 
1 1 1   16   14   54 o    552.3    2.8    0.0000   0.0000          ?        ?  3050.8562  31.2876          ?        ?      552.3        2.8       ?       ? 
1 1 1   16   14   55 o    394.0    3.0    0.0000   0.0000          ?        ?  1552.8845  23.6253          ?        ?      394.0        3.0       ?       ? 
1 1 1   16   14   56 o    409.3    2.8    0.0000   0.0000          ?        ?  1676.1193  22.9868          ?        ?      409.3        2.8       ?       ? 
1 1 1   16   14   57 o    388.9    3.0    0.0000   0.0000          ?        ?  1512.6577  22.9868          ?        ?      388.9        3.0       ?       ? 
1 1 1   16   14   58 o     19.8   10.0    0.0000   0.0000          ?        ?   -60.0210  18.5171          ?        ?       19.8       10.0       ?       ? 
1 1 1   16   14   59 o    219.4    4.5    0.0000   0.0000          ?        ?   482.0838  19.7942          ?        ?      219.4        4.5       ?       ? 
1 1 1   16   14   60 o    214.9    4.6    0.0000   0.0000          ?        ?   462.2897  19.7942          ?        ?      214.9        4.6       ?       ? 
1 1 1   16   14   61 o    166.5    5.9    0.0000   0.0000          ?        ?   277.7569  19.7942          ?        ?      166.5        5.9       ?       ? 
1 1 1   16   14   62 o    277.3    3.7    0.0000   0.0000          ?        ?   769.4186  20.4327          ?        ?      277.3        3.7       ?       ? 
1 1 1   16   14   63 o    103.6    9.6    0.0000   0.0000          ?        ?   107.9102  19.7942          ?        ?      103.6        9.6       ?       ? 
1 1 1   16   14   64 o    185.0    5.5    0.0000   0.0000          ?        ?   342.8861  20.4327          ?        ?      185.0        5.5       ?       ? 
1 1 1   16   14   65 o     37.1   15.8    0.0000   0.0000          ?        ?     0.6385  20.4327          ?        ?       37.1       15.8       ?       ? 
1 1 1   16   14   66 o    194.5    5.4    0.0000   0.0000          ?        ?   379.2819  21.0712          ?        ?      194.5        5.4       ?       ? 
1 1 1   16   14   67 o     55.8   17.2    0.0000   0.0000          ?        ?    31.9261  21.0712          ?        ?       55.8       17.2       ?       ? 
1 1 1   16   14   68 o     83.9   12.9    0.0000   0.0000          ?        ?    71.5144  21.7097          ?        ?       83.9       12.9       ?       ? 
1 1 1   16   14   69 o     86.5   12.2    0.0000   0.0000          ?        ?    75.9841  21.0712          ?        ?       86.5       12.2       ?       ? 
1 1 1   16   14   70 o    252.0    4.4    0.0000   0.0000          ?        ?   636.6060  22.3483          ?        ?      252.0        4.4       ?       ? 
1 1 1   16   14   71 f    132.4    8.7    0.0000   0.0000          ?        ?   176.8705  22.9868          ?        ?      132.4        8.7       ?       ? 
1 1 1   16   14   72 f    199.4    5.4    0.0000   0.0000          ?        ?   399.0760  21.7097          ?        ?      199.4        5.4       ?       ? 
1 1 1   16   14   73 o    255.9    4.2    0.0000   0.0000          ?        ?   656.4003  21.7097          ?        ?      255.9        4.2       ?       ? 
1 1 1   16   14   74 o    369.6    3.5    0.0000   0.0000          ?        ?  1368.9904  25.5409          ?        ?      369.6        3.5       ?       ? 
1 1 1   16   14   75 o     21.5   10.9    0.0000   0.0000          ?        ?   -72.7915  22.3483          ?        ?       21.5       10.9       ?       ? 
1 1 1   16   14   76 o     67.5   15.9    0.0000   0.0000          ?        ?    49.8047  21.0712          ?        ?       67.5       15.9       ?       ? 
1 1 1   16   15    0 o     55.9    7.5   31.9261   8.3008    31.9261   8.3008    31.9261   8.3008       55.9      7.5       55.9        7.5     0.0     0.0 
1 1 1   16   15    1 o    811.0    3.6    0.0000   0.0000          ?        ?  6576.7729  58.1055          ?        ?      811.0        3.6       ?       ? 
1 1 1   16   15    2 o   1148.2    4.6    0.0000   0.0000          ?        ? 13184.1953 104.7175          ?        ?     1148.2        4.6       ?       ? 
1 1 1   16   15    3 o    730.8    2.9    0.0000   0.0000          ?        ?  5341.2334  42.7809          ?        ?      730.8        2.9       ?       ? 
1 1 1   16   15    4 o   1214.9    4.3    0.0000   0.0000          ?        ? 14760.0664 104.7175          ?        ?     1214.9        4.3       ?       ? 
1 1 1   16   15    5 o    768.9    3.0    0.0000   0.0000          ?        ?  5912.7104  45.9736          ?        ?      768.9        3.0       ?       ? 
1 1 1   16   15    6 o    930.9    3.3    0.0000   0.0000          ?        ?  8666.0156  60.6596          ?        ?      930.9        3.3       ?       ? 
1 1 1   16   15    7 o   1154.0    3.9    0.0000   0.0000          ?        ? 13317.0078  90.6701          ?        ?     1154.0        3.9       ?       ? 
1 1 1   16   15    8 o   1345.1    4.5    0.0000   0.0000          ?        ? 18093.1504 120.6806          ?        ?     1345.1        4.5       ?       ? 
1 1 1   16   15    9 o    221.7    1.9    0.0000   0.0000          ?        ?   491.6617   8.3008          ?        ?      221.7        1.9       ?       ? 
1 1 1   16   15   10 o    812.4    3.1    0.0000   0.0000          ?        ?  6600.3979  51.0817          ?        ?      812.4        3.1       ?       ? 
1 1 1   16   15   11 o    627.8    2.6    0.0000   0.0000          ?        ?  3941.5940  33.2031          ?        ?      627.8        2.6       ?       ? 
1 1 1   16   15   12 o    193.9    2.3    0.0000   0.0000          ?        ?   376.0892   8.9393          ?        ?      193.9        2.3       ?       ? 
1 1 1   16   15   13 o   1759.8    5.9    0.0000   0.0000          ?        ? 30970.8516 207.5195          ?        ?     1759.8        5.9       ?       ? 
1 1 1   16   15   14 o   1231.0    4.3    0.0000   0.0000          ?        ? 15153.3945 104.7175          ?        ?     1231.0        4.3       ?       ? 
1 1 1   16   15   15 o   1078.0    3.8    0.0000   0.0000          ?        ? 11620.4551  81.7308          ?        ?     1078.0        3.8       ?       ? 
1 1 1   16   15   16 o   1285.6    4.7    0.0000   0.0000          ?        ? 16528.7715 120.6806          ?        ?     1285.6        4.7       ?       ? 
1 1 1   16   15   17 o   1146.6    4.5    0.0000   0.0000          ?        ? 13147.7998 102.1635          ?        ?     1146.6        4.5       ?       ? 
1 1 1   16   15   18 o    840.2    3.3    0.0000   0.0000          ?        ?  7060.1333  55.5514          ?        ?      840.2        3.3       ?       ? 
1 1 1   16   15   19 o   1569.0    5.5    0.0000   0.0000          ?        ? 24618.8398 172.4008          ?        ?     1569.0        5.5       ?       ? 
1 1 1   16   15   20 o    344.0    2.5    0.0000   0.0000          ?        ?  1183.1805  17.2401          ?        ?      344.0        2.5       ?       ? 
1 1 1   16   15   21 o   2255.7    8.4    0.0000   0.0000          ?        ? 50895.2812 379.9204          ?        ?     2255.7        8.4       ?       ? 
1 1 1   16   15   22 o    302.7    2.6    0.0000   0.0000          ?        ?   916.2786  15.9630          ?        ?      302.7        2.6       ?       ? 
1 1 1   16   15   23 o   1458.2    5.3    0.0000   0.0000          ?        ? 21266.6016 153.2452          ?        ?     1458.2        5.3       ?       ? 
1 1 1   16   15   24 o    901.1    3.4    0.0000   0.0000          ?        ?  8120.7183  61.2981          ?        ?      901.1        3.4       ?       ? 
1 1 1   16   15   25 o    950.4    3.6    0.0000   0.0000          ?        ?  9033.1650  67.6833          ?        ?      950.4        3.6       ?       ? 
1 1 1   16   15   26 o    899.8    3.7    0.0000   0.0000          ?        ?  8096.4541  65.7677          ?        ?      899.8        3.7       ?       ? 
1 1 1   16   15   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   15   28 o    397.9    2.6    0.0000   0.0000          ?        ?  1583.5337  21.0712          ?        ?      397.9        2.6       ?       ? 
1 1 1   16   15   29 o   1363.5    5.2    0.0000   0.0000          ?        ? 18595.0273 141.1133          ?        ?     1363.5        5.2       ?       ? 
1 1 1   16   15   30 o    276.1    3.4    0.0000   0.0000          ?        ?   762.3948  18.5171          ?        ?      276.1        3.4       ?       ? 
1 1 1   16   15   31 o   1079.1    4.1    0.0000   0.0000          ?        ? 11646.6348  88.1160          ?        ?     1079.1        4.1       ?       ? 
1 1 1   16   15   32 f    326.5    3.2    0.0000   0.0000          ?        ?  1066.3312  21.0712          ?        ?      326.5        3.2       ?       ? 
1 1 1   16   15   33 o   1269.1    4.8    0.0000   0.0000          ?        ? 16107.3477 121.9576          ?        ?     1269.1        4.8       ?       ? 
1 1 1   16   15   34 o    313.8    3.5    0.0000   0.0000          ?        ?   984.6003  21.7097          ?        ?      313.8        3.5       ?       ? 
1 1 1   16   15   35 o    876.4    3.5    0.0000   0.0000          ?        ?  7682.0537  61.9366          ?        ?      876.4        3.5       ?       ? 
1 1 1   16   15   36 o    882.2    3.5    0.0000   0.0000          ?        ?  7782.9404  61.2981          ?        ?      882.2        3.5       ?       ? 
1 1 1   16   15   37 o    606.8    2.7    0.0000   0.0000          ?        ?  3681.7156  32.5646          ?        ?      606.8        2.7       ?       ? 
1 1 1   16   15   38 o    274.4    3.3    0.0000   0.0000          ?        ?   752.8170  17.8786          ?        ?      274.4        3.3       ?       ? 
1 1 1   16   15   39 o    429.0    2.7    0.0000   0.0000          ?        ?  1840.8578  22.9868          ?        ?      429.0        2.7       ?       ? 
1 1 1   16   15   40 o    779.0    3.1    0.0000   0.0000          ?        ?  6069.7866  47.8891          ?        ?      779.0        3.1       ?       ? 
1 1 1   16   15   41 o    519.2    2.7    0.0000   0.0000          ?        ?  2695.8384  28.0950          ?        ?      519.2        2.7       ?       ? 
1 1 1   16   15   42 o    303.3    2.8    0.0000   0.0000          ?        ?   920.1097  17.2401          ?        ?      303.3        2.8       ?       ? 
1 1 1   16   15   43 o    494.9    2.6    0.0000   0.0000          ?        ?  2450.0076  25.5409          ?        ?      494.9        2.6       ?       ? 
1 1 1   16   15   44 o    117.4    7.3    0.0000   0.0000          ?        ?   137.9207  17.2401          ?        ?      117.4        7.3       ?       ? 
1 1 1   16   15   45 o    182.9    4.7    0.0000   0.0000          ?        ?   334.5853  17.2401          ?        ?      182.9        4.7       ?       ? 
1 1 1   16   15   46 o    702.0    3.0    0.0000   0.0000          ?        ?  4929.3867  41.5039          ?        ?      702.0        3.0       ?       ? 
1 1 1   16   15   47 o    505.5    2.6    0.0000   0.0000          ?        ?  2556.0020  26.1794          ?        ?      505.5        2.6       ?       ? 
1 1 1   16   15   48 o    162.5    5.5    0.0000   0.0000          ?        ?   264.3480  17.8786          ?        ?      162.5        5.5       ?       ? 
1 1 1   16   15   49 o    610.8    2.8    0.0000   0.0000          ?        ?  3732.1589  33.8416          ?        ?      610.8        2.8       ?       ? 
1 1 1   16   15   50 o    774.6    3.0    0.0000   0.0000          ?        ?  6001.4648  46.6121          ?        ?      774.6        3.0       ?       ? 
1 1 1   16   15   51 o    408.0    2.7    0.0000   0.0000          ?        ?  1665.2643  21.7097          ?        ?      408.0        2.7       ?       ? 
1 1 1   16   15   52 o    455.1    2.8    0.0000   0.0000          ?        ?  2072.0027  25.5409          ?        ?      455.1        2.8       ?       ? 
1 1 1   16   15   53 o    590.1    2.7    0.0000   0.0000          ?        ?  3482.4971  31.9261          ?        ?      590.1        2.7       ?       ? 
1 1 1   16   15   54 o    238.0    4.0    0.0000   0.0000          ?        ?   567.0072  19.1556          ?        ?      238.0        4.0       ?       ? 
1 1 1   16   15   55 o    180.7    5.3    0.0000   0.0000          ?        ?   326.9231  19.1556          ?        ?      180.7        5.3       ?       ? 
1 1 1   16   15   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   15   57 o    734.7    3.0    0.0000   0.0000          ?        ?  5399.9775  43.4195          ?        ?      734.7        3.0       ?       ? 
1 1 1   16   15   58 f    339.2    3.2    0.0000   0.0000          ?        ?  1151.2545  21.7097          ?        ?      339.2        3.2       ?       ? 
1 1 1   16   15   59 o    315.6    3.2    0.0000   0.0000          ?        ?   996.7323  20.4327          ?        ?      315.6        3.2       ?       ? 
1 1 1   16   15   60 o    169.7    5.6    0.0000   0.0000          ?        ?   288.6118  19.1556          ?        ?      169.7        5.6       ?       ? 
1 1 1   16   15   61 o    172.3    5.7    0.0000   0.0000          ?        ?   297.5511  19.7942          ?        ?      172.3        5.7       ?       ? 
1 1 1   16   15   62 o    251.4    3.9    0.0000   0.0000          ?        ?   632.7749  19.7942          ?        ?      251.4        3.9       ?       ? 
1 1 1   16   15   63 o    134.0    7.1    0.0000   0.0000          ?        ?   180.0631  19.1556          ?        ?      134.0        7.1       ?       ? 
1 1 1   16   15   64 o    214.4    4.8    0.0000   0.0000          ?        ?   460.3741  20.4327          ?        ?      214.4        4.8       ?       ? 
1 1 1   16   15   65 o     61.7   15.9    0.0000   0.0000          ?        ?    40.2269  19.7942          ?        ?       61.7       15.9       ?       ? 
1 1 1   16   15   66 o    119.0    8.6    0.0000   0.0000          ?        ?   142.3903  20.4327          ?        ?      119.0        8.6       ?       ? 
1 1 1   16   15   67 o    279.7    3.7    0.0000   0.0000          ?        ?   783.4660  20.4327          ?        ?      279.7        3.7       ?       ? 
1 1 1   16   15   68 o     66.2   15.7    0.0000   0.0000          ?        ?    46.6121  20.4327          ?        ?       66.2       15.7       ?       ? 
1 1 1   16   15   69 o     25.3   12.4    0.0000   0.0000          ?        ?   -37.0343  20.4327          ?        ?       25.3       12.4       ?       ? 
1 1 1   16   15   70 o    252.0    4.3    0.0000   0.0000          ?        ?   636.6060  21.7097          ?        ?      252.0        4.3       ?       ? 
1 1 1   16   15   71 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   15   72 o    262.7    4.1    0.0000   0.0000          ?        ?   691.5189  21.7097          ?        ?      262.7        4.1       ?       ? 
1 1 1   16   15   73 o     81.3   12.2    0.0000   0.0000          ?        ?    67.6833  19.7942          ?        ?       81.3       12.2       ?       ? 
1 1 1   16   15   74 o     80.4   12.7    0.0000   0.0000          ?        ?    66.4062  20.4327          ?        ?       80.4       12.7       ?       ? 
1 1 1   16   15   75 o     23.6   11.6    0.0000   0.0000          ?        ?   -42.1424  19.7942          ?        ?       23.6       11.6       ?       ? 
1 1 1   16   16    0 o    410.7    5.2 1687.6125  42.7809  1687.6125  42.7809  1687.6125  42.7809      410.7      5.2      410.7        5.2     0.0     0.0 
1 1 1   16   16    1 o      8.7    6.5  -25.5409   8.3008   -25.5409   8.3008   -25.5409   8.3008        8.7      6.5        8.7        6.5     0.0     0.0 
1 1 1   16   16    2 o   1608.0    8.7 25862.6797 280.9495 25862.6797 280.9495 25862.6797 280.9495     1608.0      8.7     1608.0        8.7     0.0     0.0 
1 1 1   16   16    3 o   1593.1    9.2 25386.9805 293.0815 25386.9805 293.0815 25386.9805 293.0815     1593.1      9.2     1593.1        9.2     0.0     0.0 
1 1 1   16   16    4 o    442.4    2.8 1957.0687  24.9023  1957.0687  24.9023  1957.0687  24.9023      442.4      2.8      442.4        2.8     0.0     0.0 
1 1 1   16   16    5 f     20.1   12.0    4.4697   8.3008     4.4697   8.3008     4.4697   8.3008       20.1     12.0       20.1       12.0     0.0     0.0 
1 1 1   16   16    6 o   1267.1    7.0 16057.5420 176.2320 16057.5420 176.2320 16057.5420 176.2320     1267.1      7.0     1267.1        7.0     0.0     0.0 
1 1 1   16   16    7 o    558.9    3.9 3124.2861  43.4195  3124.2861  43.4195  3124.2861  43.4195      558.9      3.9      558.9        3.9     0.0     0.0 
1 1 1   16   16    8 o   1553.3    9.6 24134.8398 298.1896 24134.8398 298.1896 24134.8398 298.1896     1553.3      9.6     1553.3        9.6     0.0     0.0 
1 1 1   16   16    9 o     86.2    7.5   75.9841  12.7704    75.9841  12.7704    75.9841  12.7704       86.2      7.5       86.2        7.5     0.0     0.0 
1 1 1   16   16   10 o   1420.0    7.0 20167.0664 197.9417 20167.0664 197.9417 20167.0664 197.9417     1420.0      7.0     1420.0        7.0     0.0     0.0 
1 1 1   16   16   11 o   1028.9    5.6 10587.3271 114.2954 10587.3271 114.2954 10587.3271 114.2954     1028.9      5.6     1028.9        5.6     0.0     0.0 
1 1 1   16   16   12 o   2417.8   12.0 58476.4453 579.7776 58476.4453 579.7776 58476.4453 579.7776     2417.8     12.0     2417.8       12.0     0.0     0.0 
1 1 1   16   16   13 o    372.3    3.1 1386.2305  22.9868  1386.2305  22.9868  1386.2305  22.9868      372.3      3.1      372.3        3.1     0.0     0.0 
1 1 1   16   16   14 o   1484.1    7.3 22029.6348 217.0974 22029.6348 217.0974 22029.6348 217.0974     1484.1      7.3     1484.1        7.3     0.0     0.0 
1 1 1   16   16   15 o   1027.1    5.6 10550.2930 115.5724 10550.2930 115.5724 10550.2930 115.5724     1027.1      5.6     1027.1        5.6     0.0     0.0 
1 1 1   16   16   16 o    931.6    5.4 8680.0635 101.5249  8680.0635 101.5249  8680.0635 101.5249      931.6      5.4      931.6        5.4     0.0     0.0 
1 1 1   16   16   17 o    952.8    5.6 9079.1396 105.9946  9079.1396 105.9946  9079.1396 105.9946      952.8      5.6      952.8        5.6     0.0     0.0 
1 1 1   16   16   18 o   2458.6   22.5 60513.3320 1108.4736 60513.3320 1108.4736 60513.3320 1108.4736     2458.6     22.5     2458.6       22.5     0.0     0.0 
1 1 1   16   16   19 o   1634.0   10.2 26708.0820 333.3083 26708.0820 333.3083 26708.0820 333.3083     1634.0     10.2     1634.0       10.2     0.0     0.0 
1 1 1   16   16   20 o   2409.6   14.4 58093.3320 695.9886 58093.3320 695.9886 58093.3320 695.9886     2409.6     14.4     2409.6       14.4     0.0     0.0 
1 1 1   16   16   21 o    778.7    4.7 6065.3169  72.7915  6065.3169  72.7915  6065.3169  72.7915      778.7      4.7      778.7        4.7     0.0     0.0 
1 1 1   16   16   22 o   1510.6    7.4 22822.6797 224.7596 22822.6797 224.7596 22822.6797 224.7596     1510.6      7.4     1510.6        7.4     0.0     0.0 
1 1 1   16   16   23 o    221.2    4.5  489.7461  19.7942   489.7461  19.7942   489.7461  19.7942      221.2      4.5      221.2        4.5     0.0     0.0 
1 1 1   16   16   24 o    575.3    3.6 3310.0962  40.8654  3310.0962  40.8654  3310.0962  40.8654      575.3      3.6      575.3        3.6     0.0     0.0 
1 1 1   16   16   25 o    258.7    4.3  669.8092  22.3483   669.8092  22.3483   669.8092  22.3483      258.7      4.3      258.7        4.3     0.0     0.0 
1 1 1   16   16   26 o    671.6    3.9 4511.1553  52.3588  4511.1553  52.3588  4511.1553  52.3588      671.6      3.9      671.6        3.9     0.0     0.0 
1 1 1   16   16   27 o    295.9    4.1  876.0516  24.2638   876.0516  24.2638   876.0516  24.2638      295.9      4.1      295.9        4.1     0.0     0.0 
1 1 1   16   16   28 o    444.7    3.6 1978.1399  31.9261  1978.1399  31.9261  1978.1399  31.9261      444.7      3.6      444.7        3.6     0.0     0.0 
1 1 1   16   16   29 o     38.6   20.5   21.7097  21.0712    21.7097  21.0712    21.7097  21.0712       38.6     20.5       38.6       20.5     0.0     0.0 
1 1 1   16   16   30 o    629.8    4.8 3967.7734  60.0210  3967.7734  60.0210  3967.7734  60.0210      629.8      4.8      629.8        4.8     0.0     0.0 
1 1 1   16   16   31 o   1233.5    6.2 15219.1631 152.6067 15219.1631 152.6067 15219.1631 152.6067     1233.5      6.2     1233.5        6.2     0.0     0.0 
1 1 1   16   16   32 o     96.6   11.2   97.0553  21.0712    97.0553  21.0712    97.0553  21.0712       96.6     11.2       96.6       11.2     0.0     0.0 
1 1 1   16   16   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   16   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   16   35 o    305.9    4.9  936.7112  30.0105   936.7112  30.0105   936.7112  30.0105      305.9      4.9      305.9        4.9     0.0     0.0 
1 1 1   16   16   36 o    534.6    3.9 2858.6614  41.5039  2858.6614  41.5039  2858.6614  41.5039      534.6      3.9      534.6        3.9     0.0     0.0 
1 1 1   16   16   37 f    449.8    4.0 2023.4750  36.3957  2023.4750  36.3957  2023.4750  36.3957      449.8      4.0      449.8        4.0     0.0     0.0 
1 1 1   16   16   38 o    330.2    4.1 1091.2334  26.8179  1091.2334  26.8179  1091.2334  26.8179      330.2      4.1      330.2        4.1     0.0     0.0 
1 1 1   16   16   39 o     60.6   20.2   47.2506  21.7097    47.2506  21.7097    47.2506  21.7097       60.6     20.2       60.6       20.2     0.0     0.0 
1 1 1   16   16   40 o     30.7   19.1    7.0237  22.9868     7.0237  22.9868     7.0237  22.9868       30.7     19.1       30.7       19.1     0.0     0.0 
1 1 1   16   16   41 o    342.6    3.9 1174.2412  26.8179  1174.2412  26.8179  1174.2412  26.8179      342.6      3.9      342.6        3.9     0.0     0.0 
1 1 1   16   16   42 o    406.7    3.6 1654.4095  29.3720  1654.4095  29.3720  1654.4095  29.3720      406.7      3.6      406.7        3.6     0.0     0.0 
1 1 1   16   16   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   16   44 o    193.0    5.8  373.5352  22.3483   373.5352  22.3483   373.5352  22.3483      193.0      5.8      193.0        5.8     0.0     0.0 
1 1 1   16   16   45 f     14.9   11.0  -58.1055  21.7097   -58.1055  21.7097   -58.1055  21.7097       14.9     11.0       14.9       11.0     0.0     0.0 
1 1 1   16   16   46 o    106.2   12.3  117.4880  25.5409   117.4880  25.5409   117.4880  25.5409      106.2     12.3      106.2       12.3     0.0     0.0 
1 1 1   16   16   47 f    275.3    4.8  758.5637  26.1794   758.5637  26.1794   758.5637  26.1794      275.3      4.8      275.3        4.8     0.0     0.0 
1 1 1   16   16   48 o    101.8   12.5  108.5487  24.9023   108.5487  24.9023   108.5487  24.9023      101.8     12.5      101.8       12.5     0.0     0.0 
1 1 1   16   16   49 o    206.7    6.0  428.4480  24.9023   428.4480  24.9023   428.4480  24.9023      206.7      6.0      206.7        6.0     0.0     0.0 
1 1 1   16   16   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   16   51 o    158.3    8.1  252.8546  25.5409   252.8546  25.5409   252.8546  25.5409      158.3      8.1      158.3        8.1     0.0     0.0 
1 1 1   16   16   52 o    147.6    9.4  220.9285  27.4564   220.9285  27.4564   220.9285  27.4564      147.6      9.4      147.6        9.4     0.0     0.0 
1 1 1   16   16   53 o    314.0    4.6  987.1545  28.7335   987.1545  28.7335   987.1545  28.7335      314.0      4.6      314.0        4.6     0.0     0.0 
1 1 1   16   16   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   16   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   16   56 o    458.8    4.2 2106.4829  38.9498  2106.4829  38.9498  2106.4829  38.9498      458.8      4.2      458.8        4.2     0.0     0.0 
1 1 1   16   16   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   16   58 o     15.1   11.3 -102.8020  28.7335  -102.8020  28.7335  -102.8020  28.7335       15.1     11.3       15.1       11.3     0.0     0.0 
1 1 1   16   16   59 o     22.7   16.0  -26.1794  26.8179   -26.1794  26.8179   -26.1794  26.8179       22.7     16.0       22.7       16.0     0.0     0.0 
1 1 1   16   16   60 o    230.6    5.8  533.1656  26.8179   533.1656  26.8179   533.1656  26.8179      230.6      5.8      230.6        5.8     0.0     0.0 
1 1 1   16   16   61 o    353.7    4.2 1252.1410  30.0105  1252.1410  30.0105  1252.1410  30.0105      353.7      4.2      353.7        4.2     0.0     0.0 
1 1 1   16   16   62 o    251.7    5.7  635.3290  28.7335   635.3290  28.7335   635.3290  28.7335      251.7      5.7      251.7        5.7     0.0     0.0 
1 1 1   16   16   63 o    292.1    5.0  854.9804  29.3720   854.9804  29.3720   854.9804  29.3720      292.1      5.0      292.1        5.0     0.0     0.0 
1 1 1   16   16   64 f    187.7    7.7  355.0180  28.7335   355.0180  28.7335   355.0180  28.7335      187.7      7.7      187.7        7.7     0.0     0.0 
1 1 1   16   16   65 o     27.1   18.5  -13.4090  29.3720   -13.4090  29.3720   -13.4090  29.3720       27.1     18.5       27.1       18.5     0.0     0.0 
1 1 1   16   16   66 f     33.3   21.0    7.0237  28.7335     7.0237  28.7335     7.0237  28.7335       33.3     21.0       33.3       21.0     0.0     0.0 
1 1 1   16   16   67 o     19.8   14.4  -51.0817  28.7335   -51.0817  28.7335   -51.0817  28.7335       19.8     14.4       19.8       14.4     0.0     0.0 
1 1 1   16   16   68 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   16   16   69 o    242.0    6.2  588.0784  30.0105   588.0784  30.0105   588.0784  30.0105      242.0      6.2      242.0        6.2     0.0     0.0 
1 1 1   16   16   70 f     78.0   21.8   74.7070  29.3720    74.7070  29.3720    74.7070  29.3720       78.0     21.8       78.0       21.8     0.0     0.0 
1 1 1   16   16   71 o    211.3    7.1  449.5192  30.0105   449.5192  30.0105   449.5192  30.0105      211.3      7.1      211.3        7.1     0.0     0.0 
1 1 1   16   16   72 o     54.1   25.4   44.6965  30.6490    44.6965  30.6490    44.6965  30.6490       54.1     25.4       54.1       25.4     0.0     0.0 
1 1 1   16   16   73 o     18.2   13.5  -70.2374  30.0105   -70.2374  30.0105   -70.2374  30.0105       18.2     13.5       18.2       13.5     0.0     0.0 
1 1 1   16   16   74 o    233.1    6.4  546.5745  30.0105   546.5745  30.0105   546.5745  30.0105      233.1      6.4      233.1        6.4     0.0     0.0 
1 1 1   16   16   75 o    158.3    9.3  255.4086  29.3720   255.4086  29.3720   255.4086  29.3720      158.3      9.3      158.3        9.3     0.0     0.0 
1 1 1   17    0    0 o    442.6    3.8 1958.9843  33.2031  1958.9843  33.2031  1958.9843  33.2031      442.6      3.8      442.6        3.8     0.0     0.0 
1 1 1   17    0    1 o    773.0    3.9 5975.2852  60.0210  5975.2852  60.0210  5975.2852  60.0210      773.0      3.9      773.0        3.9     0.0     0.0 
1 1 1   17    0    2 f   1046.4    5.0 10950.6455 105.3561 10950.6455 105.3561 10950.6455 105.3561     1046.4      5.0     1046.4        5.0     0.0     0.0 
1 1 1   17    0    3 o   1807.4    8.3 32673.7910 300.7437 32673.7910 300.7437 32673.7910 300.7437     1807.4      8.3     1807.4        8.3     0.0     0.0 
1 1 1   17    0    4 o   1094.7    5.2 11984.4121 114.2954 11984.4121 114.2954 11984.4121 114.2954     1094.7      5.2     1094.7        5.2     0.0     0.0 
1 1 1   17    0    5 o    812.5    4.0 6602.3135  65.7677  6602.3135  65.7677  6602.3135  65.7677      812.5      4.0      812.5        4.0     0.0     0.0 
1 1 1   17    0    6 o    802.3    4.1 6436.9365  65.1292  6436.9365  65.1292  6436.9365  65.1292      802.3      4.1      802.3        4.1     0.0     0.0 
1 1 1   17    0    7 o    658.5    3.3 4336.2002  44.0580  4336.2002  44.0580  4336.2002  44.0580      658.5      3.3      658.5        3.3     0.0     0.0 
1 1 1   17    0    8 o   1424.8    6.7 20303.0723 189.6409 20303.0723 189.6409 20303.0723 189.6409     1424.8      6.7     1424.8        6.7     0.0     0.0 
1 1 1   17    0    9 o    492.6    2.8 2426.3821  27.4564  2426.3821  27.4564  2426.3821  27.4564      492.6      2.8      492.6        2.8     0.0     0.0 
1 1 1   17    0   10 o   1231.6    5.8 15169.9971 143.0288 15169.9971 143.0288 15169.9971 143.0288     1231.6      5.8     1231.6        5.8     0.0     0.0 
1 1 1   17    0   11 f    861.5    4.3 7422.1758  73.4300  7422.1758  73.4300  7422.1758  73.4300      861.5      4.3      861.5        4.3     0.0     0.0 
1 1 1   17    0   12 o    139.9    2.7  196.0261   7.6623   196.0261   7.6623   196.0261   7.6623      139.9      2.7      139.9        2.7     0.0     0.0 
1 1 1   17    0   13 o   1590.0    7.4 25286.7324 234.3374 25286.7324 234.3374 25286.7324 234.3374     1590.0      7.4     1590.0        7.4     0.0     0.0 
1 1 1   17    0   14 o    977.3    4.5 9552.9219  88.7545  9552.9219  88.7545  9552.9219  88.7545      977.3      4.5      977.3        4.5     0.0     0.0 
1 1 1   17    0   15 o    789.8    4.0 6238.9946  63.8522  6238.9946  63.8522  6238.9946  63.8522      789.8      4.0      789.8        4.0     0.0     0.0 
1 1 1   17    0   16 o    615.0    3.3 3782.6023  40.2269  3782.6023  40.2269  3782.6023  40.2269      615.0      3.3      615.0        3.3     0.0     0.0 
1 1 1   17    0   17 o   1243.2    5.9 15457.9697 146.2215 15457.9697 146.2215 15457.9697 146.2215     1243.2      5.9     1243.2        5.9     0.0     0.0 
1 1 1   17    0   18 o    246.0    2.6  605.3185  12.7704   605.3185  12.7704   605.3185  12.7704      246.0      2.6      246.0        2.6     0.0     0.0 
1 1 1   17    0   19 o   1390.8    6.6 19346.5664 182.6172 19346.5664 182.6172 19346.5664 182.6172     1390.8      6.6     1390.8        6.6     0.0     0.0 
1 1 1   17    0   20 o    925.7    5.0 8570.2373  92.5856  8570.2373  92.5856  8570.2373  92.5856      925.7      5.0      925.7        5.0     0.0     0.0 
1 1 1   17    0   21 o    609.1    3.5 3710.4490  42.7809  3710.4490  42.7809  3710.4490  42.7809      609.1      3.5      609.1        3.5     0.0     0.0 
1 1 1   17    0   22 o   2307.8   10.5 53272.4961 483.3608 53272.4961 483.3608 53272.4961 483.3608     2307.8     10.5     2307.8       10.5     0.0     0.0 
1 1 1   17    0   23 f    167.5    3.8  280.9495  12.7704   280.9495  12.7704   280.9495  12.7704      167.5      3.8      167.5        3.8     0.0     0.0 
1 1 1   17    0   24 o   2374.6   10.8 56401.2500 514.0099 56401.2500 514.0099 56401.2500 514.0099     2374.6     10.8     2374.6       10.8     0.0     0.0 
1 1 1   17    0   25 o   1675.7    7.8 28084.0957 261.7939 28084.0957 261.7939 28084.0957 261.7939     1675.7      7.8     1675.7        7.8     0.0     0.0 
1 1 1   17    0   26 o   1047.6    5.2 10974.9102 109.8257 10974.9102 109.8257 10974.9102 109.8257     1047.6      5.2     1047.6        5.2     0.0     0.0 
1 1 1   17    0   27 o    875.8    4.4 7671.1992  77.2611  7671.1992  77.2611  7671.1992  77.2611      875.8      4.4      875.8        4.4     0.0     0.0 
1 1 1   17    0   28 o    815.0    4.4 6643.1792  72.1529  6643.1792  72.1529  6643.1792  72.1529      815.0      4.4      815.0        4.4     0.0     0.0 
1 1 1   17    0   29 o    444.1    3.2 1972.3933  28.0950  1972.3933  28.0950  1972.3933  28.0950      444.1      3.2      444.1        3.2     0.0     0.0 
1 1 1   17    0   30 o   1731.0    8.4 29968.3730 289.8888 29968.3730 289.8888 29968.3730 289.8888     1731.0      8.4     1731.0        8.4     0.0     0.0 
1 1 1   17    0   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    0   32 o    324.3    3.6 1052.2837  23.6253  1052.2837  23.6253  1052.2837  23.6253      324.3      3.6      324.3        3.6     0.0     0.0 
1 1 1   17    0   33 o    434.6    3.4 1888.7469  29.3720  1888.7469  29.3720  1888.7469  29.3720      434.6      3.4      434.6        3.4     0.0     0.0 
1 1 1   17    0   34 o     23.6   16.6  -28.0950  28.7335   -28.0950  28.7335   -28.0950  28.7335       23.6     16.6       23.6       16.6     0.0     0.0 
1 1 1   17    0   35 o    358.6    3.6 1286.6211  25.5409  1286.6211  25.5409  1286.6211  25.5409      358.6      3.6      358.6        3.6     0.0     0.0 
1 1 1   17    0   36 o     18.0   13.2  -54.2743  26.1794   -54.2743  26.1794   -54.2743  26.1794       18.0     13.2       18.0       13.2     0.0     0.0 
1 1 1   17    0   37 o   1009.6    5.3 10195.2744 106.6331 10195.2744 106.6331 10195.2744 106.6331     1009.6      5.3     1009.6        5.3     0.0     0.0 
1 1 1   17    0   38 o    623.0    3.9 3882.2114  49.1662  3882.2114  49.1662  3882.2114  49.1662      623.0      3.9      623.0        3.9     0.0     0.0 
1 1 1   17    0   39 o     31.2   23.2 -314.1526 104.7175  -314.1526 104.7175  -314.1526 104.7175       31.2     23.2       31.2       23.2     0.0     0.0 
1 1 1   17    0   40 o   1026.9    5.5 10547.1006 113.6568 10547.1006 113.6568 10547.1006 113.6568     1026.9      5.5     1026.9        5.5     0.0     0.0 
1 1 1   17    0   41 o    895.8    4.8 8026.2168  86.2004  8026.2168  86.2004  8026.2168  86.2004      895.8      4.8      895.8        4.8     0.0     0.0 
1 1 1   17    0   42 f    294.5    6.4  868.3894  37.6728   868.3894  37.6728   868.3894  37.6728      294.5      6.4      294.5        6.4     0.0     0.0 
1 1 1   17    0   43 o   1064.1    5.6 11325.4580 118.7650 11325.4580 118.7650 11325.4580 118.7650     1064.1      5.6     1064.1        5.6     0.0     0.0 
1 1 1   17    0   44 o    459.0    4.2 2107.7600  38.3113  2107.7600  38.3113  2107.7600  38.3113      459.0      4.2      459.0        4.2     0.0     0.0 
1 1 1   17    0   45 o    909.7    5.0 8276.5166  90.6701  8276.5166  90.6701  8276.5166  90.6701      909.7      5.0      909.7        5.0     0.0     0.0 
1 1 1   17    0   46 o    794.6    4.8 6315.6172  75.9841  6315.6172  75.9841  6315.6172  75.9841      794.6      4.8      794.6        4.8     0.0     0.0 
1 1 1   17    0   47 o    960.4    5.2 9225.9990  99.6094  9225.9990  99.6094  9225.9990  99.6094      960.4      5.2      960.4        5.2     0.0     0.0 
1 1 1   17    0   48 o    872.5    4.7 7615.0088  81.7308  7615.0088  81.7308  7615.0088  81.7308      872.5      4.7      872.5        4.7     0.0     0.0 
1 1 1   17    0   49 o    591.7    4.3 3501.6528  50.4432  3501.6528  50.4432  3501.6528  50.4432      591.7      4.3      591.7        4.3     0.0     0.0 
1 1 1   17    0   50 o    208.1    6.9  434.8332  28.7335   434.8332  28.7335   434.8332  28.7335      208.1      6.9      208.1        6.9     0.0     0.0 
1 1 1   17    0   51 o    116.6   11.1  139.8362  25.5409   139.8362  25.5409   139.8362  25.5409      116.6     11.1      116.6       11.1     0.0     0.0 
1 1 1   17    0   52 o    368.1    4.9 1356.2198  35.7572  1356.2198  35.7572  1356.2198  35.7572      368.1      4.9      368.1        4.9     0.0     0.0 
1 1 1   17    0   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    0   54 o    139.4    9.5  197.3032  26.1794   197.3032  26.1794   197.3032  26.1794      139.4      9.5      139.4        9.5     0.0     0.0 
1 1 1   17    0   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    0   56 o    463.3    4.0 2147.3481  37.0343  2147.3481  37.0343  2147.3481  37.0343      463.3      4.0      463.3        4.0     0.0     0.0 
1 1 1   17    0   57 o    152.0    8.0  233.0604  24.2638   233.0604  24.2638   233.0604  24.2638      152.0      8.0      152.0        8.0     0.0     0.0 
1 1 1   17    0   58 o    631.8    4.3 3993.9529  54.2743  3993.9529  54.2743  3993.9529  54.2743      631.8      4.3      631.8        4.3     0.0     0.0 
1 1 1   17    0   59 o    332.2    4.3 1104.6425  28.7335  1104.6425  28.7335  1104.6425  28.7335      332.2      4.3      332.2        4.3     0.0     0.0 
1 1 1   17    0   60 o     22.2   16.0  -42.1424  30.6490   -42.1424  30.6490   -42.1424  30.6490       22.2     16.0       22.2       16.0     0.0     0.0 
1 1 1   17    0   61 o    454.1    4.1 2063.7019  37.0343  2063.7019  37.0343  2063.7019  37.0343      454.1      4.1      454.1        4.1     0.0     0.0 
1 1 1   17    0   62 o    236.8    5.7  561.8990  26.8179   561.8990  26.8179   561.8990  26.8179      236.8      5.7      236.8        5.7     0.0     0.0 
1 1 1   17    0   63 o    359.1    4.4 1290.4523  31.2876  1290.4523  31.2876  1290.4523  31.2876      359.1      4.4      359.1        4.4     0.0     0.0 
1 1 1   17    0   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    0   65 o    484.5    3.8 2348.4824  36.3957  2348.4824  36.3957  2348.4824  36.3957      484.5      3.8      484.5        3.8     0.0     0.0 
1 1 1   17    0   66 o     15.7   11.7  -98.9709  29.3720   -98.9709  29.3720   -98.9709  29.3720       15.7     11.7       15.7       11.7     0.0     0.0 
1 1 1   17    0   67 o     15.6   11.6  -83.0078  26.8179   -83.0078  26.8179   -83.0078  26.8179       15.6     11.6       15.6       11.6     0.0     0.0 
1 1 1   17    0   68 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    0   69 o    114.6   14.0  137.9207  31.2876   137.9207  31.2876   137.9207  31.2876      114.6     14.0      114.6       14.0     0.0     0.0 
1 1 1   17    0   70 o     31.7   20.6    0.0000  30.6490     0.0000  30.6490     0.0000  30.6490       31.7     20.6       31.7       20.6     0.0     0.0 
1 1 1   17    0   71 o     22.7   16.2  -33.8416  29.3720   -33.8416  29.3720   -33.8416  29.3720       22.7     16.2       22.7       16.2     0.0     0.0 
1 1 1   17    0   72 o    187.8    8.2  355.6566  30.6490   355.6566  30.6490   355.6566  30.6490      187.8      8.2      187.8        8.2     0.0     0.0 
1 1 1   17    0   73 o     23.6   16.7  -30.6490  30.0105   -30.6490  30.0105   -30.6490  30.0105       23.6     16.7       23.6       16.7     0.0     0.0 
1 1 1   17    0   74 o    142.2   10.7  206.8810  30.0105   206.8810  30.0105   206.8810  30.0105      142.2     10.7      142.2       10.7     0.0     0.0 
1 1 1   17    0   75 o     25.2   17.5  -21.0712  29.3720   -21.0712  29.3720   -21.0712  29.3720       25.2     17.5       25.2       17.5     0.0     0.0 
1 1 1   17    0   76 o     63.0   26.7   58.1055  33.8416    58.1055  33.8416    58.1055  33.8416       63.0     26.7       63.0       26.7     0.0     0.0 
1 1 1   17    0   77 o     20.8   15.1  -56.8284  31.9261   -56.8284  31.9261   -56.8284  31.9261       20.8     15.1       20.8       15.1     0.0     0.0 
1 1 1   17    0   78 o     46.8   24.4   33.8416  29.3720    33.8416  29.3720    33.8416  29.3720       46.8     24.4       46.8       24.4     0.0     0.0 
1 1 1   17    0   79 o    206.3    8.7  431.0021  35.7572   431.0021  35.7572   431.0021  35.7572      206.3      8.7      206.3        8.7     0.0     0.0 
1 1 1   17    0   80 o     41.6   23.9   24.9023  31.2876    24.9023  31.2876    24.9023  31.2876       41.6     23.9       41.6       23.9     0.0     0.0 
1 1 1   17    1    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    1    1 o    221.7    1.4    0.0000   0.0000          ?        ?   491.6617   6.3852          ?        ?      221.7        1.4       ?       ? 
1 1 1   17    1    2 o    283.3    1.5    0.0000   0.0000          ?        ?   802.6216   8.3008          ?        ?      283.3        1.5       ?       ? 
1 1 1   17    1    3 o    916.1    3.2    0.0000   0.0000          ?        ?  8392.7285  58.1055          ?        ?      916.1        3.2       ?       ? 
1 1 1   17    1    4 o   1077.9    3.7    0.0000   0.0000          ?        ? 11619.8164  79.1767          ?        ?     1077.9        3.7       ?       ? 
1 1 1   17    1    5 o    415.2    1.8    0.0000   0.0000          ?        ?  1724.0084  14.6860          ?        ?      415.2        1.8       ?       ? 
1 1 1   17    1    6 o    634.7    2.4    0.0000   0.0000          ?        ?  4029.0715  30.0105          ?        ?      634.7        2.4       ?       ? 
1 1 1   17    1    7 o   1324.5    4.4    0.0000   0.0000          ?        ? 17544.0215 116.8494          ?        ?     1324.5        4.4       ?       ? 
1 1 1   17    1    8 f    469.1    1.8    0.0000   0.0000          ?        ?  2200.9841  17.2401          ?        ?      469.1        1.8       ?       ? 
1 1 1   17    1    9 f    703.4    2.5    0.0000   0.0000          ?        ?  4947.9043  35.7572          ?        ?      703.4        2.5       ?       ? 
1 1 1   17    1   10 o    350.2    1.6    0.0000   0.0000          ?        ?  1226.6001  11.4934          ?        ?      350.2        1.6       ?       ? 
1 1 1   17    1   11 o    733.1    2.7    0.0000   0.0000          ?        ?  5374.4365  38.9498          ?        ?      733.1        2.7       ?       ? 
1 1 1   17    1   12 o    729.9    2.6    0.0000   0.0000          ?        ?  5327.8247  38.3113          ?        ?      729.9        2.6       ?       ? 
1 1 1   17    1   13 o    578.5    2.2    0.0000   0.0000          ?        ?  3347.1304  25.5409          ?        ?      578.5        2.2       ?       ? 
1 1 1   17    1   14 o   1437.6    4.8    0.0000   0.0000          ?        ? 20669.5840 136.6436          ?        ?     1437.6        4.8       ?       ? 
1 1 1   17    1   15 o    228.8    1.7    0.0000   0.0000          ?        ?   523.5877   7.6623          ?        ?      228.8        1.7       ?       ? 
1 1 1   17    1   16 o    510.3    2.1    0.0000   0.0000          ?        ?  2604.5298  21.0712          ?        ?      510.3        2.1       ?       ? 
1 1 1   17    1   17 o    890.3    3.1    0.0000   0.0000          ?        ?  7926.6074  55.5514          ?        ?      890.3        3.1       ?       ? 
1 1 1   17    1   18 o   1062.4    3.6    0.0000   0.0000          ?        ? 11288.4238  77.2611          ?        ?     1062.4        3.6       ?       ? 
1 1 1   17    1   19 o    575.5    2.4    0.0000   0.0000          ?        ?  3312.0117  27.4564          ?        ?      575.5        2.4       ?       ? 
1 1 1   17    1   20 o    786.6    3.0    0.0000   0.0000          ?        ?  6187.2744  46.6121          ?        ?      786.6        3.0       ?       ? 
1 1 1   17    1   21 o    791.1    2.9    0.0000   0.0000          ?        ?  6258.7891  45.3350          ?        ?      791.1        2.9       ?       ? 
1 1 1   17    1   22 o    649.9    2.5    0.0000   0.0000          ?        ?  4223.1821  32.5646          ?        ?      649.9        2.5       ?       ? 
1 1 1   17    1   23 o   1002.9    3.8    0.0000   0.0000          ?        ? 10059.2695  75.9841          ?        ?     1002.9        3.8       ?       ? 
1 1 1   17    1   24 o    358.1    2.1    0.0000   0.0000          ?        ?  1282.1515  15.3245          ?        ?      358.1        2.1       ?       ? 
1 1 1   17    1   25 o   1028.8    3.6    0.0000   0.0000          ?        ? 10584.1348  74.0685          ?        ?     1028.8        3.6       ?       ? 
1 1 1   17    1   26 o    875.2    3.1    0.0000   0.0000          ?        ?  7660.3438  54.9129          ?        ?      875.2        3.1       ?       ? 
1 1 1   17    1   27 o   1024.0    4.0    0.0000   0.0000          ?        ? 10485.8018  81.0922          ?        ?     1024.0        4.0       ?       ? 
1 1 1   17    1   28 o   1386.2    4.7    0.0000   0.0000          ?        ? 19216.3086 130.2584          ?        ?     1386.2        4.7       ?       ? 
1 1 1   17    1   29 o   1154.2    4.1    0.0000   0.0000          ?        ? 13322.1143  94.5012          ?        ?     1154.2        4.1       ?       ? 
1 1 1   17    1   30 o    984.8    3.7    0.0000   0.0000          ?        ?  9698.5049  73.4300          ?        ?      984.8        3.7       ?       ? 
1 1 1   17    1   31 o     58.2   11.9    0.0000   0.0000          ?        ?    35.1187  13.4090          ?        ?       58.2       11.9       ?       ? 
1 1 1   17    1   32 o   1220.4    4.3    0.0000   0.0000          ?        ? 14894.7939 105.3561          ?        ?     1220.4        4.3       ?       ? 
1 1 1   17    1   33 o    949.4    3.6    0.0000   0.0000          ?        ?  9014.0098  68.9603          ?        ?      949.4        3.6       ?       ? 
1 1 1   17    1   34 o   1086.7    4.1    0.0000   0.0000          ?        ? 11809.4570  88.7545          ?        ?     1086.7        4.1       ?       ? 
1 1 1   17    1   35 o    953.3    3.5    0.0000   0.0000          ?        ?  9087.4395  67.0448          ?        ?      953.3        3.5       ?       ? 
1 1 1   17    1   36 o   1365.6    4.7    0.0000   0.0000          ?        ? 18649.3008 129.6199          ?        ?     1365.6        4.7       ?       ? 
1 1 1   17    1   37 o    418.0    2.8    0.0000   0.0000          ?        ?  1746.9952  23.6253          ?        ?      418.0        2.8       ?       ? 
1 1 1   17    1   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    1   39 o   1031.3    3.9    0.0000   0.0000          ?        ? 10637.1318  79.8152          ?        ?     1031.3        3.9       ?       ? 
1 1 1   17    1   40 o   1068.1    3.9    0.0000   0.0000          ?        ? 11408.4658  82.3693          ?        ?     1068.1        3.9       ?       ? 
1 1 1   17    1   41 o    942.5    3.7    0.0000   0.0000          ?        ?  8883.1123  68.9603          ?        ?      942.5        3.7       ?       ? 
1 1 1   17    1   42 o   1315.4    4.5    0.0000   0.0000          ?        ? 17304.5762 118.7650          ?        ?     1315.4        4.5       ?       ? 
1 1 1   17    1   43 o    910.1    3.3    0.0000   0.0000          ?        ?  8282.9023  60.6596          ?        ?      910.1        3.3       ?       ? 
1 1 1   17    1   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    1   45 o    563.1    3.0    0.0000   0.0000          ?        ?  3171.5371  33.8416          ?        ?      563.1        3.0       ?       ? 
1 1 1   17    1   46 o    362.7    3.0    0.0000   0.0000          ?        ?  1315.9932  21.7097          ?        ?      362.7        3.0       ?       ? 
1 1 1   17    1   47 o    808.5    3.3    0.0000   0.0000          ?        ?  6537.8232  52.9973          ?        ?      808.5        3.3       ?       ? 
1 1 1   17    1   48 o    238.6    4.3    0.0000   0.0000          ?        ?   569.5613  20.4327          ?        ?      238.6        4.3       ?       ? 
1 1 1   17    1   49 o    468.5    2.7    0.0000   0.0000          ?        ?  2195.2373  25.5409          ?        ?      468.5        2.7       ?       ? 
1 1 1   17    1   50 o    402.2    2.9    0.0000   0.0000          ?        ?  1618.0138  23.6253          ?        ?      402.2        2.9       ?       ? 
1 1 1   17    1   51 o    241.0    4.1    0.0000   0.0000          ?        ?   581.0547  19.7942          ?        ?      241.0        4.1       ?       ? 
1 1 1   17    1   52 o    319.7    3.2    0.0000   0.0000          ?        ?  1022.2732  20.4327          ?        ?      319.7        3.2       ?       ? 
1 1 1   17    1   53 o    458.2    2.7    0.0000   0.0000          ?        ?  2099.4590  24.9023          ?        ?      458.2        2.7       ?       ? 
1 1 1   17    1   54 o    791.7    3.0    0.0000   0.0000          ?        ?  6269.6440  47.8891          ?        ?      791.7        3.0       ?       ? 
1 1 1   17    1   55 o     20.4   10.3    0.0000   0.0000          ?        ?   -60.6596  19.1556          ?        ?       20.4       10.3       ?       ? 
1 1 1   17    1   56 o    604.8    2.7    0.0000   0.0000          ?        ?  3658.0906  33.2031          ?        ?      604.8        2.7       ?       ? 
1 1 1   17    1   57 o    257.9    3.8    0.0000   0.0000          ?        ?   665.3395  19.7942          ?        ?      257.9        3.8       ?       ? 
1 1 1   17    1   58 o    167.7    5.3    0.0000   0.0000          ?        ?   281.5880  17.8786          ?        ?      167.7        5.3       ?       ? 
1 1 1   17    1   59 o    592.2    2.9    0.0000   0.0000          ?        ?  3508.0381  33.8416          ?        ?      592.2        2.9       ?       ? 
1 1 1   17    1   60 o    474.5    2.8    0.0000   0.0000          ?        ?  2252.0659  26.8179          ?        ?      474.5        2.8       ?       ? 
1 1 1   17    1   61 o    444.5    2.8    0.0000   0.0000          ?        ?  1976.8630  24.9023          ?        ?      444.5        2.8       ?       ? 
1 1 1   17    1   62 o    285.5    3.6    0.0000   0.0000          ?        ?   815.3921  20.4327          ?        ?      285.5        3.6       ?       ? 
1 1 1   17    1   63 o    203.4    4.9    0.0000   0.0000          ?        ?   414.4005  19.7942          ?        ?      203.4        4.9       ?       ? 
1 1 1   17    1   64 o    348.5    3.2    0.0000   0.0000          ?        ?  1215.1067  22.3483          ?        ?      348.5        3.2       ?       ? 
1 1 1   17    1   65 o    202.3    4.9    0.0000   0.0000          ?        ?   409.9309  19.7942          ?        ?      202.3        4.9       ?       ? 
1 1 1   17    1   66 o     32.3   14.7    0.0000   0.0000          ?        ?   -13.4090  21.0712          ?        ?       32.3       14.7       ?       ? 
1 1 1   17    1   67 o    225.6    4.7    0.0000   0.0000          ?        ?   509.5403  21.0712          ?        ?      225.6        4.7       ?       ? 
1 1 1   17    1   68 o    284.7    3.9    0.0000   0.0000          ?        ?   811.5610  22.3483          ?        ?      284.7        3.9       ?       ? 
1 1 1   17    1   69 o     59.0   17.0    0.0000   0.0000          ?        ?    36.3957  21.0712          ?        ?       59.0       17.0       ?       ? 
1 1 1   17    1   70 o    257.8    4.3    0.0000   0.0000          ?        ?   665.3395  22.3483          ?        ?      257.8        4.3       ?       ? 
1 1 1   17    1   71 o     20.0   10.1    0.0000   0.0000          ?        ?   -72.7915  20.4327          ?        ?       20.0       10.1       ?       ? 
1 1 1   17    1   72 o     33.4   15.1    0.0000   0.0000          ?        ?   -11.4934  21.7097          ?        ?       33.4       15.1       ?       ? 
1 1 1   17    1   73 o    165.3    6.6    0.0000   0.0000          ?        ?   274.5643  21.7097          ?        ?      165.3        6.6       ?       ? 
1 1 1   17    1   74 o     38.8   16.5    0.0000   0.0000          ?        ?     1.2770  22.3483          ?        ?       38.8       16.5       ?       ? 
1 1 1   17    1   75 o    291.5    3.9    0.0000   0.0000          ?        ?   851.1494  22.9868          ?        ?      291.5        3.9       ?       ? 
1 1 1   17    1   76 o    118.7    9.1    0.0000   0.0000          ?        ?   142.3903  21.7097          ?        ?      118.7        9.1       ?       ? 
1 1 1   17    1   77 o     31.4   14.4    0.0000   0.0000          ?        ?   -15.3245  21.0712          ?        ?       31.4       14.4       ?       ? 
1 1 1   17    1   78 o    186.3    6.0    0.0000   0.0000          ?        ?   349.2713  22.3483          ?        ?      186.3        6.0       ?       ? 
1 1 1   17    1   79 o     35.3   15.5    0.0000   0.0000          ?        ?    -3.8311  21.0712          ?        ?       35.3       15.5       ?       ? 
1 1 1   17    2    0 o    314.2    2.3  987.1545  14.6860   987.1545  14.6860   987.1545  14.6860      314.2      2.3      314.2        2.3     0.0     0.0 
1 1 1   17    2    1 o    880.3    3.1    0.0000   0.0000          ?        ?  7750.3760  54.9129          ?        ?      880.3        3.1       ?       ? 
1 1 1   17    2    2 o     79.9    2.4    0.0000   0.0000          ?        ?    63.8522   3.8311          ?        ?       79.9        2.4       ?       ? 
1 1 1   17    2    3 o    181.2    1.4    0.0000   0.0000          ?        ?   328.2001   5.1082          ?        ?      181.2        1.4       ?       ? 
1 1 1   17    2    4 o    511.4    2.0    0.0000   0.0000          ?        ?  2615.3845  20.4327          ?        ?      511.4        2.0       ?       ? 
1 1 1   17    2    5 f   1096.1    3.7    0.0000   0.0000          ?        ? 12015.7002  81.0922          ?        ?     1096.1        3.7       ?       ? 
1 1 1   17    2    6 o   1355.6    4.5    0.0000   0.0000          ?        ? 18379.2051 122.5962          ?        ?     1355.6        4.5       ?       ? 
1 1 1   17    2    7 o    818.3    2.9    0.0000   0.0000          ?        ?  6696.8149  47.2506          ?        ?      818.3        2.9       ?       ? 
1 1 1   17    2    8 o    558.1    2.2    0.0000   0.0000          ?        ?  3115.3469  24.2638          ?        ?      558.1        2.2       ?       ? 
1 1 1   17    2    9 o   1095.0    3.7    0.0000   0.0000          ?        ? 11990.1592  81.7308          ?        ?     1095.0        3.7       ?       ? 
1 1 1   17    2   10 o    392.0    1.7    0.0000   0.0000          ?        ?  1536.2831  13.4090          ?        ?      392.0        1.7       ?       ? 
1 1 1   17    2   11 f   1827.0    6.0    0.0000   0.0000          ?        ? 33385.7422 218.3744          ?        ?     1827.0        6.0       ?       ? 
1 1 1   17    2   12 o   1558.5    5.1    0.0000   0.0000          ?        ? 24293.8320 158.9919          ?        ?     1558.5        5.1       ?       ? 
1 1 1   17    2   13 f   1137.3    3.8    0.0000   0.0000          ?        ? 12936.4482  87.4775          ?        ?     1137.3        3.8       ?       ? 
1 1 1   17    2   14 o    833.1    3.0    0.0000   0.0000          ?        ?  6941.3687  50.4432          ?        ?      833.1        3.0       ?       ? 
1 1 1   17    2   15 o   1064.1    3.6    0.0000   0.0000          ?        ? 11324.8193  77.2611          ?        ?     1064.1        3.6       ?       ? 
1 1 1   17    2   16 o    715.5    2.6    0.0000   0.0000          ?        ?  5119.0278  37.0343          ?        ?      715.5        2.6       ?       ? 
1 1 1   17    2   17 o    673.3    2.5    0.0000   0.0000          ?        ?  4532.8652  33.8416          ?        ?      673.3        2.5       ?       ? 
1 1 1   17    2   18 o    800.7    2.9    0.0000   0.0000          ?        ?  6410.7573  46.6121          ?        ?      800.7        2.9       ?       ? 
1 1 1   17    2   19 f   1472.0    5.0    0.0000   0.0000          ?        ? 21670.7852 147.4985          ?        ?     1472.0        5.0       ?       ? 
1 1 1   17    2   20 o    752.7    2.8    0.0000   0.0000          ?        ?  5665.6025  42.1424          ?        ?      752.7        2.8       ?       ? 
1 1 1   17    2   21 o   1220.5    4.2    0.0000   0.0000          ?        ? 14896.7100 101.5249          ?        ?     1220.5        4.2       ?       ? 
1 1 1   17    2   22 o    470.0    2.1    0.0000   0.0000          ?        ?  2208.6462  19.7942          ?        ?      470.0        2.1       ?       ? 
1 1 1   17    2   23 o   2287.4    7.9    0.0000   0.0000          ?        ? 52332.5977 360.1262          ?        ?     2287.4        7.9       ?       ? 
1 1 1   17    2   24 o    191.3    3.0    0.0000   0.0000          ?        ?   365.8729  11.4934          ?        ?      191.3        3.0       ?       ? 
1 1 1   17    2   25 o    394.5    2.1    0.0000   0.0000          ?        ?  1556.0771  16.6016          ?        ?      394.5        2.1       ?       ? 
1 1 1   17    2   26 o   1105.5    4.0    0.0000   0.0000          ?        ? 12221.3037  88.1160          ?        ?     1105.5        4.0       ?       ? 
1 1 1   17    2   27 o    701.1    2.7    0.0000   0.0000          ?        ?  4915.9780  37.6728          ?        ?      701.1        2.7       ?       ? 
1 1 1   17    2   28 f   1701.9    6.1    0.0000   0.0000          ?        ? 28967.1719 208.7966          ?        ?     1701.9        6.1       ?       ? 
1 1 1   17    2   29 o   2229.4    7.5    0.0000   0.0000          ?        ? 49710.1875 335.2238          ?        ?     2229.4        7.5       ?       ? 
1 1 1   17    2   30 o    691.1    2.8    0.0000   0.0000          ?        ?  4776.7803  38.9498          ?        ?      691.1        2.8       ?       ? 
1 1 1   17    2   31 o    561.9    2.6    0.0000   0.0000          ?        ?  3157.4895  28.7335          ?        ?      561.9        2.6       ?       ? 
1 1 1   17    2   32 o    782.2    3.2    0.0000   0.0000          ?        ?  6118.9526  50.4432          ?        ?      782.2        3.2       ?       ? 
1 1 1   17    2   33 o    500.7    2.4    0.0000   0.0000          ?        ?  2506.8359  24.2638          ?        ?      500.7        2.4       ?       ? 
1 1 1   17    2   34 o    811.0    3.2    0.0000   0.0000          ?        ?  6577.4111  52.3588          ?        ?      811.0        3.2       ?       ? 
1 1 1   17    2   35 f    640.4    2.9    0.0000   0.0000          ?        ?  4101.8633  37.6728          ?        ?      640.4        2.9       ?       ? 
1 1 1   17    2   36 f    332.7    2.5    0.0000   0.0000          ?        ?  1107.1964  16.6016          ?        ?      332.7        2.5       ?       ? 
1 1 1   17    2   37 f    357.5    3.0    0.0000   0.0000          ?        ?  1278.3203  21.7097          ?        ?      357.5        3.0       ?       ? 
1 1 1   17    2   38 o   1339.2    4.7    0.0000   0.0000          ?        ? 17935.4336 127.0658          ?        ?     1339.2        4.7       ?       ? 
1 1 1   17    2   39 o    451.6    2.8    0.0000   0.0000          ?        ?  2039.4380  25.5409          ?        ?      451.6        2.8       ?       ? 
1 1 1   17    2   40 o   1109.6    4.0    0.0000   0.0000          ?        ? 12313.8896  88.1160          ?        ?     1109.6        4.0       ?       ? 
1 1 1   17    2   41 f    544.5    2.9    0.0000   0.0000          ?        ?  2964.6558  31.9261          ?        ?      544.5        2.9       ?       ? 
1 1 1   17    2   42 o    824.7    3.2    0.0000   0.0000          ?        ?  6801.5322  52.3588          ?        ?      824.7        3.2       ?       ? 
1 1 1   17    2   43 o    482.1    3.1    0.0000   0.0000          ?        ?  2324.2188  30.0105          ?        ?      482.1        3.1       ?       ? 
1 1 1   17    2   44 o    941.4    3.5    0.0000   0.0000          ?        ?  8863.3184  65.7677          ?        ?      941.4        3.5       ?       ? 
1 1 1   17    2   45 f    752.4    3.1    0.0000   0.0000          ?        ?  5661.1328  45.9736          ?        ?      752.4        3.1       ?       ? 
1 1 1   17    2   46 o   1352.9    4.7    0.0000   0.0000          ?        ? 18306.4141 127.0658          ?        ?     1352.9        4.7       ?       ? 
1 1 1   17    2   47 o    672.6    2.9    0.0000   0.0000          ?        ?  4523.9258  38.9498          ?        ?      672.6        2.9       ?       ? 
1 1 1   17    2   48 o    630.3    2.7    0.0000   0.0000          ?        ?  3972.8816  33.8416          ?        ?      630.3        2.7       ?       ? 
1 1 1   17    2   49 o    521.5    2.8    0.0000   0.0000          ?        ?  2719.4636  28.7335          ?        ?      521.5        2.8       ?       ? 
1 1 1   17    2   50 o    393.6    2.8    0.0000   0.0000          ?        ?  1549.6920  22.3483          ?        ?      393.6        2.8       ?       ? 
1 1 1   17    2   51 o     85.2   10.5    0.0000   0.0000          ?        ?    72.7915  17.8786          ?        ?       85.2       10.5       ?       ? 
1 1 1   17    2   52 o    635.8    2.9    0.0000   0.0000          ?        ?  4043.7573  37.0343          ?        ?      635.8        2.9       ?       ? 
1 1 1   17    2   53 o     26.7   12.8    0.0000   0.0000          ?        ?   -26.1794  19.1556          ?        ?       26.7       12.8       ?       ? 
1 1 1   17    2   54 o    182.1    5.4    0.0000   0.0000          ?        ?   332.0312  19.7942          ?        ?      182.1        5.4       ?       ? 
1 1 1   17    2   55 o    279.4    3.5    0.0000   0.0000          ?        ?   780.9120  19.7942          ?        ?      279.4        3.5       ?       ? 
1 1 1   17    2   56 o    283.5    3.5    0.0000   0.0000          ?        ?   803.8987  19.7942          ?        ?      283.5        3.5       ?       ? 
1 1 1   17    2   57 f    604.3    2.8    0.0000   0.0000          ?        ?  3652.9822  33.8416          ?        ?      604.3        2.8       ?       ? 
1 1 1   17    2   58 o    416.6    2.8    0.0000   0.0000          ?        ?  1736.1403  23.6253          ?        ?      416.6        2.8       ?       ? 
1 1 1   17    2   59 o    253.6    3.9    0.0000   0.0000          ?        ?   643.6298  19.7942          ?        ?      253.6        3.9       ?       ? 
1 1 1   17    2   60 o    235.8    4.1    0.0000   0.0000          ?        ?   556.1523  19.1556          ?        ?      235.8        4.1       ?       ? 
1 1 1   17    2   61 o    186.3    5.5    0.0000   0.0000          ?        ?   347.3558  20.4327          ?        ?      186.3        5.5       ?       ? 
1 1 1   17    2   62 o     67.2   14.2    0.0000   0.0000          ?        ?    47.2506  18.5171          ?        ?       67.2       14.2       ?       ? 
1 1 1   17    2   63 o    391.1    2.9    0.0000   0.0000          ?        ?  1530.5364  22.9868          ?        ?      391.1        2.9       ?       ? 
1 1 1   17    2   64 o    469.6    2.8    0.0000   0.0000          ?        ?  2206.0923  26.1794          ?        ?      469.6        2.8       ?       ? 
1 1 1   17    2   65 o     22.1   11.0    0.0000   0.0000          ?        ?   -52.3588  19.7942          ?        ?       22.1       11.0       ?       ? 
1 1 1   17    2   66 o    294.3    3.7    0.0000   0.0000          ?        ?   867.1124  21.7097          ?        ?      294.3        3.7       ?       ? 
1 1 1   17    2   67 o     83.8   12.2    0.0000   0.0000          ?        ?    70.8759  20.4327          ?        ?       83.8       12.2       ?       ? 
1 1 1   17    2   68 o    184.5    5.7    0.0000   0.0000          ?        ?   340.9706  21.0712          ?        ?      184.5        5.7       ?       ? 
1 1 1   17    2   69 o    146.9    7.0    0.0000   0.0000          ?        ?   216.4588  20.4327          ?        ?      146.9        7.0       ?       ? 
1 1 1   17    2   70 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    2   71 o    170.9    6.2    0.0000   0.0000          ?        ?   293.0815  21.0712          ?        ?      170.9        6.2       ?       ? 
1 1 1   17    2   72 o     87.3   12.4    0.0000   0.0000          ?        ?    77.2611  21.7097          ?        ?       87.3       12.4       ?       ? 
1 1 1   17    2   73 o     97.2   11.5    0.0000   0.0000          ?        ?    95.7782  22.3483          ?        ?       97.2       11.5       ?       ? 
1 1 1   17    2   74 o    107.8   10.1    0.0000   0.0000          ?        ?   117.4880  21.7097          ?        ?      107.8       10.1       ?       ? 
1 1 1   17    2   75 o     50.1   17.0    0.0000   0.0000          ?        ?    24.2638  20.4327          ?        ?       50.1       17.0       ?       ? 
1 1 1   17    2   76 o    222.0    4.7    0.0000   0.0000          ?        ?   494.2158  21.0712          ?        ?      222.0        4.7       ?       ? 
1 1 1   17    2   77 o     28.5   13.5    0.0000   0.0000          ?        ?   -22.9868  20.4327          ?        ?       28.5       13.5       ?       ? 
1 1 1   17    2   78 o     24.3   12.0    0.0000   0.0000          ?        ?   -45.3350  21.0712          ?        ?       24.3       12.0       ?       ? 
1 1 1   17    2   79 o    249.7    4.5    0.0000   0.0000          ?        ?   625.7512  22.3483          ?        ?      249.7        4.5       ?       ? 
1 1 1   17    3    0 o    224.4    2.0  503.7936   8.9393   503.7936   8.9393   503.7936   8.9393      224.4      2.0      224.4        2.0     0.0     0.0 
1 1 1   17    3    1 o    818.8    2.9    0.0000   0.0000          ?        ?  6703.8389  47.2506          ?        ?      818.8        2.9       ?       ? 
1 1 1   17    3    2 o    343.8    1.6    0.0000   0.0000          ?        ?  1181.9036  10.8549          ?        ?      343.8        1.6       ?       ? 
1 1 1   17    3    3 o    749.1    2.7    0.0000   0.0000          ?        ?  5611.3281  40.8654          ?        ?      749.1        2.7       ?       ? 
1 1 1   17    3    4 o    268.4    1.5    0.0000   0.0000          ?        ?   720.2524   8.3008          ?        ?      268.4        1.5       ?       ? 
1 1 1   17    3    5 o   1199.9    4.0    0.0000   0.0000          ?        ? 14398.6631  97.0553          ?        ?     1199.9        4.0       ?       ? 
1 1 1   17    3    6 o    265.9    1.4    0.0000   0.0000          ?        ?   706.8434   7.6623          ?        ?      265.9        1.4       ?       ? 
1 1 1   17    3    7 o    828.8    2.9    0.0000   0.0000          ?        ?  6868.5767  48.5276          ?        ?      828.8        2.9       ?       ? 
1 1 1   17    3    8 o   1269.1    4.3    0.0000   0.0000          ?        ? 16107.3477 107.9102          ?        ?     1269.1        4.3       ?       ? 
1 1 1   17    3    9 o    368.4    1.7    0.0000   0.0000          ?        ?  1357.4971  12.7704          ?        ?      368.4        1.7       ?       ? 
1 1 1   17    3   10 o   1493.2    4.9    0.0000   0.0000          ?        ? 22300.3672 147.4985          ?        ?     1493.2        4.9       ?       ? 
1 1 1   17    3   11 o    731.5    2.7    0.0000   0.0000          ?        ?  5350.8110  38.9498          ?        ?      731.5        2.7       ?       ? 
1 1 1   17    3   12 o   1023.5    3.6    0.0000   0.0000          ?        ? 10476.8633  72.7915          ?        ?     1023.5        3.6       ?       ? 
1 1 1   17    3   13 o    647.5    2.5    0.0000   0.0000          ?        ?  4193.1714  31.9261          ?        ?      647.5        2.5       ?       ? 
1 1 1   17    3   14 o    250.3    1.7    0.0000   0.0000          ?        ?   626.3897   8.3008          ?        ?      250.3        1.7       ?       ? 
1 1 1   17    3   15 o   1433.1    4.8    0.0000   0.0000          ?        ? 20539.9648 137.2822          ?        ?     1433.1        4.8       ?       ? 
1 1 1   17    3   16 o    275.0    1.7    0.0000   0.0000          ?        ?   756.0096   9.5778          ?        ?      275.0        1.7       ?       ? 
1 1 1   17    3   17 o    411.2    1.9    0.0000   0.0000          ?        ?  1690.8052  15.3245          ?        ?      411.2        1.9       ?       ? 
1 1 1   17    3   18 o   1168.5    4.1    0.0000   0.0000          ?        ? 13655.4238  95.7782          ?        ?     1168.5        4.1       ?       ? 
1 1 1   17    3   19 o    436.3    2.1    0.0000   0.0000          ?        ?  1903.4330  18.5171          ?        ?      436.3        2.1       ?       ? 
1 1 1   17    3   20 o   1261.4    4.3    0.0000   0.0000          ?        ? 15913.2354 107.9102          ?        ?     1261.4        4.3       ?       ? 
1 1 1   17    3   21 o    767.6    2.9    0.0000   0.0000          ?        ?  5892.2773  44.0580          ?        ?      767.6        2.9       ?       ? 
1 1 1   17    3   22 o   1495.1    5.0    0.0000   0.0000          ?        ? 22354.0039 148.1370          ?        ?     1495.1        5.0       ?       ? 
1 1 1   17    3   23 o   1068.7    3.9    0.0000   0.0000          ?        ? 11421.8750  83.0078          ?        ?     1068.7        3.9       ?       ? 
1 1 1   17    3   24 o    264.5    2.2    0.0000   0.0000          ?        ?   699.8197  11.4934          ?        ?      264.5        2.2       ?       ? 
1 1 1   17    3   25 o    326.6    2.1    0.0000   0.0000          ?        ?  1066.9697  13.4090          ?        ?      326.6        2.1       ?       ? 
1 1 1   17    3   26 o   1142.1    4.2    0.0000   0.0000          ?        ? 13044.9971  96.4168          ?        ?     1142.1        4.2       ?       ? 
1 1 1   17    3   27 o   1349.8    4.8    0.0000   0.0000          ?        ? 18221.4922 130.2584          ?        ?     1349.8        4.8       ?       ? 
1 1 1   17    3   28 f   1236.9    4.3    0.0000   0.0000          ?        ? 15299.6172 107.2716          ?        ?     1236.9        4.3       ?       ? 
1 1 1   17    3   29 o   1460.7    5.2    0.0000   0.0000          ?        ? 21336.8398 151.9681          ?        ?     1460.7        5.2       ?       ? 
1 1 1   17    3   30 f    718.3    2.9    0.0000   0.0000          ?        ?  5159.2549  42.1424          ?        ?      718.3        2.9       ?       ? 
1 1 1   17    3   31 o   1294.6    4.5    0.0000   0.0000          ?        ? 16761.8320 116.2109          ?        ?     1294.6        4.5       ?       ? 
1 1 1   17    3   32 o   1274.5    4.4    0.0000   0.0000          ?        ? 16245.9062 113.0183          ?        ?     1274.5        4.4       ?       ? 
1 1 1   17    3   33 o   1613.9    5.7    0.0000   0.0000          ?        ? 26048.4902 183.2557          ?        ?     1613.9        5.7       ?       ? 
1 1 1   17    3   34 f   1784.0    6.0    0.0000   0.0000          ?        ? 31832.2168 214.5433          ?        ?     1784.0        6.0       ?       ? 
1 1 1   17    3   35 o   1094.8    3.9    0.0000   0.0000          ?        ? 11986.9668  85.5619          ?        ?     1094.8        3.9       ?       ? 
1 1 1   17    3   36 o    294.9    3.0    0.0000   0.0000          ?        ?   869.6664  17.8786          ?        ?      294.9        3.0       ?       ? 
1 1 1   17    3   37 o    297.3    3.0    0.0000   0.0000          ?        ?   883.7139  17.8786          ?        ?      297.3        3.0       ?       ? 
1 1 1   17    3   38 o   1132.1    3.9    0.0000   0.0000          ?        ? 12817.6836  89.3930          ?        ?     1132.1        3.9       ?       ? 
1 1 1   17    3   39 o    574.2    2.7    0.0000   0.0000          ?        ?  3296.6870  30.6490          ?        ?      574.2        2.7       ?       ? 
1 1 1   17    3   40 o    422.7    2.8    0.0000   0.0000          ?        ?  1786.5834  23.6253          ?        ?      422.7        2.8       ?       ? 
1 1 1   17    3   41 o    831.5    3.3    0.0000   0.0000          ?        ?  6913.9126  54.2743          ?        ?      831.5        3.3       ?       ? 
1 1 1   17    3   42 o    610.7    2.8    0.0000   0.0000          ?        ?  3729.6047  34.4802          ?        ?      610.7        2.8       ?       ? 
1 1 1   17    3   43 o    653.8    2.8    0.0000   0.0000          ?        ?  4274.2642  37.0343          ?        ?      653.8        2.8       ?       ? 
1 1 1   17    3   44 o    644.8    2.9    0.0000   0.0000          ?        ?  4158.0527  37.0343          ?        ?      644.8        2.9       ?       ? 
1 1 1   17    3   45 o    275.1    3.6    0.0000   0.0000          ?        ?   756.6481  19.7942          ?        ?      275.1        3.6       ?       ? 
1 1 1   17    3   46 o    411.6    2.8    0.0000   0.0000          ?        ?  1693.9978  22.9868          ?        ?      411.6        2.8       ?       ? 
1 1 1   17    3   47 o    702.9    2.9    0.0000   0.0000          ?        ?  4941.5190  40.8654          ?        ?      702.9        2.9       ?       ? 
1 1 1   17    3   48 o    472.1    3.0    0.0000   0.0000          ?        ?  2229.0791  28.0950          ?        ?      472.1        3.0       ?       ? 
1 1 1   17    3   49 o    759.3    3.0    0.0000   0.0000          ?        ?  5766.4888  45.9736          ?        ?      759.3        3.0       ?       ? 
1 1 1   17    3   50 o    454.3    2.7    0.0000   0.0000          ?        ?  2064.3403  24.9023          ?        ?      454.3        2.7       ?       ? 
1 1 1   17    3   51 o    183.0    5.1    0.0000   0.0000          ?        ?   335.2238  18.5171          ?        ?      183.0        5.1       ?       ? 
1 1 1   17    3   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    3   53 o    178.6    5.2    0.0000   0.0000          ?        ?   319.2608  18.5171          ?        ?      178.6        5.2       ?       ? 
1 1 1   17    3   54 o    316.7    3.4    0.0000   0.0000          ?        ?  1003.1175  21.7097          ?        ?      316.7        3.4       ?       ? 
1 1 1   17    3   55 f    473.8    2.8    0.0000   0.0000          ?        ?  2245.6807  26.1794          ?        ?      473.8        2.8       ?       ? 
1 1 1   17    3   56 o    348.0    3.3    0.0000   0.0000          ?        ?  1211.2755  22.9868          ?        ?      348.0        3.3       ?       ? 
1 1 1   17    3   57 o    218.3    4.4    0.0000   0.0000          ?        ?   476.9756  19.1556          ?        ?      218.3        4.4       ?       ? 
1 1 1   17    3   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    3   59 o    223.1    4.6    0.0000   0.0000          ?        ?   498.0469  20.4327          ?        ?      223.1        4.6       ?       ? 
1 1 1   17    3   60 o    506.1    2.7    0.0000   0.0000          ?        ?  2562.3872  27.4564          ?        ?      506.1        2.7       ?       ? 
1 1 1   17    3   61 f    209.0    4.6    0.0000   0.0000          ?        ?   437.3873  19.1556          ?        ?      209.0        4.6       ?       ? 
1 1 1   17    3   62 o    224.6    4.5    0.0000   0.0000          ?        ?   505.0706  20.4327          ?        ?      224.6        4.5       ?       ? 
1 1 1   17    3   63 o    184.2    5.2    0.0000   0.0000          ?        ?   339.6935  19.1556          ?        ?      184.2        5.2       ?       ? 
1 1 1   17    3   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    3   65 o    275.3    3.7    0.0000   0.0000          ?        ?   758.5637  20.4327          ?        ?      275.3        3.7       ?       ? 
1 1 1   17    3   66 o     29.8   13.7    0.0000   0.0000          ?        ?   -15.3245  19.1556          ?        ?       29.8       13.7       ?       ? 
1 1 1   17    3   67 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    3   68 o    440.8    3.0    0.0000   0.0000          ?        ?  1944.2983  26.1794          ?        ?      440.8        3.0       ?       ? 
1 1 1   17    3   69 o    384.9    3.1    0.0000   0.0000          ?        ?  1482.6472  23.6253          ?        ?      384.9        3.1       ?       ? 
1 1 1   17    3   70 o     27.6   13.2    0.0000   0.0000          ?        ?   -27.4564  20.4327          ?        ?       27.6       13.2       ?       ? 
1 1 1   17    3   71 f    239.5    4.7    0.0000   0.0000          ?        ?   574.6694  22.3483          ?        ?      239.5        4.7       ?       ? 
1 1 1   17    3   72 o     77.6   14.1    0.0000   0.0000          ?        ?    63.2136  21.0712          ?        ?       77.6       14.1       ?       ? 
1 1 1   17    3   73 o     83.9   12.2    0.0000   0.0000          ?        ?    71.5144  20.4327          ?        ?       83.9       12.2       ?       ? 
1 1 1   17    3   74 o    189.2    5.7    0.0000   0.0000          ?        ?   359.4877  21.7097          ?        ?      189.2        5.7       ?       ? 
1 1 1   17    3   75 o    110.0    9.9    0.0000   0.0000          ?        ?   122.5962  21.7097          ?        ?      110.0        9.9       ?       ? 
1 1 1   17    3   76 o    131.6    8.5    0.0000   0.0000          ?        ?   174.9549  22.3483          ?        ?      131.6        8.5       ?       ? 
1 1 1   17    3   77 o    178.9    5.9    0.0000   0.0000          ?        ?   321.8149  21.0712          ?        ?      178.9        5.9       ?       ? 
1 1 1   17    3   78 o    203.5    5.5    0.0000   0.0000          ?        ?   416.3161  22.3483          ?        ?      203.5        5.5       ?       ? 
1 1 1   17    3   79 o    228.6    4.7    0.0000   0.0000          ?        ?   524.8647  21.7097          ?        ?      228.6        4.7       ?       ? 
1 1 1   17    4    0 o    527.5    3.0 2782.6772  31.2876  2782.6772  31.2876  2782.6772  31.2876      527.5      3.0      527.5        3.0     0.0     0.0 
1 1 1   17    4    1 o    672.3    2.5    0.0000   0.0000          ?        ?  4519.4561  33.2031          ?        ?      672.3        2.5       ?       ? 
1 1 1   17    4    2 o    740.2    2.7    0.0000   0.0000          ?        ?  5479.7925  39.5883          ?        ?      740.2        2.7       ?       ? 
1 1 1   17    4    3 o    767.3    2.7    0.0000   0.0000          ?        ?  5887.8076  42.1424          ?        ?      767.3        2.7       ?       ? 
1 1 1   17    4    4 o    511.8    2.0    0.0000   0.0000          ?        ?  2619.2158  20.4327          ?        ?      511.8        2.0       ?       ? 
1 1 1   17    4    5 o   1121.2    3.8    0.0000   0.0000          ?        ? 12572.4912  85.5619          ?        ?     1121.2        3.8       ?       ? 
1 1 1   17    4    6 o    501.4    2.0    0.0000   0.0000          ?        ?  2513.8596  19.7942          ?        ?      501.4        2.0       ?       ? 
1 1 1   17    4    7 o    309.2    1.5    0.0000   0.0000          ?        ?   955.8669   9.5778          ?        ?      309.2        1.5       ?       ? 
1 1 1   17    4    8 o   1665.7    5.4    0.0000   0.0000          ?        ? 27750.7891 181.3401          ?        ?     1665.7        5.4       ?       ? 
1 1 1   17    4    9 o   1556.8    5.1    0.0000   0.0000          ?        ? 24238.9199 160.2689          ?        ?     1556.8        5.1       ?       ? 
1 1 1   17    4   10 f    420.0    1.9    0.0000   0.0000          ?        ?  1764.2352  15.9630          ?        ?      420.0        1.9       ?       ? 
1 1 1   17    4   11 o    514.5    2.1    0.0000   0.0000          ?        ?  2647.3108  21.7097          ?        ?      514.5        2.1       ?       ? 
1 1 1   17    4   12 o   1605.1    5.3    0.0000   0.0000          ?        ? 25766.2637 169.2082          ?        ?     1605.1        5.3       ?       ? 
1 1 1   17    4   13 o   1058.6    3.6    0.0000   0.0000          ?        ? 11206.6934  76.6226          ?        ?     1058.6        3.6       ?       ? 
1 1 1   17    4   14 o   1722.5    5.7    0.0000   0.0000          ?        ? 29675.2930 194.7491          ?        ?     1722.5        5.7       ?       ? 
1 1 1   17    4   15 o    801.2    2.9    0.0000   0.0000          ?        ?  6419.0576  45.9736          ?        ?      801.2        2.9       ?       ? 
1 1 1   17    4   16 o   1642.5    5.4    0.0000   0.0000          ?        ? 26980.0918 176.8705          ?        ?     1642.5        5.4       ?       ? 
1 1 1   17    4   17 o    583.4    2.4    0.0000   0.0000          ?        ?  3403.9587  27.4564          ?        ?      583.4        2.4       ?       ? 
1 1 1   17    4   18 o    539.8    2.2    0.0000   0.0000          ?        ?  2913.5742  23.6253          ?        ?      539.8        2.2       ?       ? 
1 1 1   17    4   19 f   1306.4    4.4    0.0000   0.0000          ?        ? 17068.9590 115.5724          ?        ?     1306.4        4.4       ?       ? 
1 1 1   17    4   20 o    335.2    1.9    0.0000   0.0000          ?        ?  1123.7981  12.7704          ?        ?      335.2        1.9       ?       ? 
1 1 1   17    4   21 o   1828.6    6.0    0.0000   0.0000          ?        ? 33442.5703 218.3744          ?        ?     1828.6        6.0       ?       ? 
1 1 1   17    4   22 o   1854.4    6.5    0.0000   0.0000          ?        ? 34394.6055 241.3612          ?        ?     1854.4        6.5       ?       ? 
1 1 1   17    4   23 o    664.5    2.6    0.0000   0.0000          ?        ?  4416.0156  35.1187          ?        ?      664.5        2.6       ?       ? 
1 1 1   17    4   24 o    744.1    2.8    0.0000   0.0000          ?        ?  5536.6211  41.5039          ?        ?      744.1        2.8       ?       ? 
1 1 1   17    4   25 f   1557.7    5.4    0.0000   0.0000          ?        ? 24266.3750 167.2927          ?        ?     1557.7        5.4       ?       ? 
1 1 1   17    4   26 o   1228.0    4.3    0.0000   0.0000          ?        ? 15080.6045 104.7175          ?        ?     1228.0        4.3       ?       ? 
1 1 1   17    4   27 o    397.5    2.1    0.0000   0.0000          ?        ?  1580.3411  16.6016          ?        ?      397.5        2.1       ?       ? 
1 1 1   17    4   28 f    166.8    3.4    0.0000   0.0000          ?        ?   278.3954  11.4934          ?        ?      166.8        3.4       ?       ? 
1 1 1   17    4   29 o   1460.0    5.0    0.0000   0.0000          ?        ? 21316.4062 145.5829          ?        ?     1460.0        5.0       ?       ? 
1 1 1   17    4   30 o    195.1    3.6    0.0000   0.0000          ?        ?   380.5589  14.0475          ?        ?      195.1        3.6       ?       ? 
1 1 1   17    4   31 f    449.8    2.7    0.0000   0.0000          ?        ?  2023.4750  24.2638          ?        ?      449.8        2.7       ?       ? 
1 1 1   17    4   32 o    555.6    2.9    0.0000   0.0000          ?        ?  3086.6135  32.5646          ?        ?      555.6        2.9       ?       ? 
1 1 1   17    4   33 o   1853.8    6.5    0.0000   0.0000          ?        ? 34370.3398 241.3612          ?        ?     1853.8        6.5       ?       ? 
1 1 1   17    4   34 o   1087.2    4.1    0.0000   0.0000          ?        ? 11821.5898  88.1160          ?        ?     1087.2        4.1       ?       ? 
1 1 1   17    4   35 o    826.4    3.2    0.0000   0.0000          ?        ?  6830.2656  52.3588          ?        ?      826.4        3.2       ?       ? 
1 1 1   17    4   36 o    858.5    3.2    0.0000   0.0000          ?        ?  7370.4556  54.9129          ?        ?      858.5        3.2       ?       ? 
1 1 1   17    4   37 o    621.7    2.8    0.0000   0.0000          ?        ?  3865.6101  35.1187          ?        ?      621.7        2.8       ?       ? 
1 1 1   17    4   38 o    434.0    2.6    0.0000   0.0000          ?        ?  1883.6388  22.9868          ?        ?      434.0        2.6       ?       ? 
1 1 1   17    4   39 o    720.7    3.1    0.0000   0.0000          ?        ?  5195.0117  44.0580          ?        ?      720.7        3.1       ?       ? 
1 1 1   17    4   40 o    599.5    2.8    0.0000   0.0000          ?        ?  3593.5996  33.2031          ?        ?      599.5        2.8       ?       ? 
1 1 1   17    4   41 o    578.5    2.8    0.0000   0.0000          ?        ?  3346.4917  31.9261          ?        ?      578.5        2.8       ?       ? 
1 1 1   17    4   42 o     73.5   15.3    0.0000   0.0000          ?        ?    56.1899  21.7097          ?        ?       73.5       15.3       ?       ? 
1 1 1   17    4   43 o   1068.7    3.9    0.0000   0.0000          ?        ? 11422.5137  83.6463          ?        ?     1068.7        3.9       ?       ? 
1 1 1   17    4   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    4   45 o    377.4    3.0    0.0000   0.0000          ?        ?  1424.5417  22.9868          ?        ?      377.4        3.0       ?       ? 
1 1 1   17    4   46 o    235.5    4.2    0.0000   0.0000          ?        ?   554.8753  19.7942          ?        ?      235.5        4.2       ?       ? 
1 1 1   17    4   47 o    998.2    3.7    0.0000   0.0000          ?        ?  9965.4062  74.0685          ?        ?      998.2        3.7       ?       ? 
1 1 1   17    4   48 o    209.4    4.4    0.0000   0.0000          ?        ?   438.6643  18.5171          ?        ?      209.4        4.4       ?       ? 
1 1 1   17    4   49 o    695.5    3.0    0.0000   0.0000          ?        ?  4837.4395  42.1424          ?        ?      695.5        3.0       ?       ? 
1 1 1   17    4   50 o    215.4    4.4    0.0000   0.0000          ?        ?   464.2052  19.1556          ?        ?      215.4        4.4       ?       ? 
1 1 1   17    4   51 o    545.4    2.7    0.0000   0.0000          ?        ?  2975.5107  29.3720          ?        ?      545.4        2.7       ?       ? 
1 1 1   17    4   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    4   53 o    489.2    2.7    0.0000   0.0000          ?        ?  2393.1790  26.1794          ?        ?      489.2        2.7       ?       ? 
1 1 1   17    4   54 o    269.6    3.6    0.0000   0.0000          ?        ?   727.2761  19.1556          ?        ?      269.6        3.6       ?       ? 
1 1 1   17    4   55 o    956.6    3.5    0.0000   0.0000          ?        ?  9153.2070  67.6833          ?        ?      956.6        3.5       ?       ? 
1 1 1   17    4   56 o    199.9    4.5    0.0000   0.0000          ?        ?   399.7145  17.8786          ?        ?      199.9        4.5       ?       ? 
1 1 1   17    4   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    4   58 o    352.8    3.1    0.0000   0.0000          ?        ?  1245.1172  21.7097          ?        ?      352.8        3.1       ?       ? 
1 1 1   17    4   59 o    421.6    2.8    0.0000   0.0000          ?        ?  1778.2827  23.6253          ?        ?      421.6        2.8       ?       ? 
1 1 1   17    4   60 o    158.3    6.5    0.0000   0.0000          ?        ?   250.9390  20.4327          ?        ?      158.3        6.5       ?       ? 
1 1 1   17    4   61 o    288.7    3.6    0.0000   0.0000          ?        ?   833.9093  21.0712          ?        ?      288.7        3.6       ?       ? 
1 1 1   17    4   62 o     56.7   16.5    0.0000   0.0000          ?        ?    33.2031  19.7942          ?        ?       56.7       16.5       ?       ? 
1 1 1   17    4   63 o    307.7    3.3    0.0000   0.0000          ?        ?   947.5660  20.4327          ?        ?      307.7        3.3       ?       ? 
1 1 1   17    4   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    4   65 o    187.1    5.5    0.0000   0.0000          ?        ?   350.5484  20.4327          ?        ?      187.1        5.5       ?       ? 
1 1 1   17    4   66 o     68.4   14.4    0.0000   0.0000          ?        ?    49.1662  19.1556          ?        ?       68.4       14.4       ?       ? 
1 1 1   17    4   67 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    4   68 o    290.7    3.8    0.0000   0.0000          ?        ?   846.0411  22.3483          ?        ?      290.7        3.8       ?       ? 
1 1 1   17    4   69 o    253.8    4.3    0.0000   0.0000          ?        ?   644.9069  21.7097          ?        ?      253.8        4.3       ?       ? 
1 1 1   17    4   70 o    263.9    4.2    0.0000   0.0000          ?        ?   697.2656  22.3483          ?        ?      263.9        4.2       ?       ? 
1 1 1   17    4   71 o    263.5    4.2    0.0000   0.0000          ?        ?   695.3500  22.3483          ?        ?      263.5        4.2       ?       ? 
1 1 1   17    4   72 o     29.9   14.0    0.0000   0.0000          ?        ?   -22.9868  21.7097          ?        ?       29.9       14.0       ?       ? 
1 1 1   17    4   73 o    170.5    6.4    0.0000   0.0000          ?        ?   291.8044  21.7097          ?        ?      170.5        6.4       ?       ? 
1 1 1   17    4   74 o     24.0   11.9    0.0000   0.0000          ?        ?   -47.2506  21.0712          ?        ?       24.0       11.9       ?       ? 
1 1 1   17    4   75 o     41.8   16.9    0.0000   0.0000          ?        ?     8.9393  21.7097          ?        ?       41.8       16.9       ?       ? 
1 1 1   17    4   76 o     37.3   15.9    0.0000   0.0000          ?        ?     0.6385  21.0712          ?        ?       37.3       15.9       ?       ? 
1 1 1   17    4   77 o     35.6   15.5    0.0000   0.0000          ?        ?    -1.9156  20.4327          ?        ?       35.6       15.5       ?       ? 
1 1 1   17    4   78 o    153.7    6.9    0.0000   0.0000          ?        ?   238.1686  21.0712          ?        ?      153.7        6.9       ?       ? 
1 1 1   17    4   79 o    115.6    9.1    0.0000   0.0000          ?        ?   136.0051  21.0712          ?        ?      115.6        9.1       ?       ? 
1 1 1   17    5    0 o    861.5    4.3 7422.1758  73.4300  7422.1758  73.4300  7422.1758  73.4300      861.5      4.3      861.5        4.3     0.0     0.0 
1 1 1   17    5    1 o    780.2    2.8    0.0000   0.0000          ?        ?  6087.0264  44.0580          ?        ?      780.2        2.8       ?       ? 
1 1 1   17    5    2 o    655.9    2.4    0.0000   0.0000          ?        ?  4301.7202  31.2876          ?        ?      655.9        2.4       ?       ? 
1 1 1   17    5    3 o   1154.1    3.9    0.0000   0.0000          ?        ? 13320.2002  89.3930          ?        ?     1154.1        3.9       ?       ? 
1 1 1   17    5    4 o    336.8    1.6    0.0000   0.0000          ?        ?  1134.6530  10.8549          ?        ?      336.8        1.6       ?       ? 
1 1 1   17    5    5 o   1522.2    5.0    0.0000   0.0000          ?        ? 23173.8652 153.2452          ?        ?     1522.2        5.0       ?       ? 
1 1 1   17    5    6 o    537.2    2.1    0.0000   0.0000          ?        ?  2886.1177  22.3483          ?        ?      537.2        2.1       ?       ? 
1 1 1   17    5    7 o    893.0    3.1    0.0000   0.0000          ?        ?  7974.4966  55.5514          ?        ?      893.0        3.1       ?       ? 
1 1 1   17    5    8 o    201.8    1.6    0.0000   0.0000          ?        ?   407.3768   6.3852          ?        ?      201.8        1.6       ?       ? 
1 1 1   17    5    9 o    454.6    1.9    0.0000   0.0000          ?        ?  2066.2561  17.2401          ?        ?      454.6        1.9       ?       ? 
1 1 1   17    5   10 o   1889.2    6.2    0.0000   0.0000          ?        ? 35695.9141 232.4219          ?        ?     1889.2        6.2       ?       ? 
1 1 1   17    5   11 f    662.1    2.5    0.0000   0.0000          ?        ?  4384.0894  33.2031          ?        ?      662.1        2.5       ?       ? 
1 1 1   17    5   12 o   1024.9    3.6    0.0000   0.0000          ?        ? 10504.9570  72.7915          ?        ?     1024.9        3.6       ?       ? 
1 1 1   17    5   13 o    469.0    2.0    0.0000   0.0000          ?        ?  2199.7070  18.5171          ?        ?      469.0        2.0       ?       ? 
1 1 1   17    5   14 f    249.8    1.8    0.0000   0.0000          ?        ?   623.8356   8.9393          ?        ?      249.8        1.8       ?       ? 
1 1 1   17    5   15 o    564.8    2.2    0.0000   0.0000          ?        ?  3190.0542  24.9023          ?        ?      564.8        2.2       ?       ? 
1 1 1   17    5   16 o    942.0    3.4    0.0000   0.0000          ?        ?  8874.1738  64.4907          ?        ?      942.0        3.4       ?       ? 
1 1 1   17    5   17 o    385.0    2.0    0.0000   0.0000          ?        ?  1482.6472  15.3245          ?        ?      385.0        2.0       ?       ? 
1 1 1   17    5   18 o    715.6    2.7    0.0000   0.0000          ?        ?  5120.9434  38.3113          ?        ?      715.6        2.7       ?       ? 
1 1 1   17    5   19 o    800.3    3.0    0.0000   0.0000          ?        ?  6404.3721  47.2506          ?        ?      800.3        3.0       ?       ? 
1 1 1   17    5   20 o    981.3    3.5    0.0000   0.0000          ?        ?  9629.5449  68.3218          ?        ?      981.3        3.5       ?       ? 
1 1 1   17    5   21 o   1865.7    6.4    0.0000   0.0000          ?        ? 34812.1992 238.8071          ?        ?     1865.7        6.4       ?       ? 
1 1 1   17    5   22 o    478.2    2.3    0.0000   0.0000          ?        ?  2286.5459  21.7097          ?        ?      478.2        2.3       ?       ? 
1 1 1   17    5   23 o    379.1    2.3    0.0000   0.0000          ?        ?  1437.3123  17.2401          ?        ?      379.1        2.3       ?       ? 
1 1 1   17    5   24 o   1533.1    5.2    0.0000   0.0000          ?        ? 23505.2578 160.2689          ?        ?     1533.1        5.2       ?       ? 
1 1 1   17    5   25 o   1636.6    5.5    0.0000   0.0000          ?        ? 26788.5352 181.3401          ?        ?     1636.6        5.5       ?       ? 
1 1 1   17    5   26 o    235.7    2.7    0.0000   0.0000          ?        ?   555.5138  12.7704          ?        ?      235.7        2.7       ?       ? 
1 1 1   17    5   27 o   1997.0    6.6    0.0000   0.0000          ?        ? 39885.8906 264.9865          ?        ?     1997.0        6.6       ?       ? 
1 1 1   17    5   28 o    615.8    2.7    0.0000   0.0000          ?        ?  3792.1802  33.8416          ?        ?      615.8        2.7       ?       ? 
1 1 1   17    5   29 o   1525.5    5.2    0.0000   0.0000          ?        ? 23272.1973 158.3534          ?        ?     1525.5        5.2       ?       ? 
1 1 1   17    5   30 o   1105.9    4.0    0.0000   0.0000          ?        ? 12230.8818  88.1160          ?        ?     1105.9        4.0       ?       ? 
1 1 1   17    5   31 o    364.5    2.6    0.0000   0.0000          ?        ?  1328.7635  19.1556          ?        ?      364.5        2.6       ?       ? 
1 1 1   17    5   32 o    880.4    3.5    0.0000   0.0000          ?        ?  7752.2910  61.9366          ?        ?      880.4        3.5       ?       ? 
1 1 1   17    5   33 o    662.4    2.8    0.0000   0.0000          ?        ?  4387.2817  37.0343          ?        ?      662.4        2.8       ?       ? 
1 1 1   17    5   34 o    372.2    2.9    0.0000   0.0000          ?        ?  1385.5919  21.7097          ?        ?      372.2        2.9       ?       ? 
1 1 1   17    5   35 o    660.0    2.8    0.0000   0.0000          ?        ?  4355.9946  37.0343          ?        ?      660.0        2.8       ?       ? 
1 1 1   17    5   36 o    903.7    3.4    0.0000   0.0000          ?        ?  8167.3301  60.6596          ?        ?      903.7        3.4       ?       ? 
1 1 1   17    5   37 o   1423.1    4.9    0.0000   0.0000          ?        ? 20255.8223 139.1977          ?        ?     1423.1        4.9       ?       ? 
1 1 1   17    5   38 o    416.2    2.8    0.0000   0.0000          ?        ?  1732.3091  22.9868          ?        ?      416.2        2.8       ?       ? 
1 1 1   17    5   39 o    204.3    4.5    0.0000   0.0000          ?        ?   417.5931  18.5171          ?        ?      204.3        4.5       ?       ? 
1 1 1   17    5   40 o    800.8    3.3    0.0000   0.0000          ?        ?  6413.3115  53.6358          ?        ?      800.8        3.3       ?       ? 
1 1 1   17    5   41 o   1429.0    4.8    0.0000   0.0000          ?        ? 20422.4746 137.2822          ?        ?     1429.0        4.8       ?       ? 
1 1 1   17    5   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    5   43 o    619.1    2.9    0.0000   0.0000          ?        ?  3833.0452  35.7572          ?        ?      619.1        2.9       ?       ? 
1 1 1   17    5   44 o    654.6    3.1    0.0000   0.0000          ?        ?  4285.7573  40.2269          ?        ?      654.6        3.1       ?       ? 
1 1 1   17    5   45 o    663.6    2.8    0.0000   0.0000          ?        ?  4404.5220  37.0343          ?        ?      663.6        2.8       ?       ? 
1 1 1   17    5   46 o   1353.8    4.7    0.0000   0.0000          ?        ? 18332.5957 127.0658          ?        ?     1353.8        4.7       ?       ? 
1 1 1   17    5   47 o    318.8    3.0    0.0000   0.0000          ?        ?  1016.5264  19.1556          ?        ?      318.8        3.0       ?       ? 
1 1 1   17    5   48 o    509.3    2.7    0.0000   0.0000          ?        ?  2593.6748  27.4564          ?        ?      509.3        2.7       ?       ? 
1 1 1   17    5   49 o    125.3    6.9    0.0000   0.0000          ?        ?   157.0763  17.2401          ?        ?      125.3        6.9       ?       ? 
1 1 1   17    5   50 o    680.3    2.8    0.0000   0.0000          ?        ?  4628.6436  38.3113          ?        ?      680.3        2.8       ?       ? 
1 1 1   17    5   51 o    462.9    2.6    0.0000   0.0000          ?        ?  2143.5171  24.2638          ?        ?      462.9        2.6       ?       ? 
1 1 1   17    5   52 o    436.9    2.6    0.0000   0.0000          ?        ?  1909.1797  22.9868          ?        ?      436.9        2.6       ?       ? 
1 1 1   17    5   53 o    134.1    6.7    0.0000   0.0000          ?        ?   180.0631  17.8786          ?        ?      134.1        6.7       ?       ? 
1 1 1   17    5   54 o    365.5    3.1    0.0000   0.0000          ?        ?  1336.4258  22.9868          ?        ?      365.5        3.1       ?       ? 
1 1 1   17    5   55 o    349.1    2.9    0.0000   0.0000          ?        ?  1218.9377  20.4327          ?        ?      349.1        2.9       ?       ? 
1 1 1   17    5   56 o    390.8    2.9    0.0000   0.0000          ?        ?  1527.3438  22.3483          ?        ?      390.8        2.9       ?       ? 
1 1 1   17    5   57 o    400.4    2.9    0.0000   0.0000          ?        ?  1603.9663  22.9868          ?        ?      400.4        2.9       ?       ? 
1 1 1   17    5   58 o    568.7    2.9    0.0000   0.0000          ?        ?  3234.7505  32.5646          ?        ?      568.7        2.9       ?       ? 
1 1 1   17    5   59 o    105.5    9.7    0.0000   0.0000          ?        ?   111.7413  20.4327          ?        ?      105.5        9.7       ?       ? 
1 1 1   17    5   60 o    831.9    3.1    0.0000   0.0000          ?        ?  6923.4902  52.3588          ?        ?      831.9        3.1       ?       ? 
1 1 1   17    5   61 o    244.0    4.3    0.0000   0.0000          ?        ?   595.7407  21.0712          ?        ?      244.0        4.3       ?       ? 
1 1 1   17    5   62 o    345.8    3.2    0.0000   0.0000          ?        ?  1196.5895  22.3483          ?        ?      345.8        3.2       ?       ? 
1 1 1   17    5   63 f    230.9    4.6    0.0000   0.0000          ?        ?   533.8041  21.0712          ?        ?      230.9        4.6       ?       ? 
1 1 1   17    5   64 o    243.2    4.1    0.0000   0.0000          ?        ?   591.9095  19.7942          ?        ?      243.2        4.1       ?       ? 
1 1 1   17    5   65 o     46.4   16.7    0.0000   0.0000          ?        ?    18.5171  19.7942          ?        ?       46.4       16.7       ?       ? 
1 1 1   17    5   66 o     92.2   10.7    0.0000   0.0000          ?        ?    85.5619  19.7942          ?        ?       92.2       10.7       ?       ? 
1 1 1   17    5   67 o    314.7    3.7    0.0000   0.0000          ?        ?   990.9855  22.9868          ?        ?      314.7        3.7       ?       ? 
1 1 1   17    5   68 o     66.9   15.6    0.0000   0.0000          ?        ?    47.2506  20.4327          ?        ?       66.9       15.6       ?       ? 
1 1 1   17    5   69 o    253.0    4.4    0.0000   0.0000          ?        ?   641.0757  22.3483          ?        ?      253.0        4.4       ?       ? 
1 1 1   17    5   70 o    292.6    3.7    0.0000   0.0000          ?        ?   856.8960  21.7097          ?        ?      292.6        3.7       ?       ? 
1 1 1   17    5   71 o    200.1    5.4    0.0000   0.0000          ?        ?   401.6301  21.7097          ?        ?      200.1        5.4       ?       ? 
1 1 1   17    5   72 o     34.6   15.2    0.0000   0.0000          ?        ?    -5.1082  20.4327          ?        ?       34.6       15.2       ?       ? 
1 1 1   17    5   73 o     52.3   17.6    0.0000   0.0000          ?        ?    26.8179  21.7097          ?        ?       52.3       17.6       ?       ? 
1 1 1   17    5   74 o    179.7    5.9    0.0000   0.0000          ?        ?   324.3690  21.0712          ?        ?      179.7        5.9       ?       ? 
1 1 1   17    5   75 o    207.9    5.1    0.0000   0.0000          ?        ?   433.5562  21.0712          ?        ?      207.9        5.1       ?       ? 
1 1 1   17    5   76 o    169.8    6.0    0.0000   0.0000          ?        ?   289.8888  20.4327          ?        ?      169.8        6.0       ?       ? 
1 1 1   17    5   77 o    214.1    5.2    0.0000   0.0000          ?        ?   460.3741  22.3483          ?        ?      214.1        5.2       ?       ? 
1 1 1   17    5   78 o     56.3   17.2    0.0000   0.0000          ?        ?    33.8416  21.0712          ?        ?       56.3       17.2       ?       ? 
1 1 1   17    5   79 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    6    0 o   1186.0    5.7 14067.2705 134.7281 14067.2705 134.7281 14067.2705 134.7281     1186.0      5.7     1186.0        5.7     0.0     0.0 
1 1 1   17    6    1 o    883.3    3.1    0.0000   0.0000          ?        ?  7802.7344  54.9129          ?        ?      883.3        3.1       ?       ? 
1 1 1   17    6    2 o    562.6    2.2    0.0000   0.0000          ?        ?  3165.1519  24.9023          ?        ?      562.6        2.2       ?       ? 
1 1 1   17    6    3 o    256.8    1.5    0.0000   0.0000          ?        ?   659.5928   7.6623          ?        ?      256.8        1.5       ?       ? 
1 1 1   17    6    4 o   1112.2    3.8    0.0000   0.0000          ?        ? 12371.3564  84.2849          ?        ?     1112.2        3.8       ?       ? 
1 1 1   17    6    5 o   1311.4    4.4    0.0000   0.0000          ?        ? 17199.8574 115.5724          ?        ?     1311.4        4.4       ?       ? 
1 1 1   17    6    6 o   1002.3    3.4    0.0000   0.0000          ?        ? 10045.8613  68.9603          ?        ?     1002.3        3.4       ?       ? 
1 1 1   17    6    7 o   1340.3    4.5    0.0000   0.0000          ?        ? 17966.0820 121.9576          ?        ?     1340.3        4.5       ?       ? 
1 1 1   17    6    8 o    573.7    2.2    0.0000   0.0000          ?        ?  3290.9407  24.9023          ?        ?      573.7        2.2       ?       ? 
1 1 1   17    6    9 o   1132.5    3.9    0.0000   0.0000          ?        ? 12825.9834  87.4775          ?        ?     1132.5        3.9       ?       ? 
1 1 1   17    6   10 o   1445.0    4.8    0.0000   0.0000          ?        ? 20881.5723 139.1977          ?        ?     1445.0        4.8       ?       ? 
1 1 1   17    6   11 o    190.9    1.8    0.0000   0.0000          ?        ?   364.5958   7.0237          ?        ?      190.9        1.8       ?       ? 
1 1 1   17    6   12 o    849.9    3.1    0.0000   0.0000          ?        ?  7223.5957  52.3588          ?        ?      849.9        3.1       ?       ? 
1 1 1   17    6   13 f   1815.7    5.9    0.0000   0.0000          ?        ? 32974.5352 215.1818          ?        ?     1815.7        5.9       ?       ? 
1 1 1   17    6   14 o   1199.0    4.1    0.0000   0.0000          ?        ? 14378.2305  98.3323          ?        ?     1199.0        4.1       ?       ? 
1 1 1   17    6   15 o   1258.6    4.4    0.0000   0.0000          ?        ? 15841.0820 109.8257          ?        ?     1258.6        4.4       ?       ? 
1 1 1   17    6   16 o   1040.4    3.5    0.0000   0.0000          ?        ? 10824.2188  73.4300          ?        ?     1040.4        3.5       ?       ? 
1 1 1   17    6   17 o   1208.8    4.1    0.0000   0.0000          ?        ? 14611.9287  99.6094          ?        ?     1208.8        4.1       ?       ? 
1 1 1   17    6   18 o    899.1    3.2    0.0000   0.0000          ?        ?  8083.6836  58.1055          ?        ?      899.1        3.2       ?       ? 
1 1 1   17    6   19 o    463.7    2.1    0.0000   0.0000          ?        ?  2150.5408  19.1556          ?        ?      463.7        2.1       ?       ? 
1 1 1   17    6   20 o   1405.1    5.0    0.0000   0.0000          ?        ? 19744.3652 139.1977          ?        ?     1405.1        5.0       ?       ? 
1 1 1   17    6   21 o   1070.4    3.8    0.0000   0.0000          ?        ? 11458.2705  81.0922          ?        ?     1070.4        3.8       ?       ? 
1 1 1   17    6   22 o   1647.9    5.6    0.0000   0.0000          ?        ? 27158.8789 183.2557          ?        ?     1647.9        5.6       ?       ? 
1 1 1   17    6   23 o    923.2    3.3    0.0000   0.0000          ?        ?  8523.6250  60.6596          ?        ?      923.2        3.3       ?       ? 
1 1 1   17    6   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    6   25 o   1572.4    5.5    0.0000   0.0000          ?        ? 24726.1113 171.7623          ?        ?     1572.4        5.5       ?       ? 
1 1 1   17    6   26 o   1407.0    4.7    0.0000   0.0000          ?        ? 19796.7246 133.4510          ?        ?     1407.0        4.7       ?       ? 
1 1 1   17    6   27 o    447.2    2.5    0.0000   0.0000          ?        ?  1999.8499  22.3483          ?        ?      447.2        2.5       ?       ? 
1 1 1   17    6   28 o   1020.0    3.7    0.0000   0.0000          ?        ? 10405.3486  75.3456          ?        ?     1020.0        3.7       ?       ? 
1 1 1   17    6   29 o    545.9    2.7    0.0000   0.0000          ?        ?  2980.6189  30.0105          ?        ?      545.9        2.7       ?       ? 
1 1 1   17    6   30 o    509.5    2.3    0.0000   0.0000          ?        ?  2595.5903  23.6253          ?        ?      509.5        2.3       ?       ? 
1 1 1   17    6   31 f    712.6    2.8    0.0000   0.0000          ?        ?  5077.5239  39.5883          ?        ?      712.6        2.8       ?       ? 
1 1 1   17    6   32 o    841.9    3.3    0.0000   0.0000          ?        ?  7088.8667  56.1899          ?        ?      841.9        3.3       ?       ? 
1 1 1   17    6   33 o   1154.4    4.2    0.0000   0.0000          ?        ? 13327.2227  96.4168          ?        ?     1154.4        4.2       ?       ? 
1 1 1   17    6   34 o    772.7    3.0    0.0000   0.0000          ?        ?  5970.1772  46.6121          ?        ?      772.7        3.0       ?       ? 
1 1 1   17    6   35 o   1102.8    3.9    0.0000   0.0000          ?        ? 12163.1982  86.2004          ?        ?     1102.8        3.9       ?       ? 
1 1 1   17    6   36 o    587.0    2.9    0.0000   0.0000          ?        ?  3445.4626  34.4802          ?        ?      587.0        2.9       ?       ? 
1 1 1   17    6   37 o    100.4    8.3    0.0000   0.0000          ?        ?   100.8864  16.6016          ?        ?      100.4        8.3       ?       ? 
1 1 1   17    6   38 o   1271.2    4.4    0.0000   0.0000          ?        ? 16160.9824 113.0183          ?        ?     1271.2        4.4       ?       ? 
1 1 1   17    6   39 o    427.1    2.8    0.0000   0.0000          ?        ?  1824.2563  23.6253          ?        ?      427.1        2.8       ?       ? 
1 1 1   17    6   40 o    494.3    2.8    0.0000   0.0000          ?        ?  2442.9839  27.4564          ?        ?      494.3        2.8       ?       ? 
1 1 1   17    6   41 o    514.7    2.7    0.0000   0.0000          ?        ?  2649.2261  27.4564          ?        ?      514.7        2.7       ?       ? 
1 1 1   17    6   42 o    549.8    2.8    0.0000   0.0000          ?        ?  3023.3999  30.6490          ?        ?      549.8        2.8       ?       ? 
1 1 1   17    6   43 o    642.1    2.8    0.0000   0.0000          ?        ?  4122.9341  35.7572          ?        ?      642.1        2.8       ?       ? 
1 1 1   17    6   44 o    750.1    3.1    0.0000   0.0000          ?        ?  5626.6528  46.6121          ?        ?      750.1        3.1       ?       ? 
1 1 1   17    6   45 o    460.1    2.6    0.0000   0.0000          ?        ?  2117.3376  24.2638          ?        ?      460.1        2.6       ?       ? 
1 1 1   17    6   46 o    778.4    3.0    0.0000   0.0000          ?        ?  6060.2085  46.6121          ?        ?      778.4        3.0       ?       ? 
1 1 1   17    6   47 o    125.3    7.4    0.0000   0.0000          ?        ?   157.0763  18.5171          ?        ?      125.3        7.4       ?       ? 
1 1 1   17    6   48 o    325.0    3.0    0.0000   0.0000          ?        ?  1056.1147  19.7942          ?        ?      325.0        3.0       ?       ? 
1 1 1   17    6   49 o    692.8    2.9    0.0000   0.0000          ?        ?  4801.0444  40.2269          ?        ?      692.8        2.9       ?       ? 
1 1 1   17    6   50 o     37.6   15.2    0.0000   0.0000          ?        ?     5.7467  17.8786          ?        ?       37.6       15.2       ?       ? 
1 1 1   17    6   51 f     23.8   11.7    0.0000   0.0000          ?        ?   -42.7809  19.7942          ?        ?       23.8       11.7       ?       ? 
1 1 1   17    6   52 o    372.5    2.9    0.0000   0.0000          ?        ?  1387.5076  21.7097          ?        ?      372.5        2.9       ?       ? 
1 1 1   17    6   53 o     49.9   15.6    0.0000   0.0000          ?        ?    24.9023  17.2401          ?        ?       49.9       15.6       ?       ? 
1 1 1   17    6   54 o    131.5    7.0    0.0000   0.0000          ?        ?   173.0394  18.5171          ?        ?      131.5        7.0       ?       ? 
1 1 1   17    6   55 o    117.6    7.3    0.0000   0.0000          ?        ?   138.5592  17.2401          ?        ?      117.6        7.3       ?       ? 
1 1 1   17    6   56 o    216.1    4.4    0.0000   0.0000          ?        ?   467.3978  19.1556          ?        ?      216.1        4.4       ?       ? 
1 1 1   17    6   57 o    455.8    2.7    0.0000   0.0000          ?        ?  2077.7493  24.2638          ?        ?      455.8        2.7       ?       ? 
1 1 1   17    6   58 o    276.2    3.8    0.0000   0.0000          ?        ?   763.0333  21.0712          ?        ?      276.2        3.8       ?       ? 
1 1 1   17    6   59 o    520.0    2.8    0.0000   0.0000          ?        ?  2704.7776  28.7335          ?        ?      520.0        2.8       ?       ? 
1 1 1   17    6   60 o    370.3    3.0    0.0000   0.0000          ?        ?  1371.5444  22.3483          ?        ?      370.3        3.0       ?       ? 
1 1 1   17    6   61 o    116.2    8.2    0.0000   0.0000          ?        ?   135.3666  19.1556          ?        ?      116.2        8.2       ?       ? 
1 1 1   17    6   62 o    368.5    3.0    0.0000   0.0000          ?        ?  1358.7740  22.3483          ?        ?      368.5        3.0       ?       ? 
1 1 1   17    6   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    6   64 o     25.4   12.3    0.0000   0.0000          ?        ?   -31.2876  19.1556          ?        ?       25.4       12.3       ?       ? 
1 1 1   17    6   65 o    181.7    5.4    0.0000   0.0000          ?        ?   330.7542  19.7942          ?        ?      181.7        5.4       ?       ? 
1 1 1   17    6   66 o    216.3    5.0    0.0000   0.0000          ?        ?   468.6749  21.7097          ?        ?      216.3        5.0       ?       ? 
1 1 1   17    6   67 o     62.2   15.4    0.0000   0.0000          ?        ?    40.8654  19.1556          ?        ?       62.2       15.4       ?       ? 
1 1 1   17    6   68 o     35.0   15.4    0.0000   0.0000          ?        ?    -5.7467  21.0712          ?        ?       35.0       15.4       ?       ? 
1 1 1   17    6   69 o    423.2    3.2    0.0000   0.0000          ?        ?  1792.3303  26.8179          ?        ?      423.2        3.2       ?       ? 
1 1 1   17    6   70 o    142.1    7.6    0.0000   0.0000          ?        ?   203.0499  21.7097          ?        ?      142.1        7.6       ?       ? 
1 1 1   17    6   71 o    157.3    6.9    0.0000   0.0000          ?        ?   248.3849  21.7097          ?        ?      157.3        6.9       ?       ? 
1 1 1   17    6   72 o    232.8    4.8    0.0000   0.0000          ?        ?   543.3819  22.3483          ?        ?      232.8        4.8       ?       ? 
1 1 1   17    6   73 o     69.6   15.9    0.0000   0.0000          ?        ?    51.7203  21.7097          ?        ?       69.6       15.9       ?       ? 
1 1 1   17    6   74 o    168.3    6.4    0.0000   0.0000          ?        ?   284.7806  21.7097          ?        ?      168.3        6.4       ?       ? 
1 1 1   17    6   75 o     41.4   16.3    0.0000   0.0000          ?        ?    10.8549  19.7942          ?        ?       41.4       16.3       ?       ? 
1 1 1   17    6   76 o     53.2   17.6    0.0000   0.0000          ?        ?    28.7335  21.7097          ?        ?       53.2       17.6       ?       ? 
1 1 1   17    6   77 o    176.9    5.8    0.0000   0.0000          ?        ?   314.7912  20.4327          ?        ?      176.9        5.8       ?       ? 
1 1 1   17    6   78 o     44.0   16.9    0.0000   0.0000          ?        ?    14.6860  21.0712          ?        ?       44.0       16.9       ?       ? 
1 1 1   17    7    0 o    593.5    3.2 3522.7239  37.6728  3522.7239  37.6728  3522.7239  37.6728      593.5      3.2      593.5        3.2     0.0     0.0 
1 1 1   17    7    1 o   1152.9    3.9    0.0000   0.0000          ?        ? 13292.1045  90.0316          ?        ?     1152.9        3.9       ?       ? 
1 1 1   17    7    2 o    749.7    2.6    0.0000   0.0000          ?        ?  5620.2676  39.5883          ?        ?      749.7        2.6       ?       ? 
1 1 1   17    7    3 o    263.3    1.5    0.0000   0.0000          ?        ?   693.4344   7.6623          ?        ?      263.3        1.5       ?       ? 
1 1 1   17    7    4 o    579.0    2.3    0.0000   0.0000          ?        ?  3352.8770  26.1794          ?        ?      579.0        2.3       ?       ? 
1 1 1   17    7    5 o    240.5    1.5    0.0000   0.0000          ?        ?   578.5006   7.0237          ?        ?      240.5        1.5       ?       ? 
1 1 1   17    7    6 o    409.6    1.8    0.0000   0.0000          ?        ?  1677.3964  14.6860          ?        ?      409.6        1.8       ?       ? 
1 1 1   17    7    7 o    880.0    3.1    0.0000   0.0000          ?        ?  7744.6289  54.2743          ?        ?      880.0        3.1       ?       ? 
1 1 1   17    7    8 o    341.6    1.7    0.0000   0.0000          ?        ?  1167.2175  11.4934          ?        ?      341.6        1.7       ?       ? 
1 1 1   17    7    9 o   1295.0    4.4    0.0000   0.0000          ?        ? 16772.0469 113.0183          ?        ?     1295.0        4.4       ?       ? 
1 1 1   17    7   10 o    636.2    2.4    0.0000   0.0000          ?        ?  4047.5889  30.0105          ?        ?      636.2        2.4       ?       ? 
1 1 1   17    7   11 o   1068.4    3.7    0.0000   0.0000          ?        ? 11416.1279  78.5382          ?        ?     1068.4        3.7       ?       ? 
1 1 1   17    7   12 o   1243.8    4.2    0.0000   0.0000          ?        ? 15472.6553 104.7175          ?        ?     1243.8        4.2       ?       ? 
1 1 1   17    7   13 o    763.5    2.9    0.0000   0.0000          ?        ?  5829.0640  44.0580          ?        ?      763.5        2.9       ?       ? 
1 1 1   17    7   14 o    436.8    2.0    0.0000   0.0000          ?        ?  1907.9026  17.8786          ?        ?      436.8        2.0       ?       ? 
1 1 1   17    7   15 o   1400.9    4.7    0.0000   0.0000          ?        ? 19626.2383 131.5355          ?        ?     1400.9        4.7       ?       ? 
1 1 1   17    7   16 o   1363.9    4.6    0.0000   0.0000          ?        ? 18603.3281 125.1502          ?        ?     1363.9        4.6       ?       ? 
1 1 1   17    7   17 o     16.8    8.0    0.0000   0.0000          ?        ?   -10.8549   7.6623          ?        ?       16.8        8.0       ?       ? 
1 1 1   17    7   18 o   1733.4    5.9    0.0000   0.0000          ?        ? 30051.3809 203.0499          ?        ?     1733.4        5.9       ?       ? 
1 1 1   17    7   19 o    762.7    3.0    0.0000   0.0000          ?        ?  5817.5703  45.3350          ?        ?      762.7        3.0       ?       ? 
1 1 1   17    7   20 o   1709.6    5.7    0.0000   0.0000          ?        ? 29231.5195 195.3876          ?        ?     1709.6        5.7       ?       ? 
1 1 1   17    7   21 o    428.9    2.3    0.0000   0.0000          ?        ?  1839.5808  19.7942          ?        ?      428.9        2.3       ?       ? 
1 1 1   17    7   22 o    598.7    2.5    0.0000   0.0000          ?        ?  3584.6606  29.3720          ?        ?      598.7        2.5       ?       ? 
1 1 1   17    7   23 o    372.6    2.2    0.0000   0.0000          ?        ?  1388.1460  16.6016          ?        ?      372.6        2.2       ?       ? 
1 1 1   17    7   24 o   1256.4    4.5    0.0000   0.0000          ?        ? 15786.1709 112.3798          ?        ?     1256.4        4.5       ?       ? 
1 1 1   17    7   25 o   1911.0    6.8    0.0000   0.0000          ?        ? 36522.7969 259.8783          ?        ?     1911.0        6.8       ?       ? 
1 1 1   17    7   26 o   1197.9    4.2    0.0000   0.0000          ?        ? 14350.1348 100.8864          ?        ?     1197.9        4.2       ?       ? 
1 1 1   17    7   27 o    415.1    2.4    0.0000   0.0000          ?        ?  1722.7313  19.7942          ?        ?      415.1        2.4       ?       ? 
1 1 1   17    7   28 o   1249.8    4.5    0.0000   0.0000          ?        ? 15620.7920 112.3798          ?        ?     1249.8        4.5       ?       ? 
1 1 1   17    7   29 o    412.0    2.2    0.0000   0.0000          ?        ?  1697.1904  18.5171          ?        ?      412.0        2.2       ?       ? 
1 1 1   17    7   30 o    425.1    2.4    0.0000   0.0000          ?        ?  1807.0162  20.4327          ?        ?      425.1        2.4       ?       ? 
1 1 1   17    7   31 o    531.0    2.6    0.0000   0.0000          ?        ?  2819.7114  27.4564          ?        ?      531.0        2.6       ?       ? 
1 1 1   17    7   32 o    772.8    3.3    0.0000   0.0000          ?        ?  5972.0928  51.0817          ?        ?      772.8        3.3       ?       ? 
1 1 1   17    7   33 o   1955.8    6.7    0.0000   0.0000          ?        ? 38260.8555 261.1554          ?        ?     1955.8        6.7       ?       ? 
1 1 1   17    7   34 o     96.5    7.9    0.0000   0.0000          ?        ?    93.2242  15.3245          ?        ?       96.5        7.9       ?       ? 
1 1 1   17    7   35 o    817.8    3.1    0.0000   0.0000          ?        ?  6688.5142  51.0817          ?        ?      817.8        3.1       ?       ? 
1 1 1   17    7   36 o    297.1    3.0    0.0000   0.0000          ?        ?   882.4369  17.8786          ?        ?      297.1        3.0       ?       ? 
1 1 1   17    7   37 o    691.5    2.8    0.0000   0.0000          ?        ?  4781.8887  38.3113          ?        ?      691.5        2.8       ?       ? 
1 1 1   17    7   38 o    556.3    2.7    0.0000   0.0000          ?        ?  3094.2759  30.0105          ?        ?      556.3        2.7       ?       ? 
1 1 1   17    7   39 o    894.3    3.4    0.0000   0.0000          ?        ?  7998.1216  60.6596          ?        ?      894.3        3.4       ?       ? 
1 1 1   17    7   40 o   1118.8    3.9    0.0000   0.0000          ?        ? 12517.5781  88.1160          ?        ?     1118.8        3.9       ?       ? 
1 1 1   17    7   41 o   1019.4    3.7    0.0000   0.0000          ?        ? 10391.9395  74.7070          ?        ?     1019.4        3.7       ?       ? 
1 1 1   17    7   42 o    463.0    2.6    0.0000   0.0000          ?        ?  2143.5171  24.2638          ?        ?      463.0        2.6       ?       ? 
1 1 1   17    7   43 o    805.4    3.1    0.0000   0.0000          ?        ?  6488.0181  49.8047          ?        ?      805.4        3.1       ?       ? 
1 1 1   17    7   44 o    274.9    3.4    0.0000   0.0000          ?        ?   756.0096  18.5171          ?        ?      274.9        3.4       ?       ? 
1 1 1   17    7   45 o    117.1    7.4    0.0000   0.0000          ?        ?   137.2822  17.2401          ?        ?      117.1        7.4       ?       ? 
1 1 1   17    7   46 o    584.1    2.6    0.0000   0.0000          ?        ?  3411.6211  30.6490          ?        ?      584.1        2.6       ?       ? 
1 1 1   17    7   47 o    265.7    3.6    0.0000   0.0000          ?        ?   706.2049  19.1556          ?        ?      265.7        3.6       ?       ? 
1 1 1   17    7   48 o    508.9    2.7    0.0000   0.0000          ?        ?  2589.8438  27.4564          ?        ?      508.9        2.7       ?       ? 
1 1 1   17    7   49 o    762.8    3.0    0.0000   0.0000          ?        ?  5819.4863  45.9736          ?        ?      762.8        3.0       ?       ? 
1 1 1   17    7   50 o    344.4    2.9    0.0000   0.0000          ?        ?  1186.3732  19.7942          ?        ?      344.4        2.9       ?       ? 
1 1 1   17    7   51 o    441.7    2.7    0.0000   0.0000          ?        ?  1951.3221  23.6253          ?        ?      441.7        2.7       ?       ? 
1 1 1   17    7   52 o    570.0    2.7    0.0000   0.0000          ?        ?  3249.4365  31.2876          ?        ?      570.0        2.7       ?       ? 
1 1 1   17    7   53 o    267.9    3.6    0.0000   0.0000          ?        ?   717.6983  19.1556          ?        ?      267.9        3.6       ?       ? 
1 1 1   17    7   54 o     42.1   15.5    0.0000   0.0000          ?        ?    14.0475  17.2401          ?        ?       42.1       15.5       ?       ? 
1 1 1   17    7   55 o     91.3    9.8    0.0000   0.0000          ?        ?    83.6463  17.8786          ?        ?       91.3        9.8       ?       ? 
1 1 1   17    7   56 o    324.4    3.1    0.0000   0.0000          ?        ?  1052.9221  20.4327          ?        ?      324.4        3.1       ?       ? 
1 1 1   17    7   57 o    432.0    2.9    0.0000   0.0000          ?        ?  1867.0372  24.9023          ?        ?      432.0        2.9       ?       ? 
1 1 1   17    7   58 f    101.5    9.7    0.0000   0.0000          ?        ?   103.4405  19.7942          ?        ?      101.5        9.7       ?       ? 
1 1 1   17    7   59 o    430.2    3.0    0.0000   0.0000          ?        ?  1851.7128  25.5409          ?        ?      430.2        3.0       ?       ? 
1 1 1   17    7   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    7   61 o    209.0    4.7    0.0000   0.0000          ?        ?   437.3873  19.7942          ?        ?      209.0        4.7       ?       ? 
1 1 1   17    7   62 o    278.8    3.8    0.0000   0.0000          ?        ?   777.7194  21.0712          ?        ?      278.8        3.8       ?       ? 
1 1 1   17    7   63 o     20.4   10.3    0.0000   0.0000          ?        ?   -60.0210  19.1556          ?        ?       20.4       10.3       ?       ? 
1 1 1   17    7   64 o    134.2    7.6    0.0000   0.0000          ?        ?   180.7016  20.4327          ?        ?      134.2        7.6       ?       ? 
1 1 1   17    7   65 o     36.6   15.5    0.0000   0.0000          ?        ?     0.6385  19.7942          ?        ?       36.6       15.5       ?       ? 
1 1 1   17    7   66 o    156.2    6.5    0.0000   0.0000          ?        ?   244.5538  20.4327          ?        ?      156.2        6.5       ?       ? 
1 1 1   17    7   67 o    274.3    3.8    0.0000   0.0000          ?        ?   753.4555  21.0712          ?        ?      274.3        3.8       ?       ? 
1 1 1   17    7   68 o    125.5    8.1    0.0000   0.0000          ?        ?   158.3534  20.4327          ?        ?      125.5        8.1       ?       ? 
1 1 1   17    7   69 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    7   70 o    209.8    5.3    0.0000   0.0000          ?        ?   441.2184  22.3483          ?        ?      209.8        5.3       ?       ? 
1 1 1   17    7   71 o     20.2   10.2    0.0000   0.0000          ?        ?   -75.9841  21.0712          ?        ?       20.2       10.2       ?       ? 
1 1 1   17    7   72 o    226.5    5.1    0.0000   0.0000          ?        ?   514.6484  22.9868          ?        ?      226.5        5.1       ?       ? 
1 1 1   17    7   73 o    209.2    5.3    0.0000   0.0000          ?        ?   439.3029  22.3483          ?        ?      209.2        5.3       ?       ? 
1 1 1   17    7   74 o     31.9   14.6    0.0000   0.0000          ?        ?   -14.0475  21.0712          ?        ?       31.9       14.6       ?       ? 
1 1 1   17    7   75 o     63.1   16.1    0.0000   0.0000          ?        ?    42.7809  20.4327          ?        ?       63.1       16.1       ?       ? 
1 1 1   17    7   76 o    126.6    8.3    0.0000   0.0000          ?        ?   162.1845  21.0712          ?        ?      126.6        8.3       ?       ? 
1 1 1   17    7   77 o     99.1   10.6    0.0000   0.0000          ?        ?   100.2479  21.0712          ?        ?       99.1       10.6       ?       ? 
1 1 1   17    7   78 o     26.3   12.7    0.0000   0.0000          ?        ?   -34.4802  21.0712          ?        ?       26.3       12.7       ?       ? 
1 1 1   17    8    0 o    843.4    4.3 7113.7690  72.1529  7113.7690  72.1529  7113.7690  72.1529      843.4      4.3      843.4        4.3     0.0     0.0 
1 1 1   17    8    1 o    665.8    2.5    0.0000   0.0000          ?        ?  4433.2554  33.8416          ?        ?      665.8        2.5       ?       ? 
1 1 1   17    8    2 o   1056.2    3.7    0.0000   0.0000          ?        ? 11156.8887  78.5382          ?        ?     1056.2        3.7       ?       ? 
1 1 1   17    8    3 o    484.1    2.0    0.0000   0.0000          ?        ?  2344.0129  19.1556          ?        ?      484.1        2.0       ?       ? 
1 1 1   17    8    4 o    370.8    1.7    0.0000   0.0000          ?        ?  1374.7371  12.7704          ?        ?      370.8        1.7       ?       ? 
1 1 1   17    8    5 o    688.0    2.6    0.0000   0.0000          ?        ?  4733.9995  35.1187          ?        ?      688.0        2.6       ?       ? 
1 1 1   17    8    6 o    911.2    3.3    0.0000   0.0000          ?        ?  8302.6973  60.6596          ?        ?      911.2        3.3       ?       ? 
1 1 1   17    8    7 o   1225.4    4.1    0.0000   0.0000          ?        ? 15018.0283 101.5249          ?        ?     1225.4        4.1       ?       ? 
1 1 1   17    8    8 o    276.1    1.6    0.0000   0.0000          ?        ?   762.3948   8.9393          ?        ?      276.1        1.6       ?       ? 
1 1 1   17    8    9 o    597.5    2.3    0.0000   0.0000          ?        ?  3569.9744  27.4564          ?        ?      597.5        2.3       ?       ? 
1 1 1   17    8   10 o   1539.2    5.1    0.0000   0.0000          ?        ? 23693.6211 156.4378          ?        ?     1539.2        5.1       ?       ? 
1 1 1   17    8   11 o    756.6    2.8    0.0000   0.0000          ?        ?  5724.3462  42.1424          ?        ?      756.6        2.8       ?       ? 
1 1 1   17    8   12 o    798.0    2.9    0.0000   0.0000          ?        ?  6367.9761  46.6121          ?        ?      798.0        2.9       ?       ? 
1 1 1   17    8   13 o   1436.3    4.8    0.0000   0.0000          ?        ? 20630.6328 137.9207          ?        ?     1436.3        4.8       ?       ? 
1 1 1   17    8   14 o    399.9    1.9    0.0000   0.0000          ?        ?  1599.4967  15.3245          ?        ?      399.9        1.9       ?       ? 
1 1 1   17    8   15 o    485.1    2.2    0.0000   0.0000          ?        ?  2353.5908  21.0712          ?        ?      485.1        2.2       ?       ? 
1 1 1   17    8   16 o    877.9    3.2    0.0000   0.0000          ?        ?  7706.9561  55.5514          ?        ?      877.9        3.2       ?       ? 
1 1 1   17    8   17 o    370.5    1.9    0.0000   0.0000          ?        ?  1372.8215  14.0475          ?        ?      370.5        1.9       ?       ? 
1 1 1   17    8   18 f    401.7    2.1    0.0000   0.0000          ?        ?  1613.5442  16.6016          ?        ?      401.7        2.1       ?       ? 
1 1 1   17    8   19 o   1107.0    3.8    0.0000   0.0000          ?        ? 12255.1455  84.9234          ?        ?     1107.0        3.8       ?       ? 
1 1 1   17    8   20 o    397.5    2.0    0.0000   0.0000          ?        ?  1580.3411  15.9630          ?        ?      397.5        2.0       ?       ? 
1 1 1   17    8   21 f    561.1    2.4    0.0000   0.0000          ?        ?  3148.5503  27.4564          ?        ?      561.1        2.4       ?       ? 
1 1 1   17    8   22 o    773.9    3.1    0.0000   0.0000          ?        ?  5988.6943  47.2506          ?        ?      773.9        3.1       ?       ? 
1 1 1   17    8   23 o    516.8    2.4    0.0000   0.0000          ?        ?  2670.9358  24.9023          ?        ?      516.8        2.4       ?       ? 
1 1 1   17    8   24 o   1164.3    4.2    0.0000   0.0000          ?        ? 13557.7305  97.0553          ?        ?     1164.3        4.2       ?       ? 
1 1 1   17    8   25 o    675.4    2.8    0.0000   0.0000          ?        ?  4562.2368  37.6728          ?        ?      675.4        2.8       ?       ? 
1 1 1   17    8   26 o    525.2    2.6    0.0000   0.0000          ?        ?  2758.4133  27.4564          ?        ?      525.2        2.6       ?       ? 
1 1 1   17    8   27 o    602.2    2.5    0.0000   0.0000          ?        ?  3626.1646  30.0105          ?        ?      602.2        2.5       ?       ? 
1 1 1   17    8   28 o    833.4    3.1    0.0000   0.0000          ?        ?  6945.8384  51.7203          ?        ?      833.4        3.1       ?       ? 
1 1 1   17    8   29 f     72.4    7.5    0.0000   0.0000          ?        ?    52.3588  10.8549          ?        ?       72.4        7.5       ?       ? 
1 1 1   17    8   30 o    404.5    2.4    0.0000   0.0000          ?        ?  1636.5309  19.7942          ?        ?      404.5        2.4       ?       ? 
1 1 1   17    8   31 o    633.5    2.6    0.0000   0.0000          ?        ?  4013.7468  33.2031          ?        ?      633.5        2.6       ?       ? 
1 1 1   17    8   32 o   1193.6    4.3    0.0000   0.0000          ?        ? 14247.3330 101.5249          ?        ?     1193.6        4.3       ?       ? 
1 1 1   17    8   33 o    561.0    3.0    0.0000   0.0000          ?        ?  3147.2729  33.2031          ?        ?      561.0        3.0       ?       ? 
1 1 1   17    8   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    8   35 o    105.1    8.5    0.0000   0.0000          ?        ?   110.4642  17.8786          ?        ?      105.1        8.5       ?       ? 
1 1 1   17    8   36 f   1065.0    3.9    0.0000   0.0000          ?        ? 11342.6982  82.3693          ?        ?     1065.0        3.9       ?       ? 
1 1 1   17    8   37 o    944.2    3.4    0.0000   0.0000          ?        ?  8915.6777  64.4907          ?        ?      944.2        3.4       ?       ? 
1 1 1   17    8   38 o    410.9    2.7    0.0000   0.0000          ?        ?  1688.2511  22.3483          ?        ?      410.9        2.7       ?       ? 
1 1 1   17    8   39 o   1055.8    3.8    0.0000   0.0000          ?        ? 11148.5879  79.8152          ?        ?     1055.8        3.8       ?       ? 
1 1 1   17    8   40 o   1074.5    3.8    0.0000   0.0000          ?        ? 11547.6641  81.7308          ?        ?     1074.5        3.8       ?       ? 
1 1 1   17    8   41 o    888.2    3.6    0.0000   0.0000          ?        ?  7889.5732  63.2136          ?        ?      888.2        3.6       ?       ? 
1 1 1   17    8   42 o    967.3    3.5    0.0000   0.0000          ?        ?  9358.1729  67.6833          ?        ?      967.3        3.5       ?       ? 
1 1 1   17    8   43 o    643.5    2.7    0.0000   0.0000          ?        ?  4141.4512  35.1187          ?        ?      643.5        2.7       ?       ? 
1 1 1   17    8   44 o    317.2    3.0    0.0000   0.0000          ?        ?  1006.3101  19.1556          ?        ?      317.2        3.0       ?       ? 
1 1 1   17    8   45 o    770.3    3.1    0.0000   0.0000          ?        ?  5934.4199  48.5276          ?        ?      770.3        3.1       ?       ? 
1 1 1   17    8   46 f    395.8    2.7    0.0000   0.0000          ?        ?  1566.9320  21.0712          ?        ?      395.8        2.7       ?       ? 
1 1 1   17    8   47 o    235.7    4.1    0.0000   0.0000          ?        ?   555.5138  19.1556          ?        ?      235.7        4.1       ?       ? 
1 1 1   17    8   48 o    165.3    5.4    0.0000   0.0000          ?        ?   273.2873  17.8786          ?        ?      165.3        5.4       ?       ? 
1 1 1   17    8   49 o    252.0    3.5    0.0000   0.0000          ?        ?   635.3290  17.8786          ?        ?      252.0        3.5       ?       ? 
1 1 1   17    8   50 o    280.3    3.5    0.0000   0.0000          ?        ?   786.0201  19.7942          ?        ?      280.3        3.5       ?       ? 
1 1 1   17    8   51 o    307.2    2.9    0.0000   0.0000          ?        ?   943.7350  17.8786          ?        ?      307.2        2.9       ?       ? 
1 1 1   17    8   52 o    177.2    5.0    0.0000   0.0000          ?        ?   314.1526  17.8786          ?        ?      177.2        5.0       ?       ? 
1 1 1   17    8   53 o    365.6    2.9    0.0000   0.0000          ?        ?  1337.0642  21.0712          ?        ?      365.6        2.9       ?       ? 
1 1 1   17    8   54 o     29.8   13.6    0.0000   0.0000          ?        ?   -11.4934  17.8786          ?        ?       29.8       13.6       ?       ? 
1 1 1   17    8   55 o     46.4   15.9    0.0000   0.0000          ?        ?    19.7942  17.8786          ?        ?       46.4       15.9       ?       ? 
1 1 1   17    8   56 o    144.4    6.4    0.0000   0.0000          ?        ?   208.7966  18.5171          ?        ?      144.4        6.4       ?       ? 
1 1 1   17    8   57 o    305.1    3.3    0.0000   0.0000          ?        ?   930.9645  20.4327          ?        ?      305.1        3.3       ?       ? 
1 1 1   17    8   58 o    240.3    4.1    0.0000   0.0000          ?        ?   577.8621  19.7942          ?        ?      240.3        4.1       ?       ? 
1 1 1   17    8   59 o     62.9   15.8    0.0000   0.0000          ?        ?    41.5039  19.7942          ?        ?       62.9       15.8       ?       ? 
1 1 1   17    8   60 o    397.3    2.9    0.0000   0.0000          ?        ?  1579.0640  22.9868          ?        ?      397.3        2.9       ?       ? 
1 1 1   17    8   61 o    439.3    2.8    0.0000   0.0000          ?        ?  1930.8894  24.9023          ?        ?      439.3        2.8       ?       ? 
1 1 1   17    8   62 f     34.1   14.9    0.0000   0.0000          ?        ?    -3.8311  19.1556          ?        ?       34.1       14.9       ?       ? 
1 1 1   17    8   63 o    169.7    5.8    0.0000   0.0000          ?        ?   288.6118  19.7942          ?        ?      169.7        5.8       ?       ? 
1 1 1   17    8   64 o    103.3    9.9    0.0000   0.0000          ?        ?   107.2716  20.4327          ?        ?      103.3        9.9       ?       ? 
1 1 1   17    8   65 o     26.5   12.8    0.0000   0.0000          ?        ?   -31.9261  20.4327          ?        ?       26.5       12.8       ?       ? 
1 1 1   17    8   66 o    108.7    8.8    0.0000   0.0000          ?        ?   118.7650  19.1556          ?        ?      108.7        8.8       ?       ? 
1 1 1   17    8   67 o    212.6    4.7    0.0000   0.0000          ?        ?   452.7119  19.7942          ?        ?      212.6        4.7       ?       ? 
1 1 1   17    8   68 o     21.5   10.8    0.0000   0.0000          ?        ?   -60.0210  20.4327          ?        ?       21.5       10.8       ?       ? 
1 1 1   17    8   69 o     37.9   16.1    0.0000   0.0000          ?        ?     1.2770  21.0712          ?        ?       37.9       16.1       ?       ? 
1 1 1   17    8   70 o    162.1    6.7    0.0000   0.0000          ?        ?   263.7094  21.7097          ?        ?      162.1        6.7       ?       ? 
1 1 1   17    8   71 o    124.6    8.5    0.0000   0.0000          ?        ?   156.4378  21.0712          ?        ?      124.6        8.5       ?       ? 
1 1 1   17    8   72 o    335.5    3.7    0.0000   0.0000          ?        ?  1127.6293  24.9023          ?        ?      335.5        3.7       ?       ? 
1 1 1   17    8   73 o    174.0    5.9    0.0000   0.0000          ?        ?   303.9363  20.4327          ?        ?      174.0        5.9       ?       ? 
1 1 1   17    8   74 o     29.8   14.2    0.0000   0.0000          ?        ?   -27.4564  22.9868          ?        ?       29.8       14.2       ?       ? 
1 1 1   17    8   75 f     91.2   11.9    0.0000   0.0000          ?        ?    84.9234  21.7097          ?        ?       91.2       11.9       ?       ? 
1 1 1   17    8   76 o     96.9   11.2    0.0000   0.0000          ?        ?    95.7782  21.7097          ?        ?       96.9       11.2       ?       ? 
1 1 1   17    8   77 f     26.1   12.6    0.0000   0.0000          ?        ?   -32.5646  20.4327          ?        ?       26.1       12.6       ?       ? 
1 1 1   17    8   78 o     81.8   12.1    0.0000   0.0000          ?        ?    68.9603  19.7942          ?        ?       81.8       12.1       ?       ? 
1 1 1   17    9    0 o   1123.5    6.1 12625.4883 136.0051 12625.4883 136.0051 12625.4883 136.0051     1123.5      6.1     1123.5        6.1     0.0     0.0 
1 1 1   17    9    1 o    418.2    2.0    0.0000   0.0000          ?        ?  1748.9106  16.6016          ?        ?      418.2        2.0       ?       ? 
1 1 1   17    9    2 f    394.6    1.9    0.0000   0.0000          ?        ?  1557.3542  14.6860          ?        ?      394.6        1.9       ?       ? 
1 1 1   17    9    3 f    362.9    1.8    0.0000   0.0000          ?        ?  1317.2701  12.7704          ?        ?      362.9        1.8       ?       ? 
1 1 1   17    9    4 o    981.2    3.4    0.0000   0.0000          ?        ?  9628.2676  67.0448          ?        ?      981.2        3.4       ?       ? 
1 1 1   17    9    5 o   1198.1    4.0    0.0000   0.0000          ?        ? 14355.8818  96.4168          ?        ?     1198.1        4.0       ?       ? 
1 1 1   17    9    6 o    606.0    2.3    0.0000   0.0000          ?        ?  3672.7764  28.0950          ?        ?      606.0        2.3       ?       ? 
1 1 1   17    9    7 o    737.2    2.8    0.0000   0.0000          ?        ?  5434.4575  40.8654          ?        ?      737.2        2.8       ?       ? 
1 1 1   17    9    8 o   1130.1    4.0    0.0000   0.0000          ?        ? 12772.3486  89.3930          ?        ?     1130.1        4.0       ?       ? 
1 1 1   17    9    9 o     14.8    6.9    0.0000   0.0000          ?        ?    -5.1082   5.1082          ?        ?       14.8        6.9       ?       ? 
1 1 1   17    9   10 o    615.6    2.4    0.0000   0.0000          ?        ?  3790.2642  29.3720          ?        ?      615.6        2.4       ?       ? 
1 1 1   17    9   11 o    589.0    2.3    0.0000   0.0000          ?        ?  3469.0879  26.8179          ?        ?      589.0        2.3       ?       ? 
1 1 1   17    9   12 o   1223.6    4.2    0.0000   0.0000          ?        ? 14973.9717 102.1635          ?        ?     1223.6        4.2       ?       ? 
1 1 1   17    9   13 o   1098.9    3.9    0.0000   0.0000          ?        ? 12076.3594  85.5619          ?        ?     1098.9        3.9       ?       ? 
1 1 1   17    9   14 o    240.7    2.4    0.0000   0.0000          ?        ?   579.1391  11.4934          ?        ?      240.7        2.4       ?       ? 
1 1 1   17    9   15 o   1169.5    4.0    0.0000   0.0000          ?        ? 13678.4102  93.8627          ?        ?     1169.5        4.0       ?       ? 
1 1 1   17    9   16 o    447.6    2.1    0.0000   0.0000          ?        ?  2003.6808  19.1556          ?        ?      447.6        2.1       ?       ? 
1 1 1   17    9   17 o   1316.0    4.7    0.0000   0.0000          ?        ? 17320.5391 122.5962          ?        ?     1316.0        4.7       ?       ? 
1 1 1   17    9   18 o     12.9    6.5    0.0000   0.0000          ?        ?   -28.7335   8.3008          ?        ?       12.9        6.5       ?       ? 
1 1 1   17    9   19 o   1337.4    4.6    0.0000   0.0000          ?        ? 17887.5449 123.8732          ?        ?     1337.4        4.6       ?       ? 
1 1 1   17    9   20 o    166.8    2.9    0.0000   0.0000          ?        ?   278.3954   9.5778          ?        ?      166.8        2.9       ?       ? 
1 1 1   17    9   21 o    308.3    2.2    0.0000   0.0000          ?        ?   950.7587  13.4090          ?        ?      308.3        2.2       ?       ? 
1 1 1   17    9   22 o   1532.1    5.1    0.0000   0.0000          ?        ? 23474.6094 156.4378          ?        ?     1532.1        5.1       ?       ? 
1 1 1   17    9   23 o    575.2    2.5    0.0000   0.0000          ?        ?  3308.1804  28.7335          ?        ?      575.2        2.5       ?       ? 
1 1 1   17    9   24 o   1329.8    4.7    0.0000   0.0000          ?        ? 17685.1328 125.1502          ?        ?     1329.8        4.7       ?       ? 
1 1 1   17    9   25 o   1332.1    4.6    0.0000   0.0000          ?        ? 17745.7930 122.5962          ?        ?     1332.1        4.6       ?       ? 
1 1 1   17    9   26 o   1486.2    5.2    0.0000   0.0000          ?        ? 22090.2949 155.7993          ?        ?     1486.2        5.2       ?       ? 
1 1 1   17    9   27 o    763.6    3.1    0.0000   0.0000          ?        ?  5831.6182  46.6121          ?        ?      763.6        3.1       ?       ? 
1 1 1   17    9   28 o    854.7    3.2    0.0000   0.0000          ?        ?  7304.6875  55.5514          ?        ?      854.7        3.2       ?       ? 
1 1 1   17    9   29 f    299.6    2.5    0.0000   0.0000          ?        ?   897.7615  14.6860          ?        ?      299.6        2.5       ?       ? 
1 1 1   17    9   30 o    587.5    2.7    0.0000   0.0000          ?        ?  3451.8477  31.9261          ?        ?      587.5        2.7       ?       ? 
1 1 1   17    9   31 o    924.9    3.9    0.0000   0.0000          ?        ?  8554.2734  72.7915          ?        ?      924.9        3.9       ?       ? 
1 1 1   17    9   32 o   1339.7    5.0    0.0000   0.0000          ?        ? 17951.3965 134.7281          ?        ?     1339.7        5.0       ?       ? 
1 1 1   17    9   33 o   1239.4    4.8    0.0000   0.0000          ?        ? 15362.8301 119.4035          ?        ?     1239.4        4.8       ?       ? 
1 1 1   17    9   34 o   1073.1    4.2    0.0000   0.0000          ?        ? 11515.7373  90.6701          ?        ?     1073.1        4.2       ?       ? 
1 1 1   17    9   35 f    979.5    4.0    0.0000   0.0000          ?        ?  9594.4258  79.1767          ?        ?      979.5        4.0       ?       ? 
1 1 1   17    9   36 o    418.0    2.7    0.0000   0.0000          ?        ?  1747.6338  22.9868          ?        ?      418.0        2.7       ?       ? 
1 1 1   17    9   37 o   1332.7    5.0    0.0000   0.0000          ?        ? 17764.3105 132.8125          ?        ?     1332.7        5.0       ?       ? 
1 1 1   17    9   38 o   1007.6    3.7    0.0000   0.0000          ?        ? 10154.4102  74.0685          ?        ?     1007.6        3.7       ?       ? 
1 1 1   17    9   39 o    537.4    2.7    0.0000   0.0000          ?        ?  2888.0332  28.7335          ?        ?      537.4        2.7       ?       ? 
1 1 1   17    9   40 o    474.4    2.8    0.0000   0.0000          ?        ?  2250.7888  26.1794          ?        ?      474.4        2.8       ?       ? 
1 1 1   17    9   41 o     97.8    8.8    0.0000   0.0000          ?        ?    95.7782  17.2401          ?        ?       97.8        8.8       ?       ? 
1 1 1   17    9   42 o    334.1    3.2    0.0000   0.0000          ?        ?  1116.1359  21.0712          ?        ?      334.1        3.2       ?       ? 
1 1 1   17    9   43 o    760.8    3.1    0.0000   0.0000          ?        ?  5789.4756  47.2506          ?        ?      760.8        3.1       ?       ? 
1 1 1   17    9   44 o    666.8    3.0    0.0000   0.0000          ?        ?  4446.6646  39.5883          ?        ?      666.8        3.0       ?       ? 
1 1 1   17    9   45 f    578.0    2.7    0.0000   0.0000          ?        ?  3340.7451  31.2876          ?        ?      578.0        2.7       ?       ? 
1 1 1   17    9   46 o    797.7    3.2    0.0000   0.0000          ?        ?  6364.7837  51.7203          ?        ?      797.7        3.2       ?       ? 
1 1 1   17    9   47 o    545.6    2.8    0.0000   0.0000          ?        ?  2976.7878  30.0105          ?        ?      545.6        2.8       ?       ? 
1 1 1   17    9   48 o    152.6    5.6    0.0000   0.0000          ?        ?   233.0604  17.2401          ?        ?      152.6        5.6       ?       ? 
1 1 1   17    9   49 o    436.4    2.6    0.0000   0.0000          ?        ?  1904.7100  22.9868          ?        ?      436.4        2.6       ?       ? 
1 1 1   17    9   50 f    176.7    4.9    0.0000   0.0000          ?        ?   312.2371  17.2401          ?        ?      176.7        4.9       ?       ? 
1 1 1   17    9   51 o    492.8    2.7    0.0000   0.0000          ?        ?  2428.9363  26.8179          ?        ?      492.8        2.7       ?       ? 
1 1 1   17    9   52 o    287.5    3.4    0.0000   0.0000          ?        ?   826.8855  19.7942          ?        ?      287.5        3.4       ?       ? 
1 1 1   17    9   53 o    118.7    7.5    0.0000   0.0000          ?        ?   141.1133  17.8786          ?        ?      118.7        7.5       ?       ? 
1 1 1   17    9   54 o    134.6    6.9    0.0000   0.0000          ?        ?   181.3401  18.5171          ?        ?      134.6        6.9       ?       ? 
1 1 1   17    9   55 o    389.0    2.9    0.0000   0.0000          ?        ?  1513.9348  22.3483          ?        ?      389.0        2.9       ?       ? 
1 1 1   17    9   56 o    419.6    2.7    0.0000   0.0000          ?        ?  1761.0426  22.9868          ?        ?      419.6        2.7       ?       ? 
1 1 1   17    9   57 o    439.0    2.7    0.0000   0.0000          ?        ?  1927.6968  23.6253          ?        ?      439.0        2.7       ?       ? 
1 1 1   17    9   58 o    331.8    3.2    0.0000   0.0000          ?        ?  1101.4498  21.0712          ?        ?      331.8        3.2       ?       ? 
1 1 1   17    9   59 o    137.8    7.0    0.0000   0.0000          ?        ?   190.2794  19.1556          ?        ?      137.8        7.0       ?       ? 
1 1 1   17    9   60 o    549.5    2.7    0.0000   0.0000          ?        ?  3020.2073  29.3720          ?        ?      549.5        2.7       ?       ? 
1 1 1   17    9   61 f    258.6    3.8    0.0000   0.0000          ?        ?   669.1707  19.7942          ?        ?      258.6        3.8       ?       ? 
1 1 1   17    9   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    9   63 o    207.6    4.6    0.0000   0.0000          ?        ?   431.6406  19.1556          ?        ?      207.6        4.6       ?       ? 
1 1 1   17    9   64 o    112.5    8.8    0.0000   0.0000          ?        ?   127.0658  19.7942          ?        ?      112.5        8.8       ?       ? 
1 1 1   17    9   65 o     65.1   15.0    0.0000   0.0000          ?        ?    44.6965  19.1556          ?        ?       65.1       15.0       ?       ? 
1 1 1   17    9   66 o    233.6    4.5    0.0000   0.0000          ?        ?   546.5745  21.0712          ?        ?      233.6        4.5       ?       ? 
1 1 1   17    9   67 f    264.6    4.1    0.0000   0.0000          ?        ?   701.0967  21.7097          ?        ?      264.6        4.1       ?       ? 
1 1 1   17    9   68 o    276.7    4.0    0.0000   0.0000          ?        ?   766.8644  22.3483          ?        ?      276.7        4.0       ?       ? 
1 1 1   17    9   69 o    237.0    4.7    0.0000   0.0000          ?        ?   562.5375  22.3483          ?        ?      237.0        4.7       ?       ? 
1 1 1   17    9   70 o    404.8    3.1    0.0000   0.0000          ?        ?  1640.3621  24.9023          ?        ?      404.8        3.1       ?       ? 
1 1 1   17    9   71 o     45.4   17.4    0.0000   0.0000          ?        ?    14.6860  22.3483          ?        ?       45.4       17.4       ?       ? 
1 1 1   17    9   72 o     22.9   11.5    0.0000   0.0000          ?        ?   -58.1055  21.7097          ?        ?       22.9       11.5       ?       ? 
1 1 1   17    9   73 o    207.3    4.9    0.0000   0.0000          ?        ?   431.0021  20.4327          ?        ?      207.3        4.9       ?       ? 
1 1 1   17    9   74 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17    9   75 o    189.8    5.9    0.0000   0.0000          ?        ?   362.0418  22.3483          ?        ?      189.8        5.9       ?       ? 
1 1 1   17    9   76 o     91.7   11.8    0.0000   0.0000          ?        ?    86.2004  21.7097          ?        ?       91.7       11.8       ?       ? 
1 1 1   17    9   77 o     34.5   15.3    0.0000   0.0000          ?        ?    -5.7467  21.0712          ?        ?       34.5       15.3       ?       ? 
1 1 1   17   10    0 o   1248.3    6.7 15584.3975 166.0156 15584.3975 166.0156 15584.3975 166.0156     1248.3      6.7     1248.3        6.7     0.0     0.0 
1 1 1   17   10    1 o    965.6    3.8    0.0000   0.0000          ?        ?  9323.6924  72.7915          ?        ?      965.6        3.8       ?       ? 
1 1 1   17   10    2 o   1304.6    4.7    0.0000   0.0000          ?        ? 17020.4336 123.2347          ?        ?     1304.6        4.7       ?       ? 
1 1 1   17   10    3 o   1370.5    4.9    0.0000   0.0000          ?        ? 18784.0293 134.7281          ?        ?     1370.5        4.9       ?       ? 
1 1 1   17   10    4 o   1210.2    4.2    0.0000   0.0000          ?        ? 14647.6865 101.5249          ?        ?     1210.2        4.2       ?       ? 
1 1 1   17   10    5 o    868.0    3.1    0.0000   0.0000          ?        ?  7533.9170  54.2743          ?        ?      868.0        3.1       ?       ? 
1 1 1   17   10    6 o   1027.8    3.5    0.0000   0.0000          ?        ? 10564.3398  72.7915          ?        ?     1027.8        3.5       ?       ? 
1 1 1   17   10    7 o    591.4    2.3    0.0000   0.0000          ?        ?  3497.1831  26.8179          ?        ?      591.4        2.3       ?       ? 
1 1 1   17   10    8 o   1335.9    4.5    0.0000   0.0000          ?        ? 17846.6797 120.0421          ?        ?     1335.9        4.5       ?       ? 
1 1 1   17   10    9 o    884.4    3.1    0.0000   0.0000          ?        ?  7821.2515  55.5514          ?        ?      884.4        3.1       ?       ? 
1 1 1   17   10   10 o    850.1    3.1    0.0000   0.0000          ?        ?  7226.7881  52.9973          ?        ?      850.1        3.1       ?       ? 
1 1 1   17   10   11 o    765.6    2.8    0.0000   0.0000          ?        ?  5861.6284  42.7809          ?        ?      765.6        2.8       ?       ? 
1 1 1   17   10   12 o   1854.8    6.1    0.0000   0.0000          ?        ? 34406.7383 224.7596          ?        ?     1854.8        6.1       ?       ? 
1 1 1   17   10   13 o   1099.6    4.0    0.0000   0.0000          ?        ? 12091.6836  87.4775          ?        ?     1099.6        4.0       ?       ? 
1 1 1   17   10   14 o   1020.6    3.6    0.0000   0.0000          ?        ? 10416.2031  73.4300          ?        ?     1020.6        3.6       ?       ? 
1 1 1   17   10   15 o    331.7    1.9    0.0000   0.0000          ?        ?  1100.1727  12.7704          ?        ?      331.7        1.9       ?       ? 
1 1 1   17   10   16 o    464.1    2.1    0.0000   0.0000          ?        ?  2154.3718  19.7942          ?        ?      464.1        2.1       ?       ? 
1 1 1   17   10   17 o    440.3    2.0    0.0000   0.0000          ?        ?  1938.5518  17.8786          ?        ?      440.3        2.0       ?       ? 
1 1 1   17   10   18 o    675.3    2.6    0.0000   0.0000          ?        ?  4560.3218  35.7572          ?        ?      675.3        2.6       ?       ? 
1 1 1   17   10   19 o   1113.1    3.9    0.0000   0.0000          ?        ? 12390.5117  87.4775          ?        ?     1113.1        3.9       ?       ? 
1 1 1   17   10   20 o    603.7    2.5    0.0000   0.0000          ?        ?  3644.6814  30.6490          ?        ?      603.7        2.5       ?       ? 
1 1 1   17   10   21 o   1063.5    3.8    0.0000   0.0000          ?        ? 11310.1338  80.4537          ?        ?     1063.5        3.8       ?       ? 
1 1 1   17   10   22 o    196.7    3.1    0.0000   0.0000          ?        ?   386.9441  12.1319          ?        ?      196.7        3.1       ?       ? 
1 1 1   17   10   23 o    630.1    2.7    0.0000   0.0000          ?        ?  3970.9661  33.8416          ?        ?      630.1        2.7       ?       ? 
1 1 1   17   10   24 o   1218.8    4.2    0.0000   0.0000          ?        ? 14855.8447 102.1635          ?        ?     1218.8        4.2       ?       ? 
1 1 1   17   10   25 o    263.8    2.8    0.0000   0.0000          ?        ?   695.9886  14.6860          ?        ?      263.8        2.8       ?       ? 
1 1 1   17   10   26 o    212.3    3.3    0.0000   0.0000          ?        ?   450.7963  14.0475          ?        ?      212.3        3.3       ?       ? 
1 1 1   17   10   27 f    787.8    3.1    0.0000   0.0000          ?        ?  6207.0684  48.5276          ?        ?      787.8        3.1       ?       ? 
1 1 1   17   10   28 o    448.0    2.4    0.0000   0.0000          ?        ?  2006.8734  21.0712          ?        ?      448.0        2.4       ?       ? 
1 1 1   17   10   29 o   1332.6    4.5    0.0000   0.0000          ?        ? 17759.8398 119.4035          ?        ?     1332.6        4.5       ?       ? 
1 1 1   17   10   30 o    708.0    2.9    0.0000   0.0000          ?        ?  5013.0332  41.5039          ?        ?      708.0        2.9       ?       ? 
1 1 1   17   10   31 o    916.3    3.5    0.0000   0.0000          ?        ?  8396.5596  64.4907          ?        ?      916.3        3.5       ?       ? 
1 1 1   17   10   32 o    885.2    3.7    0.0000   0.0000          ?        ?  7835.9370  65.7677          ?        ?      885.2        3.7       ?       ? 
1 1 1   17   10   33 o    469.8    3.0    0.0000   0.0000          ?        ?  2207.3694  28.0950          ?        ?      469.8        3.0       ?       ? 
1 1 1   17   10   34 o   1335.2    4.7    0.0000   0.0000          ?        ? 17830.7168 126.4273          ?        ?     1335.2        4.7       ?       ? 
1 1 1   17   10   35 o    744.4    3.1    0.0000   0.0000          ?        ?  5541.0908  46.6121          ?        ?      744.4        3.1       ?       ? 
1 1 1   17   10   36 o    541.0    2.7    0.0000   0.0000          ?        ?  2926.9832  29.3720          ?        ?      541.0        2.7       ?       ? 
1 1 1   17   10   37 o     49.8   15.9    0.0000   0.0000          ?        ?    24.2638  17.8786          ?        ?       49.8       15.9       ?       ? 
1 1 1   17   10   38 f     27.4   13.1    0.0000   0.0000          ?        ?   -28.7335  20.4327          ?        ?       27.4       13.1       ?       ? 
1 1 1   17   10   39 o    504.2    2.6    0.0000   0.0000          ?        ?  2541.9546  26.1794          ?        ?      504.2        2.6       ?       ? 
1 1 1   17   10   40 o     25.8   12.1    0.0000   0.0000          ?        ?   -17.2401  15.9630          ?        ?       25.8       12.1       ?       ? 
1 1 1   17   10   41 o    376.1    2.9    0.0000   0.0000          ?        ?  1414.3254  21.7097          ?        ?      376.1        2.9       ?       ? 
1 1 1   17   10   42 o    366.6    2.9    0.0000   0.0000          ?        ?  1344.0880  21.0712          ?        ?      366.6        2.9       ?       ? 
1 1 1   17   10   43 o    859.0    3.4    0.0000   0.0000          ?        ?  7379.3940  58.1055          ?        ?      859.0        3.4       ?       ? 
1 1 1   17   10   44 o    324.7    3.1    0.0000   0.0000          ?        ?  1054.1992  20.4327          ?        ?      324.7        3.1       ?       ? 
1 1 1   17   10   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   10   46 f    371.1    2.9    0.0000   0.0000          ?        ?  1377.2911  21.7097          ?        ?      371.1        2.9       ?       ? 
1 1 1   17   10   47 o    488.7    2.6    0.0000   0.0000          ?        ?  2388.7095  25.5409          ?        ?      488.7        2.6       ?       ? 
1 1 1   17   10   48 o    765.9    3.2    0.0000   0.0000          ?        ?  5867.3755  48.5276          ?        ?      765.9        3.2       ?       ? 
1 1 1   17   10   49 f    220.0    4.1    0.0000   0.0000          ?        ?   483.9994  17.8786          ?        ?      220.0        4.1       ?       ? 
1 1 1   17   10   50 o    270.8    3.4    0.0000   0.0000          ?        ?   733.6614  18.5171          ?        ?      270.8        3.4       ?       ? 
1 1 1   17   10   51 o    394.1    2.7    0.0000   0.0000          ?        ?  1553.5232  21.0712          ?        ?      394.1        2.7       ?       ? 
1 1 1   17   10   52 o     68.8   13.0    0.0000   0.0000          ?        ?    49.1662  17.2401          ?        ?       68.8       13.0       ?       ? 
1 1 1   17   10   53 o    184.6    4.7    0.0000   0.0000          ?        ?   340.9706  17.2401          ?        ?      184.6        4.7       ?       ? 
1 1 1   17   10   54 o     67.9   13.2    0.0000   0.0000          ?        ?    47.8891  17.2401          ?        ?       67.9       13.2       ?       ? 
1 1 1   17   10   55 o    149.6    6.0    0.0000   0.0000          ?        ?   224.1211  17.8786          ?        ?      149.6        6.0       ?       ? 
1 1 1   17   10   56 o     19.6    9.9    0.0000   0.0000          ?        ?   -56.8284  17.8786          ?        ?       19.6        9.9       ?       ? 
1 1 1   17   10   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   10   58 o    391.2    2.8    0.0000   0.0000          ?        ?  1531.1749  21.7097          ?        ?      391.2        2.8       ?       ? 
1 1 1   17   10   59 o     22.9   11.3    0.0000   0.0000          ?        ?   -44.0580  19.1556          ?        ?       22.9       11.3       ?       ? 
1 1 1   17   10   60 o    368.5    3.0    0.0000   0.0000          ?        ?  1358.7740  22.3483          ?        ?      368.5        3.0       ?       ? 
1 1 1   17   10   61 o    465.8    2.8    0.0000   0.0000          ?        ?  2170.9736  26.1794          ?        ?      465.8        2.8       ?       ? 
1 1 1   17   10   62 o     27.3   13.0    0.0000   0.0000          ?        ?   -23.6253  19.1556          ?        ?       27.3       13.0       ?       ? 
1 1 1   17   10   63 o    164.0    6.2    0.0000   0.0000          ?        ?   269.4561  20.4327          ?        ?      164.0        6.2       ?       ? 
1 1 1   17   10   64 o    256.4    4.1    0.0000   0.0000          ?        ?   658.3158  21.0712          ?        ?      256.4        4.1       ?       ? 
1 1 1   17   10   65 o    137.7    7.0    0.0000   0.0000          ?        ?   190.2794  19.1556          ?        ?      137.7        7.0       ?       ? 
1 1 1   17   10   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   10   67 o     84.1   12.1    0.0000   0.0000          ?        ?    71.5144  20.4327          ?        ?       84.1       12.1       ?       ? 
1 1 1   17   10   68 o    198.6    5.3    0.0000   0.0000          ?        ?   395.2449  21.0712          ?        ?      198.6        5.3       ?       ? 
1 1 1   17   10   69 o     44.3   17.0    0.0000   0.0000          ?        ?    14.0475  21.0712          ?        ?       44.3       17.0       ?       ? 
1 1 1   17   10   70 o     45.0   16.8    0.0000   0.0000          ?        ?    15.9630  20.4327          ?        ?       45.0       16.8       ?       ? 
1 1 1   17   10   71 o    139.1    7.6    0.0000   0.0000          ?        ?   194.7491  21.0712          ?        ?      139.1        7.6       ?       ? 
1 1 1   17   10   72 o    203.6    5.2    0.0000   0.0000          ?        ?   415.6776  21.0712          ?        ?      203.6        5.2       ?       ? 
1 1 1   17   10   73 o    210.3    5.3    0.0000   0.0000          ?        ?   443.7725  22.3483          ?        ?      210.3        5.3       ?       ? 
1 1 1   17   10   74 o     31.6   14.5    0.0000   0.0000          ?        ?   -14.6860  21.0712          ?        ?       31.6       14.5       ?       ? 
1 1 1   17   10   75 o     54.5   16.6    0.0000   0.0000          ?        ?    31.2876  19.7942          ?        ?       54.5       16.6       ?       ? 
1 1 1   17   10   76 o    180.6    5.8    0.0000   0.0000          ?        ?   328.2001  21.0712          ?        ?      180.6        5.8       ?       ? 
1 1 1   17   10   77 o    157.9    6.5    0.0000   0.0000          ?        ?   251.5775  20.4327          ?        ?      157.9        6.5       ?       ? 
1 1 1   17   11    0 o    402.7    2.9 1621.8450  23.6253  1621.8450  23.6253  1621.8450  23.6253      402.7      2.9      402.7        2.9     0.0     0.0 
1 1 1   17   11    1 o    454.6    2.3    0.0000   0.0000          ?        ?  2066.8945  21.0712          ?        ?      454.6        2.3       ?       ? 
1 1 1   17   11    2 o   2095.7    7.4    0.0000   0.0000          ?        ? 43930.2891 312.2371          ?        ?     2095.7        7.4       ?       ? 
1 1 1   17   11    3 o   1624.1    5.7    0.0000   0.0000          ?        ? 26380.5215 186.4483          ?        ?     1624.1        5.7       ?       ? 
1 1 1   17   11    4 o    240.7    1.7    0.0000   0.0000          ?        ?   579.1391   8.3008          ?        ?      240.7        1.7       ?       ? 
1 1 1   17   11    5 o   1011.8    3.5    0.0000   0.0000          ?        ? 10238.0557  71.5144          ?        ?     1011.8        3.5       ?       ? 
1 1 1   17   11    6 o    349.6    1.7    0.0000   0.0000          ?        ?  1222.1304  12.1319          ?        ?      349.6        1.7       ?       ? 
1 1 1   17   11    7 o   1427.1    4.9    0.0000   0.0000          ?        ? 20368.2012 138.5592          ?        ?     1427.1        4.9       ?       ? 
1 1 1   17   11    8 o    683.4    2.6    0.0000   0.0000          ?        ?  4670.7856  35.7572          ?        ?      683.4        2.6       ?       ? 
1 1 1   17   11    9 o    969.2    3.4    0.0000   0.0000          ?        ?  9394.5693  65.7677          ?        ?      969.2        3.4       ?       ? 
1 1 1   17   11   10 o   1068.2    3.7    0.0000   0.0000          ?        ? 11410.3818  78.5382          ?        ?     1068.2        3.7       ?       ? 
1 1 1   17   11   11 o    236.9    2.0    0.0000   0.0000          ?        ?   561.2605   9.5778          ?        ?      236.9        2.0       ?       ? 
1 1 1   17   11   12 o    552.9    2.3    0.0000   0.0000          ?        ?  3057.2415  24.9023          ?        ?      552.9        2.3       ?       ? 
1 1 1   17   11   13 o   1318.0    4.4    0.0000   0.0000          ?        ? 17373.5352 116.8494          ?        ?     1318.0        4.4       ?       ? 
1 1 1   17   11   14 o   1163.8    4.1    0.0000   0.0000          ?        ? 13544.9600  94.5012          ?        ?     1163.8        4.1       ?       ? 
1 1 1   17   11   15 o    800.7    3.0    0.0000   0.0000          ?        ?  6412.0342  48.5276          ?        ?      800.7        3.0       ?       ? 
1 1 1   17   11   16 o    814.5    3.0    0.0000   0.0000          ?        ?  6633.6016  48.5276          ?        ?      814.5        3.0       ?       ? 
1 1 1   17   11   17 o    760.6    3.0    0.0000   0.0000          ?        ?  5785.0059  45.3350          ?        ?      760.6        3.0       ?       ? 
1 1 1   17   11   18 o   1173.9    4.1    0.0000   0.0000          ?        ? 13779.9355  97.0553          ?        ?     1173.9        4.1       ?       ? 
1 1 1   17   11   19 o    565.5    2.9    0.0000   0.0000          ?        ?  3198.3547  32.5646          ?        ?      565.5        2.9       ?       ? 
1 1 1   17   11   20 f   1383.8    5.0    0.0000   0.0000          ?        ? 19149.9023 137.9207          ?        ?     1383.8        5.0       ?       ? 
1 1 1   17   11   21 o    875.1    3.3    0.0000   0.0000          ?        ?  7657.7900  58.1055          ?        ?      875.1        3.3       ?       ? 
1 1 1   17   11   22 o    396.0    2.4    0.0000   0.0000          ?        ?  1568.2091  19.1556          ?        ?      396.0        2.4       ?       ? 
1 1 1   17   11   23 o    672.7    2.8    0.0000   0.0000          ?        ?  4525.2026  38.3113          ?        ?      672.7        2.8       ?       ? 
1 1 1   17   11   24 o   1432.1    5.3    0.0000   0.0000          ?        ? 20511.2305 150.6911          ?        ?     1432.1        5.3       ?       ? 
1 1 1   17   11   25 o    574.3    2.7    0.0000   0.0000          ?        ?  3297.9641  30.6490          ?        ?      574.3        2.7       ?       ? 
1 1 1   17   11   26 o   1289.9    4.5    0.0000   0.0000          ?        ? 16639.2344 115.5724          ?        ?     1289.9        4.5       ?       ? 
1 1 1   17   11   27 o    523.2    2.7    0.0000   0.0000          ?        ?  2737.3423  28.7335          ?        ?      523.2        2.7       ?       ? 
1 1 1   17   11   28 o    708.0    2.9    0.0000   0.0000          ?        ?  5012.3945  41.5039          ?        ?      708.0        2.9       ?       ? 
1 1 1   17   11   29 o   1399.2    4.9    0.0000   0.0000          ?        ? 19578.3496 137.9207          ?        ?     1399.2        4.9       ?       ? 
1 1 1   17   11   30 o    755.9    3.3    0.0000   0.0000          ?        ?  5714.1304  49.1662          ?        ?      755.9        3.3       ?       ? 
1 1 1   17   11   31 o    700.9    3.0    0.0000   0.0000          ?        ?  4912.1470  41.5039          ?        ?      700.9        3.0       ?       ? 
1 1 1   17   11   32 o   1760.3    6.0    0.0000   0.0000          ?        ? 30991.2871 212.6277          ?        ?     1760.3        6.0       ?       ? 
1 1 1   17   11   33 o   1264.4    4.7    0.0000   0.0000          ?        ? 15987.9424 118.7650          ?        ?     1264.4        4.7       ?       ? 
1 1 1   17   11   34 o    301.1    3.1    0.0000   0.0000          ?        ?   906.7007  18.5171          ?        ?      301.1        3.1       ?       ? 
1 1 1   17   11   35 f     34.7   14.8    0.0000   0.0000          ?        ?     0.0000  17.8786          ?        ?       34.7       14.8       ?       ? 
1 1 1   17   11   36 f    406.3    2.7    0.0000   0.0000          ?        ?  1651.2169  21.7097          ?        ?      406.3        2.7       ?       ? 
1 1 1   17   11   37 o    498.3    2.9    0.0000   0.0000          ?        ?  2483.2104  29.3720          ?        ?      498.3        2.9       ?       ? 
1 1 1   17   11   38 o    537.4    2.7    0.0000   0.0000          ?        ?  2888.0332  29.3720          ?        ?      537.4        2.7       ?       ? 
1 1 1   17   11   39 o    243.7    3.5    0.0000   0.0000          ?        ?   593.8251  17.2401          ?        ?      243.7        3.5       ?       ? 
1 1 1   17   11   40 o    182.9    4.7    0.0000   0.0000          ?        ?   334.5853  17.2401          ?        ?      182.9        4.7       ?       ? 
1 1 1   17   11   41 o    696.6    2.9    0.0000   0.0000          ?        ?  4852.7642  40.2269          ?        ?      696.6        2.9       ?       ? 
1 1 1   17   11   42 o    501.0    2.5    0.0000   0.0000          ?        ?  2510.6670  25.5409          ?        ?      501.0        2.5       ?       ? 
1 1 1   17   11   43 o    487.7    2.6    0.0000   0.0000          ?        ?  2379.1316  25.5409          ?        ?      487.7        2.6       ?       ? 
1 1 1   17   11   44 o    225.0    4.4    0.0000   0.0000          ?        ?   506.3477  19.7942          ?        ?      225.0        4.4       ?       ? 
1 1 1   17   11   45 o   1080.0    3.8    0.0000   0.0000          ?        ? 11666.4287  83.0078          ?        ?     1080.0        3.8       ?       ? 
1 1 1   17   11   46 o    573.1    2.8    0.0000   0.0000          ?        ?  3285.1938  31.9261          ?        ?      573.1        2.8       ?       ? 
1 1 1   17   11   47 o    674.1    2.8    0.0000   0.0000          ?        ?  4544.3584  38.3113          ?        ?      674.1        2.8       ?       ? 
1 1 1   17   11   48 o    677.4    3.0    0.0000   0.0000          ?        ?  4589.0552  40.2269          ?        ?      677.4        3.0       ?       ? 
1 1 1   17   11   49 o    410.5    2.7    0.0000   0.0000          ?        ?  1685.0586  22.3483          ?        ?      410.5        2.7       ?       ? 
1 1 1   17   11   50 o    689.8    2.8    0.0000   0.0000          ?        ?  4758.9014  38.9498          ?        ?      689.8        2.8       ?       ? 
1 1 1   17   11   51 o    127.0    6.8    0.0000   0.0000          ?        ?   161.5460  17.2401          ?        ?      127.0        6.8       ?       ? 
1 1 1   17   11   52 o     50.8   16.2    0.0000   0.0000          ?        ?    25.5409  18.5171          ?        ?       50.8       16.2       ?       ? 
1 1 1   17   11   53 o    192.2    4.7    0.0000   0.0000          ?        ?   369.7040  17.8786          ?        ?      192.2        4.7       ?       ? 
1 1 1   17   11   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   11   55 f    328.8    3.0    0.0000   0.0000          ?        ?  1081.6556  19.7942          ?        ?      328.8        3.0       ?       ? 
1 1 1   17   11   56 o    442.0    2.8    0.0000   0.0000          ?        ?  1953.8762  24.9023          ?        ?      442.0        2.8       ?       ? 
1 1 1   17   11   57 o    342.3    3.1    0.0000   0.0000          ?        ?  1172.3258  21.0712          ?        ?      342.3        3.1       ?       ? 
1 1 1   17   11   58 f    609.3    2.8    0.0000   0.0000          ?        ?  3713.6416  34.4802          ?        ?      609.3        2.8       ?       ? 
1 1 1   17   11   59 o    121.0    7.9    0.0000   0.0000          ?        ?   146.8600  19.1556          ?        ?      121.0        7.9       ?       ? 
1 1 1   17   11   60 o    189.0    5.1    0.0000   0.0000          ?        ?   357.5721  19.1556          ?        ?      189.0        5.1       ?       ? 
1 1 1   17   11   61 o     23.5   11.6    0.0000   0.0000          ?        ?   -40.2269  19.1556          ?        ?       23.5       11.6       ?       ? 
1 1 1   17   11   62 o    413.8    2.9    0.0000   0.0000          ?        ?  1713.1534  23.6253          ?        ?      413.8        2.9       ?       ? 
1 1 1   17   11   63 o    274.6    3.7    0.0000   0.0000          ?        ?   754.7325  20.4327          ?        ?      274.6        3.7       ?       ? 
1 1 1   17   11   64 o    197.5    5.2    0.0000   0.0000          ?        ?   390.7752  20.4327          ?        ?      197.5        5.2       ?       ? 
1 1 1   17   11   65 o     73.4   13.6    0.0000   0.0000          ?        ?    56.1899  19.1556          ?        ?       73.4       13.6       ?       ? 
1 1 1   17   11   66 o     78.6   13.0    0.0000   0.0000          ?        ?    62.5751  20.4327          ?        ?       78.6       13.0       ?       ? 
1 1 1   17   11   67 o     39.0   16.0    0.0000   0.0000          ?        ?     5.7467  19.7942          ?        ?       39.0       16.0       ?       ? 
1 1 1   17   11   68 o    170.4    6.0    0.0000   0.0000          ?        ?   291.1659  20.4327          ?        ?      170.4        6.0       ?       ? 
1 1 1   17   11   69 o     64.4   15.5    0.0000   0.0000          ?        ?    44.0580  19.7942          ?        ?       64.4       15.5       ?       ? 
1 1 1   17   11   70 o    163.6    6.6    0.0000   0.0000          ?        ?   268.8176  21.7097          ?        ?      163.6        6.6       ?       ? 
1 1 1   17   11   71 o     46.9   16.9    0.0000   0.0000          ?        ?    19.1556  20.4327          ?        ?       46.9       16.9       ?       ? 
1 1 1   17   11   72 o    130.3    8.1    0.0000   0.0000          ?        ?   171.1238  21.0712          ?        ?      130.3        8.1       ?       ? 
1 1 1   17   11   73 o    108.0   10.1    0.0000   0.0000          ?        ?   118.1265  21.7097          ?        ?      108.0       10.1       ?       ? 
1 1 1   17   11   74 o     19.8   10.0    0.0000   0.0000          ?        ?   -68.3218  19.7942          ?        ?       19.8       10.0       ?       ? 
1 1 1   17   11   75 o    130.0    7.4    0.0000   0.0000          ?        ?   170.4853  19.1556          ?        ?      130.0        7.4       ?       ? 
1 1 1   17   11   76 o     22.2   11.1    0.0000   0.0000          ?        ?   -50.4432  19.7942          ?        ?       22.2       11.1       ?       ? 
1 1 1   17   11   77 o    118.3    8.9    0.0000   0.0000          ?        ?   142.3903  21.0712          ?        ?      118.3        8.9       ?       ? 
1 1 1   17   12    0 o    679.0    4.1 4611.4033  55.5514  4611.4033  55.5514  4611.4033  55.5514      679.0      4.1      679.0        4.1     0.0     0.0 
1 1 1   17   12    1 o   1627.9    5.9    0.0000   0.0000          ?        ? 26503.1191 193.4720          ?        ?     1627.9        5.9       ?       ? 
1 1 1   17   12    2 o   1071.3    4.1    0.0000   0.0000          ?        ? 11477.4258  87.4775          ?        ?     1071.3        4.1       ?       ? 
1 1 1   17   12    3 o    825.0    3.3    0.0000   0.0000          ?        ?  6806.6406  54.2743          ?        ?      825.0        3.3       ?       ? 
1 1 1   17   12    4 o   1001.8    3.7    0.0000   0.0000          ?        ? 10035.6445  73.4300          ?        ?     1001.8        3.7       ?       ? 
1 1 1   17   12    5 o   1012.8    3.7    0.0000   0.0000          ?        ? 10257.2119  74.0685          ?        ?     1012.8        3.7       ?       ? 
1 1 1   17   12    6 o    645.0    2.9    0.0000   0.0000          ?        ?  4159.9683  37.6728          ?        ?      645.0        2.9       ?       ? 
1 1 1   17   12    7 o    283.8    1.9    0.0000   0.0000          ?        ?   805.1758  10.8549          ?        ?      283.8        1.9       ?       ? 
1 1 1   17   12    8 o    561.2    2.3    0.0000   0.0000          ?        ?  3149.8271  26.1794          ?        ?      561.2        2.3       ?       ? 
1 1 1   17   12    9 o    947.4    3.6    0.0000   0.0000          ?        ?  8975.6982  67.6833          ?        ?      947.4        3.6       ?       ? 
1 1 1   17   12   10 o   1217.5    4.4    0.0000   0.0000          ?        ? 14825.1953 107.9102          ?        ?     1217.5        4.4       ?       ? 
1 1 1   17   12   11 o    992.7    3.6    0.0000   0.0000          ?        ?  9854.3047  72.1529          ?        ?      992.7        3.6       ?       ? 
1 1 1   17   12   12 o   1278.3    4.6    0.0000   0.0000          ?        ? 16341.6846 117.4880          ?        ?     1278.3        4.6       ?       ? 
1 1 1   17   12   13 o   1161.3    4.2    0.0000   0.0000          ?        ? 13486.2158  98.3323          ?        ?     1161.3        4.2       ?       ? 
1 1 1   17   12   14 o    424.8    2.2    0.0000   0.0000          ?        ?  1804.4622  18.5171          ?        ?      424.8        2.2       ?       ? 
1 1 1   17   12   15 o    931.3    3.5    0.0000   0.0000          ?        ?  8673.6777  65.1292          ?        ?      931.3        3.5       ?       ? 
1 1 1   17   12   16 o    975.3    3.7    0.0000   0.0000          ?        ?  9513.3340  71.5144          ?        ?      975.3        3.7       ?       ? 
1 1 1   17   12   17 o   1719.7    6.2    0.0000   0.0000          ?        ? 29578.2363 213.9047          ?        ?     1719.7        6.2       ?       ? 
1 1 1   17   12   18 o   1020.2    4.1    0.0000   0.0000          ?        ? 10407.9023  84.2849          ?        ?     1020.2        4.1       ?       ? 
1 1 1   17   12   19 o   1999.1    7.5    0.0000   0.0000          ?        ? 39972.7305 300.7437          ?        ?     1999.1        7.5       ?       ? 
1 1 1   17   12   20 o   2006.1    7.0    0.0000   0.0000          ?        ? 40250.4883 280.9495          ?        ?     2006.1        7.0       ?       ? 
1 1 1   17   12   21 o    582.3    2.6    0.0000   0.0000          ?        ?  3390.5498  30.0105          ?        ?      582.3        2.6       ?       ? 
1 1 1   17   12   22 o    811.3    3.4    0.0000   0.0000          ?        ?  6581.8813  54.9129          ?        ?      811.3        3.4       ?       ? 
1 1 1   17   12   23 o   1116.5    3.9    0.0000   0.0000          ?        ? 12467.1348  87.4775          ?        ?     1116.5        3.9       ?       ? 
1 1 1   17   12   24 o    561.3    2.6    0.0000   0.0000          ?        ?  3151.1042  28.7335          ?        ?      561.3        2.6       ?       ? 
1 1 1   17   12   25 o   1274.7    4.4    0.0000   0.0000          ?        ? 16250.3750 111.7413          ?        ?     1274.7        4.4       ?       ? 
1 1 1   17   12   26 f   1108.8    4.2    0.0000   0.0000          ?        ? 12294.7344  92.5856          ?        ?     1108.8        4.2       ?       ? 
1 1 1   17   12   27 o    617.0    2.7    0.0000   0.0000          ?        ?  3807.5044  33.2031          ?        ?      617.0        2.7       ?       ? 
1 1 1   17   12   28 o    737.7    2.9    0.0000   0.0000          ?        ?  5442.7583  43.4195          ?        ?      737.7        2.9       ?       ? 
1 1 1   17   12   29 o    473.5    2.8    0.0000   0.0000          ?        ?  2242.4880  26.8179          ?        ?      473.5        2.8       ?       ? 
1 1 1   17   12   30 o    618.6    2.7    0.0000   0.0000          ?        ?  3826.6599  33.8416          ?        ?      618.6        2.7       ?       ? 
1 1 1   17   12   31 o   1108.6    3.9    0.0000   0.0000          ?        ? 12290.2646  86.8389          ?        ?     1108.6        3.9       ?       ? 
1 1 1   17   12   32 o   1023.5    3.8    0.0000   0.0000          ?        ? 10475.5859  78.5382          ?        ?     1023.5        3.8       ?       ? 
1 1 1   17   12   33 o    461.6    2.8    0.0000   0.0000          ?        ?  2130.7468  25.5409          ?        ?      461.6        2.8       ?       ? 
1 1 1   17   12   34 o    731.8    3.1    0.0000   0.0000          ?        ?  5355.9194  45.3350          ?        ?      731.8        3.1       ?       ? 
1 1 1   17   12   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   12   36 o    869.9    3.5    0.0000   0.0000          ?        ?  7567.7578  60.6596          ?        ?      869.9        3.5       ?       ? 
1 1 1   17   12   37 o    897.5    3.5    0.0000   0.0000          ?        ?  8054.9502  63.2136          ?        ?      897.5        3.5       ?       ? 
1 1 1   17   12   38 o    966.4    3.5    0.0000   0.0000          ?        ?  9340.9326  68.3218          ?        ?      966.4        3.5       ?       ? 
1 1 1   17   12   39 o    686.9    2.9    0.0000   0.0000          ?        ?  4719.3130  39.5883          ?        ?      686.9        2.9       ?       ? 
1 1 1   17   12   40 o    692.4    3.0    0.0000   0.0000          ?        ?  4794.0205  40.8654          ?        ?      692.4        3.0       ?       ? 
1 1 1   17   12   41 o    708.8    3.0    0.0000   0.0000          ?        ?  5025.1650  42.7809          ?        ?      708.8        3.0       ?       ? 
1 1 1   17   12   42 o    248.6    3.6    0.0000   0.0000          ?        ?   618.0889  17.8786          ?        ?      248.6        3.6       ?       ? 
1 1 1   17   12   43 o    285.0    3.4    0.0000   0.0000          ?        ?   812.1995  19.1556          ?        ?      285.0        3.4       ?       ? 
1 1 1   17   12   44 o    252.3    3.8    0.0000   0.0000          ?        ?   636.6060  19.1556          ?        ?      252.3        3.8       ?       ? 
1 1 1   17   12   45 f    658.8    2.9    0.0000   0.0000          ?        ?  4340.6699  38.3113          ?        ?      658.8        2.9       ?       ? 
1 1 1   17   12   46 o    686.7    3.0    0.0000   0.0000          ?        ?  4716.7593  40.8654          ?        ?      686.7        3.0       ?       ? 
1 1 1   17   12   47 o    433.0    2.7    0.0000   0.0000          ?        ?  1875.3381  23.6253          ?        ?      433.0        2.7       ?       ? 
1 1 1   17   12   48 o    486.1    2.8    0.0000   0.0000          ?        ?  2363.8071  27.4564          ?        ?      486.1        2.8       ?       ? 
1 1 1   17   12   49 f    307.9    3.1    0.0000   0.0000          ?        ?   948.2046  19.1556          ?        ?      307.9        3.1       ?       ? 
1 1 1   17   12   50 o    261.6    3.5    0.0000   0.0000          ?        ?   684.4952  18.5171          ?        ?      261.6        3.5       ?       ? 
1 1 1   17   12   51 o    199.7    4.8    0.0000   0.0000          ?        ?   399.0760  19.1556          ?        ?      199.7        4.8       ?       ? 
1 1 1   17   12   52 o    308.5    3.2    0.0000   0.0000          ?        ?   952.0358  19.7942          ?        ?      308.5        3.2       ?       ? 
1 1 1   17   12   53 o     26.6   12.5    0.0000   0.0000          ?        ?   -19.1556  17.2401          ?        ?       26.6       12.5       ?       ? 
1 1 1   17   12   54 o    258.1    3.6    0.0000   0.0000          ?        ?   666.6166  18.5171          ?        ?      258.1        3.6       ?       ? 
1 1 1   17   12   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   12   56 o    471.9    2.7    0.0000   0.0000          ?        ?  2227.8020  25.5409          ?        ?      471.9        2.7       ?       ? 
1 1 1   17   12   57 o    204.9    4.5    0.0000   0.0000          ?        ?   420.1472  18.5171          ?        ?      204.9        4.5       ?       ? 
1 1 1   17   12   58 o    225.1    4.3    0.0000   0.0000          ?        ?   506.9862  19.1556          ?        ?      225.1        4.3       ?       ? 
1 1 1   17   12   59 o     21.3   10.6    0.0000   0.0000          ?        ?   -49.8047  18.5171          ?        ?       21.3       10.6       ?       ? 
1 1 1   17   12   60 o    351.9    3.2    0.0000   0.0000          ?        ?  1238.7319  22.3483          ?        ?      351.9        3.2       ?       ? 
1 1 1   17   12   61 o    231.2    4.3    0.0000   0.0000          ?        ?   535.0811  19.7942          ?        ?      231.2        4.3       ?       ? 
1 1 1   17   12   62 o    121.8    7.6    0.0000   0.0000          ?        ?   148.7755  18.5171          ?        ?      121.8        7.6       ?       ? 
1 1 1   17   12   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   12   64 o    234.5    4.2    0.0000   0.0000          ?        ?   550.4056  19.7942          ?        ?      234.5        4.2       ?       ? 
1 1 1   17   12   65 o    293.1    3.7    0.0000   0.0000          ?        ?   860.0886  21.7097          ?        ?      293.1        3.7       ?       ? 
1 1 1   17   12   66 o    224.4    4.6    0.0000   0.0000          ?        ?   504.4321  20.4327          ?        ?      224.4        4.6       ?       ? 
1 1 1   17   12   67 o    192.7    5.5    0.0000   0.0000          ?        ?   372.2581  21.0712          ?        ?      192.7        5.5       ?       ? 
1 1 1   17   12   68 o    136.9    7.9    0.0000   0.0000          ?        ?   188.3639  21.7097          ?        ?      136.9        7.9       ?       ? 
1 1 1   17   12   69 o     60.2   16.8    0.0000   0.0000          ?        ?    38.3113  21.0712          ?        ?       60.2       16.8       ?       ? 
1 1 1   17   12   70 o    199.2    5.3    0.0000   0.0000          ?        ?   397.7990  21.0712          ?        ?      199.2        5.3       ?       ? 
1 1 1   17   12   71 o     21.6   10.9    0.0000   0.0000          ?        ?   -63.2136  21.0712          ?        ?       21.6       10.9       ?       ? 
1 1 1   17   12   72 o    276.8    4.0    0.0000   0.0000          ?        ?   767.5030  22.3483          ?        ?      276.8        4.0       ?       ? 
1 1 1   17   12   73 o    228.1    4.6    0.0000   0.0000          ?        ?   521.6721  21.0712          ?        ?      228.1        4.6       ?       ? 
1 1 1   17   12   74 o    215.8    5.0    0.0000   0.0000          ?        ?   467.3978  21.7097          ?        ?      215.8        5.0       ?       ? 
1 1 1   17   12   75 o    138.2    7.2    0.0000   0.0000          ?        ?   192.8335  19.7942          ?        ?      138.2        7.2       ?       ? 
1 1 1   17   12   76 f     23.4   11.6    0.0000   0.0000          ?        ?   -46.6121  20.4327          ?        ?       23.4       11.6       ?       ? 
1 1 1   17   13    0 o    819.4    4.9 6714.6934  81.0922  6714.6934  81.0922  6714.6934  81.0922      819.4      4.9      819.4        4.9     0.0     0.0 
1 1 1   17   13    1 o    782.1    3.4    0.0000   0.0000          ?        ?  6117.0371  52.9973          ?        ?      782.1        3.4       ?       ? 
1 1 1   17   13    2 o    562.0    2.7    0.0000   0.0000          ?        ?  3158.7666  30.6490          ?        ?      562.0        2.7       ?       ? 
1 1 1   17   13    3 o    836.2    3.5    0.0000   0.0000          ?        ?  6993.0884  58.1055          ?        ?      836.2        3.5       ?       ? 
1 1 1   17   13    4 o   1850.8    6.7    0.0000   0.0000          ?        ? 34258.5977 247.1079          ?        ?     1850.8        6.7       ?       ? 
1 1 1   17   13    5 o    577.3    2.4    0.0000   0.0000          ?        ?  3332.4446  27.4564          ?        ?      577.3        2.4       ?       ? 
1 1 1   17   13    6 o   1020.6    3.9    0.0000   0.0000          ?        ? 10417.4805  80.4537          ?        ?     1020.6        3.9       ?       ? 
1 1 1   17   13    7 o    692.9    2.7    0.0000   0.0000          ?        ?  4801.0444  37.0343          ?        ?      692.9        2.7       ?       ? 
1 1 1   17   13    8 o    384.9    2.2    0.0000   0.0000          ?        ?  1481.3701  16.6016          ?        ?      384.9        2.2       ?       ? 
1 1 1   17   13    9 o   1069.6    3.8    0.0000   0.0000          ?        ? 11441.0312  81.0922          ?        ?     1069.6        3.8       ?       ? 
1 1 1   17   13   10 o   1855.0    6.5    0.0000   0.0000          ?        ? 34415.6758 240.0841          ?        ?     1855.0        6.5       ?       ? 
1 1 1   17   13   11 o    766.2    3.2    0.0000   0.0000          ?        ?  5870.5679  49.1662          ?        ?      766.2        3.2       ?       ? 
1 1 1   17   13   12 o   1232.0    4.6    0.0000   0.0000          ?        ? 15180.2129 113.0183          ?        ?     1232.0        4.6       ?       ? 
1 1 1   17   13   13 o    234.7    2.4    0.0000   0.0000          ?        ?   551.0442  11.4934          ?        ?      234.7        2.4       ?       ? 
1 1 1   17   13   14 o    560.5    2.5    0.0000   0.0000          ?        ?  3141.5264  28.0950          ?        ?      560.5        2.5       ?       ? 
1 1 1   17   13   15 o   1061.2    4.1    0.0000   0.0000          ?        ? 11261.6055  86.2004          ?        ?     1061.2        4.1       ?       ? 
1 1 1   17   13   16 o    405.2    2.4    0.0000   0.0000          ?        ?  1642.2777  19.1556          ?        ?      405.2        2.4       ?       ? 
1 1 1   17   13   17 o     15.8    8.0    0.0000   0.0000          ?        ?   -36.3957  11.4934          ?        ?       15.8        8.0       ?       ? 
1 1 1   17   13   18 o    647.6    2.7    0.0000   0.0000          ?        ?  4194.4487  34.4802          ?        ?      647.6        2.7       ?       ? 
1 1 1   17   13   19 o   1499.8    5.4    0.0000   0.0000          ?        ? 22495.7559 162.1845          ?        ?     1499.8        5.4       ?       ? 
1 1 1   17   13   20 o    436.7    2.4    0.0000   0.0000          ?        ?  1907.2642  21.0712          ?        ?      436.7        2.4       ?       ? 
1 1 1   17   13   21 o    483.7    2.6    0.0000   0.0000          ?        ?  2339.5432  24.9023          ?        ?      483.7        2.6       ?       ? 
1 1 1   17   13   22 o    224.5    2.4    0.0000   0.0000          ?        ?   503.7936  10.8549          ?        ?      224.5        2.4       ?       ? 
1 1 1   17   13   23 o   1517.8    5.3    0.0000   0.0000          ?        ? 23039.7754 160.9075          ?        ?     1517.8        5.3       ?       ? 
1 1 1   17   13   24 o   1431.2    5.2    0.0000   0.0000          ?        ? 20485.0508 148.7755          ?        ?     1431.2        5.2       ?       ? 
1 1 1   17   13   25 o   1300.5    4.6    0.0000   0.0000          ?        ? 16915.7148 120.0421          ?        ?     1300.5        4.6       ?       ? 
1 1 1   17   13   26 o    692.5    2.9    0.0000   0.0000          ?        ?  4795.9355  40.2269          ?        ?      692.5        2.9       ?       ? 
1 1 1   17   13   27 o    354.2    2.6    0.0000   0.0000          ?        ?  1254.6949  18.5171          ?        ?      354.2        2.6       ?       ? 
1 1 1   17   13   28 o    617.8    2.8    0.0000   0.0000          ?        ?  3816.4438  34.4802          ?        ?      617.8        2.8       ?       ? 
1 1 1   17   13   29 o    683.7    2.9    0.0000   0.0000          ?        ?  4675.2554  39.5883          ?        ?      683.7        2.9       ?       ? 
1 1 1   17   13   30 o   1119.8    4.3    0.0000   0.0000          ?        ? 12541.2031  97.0553          ?        ?     1119.8        4.3       ?       ? 
1 1 1   17   13   31 o    860.6    3.3    0.0000   0.0000          ?        ?  7406.8511  56.8284          ?        ?      860.6        3.3       ?       ? 
1 1 1   17   13   32 o    682.4    2.8    0.0000   0.0000          ?        ?  4657.3770  38.3113          ?        ?      682.4        2.8       ?       ? 
1 1 1   17   13   33 o    439.0    2.8    0.0000   0.0000          ?        ?  1927.6968  24.9023          ?        ?      439.0        2.8       ?       ? 
1 1 1   17   13   34 o    712.7    3.0    0.0000   0.0000          ?        ?  5080.0781  43.4195          ?        ?      712.7        3.0       ?       ? 
1 1 1   17   13   35 o   1057.7    4.2    0.0000   0.0000          ?        ? 11189.4531  88.7545          ?        ?     1057.7        4.2       ?       ? 
1 1 1   17   13   36 o    703.8    3.1    0.0000   0.0000          ?        ?  4953.0122  43.4195          ?        ?      703.8        3.1       ?       ? 
1 1 1   17   13   37 o   1598.0    5.6    0.0000   0.0000          ?        ? 25542.1426 177.5090          ?        ?     1598.0        5.6       ?       ? 
1 1 1   17   13   38 o    965.6    3.8    0.0000   0.0000          ?        ?  9324.9697  72.7915          ?        ?      965.6        3.8       ?       ? 
1 1 1   17   13   39 f    316.9    3.3    0.0000   0.0000          ?        ?  1004.3945  21.0712          ?        ?      316.9        3.3       ?       ? 
1 1 1   17   13   40 o     92.5    9.3    0.0000   0.0000          ?        ?    85.5619  17.2401          ?        ?       92.5        9.3       ?       ? 
1 1 1   17   13   41 o    566.4    2.9    0.0000   0.0000          ?        ?  3208.5713  33.2031          ?        ?      566.4        2.9       ?       ? 
1 1 1   17   13   42 f    408.9    3.0    0.0000   0.0000          ?        ?  1672.2881  24.9023          ?        ?      408.9        3.0       ?       ? 
1 1 1   17   13   43 o    717.8    3.0    0.0000   0.0000          ?        ?  5152.8696  42.7809          ?        ?      717.8        3.0       ?       ? 
1 1 1   17   13   44 f    377.0    2.9    0.0000   0.0000          ?        ?  1421.3491  21.7097          ?        ?      377.0        2.9       ?       ? 
1 1 1   17   13   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   13   46 o     78.2   11.0    0.0000   0.0000          ?        ?    61.2981  17.2401          ?        ?       78.2       11.0       ?       ? 
1 1 1   17   13   47 o    329.8    3.1    0.0000   0.0000          ?        ?  1088.0408  20.4327          ?        ?      329.8        3.1       ?       ? 
1 1 1   17   13   48 o    254.7    3.8    0.0000   0.0000          ?        ?   648.7380  19.1556          ?        ?      254.7        3.8       ?       ? 
1 1 1   17   13   49 o     21.0   10.5    0.0000   0.0000          ?        ?   -43.4195  17.2401          ?        ?       21.0       10.5       ?       ? 
1 1 1   17   13   50 o     33.1   14.1    0.0000   0.0000          ?        ?    -0.6385  16.6016          ?        ?       33.1       14.1       ?       ? 
1 1 1   17   13   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   13   52 o    551.5    2.7    0.0000   0.0000          ?        ?  3041.9170  29.3720          ?        ?      551.5        2.7       ?       ? 
1 1 1   17   13   53 o    239.7    4.0    0.0000   0.0000          ?        ?   574.6694  19.1556          ?        ?      239.7        4.0       ?       ? 
1 1 1   17   13   54 o     24.4   11.9    0.0000   0.0000          ?        ?   -39.5883  19.7942          ?        ?       24.4       11.9       ?       ? 
1 1 1   17   13   55 o    719.2    3.0    0.0000   0.0000          ?        ?  5174.5796  42.7809          ?        ?      719.2        3.0       ?       ? 
1 1 1   17   13   56 o    214.2    4.5    0.0000   0.0000          ?        ?   459.0970  19.1556          ?        ?      214.2        4.5       ?       ? 
1 1 1   17   13   57 o    273.1    3.9    0.0000   0.0000          ?        ?   746.4318  21.0712          ?        ?      273.1        3.9       ?       ? 
1 1 1   17   13   58 o    312.6    3.3    0.0000   0.0000          ?        ?   977.5767  20.4327          ?        ?      312.6        3.3       ?       ? 
1 1 1   17   13   59 o    328.9    3.2    0.0000   0.0000          ?        ?  1082.2942  21.0712          ?        ?      328.9        3.2       ?       ? 
1 1 1   17   13   60 o     24.9   12.0    0.0000   0.0000          ?        ?   -30.6490  18.5171          ?        ?       24.9       12.0       ?       ? 
1 1 1   17   13   61 o    196.4    4.9    0.0000   0.0000          ?        ?   386.3056  19.1556          ?        ?      196.4        4.9       ?       ? 
1 1 1   17   13   62 o     21.0   10.6    0.0000   0.0000          ?        ?   -60.0210  19.7942          ?        ?       21.0       10.6       ?       ? 
1 1 1   17   13   63 o     29.6   13.8    0.0000   0.0000          ?        ?   -17.8786  19.7942          ?        ?       29.6       13.8       ?       ? 
1 1 1   17   13   64 o     19.9   10.1    0.0000   0.0000          ?        ?   -73.4300  20.4327          ?        ?       19.9       10.1       ?       ? 
1 1 1   17   13   65 o    215.7    4.7    0.0000   0.0000          ?        ?   466.1208  20.4327          ?        ?      215.7        4.7       ?       ? 
1 1 1   17   13   66 f    299.6    3.7    0.0000   0.0000          ?        ?   898.3999  22.3483          ?        ?      299.6        3.7       ?       ? 
1 1 1   17   13   67 o    176.9    6.3    0.0000   0.0000          ?        ?   314.1526  22.3483          ?        ?      176.9        6.3       ?       ? 
1 1 1   17   13   68 o    244.1    4.6    0.0000   0.0000          ?        ?   597.0177  22.3483          ?        ?      244.1        4.6       ?       ? 
1 1 1   17   13   69 o    108.7   10.0    0.0000   0.0000          ?        ?   119.4035  21.7097          ?        ?      108.7       10.0       ?       ? 
1 1 1   17   13   70 f    338.4    3.6    0.0000   0.0000          ?        ?  1146.7849  24.2638          ?        ?      338.4        3.6       ?       ? 
1 1 1   17   13   71 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   13   72 o    188.7    5.9    0.0000   0.0000          ?        ?   357.5721  22.3483          ?        ?      188.7        5.9       ?       ? 
1 1 1   17   13   73 o    137.8    7.9    0.0000   0.0000          ?        ?   191.5565  21.7097          ?        ?      137.8        7.9       ?       ? 
1 1 1   17   13   74 o     48.1   17.0    0.0000   0.0000          ?        ?    21.7097  20.4327          ?        ?       48.1       17.0       ?       ? 
1 1 1   17   13   75 o     31.1   14.2    0.0000   0.0000          ?        ?   -12.1319  19.7942          ?        ?       31.1       14.2       ?       ? 
1 1 1   17   13   76 o     87.7   11.6    0.0000   0.0000          ?        ?    79.1767  20.4327          ?        ?       87.7       11.6       ?       ? 
1 1 1   17   14    0 o    242.8    4.5  589.9940  21.7097   589.9940  21.7097   589.9940  21.7097      242.8      4.5      242.8        4.5     0.0     0.0 
1 1 1   17   14    1 o    504.3    2.6    0.0000   0.0000          ?        ?  2543.2314  26.1794          ?        ?      504.3        2.6       ?       ? 
1 1 1   17   14    2 o    635.8    3.0    0.0000   0.0000          ?        ?  4042.4802  38.3113          ?        ?      635.8        3.0       ?       ? 
1 1 1   17   14    3 o    236.9    2.2    0.0000   0.0000          ?        ?   561.2605  10.2163          ?        ?      236.9        2.2       ?       ? 
1 1 1   17   14    4 o    275.1    2.3    0.0000   0.0000          ?        ?   756.6481  12.7704          ?        ?      275.1        2.3       ?       ? 
1 1 1   17   14    5 o    627.9    2.5    0.0000   0.0000          ?        ?  3942.2327  31.2876          ?        ?      627.9        2.5       ?       ? 
1 1 1   17   14    6 o   1689.6    5.5    0.0000   0.0000          ?        ? 28549.5801 186.4483          ?        ?     1689.6        5.5       ?       ? 
1 1 1   17   14    7 o   1103.2    4.0    0.0000   0.0000          ?        ? 12171.4990  87.4775          ?        ?     1103.2        4.0       ?       ? 
1 1 1   17   14    8 o   1785.2    6.1    0.0000   0.0000          ?        ? 31871.8066 217.0974          ?        ?     1785.2        6.1       ?       ? 
1 1 1   17   14    9 o    607.3    2.8    0.0000   0.0000          ?        ?  3688.1008  34.4802          ?        ?      607.3        2.8       ?       ? 
1 1 1   17   14   10 o   1393.3    4.8    0.0000   0.0000          ?        ? 19415.5273 133.4510          ?        ?     1393.3        4.8       ?       ? 
1 1 1   17   14   11 o    340.5    2.0    0.0000   0.0000          ?        ?  1159.5553  13.4090          ?        ?      340.5        2.0       ?       ? 
1 1 1   17   14   12 o    837.6    3.2    0.0000   0.0000          ?        ?  7016.0762  54.2743          ?        ?      837.6        3.2       ?       ? 
1 1 1   17   14   13 o    397.5    2.1    0.0000   0.0000          ?        ?  1580.3411  16.6016          ?        ?      397.5        2.1       ?       ? 
1 1 1   17   14   14 o   1649.9    6.0    0.0000   0.0000          ?        ? 27223.3691 197.3032          ?        ?     1649.9        6.0       ?       ? 
1 1 1   17   14   15 o   1067.6    4.0    0.0000   0.0000          ?        ? 11398.8877  84.9234          ?        ?     1067.6        4.0       ?       ? 
1 1 1   17   14   16 o    876.6    3.3    0.0000   0.0000          ?        ?  7683.9692  58.1055          ?        ?      876.6        3.3       ?       ? 
1 1 1   17   14   17 o   1177.4    4.2    0.0000   0.0000          ?        ? 13862.3047  98.9709          ?        ?     1177.4        4.2       ?       ? 
1 1 1   17   14   18 o    762.4    3.1    0.0000   0.0000          ?        ?  5812.4624  46.6121          ?        ?      762.4        3.1       ?       ? 
1 1 1   17   14   19 o   1820.0    6.3    0.0000   0.0000          ?        ? 33127.7812 228.5907          ?        ?     1820.0        6.3       ?       ? 
1 1 1   17   14   20 o   1528.5    5.6    0.0000   0.0000          ?        ? 23366.0605 171.7623          ?        ?     1528.5        5.6       ?       ? 
1 1 1   17   14   21 o   1577.2    5.5    0.0000   0.0000          ?        ? 24879.3555 172.4008          ?        ?     1577.2        5.5       ?       ? 
1 1 1   17   14   22 o    470.7    2.4    0.0000   0.0000          ?        ?  2215.6699  22.9868          ?        ?      470.7        2.4       ?       ? 
1 1 1   17   14   23 f   1297.8    4.6    0.0000   0.0000          ?        ? 16844.2012 118.7650          ?        ?     1297.8        4.6       ?       ? 
1 1 1   17   14   24 o    269.1    2.8    0.0000   0.0000          ?        ?   724.0836  15.3245          ?        ?      269.1        2.8       ?       ? 
1 1 1   17   14   25 o    431.1    2.5    0.0000   0.0000          ?        ?  1858.0979  21.7097          ?        ?      431.1        2.5       ?       ? 
1 1 1   17   14   26 o   1089.3    4.0    0.0000   0.0000          ?        ? 11866.2861  86.8389          ?        ?     1089.3        4.0       ?       ? 
1 1 1   17   14   27 o   1019.9    3.8    0.0000   0.0000          ?        ? 10402.7939  77.2611          ?        ?     1019.9        3.8       ?       ? 
1 1 1   17   14   28 o   1231.1    4.4    0.0000   0.0000          ?        ? 15157.2266 109.1872          ?        ?     1231.1        4.4       ?       ? 
1 1 1   17   14   29 o   1331.8    4.7    0.0000   0.0000          ?        ? 17737.4922 123.8732          ?        ?     1331.8        4.7       ?       ? 
1 1 1   17   14   30 o    872.6    3.6    0.0000   0.0000          ?        ?  7614.3706  62.5751          ?        ?      872.6        3.6       ?       ? 
1 1 1   17   14   31 o    427.3    3.0    0.0000   0.0000          ?        ?  1826.1719  25.5409          ?        ?      427.3        3.0       ?       ? 
1 1 1   17   14   32 o   1336.6    5.2    0.0000   0.0000          ?        ? 17867.1113 137.9207          ?        ?     1336.6        5.2       ?       ? 
1 1 1   17   14   33 o    252.4    3.7    0.0000   0.0000          ?        ?   637.2446  18.5171          ?        ?      252.4        3.7       ?       ? 
1 1 1   17   14   34 o    680.9    3.0    0.0000   0.0000          ?        ?  4636.9443  40.8654          ?        ?      680.9        3.0       ?       ? 
1 1 1   17   14   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   14   36 o    255.9    3.9    0.0000   0.0000          ?        ?   655.1232  19.7942          ?        ?      255.9        3.9       ?       ? 
1 1 1   17   14   37 o    448.4    2.7    0.0000   0.0000          ?        ?  2010.7046  24.2638          ?        ?      448.4        2.7       ?       ? 
1 1 1   17   14   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   14   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   14   40 o    519.3    2.6    0.0000   0.0000          ?        ?  2697.1152  26.8179          ?        ?      519.3        2.6       ?       ? 
1 1 1   17   14   41 f    299.6    3.1    0.0000   0.0000          ?        ?   897.7615  18.5171          ?        ?      299.6        3.1       ?       ? 
1 1 1   17   14   42 f   1100.1    4.1    0.0000   0.0000          ?        ? 12105.0938  90.0316          ?        ?     1100.1        4.1       ?       ? 
1 1 1   17   14   43 o    138.4    6.0    0.0000   0.0000          ?        ?   191.5565  16.6016          ?        ?      138.4        6.0       ?       ? 
1 1 1   17   14   44 o    356.3    2.9    0.0000   0.0000          ?        ?  1269.3810  20.4327          ?        ?      356.3        2.9       ?       ? 
1 1 1   17   14   45 o    413.2    2.6    0.0000   0.0000          ?        ?  1707.4067  21.7097          ?        ?      413.2        2.6       ?       ? 
1 1 1   17   14   46 o    462.6    2.7    0.0000   0.0000          ?        ?  2140.3245  24.9023          ?        ?      462.6        2.7       ?       ? 
1 1 1   17   14   47 o    718.8    2.9    0.0000   0.0000          ?        ?  5168.1943  41.5039          ?        ?      718.8        2.9       ?       ? 
1 1 1   17   14   48 o    233.7    3.7    0.0000   0.0000          ?        ?   546.5745  17.2401          ?        ?      233.7        3.7       ?       ? 
1 1 1   17   14   49 o    365.2    2.8    0.0000   0.0000          ?        ?  1333.8716  20.4327          ?        ?      365.2        2.8       ?       ? 
1 1 1   17   14   50 o    360.9    3.0    0.0000   0.0000          ?        ?  1302.5841  21.7097          ?        ?      360.9        3.0       ?       ? 
1 1 1   17   14   51 o    370.6    2.8    0.0000   0.0000          ?        ?  1374.0985  20.4327          ?        ?      370.6        2.8       ?       ? 
1 1 1   17   14   52 o    499.9    2.7    0.0000   0.0000          ?        ?  2499.8123  26.8179          ?        ?      499.9        2.7       ?       ? 
1 1 1   17   14   53 o    206.9    4.3    0.0000   0.0000          ?        ?   428.4480  17.8786          ?        ?      206.9        4.3       ?       ? 
1 1 1   17   14   54 o    458.1    2.9    0.0000   0.0000          ?        ?  2099.4590  26.8179          ?        ?      458.1        2.9       ?       ? 
1 1 1   17   14   55 o    337.8    3.1    0.0000   0.0000          ?        ?  1141.6766  21.0712          ?        ?      337.8        3.1       ?       ? 
1 1 1   17   14   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   14   57 o    143.5    6.7    0.0000   0.0000          ?        ?   206.2425  19.1556          ?        ?      143.5        6.7       ?       ? 
1 1 1   17   14   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   14   59 o    175.3    5.5    0.0000   0.0000          ?        ?   307.7674  19.1556          ?        ?      175.3        5.5       ?       ? 
1 1 1   17   14   60 o    207.6    4.8    0.0000   0.0000          ?        ?   431.6406  19.7942          ?        ?      207.6        4.8       ?       ? 
1 1 1   17   14   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   14   62 o    169.9    5.6    0.0000   0.0000          ?        ?   289.2503  19.1556          ?        ?      169.9        5.6       ?       ? 
1 1 1   17   14   63 o    323.7    3.4    0.0000   0.0000          ?        ?  1048.4525  21.7097          ?        ?      323.7        3.4       ?       ? 
1 1 1   17   14   64 o     40.9   16.1    0.0000   0.0000          ?        ?    10.2163  19.1556          ?        ?       40.9       16.1       ?       ? 
1 1 1   17   14   65 o    102.6    9.6    0.0000   0.0000          ?        ?   105.9946  19.7942          ?        ?      102.6        9.6       ?       ? 
1 1 1   17   14   66 o    155.7    6.6    0.0000   0.0000          ?        ?   243.2767  20.4327          ?        ?      155.7        6.6       ?       ? 
1 1 1   17   14   67 o     97.4   10.5    0.0000   0.0000          ?        ?    95.7782  20.4327          ?        ?       97.4       10.5       ?       ? 
1 1 1   17   14   68 o    198.9    5.3    0.0000   0.0000          ?        ?   396.5219  21.0712          ?        ?      198.9        5.3       ?       ? 
1 1 1   17   14   69 o     27.4   13.2    0.0000   0.0000          ?        ?   -30.6490  21.0712          ?        ?       27.4       13.2       ?       ? 
1 1 1   17   14   70 o     76.3   13.9    0.0000   0.0000          ?        ?    61.2981  20.4327          ?        ?       76.3       13.9       ?       ? 
1 1 1   17   14   71 o     20.5   10.4    0.0000   0.0000          ?        ?   -67.6833  20.4327          ?        ?       20.5       10.4       ?       ? 
1 1 1   17   14   72 o    157.9    6.9    0.0000   0.0000          ?        ?   250.9390  21.7097          ?        ?      157.9        6.9       ?       ? 
1 1 1   17   14   73 o    182.8    5.6    0.0000   0.0000          ?        ?   335.8624  20.4327          ?        ?      182.8        5.6       ?       ? 
1 1 1   17   14   74 o    220.5    4.9    0.0000   0.0000          ?        ?   488.4691  21.7097          ?        ?      220.5        4.9       ?       ? 
1 1 1   17   14   75 o    135.4    7.3    0.0000   0.0000          ?        ?   185.1713  19.7942          ?        ?      135.4        7.3       ?       ? 
1 1 1   17   15    0 o    488.9    3.6 2390.6250  35.1187  2390.6250  35.1187  2390.6250  35.1187      488.9      3.6      488.9        3.6     0.0     0.0 
1 1 1   17   15    1 o    754.5    3.5    0.0000   0.0000          ?        ?  5693.0586  52.3588          ?        ?      754.5        3.5       ?       ? 
1 1 1   17   15    2 o    672.6    3.2    0.0000   0.0000          ?        ?  4524.5640  43.4195          ?        ?      672.6        3.2       ?       ? 
1 1 1   17   15    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   15    4 o    730.0    2.9    0.0000   0.0000          ?        ?  5329.1016  42.7809          ?        ?      730.0        2.9       ?       ? 
1 1 1   17   15    5 o    589.6    2.4    0.0000   0.0000          ?        ?  3476.7502  28.7335          ?        ?      589.6        2.4       ?       ? 
1 1 1   17   15    6 o   1496.4    5.2    0.0000   0.0000          ?        ? 22392.9531 155.1608          ?        ?     1496.4        5.2       ?       ? 
1 1 1   17   15    7 o    985.1    3.5    0.0000   0.0000          ?        ?  9704.8906  69.5989          ?        ?      985.1        3.5       ?       ? 
1 1 1   17   15    8 o    742.5    2.8    0.0000   0.0000          ?        ?  5512.9961  41.5039          ?        ?      742.5        2.8       ?       ? 
1 1 1   17   15    9 o   1129.2    4.4    0.0000   0.0000          ?        ? 12750.6387  98.3323          ?        ?     1129.2        4.4       ?       ? 
1 1 1   17   15   10 o   1216.6    4.2    0.0000   0.0000          ?        ? 14800.9316 102.1635          ?        ?     1216.6        4.2       ?       ? 
1 1 1   17   15   11 o    345.9    2.6    0.0000   0.0000          ?        ?  1196.5895  17.8786          ?        ?      345.9        2.6       ?       ? 
1 1 1   17   15   12 o    764.7    2.8    0.0000   0.0000          ?        ?  5848.2197  42.7809          ?        ?      764.7        2.8       ?       ? 
1 1 1   17   15   13 o    732.9    3.0    0.0000   0.0000          ?        ?  5371.2441  43.4195          ?        ?      732.9        3.0       ?       ? 
1 1 1   17   15   14 f    462.1    2.3    0.0000   0.0000          ?        ?  2135.8547  21.0712          ?        ?      462.1        2.3       ?       ? 
1 1 1   17   15   15 o   2068.9    7.2    0.0000   0.0000          ?        ? 42810.9609 298.1896          ?        ?     2068.9        7.2       ?       ? 
1 1 1   17   15   16 o   1440.0    5.2    0.0000   0.0000          ?        ? 20737.9062 150.6911          ?        ?     1440.0        5.2       ?       ? 
1 1 1   17   15   17 o    444.3    2.7    0.0000   0.0000          ?        ?  1973.6704  24.2638          ?        ?      444.3        2.7       ?       ? 
1 1 1   17   15   18 o   2114.0    7.4    0.0000   0.0000          ?        ? 44698.4297 310.9600          ?        ?     2114.0        7.4       ?       ? 
1 1 1   17   15   19 o   1211.4    4.3    0.0000   0.0000          ?        ? 14675.7803 104.0790          ?        ?     1211.4        4.3       ?       ? 
1 1 1   17   15   20 o   1761.1    6.4    0.0000   0.0000          ?        ? 31021.2949 226.0367          ?        ?     1761.1        6.4       ?       ? 
1 1 1   17   15   21 o    698.7    2.8    0.0000   0.0000          ?        ?  4881.4980  38.9498          ?        ?      698.7        2.8       ?       ? 
1 1 1   17   15   22 o   1212.4    4.2    0.0000   0.0000          ?        ? 14700.6836 102.1635          ?        ?     1212.4        4.2       ?       ? 
1 1 1   17   15   23 o    841.0    3.2    0.0000   0.0000          ?        ?  7072.9038  53.6358          ?        ?      841.0        3.2       ?       ? 
1 1 1   17   15   24 o    841.4    3.2    0.0000   0.0000          ?        ?  7080.5664  53.6358          ?        ?      841.4        3.2       ?       ? 
1 1 1   17   15   25 o    438.9    2.4    0.0000   0.0000          ?        ?  1926.4198  21.0712          ?        ?      438.9        2.4       ?       ? 
1 1 1   17   15   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   15   27 o    826.5    3.1    0.0000   0.0000          ?        ?  6830.9048  51.0817          ?        ?      826.5        3.1       ?       ? 
1 1 1   17   15   28 f   1351.8    4.8    0.0000   0.0000          ?        ? 18274.4883 130.8969          ?        ?     1351.8        4.8       ?       ? 
1 1 1   17   15   29 o   1099.8    4.6    0.0000   0.0000          ?        ? 12096.1543 100.8864          ?        ?     1099.8        4.6       ?       ? 
1 1 1   17   15   30 o    817.2    3.2    0.0000   0.0000          ?        ?  6678.2979  51.7203          ?        ?      817.2        3.2       ?       ? 
1 1 1   17   15   31 o    956.9    3.7    0.0000   0.0000          ?        ?  9157.0381  70.2374          ?        ?      956.9        3.7       ?       ? 
1 1 1   17   15   32 o    719.6    3.0    0.0000   0.0000          ?        ?  5179.0488  43.4195          ?        ?      719.6        3.0       ?       ? 
1 1 1   17   15   33 o    806.5    3.5    0.0000   0.0000          ?        ?  6504.6201  56.8284          ?        ?      806.5        3.5       ?       ? 
1 1 1   17   15   34 o     80.3   10.7    0.0000   0.0000          ?        ?    64.4907  17.2401          ?        ?       80.3       10.7       ?       ? 
1 1 1   17   15   35 o    360.2    2.7    0.0000   0.0000          ?        ?  1297.4760  19.7942          ?        ?      360.2        2.7       ?       ? 
1 1 1   17   15   36 o    436.7    2.9    0.0000   0.0000          ?        ?  1907.2642  24.9023          ?        ?      436.7        2.9       ?       ? 
1 1 1   17   15   37 o    915.9    3.4    0.0000   0.0000          ?        ?  8388.8975  61.9366          ?        ?      915.9        3.4       ?       ? 
1 1 1   17   15   38 o   1244.4    4.4    0.0000   0.0000          ?        ? 15489.2578 110.4642          ?        ?     1244.4        4.4       ?       ? 
1 1 1   17   15   39 o    514.6    2.9    0.0000   0.0000          ?        ?  2648.5876  30.0105          ?        ?      514.6        2.9       ?       ? 
1 1 1   17   15   40 o     48.1   15.0    0.0000   0.0000          ?        ?    22.9868  15.9630          ?        ?       48.1       15.0       ?       ? 
1 1 1   17   15   41 o    503.0    2.6    0.0000   0.0000          ?        ?  2530.4612  26.1794          ?        ?      503.0        2.6       ?       ? 
1 1 1   17   15   42 f     24.1   11.7    0.0000   0.0000          ?        ?   -31.2876  17.8786          ?        ?       24.1       11.7       ?       ? 
1 1 1   17   15   43 o     91.0    9.5    0.0000   0.0000          ?        ?    83.0078  17.2401          ?        ?       91.0        9.5       ?       ? 
1 1 1   17   15   44 o    461.1    2.6    0.0000   0.0000          ?        ?  2126.2771  23.6253          ?        ?      461.1        2.6       ?       ? 
1 1 1   17   15   45 o    223.0    3.9    0.0000   0.0000          ?        ?   497.4084  17.2401          ?        ?      223.0        3.9       ?       ? 
1 1 1   17   15   46 o    581.1    2.8    0.0000   0.0000          ?        ?  3377.7793  32.5646          ?        ?      581.1        2.8       ?       ? 
1 1 1   17   15   47 o    361.5    2.8    0.0000   0.0000          ?        ?  1307.0537  20.4327          ?        ?      361.5        2.8       ?       ? 
1 1 1   17   15   48 o    283.0    3.3    0.0000   0.0000          ?        ?   801.3447  18.5171          ?        ?      283.0        3.3       ?       ? 
1 1 1   17   15   49 o    507.8    2.6    0.0000   0.0000          ?        ?  2578.9888  26.1794          ?        ?      507.8        2.6       ?       ? 
1 1 1   17   15   50 o    282.0    3.3    0.0000   0.0000          ?        ?   795.5980  18.5171          ?        ?      282.0        3.3       ?       ? 
1 1 1   17   15   51 o    240.6    3.7    0.0000   0.0000          ?        ?   579.1391  17.8786          ?        ?      240.6        3.7       ?       ? 
1 1 1   17   15   52 o    277.1    3.5    0.0000   0.0000          ?        ?   768.1415  19.1556          ?        ?      277.1        3.5       ?       ? 
1 1 1   17   15   53 o    773.1    3.1    0.0000   0.0000          ?        ?  5979.1167  47.2506          ?        ?      773.1        3.1       ?       ? 
1 1 1   17   15   54 o    413.3    2.8    0.0000   0.0000          ?        ?  1708.6840  22.9868          ?        ?      413.3        2.8       ?       ? 
1 1 1   17   15   55 f    311.1    3.3    0.0000   0.0000          ?        ?   967.9988  20.4327          ?        ?      311.1        3.3       ?       ? 
1 1 1   17   15   56 o    110.8    8.4    0.0000   0.0000          ?        ?   123.2347  18.5171          ?        ?      110.8        8.4       ?       ? 
1 1 1   17   15   57 o    185.6    5.0    0.0000   0.0000          ?        ?   344.8017  18.5171          ?        ?      185.6        5.0       ?       ? 
1 1 1   17   15   58 o    244.5    4.0    0.0000   0.0000          ?        ?   598.2947  19.7942          ?        ?      244.5        4.0       ?       ? 
1 1 1   17   15   59 o    317.0    3.3    0.0000   0.0000          ?        ?  1005.6716  21.0712          ?        ?      317.0        3.3       ?       ? 
1 1 1   17   15   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   15   61 o    365.4    3.0    0.0000   0.0000          ?        ?  1335.7872  21.7097          ?        ?      365.4        3.0       ?       ? 
1 1 1   17   15   62 o    287.7    3.6    0.0000   0.0000          ?        ?   828.1625  20.4327          ?        ?      287.7        3.6       ?       ? 
1 1 1   17   15   63 o    251.9    3.9    0.0000   0.0000          ?        ?   635.3290  19.7942          ?        ?      251.9        3.9       ?       ? 
1 1 1   17   15   64 o    177.0    5.6    0.0000   0.0000          ?        ?   314.1526  19.7942          ?        ?      177.0        5.6       ?       ? 
1 1 1   17   15   65 o    270.1    3.9    0.0000   0.0000          ?        ?   730.4688  21.0712          ?        ?      270.1        3.9       ?       ? 
1 1 1   17   15   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   15   67 o     58.3   16.7    0.0000   0.0000          ?        ?    35.7572  20.4327          ?        ?       58.3       16.7       ?       ? 
1 1 1   17   15   68 o     31.8   14.4    0.0000   0.0000          ?        ?   -10.8549  19.7942          ?        ?       31.8       14.4       ?       ? 
1 1 1   17   15   69 f    166.9    6.3    0.0000   0.0000          ?        ?   279.6725  21.0712          ?        ?      166.9        6.3       ?       ? 
1 1 1   17   15   70 o    104.4   10.4    0.0000   0.0000          ?        ?   110.4642  21.7097          ?        ?      104.4       10.4       ?       ? 
1 1 1   17   15   71 o    219.5    4.9    0.0000   0.0000          ?        ?   483.3608  21.7097          ?        ?      219.5        4.9       ?       ? 
1 1 1   17   15   72 o     54.7   16.9    0.0000   0.0000          ?        ?    31.2876  20.4327          ?        ?       54.7       16.9       ?       ? 
1 1 1   17   15   73 o     55.4   16.6    0.0000   0.0000          ?        ?    32.5646  19.7942          ?        ?       55.4       16.6       ?       ? 
1 1 1   17   15   74 o     46.5   16.7    0.0000   0.0000          ?        ?    19.7942  19.7942          ?        ?       46.5       16.7       ?       ? 
1 1 1   17   15   75 o     96.9    9.9    0.0000   0.0000          ?        ?    95.7782  19.1556          ?        ?       96.9        9.9       ?       ? 
1 1 1   17   16    0 o    282.2    3.8  796.8750  21.7097   796.8750  21.7097   796.8750  21.7097      282.2      3.8      282.2        3.8     0.0     0.0 
1 1 1   17   16    1 o   1561.4    6.9    0.0000   0.0000          ?        ? 24384.5020 214.5433          ?        ?     1561.4        6.9       ?       ? 
1 1 1   17   16    2 f    206.2    3.9    0.0000   0.0000          ?        ?   425.2554  15.9630          ?        ?      206.2        3.9       ?       ? 
1 1 1   17   16    3 o    860.1    3.9    0.0000   0.0000          ?        ?  7398.5498  67.6833          ?        ?      860.1        3.9       ?       ? 
1 1 1   17   16    4 o   1139.3    4.7    0.0000   0.0000          ?        ? 12981.1445 107.2716          ?        ?     1139.3        4.7       ?       ? 
1 1 1   17   16    5 o   1962.1    7.9    0.0000   0.0000          ?        ? 38506.0469 309.6830          ?        ?     1962.1        7.9       ?       ? 
1 1 1   17   16    6 o    637.7    2.7    0.0000   0.0000          ?        ?  4066.1057  34.4802          ?        ?      637.7        2.7       ?       ? 
1 1 1   17   16    7 o    640.1    2.6    0.0000   0.0000          ?        ?  4096.7544  33.2031          ?        ?      640.1        2.6       ?       ? 
1 1 1   17   16    8 o   1591.5    5.8    0.0000   0.0000          ?        ? 25332.7070 183.8942          ?        ?     1591.5        5.8       ?       ? 
1 1 1   17   16    9 o   1063.5    4.4    0.0000   0.0000          ?        ? 11310.7725  94.5012          ?        ?     1063.5        4.4       ?       ? 
1 1 1   17   16   10 o    446.4    2.2    0.0000   0.0000          ?        ?  1992.8260  19.7942          ?        ?      446.4        2.2       ?       ? 
1 1 1   17   16   11 o    687.1    3.1    0.0000   0.0000          ?        ?  4721.2290  42.1424          ?        ?      687.1        3.1       ?       ? 
1 1 1   17   16   12 o    423.5    2.3    0.0000   0.0000          ?        ?  1793.6072  19.1556          ?        ?      423.5        2.3       ?       ? 
1 1 1   17   16   13 o    748.3    3.1    0.0000   0.0000          ?        ?  5599.1963  46.6121          ?        ?      748.3        3.1       ?       ? 
1 1 1   17   16   14 o   1901.2    7.0    0.0000   0.0000          ?        ? 36151.8164 266.2635          ?        ?     1901.2        7.0       ?       ? 
1 1 1   17   16   15 o    466.8    2.5    0.0000   0.0000          ?        ?  2178.6360  22.9868          ?        ?      466.8        2.5       ?       ? 
1 1 1   17   16   16 o   1474.7    5.4    0.0000   0.0000          ?        ? 21748.6855 158.9919          ?        ?     1474.7        5.4       ?       ? 
1 1 1   17   16   17 o   2174.7    7.6    0.0000   0.0000          ?        ? 47304.8750 328.8386          ?        ?     2174.7        7.6       ?       ? 
1 1 1   17   16   18 o    838.2    3.5    0.0000   0.0000          ?        ?  7026.9307  58.1055          ?        ?      838.2        3.5       ?       ? 
1 1 1   17   16   19 o    839.7    3.7    0.0000   0.0000          ?        ?  7051.1948  61.2981          ?        ?      839.7        3.7       ?       ? 
1 1 1   17   16   20 o    412.5    2.6    0.0000   0.0000          ?        ?  1701.6602  21.7097          ?        ?      412.5        2.6       ?       ? 
1 1 1   17   16   21 o   1274.8    4.6    0.0000   0.0000          ?        ? 16252.9287 116.8494          ?        ?     1274.8        4.6       ?       ? 
1 1 1   17   16   22 f    939.2    3.4    0.0000   0.0000          ?        ?  8821.8145  64.4907          ?        ?      939.2        3.4       ?       ? 
1 1 1   17   16   23 o    789.4    3.2    0.0000   0.0000          ?        ?  6231.3325  49.8047          ?        ?      789.4        3.2       ?       ? 
1 1 1   17   16   24 o    255.7    3.0    0.0000   0.0000          ?        ?   653.8461  15.3245          ?        ?      255.7        3.0       ?       ? 
1 1 1   17   16   25 o    460.0    2.4    0.0000   0.0000          ?        ?  2116.0605  22.3483          ?        ?      460.0        2.4       ?       ? 
1 1 1   17   16   26 o   1388.1    4.8    0.0000   0.0000          ?        ? 19269.3066 132.8125          ?        ?     1388.1        4.8       ?       ? 
1 1 1   17   16   27 o    960.9    3.6    0.0000   0.0000          ?        ?  9233.0225  68.3218          ?        ?      960.9        3.6       ?       ? 
1 1 1   17   16   28 f   1064.1    4.1    0.0000   0.0000          ?        ? 11324.1807  86.8389          ?        ?     1064.1        4.1       ?       ? 
1 1 1   17   16   29 o    817.4    3.2    0.0000   0.0000          ?        ?  6682.1289  52.3588          ?        ?      817.4        3.2       ?       ? 
1 1 1   17   16   30 o    623.3    3.0    0.0000   0.0000          ?        ?  3885.4041  37.0343          ?        ?      623.3        3.0       ?       ? 
1 1 1   17   16   31 o     17.2    8.7    0.0000   0.0000          ?        ?   -56.1899  15.3245          ?        ?       17.2        8.7       ?       ? 
1 1 1   17   16   32 o   1081.6    4.0    0.0000   0.0000          ?        ? 11699.6318  85.5619          ?        ?     1081.6        4.0       ?       ? 
1 1 1   17   16   33 o    370.0    2.6    0.0000   0.0000          ?        ?  1368.9904  19.1556          ?        ?      370.0        2.6       ?       ? 
1 1 1   17   16   34 o    551.7    2.8    0.0000   0.0000          ?        ?  3044.4709  31.2876          ?        ?      551.7        2.8       ?       ? 
1 1 1   17   16   35 o    659.8    2.9    0.0000   0.0000          ?        ?  4353.4404  38.3113          ?        ?      659.8        2.9       ?       ? 
1 1 1   17   16   36 o    462.2    2.9    0.0000   0.0000          ?        ?  2136.4934  26.8179          ?        ?      462.2        2.9       ?       ? 
1 1 1   17   16   37 o    906.1    3.4    0.0000   0.0000          ?        ?  8212.0264  61.2981          ?        ?      906.1        3.4       ?       ? 
1 1 1   17   16   38 o    747.5    3.0    0.0000   0.0000          ?        ?  5588.3413  45.3350          ?        ?      747.5        3.0       ?       ? 
1 1 1   17   16   39 o    284.6    3.3    0.0000   0.0000          ?        ?   810.2839  18.5171          ?        ?      284.6        3.3       ?       ? 
1 1 1   17   16   40 o     17.9    9.1    0.0000   0.0000          ?        ?   -60.6596  16.6016          ?        ?       17.9        9.1       ?       ? 
1 1 1   17   16   41 o    643.5    2.7    0.0000   0.0000          ?        ?  4140.8130  34.4802          ?        ?      643.5        2.7       ?       ? 
1 1 1   17   16   42 o    454.7    2.7    0.0000   0.0000          ?        ?  2068.1716  24.9023          ?        ?      454.7        2.7       ?       ? 
1 1 1   17   16   43 o    685.5    2.8    0.0000   0.0000          ?        ?  4699.5190  38.9498          ?        ?      685.5        2.8       ?       ? 
1 1 1   17   16   44 o    385.4    2.7    0.0000   0.0000          ?        ?  1485.8398  21.0712          ?        ?      385.4        2.7       ?       ? 
1 1 1   17   16   45 o    567.4    2.6    0.0000   0.0000          ?        ?  3220.0645  30.0105          ?        ?      567.4        2.6       ?       ? 
1 1 1   17   16   46 o    413.6    2.9    0.0000   0.0000          ?        ?  1710.5994  23.6253          ?        ?      413.6        2.9       ?       ? 
1 1 1   17   16   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   16   48 o    296.3    3.2    0.0000   0.0000          ?        ?   877.9672  19.1556          ?        ?      296.3        3.2       ?       ? 
1 1 1   17   16   49 o    239.0    3.7    0.0000   0.0000          ?        ?   571.4769  17.8786          ?        ?      239.0        3.7       ?       ? 
1 1 1   17   16   50 o     37.2   15.2    0.0000   0.0000          ?        ?     5.1082  17.8786          ?        ?       37.2       15.2       ?       ? 
1 1 1   17   16   51 o    238.9    3.7    0.0000   0.0000          ?        ?   570.8383  17.8786          ?        ?      238.9        3.7       ?       ? 
1 1 1   17   16   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   16   53 o    216.0    4.3    0.0000   0.0000          ?        ?   466.7593  18.5171          ?        ?      216.0        4.3       ?       ? 
1 1 1   17   16   54 o    473.3    2.8    0.0000   0.0000          ?        ?  2241.2109  26.8179          ?        ?      473.3        2.8       ?       ? 
1 1 1   17   16   55 o     21.4   10.7    0.0000   0.0000          ?        ?   -52.9973  19.1556          ?        ?       21.4       10.7       ?       ? 
1 1 1   17   16   56 o     99.3    9.6    0.0000   0.0000          ?        ?    98.9709  19.1556          ?        ?       99.3        9.6       ?       ? 
1 1 1   17   16   57 o    239.3    4.3    0.0000   0.0000          ?        ?   573.3925  20.4327          ?        ?      239.3        4.3       ?       ? 
1 1 1   17   16   58 o    201.5    4.9    0.0000   0.0000          ?        ?   406.7383  19.7942          ?        ?      201.5        4.9       ?       ? 
1 1 1   17   16   59 o    165.0    5.8    0.0000   0.0000          ?        ?   272.6487  19.1556          ?        ?      165.0        5.8       ?       ? 
1 1 1   17   16   60 o    227.3    4.4    0.0000   0.0000          ?        ?   517.2025  19.7942          ?        ?      227.3        4.4       ?       ? 
1 1 1   17   16   61 o    309.7    3.4    0.0000   0.0000          ?        ?   959.6980  21.0712          ?        ?      309.7        3.4       ?       ? 
1 1 1   17   16   62 o     60.4   16.8    0.0000   0.0000          ?        ?    38.3113  21.0712          ?        ?       60.4       16.8       ?       ? 
1 1 1   17   16   63 o    257.2    4.1    0.0000   0.0000          ?        ?   662.1469  21.0712          ?        ?      257.2        4.1       ?       ? 
1 1 1   17   16   64 o    173.2    5.9    0.0000   0.0000          ?        ?   300.7437  20.4327          ?        ?      173.2        5.9       ?       ? 
1 1 1   17   16   65 o    192.5    5.5    0.0000   0.0000          ?        ?   371.6196  21.0712          ?        ?      192.5        5.5       ?       ? 
1 1 1   17   16   66 o    205.7    5.1    0.0000   0.0000          ?        ?   423.9784  21.0712          ?        ?      205.7        5.1       ?       ? 
1 1 1   17   16   67 o    176.9    6.1    0.0000   0.0000          ?        ?   314.1526  21.7097          ?        ?      176.9        6.1       ?       ? 
1 1 1   17   16   68 o    217.8    4.8    0.0000   0.0000          ?        ?   475.6986  21.0712          ?        ?      217.8        4.8       ?       ? 
1 1 1   17   16   69 o     24.9   12.2    0.0000   0.0000          ?        ?   -45.9736  21.7097          ?        ?       24.9       12.2       ?       ? 
1 1 1   17   16   70 o    170.8    6.2    0.0000   0.0000          ?        ?   293.0815  21.0712          ?        ?      170.8        6.2       ?       ? 
1 1 1   17   16   71 o    196.3    5.4    0.0000   0.0000          ?        ?   386.9441  21.0712          ?        ?      196.3        5.4       ?       ? 
1 1 1   17   16   72 f    159.8    6.8    0.0000   0.0000          ?        ?   257.3242  21.7097          ?        ?      159.8        6.8       ?       ? 
1 1 1   17   16   73 o     36.9   15.7    0.0000   0.0000          ?        ?     1.2770  20.4327          ?        ?       36.9       15.7       ?       ? 
1 1 1   17   16   74 o    112.5    8.5    0.0000   0.0000          ?        ?   128.3428  19.1556          ?        ?      112.5        8.5       ?       ? 
1 1 1   17   17    0 f    871.1    8.2 7590.1064 143.0288  7590.1064 143.0288  7590.1064 143.0288      871.1      8.2      871.1        8.2     0.0     0.0 
1 1 1   17   17    1 o   1292.9    7.4 16718.4121 190.9180 16718.4121 190.9180 16718.4121 190.9180     1292.9      7.4     1292.9        7.4     0.0     0.0 
1 1 1   17   17    2 f     26.1   19.3 -150.0526  61.9366  -150.0526  61.9366  -150.0526  61.9366       26.1     19.3       26.1       19.3     0.0     0.0 
1 1 1   17   17    3 o   1552.4    9.1 24103.5527 282.8651 24103.5527 282.8651 24103.5527 282.8651     1552.4      9.1     1552.4        9.1     0.0     0.0 
1 1 1   17   17    4 o    444.0    3.5 1971.7548  31.2876  1971.7548  31.2876  1971.7548  31.2876      444.0      3.5      444.0        3.5     0.0     0.0 
1 1 1   17   17    5 o    132.7    6.5  177.5090  17.2401   177.5090  17.2401   177.5090  17.2401      132.7      6.5      132.7        6.5     0.0     0.0 
1 1 1   17   17    6 o      9.3    7.0  -33.8416  10.2163   -33.8416  10.2163   -33.8416  10.2163        9.3      7.0        9.3        7.0     0.0     0.0 
1 1 1   17   17    7 o    226.7    2.5  514.0099  11.4934   514.0099  11.4934   514.0099  11.4934      226.7      2.5      226.7        2.5     0.0     0.0 
1 1 1   17   17    8 o   2369.3   11.8 56150.9570 558.7064 56150.9570 558.7064 56150.9570 558.7064     2369.3     11.8     2369.3       11.8     0.0     0.0 
1 1 1   17   17    9 o    869.7    4.6 7563.9272  80.4537  7563.9272  80.4537  7563.9272  80.4537      869.7      4.6      869.7        4.6     0.0     0.0 
1 1 1   17   17   10 o   1119.9    5.7 12542.4805 127.7043 12542.4805 127.7043 12542.4805 127.7043     1119.9      5.7     1119.9        5.7     0.0     0.0 
1 1 1   17   17   11 o    615.9    4.0 3793.4568  49.1662  3793.4568  49.1662  3793.4568  49.1662      615.9      4.0      615.9        4.0     0.0     0.0 
1 1 1   17   17   12 o    915.6    4.6 8384.4277  83.6463  8384.4277  83.6463  8384.4277  83.6463      915.6      4.6      915.6        4.6     0.0     0.0 
1 1 1   17   17   13 o     16.4   12.1  -54.9129  23.6253   -54.9129  23.6253   -54.9129  23.6253       16.4     12.1       16.4       12.1     0.0     0.0 
1 1 1   17   17   14 o   1128.4    5.7 12734.0371 127.7043 12734.0371 127.7043 12734.0371 127.7043     1128.4      5.7     1128.4        5.7     0.0     0.0 
1 1 1   17   17   15 o    797.0    4.1 6352.0132  65.7677  6352.0132  65.7677  6352.0132  65.7677      797.0      4.1      797.0        4.1     0.0     0.0 
1 1 1   17   17   16 o     21.5   14.6   -7.6623  17.8786    -7.6623  17.8786    -7.6623  17.8786       21.5     14.6       21.5       14.6     0.0     0.0 
1 1 1   17   17   17 f    957.9    5.1 9176.8320  98.3323  9176.8320  98.3323  9176.8320  98.3323      957.9      5.1      957.9        5.1     0.0     0.0 
1 1 1   17   17   18 o    412.0    4.3 1698.4675  35.7572  1698.4675  35.7572  1698.4675  35.7572      412.0      4.3      412.0        4.3     0.0     0.0 
1 1 1   17   17   19 o    237.0    4.4  562.5375  21.0712   562.5375  21.0712   562.5375  21.0712      237.0      4.4      237.0        4.4     0.0     0.0 
1 1 1   17   17   20 o     96.2   10.5   95.7782  19.7942    95.7782  19.7942    95.7782  19.7942       96.2     10.5       96.2       10.5     0.0     0.0 
1 1 1   17   17   21 o     39.0   20.3   22.3483  20.4327    22.3483  20.4327    22.3483  20.4327       39.0     20.3       39.0       20.3     0.0     0.0 
1 1 1   17   17   22 o    163.5    5.7  268.1791  18.5171   268.1791  18.5171   268.1791  18.5171      163.5      5.7      163.5        5.7     0.0     0.0 
1 1 1   17   17   23 f    431.9    3.5 1865.7603  30.6490  1865.7603  30.6490  1865.7603  30.6490      431.9      3.5      431.9        3.5     0.0     0.0 
1 1 1   17   17   24 o   1033.7    5.5 10687.5752 113.6568 10687.5752 113.6568 10687.5752 113.6568     1033.7      5.5     1033.7        5.5     0.0     0.0 
1 1 1   17   17   25 o    293.9    4.0  864.5582  23.6253   864.5582  23.6253   864.5582  23.6253      293.9      4.0      293.9        4.0     0.0     0.0 
1 1 1   17   17   26 o    355.8    3.6 1266.1884  25.5409  1266.1884  25.5409  1266.1884  25.5409      355.8      3.6      355.8        3.6     0.0     0.0 
1 1 1   17   17   27 o   1443.8    7.0 20849.0078 202.4114 20849.0078 202.4114 20849.0078 202.4114     1443.8      7.0     1443.8        7.0     0.0     0.0 
1 1 1   17   17   28 o     22.9   16.7  -77.2611  40.2269   -77.2611  40.2269   -77.2611  40.2269       22.9     16.7       22.9       16.7     0.0     0.0 
1 1 1   17   17   29 o    261.2    5.5  683.2181  28.7335   683.2181  28.7335   683.2181  28.7335      261.2      5.5      261.2        5.5     0.0     0.0 
1 1 1   17   17   30 o    964.8    5.2 9310.2832  99.6094  9310.2832  99.6094  9310.2832  99.6094      964.8      5.2      964.8        5.2     0.0     0.0 
1 1 1   17   17   31 o     29.6   18.7    4.4697  22.9868     4.4697  22.9868     4.4697  22.9868       29.6     18.7       29.6       18.7     0.0     0.0 
1 1 1   17   17   32 f     21.1   14.6  -13.4090  19.7942   -13.4090  19.7942   -13.4090  19.7942       21.1     14.6       21.1       14.6     0.0     0.0 
1 1 1   17   17   33 o     52.3   20.5   37.6728  20.4327    37.6728  20.4327    37.6728  20.4327       52.3     20.5       52.3       20.5     0.0     0.0 
1 1 1   17   17   34 o    568.3    4.0 3230.9194  45.3350  3230.9194  45.3350  3230.9194  45.3350      568.3      4.0      568.3        4.0     0.0     0.0 
1 1 1   17   17   35 o   1059.7    6.1 11232.8721 129.6199 11232.8721 129.6199 11232.8721 129.6199     1059.7      6.1     1059.7        6.1     0.0     0.0 
1 1 1   17   17   36 o    212.8    5.6  453.9889  23.6253   453.9889  23.6253   453.9889  23.6253      212.8      5.6      212.8        5.6     0.0     0.0 
1 1 1   17   17   37 o   2051.0    9.8 42093.8984 403.5457 42093.8984 403.5457 42093.8984 403.5457     2051.0      9.8     2051.0        9.8     0.0     0.0 
1 1 1   17   17   38 f    687.6    4.0 4728.8911  55.5514  4728.8911  55.5514  4728.8911  55.5514      687.6      4.0      687.6        4.0     0.0     0.0 
1 1 1   17   17   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   17   40 o    482.8    3.8 2331.8811  36.3957  2331.8811  36.3957  2331.8811  36.3957      482.8      3.8      482.8        3.8     0.0     0.0 
1 1 1   17   17   41 o    148.4    8.0  222.2055  23.6253   222.2055  23.6253   222.2055  23.6253      148.4      8.0      148.4        8.0     0.0     0.0 
1 1 1   17   17   42 o    267.6    5.4  717.0598  28.7335   717.0598  28.7335   717.0598  28.7335      267.6      5.4      267.6        5.4     0.0     0.0 
1 1 1   17   17   43 o    356.4    3.9 1270.6581  28.0950  1270.6581  28.0950  1270.6581  28.0950      356.4      3.9      356.4        3.9     0.0     0.0 
1 1 1   17   17   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   17   45 o     15.1   11.2  -63.8522  22.9868   -63.8522  22.9868   -63.8522  22.9868       15.1     11.2       15.1       11.2     0.0     0.0 
1 1 1   17   17   46 o     54.1   21.9   40.8654  22.9868    40.8654  22.9868    40.8654  22.9868       54.1     21.9       54.1       21.9     0.0     0.0 
1 1 1   17   17   47 o     44.9   22.4   30.0105  24.2638    30.0105  24.2638    30.0105  24.2638       44.9     22.4       44.9       22.4     0.0     0.0 
1 1 1   17   17   48 o    523.4    3.9 2740.5349  40.8654  2740.5349  40.8654  2740.5349  40.8654      523.4      3.9      523.4        3.9     0.0     0.0 
1 1 1   17   17   49 o    554.4    3.7 3075.1201  41.5039  3075.1201  41.5039  3075.1201  41.5039      554.4      3.7      554.4        3.7     0.0     0.0 
1 1 1   17   17   50 o    158.9    8.3  254.7701  26.1794   254.7701  26.1794   254.7701  26.1794      158.9      8.3      158.9        8.3     0.0     0.0 
1 1 1   17   17   51 o     22.1   15.4  -19.7942  23.6253   -19.7942  23.6253   -19.7942  23.6253       22.1     15.4       22.1       15.4     0.0     0.0 
1 1 1   17   17   52 o    221.4    5.9  491.6617  26.1794   491.6617  26.1794   491.6617  26.1794      221.4      5.9      221.4        5.9     0.0     0.0 
1 1 1   17   17   53 o     16.8   12.4  -61.2981  25.5409   -61.2981  25.5409   -61.2981  25.5409       16.8     12.4       16.8       12.4     0.0     0.0 
1 1 1   17   17   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   17   55 f    573.5    3.8 3290.3018  43.4195  3290.3018  43.4195  3290.3018  43.4195      573.5      3.8      573.5        3.8     0.0     0.0 
1 1 1   17   17   56 o     18.9   13.8  -55.5514  28.0950   -55.5514  28.0950   -55.5514  28.0950       18.9     13.8       18.9       13.8     0.0     0.0 
1 1 1   17   17   57 o    268.5    5.4  722.1680  28.7335   722.1680  28.7335   722.1680  28.7335      268.5      5.4      268.5        5.4     0.0     0.0 
1 1 1   17   17   58 o    133.7   10.4  182.6172  27.4564   182.6172  27.4564   182.6172  27.4564      133.7     10.4      133.7       10.4     0.0     0.0 
1 1 1   17   17   59 f    531.2    3.9 2823.5427  41.5039  2823.5427  41.5039  2823.5427  41.5039      531.2      3.9      531.2        3.9     0.0     0.0 
1 1 1   17   17   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   17   61 o    170.3    7.9  292.4429  26.8179   292.4429  26.8179   292.4429  26.8179      170.3      7.9      170.3        7.9     0.0     0.0 
1 1 1   17   17   62 o    440.6    4.1 1943.0212  35.7572  1943.0212  35.7572  1943.0212  35.7572      440.6      4.1      440.6        4.1     0.0     0.0 
1 1 1   17   17   63 o    288.4    5.5  833.9093  31.9261   833.9093  31.9261   833.9093  31.9261      288.4      5.5      288.4        5.5     0.0     0.0 
1 1 1   17   17   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   17   65 o     39.9   23.1   21.0712  29.3720    21.0712  29.3720    21.0712  29.3720       39.9     23.1       39.9       23.1     0.0     0.0 
1 1 1   17   17   66 f    356.9    4.7 1275.7662  33.2031  1275.7662  33.2031  1275.7662  33.2031      356.9      4.7      356.9        4.7     0.0     0.0 
1 1 1   17   17   67 o    547.5    4.1 3000.4131  44.6965  3000.4131  44.6965  3000.4131  44.6965      547.5      4.1      547.5        4.1     0.0     0.0 
1 1 1   17   17   68 o    153.9    9.6  240.7227  29.3720   240.7227  29.3720   240.7227  29.3720      153.9      9.6      153.9        9.6     0.0     0.0 
1 1 1   17   17   69 f     34.9   21.5   11.4934  28.7335    11.4934  28.7335    11.4934  28.7335       34.9     21.5       34.9       21.5     0.0     0.0 
1 1 1   17   17   70 o    334.9    5.1 1124.4366  33.8416  1124.4366  33.8416  1124.4366  33.8416      334.9      5.1      334.9        5.1     0.0     0.0 
1 1 1   17   17   71 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   17   17   72 o     81.7   19.8   79.1767  28.0950    79.1767  28.0950    79.1767  28.0950       81.7     19.8       81.7       19.8     0.0     0.0 
1 1 1   17   17   73 o     56.4   24.4   47.2506  28.0950    47.2506  28.0950    47.2506  28.0950       56.4     24.4       56.4       24.4     0.0     0.0 
1 1 1   17   17   74 o     70.1   22.7   64.4907  28.0950    64.4907  28.0950    64.4907  28.0950       70.1     22.7       70.1       22.7     0.0     0.0 
1 1 1   18    0    0 o     62.3    6.8   40.2269   8.3008    40.2269   8.3008    40.2269   8.3008       62.3      6.8       62.3        6.8     0.0     0.0 
1 1 1   18    0    1 o   1079.7    5.1 11658.7666 111.1028 11658.7666 111.1028 11658.7666 111.1028     1079.7      5.1     1079.7        5.1     0.0     0.0 
1 1 1   18    0    2 o   1235.5    5.8 15265.7754 144.3059 15265.7754 144.3059 15265.7754 144.3059     1235.5      5.8     1235.5        5.8     0.0     0.0 
1 1 1   18    0    3 o    272.1    2.0  740.6851  10.8549   740.6851  10.8549   740.6851  10.8549      272.1      2.0      272.1        2.0     0.0     0.0 
1 1 1   18    0    4 o   1505.3    7.0 22664.3242 211.3506 22664.3242 211.3506 22664.3242 211.3506     1505.3      7.0     1505.3        7.0     0.0     0.0 
1 1 1   18    0    5 o   1063.6    5.1 11313.9648 108.5487 11313.9648 108.5487 11313.9648 108.5487     1063.6      5.1     1063.6        5.1     0.0     0.0 
1 1 1   18    0    6 o   2568.3   11.6 65985.4609 597.0177 65985.4609 597.0177 65985.4609 597.0177     2568.3     11.6     2568.3       11.6     0.0     0.0 
1 1 1   18    0    7 o   2095.2    9.5 43911.1328 399.7145 43911.1328 399.7145 43911.1328 399.7145     2095.2      9.5     2095.2        9.5     0.0     0.0 
1 1 1   18    0    8 o   1193.1    5.7 14236.4785 136.6436 14236.4785 136.6436 14236.4785 136.6436     1193.1      5.7     1193.1        5.7     0.0     0.0 
1 1 1   18    0    9 o    994.1    4.8 9883.6768  95.7782  9883.6768  95.7782  9883.6768  95.7782      994.1      4.8      994.1        4.8     0.0     0.0 
1 1 1   18    0   10 o      7.3    5.4  -17.2401   5.7467   -17.2401   5.7467   -17.2401   5.7467        7.3      5.4        7.3        5.4     0.0     0.0 
1 1 1   18    0   11 o    338.8    2.3 1148.0619  15.3245  1148.0619  15.3245  1148.0619  15.3245      338.8      2.3      338.8        2.3     0.0     0.0 
1 1 1   18    0   12 o   1228.4    5.9 15092.7354 144.3059 15092.7354 144.3059 15092.7354 144.3059     1228.4      5.9     1228.4        5.9     0.0     0.0 
1 1 1   18    0   13 o    141.1    2.9  199.2188   8.3008   199.2188   8.3008   199.2188   8.3008      141.1      2.9      141.1        2.9     0.0     0.0 
1 1 1   18    0   14 o    293.4    2.3  860.7272  13.4090   860.7272  13.4090   860.7272  13.4090      293.4      2.3      293.4        2.3     0.0     0.0 
1 1 1   18    0   15 o    630.1    3.3 3970.9661  41.5039  3970.9661  41.5039  3970.9661  41.5039      630.1      3.3      630.1        3.3     0.0     0.0 
1 1 1   18    0   16 o    505.9    3.0 2559.1946  30.0105  2559.1946  30.0105  2559.1946  30.0105      505.9      3.0      505.9        3.0     0.0     0.0 
1 1 1   18    0   17 o   1397.6    6.6 19534.9297 183.8942 19534.9297 183.8942 19534.9297 183.8942     1397.6      6.6     1397.6        6.6     0.0     0.0 
1 1 1   18    0   18 o    130.4    3.7  170.4853   9.5778   170.4853   9.5778   170.4853   9.5778      130.4      3.7      130.4        3.7     0.0     0.0 
1 1 1   18    0   19 o    561.4    3.2 3151.7427  36.3957  3151.7427  36.3957  3151.7427  36.3957      561.4      3.2      561.4        3.2     0.0     0.0 
1 1 1   18    0   20 o    445.8    3.5 1987.7178  31.2876  1987.7178  31.2876  1987.7178  31.2876      445.8      3.5      445.8        3.5     0.0     0.0 
1 1 1   18    0   21 o   1756.4    8.1 30854.0039 284.7806 30854.0039 284.7806 30854.0039 284.7806     1756.4      8.1     1756.4        8.1     0.0     0.0 
1 1 1   18    0   22 f   1524.1    7.5 23233.8867 227.3137 23233.8867 227.3137 23233.8867 227.3137     1524.1      7.5     1524.1        7.5     0.0     0.0 
1 1 1   18    0   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    0   24 o   1529.0    7.3 23380.7461 222.2055 23380.7461 222.2055 23380.7461 222.2055     1529.0      7.3     1529.0        7.3     0.0     0.0 
1 1 1   18    0   25 o   1240.0    5.9 15378.1543 147.4985 15378.1543 147.4985 15378.1543 147.4985     1240.0      5.9     1240.0        5.9     0.0     0.0 
1 1 1   18    0   26 o   1893.1    8.8 35844.0508 331.3927 35844.0508 331.3927 35844.0508 331.3927     1893.1      8.8     1893.1        8.8     0.0     0.0 
1 1 1   18    0   27 f    145.2    7.7  212.6277  22.3483   212.6277  22.3483   212.6277  22.3483      145.2      7.7      145.2        7.7     0.0     0.0 
1 1 1   18    0   28 o    280.3    4.0  786.0201  22.3483   786.0201  22.3483   786.0201  22.3483      280.3      4.0      280.3        4.0     0.0     0.0 
1 1 1   18    0   29 o   1598.3    7.5 25549.8047 239.4456 25549.8047 239.4456 25549.8047 239.4456     1598.3      7.5     1598.3        7.5     0.0     0.0 
1 1 1   18    0   30 o    730.4    4.1 5334.8481  59.3825  5334.8481  59.3825  5334.8481  59.3825      730.4      4.1      730.4        4.1     0.0     0.0 
1 1 1   18    0   31 o    277.5    4.4  770.6956  24.2638   770.6956  24.2638   770.6956  24.2638      277.5      4.4      277.5        4.4     0.0     0.0 
1 1 1   18    0   32 o    288.0    4.1  830.0781  23.6253   830.0781  23.6253   830.0781  23.6253      288.0      4.1      288.0        4.1     0.0     0.0 
1 1 1   18    0   33 o   1013.0    5.5 10262.3193 111.7413 10262.3193 111.7413 10262.3193 111.7413     1013.0      5.5     1013.0        5.5     0.0     0.0 
1 1 1   18    0   34 o   1209.3    6.4 14627.2539 154.5222 14627.2539 154.5222 14627.2539 154.5222     1209.3      6.4     1209.3        6.4     0.0     0.0 
1 1 1   18    0   35 o    446.1    3.5 1990.9104  31.2876  1990.9104  31.2876  1990.9104  31.2876      446.1      3.5      446.1        3.5     0.0     0.0 
1 1 1   18    0   36 o    294.0    5.2  865.1968  30.6490   865.1968  30.6490   865.1968  30.6490      294.0      5.2      294.0        5.2     0.0     0.0 
1 1 1   18    0   37 o   1015.9    5.0 10322.3408 101.5249 10322.3408 101.5249 10322.3408 101.5249     1015.9      5.0     1015.9        5.0     0.0     0.0 
1 1 1   18    0   38 o   1513.3    7.2 22905.6875 216.4588 22905.6875 216.4588 22905.6875 216.4588     1513.3      7.2     1513.3        7.2     0.0     0.0 
1 1 1   18    0   39 o    760.8    4.8 5789.4756  73.4300  5789.4756  73.4300  5789.4756  73.4300      760.8      4.8      760.8        4.8     0.0     0.0 
1 1 1   18    0   40 o   2810.5   13.2 79032.3750 741.3236 79032.3750 741.3236 79032.3750 741.3236     2810.5     13.2     2810.5       13.2     0.0     0.0 
1 1 1   18    0   41 o   1267.9    6.2 16079.8906 157.7148 16079.8906 157.7148 16079.8906 157.7148     1267.9      6.2     1267.9        6.2     0.0     0.0 
1 1 1   18    0   42 o    340.9    4.4 1162.7479  30.0105  1162.7479  30.0105  1162.7479  30.0105      340.9      4.4      340.9        4.4     0.0     0.0 
1 1 1   18    0   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    0   44 o    710.2    4.2 5044.9590  60.0210  5044.9590  60.0210  5044.9590  60.0210      710.2      4.2      710.2        4.2     0.0     0.0 
1 1 1   18    0   45 o    449.6    3.7 2021.5594  33.2031  2021.5594  33.2031  2021.5594  33.2031      449.6      3.7      449.6        3.7     0.0     0.0 
1 1 1   18    0   46 o    264.3    5.1  699.1812  26.8179   699.1812  26.8179   699.1812  26.8179      264.3      5.1      264.3        5.1     0.0     0.0 
1 1 1   18    0   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    0   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    0   49 o    436.0    3.9 1901.5173  33.8416  1901.5173  33.8416  1901.5173  33.8416      436.0      3.9      436.0        3.9     0.0     0.0 
1 1 1   18    0   50 o    379.7    4.1 1442.4203  31.2876  1442.4203  31.2876  1442.4203  31.2876      379.7      4.1      379.7        4.1     0.0     0.0 
1 1 1   18    0   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    0   52 o    368.1    4.2 1355.5814  30.6490  1355.5814  30.6490  1355.5814  30.6490      368.1      4.2      368.1        4.2     0.0     0.0 
1 1 1   18    0   53 o    428.3    4.0 1835.1111  34.4802  1835.1111  34.4802  1835.1111  34.4802      428.3      4.0      428.3        4.0     0.0     0.0 
1 1 1   18    0   54 o    121.1   11.3  150.6911  26.8179   150.6911  26.8179   150.6911  26.8179      121.1     11.3      121.1       11.3     0.0     0.0 
1 1 1   18    0   55 o     20.5   14.8  -40.8654  27.4564   -40.8654  27.4564   -40.8654  27.4564       20.5     14.8       20.5       14.8     0.0     0.0 
1 1 1   18    0   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    0   57 o    206.6    6.5  428.4480  26.8179   428.4480  26.8179   428.4480  26.8179      206.6      6.5      206.6        6.5     0.0     0.0 
1 1 1   18    0   58 o    385.5    4.2 1487.1168  32.5646  1487.1168  32.5646  1487.1168  32.5646      385.5      4.2      385.5        4.2     0.0     0.0 
1 1 1   18    0   59 o     27.1   18.5  -14.0475  29.3720   -14.0475  29.3720   -14.0475  29.3720       27.1     18.5       27.1       18.5     0.0     0.0 
1 1 1   18    0   60 o     42.7   23.4   26.1794  28.0950    26.1794  28.0950    26.1794  28.0950       42.7     23.4       42.7       23.4     0.0     0.0 
1 1 1   18    0   61 f    153.2    9.2  237.5300  28.0950   237.5300  28.0950   237.5300  28.0950      153.2      9.2      153.2        9.2     0.0     0.0 
1 1 1   18    0   62 o    314.0    5.2  987.1545  32.5646   987.1545  32.5646   987.1545  32.5646      314.0      5.2      314.0        5.2     0.0     0.0 
1 1 1   18    0   63 o    453.0    4.1 2053.4856  37.0343  2053.4856  37.0343  2053.4856  37.0343      453.0      4.1      453.0        4.1     0.0     0.0 
1 1 1   18    0   64 o     85.0   17.4   81.0922  26.1794    81.0922  26.1794    81.0922  26.1794       85.0     17.4       85.0       17.4     0.0     0.0 
1 1 1   18    0   65 o    147.5    9.8  220.9285  28.7335   220.9285  28.7335   220.9285  28.7335      147.5      9.8      147.5        9.8     0.0     0.0 
1 1 1   18    0   66 o     34.6   21.8    7.0237  31.2876     7.0237  31.2876     7.0237  31.2876       34.6     21.8       34.6       21.8     0.0     0.0 
1 1 1   18    0   67 o    387.0    4.5 1499.2488  34.4802  1499.2488  34.4802  1499.2488  34.4802      387.0      4.5      387.0        4.5     0.0     0.0 
1 1 1   18    0   68 o     40.3   23.2   21.7097  29.3720    21.7097  29.3720    21.7097  29.3720       40.3     23.2       40.3       23.2     0.0     0.0 
1 1 1   18    0   69 o    184.5    8.5  343.5246  31.2876   343.5246  31.2876   343.5246  31.2876      184.5      8.5      184.5        8.5     0.0     0.0 
1 1 1   18    0   70 o    121.7   13.4  154.5222  31.9261   154.5222  31.9261   154.5222  31.9261      121.7     13.4      121.7       13.4     0.0     0.0 
1 1 1   18    0   71 o     34.2   21.7    6.3852  31.2876     6.3852  31.2876     6.3852  31.2876       34.2     21.7       34.2       21.7     0.0     0.0 
1 1 1   18    0   72 o     54.1   25.4   44.0580  30.6490    44.0580  30.6490    44.0580  30.6490       54.1     25.4       54.1       25.4     0.0     0.0 
1 1 1   18    0   73 o    129.1   12.8  173.0394  32.5646   173.0394  32.5646   173.0394  32.5646      129.1     12.8      129.1       12.8     0.0     0.0 
1 1 1   18    0   74 o    201.0    8.0  407.3768  31.9261   407.3768  31.9261   407.3768  31.9261      201.0      8.0      201.0        8.0     0.0     0.0 
1 1 1   18    0   75 o    352.9    5.0 1248.3098  35.1187  1248.3098  35.1187  1248.3098  35.1187      352.9      5.0      352.9        5.0     0.0     0.0 
1 1 1   18    0   76 o     22.3   15.9  -31.2876  28.0950   -31.2876  28.0950   -31.2876  28.0950       22.3     15.9       22.3       15.9     0.0     0.0 
1 1 1   18    0   77 o    282.9    5.4  803.2603  30.6490   803.2603  30.6490   803.2603  30.6490      282.9      5.4      282.9        5.4     0.0     0.0 
1 1 1   18    0   78 o    176.2    8.2  314.1526  28.7335   314.1526  28.7335   314.1526  28.7335      176.2      8.2      176.2        8.2     0.0     0.0 
1 1 1   18    0   79 o    272.4    6.0  745.7933  32.5646   745.7933  32.5646   745.7933  32.5646      272.4      6.0      272.4        6.0     0.0     0.0 
1 1 1   18    1    0 o   1731.0    8.1 29969.0117 279.6725 29969.0117 279.6725 29969.0117 279.6725     1731.0      8.1     1731.0        8.1     0.0     0.0 
1 1 1   18    1    1 o    425.2    1.8    0.0000   0.0000          ?        ?  1807.6548  15.3245          ?        ?      425.2        1.8       ?       ? 
1 1 1   18    1    2 o   1204.9    4.1    0.0000   0.0000          ?        ? 14518.0654  98.3323          ?        ?     1204.9        4.1       ?       ? 
1 1 1   18    1    3 o    331.8    1.5    0.0000   0.0000          ?        ?  1100.8113  10.2163          ?        ?      331.8        1.5       ?       ? 
1 1 1   18    1    4 o    757.6    2.7    0.0000   0.0000          ?        ?  5739.0322  40.8654          ?        ?      757.6        2.7       ?       ? 
1 1 1   18    1    5 o    988.5    3.4    0.0000   0.0000          ?        ?  9772.5732  67.6833          ?        ?      988.5        3.4       ?       ? 
1 1 1   18    1    6 o   1336.3    4.4    0.0000   0.0000          ?        ? 17858.1738 118.7650          ?        ?     1336.3        4.4       ?       ? 
1 1 1   18    1    7 o    116.6    2.2    0.0000   0.0000          ?        ?   136.0051   5.1082          ?        ?      116.6        2.2       ?       ? 
1 1 1   18    1    8 o    887.1    3.1    0.0000   0.0000          ?        ?  7870.4175  54.9129          ?        ?      887.1        3.1       ?       ? 
1 1 1   18    1    9 f    698.8    2.5    0.0000   0.0000          ?        ?  4884.0522  35.1187          ?        ?      698.8        2.5       ?       ? 
1 1 1   18    1   10 o    370.0    1.6    0.0000   0.0000          ?        ?  1368.9904  12.1319          ?        ?      370.0        1.6       ?       ? 
1 1 1   18    1   11 o    732.7    2.7    0.0000   0.0000          ?        ?  5368.0513  38.9498          ?        ?      732.7        2.7       ?       ? 
1 1 1   18    1   12 o   1076.9    3.7    0.0000   0.0000          ?        ? 11598.7451  79.1767          ?        ?     1076.9        3.7       ?       ? 
1 1 1   18    1   13 o    912.6    3.1    0.0000   0.0000          ?        ?  8329.5146  57.4669          ?        ?      912.6        3.1       ?       ? 
1 1 1   18    1   14 o   1374.7    4.6    0.0000   0.0000          ?        ? 18900.2402 125.7888          ?        ?     1374.7        4.6       ?       ? 
1 1 1   18    1   15 o    318.6    1.7    0.0000   0.0000          ?        ?  1015.2494  10.8549          ?        ?      318.6        1.7       ?       ? 
1 1 1   18    1   16 o   1338.8    4.5    0.0000   0.0000          ?        ? 17925.8555 120.0421          ?        ?     1338.8        4.5       ?       ? 
1 1 1   18    1   17 f   1188.5    4.0    0.0000   0.0000          ?        ? 14127.2910  95.7782          ?        ?     1188.5        4.0       ?       ? 
1 1 1   18    1   18 o   1418.1    4.8    0.0000   0.0000          ?        ? 20112.7930 134.7281          ?        ?     1418.1        4.8       ?       ? 
1 1 1   18    1   19 o    647.0    2.4    0.0000   0.0000          ?        ?  4186.1475  31.2876          ?        ?      647.0        2.4       ?       ? 
1 1 1   18    1   20 o   1331.6    4.4    0.0000   0.0000          ?        ? 17731.7461 118.1265          ?        ?     1331.6        4.4       ?       ? 
1 1 1   18    1   21 o   1007.3    3.6    0.0000   0.0000          ?        ? 10146.7471  72.7915          ?        ?     1007.3        3.6       ?       ? 
1 1 1   18    1   22 o    634.6    2.5    0.0000   0.0000          ?        ?  4027.1560  31.9261          ?        ?      634.6        2.5       ?       ? 
1 1 1   18    1   23 o    801.9    3.2    0.0000   0.0000          ?        ?  6429.9126  51.0817          ?        ?      801.9        3.2       ?       ? 
1 1 1   18    1   24 o    748.5    2.9    0.0000   0.0000          ?        ?  5603.0273  43.4195          ?        ?      748.5        2.9       ?       ? 
1 1 1   18    1   25 o    669.9    2.7    0.0000   0.0000          ?        ?  4487.5298  35.7572          ?        ?      669.9        2.7       ?       ? 
1 1 1   18    1   26 o    475.4    2.7    0.0000   0.0000          ?        ?  2260.3665  25.5409          ?        ?      475.4        2.7       ?       ? 
1 1 1   18    1   27 o    622.3    2.7    0.0000   0.0000          ?        ?  3872.6335  33.8416          ?        ?      622.3        2.7       ?       ? 
1 1 1   18    1   28 o    978.9    3.6    0.0000   0.0000          ?        ?  9583.5713  70.8759          ?        ?      978.9        3.6       ?       ? 
1 1 1   18    1   29 o   1748.0    6.0    0.0000   0.0000          ?        ? 30557.0918 210.7121          ?        ?     1748.0        6.0       ?       ? 
1 1 1   18    1   30 o    558.5    2.6    0.0000   0.0000          ?        ?  3119.1782  28.7335          ?        ?      558.5        2.6       ?       ? 
1 1 1   18    1   31 o     19.0    9.3    0.0000   0.0000          ?        ?   -24.9023  12.1319          ?        ?       19.0        9.3       ?       ? 
1 1 1   18    1   32 o     29.8   12.4    0.0000   0.0000          ?        ?     1.9156  12.1319          ?        ?       29.8       12.4       ?       ? 
1 1 1   18    1   33 o    728.9    2.8    0.0000   0.0000          ?        ?  5312.5000  41.5039          ?        ?      728.9        2.8       ?       ? 
1 1 1   18    1   34 o    753.7    2.9    0.0000   0.0000          ?        ?  5680.9268  44.0580          ?        ?      753.7        2.9       ?       ? 
1 1 1   18    1   35 o   1015.9    3.6    0.0000   0.0000          ?        ? 10321.7021  73.4300          ?        ?     1015.9        3.6       ?       ? 
1 1 1   18    1   36 o   1313.5    4.6    0.0000   0.0000          ?        ? 17254.7695 120.0421          ?        ?     1313.5        4.6       ?       ? 
1 1 1   18    1   37 o    990.3    3.6    0.0000   0.0000          ?        ?  9808.3301  72.1529          ?        ?      990.3        3.6       ?       ? 
1 1 1   18    1   38 o   1014.7    3.6    0.0000   0.0000          ?        ? 10297.4375  72.7915          ?        ?     1014.7        3.6       ?       ? 
1 1 1   18    1   39 o    160.4    6.4    0.0000   0.0000          ?        ?   257.3242  20.4327          ?        ?      160.4        6.4       ?       ? 
1 1 1   18    1   40 o    402.0    3.1    0.0000   0.0000          ?        ?  1616.0983  24.9023          ?        ?      402.0        3.1       ?       ? 
1 1 1   18    1   41 o   1074.9    3.9    0.0000   0.0000          ?        ? 11555.9648  84.2849          ?        ?     1074.9        3.9       ?       ? 
1 1 1   18    1   42 o    751.5    3.0    0.0000   0.0000          ?        ?  5648.3623  45.3350          ?        ?      751.5        3.0       ?       ? 
1 1 1   18    1   43 o    798.2    3.1    0.0000   0.0000          ?        ?  6372.4458  49.8047          ?        ?      798.2        3.1       ?       ? 
1 1 1   18    1   44 o    614.1    2.7    0.0000   0.0000          ?        ?  3771.7473  33.2031          ?        ?      614.1        2.7       ?       ? 
1 1 1   18    1   45 o    219.7    4.2    0.0000   0.0000          ?        ?   482.7224  18.5171          ?        ?      219.7        4.2       ?       ? 
1 1 1   18    1   46 o    202.8    4.6    0.0000   0.0000          ?        ?   411.2079  18.5171          ?        ?      202.8        4.6       ?       ? 
1 1 1   18    1   47 o    355.5    3.1    0.0000   0.0000          ?        ?  1264.2728  22.3483          ?        ?      355.5        3.1       ?       ? 
1 1 1   18    1   48 o    236.1    4.1    0.0000   0.0000          ?        ?   557.4294  19.1556          ?        ?      236.1        4.1       ?       ? 
1 1 1   18    1   49 o    407.2    2.7    0.0000   0.0000          ?        ?  1658.2407  22.3483          ?        ?      407.2        2.7       ?       ? 
1 1 1   18    1   50 o    430.4    2.8    0.0000   0.0000          ?        ?  1852.3513  24.2638          ?        ?      430.4        2.8       ?       ? 
1 1 1   18    1   51 o    321.5    3.7    0.0000   0.0000          ?        ?  1033.7665  23.6253          ?        ?      321.5        3.7       ?       ? 
1 1 1   18    1   52 o    388.9    3.0    0.0000   0.0000          ?        ?  1512.6577  22.9868          ?        ?      388.9        3.0       ?       ? 
1 1 1   18    1   53 o    825.6    3.2    0.0000   0.0000          ?        ?  6818.1343  52.3588          ?        ?      825.6        3.2       ?       ? 
1 1 1   18    1   54 o    251.2    4.1    0.0000   0.0000          ?        ?   631.4979  20.4327          ?        ?      251.2        4.1       ?       ? 
1 1 1   18    1   55 o    305.0    3.5    0.0000   0.0000          ?        ?   930.3260  21.0712          ?        ?      305.0        3.5       ?       ? 
1 1 1   18    1   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    1   57 o    319.4    3.2    0.0000   0.0000          ?        ?  1020.3576  20.4327          ?        ?      319.4        3.2       ?       ? 
1 1 1   18    1   58 o     20.8   10.5    0.0000   0.0000          ?        ?   -56.8284  19.1556          ?        ?       20.8       10.5       ?       ? 
1 1 1   18    1   59 o     56.8   16.5    0.0000   0.0000          ?        ?    33.2031  19.7942          ?        ?       56.8       16.5       ?       ? 
1 1 1   18    1   60 o    572.7    2.8    0.0000   0.0000          ?        ?  3280.7241  31.9261          ?        ?      572.7        2.8       ?       ? 
1 1 1   18    1   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    1   62 o    359.8    3.0    0.0000   0.0000          ?        ?  1294.9219  21.7097          ?        ?      359.8        3.0       ?       ? 
1 1 1   18    1   63 f     79.6   12.4    0.0000   0.0000          ?        ?    63.8522  19.7942          ?        ?       79.6       12.4       ?       ? 
1 1 1   18    1   64 o    291.3    3.8    0.0000   0.0000          ?        ?   849.2338  22.3483          ?        ?      291.3        3.8       ?       ? 
1 1 1   18    1   65 o    253.8    4.3    0.0000   0.0000          ?        ?   644.9069  21.7097          ?        ?      253.8        4.3       ?       ? 
1 1 1   18    1   66 o    341.3    3.3    0.0000   0.0000          ?        ?  1165.9406  22.3483          ?        ?      341.3        3.3       ?       ? 
1 1 1   18    1   67 o    320.8    3.5    0.0000   0.0000          ?        ?  1029.9354  22.3483          ?        ?      320.8        3.5       ?       ? 
1 1 1   18    1   68 o    222.3    4.9    0.0000   0.0000          ?        ?   494.8542  21.7097          ?        ?      222.3        4.9       ?       ? 
1 1 1   18    1   69 o    289.6    4.0    0.0000   0.0000          ?        ?   839.6559  22.9868          ?        ?      289.6        4.0       ?       ? 
1 1 1   18    1   70 o    208.1    5.2    0.0000   0.0000          ?        ?   434.1947  21.7097          ?        ?      208.1        5.2       ?       ? 
1 1 1   18    1   71 o    120.5    9.0    0.0000   0.0000          ?        ?   146.2215  21.7097          ?        ?      120.5        9.0       ?       ? 
1 1 1   18    1   72 o     63.0   16.5    0.0000   0.0000          ?        ?    42.1424  21.0712          ?        ?       63.0       16.5       ?       ? 
1 1 1   18    1   73 o    117.2    9.3    0.0000   0.0000          ?        ?   138.5592  21.7097          ?        ?      117.2        9.3       ?       ? 
1 1 1   18    1   74 o     26.7   13.0    0.0000   0.0000          ?        ?   -42.1424  22.9868          ?        ?       26.7       13.0       ?       ? 
1 1 1   18    1   75 o    134.9    7.8    0.0000   0.0000          ?        ?   183.2557  21.0712          ?        ?      134.9        7.8       ?       ? 
1 1 1   18    1   76 o     82.0   13.2    0.0000   0.0000          ?        ?    68.9603  21.7097          ?        ?       82.0       13.2       ?       ? 
1 1 1   18    1   77 o     45.8   16.9    0.0000   0.0000          ?        ?    17.8786  20.4327          ?        ?       45.8       16.9       ?       ? 
1 1 1   18    1   78 o     21.1   10.6    0.0000   0.0000          ?        ?   -62.5751  20.4327          ?        ?       21.1       10.6       ?       ? 
1 1 1   18    1   79 o    209.6    5.5    0.0000   0.0000          ?        ?   441.8569  22.9868          ?        ?      209.6        5.5       ?       ? 
1 1 1   18    2    0 o   1047.0    5.1 10963.4160 106.6331 10963.4160 106.6331 10963.4160 106.6331     1047.0      5.1     1047.0        5.1     0.0     0.0 
1 1 1   18    2    1 o    673.5    2.5    0.0000   0.0000          ?        ?  4536.0576  33.2031          ?        ?      673.5        2.5       ?       ? 
1 1 1   18    2    2 o    110.1    1.7    0.0000   0.0000          ?        ?   121.3191   3.8311          ?        ?      110.1        1.7       ?       ? 
1 1 1   18    2    3 o    953.7    3.3    0.0000   0.0000          ?        ?  9096.3789  63.2136          ?        ?      953.7        3.3       ?       ? 
1 1 1   18    2    4 o    897.5    3.1    0.0000   0.0000          ?        ?  8054.9502  56.1899          ?        ?      897.5        3.1       ?       ? 
1 1 1   18    2    5 o    221.6    1.4    0.0000   0.0000          ?        ?   491.0231   6.3852          ?        ?      221.6        1.4       ?       ? 
1 1 1   18    2    6 o    854.7    3.0    0.0000   0.0000          ?        ?  7305.3257  51.0817          ?        ?      854.7        3.0       ?       ? 
1 1 1   18    2    7 o   1315.1    4.4    0.0000   0.0000          ?        ? 17296.9121 114.9339          ?        ?     1315.1        4.4       ?       ? 
1 1 1   18    2    8 o    756.0    2.7    0.0000   0.0000          ?        ?  5716.0459  40.8654          ?        ?      756.0        2.7       ?       ? 
1 1 1   18    2    9 o   1331.1    4.5    0.0000   0.0000          ?        ? 17720.2520 118.7650          ?        ?     1331.1        4.5       ?       ? 
1 1 1   18    2   10 o    803.5    2.9    0.0000   0.0000          ?        ?  6456.7310  45.9736          ?        ?      803.5        2.9       ?       ? 
1 1 1   18    2   11 o     51.2    5.0    0.0000   0.0000          ?        ?    26.1794   5.1082          ?        ?       51.2        5.0       ?       ? 
1 1 1   18    2   12 o    483.4    2.0    0.0000   0.0000          ?        ?  2336.9893  19.1556          ?        ?      483.4        2.0       ?       ? 
1 1 1   18    2   13 o   1149.3    3.9    0.0000   0.0000          ?        ? 13209.7354  90.0316          ?        ?     1149.3        3.9       ?       ? 
1 1 1   18    2   14 o     71.9    3.6    0.0000   0.0000          ?        ?    51.7203   5.1082          ?        ?       71.9        3.6       ?       ? 
1 1 1   18    2   15 o    754.2    2.8    0.0000   0.0000          ?        ?  5688.5894  41.5039          ?        ?      754.2        2.8       ?       ? 
1 1 1   18    2   16 o    454.0    1.9    0.0000   0.0000          ?        ?  2061.1477  17.2401          ?        ?      454.0        1.9       ?       ? 
1 1 1   18    2   17 o    383.6    1.8    0.0000   0.0000          ?        ?  1471.7924  14.0475          ?        ?      383.6        1.8       ?       ? 
1 1 1   18    2   18 o    999.0    3.5    0.0000   0.0000          ?        ?  9980.0928  69.5989          ?        ?      999.0        3.5       ?       ? 
1 1 1   18    2   19 o   1030.2    3.6    0.0000   0.0000          ?        ? 10612.8682  74.0685          ?        ?     1030.2        3.6       ?       ? 
1 1 1   18    2   20 o   1699.4    5.7    0.0000   0.0000          ?        ? 28882.8867 194.7491          ?        ?     1699.4        5.7       ?       ? 
1 1 1   18    2   21 o    721.7    2.7    0.0000   0.0000          ?        ?  5209.0596  39.5883          ?        ?      721.7        2.7       ?       ? 
1 1 1   18    2   22 o   1507.5    5.3    0.0000   0.0000          ?        ? 22726.2617 160.9075          ?        ?     1507.5        5.3       ?       ? 
1 1 1   18    2   23 o    333.5    2.1    0.0000   0.0000          ?        ?  1112.3047  14.0475          ?        ?      333.5        2.1       ?       ? 
1 1 1   18    2   24 o    466.0    2.2    0.0000   0.0000          ?        ?  2171.6121  20.4327          ?        ?      466.0        2.2       ?       ? 
1 1 1   18    2   25 o   1136.3    4.1    0.0000   0.0000          ?        ? 12911.5459  93.2242          ?        ?     1136.3        4.1       ?       ? 
1 1 1   18    2   26 o    266.5    2.5    0.0000   0.0000          ?        ?   710.0360  13.4090          ?        ?      266.5        2.5       ?       ? 
1 1 1   18    2   27 o    807.7    3.0    0.0000   0.0000          ?        ?  6523.7754  47.8891          ?        ?      807.7        3.0       ?       ? 
1 1 1   18    2   28 o    780.7    3.0    0.0000   0.0000          ?        ?  6095.3271  47.2506          ?        ?      780.7        3.0       ?       ? 
1 1 1   18    2   29 o    524.2    2.6    0.0000   0.0000          ?        ?  2747.5586  27.4564          ?        ?      524.2        2.6       ?       ? 
1 1 1   18    2   30 o   1394.8    5.0    0.0000   0.0000          ?        ? 19457.6699 140.4748          ?        ?     1394.8        5.0       ?       ? 
1 1 1   18    2   31 o   1173.0    4.2    0.0000   0.0000          ?        ? 13760.1406  98.3323          ?        ?     1173.0        4.2       ?       ? 
1 1 1   18    2   32 o    547.9    2.6    0.0000   0.0000          ?        ?  3002.3289  28.0950          ?        ?      547.9        2.6       ?       ? 
1 1 1   18    2   33 o    688.4    2.9    0.0000   0.0000          ?        ?  4738.4688  39.5883          ?        ?      688.4        2.9       ?       ? 
1 1 1   18    2   34 o    791.8    3.0    0.0000   0.0000          ?        ?  6269.6440  47.8891          ?        ?      791.8        3.0       ?       ? 
1 1 1   18    2   35 o    703.5    2.8    0.0000   0.0000          ?        ?  4949.8198  39.5883          ?        ?      703.5        2.8       ?       ? 
1 1 1   18    2   36 o    719.2    3.1    0.0000   0.0000          ?        ?  5172.0254  44.6965          ?        ?      719.2        3.1       ?       ? 
1 1 1   18    2   37 o    766.4    3.2    0.0000   0.0000          ?        ?  5874.3989  49.8047          ?        ?      766.4        3.2       ?       ? 
1 1 1   18    2   38 o    667.0    3.2    0.0000   0.0000          ?        ?  4449.2188  42.1424          ?        ?      667.0        3.2       ?       ? 
1 1 1   18    2   39 o    856.1    3.3    0.0000   0.0000          ?        ?  7329.5898  56.1899          ?        ?      856.1        3.3       ?       ? 
1 1 1   18    2   40 o   1145.4    4.1    0.0000   0.0000          ?        ? 13120.9805  93.2242          ?        ?     1145.4        4.1       ?       ? 
1 1 1   18    2   41 o    853.2    3.4    0.0000   0.0000          ?        ?  7279.7847  57.4669          ?        ?      853.2        3.4       ?       ? 
1 1 1   18    2   42 o    939.4    3.6    0.0000   0.0000          ?        ?  8825.6455  67.0448          ?        ?      939.4        3.6       ?       ? 
1 1 1   18    2   43 o   1577.0    5.3    0.0000   0.0000          ?        ? 24874.8867 166.6541          ?        ?     1577.0        5.3       ?       ? 
1 1 1   18    2   44 o    727.5    3.1    0.0000   0.0000          ?        ?  5292.7061  45.3350          ?        ?      727.5        3.1       ?       ? 
1 1 1   18    2   45 o    849.9    3.3    0.0000   0.0000          ?        ?  7224.2339  56.1899          ?        ?      849.9        3.3       ?       ? 
1 1 1   18    2   46 o     72.2   15.1    0.0000   0.0000          ?        ?    54.2743  21.0712          ?        ?       72.2       15.1       ?       ? 
1 1 1   18    2   47 o    444.0    2.7    0.0000   0.0000          ?        ?  1971.1163  23.6253          ?        ?      444.0        2.7       ?       ? 
1 1 1   18    2   48 o    962.3    3.5    0.0000   0.0000          ?        ?  9261.1182  66.4062          ?        ?      962.3        3.5       ?       ? 
1 1 1   18    2   49 o    577.4    2.7    0.0000   0.0000          ?        ?  3333.7212  31.2876          ?        ?      577.4        2.7       ?       ? 
1 1 1   18    2   50 o    173.7    5.7    0.0000   0.0000          ?        ?   302.0207  19.7942          ?        ?      173.7        5.7       ?       ? 
1 1 1   18    2   51 o    182.3    5.4    0.0000   0.0000          ?        ?   332.6698  19.7942          ?        ?      182.3        5.4       ?       ? 
1 1 1   18    2   52 o    343.0    3.1    0.0000   0.0000          ?        ?  1176.7954  21.0712          ?        ?      343.0        3.1       ?       ? 
1 1 1   18    2   53 o    620.1    2.8    0.0000   0.0000          ?        ?  3846.4543  34.4802          ?        ?      620.1        2.8       ?       ? 
1 1 1   18    2   54 o    298.7    3.4    0.0000   0.0000          ?        ?   892.6533  20.4327          ?        ?      298.7        3.4       ?       ? 
1 1 1   18    2   55 o    306.3    3.2    0.0000   0.0000          ?        ?   938.6268  19.7942          ?        ?      306.3        3.2       ?       ? 
1 1 1   18    2   56 o    326.3    3.1    0.0000   0.0000          ?        ?  1065.0541  20.4327          ?        ?      326.3        3.1       ?       ? 
1 1 1   18    2   57 o    368.5    2.9    0.0000   0.0000          ?        ?  1358.1355  21.7097          ?        ?      368.5        2.9       ?       ? 
1 1 1   18    2   58 o    196.8    5.0    0.0000   0.0000          ?        ?   387.5826  19.7942          ?        ?      196.8        5.0       ?       ? 
1 1 1   18    2   59 o    234.8    4.4    0.0000   0.0000          ?        ?   551.6827  20.4327          ?        ?      234.8        4.4       ?       ? 
1 1 1   18    2   60 o    201.9    4.7    0.0000   0.0000          ?        ?   408.0153  19.1556          ?        ?      201.9        4.7       ?       ? 
1 1 1   18    2   61 o    397.7    3.0    0.0000   0.0000          ?        ?  1582.2566  23.6253          ?        ?      397.7        3.0       ?       ? 
1 1 1   18    2   62 o    209.3    4.7    0.0000   0.0000          ?        ?   438.6643  19.7942          ?        ?      209.3        4.7       ?       ? 
1 1 1   18    2   63 o    241.7    4.1    0.0000   0.0000          ?        ?   584.8858  19.7942          ?        ?      241.7        4.1       ?       ? 
1 1 1   18    2   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    2   65 f     91.9   10.4    0.0000   0.0000          ?        ?    84.9234  19.1556          ?        ?       91.9       10.4       ?       ? 
1 1 1   18    2   66 o    105.4    9.4    0.0000   0.0000          ?        ?   111.7413  19.7942          ?        ?      105.4        9.4       ?       ? 
1 1 1   18    2   67 o    235.9    4.5    0.0000   0.0000          ?        ?   557.4294  21.0712          ?        ?      235.9        4.5       ?       ? 
1 1 1   18    2   68 o    365.9    3.2    0.0000   0.0000          ?        ?  1339.6184  23.6253          ?        ?      365.9        3.2       ?       ? 
1 1 1   18    2   69 o     85.2   12.0    0.0000   0.0000          ?        ?    73.4300  20.4327          ?        ?       85.2       12.0       ?       ? 
1 1 1   18    2   70 o    159.7    6.8    0.0000   0.0000          ?        ?   256.0471  21.7097          ?        ?      159.7        6.8       ?       ? 
1 1 1   18    2   71 o     76.7   15.1    0.0000   0.0000          ?        ?    61.9366  22.3483          ?        ?       76.7       15.1       ?       ? 
1 1 1   18    2   72 o    234.2    4.8    0.0000   0.0000          ?        ?   549.7671  22.3483          ?        ?      234.2        4.8       ?       ? 
1 1 1   18    2   73 o     72.7   15.4    0.0000   0.0000          ?        ?    56.1899  21.7097          ?        ?       72.7       15.4       ?       ? 
1 1 1   18    2   74 o     55.9   17.2    0.0000   0.0000          ?        ?    32.5646  21.0712          ?        ?       55.9       17.2       ?       ? 
1 1 1   18    2   75 o    151.5    7.2    0.0000   0.0000          ?        ?   231.1448  21.7097          ?        ?      151.5        7.2       ?       ? 
1 1 1   18    2   76 o     29.5   14.1    0.0000   0.0000          ?        ?   -28.7335  22.9868          ?        ?       29.5       14.1       ?       ? 
1 1 1   18    2   77 o    153.1    6.9    0.0000   0.0000          ?        ?   236.2530  21.0712          ?        ?      153.1        6.9       ?       ? 
1 1 1   18    2   78 o     52.4   17.3    0.0000   0.0000          ?        ?    28.0950  21.0712          ?        ?       52.4       17.3       ?       ? 
1 1 1   18    2   79 o    133.1    7.7    0.0000   0.0000          ?        ?   179.4246  20.4327          ?        ?      133.1        7.7       ?       ? 
1 1 1   18    3    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    3    1 o    462.4    1.9    0.0000   0.0000          ?        ?  2137.7703  17.8786          ?        ?      462.4        1.9       ?       ? 
1 1 1   18    3    2 o   1300.1    4.4    0.0000   0.0000          ?        ? 16904.2207 114.2954          ?        ?     1300.1        4.4       ?       ? 
1 1 1   18    3    3 o    535.1    2.1    0.0000   0.0000          ?        ?  2863.7695  22.3483          ?        ?      535.1        2.1       ?       ? 
1 1 1   18    3    4 o    881.0    3.1    0.0000   0.0000          ?        ?  7761.2305  54.2743          ?        ?      881.0        3.1       ?       ? 
1 1 1   18    3    5 o    428.8    1.8    0.0000   0.0000          ?        ?  1838.9423  15.3245          ?        ?      428.8        1.8       ?       ? 
1 1 1   18    3    6 o   1268.5    4.3    0.0000   0.0000          ?        ? 16092.6611 108.5487          ?        ?     1268.5        4.3       ?       ? 
1 1 1   18    3    7 o    376.4    1.8    0.0000   0.0000          ?        ?  1416.8794  13.4090          ?        ?      376.4        1.8       ?       ? 
1 1 1   18    3    8 f    484.6    2.0    0.0000   0.0000          ?        ?  2348.4824  19.1556          ?        ?      484.6        2.0       ?       ? 
1 1 1   18    3    9 o    731.2    2.7    0.0000   0.0000          ?        ?  5346.9805  38.9498          ?        ?      731.2        2.7       ?       ? 
1 1 1   18    3   10 o    668.2    2.5    0.0000   0.0000          ?        ?  4465.1816  33.2031          ?        ?      668.2        2.5       ?       ? 
1 1 1   18    3   11 o    485.5    2.0    0.0000   0.0000          ?        ?  2356.7834  19.1556          ?        ?      485.5        2.0       ?       ? 
1 1 1   18    3   12 o   1082.0    3.7    0.0000   0.0000          ?        ? 11707.2939  79.8152          ?        ?     1082.0        3.7       ?       ? 
1 1 1   18    3   13 o    627.6    2.4    0.0000   0.0000          ?        ?  3938.4014  30.6490          ?        ?      627.6        2.4       ?       ? 
1 1 1   18    3   14 o    620.4    2.3    0.0000   0.0000          ?        ?  3849.6470  28.7335          ?        ?      620.4        2.3       ?       ? 
1 1 1   18    3   15 o    962.5    3.4    0.0000   0.0000          ?        ?  9264.3105  64.4907          ?        ?      962.5        3.4       ?       ? 
1 1 1   18    3   16 o   1187.7    4.0    0.0000   0.0000          ?        ? 14107.4961  95.7782          ?        ?     1187.7        4.0       ?       ? 
1 1 1   18    3   17 o    333.9    1.8    0.0000   0.0000          ?        ?  1114.8588  12.1319          ?        ?      333.9        1.8       ?       ? 
1 1 1   18    3   18 o   1144.6    3.9    0.0000   0.0000          ?        ? 13101.8242  90.0316          ?        ?     1144.6        3.9       ?       ? 
1 1 1   18    3   19 o    489.1    2.2    0.0000   0.0000          ?        ?  2392.5405  21.0712          ?        ?      489.1        2.2       ?       ? 
1 1 1   18    3   20 o     21.5    9.7    0.0000   0.0000          ?        ?    -5.1082   8.9393          ?        ?       21.5        9.7       ?       ? 
1 1 1   18    3   21 f    173.0    3.0    0.0000   0.0000          ?        ?   299.4666  10.2163          ?        ?      173.0        3.0       ?       ? 
1 1 1   18    3   22 o    546.0    2.3    0.0000   0.0000          ?        ?  2981.2573  25.5409          ?        ?      546.0        2.3       ?       ? 
1 1 1   18    3   23 o   1289.3    4.4    0.0000   0.0000          ?        ? 16623.9102 113.0183          ?        ?     1289.3        4.4       ?       ? 
1 1 1   18    3   24 o   1332.2    4.5    0.0000   0.0000          ?        ? 17748.3477 120.0421          ?        ?     1332.2        4.5       ?       ? 
1 1 1   18    3   25 o    776.8    3.0    0.0000   0.0000          ?        ?  6034.0293  46.6121          ?        ?      776.8        3.0       ?       ? 
1 1 1   18    3   26 o    428.7    2.2    0.0000   0.0000          ?        ?  1837.6652  18.5171          ?        ?      428.7        2.2       ?       ? 
1 1 1   18    3   27 o    669.0    2.7    0.0000   0.0000          ?        ?  4475.3984  35.7572          ?        ?      669.0        2.7       ?       ? 
1 1 1   18    3   28 o    745.7    2.9    0.0000   0.0000          ?        ?  5560.2461  42.7809          ?        ?      745.7        2.9       ?       ? 
1 1 1   18    3   29 o    432.5    2.4    0.0000   0.0000          ?        ?  1870.8684  20.4327          ?        ?      432.5        2.4       ?       ? 
1 1 1   18    3   30 o    314.6    2.3    0.0000   0.0000          ?        ?   989.7085  14.6860          ?        ?      314.6        2.3       ?       ? 
1 1 1   18    3   31 o   1274.6    4.6    0.0000   0.0000          ?        ? 16247.8223 117.4880          ?        ?     1274.6        4.6       ?       ? 
1 1 1   18    3   32 o    263.7    3.0    0.0000   0.0000          ?        ?   695.3500  15.9630          ?        ?      263.7        3.0       ?       ? 
1 1 1   18    3   33 o   1271.1    4.4    0.0000   0.0000          ?        ? 16157.1504 113.0183          ?        ?     1271.1        4.4       ?       ? 
1 1 1   18    3   34 o    615.6    2.8    0.0000   0.0000          ?        ?  3790.2642  34.4802          ?        ?      615.6        2.8       ?       ? 
1 1 1   18    3   35 o    818.2    3.2    0.0000   0.0000          ?        ?  6694.8994  51.7203          ?        ?      818.2        3.2       ?       ? 
1 1 1   18    3   36 o    780.5    3.1    0.0000   0.0000          ?        ?  6091.4961  47.8891          ?        ?      780.5        3.1       ?       ? 
1 1 1   18    3   37 o    515.8    2.5    0.0000   0.0000          ?        ?  2660.0811  26.1794          ?        ?      515.8        2.5       ?       ? 
1 1 1   18    3   38 o    437.3    2.6    0.0000   0.0000          ?        ?  1912.3723  22.3483          ?        ?      437.3        2.6       ?       ? 
1 1 1   18    3   39 o   1303.9    4.6    0.0000   0.0000          ?        ? 17003.1914 118.7650          ?        ?     1303.9        4.6       ?       ? 
1 1 1   18    3   40 o   1038.3    3.7    0.0000   0.0000          ?        ? 10781.4375  76.6226          ?        ?     1038.3        3.7       ?       ? 
1 1 1   18    3   41 o    519.0    2.7    0.0000   0.0000          ?        ?  2693.9226  28.0950          ?        ?      519.0        2.7       ?       ? 
1 1 1   18    3   42 o     51.9   17.6    0.0000   0.0000          ?        ?    24.9023  21.7097          ?        ?       51.9       17.6       ?       ? 
1 1 1   18    3   43 f    402.2    3.0    0.0000   0.0000          ?        ?  1618.0138  24.2638          ?        ?      402.2        3.0       ?       ? 
1 1 1   18    3   44 o    478.2    2.7    0.0000   0.0000          ?        ?  2286.5459  25.5409          ?        ?      478.2        2.7       ?       ? 
1 1 1   18    3   45 o   1060.2    3.9    0.0000   0.0000          ?        ? 11243.0889  83.0078          ?        ?     1060.2        3.9       ?       ? 
1 1 1   18    3   46 o    391.8    3.0    0.0000   0.0000          ?        ?  1535.0060  23.6253          ?        ?      391.8        3.0       ?       ? 
1 1 1   18    3   47 o   1074.3    3.9    0.0000   0.0000          ?        ? 11544.4707  83.6463          ?        ?     1074.3        3.9       ?       ? 
1 1 1   18    3   48 o     68.6   15.7    0.0000   0.0000          ?        ?    49.1662  21.0712          ?        ?       68.6       15.7       ?       ? 
1 1 1   18    3   49 o    608.2    2.8    0.0000   0.0000          ?        ?  3698.9558  33.8416          ?        ?      608.2        2.8       ?       ? 
1 1 1   18    3   50 o    512.9    2.7    0.0000   0.0000          ?        ?  2630.7090  28.0950          ?        ?      512.9        2.7       ?       ? 
1 1 1   18    3   51 o    253.9    3.9    0.0000   0.0000          ?        ?   644.9069  19.7942          ?        ?      253.9        3.9       ?       ? 
1 1 1   18    3   52 o    297.0    3.3    0.0000   0.0000          ?        ?   882.4369  19.7942          ?        ?      297.0        3.3       ?       ? 
1 1 1   18    3   53 o    201.9    4.7    0.0000   0.0000          ?        ?   408.0153  19.1556          ?        ?      201.9        4.7       ?       ? 
1 1 1   18    3   54 o    385.6    2.8    0.0000   0.0000          ?        ?  1487.1168  21.7097          ?        ?      385.6        2.8       ?       ? 
1 1 1   18    3   55 o     33.4   14.9    0.0000   0.0000          ?        ?    -8.9393  20.4327          ?        ?       33.4       14.9       ?       ? 
1 1 1   18    3   56 o    490.1    2.7    0.0000   0.0000          ?        ?  2402.1184  26.1794          ?        ?      490.1        2.7       ?       ? 
1 1 1   18    3   57 o    542.7    2.6    0.0000   0.0000          ?        ?  2945.5002  28.0950          ?        ?      542.7        2.6       ?       ? 
1 1 1   18    3   58 o    110.9    8.6    0.0000   0.0000          ?        ?   123.2347  19.1556          ?        ?      110.9        8.6       ?       ? 
1 1 1   18    3   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    3   60 o    331.1    3.2    0.0000   0.0000          ?        ?  1096.9802  21.0712          ?        ?      331.1        3.2       ?       ? 
1 1 1   18    3   61 o    368.3    3.0    0.0000   0.0000          ?        ?  1356.8584  22.3483          ?        ?      368.3        3.0       ?       ? 
1 1 1   18    3   62 o    209.0    4.7    0.0000   0.0000          ?        ?   437.3873  19.7942          ?        ?      209.0        4.7       ?       ? 
1 1 1   18    3   63 o    284.5    3.7    0.0000   0.0000          ?        ?   810.2839  21.0712          ?        ?      284.5        3.7       ?       ? 
1 1 1   18    3   64 o    120.2    8.2    0.0000   0.0000          ?        ?   144.9444  19.7942          ?        ?      120.2        8.2       ?       ? 
1 1 1   18    3   65 o    114.7    8.9    0.0000   0.0000          ?        ?   132.1740  20.4327          ?        ?      114.7        8.9       ?       ? 
1 1 1   18    3   66 o     19.6    9.9    0.0000   0.0000          ?        ?   -71.5144  19.7942          ?        ?       19.6        9.9       ?       ? 
1 1 1   18    3   67 o     28.5   13.6    0.0000   0.0000          ?        ?   -26.1794  21.0712          ?        ?       28.5       13.6       ?       ? 
1 1 1   18    3   68 o    341.3    3.6    0.0000   0.0000          ?        ?  1165.9406  24.2638          ?        ?      341.3        3.6       ?       ? 
1 1 1   18    3   69 o     41.1   16.7    0.0000   0.0000          ?        ?     7.0237  21.7097          ?        ?       41.1       16.7       ?       ? 
1 1 1   18    3   70 f     47.3   17.4    0.0000   0.0000          ?        ?    18.5171  21.7097          ?        ?       47.3       17.4       ?       ? 
1 1 1   18    3   71 f    256.7    4.2    0.0000   0.0000          ?        ?   660.2314  21.7097          ?        ?      256.7        4.2       ?       ? 
1 1 1   18    3   72 o     66.1   16.1    0.0000   0.0000          ?        ?    46.6121  21.0712          ?        ?       66.1       16.1       ?       ? 
1 1 1   18    3   73 o     85.3   12.7    0.0000   0.0000          ?        ?    74.0685  21.7097          ?        ?       85.3       12.7       ?       ? 
1 1 1   18    3   74 o    138.4    7.6    0.0000   0.0000          ?        ?   192.8335  21.0712          ?        ?      138.4        7.6       ?       ? 
1 1 1   18    3   75 o     44.0   16.9    0.0000   0.0000          ?        ?    14.0475  21.0712          ?        ?       44.0       16.9       ?       ? 
1 1 1   18    3   76 o     48.0   17.5    0.0000   0.0000          ?        ?    20.4327  21.7097          ?        ?       48.0       17.5       ?       ? 
1 1 1   18    3   77 o     47.8   16.7    0.0000   0.0000          ?        ?    21.7097  19.7942          ?        ?       47.8       16.7       ?       ? 
1 1 1   18    3   78 o     27.8   13.4    0.0000   0.0000          ?        ?   -33.2031  22.3483          ?        ?       27.8       13.4       ?       ? 
1 1 1   18    3   79 o    130.0    7.9    0.0000   0.0000          ?        ?   171.1238  20.4327          ?        ?      130.0        7.9       ?       ? 
1 1 1   18    4    0 f    549.2    3.1 3017.0146  33.8416  3017.0146  33.8416  3017.0146  33.8416      549.2      3.1      549.2        3.1     0.0     0.0 
1 1 1   18    4    1 o    759.6    2.8    0.0000   0.0000          ?        ?  5770.3198  42.1424          ?        ?      759.6        2.8       ?       ? 
1 1 1   18    4    2 o    883.0    3.1    0.0000   0.0000          ?        ?  7797.6260  54.9129          ?        ?      883.0        3.1       ?       ? 
1 1 1   18    4    3 o   1004.3    3.5    0.0000   0.0000          ?        ? 10086.0879  69.5989          ?        ?     1004.3        3.5       ?       ? 
1 1 1   18    4    4 o    322.3    1.6    0.0000   0.0000          ?        ?  1038.8746  10.2163          ?        ?      322.3        1.6       ?       ? 
1 1 1   18    4    5 o    283.6    1.6    0.0000   0.0000          ?        ?   804.5372   8.9393          ?        ?      283.6        1.6       ?       ? 
1 1 1   18    4    6 f    437.6    1.8    0.0000   0.0000          ?        ?  1914.9263  15.9630          ?        ?      437.6        1.8       ?       ? 
1 1 1   18    4    7 f   1375.2    4.6    0.0000   0.0000          ?        ? 18914.2871 125.7888          ?        ?     1375.2        4.6       ?       ? 
1 1 1   18    4    8 o   1284.9    4.2    0.0000   0.0000          ?        ? 16510.2539 109.1872          ?        ?     1284.9        4.2       ?       ? 
1 1 1   18    4    9 o    807.9    2.9    0.0000   0.0000          ?        ?  6526.9683  47.2506          ?        ?      807.9        2.9       ?       ? 
1 1 1   18    4   10 o    812.1    2.9    0.0000   0.0000          ?        ?  6595.9282  46.6121          ?        ?      812.1        2.9       ?       ? 
1 1 1   18    4   11 f    956.6    3.4    0.0000   0.0000          ?        ?  9151.2920  64.4907          ?        ?      956.6        3.4       ?       ? 
1 1 1   18    4   12 o    802.4    2.9    0.0000   0.0000          ?        ?  6438.8521  46.6121          ?        ?      802.4        2.9       ?       ? 
1 1 1   18    4   13 o    923.0    3.3    0.0000   0.0000          ?        ?  8520.4326  60.0210          ?        ?      923.0        3.3       ?       ? 
1 1 1   18    4   14 f    393.0    1.8    0.0000   0.0000          ?        ?  1544.5837  14.0475          ?        ?      393.0        1.8       ?       ? 
1 1 1   18    4   15 o   1330.7    4.5    0.0000   0.0000          ?        ? 17710.0371 118.7650          ?        ?     1330.7        4.5       ?       ? 
1 1 1   18    4   16 o   1072.9    3.7    0.0000   0.0000          ?        ? 11511.9062  79.8152          ?        ?     1072.9        3.7       ?       ? 
1 1 1   18    4   17 o    840.3    3.0    0.0000   0.0000          ?        ?  7061.4106  51.0817          ?        ?      840.3        3.0       ?       ? 
1 1 1   18    4   18 o    900.2    3.3    0.0000   0.0000          ?        ?  8104.7554  60.0210          ?        ?      900.2        3.3       ?       ? 
1 1 1   18    4   19 o   1023.7    3.6    0.0000   0.0000          ?        ? 10480.0557  74.0685          ?        ?     1023.7        3.6       ?       ? 
1 1 1   18    4   20 o    255.5    2.2    0.0000   0.0000          ?        ?   652.5691  11.4934          ?        ?      255.5        2.2       ?       ? 
1 1 1   18    4   21 o   1905.8    6.4    0.0000   0.0000          ?        ? 36325.4961 242.6382          ?        ?     1905.8        6.4       ?       ? 
1 1 1   18    4   22 o   1096.0    3.8    0.0000   0.0000          ?        ? 12013.7842  83.6463          ?        ?     1096.0        3.8       ?       ? 
1 1 1   18    4   23 o    996.5    3.5    0.0000   0.0000          ?        ?  9930.9268  70.2374          ?        ?      996.5        3.5       ?       ? 
1 1 1   18    4   24 o   1795.3    6.3    0.0000   0.0000          ?        ? 32233.2109 227.3137          ?        ?     1795.3        6.3       ?       ? 
1 1 1   18    4   25 o   1438.5    5.0    0.0000   0.0000          ?        ? 20695.7617 143.6674          ?        ?     1438.5        5.0       ?       ? 
1 1 1   18    4   26 o   1402.7    4.8    0.0000   0.0000          ?        ? 19676.6836 134.7281          ?        ?     1402.7        4.8       ?       ? 
1 1 1   18    4   27 o    421.8    2.6    0.0000   0.0000          ?        ?  1778.9213  21.7097          ?        ?      421.8        2.6       ?       ? 
1 1 1   18    4   28 o    261.7    2.7    0.0000   0.0000          ?        ?   685.1337  14.0475          ?        ?      261.7        2.7       ?       ? 
1 1 1   18    4   29 o    518.2    2.5    0.0000   0.0000          ?        ?  2684.9834  26.1794          ?        ?      518.2        2.5       ?       ? 
1 1 1   18    4   30 o    798.9    3.3    0.0000   0.0000          ?        ?  6382.0234  52.3588          ?        ?      798.9        3.3       ?       ? 
1 1 1   18    4   31 o    975.7    3.5    0.0000   0.0000          ?        ?  9519.7188  68.3218          ?        ?      975.7        3.5       ?       ? 
1 1 1   18    4   32 o    594.7    2.6    0.0000   0.0000          ?        ?  3536.7715  31.2876          ?        ?      594.7        2.6       ?       ? 
1 1 1   18    4   33 o    747.2    3.1    0.0000   0.0000          ?        ?  5583.8716  46.6121          ?        ?      747.2        3.1       ?       ? 
1 1 1   18    4   34 o    932.5    3.5    0.0000   0.0000          ?        ?  8696.6650  64.4907          ?        ?      932.5        3.5       ?       ? 
1 1 1   18    4   35 o    885.5    3.5    0.0000   0.0000          ?        ?  7842.3223  62.5751          ?        ?      885.5        3.5       ?       ? 
1 1 1   18    4   36 o    715.5    2.9    0.0000   0.0000          ?        ?  5120.3052  40.8654          ?        ?      715.5        2.9       ?       ? 
1 1 1   18    4   37 o    788.6    3.0    0.0000   0.0000          ?        ?  6218.5625  47.2506          ?        ?      788.6        3.0       ?       ? 
1 1 1   18    4   38 o    490.6    2.5    0.0000   0.0000          ?        ?  2406.5879  24.9023          ?        ?      490.6        2.5       ?       ? 
1 1 1   18    4   39 o    420.9    2.7    0.0000   0.0000          ?        ?  1771.8975  22.3483          ?        ?      420.9        2.7       ?       ? 
1 1 1   18    4   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    4   41 o   1028.2    3.7    0.0000   0.0000          ?        ? 10572.6416  75.3456          ?        ?     1028.2        3.7       ?       ? 
1 1 1   18    4   42 o   1281.7    4.4    0.0000   0.0000          ?        ? 16430.4375 112.3798          ?        ?     1281.7        4.4       ?       ? 
1 1 1   18    4   43 o    599.8    2.8    0.0000   0.0000          ?        ?  3597.4309  33.2031          ?        ?      599.8        2.8       ?       ? 
1 1 1   18    4   44 o    848.7    3.3    0.0000   0.0000          ?        ?  7203.1621  56.1899          ?        ?      848.7        3.3       ?       ? 
1 1 1   18    4   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    4   46 o    476.2    2.7    0.0000   0.0000          ?        ?  2267.3904  25.5409          ?        ?      476.2        2.7       ?       ? 
1 1 1   18    4   47 o    710.3    2.9    0.0000   0.0000          ?        ?  5045.5981  40.8654          ?        ?      710.3        2.9       ?       ? 
1 1 1   18    4   48 o    448.0    2.8    0.0000   0.0000          ?        ?  2007.5120  24.9023          ?        ?      448.0        2.8       ?       ? 
1 1 1   18    4   49 o    203.2    4.7    0.0000   0.0000          ?        ?   413.1235  19.1556          ?        ?      203.2        4.7       ?       ? 
1 1 1   18    4   50 o    202.9    4.2    0.0000   0.0000          ?        ?   411.8464  17.2401          ?        ?      202.9        4.2       ?       ? 
1 1 1   18    4   51 o    175.7    5.1    0.0000   0.0000          ?        ?   309.0445  17.8786          ?        ?      175.7        5.1       ?       ? 
1 1 1   18    4   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    4   53 o    421.2    2.7    0.0000   0.0000          ?        ?  1774.4515  22.9868          ?        ?      421.2        2.7       ?       ? 
1 1 1   18    4   54 o    580.5    2.8    0.0000   0.0000          ?        ?  3370.1172  31.9261          ?        ?      580.5        2.8       ?       ? 
1 1 1   18    4   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    4   56 o    414.5    2.8    0.0000   0.0000          ?        ?  1718.9003  22.9868          ?        ?      414.5        2.8       ?       ? 
1 1 1   18    4   57 o    333.1    3.2    0.0000   0.0000          ?        ?  1109.7506  21.0712          ?        ?      333.1        3.2       ?       ? 
1 1 1   18    4   58 o    426.8    2.8    0.0000   0.0000          ?        ?  1821.7021  24.2638          ?        ?      426.8        2.8       ?       ? 
1 1 1   18    4   59 o    202.7    4.9    0.0000   0.0000          ?        ?   411.2079  19.7942          ?        ?      202.7        4.9       ?       ? 
1 1 1   18    4   60 f    409.3    3.0    0.0000   0.0000          ?        ?  1676.1193  24.2638          ?        ?      409.3        3.0       ?       ? 
1 1 1   18    4   61 f     29.1   13.4    0.0000   0.0000          ?        ?   -13.4090  17.8786          ?        ?       29.1       13.4       ?       ? 
1 1 1   18    4   62 o     87.3   11.0    0.0000   0.0000          ?        ?    76.6226  19.1556          ?        ?       87.3       11.0       ?       ? 
1 1 1   18    4   63 o     19.1    9.7    0.0000   0.0000          ?        ?   -70.2374  19.1556          ?        ?       19.1        9.7       ?       ? 
1 1 1   18    4   64 f    309.0    3.4    0.0000   0.0000          ?        ?   955.2284  21.0712          ?        ?      309.0        3.4       ?       ? 
1 1 1   18    4   65 o     25.2   12.3    0.0000   0.0000          ?        ?   -35.1187  19.7942          ?        ?       25.2       12.3       ?       ? 
1 1 1   18    4   66 o    100.2    9.6    0.0000   0.0000          ?        ?   100.8864  19.1556          ?        ?      100.2        9.6       ?       ? 
1 1 1   18    4   67 o    204.5    5.2    0.0000   0.0000          ?        ?   418.8702  21.0712          ?        ?      204.5        5.2       ?       ? 
1 1 1   18    4   68 o    198.0    5.2    0.0000   0.0000          ?        ?   392.6908  20.4327          ?        ?      198.0        5.2       ?       ? 
1 1 1   18    4   69 o     24.6   12.1    0.0000   0.0000          ?        ?   -47.8891  21.7097          ?        ?       24.6       12.1       ?       ? 
1 1 1   18    4   70 o    357.1    3.4    0.0000   0.0000          ?        ?  1276.4047  24.2638          ?        ?      357.1        3.4       ?       ? 
1 1 1   18    4   71 o    227.2    4.8    0.0000   0.0000          ?        ?   517.2025  21.7097          ?        ?      227.2        4.8       ?       ? 
1 1 1   18    4   72 o     20.2   10.2    0.0000   0.0000          ?        ?   -75.9841  21.0712          ?        ?       20.2       10.2       ?       ? 
1 1 1   18    4   73 o    172.5    6.1    0.0000   0.0000          ?        ?   298.8281  21.0712          ?        ?      172.5        6.1       ?       ? 
1 1 1   18    4   74 f     30.3   14.1    0.0000   0.0000          ?        ?   -19.1556  21.0712          ?        ?       30.3       14.1       ?       ? 
1 1 1   18    4   75 o     61.3   16.7    0.0000   0.0000          ?        ?    40.2269  21.0712          ?        ?       61.3       16.7       ?       ? 
1 1 1   18    4   76 o    277.9    4.3    0.0000   0.0000          ?        ?   774.5267  23.6253          ?        ?      277.9        4.3       ?       ? 
1 1 1   18    4   77 o     89.6   12.5    0.0000   0.0000          ?        ?    82.3693  22.3483          ?        ?       89.6       12.5       ?       ? 
1 1 1   18    4   78 f    145.8    6.8    0.0000   0.0000          ?        ?   214.5433  19.7942          ?        ?      145.8        6.8       ?       ? 
1 1 1   18    5    0 o    221.7    2.2  491.6617   9.5778   491.6617   9.5778   491.6617   9.5778      221.7      2.2      221.7        2.2     0.0     0.0 
1 1 1   18    5    1 o   1230.5    4.2    0.0000   0.0000          ?        ? 15142.5400 102.8020          ?        ?     1230.5        4.2       ?       ? 
1 1 1   18    5    2 o    913.4    3.2    0.0000   0.0000          ?        ?  8342.9238  58.7440          ?        ?      913.4        3.2       ?       ? 
1 1 1   18    5    3 o    497.2    2.1    0.0000   0.0000          ?        ?  2471.7173  20.4327          ?        ?      497.2        2.1       ?       ? 
1 1 1   18    5    4 o    297.6    1.6    0.0000   0.0000          ?        ?   885.6295   9.5778          ?        ?      297.6        1.6       ?       ? 
1 1 1   18    5    5 o    531.8    2.1    0.0000   0.0000          ?        ?  2828.6509  22.3483          ?        ?      531.8        2.1       ?       ? 
1 1 1   18    5    6 o    407.4    1.9    0.0000   0.0000          ?        ?  1659.5177  15.3245          ?        ?      407.4        1.9       ?       ? 
1 1 1   18    5    7 o    393.7    1.8    0.0000   0.0000          ?        ?  1550.3306  14.0475          ?        ?      393.7        1.8       ?       ? 
1 1 1   18    5    8 o   1166.1    4.0    0.0000   0.0000          ?        ? 13598.5947  92.5856          ?        ?     1166.1        4.0       ?       ? 
1 1 1   18    5    9 f    572.0    2.2    0.0000   0.0000          ?        ?  3272.4233  25.5409          ?        ?      572.0        2.2       ?       ? 
1 1 1   18    5   10 o    172.1    2.0    0.0000   0.0000          ?        ?   296.2740   7.0237          ?        ?      172.1        2.0       ?       ? 
1 1 1   18    5   11 o   1127.5    3.9    0.0000   0.0000          ?        ? 12714.2422  86.8389          ?        ?     1127.5        3.9       ?       ? 
1 1 1   18    5   12 o    838.1    3.0    0.0000   0.0000          ?        ?  7024.3765  49.8047          ?        ?      838.1        3.0       ?       ? 
1 1 1   18    5   13 o    423.1    1.9    0.0000   0.0000          ?        ?  1789.7760  15.9630          ?        ?      423.1        1.9       ?       ? 
1 1 1   18    5   14 o   1364.7    4.6    0.0000   0.0000          ?        ? 18625.6758 125.1502          ?        ?     1364.7        4.6       ?       ? 
1 1 1   18    5   15 o    555.5    2.2    0.0000   0.0000          ?        ?  3085.3367  24.9023          ?        ?      555.5        2.2       ?       ? 
1 1 1   18    5   16 o   1050.8    3.6    0.0000   0.0000          ?        ? 11041.9551  76.6226          ?        ?     1050.8        3.6       ?       ? 
1 1 1   18    5   17 o   1363.6    4.7    0.0000   0.0000          ?        ? 18595.6660 127.7043          ?        ?     1363.6        4.7       ?       ? 
1 1 1   18    5   18 o   1639.3    5.4    0.0000   0.0000          ?        ? 26877.2891 177.5090          ?        ?     1639.3        5.4       ?       ? 
1 1 1   18    5   19 o    939.3    3.5    0.0000   0.0000          ?        ?  8823.0918  65.1292          ?        ?      939.3        3.5       ?       ? 
1 1 1   18    5   20 o   1072.7    3.7    0.0000   0.0000          ?        ? 11508.0752  80.4537          ?        ?     1072.7        3.7       ?       ? 
1 1 1   18    5   21 o    188.4    3.4    0.0000   0.0000          ?        ?   355.0180  12.7704          ?        ?      188.4        3.4       ?       ? 
1 1 1   18    5   22 o   1041.4    3.7    0.0000   0.0000          ?        ? 10845.9277  76.6226          ?        ?     1041.4        3.7       ?       ? 
1 1 1   18    5   23 o   1150.7    4.1    0.0000   0.0000          ?        ? 13242.2998  94.5012          ?        ?     1150.7        4.1       ?       ? 
1 1 1   18    5   24 o   1188.5    4.2    0.0000   0.0000          ?        ? 14126.0146  98.9709          ?        ?     1188.5        4.2       ?       ? 
1 1 1   18    5   25 o   1129.5    4.0    0.0000   0.0000          ?        ? 12758.9385  90.6701          ?        ?     1129.5        4.0       ?       ? 
1 1 1   18    5   26 o    646.6    2.5    0.0000   0.0000          ?        ?  4181.0396  32.5646          ?        ?      646.6        2.5       ?       ? 
1 1 1   18    5   27 o    544.5    2.5    0.0000   0.0000          ?        ?  2964.6558  27.4564          ?        ?      544.5        2.5       ?       ? 
1 1 1   18    5   28 o    825.9    3.1    0.0000   0.0000          ?        ?  6821.3267  51.0817          ?        ?      825.9        3.1       ?       ? 
1 1 1   18    5   29 o    698.8    2.9    0.0000   0.0000          ?        ?  4884.0522  40.8654          ?        ?      698.8        2.9       ?       ? 
1 1 1   18    5   30 f   1361.1    4.9    0.0000   0.0000          ?        ? 18527.3438 132.1740          ?        ?     1361.1        4.9       ?       ? 
1 1 1   18    5   31 o    647.7    2.7    0.0000   0.0000          ?        ?  4195.0869  35.1187          ?        ?      647.7        2.7       ?       ? 
1 1 1   18    5   32 o   1734.9    6.1    0.0000   0.0000          ?        ? 30104.3809 210.0736          ?        ?     1734.9        6.1       ?       ? 
1 1 1   18    5   33 o    894.2    3.5    0.0000   0.0000          ?        ?  7995.5674  61.9366          ?        ?      894.2        3.5       ?       ? 
1 1 1   18    5   34 o    759.8    3.0    0.0000   0.0000          ?        ?  5772.8740  45.9736          ?        ?      759.8        3.0       ?       ? 
1 1 1   18    5   35 o    917.1    3.4    0.0000   0.0000          ?        ?  8411.8838  62.5751          ?        ?      917.1        3.4       ?       ? 
1 1 1   18    5   36 o   1309.4    4.5    0.0000   0.0000          ?        ? 17147.4980 118.7650          ?        ?     1309.4        4.5       ?       ? 
1 1 1   18    5   37 o    267.9    3.5    0.0000   0.0000          ?        ?   717.6983  18.5171          ?        ?      267.9        3.5       ?       ? 
1 1 1   18    5   38 o    787.3    3.0    0.0000   0.0000          ?        ?  6198.1294  47.2506          ?        ?      787.3        3.0       ?       ? 
1 1 1   18    5   39 o    579.8    2.9    0.0000   0.0000          ?        ?  3361.8164  33.8416          ?        ?      579.8        2.9       ?       ? 
1 1 1   18    5   40 o    642.3    2.8    0.0000   0.0000          ?        ?  4125.4883  36.3957          ?        ?      642.3        2.8       ?       ? 
1 1 1   18    5   41 o    713.7    2.9    0.0000   0.0000          ?        ?  5093.4873  41.5039          ?        ?      713.7        2.9       ?       ? 
1 1 1   18    5   42 o    734.3    3.0    0.0000   0.0000          ?        ?  5391.6768  43.4195          ?        ?      734.3        3.0       ?       ? 
1 1 1   18    5   43 o    479.8    2.7    0.0000   0.0000          ?        ?  2302.5090  25.5409          ?        ?      479.8        2.7       ?       ? 
1 1 1   18    5   44 o    206.2    5.1    0.0000   0.0000          ?        ?   425.2554  21.0712          ?        ?      206.2        5.1       ?       ? 
1 1 1   18    5   45 o   1147.2    4.1    0.0000   0.0000          ?        ? 13164.4004  94.5012          ?        ?     1147.2        4.1       ?       ? 
1 1 1   18    5   46 o    388.7    3.0    0.0000   0.0000          ?        ?  1511.3806  23.6253          ?        ?      388.7        3.0       ?       ? 
1 1 1   18    5   47 o    461.0    2.7    0.0000   0.0000          ?        ?  2125.0000  24.9023          ?        ?      461.0        2.7       ?       ? 
1 1 1   18    5   48 o    368.5    2.9    0.0000   0.0000          ?        ?  1358.1355  21.0712          ?        ?      368.5        2.9       ?       ? 
1 1 1   18    5   49 o    425.8    2.7    0.0000   0.0000          ?        ?  1813.4014  22.9868          ?        ?      425.8        2.7       ?       ? 
1 1 1   18    5   50 o     57.1   15.3    0.0000   0.0000          ?        ?    33.8416  17.8786          ?        ?       57.1       15.3       ?       ? 
1 1 1   18    5   51 o    397.7    2.7    0.0000   0.0000          ?        ?  1581.6180  21.7097          ?        ?      397.7        2.7       ?       ? 
1 1 1   18    5   52 o    155.5    5.7    0.0000   0.0000          ?        ?   241.9997  17.8786          ?        ?      155.5        5.7       ?       ? 
1 1 1   18    5   53 o    372.6    2.7    0.0000   0.0000          ?        ?  1388.7845  20.4327          ?        ?      372.6        2.7       ?       ? 
1 1 1   18    5   54 o    135.1    6.6    0.0000   0.0000          ?        ?   182.6172  17.8786          ?        ?      135.1        6.6       ?       ? 
1 1 1   18    5   55 o    112.0    8.3    0.0000   0.0000          ?        ?   125.7888  18.5171          ?        ?      112.0        8.3       ?       ? 
1 1 1   18    5   56 o    132.9    6.7    0.0000   0.0000          ?        ?   176.8705  17.8786          ?        ?      132.9        6.7       ?       ? 
1 1 1   18    5   57 o    396.0    2.8    0.0000   0.0000          ?        ?  1568.2091  22.3483          ?        ?      396.0        2.8       ?       ? 
1 1 1   18    5   58 o    409.0    3.1    0.0000   0.0000          ?        ?  1673.5652  25.5409          ?        ?      409.0        3.1       ?       ? 
1 1 1   18    5   59 o    429.8    2.7    0.0000   0.0000          ?        ?  1847.8816  23.6253          ?        ?      429.8        2.7       ?       ? 
1 1 1   18    5   60 o    578.7    2.8    0.0000   0.0000          ?        ?  3349.6843  32.5646          ?        ?      578.7        2.8       ?       ? 
1 1 1   18    5   61 o    175.1    5.3    0.0000   0.0000          ?        ?   307.1289  18.5171          ?        ?      175.1        5.3       ?       ? 
1 1 1   18    5   62 o     50.5   16.5    0.0000   0.0000          ?        ?    24.9023  19.1556          ?        ?       50.5       16.5       ?       ? 
1 1 1   18    5   63 o    183.1    5.2    0.0000   0.0000          ?        ?   335.8624  19.1556          ?        ?      183.1        5.2       ?       ? 
1 1 1   18    5   64 o    560.5    2.8    0.0000   0.0000          ?        ?  3143.4419  31.2876          ?        ?      560.5        2.8       ?       ? 
1 1 1   18    5   65 o    126.4    7.6    0.0000   0.0000          ?        ?   160.2689  19.1556          ?        ?      126.4        7.6       ?       ? 
1 1 1   18    5   66 o    193.6    5.1    0.0000   0.0000          ?        ?   375.4507  19.7942          ?        ?      193.6        5.1       ?       ? 
1 1 1   18    5   67 o    104.1   10.1    0.0000   0.0000          ?        ?   109.1872  21.0712          ?        ?      104.1       10.1       ?       ? 
1 1 1   18    5   68 o    268.1    4.2    0.0000   0.0000          ?        ?   719.6138  22.3483          ?        ?      268.1        4.2       ?       ? 
1 1 1   18    5   69 o    356.7    3.4    0.0000   0.0000          ?        ?  1273.2120  24.2638          ?        ?      356.7        3.4       ?       ? 
1 1 1   18    5   70 o    419.9    3.0    0.0000   0.0000          ?        ?  1764.2352  25.5409          ?        ?      419.9        3.0       ?       ? 
1 1 1   18    5   71 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    5   72 o     38.3   16.3    0.0000   0.0000          ?        ?     1.2770  21.7097          ?        ?       38.3       16.3       ?       ? 
1 1 1   18    5   73 o    315.4    3.5    0.0000   0.0000          ?        ?   996.0938  22.3483          ?        ?      315.4        3.5       ?       ? 
1 1 1   18    5   74 o     46.7   17.4    0.0000   0.0000          ?        ?    17.8786  21.7097          ?        ?       46.7       17.4       ?       ? 
1 1 1   18    5   75 o    163.5    6.4    0.0000   0.0000          ?        ?   268.8176  21.0712          ?        ?      163.5        6.4       ?       ? 
1 1 1   18    5   76 o     71.0   15.7    0.0000   0.0000          ?        ?    54.2743  21.7097          ?        ?       71.0       15.7       ?       ? 
1 1 1   18    5   77 o     37.4   16.0    0.0000   0.0000          ?        ?     1.2770  21.0712          ?        ?       37.4       16.0       ?       ? 
1 1 1   18    5   78 o    246.8    4.1    0.0000   0.0000          ?        ?   611.0652  20.4327          ?        ?      246.8        4.1       ?       ? 
1 1 1   18    6    0 o    476.1    2.7 2267.3904  26.1794  2267.3904  26.1794  2267.3904  26.1794      476.1      2.7      476.1        2.7     0.0     0.0 
1 1 1   18    6    1 o    747.0    2.7    0.0000   0.0000          ?        ?  5580.6792  40.8654          ?        ?      747.0        2.7       ?       ? 
1 1 1   18    6    2 o    271.9    1.5    0.0000   0.0000          ?        ?   739.4081   8.3008          ?        ?      271.9        1.5       ?       ? 
1 1 1   18    6    3 o    635.9    2.4    0.0000   0.0000          ?        ?  4044.3962  30.0105          ?        ?      635.9        2.4       ?       ? 
1 1 1   18    6    4 o   1290.7    4.3    0.0000   0.0000          ?        ? 16660.9453 111.7413          ?        ?     1290.7        4.3       ?       ? 
1 1 1   18    6    5 o    397.0    1.8    0.0000   0.0000          ?        ?  1575.8713  14.0475          ?        ?      397.0        1.8       ?       ? 
1 1 1   18    6    6 o   1173.3    4.0    0.0000   0.0000          ?        ? 13766.5264  93.8627          ?        ?     1173.3        4.0       ?       ? 
1 1 1   18    6    7 o    184.1    1.7    0.0000   0.0000          ?        ?   339.0550   6.3852          ?        ?      184.1        1.7       ?       ? 
1 1 1   18    6    8 f    696.9    2.6    0.0000   0.0000          ?        ?  4857.2339  36.3957          ?        ?      696.9        2.6       ?       ? 
1 1 1   18    6    9 o   1659.1    5.4    0.0000   0.0000          ?        ? 27529.2207 180.7016          ?        ?     1659.1        5.4       ?       ? 
1 1 1   18    6   10 o    395.4    1.8    0.0000   0.0000          ?        ?  1563.7394  14.0475          ?        ?      395.4        1.8       ?       ? 
1 1 1   18    6   11 o    872.0    3.1    0.0000   0.0000          ?        ?  7604.7925  54.2743          ?        ?      872.0        3.1       ?       ? 
1 1 1   18    6   12 o    436.7    2.0    0.0000   0.0000          ?        ?  1907.2642  17.8786          ?        ?      436.7        2.0       ?       ? 
1 1 1   18    6   13 o   1312.6    4.4    0.0000   0.0000          ?        ? 17229.8672 116.2109          ?        ?     1312.6        4.4       ?       ? 
1 1 1   18    6   14 f    913.6    3.2    0.0000   0.0000          ?        ?  8347.3936  59.3825          ?        ?      913.6        3.2       ?       ? 
1 1 1   18    6   15 o    419.9    2.0    0.0000   0.0000          ?        ?  1763.5968  16.6016          ?        ?      419.9        2.0       ?       ? 
1 1 1   18    6   16 f    790.8    2.9    0.0000   0.0000          ?        ?  6254.3193  46.6121          ?        ?      790.8        2.9       ?       ? 
1 1 1   18    6   17 o    645.2    2.5    0.0000   0.0000          ?        ?  4163.1611  32.5646          ?        ?      645.2        2.5       ?       ? 
1 1 1   18    6   18 o   1032.8    3.6    0.0000   0.0000          ?        ? 10667.7803  74.0685          ?        ?     1032.8        3.6       ?       ? 
1 1 1   18    6   19 o    270.2    2.1    0.0000   0.0000          ?        ?   729.8303  11.4934          ?        ?      270.2        2.1       ?       ? 
1 1 1   18    6   20 o   1686.7    5.8    0.0000   0.0000          ?        ? 28452.5234 196.0261          ?        ?     1686.7        5.8       ?       ? 
1 1 1   18    6   21 o   1064.0    3.8    0.0000   0.0000          ?        ? 11322.2656  79.8152          ?        ?     1064.0        3.8       ?       ? 
1 1 1   18    6   22 o    364.4    2.1    0.0000   0.0000          ?        ?  1328.1250  15.3245          ?        ?      364.4        2.1       ?       ? 
1 1 1   18    6   23 o   1087.2    3.8    0.0000   0.0000          ?        ? 11820.9512  83.6463          ?        ?     1087.2        3.8       ?       ? 
1 1 1   18    6   24 o    706.8    2.8    0.0000   0.0000          ?        ?  4995.1548  39.5883          ?        ?      706.8        2.8       ?       ? 
1 1 1   18    6   25 o    673.7    2.7    0.0000   0.0000          ?        ?  4538.6118  37.0343          ?        ?      673.7        2.7       ?       ? 
1 1 1   18    6   26 o    674.0    2.7    0.0000   0.0000          ?        ?  4543.0815  37.0343          ?        ?      674.0        2.7       ?       ? 
1 1 1   18    6   27 o    187.4    3.2    0.0000   0.0000          ?        ?   351.1869  12.1319          ?        ?      187.4        3.2       ?       ? 
1 1 1   18    6   28 o   1230.3    4.2    0.0000   0.0000          ?        ? 15136.1553 103.4405          ?        ?     1230.3        4.2       ?       ? 
1 1 1   18    6   29 o    320.0    2.5    0.0000   0.0000          ?        ?  1024.1886  15.9630          ?        ?      320.0        2.5       ?       ? 
1 1 1   18    6   30 f    965.7    3.5    0.0000   0.0000          ?        ?  9325.6084  67.0448          ?        ?      965.7        3.5       ?       ? 
1 1 1   18    6   31 o    196.7    4.4    0.0000   0.0000          ?        ?   386.9441  17.2401          ?        ?      196.7        4.4       ?       ? 
1 1 1   18    6   32 o    640.2    2.8    0.0000   0.0000          ?        ?  4099.3091  35.7572          ?        ?      640.2        2.8       ?       ? 
1 1 1   18    6   33 o     31.5   14.5    0.0000   0.0000          ?        ?   -16.6016  21.0712          ?        ?       31.5       14.5       ?       ? 
1 1 1   18    6   34 f    772.0    3.1    0.0000   0.0000          ?        ?  5959.9609  47.2506          ?        ?      772.0        3.1       ?       ? 
1 1 1   18    6   35 o    644.4    2.7    0.0000   0.0000          ?        ?  4152.9448  34.4802          ?        ?      644.4        2.7       ?       ? 
1 1 1   18    6   36 o    536.9    2.6    0.0000   0.0000          ?        ?  2882.2866  27.4564          ?        ?      536.9        2.6       ?       ? 
1 1 1   18    6   37 o    590.2    2.6    0.0000   0.0000          ?        ?  3483.7739  30.6490          ?        ?      590.2        2.6       ?       ? 
1 1 1   18    6   38 o    238.5    3.7    0.0000   0.0000          ?        ?   568.9227  17.8786          ?        ?      238.5        3.7       ?       ? 
1 1 1   18    6   39 o   1365.1    4.8    0.0000   0.0000          ?        ? 18639.0859 132.1740          ?        ?     1365.1        4.8       ?       ? 
1 1 1   18    6   40 o    802.0    3.1    0.0000   0.0000          ?        ?  6432.4668  50.4432          ?        ?      802.0        3.1       ?       ? 
1 1 1   18    6   41 o    855.5    3.6    0.0000   0.0000          ?        ?  7320.0122  61.9366          ?        ?      855.5        3.6       ?       ? 
1 1 1   18    6   42 o    319.5    3.3    0.0000   0.0000          ?        ?  1020.9960  21.0712          ?        ?      319.5        3.3       ?       ? 
1 1 1   18    6   43 o   1032.1    3.9    0.0000   0.0000          ?        ? 10654.3721  79.8152          ?        ?     1032.1        3.9       ?       ? 
1 1 1   18    6   44 o    238.2    4.0    0.0000   0.0000          ?        ?   567.6458  19.1556          ?        ?      238.2        4.0       ?       ? 
1 1 1   18    6   45 o    319.7    3.0    0.0000   0.0000          ?        ?  1022.2732  19.1556          ?        ?      319.7        3.0       ?       ? 
1 1 1   18    6   46 o    325.4    3.2    0.0000   0.0000          ?        ?  1059.3074  21.0712          ?        ?      325.4        3.2       ?       ? 
1 1 1   18    6   47 o    648.1    2.8    0.0000   0.0000          ?        ?  4200.8340  35.7572          ?        ?      648.1        2.8       ?       ? 
1 1 1   18    6   48 o    668.7    2.9    0.0000   0.0000          ?        ?  4471.5669  38.3113          ?        ?      668.7        2.9       ?       ? 
1 1 1   18    6   49 o    404.4    2.8    0.0000   0.0000          ?        ?  1635.2539  22.3483          ?        ?      404.4        2.8       ?       ? 
1 1 1   18    6   50 o    423.2    2.8    0.0000   0.0000          ?        ?  1791.0532  23.6253          ?        ?      423.2        2.8       ?       ? 
1 1 1   18    6   51 o    393.1    2.8    0.0000   0.0000          ?        ?  1545.8608  21.7097          ?        ?      393.1        2.8       ?       ? 
1 1 1   18    6   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    6   53 f    310.4    3.2    0.0000   0.0000          ?        ?   963.5291  19.7942          ?        ?      310.4        3.2       ?       ? 
1 1 1   18    6   54 o    151.1    5.9    0.0000   0.0000          ?        ?   228.5907  17.8786          ?        ?      151.1        5.9       ?       ? 
1 1 1   18    6   55 o     19.0    9.6    0.0000   0.0000          ?        ?   -56.8284  17.2401          ?        ?       19.0        9.6       ?       ? 
1 1 1   18    6   56 o    115.4    8.0    0.0000   0.0000          ?        ?   133.4510  18.5171          ?        ?      115.4        8.0       ?       ? 
1 1 1   18    6   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    6   58 o    218.8    4.4    0.0000   0.0000          ?        ?   478.8912  19.1556          ?        ?      218.8        4.4       ?       ? 
1 1 1   18    6   59 o    430.6    2.8    0.0000   0.0000          ?        ?  1854.9053  24.2638          ?        ?      430.6        2.8       ?       ? 
1 1 1   18    6   60 o    302.3    3.6    0.0000   0.0000          ?        ?   914.3630  21.7097          ?        ?      302.3        3.6       ?       ? 
1 1 1   18    6   61 o    435.2    2.9    0.0000   0.0000          ?        ?  1895.1321  24.9023          ?        ?      435.2        2.9       ?       ? 
1 1 1   18    6   62 o    200.9    5.1    0.0000   0.0000          ?        ?   404.1842  20.4327          ?        ?      200.9        5.1       ?       ? 
1 1 1   18    6   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    6   64 o    142.1    7.0    0.0000   0.0000          ?        ?   202.4114  19.7942          ?        ?      142.1        7.0       ?       ? 
1 1 1   18    6   65 o    149.9    6.6    0.0000   0.0000          ?        ?   225.3981  19.7942          ?        ?      149.9        6.6       ?       ? 
1 1 1   18    6   66 o    142.9    6.9    0.0000   0.0000          ?        ?   204.9654  19.7942          ?        ?      142.9        6.9       ?       ? 
1 1 1   18    6   67 o    114.4    8.7    0.0000   0.0000          ?        ?   131.5355  19.7942          ?        ?      114.4        8.7       ?       ? 
1 1 1   18    6   68 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    6   69 o    129.7    8.1    0.0000   0.0000          ?        ?   169.2082  21.0712          ?        ?      129.7        8.1       ?       ? 
1 1 1   18    6   70 o     38.4   16.3    0.0000   0.0000          ?        ?     1.2770  21.7097          ?        ?       38.4       16.3       ?       ? 
1 1 1   18    6   71 o     35.0   15.5    0.0000   0.0000          ?        ?    -7.0237  21.7097          ?        ?       35.0       15.5       ?       ? 
1 1 1   18    6   72 o     35.1   15.5    0.0000   0.0000          ?        ?    -5.1082  21.0712          ?        ?       35.1       15.5       ?       ? 
1 1 1   18    6   73 o     91.7   11.8    0.0000   0.0000          ?        ?    85.5619  21.7097          ?        ?       91.7       11.8       ?       ? 
1 1 1   18    6   74 o     42.1   16.9    0.0000   0.0000          ?        ?     9.5778  21.7097          ?        ?       42.1       16.9       ?       ? 
1 1 1   18    6   75 o    128.7    8.2    0.0000   0.0000          ?        ?   167.2927  21.0712          ?        ?      128.7        8.2       ?       ? 
1 1 1   18    6   76 f    217.0    5.1    0.0000   0.0000          ?        ?   473.1445  22.3483          ?        ?      217.0        5.1       ?       ? 
1 1 1   18    6   77 o     36.4   15.4    0.0000   0.0000          ?        ?     2.5541  19.1556          ?        ?       36.4       15.4       ?       ? 
1 1 1   18    6   78 o    212.2    5.3    0.0000   0.0000          ?        ?   452.7119  22.3483          ?        ?      212.2        5.3       ?       ? 
1 1 1   18    7    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    7    1 o    154.1    1.9    0.0000   0.0000          ?        ?   237.5300   5.7467          ?        ?      154.1        1.9       ?       ? 
1 1 1   18    7    2 o    596.7    2.3    0.0000   0.0000          ?        ?  3560.3965  27.4564          ?        ?      596.7        2.3       ?       ? 
1 1 1   18    7    3 o   1181.8    4.1    0.0000   0.0000          ?        ? 13967.0215  96.4168          ?        ?     1181.8        4.1       ?       ? 
1 1 1   18    7    4 o   1042.0    3.6    0.0000   0.0000          ?        ? 10859.3369  74.7070          ?        ?     1042.0        3.6       ?       ? 
1 1 1   18    7    5 o    519.4    2.1    0.0000   0.0000          ?        ?  2697.7539  21.7097          ?        ?      519.4        2.1       ?       ? 
1 1 1   18    7    6 o    671.6    2.5    0.0000   0.0000          ?        ?  4511.1553  33.8416          ?        ?      671.6        2.5       ?       ? 
1 1 1   18    7    7 o    147.6    1.9    0.0000   0.0000          ?        ?   217.7359   5.7467          ?        ?      147.6        1.9       ?       ? 
1 1 1   18    7    8 o    869.8    3.1    0.0000   0.0000          ?        ?  7565.2046  53.6358          ?        ?      869.8        3.1       ?       ? 
1 1 1   18    7    9 o    536.8    2.1    0.0000   0.0000          ?        ?  2881.6479  22.9868          ?        ?      536.8        2.1       ?       ? 
1 1 1   18    7   10 o   1181.5    4.0    0.0000   0.0000          ?        ? 13959.3594  95.1397          ?        ?     1181.5        4.0       ?       ? 
1 1 1   18    7   11 o    183.8    2.1    0.0000   0.0000          ?        ?   337.7780   7.6623          ?        ?      183.8        2.1       ?       ? 
1 1 1   18    7   12 o   1138.6    3.9    0.0000   0.0000          ?        ? 12963.9053  88.1160          ?        ?     1138.6        3.9       ?       ? 
1 1 1   18    7   13 o   1336.7    4.5    0.0000   0.0000          ?        ? 17868.3887 119.4035          ?        ?     1336.7        4.5       ?       ? 
1 1 1   18    7   14 o    972.0    3.4    0.0000   0.0000          ?        ?  9448.2041  67.0448          ?        ?      972.0        3.4       ?       ? 
1 1 1   18    7   15 o   1923.5    6.4    0.0000   0.0000          ?        ? 37002.3281 247.1079          ?        ?     1923.5        6.4       ?       ? 
1 1 1   18    7   16 o    617.8    2.4    0.0000   0.0000          ?        ?  3816.4438  30.0105          ?        ?      617.8        2.4       ?       ? 
1 1 1   18    7   17 o   1195.8    4.3    0.0000   0.0000          ?        ? 14299.6914 102.1635          ?        ?     1195.8        4.3       ?       ? 
1 1 1   18    7   18 o    427.1    2.2    0.0000   0.0000          ?        ?  1824.2563  19.1556          ?        ?      427.1        2.2       ?       ? 
1 1 1   18    7   19 o   1119.0    3.9    0.0000   0.0000          ?        ? 12521.4092  87.4775          ?        ?     1119.0        3.9       ?       ? 
1 1 1   18    7   20 o    438.7    2.1    0.0000   0.0000          ?        ?  1924.5042  18.5171          ?        ?      438.7        2.1       ?       ? 
1 1 1   18    7   21 o    581.6    2.4    0.0000   0.0000          ?        ?  3382.8875  28.0950          ?        ?      581.6        2.4       ?       ? 
1 1 1   18    7   22 o    240.8    2.3    0.0000   0.0000          ?        ?   579.7776  10.8549          ?        ?      240.8        2.3       ?       ? 
1 1 1   18    7   23 o    529.0    2.4    0.0000   0.0000          ?        ?  2798.0020  25.5409          ?        ?      529.0        2.4       ?       ? 
1 1 1   18    7   24 o   1211.1    4.1    0.0000   0.0000          ?        ? 14667.4805 100.2479          ?        ?     1211.1        4.1       ?       ? 
1 1 1   18    7   25 o    951.3    3.5    0.0000   0.0000          ?        ?  9049.1279  66.4062          ?        ?      951.3        3.5       ?       ? 
1 1 1   18    7   26 o   1564.7    5.5    0.0000   0.0000          ?        ? 24485.3887 171.1238          ?        ?     1564.7        5.5       ?       ? 
1 1 1   18    7   27 o    814.3    3.0    0.0000   0.0000          ?        ?  6630.4087  49.1662          ?        ?      814.3        3.0       ?       ? 
1 1 1   18    7   28 o    865.9    3.3    0.0000   0.0000          ?        ?  7497.5205  57.4669          ?        ?      865.9        3.3       ?       ? 
1 1 1   18    7   29 o    946.3    3.5    0.0000   0.0000          ?        ?  8954.6279  65.7677          ?        ?      946.3        3.5       ?       ? 
1 1 1   18    7   30 o    826.1    3.1    0.0000   0.0000          ?        ?  6824.5195  50.4432          ?        ?      826.1        3.1       ?       ? 
1 1 1   18    7   31 o    812.2    3.1    0.0000   0.0000          ?        ?  6596.5669  49.8047          ?        ?      812.2        3.1       ?       ? 
1 1 1   18    7   32 o    269.4    3.2    0.0000   0.0000          ?        ?   725.9991  17.2401          ?        ?      269.4        3.2       ?       ? 
1 1 1   18    7   33 o   2175.1    7.3    0.0000   0.0000          ?        ? 47320.8359 316.0682          ?        ?     2175.1        7.3       ?       ? 
1 1 1   18    7   34 o    721.4    3.0    0.0000   0.0000          ?        ?  5204.5898  43.4195          ?        ?      721.4        3.0       ?       ? 
1 1 1   18    7   35 o    403.2    2.8    0.0000   0.0000          ?        ?  1625.6761  22.3483          ?        ?      403.2        2.8       ?       ? 
1 1 1   18    7   36 o    973.9    3.5    0.0000   0.0000          ?        ?  9485.8770  68.9603          ?        ?      973.9        3.5       ?       ? 
1 1 1   18    7   37 o    722.0    2.8    0.0000   0.0000          ?        ?  5212.8906  40.8654          ?        ?      722.0        2.8       ?       ? 
1 1 1   18    7   38 o    256.9    3.4    0.0000   0.0000          ?        ?   660.2314  17.2401          ?        ?      256.9        3.4       ?       ? 
1 1 1   18    7   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    7   40 o    152.4    5.9    0.0000   0.0000          ?        ?   232.4219  17.8786          ?        ?      152.4        5.9       ?       ? 
1 1 1   18    7   41 o     18.9    9.6    0.0000   0.0000          ?        ?   -67.6833  18.5171          ?        ?       18.9        9.6       ?       ? 
1 1 1   18    7   42 o    912.4    3.6    0.0000   0.0000          ?        ?  8326.3223  65.1292          ?        ?      912.4        3.6       ?       ? 
1 1 1   18    7   43 o    571.6    2.6    0.0000   0.0000          ?        ?  3267.9536  30.0105          ?        ?      571.6        2.6       ?       ? 
1 1 1   18    7   44 o    565.0    2.5    0.0000   0.0000          ?        ?  3191.9695  28.7335          ?        ?      565.0        2.5       ?       ? 
1 1 1   18    7   45 o     56.5   15.0    0.0000   0.0000          ?        ?    33.2031  17.2401          ?        ?       56.5       15.0       ?       ? 
1 1 1   18    7   46 o    232.4    3.8    0.0000   0.0000          ?        ?   540.1893  17.8786          ?        ?      232.4        3.8       ?       ? 
1 1 1   18    7   47 o    446.8    2.7    0.0000   0.0000          ?        ?  1996.6572  24.2638          ?        ?      446.8        2.7       ?       ? 
1 1 1   18    7   48 o    364.6    2.8    0.0000   0.0000          ?        ?  1329.4020  20.4327          ?        ?      364.6        2.8       ?       ? 
1 1 1   18    7   49 o    120.6    7.1    0.0000   0.0000          ?        ?   145.5829  17.2401          ?        ?      120.6        7.1       ?       ? 
1 1 1   18    7   50 o    453.4    2.6    0.0000   0.0000          ?        ?  2056.0396  23.6253          ?        ?      453.4        2.6       ?       ? 
1 1 1   18    7   51 o    114.6    7.8    0.0000   0.0000          ?        ?   131.5355  17.8786          ?        ?      114.6        7.8       ?       ? 
1 1 1   18    7   52 o    280.1    3.5    0.0000   0.0000          ?        ?   784.7431  19.7942          ?        ?      280.1        3.5       ?       ? 
1 1 1   18    7   53 f    222.7    4.2    0.0000   0.0000          ?        ?   496.1313  18.5171          ?        ?      222.7        4.2       ?       ? 
1 1 1   18    7   54 o    332.1    3.3    0.0000   0.0000          ?        ?  1103.3654  21.7097          ?        ?      332.1        3.3       ?       ? 
1 1 1   18    7   55 o    579.2    2.8    0.0000   0.0000          ?        ?  3356.0696  31.9261          ?        ?      579.2        2.8       ?       ? 
1 1 1   18    7   56 o    470.7    2.6    0.0000   0.0000          ?        ?  2216.3086  24.9023          ?        ?      470.7        2.6       ?       ? 
1 1 1   18    7   57 o    161.9    6.1    0.0000   0.0000          ?        ?   262.4324  19.7942          ?        ?      161.9        6.1       ?       ? 
1 1 1   18    7   58 o    591.0    2.8    0.0000   0.0000          ?        ?  3493.9905  32.5646          ?        ?      591.0        2.8       ?       ? 
1 1 1   18    7   59 o    131.4    7.3    0.0000   0.0000          ?        ?   173.0394  19.1556          ?        ?      131.4        7.3       ?       ? 
1 1 1   18    7   60 f    257.2    3.8    0.0000   0.0000          ?        ?   662.1469  19.7942          ?        ?      257.2        3.8       ?       ? 
1 1 1   18    7   61 o    103.7    9.2    0.0000   0.0000          ?        ?   107.9102  19.1556          ?        ?      103.7        9.2       ?       ? 
1 1 1   18    7   62 o    282.8    3.6    0.0000   0.0000          ?        ?   800.0676  20.4327          ?        ?      282.8        3.6       ?       ? 
1 1 1   18    7   63 o    263.3    4.0    0.0000   0.0000          ?        ?   694.0730  21.0712          ?        ?      263.3        4.0       ?       ? 
1 1 1   18    7   64 o    203.3    4.7    0.0000   0.0000          ?        ?   413.7620  19.1556          ?        ?      203.3        4.7       ?       ? 
1 1 1   18    7   65 o    216.9    4.9    0.0000   0.0000          ?        ?   471.2290  21.0712          ?        ?      216.9        4.9       ?       ? 
1 1 1   18    7   66 f    271.5    3.9    0.0000   0.0000          ?        ?   738.1310  21.0712          ?        ?      271.5        3.9       ?       ? 
1 1 1   18    7   67 o     60.2   15.7    0.0000   0.0000          ?        ?    38.3113  19.1556          ?        ?       60.2       15.7       ?       ? 
1 1 1   18    7   68 f    109.8    9.3    0.0000   0.0000          ?        ?   121.3191  20.4327          ?        ?      109.8        9.3       ?       ? 
1 1 1   18    7   69 o     82.9   12.7    0.0000   0.0000          ?        ?    69.5989  21.0712          ?        ?       82.9       12.7       ?       ? 
1 1 1   18    7   70 f     33.5   15.1    0.0000   0.0000          ?        ?    -9.5778  21.0712          ?        ?       33.5       15.1       ?       ? 
1 1 1   18    7   71 o    265.3    4.2    0.0000   0.0000          ?        ?   704.9279  22.3483          ?        ?      265.3        4.2       ?       ? 
1 1 1   18    7   72 o    254.8    4.4    0.0000   0.0000          ?        ?   650.6536  22.3483          ?        ?      254.8        4.4       ?       ? 
1 1 1   18    7   73 o    213.8    4.9    0.0000   0.0000          ?        ?   458.4586  21.0712          ?        ?      213.8        4.9       ?       ? 
1 1 1   18    7   74 o     95.1   11.1    0.0000   0.0000          ?        ?    91.9471  21.0712          ?        ?       95.1       11.1       ?       ? 
1 1 1   18    7   75 o     37.0   15.9    0.0000   0.0000          ?        ?     0.0000  21.0712          ?        ?       37.0       15.9       ?       ? 
1 1 1   18    7   76 o    150.8    7.0    0.0000   0.0000          ?        ?   229.2293  21.0712          ?        ?      150.8        7.0       ?       ? 
1 1 1   18    7   77 o     41.7   16.8    0.0000   0.0000          ?        ?     9.5778  21.7097          ?        ?       41.7       16.8       ?       ? 
1 1 1   18    7   78 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    8    0 o    367.3    2.5 1349.1962  18.5171  1349.1962  18.5171  1349.1962  18.5171      367.3      2.5      367.3        2.5     0.0     0.0 
1 1 1   18    8    1 o    258.2    1.6    0.0000   0.0000          ?        ?   666.6166   8.3008          ?        ?      258.2        1.6       ?       ? 
1 1 1   18    8    2 o    797.7    2.9    0.0000   0.0000          ?        ?  6363.5063  45.9736          ?        ?      797.7        2.9       ?       ? 
1 1 1   18    8    3 o     84.9    2.3    0.0000   0.0000          ?        ?    72.1529   3.8311          ?        ?       84.9        2.3       ?       ? 
1 1 1   18    8    4 o    304.8    1.8    0.0000   0.0000          ?        ?   929.0490  10.8549          ?        ?      304.8        1.8       ?       ? 
1 1 1   18    8    5 o   1440.0    4.8    0.0000   0.0000          ?        ? 20737.9062 138.5592          ?        ?     1440.0        4.8       ?       ? 
1 1 1   18    8    6 o   1122.2    3.8    0.0000   0.0000          ?        ? 12593.5625  86.2004          ?        ?     1122.2        3.8       ?       ? 
1 1 1   18    8    7 o   1114.9    3.8    0.0000   0.0000          ?        ? 12430.7393  84.9234          ?        ?     1114.9        3.8       ?       ? 
1 1 1   18    8    8 o    491.3    2.0    0.0000   0.0000          ?        ?  2414.2502  19.7942          ?        ?      491.3        2.0       ?       ? 
1 1 1   18    8    9 o    974.5    3.5    0.0000   0.0000          ?        ?  9497.3711  67.6833          ?        ?      974.5        3.5       ?       ? 
1 1 1   18    8   10 o   1080.0    3.7    0.0000   0.0000          ?        ? 11665.1514  79.8152          ?        ?     1080.0        3.7       ?       ? 
1 1 1   18    8   11 o    602.4    2.3    0.0000   0.0000          ?        ?  3628.7183  28.0950          ?        ?      602.4        2.3       ?       ? 
1 1 1   18    8   12 o   1887.7    6.2    0.0000   0.0000          ?        ? 35639.0859 232.4219          ?        ?     1887.7        6.2       ?       ? 
1 1 1   18    8   13 o    358.4    1.9    0.0000   0.0000          ?        ?  1284.7054  13.4090          ?        ?      358.4        1.9       ?       ? 
1 1 1   18    8   14 o    988.6    3.5    0.0000   0.0000          ?        ?  9773.8506  68.3218          ?        ?      988.6        3.5       ?       ? 
1 1 1   18    8   15 o   1269.9    4.3    0.0000   0.0000          ?        ? 16126.5029 109.1872          ?        ?     1269.9        4.3       ?       ? 
1 1 1   18    8   16 o    647.6    2.7    0.0000   0.0000          ?        ?  4193.8101  34.4802          ?        ?      647.6        2.7       ?       ? 
1 1 1   18    8   17 o   1671.8    5.5    0.0000   0.0000          ?        ? 27953.1992 184.5327          ?        ?     1671.8        5.5       ?       ? 
1 1 1   18    8   18 o    736.8    2.8    0.0000   0.0000          ?        ?  5429.3491  41.5039          ?        ?      736.8        2.8       ?       ? 
1 1 1   18    8   19 o    484.9    2.3    0.0000   0.0000          ?        ?  2351.6750  22.3483          ?        ?      484.9        2.3       ?       ? 
1 1 1   18    8   20 o    416.9    2.1    0.0000   0.0000          ?        ?  1738.0559  17.2401          ?        ?      416.9        2.1       ?       ? 
1 1 1   18    8   21 o    691.2    2.7    0.0000   0.0000          ?        ?  4777.4189  37.6728          ?        ?      691.2        2.7       ?       ? 
1 1 1   18    8   22 o   1873.1    6.4    0.0000   0.0000          ?        ? 35089.3164 240.0841          ?        ?     1873.1        6.4       ?       ? 
1 1 1   18    8   23 o    400.1    2.2    0.0000   0.0000          ?        ?  1600.7737  17.2401          ?        ?      400.1        2.2       ?       ? 
1 1 1   18    8   24 o   1123.1    4.0    0.0000   0.0000          ?        ? 12614.6328  90.0316          ?        ?     1123.1        4.0       ?       ? 
1 1 1   18    8   25 o   1136.8    4.2    0.0000   0.0000          ?        ? 12923.6777  95.7782          ?        ?     1136.8        4.2       ?       ? 
1 1 1   18    8   26 o    264.8    2.5    0.0000   0.0000          ?        ?   701.0967  13.4090          ?        ?      264.8        2.5       ?       ? 
1 1 1   18    8   27 o   1663.3    5.7    0.0000   0.0000          ?        ? 27669.0566 190.9180          ?        ?     1663.3        5.7       ?       ? 
1 1 1   18    8   28 o    207.8    3.5    0.0000   0.0000          ?        ?   431.6406  14.6860          ?        ?      207.8        3.5       ?       ? 
1 1 1   18    8   29 f    133.5    4.8    0.0000   0.0000          ?        ?   178.1475  12.7704          ?        ?      133.5        4.8       ?       ? 
1 1 1   18    8   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    8   31 o    668.4    2.9    0.0000   0.0000          ?        ?  4467.0972  38.3113          ?        ?      668.4        2.9       ?       ? 
1 1 1   18    8   32 o   1507.0    5.8    0.0000   0.0000          ?        ? 22715.4062 173.6779          ?        ?     1507.0        5.8       ?       ? 
1 1 1   18    8   33 o    543.1    2.7    0.0000   0.0000          ?        ?  2949.9700  29.3720          ?        ?      543.1        2.7       ?       ? 
1 1 1   18    8   34 o    396.6    2.8    0.0000   0.0000          ?        ?  1572.6788  22.3483          ?        ?      396.6        2.8       ?       ? 
1 1 1   18    8   35 o    217.2    3.7    0.0000   0.0000          ?        ?   471.8675  15.9630          ?        ?      217.2        3.7       ?       ? 
1 1 1   18    8   36 o   1061.9    4.1    0.0000   0.0000          ?        ? 11276.9307  87.4775          ?        ?     1061.9        4.1       ?       ? 
1 1 1   18    8   37 o   1113.1    4.0    0.0000   0.0000          ?        ? 12391.1504  89.3930          ?        ?     1113.1        4.0       ?       ? 
1 1 1   18    8   38 o   1856.3    6.4    0.0000   0.0000          ?        ? 34466.1172 236.2530          ?        ?     1856.3        6.4       ?       ? 
1 1 1   18    8   39 o    491.9    2.7    0.0000   0.0000          ?        ?  2419.3584  26.8179          ?        ?      491.9        2.7       ?       ? 
1 1 1   18    8   40 o    244.2    3.8    0.0000   0.0000          ?        ?   596.3792  18.5171          ?        ?      244.2        3.8       ?       ? 
1 1 1   18    8   41 f     66.4   14.8    0.0000   0.0000          ?        ?    45.9736  19.1556          ?        ?       66.4       14.8       ?       ? 
1 1 1   18    8   42 o    305.6    3.3    0.0000   0.0000          ?        ?   934.1572  20.4327          ?        ?      305.6        3.3       ?       ? 
1 1 1   18    8   43 o    107.7    9.5    0.0000   0.0000          ?        ?   116.2109  20.4327          ?        ?      107.7        9.5       ?       ? 
1 1 1   18    8   44 o    950.6    3.5    0.0000   0.0000          ?        ?  9038.2734  66.4062          ?        ?      950.6        3.5       ?       ? 
1 1 1   18    8   45 o    263.5    3.6    0.0000   0.0000          ?        ?   694.7115  19.1556          ?        ?      263.5        3.6       ?       ? 
1 1 1   18    8   46 o    268.6    3.8    0.0000   0.0000          ?        ?   721.5294  20.4327          ?        ?      268.6        3.8       ?       ? 
1 1 1   18    8   47 o    642.6    2.7    0.0000   0.0000          ?        ?  4129.9580  35.1187          ?        ?      642.6        2.7       ?       ? 
1 1 1   18    8   48 o    407.8    2.7    0.0000   0.0000          ?        ?  1663.3489  22.3483          ?        ?      407.8        2.7       ?       ? 
1 1 1   18    8   49 o    355.1    3.1    0.0000   0.0000          ?        ?  1261.0802  21.7097          ?        ?      355.1        3.1       ?       ? 
1 1 1   18    8   50 o    219.1    3.9    0.0000   0.0000          ?        ?   480.1682  17.2401          ?        ?      219.1        3.9       ?       ? 
1 1 1   18    8   51 o     44.8   15.6    0.0000   0.0000          ?        ?    17.8786  17.2401          ?        ?       44.8       15.6       ?       ? 
1 1 1   18    8   52 o    292.4    3.3    0.0000   0.0000          ?        ?   854.9804  19.1556          ?        ?      292.4        3.3       ?       ? 
1 1 1   18    8   53 o    180.7    4.9    0.0000   0.0000          ?        ?   326.9231  17.8786          ?        ?      180.7        4.9       ?       ? 
1 1 1   18    8   54 o    163.5    5.5    0.0000   0.0000          ?        ?   267.5406  17.8786          ?        ?      163.5        5.5       ?       ? 
1 1 1   18    8   55 o     73.1   13.6    0.0000   0.0000          ?        ?    55.5514  19.1556          ?        ?       73.1       13.6       ?       ? 
1 1 1   18    8   56 o    464.8    2.7    0.0000   0.0000          ?        ?  2160.7571  25.5409          ?        ?      464.8        2.7       ?       ? 
1 1 1   18    8   57 o    165.6    5.8    0.0000   0.0000          ?        ?   274.5643  19.1556          ?        ?      165.6        5.8       ?       ? 
1 1 1   18    8   58 o     98.3    9.4    0.0000   0.0000          ?        ?    97.0553  18.5171          ?        ?       98.3        9.4       ?       ? 
1 1 1   18    8   59 o    332.5    3.2    0.0000   0.0000          ?        ?  1105.9194  21.0712          ?        ?      332.5        3.2       ?       ? 
1 1 1   18    8   60 o    258.2    3.7    0.0000   0.0000          ?        ?   667.2551  19.1556          ?        ?      258.2        3.7       ?       ? 
1 1 1   18    8   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    8   62 o    364.3    3.1    0.0000   0.0000          ?        ?  1328.1250  22.3483          ?        ?      364.3        3.1       ?       ? 
1 1 1   18    8   63 f    101.4    9.4    0.0000   0.0000          ?        ?   103.4405  19.1556          ?        ?      101.4        9.4       ?       ? 
1 1 1   18    8   64 o    153.1    6.5    0.0000   0.0000          ?        ?   234.9760  19.7942          ?        ?      153.1        6.5       ?       ? 
1 1 1   18    8   65 o    309.1    3.4    0.0000   0.0000          ?        ?   955.8669  21.0712          ?        ?      309.1        3.4       ?       ? 
1 1 1   18    8   66 o    160.0    6.2    0.0000   0.0000          ?        ?   256.6857  19.7942          ?        ?      160.0        6.2       ?       ? 
1 1 1   18    8   67 o    169.3    5.8    0.0000   0.0000          ?        ?   287.3347  19.7942          ?        ?      169.3        5.8       ?       ? 
1 1 1   18    8   68 o     66.8   15.6    0.0000   0.0000          ?        ?    47.2506  20.4327          ?        ?       66.8       15.6       ?       ? 
1 1 1   18    8   69 o    157.5    6.5    0.0000   0.0000          ?        ?   249.0234  20.4327          ?        ?      157.5        6.5       ?       ? 
1 1 1   18    8   70 o    127.7    8.5    0.0000   0.0000          ?        ?   164.1001  21.7097          ?        ?      127.7        8.5       ?       ? 
1 1 1   18    8   71 o    130.2    7.8    0.0000   0.0000          ?        ?   170.4853  20.4327          ?        ?      130.2        7.8       ?       ? 
1 1 1   18    8   72 o    130.1    7.9    0.0000   0.0000          ?        ?   170.4853  20.4327          ?        ?      130.1        7.9       ?       ? 
1 1 1   18    8   73 o    123.0    8.3    0.0000   0.0000          ?        ?   152.6067  20.4327          ?        ?      123.0        8.3       ?       ? 
1 1 1   18    8   74 o    257.1    4.2    0.0000   0.0000          ?        ?   662.7855  21.7097          ?        ?      257.1        4.2       ?       ? 
1 1 1   18    8   75 o    191.7    6.2    0.0000   0.0000          ?        ?   369.7040  23.6253          ?        ?      191.7        6.2       ?       ? 
1 1 1   18    8   76 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    8   77 o    145.1    7.3    0.0000   0.0000          ?        ?   212.6277  21.0712          ?        ?      145.1        7.3       ?       ? 
1 1 1   18    9    0 o    712.3    3.9 5074.9697  56.1899  5074.9697  56.1899  5074.9697  56.1899      712.3      3.9      712.3        3.9     0.0     0.0 
1 1 1   18    9    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    9    2 o    757.5    3.0    0.0000   0.0000          ?        ?  5738.3940  44.6965          ?        ?      757.5        3.0       ?       ? 
1 1 1   18    9    3 o   1031.5    3.7    0.0000   0.0000          ?        ? 10640.3242  77.2611          ?        ?     1031.5        3.7       ?       ? 
1 1 1   18    9    4 o    454.5    2.0    0.0000   0.0000          ?        ?  2065.6174  17.8786          ?        ?      454.5        2.0       ?       ? 
1 1 1   18    9    5 f    135.4    2.1    0.0000   0.0000          ?        ?   183.2557   5.7467          ?        ?      135.4        2.1       ?       ? 
1 1 1   18    9    6 o   1054.5    3.7    0.0000   0.0000          ?        ? 11121.1309  77.2611          ?        ?     1054.5        3.7       ?       ? 
1 1 1   18    9    7 o    583.9    2.3    0.0000   0.0000          ?        ?  3409.0671  26.8179          ?        ?      583.9        2.3       ?       ? 
1 1 1   18    9    8 o    128.8    2.2    0.0000   0.0000          ?        ?   166.0156   5.7467          ?        ?      128.8        2.2       ?       ? 
1 1 1   18    9    9 o    285.5    1.8    0.0000   0.0000          ?        ?   815.3921  10.2163          ?        ?      285.5        1.8       ?       ? 
1 1 1   18    9   10 o    631.2    2.5    0.0000   0.0000          ?        ?  3983.7366  31.2876          ?        ?      631.2        2.5       ?       ? 
1 1 1   18    9   11 o    573.3    2.3    0.0000   0.0000          ?        ?  3287.1094  26.8179          ?        ?      573.3        2.3       ?       ? 
1 1 1   18    9   12 o   1247.2    4.3    0.0000   0.0000          ?        ? 15556.3027 107.9102          ?        ?     1247.2        4.3       ?       ? 
1 1 1   18    9   13 o    634.9    2.4    0.0000   0.0000          ?        ?  4031.6257  30.6490          ?        ?      634.9        2.4       ?       ? 
1 1 1   18    9   14 o   1100.7    3.9    0.0000   0.0000          ?        ? 12115.3096  84.9234          ?        ?     1100.7        3.9       ?       ? 
1 1 1   18    9   15 o    870.8    3.2    0.0000   0.0000          ?        ?  7583.7212  54.9129          ?        ?      870.8        3.2       ?       ? 
1 1 1   18    9   16 o   2086.9    6.8    0.0000   0.0000          ?        ? 43558.0312 282.2266          ?        ?     2086.9        6.8       ?       ? 
1 1 1   18    9   17 o    870.9    3.3    0.0000   0.0000          ?        ?  7584.3604  56.8284          ?        ?      870.9        3.3       ?       ? 
1 1 1   18    9   18 o   2229.5    7.4    0.0000   0.0000          ?        ? 49712.7422 330.1157          ?        ?     2229.5        7.4       ?       ? 
1 1 1   18    9   19 o    782.9    3.0    0.0000   0.0000          ?        ?  6129.1694  46.6121          ?        ?      782.9        3.0       ?       ? 
1 1 1   18    9   20 o   1603.6    5.4    0.0000   0.0000          ?        ? 25719.0117 174.3164          ?        ?     1603.6        5.4       ?       ? 
1 1 1   18    9   21 o    763.1    3.0    0.0000   0.0000          ?        ?  5823.9556  45.3350          ?        ?      763.1        3.0       ?       ? 
1 1 1   18    9   22 o    891.4    3.4    0.0000   0.0000          ?        ?  7945.7632  60.0210          ?        ?      891.4        3.4       ?       ? 
1 1 1   18    9   23 o   1485.4    5.1    0.0000   0.0000          ?        ? 22066.6680 151.3296          ?        ?     1485.4        5.1       ?       ? 
1 1 1   18    9   24 o    898.7    3.6    0.0000   0.0000          ?        ?  8076.6602  64.4907          ?        ?      898.7        3.6       ?       ? 
1 1 1   18    9   25 o   1850.0    6.3    0.0000   0.0000          ?        ? 34231.1445 234.3374          ?        ?     1850.0        6.3       ?       ? 
1 1 1   18    9   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    9   27 o   1011.7    3.7    0.0000   0.0000          ?        ? 10235.5020  74.0685          ?        ?     1011.7        3.7       ?       ? 
1 1 1   18    9   28 o    332.6    2.3    0.0000   0.0000          ?        ?  1106.5580  15.3245          ?        ?      332.6        2.3       ?       ? 
1 1 1   18    9   29 o     53.1   12.8    0.0000   0.0000          ?        ?    29.3720  13.4090          ?        ?       53.1       12.8       ?       ? 
1 1 1   18    9   30 o     84.2    8.0    0.0000   0.0000          ?        ?    70.8759  13.4090          ?        ?       84.2        8.0       ?       ? 
1 1 1   18    9   31 o   1145.1    4.3    0.0000   0.0000          ?        ? 13113.3184  99.6094          ?        ?     1145.1        4.3       ?       ? 
1 1 1   18    9   32 o   1230.7    4.8    0.0000   0.0000          ?        ? 15148.9258 118.7650          ?        ?     1230.7        4.8       ?       ? 
1 1 1   18    9   33 o    829.1    3.6    0.0000   0.0000          ?        ?  6874.3237  59.3825          ?        ?      829.1        3.6       ?       ? 
1 1 1   18    9   34 o    733.6    3.3    0.0000   0.0000          ?        ?  5381.4600  47.8891          ?        ?      733.6        3.3       ?       ? 
1 1 1   18    9   35 o    858.2    3.5    0.0000   0.0000          ?        ?  7365.9854  60.6596          ?        ?      858.2        3.5       ?       ? 
1 1 1   18    9   36 o   1119.0    4.5    0.0000   0.0000          ?        ? 12523.3252 100.8864          ?        ?     1119.0        4.5       ?       ? 
1 1 1   18    9   37 o    169.7    6.0    0.0000   0.0000          ?        ?   287.9732  20.4327          ?        ?      169.7        6.0       ?       ? 
1 1 1   18    9   38 o    353.6    3.0    0.0000   0.0000          ?        ?  1250.2253  21.0712          ?        ?      353.6        3.0       ?       ? 
1 1 1   18    9   39 o    239.2    3.6    0.0000   0.0000          ?        ?   572.1154  17.2401          ?        ?      239.2        3.6       ?       ? 
1 1 1   18    9   40 f    892.8    3.4    0.0000   0.0000          ?        ?  7971.9424  60.6596          ?        ?      892.8        3.4       ?       ? 
1 1 1   18    9   41 f    653.6    2.8    0.0000   0.0000          ?        ?  4272.3481  36.3957          ?        ?      653.6        2.8       ?       ? 
1 1 1   18    9   42 o    742.7    3.1    0.0000   0.0000          ?        ?  5516.1885  46.6121          ?        ?      742.7        3.1       ?       ? 
1 1 1   18    9   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    9   44 o    615.5    2.9    0.0000   0.0000          ?        ?  3788.9875  35.7572          ?        ?      615.5        2.9       ?       ? 
1 1 1   18    9   45 o    555.8    2.8    0.0000   0.0000          ?        ?  3089.1675  30.6490          ?        ?      555.8        2.8       ?       ? 
1 1 1   18    9   46 o    297.5    3.5    0.0000   0.0000          ?        ?   884.9910  21.0712          ?        ?      297.5        3.5       ?       ? 
1 1 1   18    9   47 f    372.0    2.8    0.0000   0.0000          ?        ?  1383.6764  21.0712          ?        ?      372.0        2.8       ?       ? 
1 1 1   18    9   48 o    359.6    2.8    0.0000   0.0000          ?        ?  1293.0063  20.4327          ?        ?      359.6        2.8       ?       ? 
1 1 1   18    9   49 o    164.9    5.6    0.0000   0.0000          ?        ?   272.0102  18.5171          ?        ?      164.9        5.6       ?       ? 
1 1 1   18    9   50 o    520.9    2.6    0.0000   0.0000          ?        ?  2713.7168  27.4564          ?        ?      520.9        2.6       ?       ? 
1 1 1   18    9   51 o    302.3    3.2    0.0000   0.0000          ?        ?   914.3630  19.1556          ?        ?      302.3        3.2       ?       ? 
1 1 1   18    9   52 o     57.4   14.5    0.0000   0.0000          ?        ?    34.4802  16.6016          ?        ?       57.4       14.5       ?       ? 
1 1 1   18    9   53 o    164.9    5.2    0.0000   0.0000          ?        ?   272.0102  17.2401          ?        ?      164.9        5.2       ?       ? 
1 1 1   18    9   54 o    244.8    3.9    0.0000   0.0000          ?        ?   599.5718  19.1556          ?        ?      244.8        3.9       ?       ? 
1 1 1   18    9   55 o    411.8    2.8    0.0000   0.0000          ?        ?  1695.9135  22.9868          ?        ?      411.8        2.8       ?       ? 
1 1 1   18    9   56 o     25.4   12.3    0.0000   0.0000          ?        ?   -31.2876  19.1556          ?        ?       25.4       12.3       ?       ? 
1 1 1   18    9   57 o    341.1    3.1    0.0000   0.0000          ?        ?  1164.0249  21.0712          ?        ?      341.1        3.1       ?       ? 
1 1 1   18    9   58 o    223.8    4.4    0.0000   0.0000          ?        ?   501.2395  19.7942          ?        ?      223.8        4.4       ?       ? 
1 1 1   18    9   59 o    272.7    3.5    0.0000   0.0000          ?        ?   743.8777  19.1556          ?        ?      272.7        3.5       ?       ? 
1 1 1   18    9   60 o    262.5    3.8    0.0000   0.0000          ?        ?   689.6033  19.7942          ?        ?      262.5        3.8       ?       ? 
1 1 1   18    9   61 o    213.5    4.6    0.0000   0.0000          ?        ?   456.5430  19.7942          ?        ?      213.5        4.6       ?       ? 
1 1 1   18    9   62 o    413.1    3.0    0.0000   0.0000          ?        ?  1707.4067  24.9023          ?        ?      413.1        3.0       ?       ? 
1 1 1   18    9   63 o     96.6   10.2    0.0000   0.0000          ?        ?    93.8627  19.7942          ?        ?       96.6       10.2       ?       ? 
1 1 1   18    9   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18    9   65 o    486.6    2.8    0.0000   0.0000          ?        ?  2368.9153  27.4564          ?        ?      486.6        2.8       ?       ? 
1 1 1   18    9   66 o    162.8    6.1    0.0000   0.0000          ?        ?   265.6250  19.7942          ?        ?      162.8        6.1       ?       ? 
1 1 1   18    9   67 o     44.8   17.0    0.0000   0.0000          ?        ?    14.6860  21.0712          ?        ?       44.8       17.0       ?       ? 
1 1 1   18    9   68 o     29.2   13.7    0.0000   0.0000          ?        ?   -23.6253  21.0712          ?        ?       29.2       13.7       ?       ? 
1 1 1   18    9   69 o    380.5    3.2    0.0000   0.0000          ?        ?  1448.8055  24.2638          ?        ?      380.5        3.2       ?       ? 
1 1 1   18    9   70 o     66.6   16.4    0.0000   0.0000          ?        ?    47.2506  21.7097          ?        ?       66.6       16.4       ?       ? 
1 1 1   18    9   71 o    140.0    7.5    0.0000   0.0000          ?        ?   197.3032  21.0712          ?        ?      140.0        7.5       ?       ? 
1 1 1   18    9   72 o     93.6   10.9    0.0000   0.0000          ?        ?    88.7545  20.4327          ?        ?       93.6       10.9       ?       ? 
1 1 1   18    9   73 o    140.2    7.3    0.0000   0.0000          ?        ?   197.9417  20.4327          ?        ?      140.2        7.3       ?       ? 
1 1 1   18    9   74 o    125.2    8.4    0.0000   0.0000          ?        ?   158.3534  21.0712          ?        ?      125.2        8.4       ?       ? 
1 1 1   18    9   75 o     36.9   15.9    0.0000   0.0000          ?        ?     0.0000  21.0712          ?        ?       36.9       15.9       ?       ? 
1 1 1   18    9   76 o    152.0    6.7    0.0000   0.0000          ?        ?   233.0604  20.4327          ?        ?      152.0        6.7       ?       ? 
1 1 1   18    9   77 o    147.5    7.6    0.0000   0.0000          ?        ?   220.2900  22.3483          ?        ?      147.5        7.6       ?       ? 
1 1 1   18   10    0 o     58.7    6.7   35.7572   7.6623    35.7572   7.6623    35.7572   7.6623       58.7      6.7       58.7        6.7     0.0     0.0 
1 1 1   18   10    1 o    724.9    3.0    0.0000   0.0000          ?        ?  5255.6714  43.4195          ?        ?      724.9        3.0       ?       ? 
1 1 1   18   10    2 o   1234.8    4.5    0.0000   0.0000          ?        ? 15248.5352 111.1028          ?        ?     1234.8        4.5       ?       ? 
1 1 1   18   10    3 o   1012.2    3.8    0.0000   0.0000          ?        ? 10246.9951  75.9841          ?        ?     1012.2        3.8       ?       ? 
1 1 1   18   10    4 o   1092.4    3.8    0.0000   0.0000          ?        ? 11933.9688  83.0078          ?        ?     1092.4        3.8       ?       ? 
1 1 1   18   10    5 o   1098.7    3.7    0.0000   0.0000          ?        ? 12071.8896  82.3693          ?        ?     1098.7        3.7       ?       ? 
1 1 1   18   10    6 o    844.3    3.0    0.0000   0.0000          ?        ?  7128.4556  51.0817          ?        ?      844.3        3.0       ?       ? 
1 1 1   18   10    7 o    686.3    2.6    0.0000   0.0000          ?        ?  4710.3740  35.1187          ?        ?      686.3        2.6       ?       ? 
1 1 1   18   10    8 o    924.9    3.2    0.0000   0.0000          ?        ?  8555.5518  60.0210          ?        ?      924.9        3.2       ?       ? 
1 1 1   18   10    9 o    366.4    1.8    0.0000   0.0000          ?        ?  1342.1725  13.4090          ?        ?      366.4        1.8       ?       ? 
1 1 1   18   10   10 o   1884.2    6.2    0.0000   0.0000          ?        ? 35507.5469 231.7833          ?        ?     1884.2        6.2       ?       ? 
1 1 1   18   10   11 o   1313.1    4.5    0.0000   0.0000          ?        ? 17243.9160 118.7650          ?        ?     1313.1        4.5       ?       ? 
1 1 1   18   10   12 o   1086.6    3.8    0.0000   0.0000          ?        ? 11807.5420  81.7308          ?        ?     1086.6        3.8       ?       ? 
1 1 1   18   10   13 o    890.2    3.3    0.0000   0.0000          ?        ?  7924.6919  59.3825          ?        ?      890.2        3.3       ?       ? 
1 1 1   18   10   14 f   1009.6    3.6    0.0000   0.0000          ?        ? 10192.7207  72.7915          ?        ?     1009.6        3.6       ?       ? 
1 1 1   18   10   15 o   2090.4    6.9    0.0000   0.0000          ?        ? 43702.3359 289.8888          ?        ?     2090.4        6.9       ?       ? 
1 1 1   18   10   16 o    874.5    3.3    0.0000   0.0000          ?        ?  7648.2124  58.1055          ?        ?      874.5        3.3       ?       ? 
1 1 1   18   10   17 o   1413.0    4.9    0.0000   0.0000          ?        ? 19965.9316 139.8362          ?        ?     1413.0        4.9       ?       ? 
1 1 1   18   10   18 o    337.3    2.7    0.0000   0.0000          ?        ?  1137.8455  17.8786          ?        ?      337.3        2.7       ?       ? 
1 1 1   18   10   19 o   1043.1    3.9    0.0000   0.0000          ?        ? 10880.4082  81.0922          ?        ?     1043.1        3.9       ?       ? 
1 1 1   18   10   20 o   1563.2    5.4    0.0000   0.0000          ?        ? 24437.5000 169.2082          ?        ?     1563.2        5.4       ?       ? 
1 1 1   18   10   21 o    964.8    3.6    0.0000   0.0000          ?        ?  9308.3682  68.9603          ?        ?      964.8        3.6       ?       ? 
1 1 1   18   10   22 o    632.3    2.7    0.0000   0.0000          ?        ?  3998.4226  33.8416          ?        ?      632.3        2.7       ?       ? 
1 1 1   18   10   23 o    476.8    2.7    0.0000   0.0000          ?        ?  2273.7756  26.1794          ?        ?      476.8        2.7       ?       ? 
1 1 1   18   10   24 o    252.3    3.2    0.0000   0.0000          ?        ?   636.6060  15.9630          ?        ?      252.3        3.2       ?       ? 
1 1 1   18   10   25 o   1100.6    3.9    0.0000   0.0000          ?        ? 12113.3936  86.8389          ?        ?     1100.6        3.9       ?       ? 
1 1 1   18   10   26 o    906.4    3.3    0.0000   0.0000          ?        ?  8215.2188  60.6596          ?        ?      906.4        3.3       ?       ? 
1 1 1   18   10   27 o    170.4    4.1    0.0000   0.0000          ?        ?   290.5273  14.0475          ?        ?      170.4        4.1       ?       ? 
1 1 1   18   10   28 o    709.5    2.9    0.0000   0.0000          ?        ?  5034.1045  41.5039          ?        ?      709.5        2.9       ?       ? 
1 1 1   18   10   29 o   1199.6    4.5    0.0000   0.0000          ?        ? 14392.2773 107.2716          ?        ?     1199.6        4.5       ?       ? 
1 1 1   18   10   30 o    608.9    3.1    0.0000   0.0000          ?        ?  3707.2563  38.3113          ?        ?      608.9        3.1       ?       ? 
1 1 1   18   10   31 o    301.9    2.9    0.0000   0.0000          ?        ?   911.1703  17.2401          ?        ?      301.9        2.9       ?       ? 
1 1 1   18   10   32 o    369.1    2.9    0.0000   0.0000          ?        ?  1362.6051  21.7097          ?        ?      369.1        2.9       ?       ? 
1 1 1   18   10   33 o    413.3    2.9    0.0000   0.0000          ?        ?  1708.0454  23.6253          ?        ?      413.3        2.9       ?       ? 
1 1 1   18   10   34 o   1123.4    4.2    0.0000   0.0000          ?        ? 12620.3799  94.5012          ?        ?     1123.4        4.2       ?       ? 
1 1 1   18   10   35 o    570.8    3.1    0.0000   0.0000          ?        ?  3258.3757  35.1187          ?        ?      570.8        3.1       ?       ? 
1 1 1   18   10   36 o    348.1    3.0    0.0000   0.0000          ?        ?  1211.9141  21.0712          ?        ?      348.1        3.0       ?       ? 
1 1 1   18   10   37 o    679.2    2.9    0.0000   0.0000          ?        ?  4613.9570  39.5883          ?        ?      679.2        2.9       ?       ? 
1 1 1   18   10   38 o    958.3    3.5    0.0000   0.0000          ?        ?  9185.1338  67.0448          ?        ?      958.3        3.5       ?       ? 
1 1 1   18   10   39 o   1332.5    4.8    0.0000   0.0000          ?        ? 17757.9258 127.7043          ?        ?     1332.5        4.8       ?       ? 
1 1 1   18   10   40 o    492.2    2.6    0.0000   0.0000          ?        ?  2422.5510  25.5409          ?        ?      492.2        2.6       ?       ? 
1 1 1   18   10   41 o    644.1    3.2    0.0000   0.0000          ?        ?  4149.1133  40.8654          ?        ?      644.1        3.2       ?       ? 
1 1 1   18   10   42 o    274.0    3.4    0.0000   0.0000          ?        ?   750.9014  18.5171          ?        ?      274.0        3.4       ?       ? 
1 1 1   18   10   43 o   1162.4    4.1    0.0000   0.0000          ?        ? 13515.5869  95.7782          ?        ?     1162.4        4.1       ?       ? 
1 1 1   18   10   44 o    295.7    3.3    0.0000   0.0000          ?        ?   874.7747  19.7942          ?        ?      295.7        3.3       ?       ? 
1 1 1   18   10   45 o    147.7    5.8    0.0000   0.0000          ?        ?   218.3744  17.2401          ?        ?      147.7        5.8       ?       ? 
1 1 1   18   10   46 o    521.0    2.8    0.0000   0.0000          ?        ?  2714.9941  29.3720          ?        ?      521.0        2.8       ?       ? 
1 1 1   18   10   47 o     53.0   16.4    0.0000   0.0000          ?        ?    28.0950  19.1556          ?        ?       53.0       16.4       ?       ? 
1 1 1   18   10   48 o    633.3    2.8    0.0000   0.0000          ?        ?  4011.1929  35.1187          ?        ?      633.3        2.8       ?       ? 
1 1 1   18   10   49 o    398.5    2.8    0.0000   0.0000          ?        ?  1588.0033  22.3483          ?        ?      398.5        2.8       ?       ? 
1 1 1   18   10   50 o    630.1    2.7    0.0000   0.0000          ?        ?  3970.9661  34.4802          ?        ?      630.1        2.7       ?       ? 
1 1 1   18   10   51 o    309.5    3.3    0.0000   0.0000          ?        ?   958.4210  20.4327          ?        ?      309.5        3.3       ?       ? 
1 1 1   18   10   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   10   53 o    614.2    2.8    0.0000   0.0000          ?        ?  3773.0244  33.8416          ?        ?      614.2        2.8       ?       ? 
1 1 1   18   10   54 o    173.3    5.2    0.0000   0.0000          ?        ?   300.7437  17.8786          ?        ?      173.3        5.2       ?       ? 
1 1 1   18   10   55 o     21.9   10.9    0.0000   0.0000          ?        ?   -42.1424  17.8786          ?        ?       21.9       10.9       ?       ? 
1 1 1   18   10   56 o     21.1   10.5    0.0000   0.0000          ?        ?   -42.7809  17.2401          ?        ?       21.1       10.5       ?       ? 
1 1 1   18   10   57 o     21.6   10.7    0.0000   0.0000          ?        ?   -44.0580  17.8786          ?        ?       21.6       10.7       ?       ? 
1 1 1   18   10   58 f    109.1    8.5    0.0000   0.0000          ?        ?   119.4035  18.5171          ?        ?      109.1        8.5       ?       ? 
1 1 1   18   10   59 o    192.5    5.0    0.0000   0.0000          ?        ?   370.9810  19.1556          ?        ?      192.5        5.0       ?       ? 
1 1 1   18   10   60 o    184.7    5.2    0.0000   0.0000          ?        ?   341.6091  19.1556          ?        ?      184.7        5.2       ?       ? 
1 1 1   18   10   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   10   62 o    136.3    7.5    0.0000   0.0000          ?        ?   186.4483  20.4327          ?        ?      136.3        7.5       ?       ? 
1 1 1   18   10   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   10   64 o    103.0    9.6    0.0000   0.0000          ?        ?   106.6331  19.7942          ?        ?      103.0        9.6       ?       ? 
1 1 1   18   10   65 o    276.4    3.7    0.0000   0.0000          ?        ?   764.9489  20.4327          ?        ?      276.4        3.7       ?       ? 
1 1 1   18   10   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   10   67 o    134.1    7.6    0.0000   0.0000          ?        ?   180.7016  20.4327          ?        ?      134.1        7.6       ?       ? 
1 1 1   18   10   68 o    339.4    3.4    0.0000   0.0000          ?        ?  1153.1700  22.9868          ?        ?      339.4        3.4       ?       ? 
1 1 1   18   10   69 o     70.7   15.3    0.0000   0.0000          ?        ?    52.9973  21.0712          ?        ?       70.7       15.3       ?       ? 
1 1 1   18   10   70 o     27.7   13.3    0.0000   0.0000          ?        ?   -29.3720  21.0712          ?        ?       27.7       13.3       ?       ? 
1 1 1   18   10   71 o    101.2    9.8    0.0000   0.0000          ?        ?   103.4405  19.7942          ?        ?      101.2        9.8       ?       ? 
1 1 1   18   10   72 f    112.1    9.4    0.0000   0.0000          ?        ?   127.0658  21.0712          ?        ?      112.1        9.4       ?       ? 
1 1 1   18   10   73 o     52.3   17.3    0.0000   0.0000          ?        ?    27.4564  21.0712          ?        ?       52.3       17.3       ?       ? 
1 1 1   18   10   74 o     87.4   11.7    0.0000   0.0000          ?        ?    77.8996  20.4327          ?        ?       87.4       11.7       ?       ? 
1 1 1   18   10   75 o    200.3    5.3    0.0000   0.0000          ?        ?   402.9071  21.0712          ?        ?      200.3        5.3       ?       ? 
1 1 1   18   10   76 o     39.3   15.8    0.0000   0.0000          ?        ?     8.3008  19.1556          ?        ?       39.3       15.8       ?       ? 
1 1 1   18   11    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   11    1 o    639.8    2.8    0.0000   0.0000          ?        ?  4092.9236  35.7572          ?        ?      639.8        2.8       ?       ? 
1 1 1   18   11    2 o   1127.7    4.3    0.0000   0.0000          ?        ? 12718.7129  97.0553          ?        ?     1127.7        4.3       ?       ? 
1 1 1   18   11    3 o     44.3   10.9    0.0000   0.0000          ?        ?    20.4327   9.5778          ?        ?       44.3       10.9       ?       ? 
1 1 1   18   11    4 o     97.2    3.3    0.0000   0.0000          ?        ?    94.5012   6.3852          ?        ?       97.2        3.3       ?       ? 
1 1 1   18   11    5 o    535.0    2.3    0.0000   0.0000          ?        ?  2862.4924  24.2638          ?        ?      535.0        2.3       ?       ? 
1 1 1   18   11    6 o   1314.4    4.6    0.0000   0.0000          ?        ? 17277.7559 121.3191          ?        ?     1314.4        4.6       ?       ? 
1 1 1   18   11    7 o   1018.5    3.6    0.0000   0.0000          ?        ? 10374.6992  73.4300          ?        ?     1018.5        3.6       ?       ? 
1 1 1   18   11    8 o   1184.9    4.1    0.0000   0.0000          ?        ? 14039.8135  97.6938          ?        ?     1184.9        4.1       ?       ? 
1 1 1   18   11    9 o    549.3    2.3    0.0000   0.0000          ?        ?  3017.6533  24.9023          ?        ?      549.3        2.3       ?       ? 
1 1 1   18   11   10 o    535.7    2.5    0.0000   0.0000          ?        ?  2870.1548  26.8179          ?        ?      535.7        2.5       ?       ? 
1 1 1   18   11   11 o    496.2    2.3    0.0000   0.0000          ?        ?  2462.1394  22.3483          ?        ?      496.2        2.3       ?       ? 
1 1 1   18   11   12 o    772.6    3.2    0.0000   0.0000          ?        ?  5968.8999  49.8047          ?        ?      772.6        3.2       ?       ? 
1 1 1   18   11   13 o    248.6    2.7    0.0000   0.0000          ?        ?   618.0889  13.4090          ?        ?      248.6        2.7       ?       ? 
1 1 1   18   11   14 o    952.7    3.6    0.0000   0.0000          ?        ?  9077.2236  67.6833          ?        ?      952.7        3.6       ?       ? 
1 1 1   18   11   15 o    543.7    2.5    0.0000   0.0000          ?        ?  2956.3552  27.4564          ?        ?      543.7        2.5       ?       ? 
1 1 1   18   11   16 o    380.7    2.3    0.0000   0.0000          ?        ?  1449.4441  17.2401          ?        ?      380.7        2.3       ?       ? 
1 1 1   18   11   17 o   1003.2    4.0    0.0000   0.0000          ?        ? 10065.0166  81.0922          ?        ?     1003.2        4.0       ?       ? 
1 1 1   18   11   18 o   2000.3    7.3    0.0000   0.0000          ?        ? 40019.9805 293.7199          ?        ?     2000.3        7.3       ?       ? 
1 1 1   18   11   19 o   1042.8    4.2    0.0000   0.0000          ?        ? 10874.0234  86.8389          ?        ?     1042.8        4.2       ?       ? 
1 1 1   18   11   20 o   1495.1    5.2    0.0000   0.0000          ?        ? 22355.2812 155.7993          ?        ?     1495.1        5.2       ?       ? 
1 1 1   18   11   21 o    486.6    2.4    0.0000   0.0000          ?        ?  2367.6382  22.9868          ?        ?      486.6        2.4       ?       ? 
1 1 1   18   11   22 o   1182.7    4.1    0.0000   0.0000          ?        ? 13987.4551  96.4168          ?        ?     1182.7        4.1       ?       ? 
1 1 1   18   11   23 o    823.7    3.1    0.0000   0.0000          ?        ?  6785.5688  51.0817          ?        ?      823.7        3.1       ?       ? 
1 1 1   18   11   24 o    624.7    2.8    0.0000   0.0000          ?        ?  3902.6443  34.4802          ?        ?      624.7        2.8       ?       ? 
1 1 1   18   11   25 o     35.3   13.5    0.0000   0.0000          ?        ?     8.3008  13.4090          ?        ?       35.3       13.5       ?       ? 
1 1 1   18   11   26 o   1026.8    3.9    0.0000   0.0000          ?        ? 10543.9082  79.1767          ?        ?     1026.8        3.9       ?       ? 
1 1 1   18   11   27 f    872.5    3.7    0.0000   0.0000          ?        ?  7613.0938  65.1292          ?        ?      872.5        3.7       ?       ? 
1 1 1   18   11   28 o   1183.9    4.2    0.0000   0.0000          ?        ? 14016.8262  98.3323          ?        ?     1183.9        4.2       ?       ? 
1 1 1   18   11   29 o   2096.1    7.4    0.0000   0.0000          ?        ? 43945.6133 312.2371          ?        ?     2096.1        7.4       ?       ? 
1 1 1   18   11   30 o    297.6    3.2    0.0000   0.0000          ?        ?   885.6295  19.1556          ?        ?      297.6        3.2       ?       ? 
1 1 1   18   11   31 o    755.5    3.0    0.0000   0.0000          ?        ?  5708.3833  44.6965          ?        ?      755.5        3.0       ?       ? 
1 1 1   18   11   32 o   1133.8    4.3    0.0000   0.0000          ?        ? 12857.2715  97.0553          ?        ?     1133.8        4.3       ?       ? 
1 1 1   18   11   33 o    204.7    4.4    0.0000   0.0000          ?        ?   418.8702  17.8786          ?        ?      204.7        4.4       ?       ? 
1 1 1   18   11   34 f   1096.9    4.2    0.0000   0.0000          ?        ? 12032.9404  93.2242          ?        ?     1096.9        4.2       ?       ? 
1 1 1   18   11   35 o    603.0    2.9    0.0000   0.0000          ?        ?  3636.3806  34.4802          ?        ?      603.0        2.9       ?       ? 
1 1 1   18   11   36 o    738.4    3.1    0.0000   0.0000          ?        ?  5452.3364  45.3350          ?        ?      738.4        3.1       ?       ? 
1 1 1   18   11   37 o    706.3    2.9    0.0000   0.0000          ?        ?  4989.4082  41.5039          ?        ?      706.3        2.9       ?       ? 
1 1 1   18   11   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   11   39 o    412.9    2.6    0.0000   0.0000          ?        ?  1704.8528  21.7097          ?        ?      412.9        2.6       ?       ? 
1 1 1   18   11   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   11   41 f    780.9    3.0    0.0000   0.0000          ?        ?  6098.5200  47.2506          ?        ?      780.9        3.0       ?       ? 
1 1 1   18   11   42 o    470.7    2.7    0.0000   0.0000          ?        ?  2215.6699  25.5409          ?        ?      470.7        2.7       ?       ? 
1 1 1   18   11   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   11   44 o    496.7    2.8    0.0000   0.0000          ?        ?  2467.2476  27.4564          ?        ?      496.7        2.8       ?       ? 
1 1 1   18   11   45 o    436.0    2.9    0.0000   0.0000          ?        ?  1900.8789  24.9023          ?        ?      436.0        2.9       ?       ? 
1 1 1   18   11   46 o    761.7    3.0    0.0000   0.0000          ?        ?  5802.2461  45.9736          ?        ?      761.7        3.0       ?       ? 
1 1 1   18   11   47 o    563.2    2.8    0.0000   0.0000          ?        ?  3172.8140  31.2876          ?        ?      563.2        2.8       ?       ? 
1 1 1   18   11   48 o    184.8    4.8    0.0000   0.0000          ?        ?   341.6091  17.8786          ?        ?      184.8        4.8       ?       ? 
1 1 1   18   11   49 o    366.4    2.8    0.0000   0.0000          ?        ?  1342.8110  20.4327          ?        ?      366.4        2.8       ?       ? 
1 1 1   18   11   50 o     27.2   13.0    0.0000   0.0000          ?        ?   -26.8179  19.7942          ?        ?       27.2       13.0       ?       ? 
1 1 1   18   11   51 f    241.4    3.8    0.0000   0.0000          ?        ?   582.9703  18.5171          ?        ?      241.4        3.8       ?       ? 
1 1 1   18   11   52 o    189.0    4.9    0.0000   0.0000          ?        ?   357.5721  18.5171          ?        ?      189.0        4.9       ?       ? 
1 1 1   18   11   53 o    331.9    3.1    0.0000   0.0000          ?        ?  1102.0884  20.4327          ?        ?      331.9        3.1       ?       ? 
1 1 1   18   11   54 o    290.4    3.2    0.0000   0.0000          ?        ?   843.4871  18.5171          ?        ?      290.4        3.2       ?       ? 
1 1 1   18   11   55 o    124.7    7.4    0.0000   0.0000          ?        ?   155.7993  18.5171          ?        ?      124.7        7.4       ?       ? 
1 1 1   18   11   56 o    336.8    3.0    0.0000   0.0000          ?        ?  1134.6530  20.4327          ?        ?      336.8        3.0       ?       ? 
1 1 1   18   11   57 o    344.8    3.1    0.0000   0.0000          ?        ?  1189.5658  21.0712          ?        ?      344.8        3.1       ?       ? 
1 1 1   18   11   58 o    312.4    3.2    0.0000   0.0000          ?        ?   976.2995  19.7942          ?        ?      312.4        3.2       ?       ? 
1 1 1   18   11   59 o    249.4    3.8    0.0000   0.0000          ?        ?   622.5586  19.1556          ?        ?      249.4        3.8       ?       ? 
1 1 1   18   11   60 o    156.8    5.9    0.0000   0.0000          ?        ?   246.4693  18.5171          ?        ?      156.8        5.9       ?       ? 
1 1 1   18   11   61 o    309.7    3.4    0.0000   0.0000          ?        ?   959.6980  21.0712          ?        ?      309.7        3.4       ?       ? 
1 1 1   18   11   62 o     86.1   11.5    0.0000   0.0000          ?        ?    74.7070  19.7942          ?        ?       86.1       11.5       ?       ? 
1 1 1   18   11   63 o    130.3    7.6    0.0000   0.0000          ?        ?   170.4853  19.7942          ?        ?      130.3        7.6       ?       ? 
1 1 1   18   11   64 o    129.4    7.4    0.0000   0.0000          ?        ?   167.9312  19.1556          ?        ?      129.4        7.4       ?       ? 
1 1 1   18   11   65 o    137.0    7.5    0.0000   0.0000          ?        ?   188.3639  20.4327          ?        ?      137.0        7.5       ?       ? 
1 1 1   18   11   66 o    179.3    5.9    0.0000   0.0000          ?        ?   322.4534  21.0712          ?        ?      179.3        5.9       ?       ? 
1 1 1   18   11   67 o    133.2    7.7    0.0000   0.0000          ?        ?   178.1475  20.4327          ?        ?      133.2        7.7       ?       ? 
1 1 1   18   11   68 o     57.1   17.1    0.0000   0.0000          ?        ?    33.8416  21.0712          ?        ?       57.1       17.1       ?       ? 
1 1 1   18   11   69 o     38.5   16.0    0.0000   0.0000          ?        ?     3.8311  20.4327          ?        ?       38.5       16.0       ?       ? 
1 1 1   18   11   70 o    124.9    8.4    0.0000   0.0000          ?        ?   157.0763  21.0712          ?        ?      124.9        8.4       ?       ? 
1 1 1   18   11   71 o    238.4    4.6    0.0000   0.0000          ?        ?   569.5613  21.7097          ?        ?      238.4        4.6       ?       ? 
1 1 1   18   11   72 o    117.1    9.3    0.0000   0.0000          ?        ?   138.5592  21.7097          ?        ?      117.1        9.3       ?       ? 
1 1 1   18   11   73 o    191.9    5.3    0.0000   0.0000          ?        ?   369.7040  20.4327          ?        ?      191.9        5.3       ?       ? 
1 1 1   18   11   74 o    209.3    5.0    0.0000   0.0000          ?        ?   439.9414  21.0712          ?        ?      209.3        5.0       ?       ? 
1 1 1   18   11   75 o     30.4   14.0    0.0000   0.0000          ?        ?   -14.0475  19.7942          ?        ?       30.4       14.0       ?       ? 
1 1 1   18   11   76 f     46.2   16.2    0.0000   0.0000          ?        ?    20.4327  18.5171          ?        ?       46.2       16.2       ?       ? 
1 1 1   18   12    0 o    207.3    4.5  430.3636  18.5171   430.3636  18.5171   430.3636  18.5171      207.3      4.5      207.3        4.5     0.0     0.0 
1 1 1   18   12    1 o   2816.1   10.8    0.0000   0.0000          ?        ? 79334.3984 606.5955          ?        ?     2816.1       10.8       ?       ? 
1 1 1   18   12    2 o    926.8    3.8    0.0000   0.0000          ?        ?  8590.6699  70.8759          ?        ?      926.8        3.8       ?       ? 
1 1 1   18   12    3 o    700.3    2.9    0.0000   0.0000          ?        ?  4904.4844  40.2269          ?        ?      700.3        2.9       ?       ? 
1 1 1   18   12    4 o    519.3    2.4    0.0000   0.0000          ?        ?  2697.1152  24.9023          ?        ?      519.3        2.4       ?       ? 
1 1 1   18   12    5 o    979.8    3.5    0.0000   0.0000          ?        ?  9600.1729  67.6833          ?        ?      979.8        3.5       ?       ? 
1 1 1   18   12    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   12    7 o    711.9    2.7    0.0000   0.0000          ?        ?  5067.9463  38.9498          ?        ?      711.9        2.7       ?       ? 
1 1 1   18   12    8 o    869.1    3.4    0.0000   0.0000          ?        ?  7553.0723  58.7440          ?        ?      869.1        3.4       ?       ? 
1 1 1   18   12    9 o    961.9    3.6    0.0000   0.0000          ?        ?  9252.8164  69.5989          ?        ?      961.9        3.6       ?       ? 
1 1 1   18   12   10 f   1661.7    5.7    0.0000   0.0000          ?        ? 27616.6992 190.2794          ?        ?     1661.7        5.7       ?       ? 
1 1 1   18   12   11 o    586.4    2.4    0.0000   0.0000          ?        ?  3439.0774  28.0950          ?        ?      586.4        2.4       ?       ? 
1 1 1   18   12   12 o    720.6    2.7    0.0000   0.0000          ?        ?  5192.4580  39.5883          ?        ?      720.6        2.7       ?       ? 
1 1 1   18   12   13 o   1080.6    3.8    0.0000   0.0000          ?        ? 11677.9219  81.7308          ?        ?     1080.6        3.8       ?       ? 
1 1 1   18   12   14 o    703.9    2.8    0.0000   0.0000          ?        ?  4954.9277  38.9498          ?        ?      703.9        2.8       ?       ? 
1 1 1   18   12   15 o   1905.3    6.7    0.0000   0.0000          ?        ? 36307.6172 254.1316          ?        ?     1905.3        6.7       ?       ? 
1 1 1   18   12   16 o   1245.1    4.6    0.0000   0.0000          ?        ? 15504.5820 115.5724          ?        ?     1245.1        4.6       ?       ? 
1 1 1   18   12   17 f    602.3    2.7    0.0000   0.0000          ?        ?  3628.0801  31.9261          ?        ?      602.3        2.7       ?       ? 
1 1 1   18   12   18 o    673.9    2.7    0.0000   0.0000          ?        ?  4541.8042  37.0343          ?        ?      673.9        2.7       ?       ? 
1 1 1   18   12   19 o    724.3    2.9    0.0000   0.0000          ?        ?  5246.0938  42.1424          ?        ?      724.3        2.9       ?       ? 
1 1 1   18   12   20 o   1269.7    4.7    0.0000   0.0000          ?        ? 16121.3945 120.0421          ?        ?     1269.7        4.7       ?       ? 
1 1 1   18   12   21 o    542.7    2.4    0.0000   0.0000          ?        ?  2944.8618  26.1794          ?        ?      542.7        2.4       ?       ? 
1 1 1   18   12   22 o    123.8    4.6    0.0000   0.0000          ?        ?   153.2452  11.4934          ?        ?      123.8        4.6       ?       ? 
1 1 1   18   12   23 f    254.9    3.0    0.0000   0.0000          ?        ?   650.0150  15.3245          ?        ?      254.9        3.0       ?       ? 
1 1 1   18   12   24 o    743.9    3.0    0.0000   0.0000          ?        ?  5534.0669  44.0580          ?        ?      743.9        3.0       ?       ? 
1 1 1   18   12   25 f    706.4    2.9    0.0000   0.0000          ?        ?  4990.6851  40.8654          ?        ?      706.4        2.9       ?       ? 
1 1 1   18   12   26 o    253.8    3.0    0.0000   0.0000          ?        ?   644.2683  15.3245          ?        ?      253.8        3.0       ?       ? 
1 1 1   18   12   27 o    641.1    2.7    0.0000   0.0000          ?        ?  4110.8022  34.4802          ?        ?      641.1        2.7       ?       ? 
1 1 1   18   12   28 o    557.3    2.7    0.0000   0.0000          ?        ?  3106.4077  30.0105          ?        ?      557.3        2.7       ?       ? 
1 1 1   18   12   29 o   1755.0    6.1    0.0000   0.0000          ?        ? 30804.8359 213.2662          ?        ?     1755.0        6.1       ?       ? 
1 1 1   18   12   30 o   1112.3    4.1    0.0000   0.0000          ?        ? 12373.2725  90.6701          ?        ?     1112.3        4.1       ?       ? 
1 1 1   18   12   31 o   1208.6    4.5    0.0000   0.0000          ?        ? 14609.3750 108.5487          ?        ?     1208.6        4.5       ?       ? 
1 1 1   18   12   32 o    508.1    2.8    0.0000   0.0000          ?        ?  2582.1814  28.0950          ?        ?      508.1        2.8       ?       ? 
1 1 1   18   12   33 o    127.6    6.3    0.0000   0.0000          ?        ?   162.8230  15.9630          ?        ?      127.6        6.3       ?       ? 
1 1 1   18   12   34 o    450.0    2.8    0.0000   0.0000          ?        ?  2024.7521  24.9023          ?        ?      450.0        2.8       ?       ? 
1 1 1   18   12   35 o    557.3    2.8    0.0000   0.0000          ?        ?  3105.7690  31.2876          ?        ?      557.3        2.8       ?       ? 
1 1 1   18   12   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   12   37 o    865.0    3.4    0.0000   0.0000          ?        ?  7482.1968  58.1055          ?        ?      865.0        3.4       ?       ? 
1 1 1   18   12   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   12   39 o    777.4    3.2    0.0000   0.0000          ?        ?  6044.2456  49.8047          ?        ?      777.4        3.2       ?       ? 
1 1 1   18   12   40 o    728.0    3.1    0.0000   0.0000          ?        ?  5299.7295  44.6965          ?        ?      728.0        3.1       ?       ? 
1 1 1   18   12   41 o    439.8    2.7    0.0000   0.0000          ?        ?  1934.0819  23.6253          ?        ?      439.8        2.7       ?       ? 
1 1 1   18   12   42 o     21.0   10.5    0.0000   0.0000          ?        ?   -47.8891  17.8786          ?        ?       21.0       10.5       ?       ? 
1 1 1   18   12   43 o    166.2    5.2    0.0000   0.0000          ?        ?   276.4799  17.2401          ?        ?      166.2        5.2       ?       ? 
1 1 1   18   12   44 o    645.7    2.9    0.0000   0.0000          ?        ?  4169.5464  37.0343          ?        ?      645.7        2.9       ?       ? 
1 1 1   18   12   45 o    375.3    3.1    0.0000   0.0000          ?        ?  1408.5787  22.9868          ?        ?      375.3        3.1       ?       ? 
1 1 1   18   12   46 f    150.9    5.7    0.0000   0.0000          ?        ?   227.9522  17.2401          ?        ?      150.9        5.7       ?       ? 
1 1 1   18   12   47 o    630.0    2.7    0.0000   0.0000          ?        ?  3969.6890  34.4802          ?        ?      630.0        2.7       ?       ? 
1 1 1   18   12   48 o    132.0    6.5    0.0000   0.0000          ?        ?   174.3164  17.2401          ?        ?      132.0        6.5       ?       ? 
1 1 1   18   12   49 o    529.4    2.7    0.0000   0.0000          ?        ?  2803.1099  28.0950          ?        ?      529.4        2.7       ?       ? 
1 1 1   18   12   50 o    224.5    4.1    0.0000   0.0000          ?        ?   504.4321  18.5171          ?        ?      224.5        4.1       ?       ? 
1 1 1   18   12   51 o    363.3    2.8    0.0000   0.0000          ?        ?  1319.8242  20.4327          ?        ?      363.3        2.8       ?       ? 
1 1 1   18   12   52 o     19.9   10.0    0.0000   0.0000          ?        ?   -45.9736  16.6016          ?        ?       19.9       10.0       ?       ? 
1 1 1   18   12   53 o    333.4    3.1    0.0000   0.0000          ?        ?  1111.6661  20.4327          ?        ?      333.4        3.1       ?       ? 
1 1 1   18   12   54 o    185.3    5.0    0.0000   0.0000          ?        ?   343.5246  18.5171          ?        ?      185.3        5.0       ?       ? 
1 1 1   18   12   55 o    313.8    3.3    0.0000   0.0000          ?        ?   985.2389  20.4327          ?        ?      313.8        3.3       ?       ? 
1 1 1   18   12   56 o    149.6    6.2    0.0000   0.0000          ?        ?   224.1211  18.5171          ?        ?      149.6        6.2       ?       ? 
1 1 1   18   12   57 o     82.0   11.7    0.0000   0.0000          ?        ?    67.6833  19.1556          ?        ?       82.0       11.7       ?       ? 
1 1 1   18   12   58 o    504.9    2.7    0.0000   0.0000          ?        ?  2550.2554  26.8179          ?        ?      504.9        2.7       ?       ? 
1 1 1   18   12   59 o    242.5    4.1    0.0000   0.0000          ?        ?   588.7169  19.7942          ?        ?      242.5        4.1       ?       ? 
1 1 1   18   12   60 o    223.5    4.4    0.0000   0.0000          ?        ?   499.9625  19.7942          ?        ?      223.5        4.4       ?       ? 
1 1 1   18   12   61 f    236.6    4.3    0.0000   0.0000          ?        ?   560.6220  20.4327          ?        ?      236.6        4.3       ?       ? 
1 1 1   18   12   62 o    247.3    4.1    0.0000   0.0000          ?        ?   612.3422  20.4327          ?        ?      247.3        4.1       ?       ? 
1 1 1   18   12   63 o    158.6    6.2    0.0000   0.0000          ?        ?   252.2160  19.7942          ?        ?      158.6        6.2       ?       ? 
1 1 1   18   12   64 o     24.9   12.3    0.0000   0.0000          ?        ?   -42.7809  21.0712          ?        ?       24.9       12.3       ?       ? 
1 1 1   18   12   65 o    273.0    4.0    0.0000   0.0000          ?        ?   746.4318  21.7097          ?        ?      273.0        4.0       ?       ? 
1 1 1   18   12   66 o    345.2    3.4    0.0000   0.0000          ?        ?  1192.7584  23.6253          ?        ?      345.2        3.4       ?       ? 
1 1 1   18   12   67 o     98.1   10.1    0.0000   0.0000          ?        ?    97.0553  19.7942          ?        ?       98.1       10.1       ?       ? 
1 1 1   18   12   68 o    113.4    9.3    0.0000   0.0000          ?        ?   129.6199  21.0712          ?        ?      113.4        9.3       ?       ? 
1 1 1   18   12   69 o    290.6    4.0    0.0000   0.0000          ?        ?   846.0411  22.9868          ?        ?      290.6        4.0       ?       ? 
1 1 1   18   12   70 o     68.4   15.3    0.0000   0.0000          ?        ?    49.8047  20.4327          ?        ?       68.4       15.3       ?       ? 
1 1 1   18   12   71 o     91.0   11.9    0.0000   0.0000          ?        ?    84.2849  21.7097          ?        ?       91.0       11.9       ?       ? 
1 1 1   18   12   72 o     61.7   16.7    0.0000   0.0000          ?        ?    40.8654  21.0712          ?        ?       61.7       16.7       ?       ? 
1 1 1   18   12   73 o    218.6    5.0    0.0000   0.0000          ?        ?   479.5297  21.7097          ?        ?      218.6        5.0       ?       ? 
1 1 1   18   12   74 o    146.6    6.8    0.0000   0.0000          ?        ?   216.4588  19.7942          ?        ?      146.6        6.8       ?       ? 
1 1 1   18   12   75 o    103.2    9.9    0.0000   0.0000          ?        ?   108.5487  20.4327          ?        ?      103.2        9.9       ?       ? 
1 1 1   18   12   76 o    118.7    8.6    0.0000   0.0000          ?        ?   143.0288  20.4327          ?        ?      118.7        8.6       ?       ? 
1 1 1   18   13    0 o    265.0    3.5  702.3738  18.5171   702.3738  18.5171   702.3738  18.5171      265.0      3.5      265.0        3.5     0.0     0.0 
1 1 1   18   13    1 o    531.4    2.7    0.0000   0.0000          ?        ?  2824.1812  28.7335          ?        ?      531.4        2.7       ?       ? 
1 1 1   18   13    2 o   1654.4    6.1    0.0000   0.0000          ?        ? 27373.4219 200.4958          ?        ?     1654.4        6.1       ?       ? 
1 1 1   18   13    3 o   1441.6    5.2    0.0000   0.0000          ?        ? 20783.2402 150.0526          ?        ?     1441.6        5.2       ?       ? 
1 1 1   18   13    4 o   2131.7    8.0    0.0000   0.0000          ?        ? 45452.5234 342.8861          ?        ?     2131.7        8.0       ?       ? 
1 1 1   18   13    5 o   1835.8    6.5    0.0000   0.0000          ?        ? 33706.2773 236.8915          ?        ?     1835.8        6.5       ?       ? 
1 1 1   18   13    6 o    360.1    1.9    0.0000   0.0000          ?        ?  1296.8374  13.4090          ?        ?      360.1        1.9       ?       ? 
1 1 1   18   13    7 o    767.5    3.0    0.0000   0.0000          ?        ?  5891.0005  46.6121          ?        ?      767.5        3.0       ?       ? 
1 1 1   18   13    8 o   1522.2    5.2    0.0000   0.0000          ?        ? 23173.2266 157.7148          ?        ?     1522.2        5.2       ?       ? 
1 1 1   18   13    9 o   2207.4    7.3    0.0000   0.0000          ?        ? 48733.8867 323.0919          ?        ?     2207.4        7.3       ?       ? 
1 1 1   18   13   10 o    377.3    2.1    0.0000   0.0000          ?        ?  1423.9032  15.9630          ?        ?      377.3        2.1       ?       ? 
1 1 1   18   13   11 f   1593.7    5.4    0.0000   0.0000          ?        ? 25401.0293 171.7623          ?        ?     1593.7        5.4       ?       ? 
1 1 1   18   13   12 o    629.3    2.5    0.0000   0.0000          ?        ?  3960.1111  31.2876          ?        ?      629.3        2.5       ?       ? 
1 1 1   18   13   13 o    447.5    2.2    0.0000   0.0000          ?        ?  2002.4038  19.7942          ?        ?      447.5        2.2       ?       ? 
1 1 1   18   13   14 o    515.1    2.4    0.0000   0.0000          ?        ?  2653.6958  24.9023          ?        ?      515.1        2.4       ?       ? 
1 1 1   18   13   15 o    414.9    2.3    0.0000   0.0000          ?        ?  1721.4543  19.1556          ?        ?      414.9        2.3       ?       ? 
1 1 1   18   13   16 o   1418.2    4.7    0.0000   0.0000          ?        ? 20114.7070 134.7281          ?        ?     1418.2        4.7       ?       ? 
1 1 1   18   13   17 o    366.4    2.1    0.0000   0.0000          ?        ?  1342.1725  15.3245          ?        ?      366.4        2.1       ?       ? 
1 1 1   18   13   18 o   1146.5    4.3    0.0000   0.0000          ?        ? 13145.2441  97.6938          ?        ?     1146.5        4.3       ?       ? 
1 1 1   18   13   19 o    526.2    2.8    0.0000   0.0000          ?        ?  2768.6299  29.3720          ?        ?      526.2        2.8       ?       ? 
1 1 1   18   13   20 o    450.8    2.5    0.0000   0.0000          ?        ?  2032.4143  22.9868          ?        ?      450.8        2.5       ?       ? 
1 1 1   18   13   21 o   1078.9    4.0    0.0000   0.0000          ?        ? 11640.2490  86.8389          ?        ?     1078.9        4.0       ?       ? 
1 1 1   18   13   22 o    458.8    2.3    0.0000   0.0000          ?        ?  2105.2058  21.0712          ?        ?      458.8        2.3       ?       ? 
1 1 1   18   13   23 o   1009.9    3.7    0.0000   0.0000          ?        ? 10200.3828  74.0685          ?        ?     1009.9        3.7       ?       ? 
1 1 1   18   13   24 o   1458.8    5.2    0.0000   0.0000          ?        ? 21282.5645 150.6911          ?        ?     1458.8        5.2       ?       ? 
1 1 1   18   13   25 o   1237.8    4.3    0.0000   0.0000          ?        ? 15323.2422 106.6331          ?        ?     1237.8        4.3       ?       ? 
1 1 1   18   13   26 o    884.0    3.4    0.0000   0.0000          ?        ?  7815.5049  59.3825          ?        ?      884.0        3.4       ?       ? 
1 1 1   18   13   27 o    241.8    3.0    0.0000   0.0000          ?        ?   584.8858  14.6860          ?        ?      241.8        3.0       ?       ? 
1 1 1   18   13   28 o    142.7    4.7    0.0000   0.0000          ?        ?   203.6884  13.4090          ?        ?      142.7        4.7       ?       ? 
1 1 1   18   13   29 o    962.8    3.6    0.0000   0.0000          ?        ?  9270.6953  68.9603          ?        ?      962.8        3.6       ?       ? 
1 1 1   18   13   30 o   1085.4    4.2    0.0000   0.0000          ?        ? 11781.3623  91.3086          ?        ?     1085.4        4.2       ?       ? 
1 1 1   18   13   31 o   1175.3    4.4    0.0000   0.0000          ?        ? 13815.6924 103.4405          ?        ?     1175.3        4.4       ?       ? 
1 1 1   18   13   32 o    394.5    2.6    0.0000   0.0000          ?        ?  1556.7157  20.4327          ?        ?      394.5        2.6       ?       ? 
1 1 1   18   13   33 o   1008.1    4.0    0.0000   0.0000          ?        ? 10162.7100  81.0922          ?        ?     1008.1        4.0       ?       ? 
1 1 1   18   13   34 o    744.4    3.0    0.0000   0.0000          ?        ?  5541.7295  44.6965          ?        ?      744.4        3.0       ?       ? 
1 1 1   18   13   35 o    300.4    3.2    0.0000   0.0000          ?        ?   902.2311  19.1556          ?        ?      300.4        3.2       ?       ? 
1 1 1   18   13   36 o    635.8    2.9    0.0000   0.0000          ?        ?  4042.4802  36.3957          ?        ?      635.8        2.9       ?       ? 
1 1 1   18   13   37 f    290.5    3.2    0.0000   0.0000          ?        ?   844.1255  18.5171          ?        ?      290.5        3.2       ?       ? 
1 1 1   18   13   38 o    600.2    2.7    0.0000   0.0000          ?        ?  3603.1775  32.5646          ?        ?      600.2        2.7       ?       ? 
1 1 1   18   13   39 o    725.3    2.9    0.0000   0.0000          ?        ?  5260.7798  41.5039          ?        ?      725.3        2.9       ?       ? 
1 1 1   18   13   40 o    331.7    3.1    0.0000   0.0000          ?        ?  1100.1727  20.4327          ?        ?      331.7        3.1       ?       ? 
1 1 1   18   13   41 o    144.0    5.5    0.0000   0.0000          ?        ?   207.5195  15.9630          ?        ?      144.0        5.5       ?       ? 
1 1 1   18   13   42 o    263.7    3.4    0.0000   0.0000          ?        ?   695.3500  17.8786          ?        ?      263.7        3.4       ?       ? 
1 1 1   18   13   43 o    648.5    2.8    0.0000   0.0000          ?        ?  4205.9419  36.3957          ?        ?      648.5        2.8       ?       ? 
1 1 1   18   13   44 o    136.5    6.5    0.0000   0.0000          ?        ?   186.4483  17.8786          ?        ?      136.5        6.5       ?       ? 
1 1 1   18   13   45 o    384.4    2.7    0.0000   0.0000          ?        ?  1477.5391  20.4327          ?        ?      384.4        2.7       ?       ? 
1 1 1   18   13   46 o    320.5    3.0    0.0000   0.0000          ?        ?  1027.3812  19.1556          ?        ?      320.5        3.0       ?       ? 
1 1 1   18   13   47 o    337.2    3.0    0.0000   0.0000          ?        ?  1137.2070  20.4327          ?        ?      337.2        3.0       ?       ? 
1 1 1   18   13   48 o    158.4    5.2    0.0000   0.0000          ?        ?   250.9390  16.6016          ?        ?      158.4        5.2       ?       ? 
1 1 1   18   13   49 o    143.5    6.2    0.0000   0.0000          ?        ?   206.2425  17.8786          ?        ?      143.5        6.2       ?       ? 
1 1 1   18   13   50 o    341.9    2.8    0.0000   0.0000          ?        ?  1169.1332  19.1556          ?        ?      341.9        2.8       ?       ? 
1 1 1   18   13   51 o    342.8    2.9    0.0000   0.0000          ?        ?  1175.5183  19.7942          ?        ?      342.8        2.9       ?       ? 
1 1 1   18   13   52 f    511.2    2.7    0.0000   0.0000          ?        ?  2613.4690  27.4564          ?        ?      511.2        2.7       ?       ? 
1 1 1   18   13   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   13   54 o    466.2    2.8    0.0000   0.0000          ?        ?  2174.1663  26.1794          ?        ?      466.2        2.8       ?       ? 
1 1 1   18   13   55 o    519.9    2.8    0.0000   0.0000          ?        ?  2704.1392  28.7335          ?        ?      519.9        2.8       ?       ? 
1 1 1   18   13   56 o    312.2    3.2    0.0000   0.0000          ?        ?   975.0225  19.7942          ?        ?      312.2        3.2       ?       ? 
1 1 1   18   13   57 o    573.6    2.7    0.0000   0.0000          ?        ?  3290.9407  30.6490          ?        ?      573.6        2.7       ?       ? 
1 1 1   18   13   58 o     26.1   12.5    0.0000   0.0000          ?        ?   -25.5409  18.5171          ?        ?       26.1       12.5       ?       ? 
1 1 1   18   13   59 o     91.5   10.1    0.0000   0.0000          ?        ?    84.2849  18.5171          ?        ?       91.5       10.1       ?       ? 
1 1 1   18   13   60 o    383.2    2.9    0.0000   0.0000          ?        ?  1469.2383  22.3483          ?        ?      383.2        2.9       ?       ? 
1 1 1   18   13   61 o    242.6    4.2    0.0000   0.0000          ?        ?   589.3555  20.4327          ?        ?      242.6        4.2       ?       ? 
1 1 1   18   13   62 o    362.7    3.1    0.0000   0.0000          ?        ?  1316.6316  22.3483          ?        ?      362.7        3.1       ?       ? 
1 1 1   18   13   63 o    112.7    8.8    0.0000   0.0000          ?        ?   127.7043  19.7942          ?        ?      112.7        8.8       ?       ? 
1 1 1   18   13   64 o    207.4    4.9    0.0000   0.0000          ?        ?   431.0021  20.4327          ?        ?      207.4        4.9       ?       ? 
1 1 1   18   13   65 f    319.1    3.5    0.0000   0.0000          ?        ?  1019.0806  22.3483          ?        ?      319.1        3.5       ?       ? 
1 1 1   18   13   66 o    270.4    4.0    0.0000   0.0000          ?        ?   732.3843  21.7097          ?        ?      270.4        4.0       ?       ? 
1 1 1   18   13   67 o    340.0    3.3    0.0000   0.0000          ?        ?  1157.0012  22.3483          ?        ?      340.0        3.3       ?       ? 
1 1 1   18   13   68 o    261.6    3.9    0.0000   0.0000          ?        ?   685.1337  20.4327          ?        ?      261.6        3.9       ?       ? 
1 1 1   18   13   69 o    135.0    7.6    0.0000   0.0000          ?        ?   183.2557  20.4327          ?        ?      135.0        7.6       ?       ? 
1 1 1   18   13   70 o    198.6    5.5    0.0000   0.0000          ?        ?   395.8834  21.7097          ?        ?      198.6        5.5       ?       ? 
1 1 1   18   13   71 o    170.6    6.0    0.0000   0.0000          ?        ?   292.4429  20.4327          ?        ?      170.6        6.0       ?       ? 
1 1 1   18   13   72 o    123.4    8.5    0.0000   0.0000          ?        ?   153.8837  21.0712          ?        ?      123.4        8.5       ?       ? 
1 1 1   18   13   73 o    139.8    7.5    0.0000   0.0000          ?        ?   197.3032  21.0712          ?        ?      139.8        7.5       ?       ? 
1 1 1   18   13   74 o     62.8   15.8    0.0000   0.0000          ?        ?    42.7809  19.7942          ?        ?       62.8       15.8       ?       ? 
1 1 1   18   13   75 f     39.2   16.2    0.0000   0.0000          ?        ?     6.3852  20.4327          ?        ?       39.2       16.2       ?       ? 
1 1 1   18   14    0 o   3525.6   39.0 124629.2109 2748.8357 124629.2109 2748.8357 124629.2109 2748.8357     3525.6     39.0     3525.6       39.0     0.0     0.0 
1 1 1   18   14    1 o   2869.3   12.2    0.0000   0.0000          ?        ? 82367.3750 697.2656          ?        ?     2869.3       12.2       ?       ? 
1 1 1   18   14    2 o   1736.2    6.9    0.0000   0.0000          ?        ? 30149.7129 238.8071          ?        ?     1736.2        6.9       ?       ? 
1 1 1   18   14    3 o   1846.0    6.9    0.0000   0.0000          ?        ? 34081.7305 253.4931          ?        ?     1846.0        6.9       ?       ? 
1 1 1   18   14    4 o    445.4    2.5    0.0000   0.0000          ?        ?  1983.8867  22.3483          ?        ?      445.4        2.5       ?       ? 
1 1 1   18   14    5 o    350.4    2.3    0.0000   0.0000          ?        ?  1227.8771  15.9630          ?        ?      350.4        2.3       ?       ? 
1 1 1   18   14    6 o    605.2    2.4    0.0000   0.0000          ?        ?  3662.5598  28.7335          ?        ?      605.2        2.4       ?       ? 
1 1 1   18   14    7 o   1412.4    4.7    0.0000   0.0000          ?        ? 19949.9688 134.0895          ?        ?     1412.4        4.7       ?       ? 
1 1 1   18   14    8 o    765.9    2.9    0.0000   0.0000          ?        ?  5866.0981  44.0580          ?        ?      765.9        2.9       ?       ? 
1 1 1   18   14    9 o   1995.1    6.5    0.0000   0.0000          ?        ? 39808.6289 259.8783          ?        ?     1995.1        6.5       ?       ? 
1 1 1   18   14   10 o    685.1    2.7    0.0000   0.0000          ?        ?  4693.1338  36.3957          ?        ?      685.1        2.7       ?       ? 
1 1 1   18   14   11 o    119.3    2.9    0.0000   0.0000          ?        ?   142.3903   7.0237          ?        ?      119.3        2.9       ?       ? 
1 1 1   18   14   12 f    768.3    3.0    0.0000   0.0000          ?        ?  5902.4941  46.6121          ?        ?      768.3        3.0       ?       ? 
1 1 1   18   14   13 o    770.5    3.2    0.0000   0.0000          ?        ?  5937.6128  49.1662          ?        ?      770.5        3.2       ?       ? 
1 1 1   18   14   14 o    968.0    3.9    0.0000   0.0000          ?        ?  9371.5820  75.3456          ?        ?      968.0        3.9       ?       ? 
1 1 1   18   14   15 o    945.7    3.4    0.0000   0.0000          ?        ?  8943.1338  65.1292          ?        ?      945.7        3.4       ?       ? 
1 1 1   18   14   16 o   1008.0    3.7    0.0000   0.0000          ?        ? 10161.4336  75.3456          ?        ?     1008.0        3.7       ?       ? 
1 1 1   18   14   17 o   1095.7    4.1    0.0000   0.0000          ?        ? 12005.4834  89.3930          ?        ?     1095.7        4.1       ?       ? 
1 1 1   18   14   18 o    376.8    2.2    0.0000   0.0000          ?        ?  1420.0720  16.6016          ?        ?      376.8        2.2       ?       ? 
1 1 1   18   14   19 o   1617.0    5.6    0.0000   0.0000          ?        ? 26151.2930 182.6172          ?        ?     1617.0        5.6       ?       ? 
1 1 1   18   14   20 o   1589.1    5.5    0.0000   0.0000          ?        ? 25255.4453 175.5934          ?        ?     1589.1        5.5       ?       ? 
1 1 1   18   14   21 o   1515.0    5.6    0.0000   0.0000          ?        ? 22954.8516 168.5697          ?        ?     1515.0        5.6       ?       ? 
1 1 1   18   14   22 o   1657.8    5.5    0.0000   0.0000          ?        ? 27485.1641 182.6172          ?        ?     1657.8        5.5       ?       ? 
1 1 1   18   14   23 o    427.0    2.5    0.0000   0.0000          ?        ?  1822.9792  21.0712          ?        ?      427.0        2.5       ?       ? 
1 1 1   18   14   24 o    195.1    3.8    0.0000   0.0000          ?        ?   380.5589  14.6860          ?        ?      195.1        3.8       ?       ? 
1 1 1   18   14   25 o   1052.4    3.8    0.0000   0.0000          ?        ? 11077.0732  79.1767          ?        ?     1052.4        3.8       ?       ? 
1 1 1   18   14   26 o    530.7    2.5    0.0000   0.0000          ?        ?  2816.5190  26.1794          ?        ?      530.7        2.5       ?       ? 
1 1 1   18   14   27 o   1306.3    4.7    0.0000   0.0000          ?        ? 17067.0430 123.8732          ?        ?     1306.3        4.7       ?       ? 
1 1 1   18   14   28 o    826.0    3.1    0.0000   0.0000          ?        ?  6822.6035  51.0817          ?        ?      826.0        3.1       ?       ? 
1 1 1   18   14   29 o    239.8    3.9    0.0000   0.0000          ?        ?   575.3080  18.5171          ?        ?      239.8        3.9       ?       ? 
1 1 1   18   14   30 o    882.1    3.4    0.0000   0.0000          ?        ?  7781.6626  60.0210          ?        ?      882.1        3.4       ?       ? 
1 1 1   18   14   31 o    732.9    3.5    0.0000   0.0000          ?        ?  5371.8823  51.7203          ?        ?      732.9        3.5       ?       ? 
1 1 1   18   14   32 o    826.5    3.3    0.0000   0.0000          ?        ?  6830.9048  54.2743          ?        ?      826.5        3.3       ?       ? 
1 1 1   18   14   33 o    106.6    9.0    0.0000   0.0000          ?        ?   113.6568  19.1556          ?        ?      106.6        9.0       ?       ? 
1 1 1   18   14   34 o    931.5    3.6    0.0000   0.0000          ?        ?  8676.8701  66.4062          ?        ?      931.5        3.6       ?       ? 
1 1 1   18   14   35 o    280.5    3.5    0.0000   0.0000          ?        ?   786.6586  19.7942          ?        ?      280.5        3.5       ?       ? 
1 1 1   18   14   36 o    771.1    3.1    0.0000   0.0000          ?        ?  5947.1904  47.8891          ?        ?      771.1        3.1       ?       ? 
1 1 1   18   14   37 o    534.1    2.7    0.0000   0.0000          ?        ?  2852.9146  29.3720          ?        ?      534.1        2.7       ?       ? 
1 1 1   18   14   38 o    479.6    3.0    0.0000   0.0000          ?        ?  2299.9551  28.7335          ?        ?      479.6        3.0       ?       ? 
1 1 1   18   14   39 o    610.4    2.7    0.0000   0.0000          ?        ?  3726.4121  32.5646          ?        ?      610.4        2.7       ?       ? 
1 1 1   18   14   40 o    478.9    2.6    0.0000   0.0000          ?        ?  2293.5698  24.9023          ?        ?      478.9        2.6       ?       ? 
1 1 1   18   14   41 o    543.3    2.6    0.0000   0.0000          ?        ?  2952.5239  28.0950          ?        ?      543.3        2.6       ?       ? 
1 1 1   18   14   42 o    286.6    3.2    0.0000   0.0000          ?        ?   821.7773  18.5171          ?        ?      286.6        3.2       ?       ? 
1 1 1   18   14   43 o    400.4    2.8    0.0000   0.0000          ?        ?  1603.3279  22.3483          ?        ?      400.4        2.8       ?       ? 
1 1 1   18   14   44 o    773.5    3.1    0.0000   0.0000          ?        ?  5983.5859  47.8891          ?        ?      773.5        3.1       ?       ? 
1 1 1   18   14   45 o    437.2    2.7    0.0000   0.0000          ?        ?  1911.7338  23.6253          ?        ?      437.2        2.7       ?       ? 
1 1 1   18   14   46 o     39.6   15.1    0.0000   0.0000          ?        ?    10.8549  16.6016          ?        ?       39.6       15.1       ?       ? 
1 1 1   18   14   47 o    316.1    3.0    0.0000   0.0000          ?        ?   999.2863  19.1556          ?        ?      316.1        3.0       ?       ? 
1 1 1   18   14   48 o    246.1    3.6    0.0000   0.0000          ?        ?   605.9570  17.8786          ?        ?      246.1        3.6       ?       ? 
1 1 1   18   14   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   14   50 o    410.5    2.6    0.0000   0.0000          ?        ?  1685.0586  21.7097          ?        ?      410.5        2.6       ?       ? 
1 1 1   18   14   51 o    114.6    7.2    0.0000   0.0000          ?        ?   131.5355  16.6016          ?        ?      114.6        7.2       ?       ? 
1 1 1   18   14   52 o    396.7    2.7    0.0000   0.0000          ?        ?  1573.9558  21.7097          ?        ?      396.7        2.7       ?       ? 
1 1 1   18   14   53 o    150.5    5.7    0.0000   0.0000          ?        ?   226.6752  17.2401          ?        ?      150.5        5.7       ?       ? 
1 1 1   18   14   54 o    389.5    2.9    0.0000   0.0000          ?        ?  1517.7659  22.3483          ?        ?      389.5        2.9       ?       ? 
1 1 1   18   14   55 o    411.3    2.8    0.0000   0.0000          ?        ?  1692.0823  22.9868          ?        ?      411.3        2.8       ?       ? 
1 1 1   18   14   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   14   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   14   58 o    262.3    3.9    0.0000   0.0000          ?        ?   688.3264  20.4327          ?        ?      262.3        3.9       ?       ? 
1 1 1   18   14   59 o    168.8    5.7    0.0000   0.0000          ?        ?   285.4192  19.1556          ?        ?      168.8        5.7       ?       ? 
1 1 1   18   14   60 o    123.1    7.8    0.0000   0.0000          ?        ?   151.9681  19.1556          ?        ?      123.1        7.8       ?       ? 
1 1 1   18   14   61 o    599.1    2.8    0.0000   0.0000          ?        ?  3591.0459  33.2031          ?        ?      599.1        2.8       ?       ? 
1 1 1   18   14   62 o    308.4    3.4    0.0000   0.0000          ?        ?   952.0358  21.0712          ?        ?      308.4        3.4       ?       ? 
1 1 1   18   14   63 o     85.0   10.9    0.0000   0.0000          ?        ?    72.7915  18.5171          ?        ?       85.0       10.9       ?       ? 
1 1 1   18   14   64 f    241.8    4.2    0.0000   0.0000          ?        ?   585.5243  20.4327          ?        ?      241.8        4.2       ?       ? 
1 1 1   18   14   65 o    367.9    3.1    0.0000   0.0000          ?        ?  1354.3044  22.9868          ?        ?      367.9        3.1       ?       ? 
1 1 1   18   14   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   14   67 o    104.9    9.7    0.0000   0.0000          ?        ?   111.1028  20.4327          ?        ?      104.9        9.7       ?       ? 
1 1 1   18   14   68 o    221.8    4.9    0.0000   0.0000          ?        ?   492.9387  21.7097          ?        ?      221.8        4.9       ?       ? 
1 1 1   18   14   69 o    225.7    4.8    0.0000   0.0000          ?        ?   510.8173  21.7097          ?        ?      225.7        4.8       ?       ? 
1 1 1   18   14   70 o     23.8   11.7    0.0000   0.0000          ?        ?   -41.5039  19.7942          ?        ?       23.8       11.7       ?       ? 
1 1 1   18   14   71 o     36.9   15.6    0.0000   0.0000          ?        ?     1.9156  19.7942          ?        ?       36.9       15.6       ?       ? 
1 1 1   18   14   72 o    162.5    6.5    0.0000   0.0000          ?        ?   265.6250  21.0712          ?        ?      162.5        6.5       ?       ? 
1 1 1   18   14   73 o     99.3   10.0    0.0000   0.0000          ?        ?   100.2479  19.7942          ?        ?       99.3       10.0       ?       ? 
1 1 1   18   14   74 o    225.0    4.7    0.0000   0.0000          ?        ?   508.2632  21.0712          ?        ?      225.0        4.7       ?       ? 
1 1 1   18   14   75 o    161.1    6.5    0.0000   0.0000          ?        ?   261.7939  21.0712          ?        ?      161.1        6.5       ?       ? 
1 1 1   18   15    0 o    119.2    8.7  144.3059  20.4327   144.3059  20.4327   144.3059  20.4327      119.2      8.7      119.2        8.7     0.0     0.0 
1 1 1   18   15    1 o    866.1    3.8    0.0000   0.0000          ?        ?  7501.9907  66.4062          ?        ?      866.1        3.8       ?       ? 
1 1 1   18   15    2 o    432.5    2.7    0.0000   0.0000          ?        ?  1870.2299  23.6253          ?        ?      432.5        2.7       ?       ? 
1 1 1   18   15    3 o   1136.3    4.5    0.0000   0.0000          ?        ? 12912.1836 101.5249          ?        ?     1136.3        4.5       ?       ? 
1 1 1   18   15    4 o   2530.4   10.1    0.0000   0.0000          ?        ? 64047.5469 509.5403          ?        ?     2530.4       10.1       ?       ? 
1 1 1   18   15    5 o   1152.7    4.2    0.0000   0.0000          ?        ? 13287.6348  97.6938          ?        ?     1152.7        4.2       ?       ? 
1 1 1   18   15    6 o   1389.9    5.0    0.0000   0.0000          ?        ? 19318.4727 137.9207          ?        ?     1389.9        5.0       ?       ? 
1 1 1   18   15    7 o   1464.4    5.8    0.0000   0.0000          ?        ? 21447.9414 169.8468          ?        ?     1464.4        5.8       ?       ? 
1 1 1   18   15    8 o    678.3    2.8    0.0000   0.0000          ?        ?  4601.1865  37.6728          ?        ?      678.3        2.8       ?       ? 
1 1 1   18   15    9 o    568.9    2.6    0.0000   0.0000          ?        ?  3236.0276  30.0105          ?        ?      568.9        2.6       ?       ? 
1 1 1   18   15   10 o    264.7    3.5    0.0000   0.0000          ?        ?   700.4582  18.5171          ?        ?      264.7        3.5       ?       ? 
1 1 1   18   15   11 o    530.9    2.5    0.0000   0.0000          ?        ?  2819.0730  26.8179          ?        ?      530.9        2.5       ?       ? 
1 1 1   18   15   12 o    267.7    2.7    0.0000   0.0000          ?        ?   716.4213  14.6860          ?        ?      267.7        2.7       ?       ? 
1 1 1   18   15   13 o    495.5    2.8    0.0000   0.0000          ?        ?  2455.7542  27.4564          ?        ?      495.5        2.8       ?       ? 
1 1 1   18   15   14 o    639.5    2.8    0.0000   0.0000          ?        ?  4089.7310  36.3957          ?        ?      639.5        2.8       ?       ? 
1 1 1   18   15   15 f    404.2    2.2    0.0000   0.0000          ?        ?  1633.9768  17.8786          ?        ?      404.2        2.2       ?       ? 
1 1 1   18   15   16 o   1301.6    5.3    0.0000   0.0000          ?        ? 16944.4473 137.2822          ?        ?     1301.6        5.3       ?       ? 
1 1 1   18   15   17 o    308.5    2.9    0.0000   0.0000          ?        ?   952.0358  17.8786          ?        ?      308.5        2.9       ?       ? 
1 1 1   18   15   18 o   2089.5    7.6    0.0000   0.0000          ?        ? 43671.0469 316.0682          ?        ?     2089.5        7.6       ?       ? 
1 1 1   18   15   19 o   2306.0    9.2    0.0000   0.0000          ?        ? 53195.8711 423.3398          ?        ?     2306.0        9.2       ?       ? 
1 1 1   18   15   20 o   1397.2    4.9    0.0000   0.0000          ?        ? 19523.4375 137.9207          ?        ?     1397.2        4.9       ?       ? 
1 1 1   18   15   21 o   1069.6    4.0    0.0000   0.0000          ?        ? 11441.0312  84.9234          ?        ?     1069.6        4.0       ?       ? 
1 1 1   18   15   22 o    623.0    2.7    0.0000   0.0000          ?        ?  3881.5732  33.2031          ?        ?      623.0        2.7       ?       ? 
1 1 1   18   15   23 o   1070.9    3.9    0.0000   0.0000          ?        ? 11468.4863  83.0078          ?        ?     1070.9        3.9       ?       ? 
1 1 1   18   15   24 o    898.8    3.4    0.0000   0.0000          ?        ?  8079.2144  61.9366          ?        ?      898.8        3.4       ?       ? 
1 1 1   18   15   25 o    805.7    3.1    0.0000   0.0000          ?        ?  6491.2109  50.4432          ?        ?      805.7        3.1       ?       ? 
1 1 1   18   15   26 o    571.1    2.7    0.0000   0.0000          ?        ?  3262.2070  31.2876          ?        ?      571.1        2.7       ?       ? 
1 1 1   18   15   27 o    207.8    4.1    0.0000   0.0000          ?        ?   431.6406  17.2401          ?        ?      207.8        4.1       ?       ? 
1 1 1   18   15   28 o    845.0    3.3    0.0000   0.0000          ?        ?  7141.2261  56.1899          ?        ?      845.0        3.3       ?       ? 
1 1 1   18   15   29 o   1280.2    4.7    0.0000   0.0000          ?        ? 16390.8496 120.6806          ?        ?     1280.2        4.7       ?       ? 
1 1 1   18   15   30 o    498.9    2.8    0.0000   0.0000          ?        ?  2489.5957  27.4564          ?        ?      498.9        2.8       ?       ? 
1 1 1   18   15   31 o    408.6    2.9    0.0000   0.0000          ?        ?  1669.7340  23.6253          ?        ?      408.6        2.9       ?       ? 
1 1 1   18   15   32 o    559.2    2.6    0.0000   0.0000          ?        ?  3127.4788  28.7335          ?        ?      559.2        2.6       ?       ? 
1 1 1   18   15   33 o    637.2    3.1    0.0000   0.0000          ?        ?  4060.3591  38.9498          ?        ?      637.2        3.1       ?       ? 
1 1 1   18   15   34 o   1383.9    5.2    0.0000   0.0000          ?        ? 19155.0098 143.6674          ?        ?     1383.9        5.2       ?       ? 
1 1 1   18   15   35 o    891.3    3.5    0.0000   0.0000          ?        ?  7945.1250  61.9366          ?        ?      891.3        3.5       ?       ? 
1 1 1   18   15   36 o   1158.8    4.6    0.0000   0.0000          ?        ? 13430.6631 107.2716          ?        ?     1158.8        4.6       ?       ? 
1 1 1   18   15   37 f    472.5    2.9    0.0000   0.0000          ?        ?  2232.9102  27.4564          ?        ?      472.5        2.9       ?       ? 
1 1 1   18   15   38 o    767.7    3.1    0.0000   0.0000          ?        ?  5894.8315  47.2506          ?        ?      767.7        3.1       ?       ? 
1 1 1   18   15   39 o    748.3    3.1    0.0000   0.0000          ?        ?  5600.4731  46.6121          ?        ?      748.3        3.1       ?       ? 
1 1 1   18   15   40 o    143.6    5.8    0.0000   0.0000          ?        ?   206.2425  16.6016          ?        ?      143.6        5.8       ?       ? 
1 1 1   18   15   41 o    181.7    4.9    0.0000   0.0000          ?        ?   330.1157  17.8786          ?        ?      181.7        4.9       ?       ? 
1 1 1   18   15   42 o    712.7    3.0    0.0000   0.0000          ?        ?  5080.0781  42.1424          ?        ?      712.7        3.0       ?       ? 
1 1 1   18   15   43 o    452.8    2.7    0.0000   0.0000          ?        ?  2050.2930  24.2638          ?        ?      452.8        2.7       ?       ? 
1 1 1   18   15   44 o    665.0    2.9    0.0000   0.0000          ?        ?  4422.4004  38.9498          ?        ?      665.0        2.9       ?       ? 
1 1 1   18   15   45 o    672.6    2.9    0.0000   0.0000          ?        ?  4525.2026  39.5883          ?        ?      672.6        2.9       ?       ? 
1 1 1   18   15   46 o    238.1    4.0    0.0000   0.0000          ?        ?   567.0072  19.1556          ?        ?      238.1        4.0       ?       ? 
1 1 1   18   15   47 o    320.0    3.2    0.0000   0.0000          ?        ?  1024.1886  20.4327          ?        ?      320.0        3.2       ?       ? 
1 1 1   18   15   48 o    183.5    5.0    0.0000   0.0000          ?        ?   337.1394  18.5171          ?        ?      183.5        5.0       ?       ? 
1 1 1   18   15   49 o    144.6    6.2    0.0000   0.0000          ?        ?   209.4351  17.8786          ?        ?      144.6        6.2       ?       ? 
1 1 1   18   15   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   15   51 o    340.4    3.0    0.0000   0.0000          ?        ?  1158.9167  20.4327          ?        ?      340.4        3.0       ?       ? 
1 1 1   18   15   52 o     27.7   13.1    0.0000   0.0000          ?        ?   -22.3483  19.1556          ?        ?       27.7       13.1       ?       ? 
1 1 1   18   15   53 o     98.4    9.4    0.0000   0.0000          ?        ?    97.0553  18.5171          ?        ?       98.4        9.4       ?       ? 
1 1 1   18   15   54 o    435.3    2.8    0.0000   0.0000          ?        ?  1895.7706  24.2638          ?        ?      435.3        2.8       ?       ? 
1 1 1   18   15   55 o     24.5   11.9    0.0000   0.0000          ?        ?   -29.3720  17.8786          ?        ?       24.5       11.9       ?       ? 
1 1 1   18   15   56 o    316.1    3.3    0.0000   0.0000          ?        ?   999.9249  21.0712          ?        ?      316.1        3.3       ?       ? 
1 1 1   18   15   57 o    469.0    2.7    0.0000   0.0000          ?        ?  2200.3455  25.5409          ?        ?      469.0        2.7       ?       ? 
1 1 1   18   15   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   15   59 o    150.6    6.4    0.0000   0.0000          ?        ?   227.3137  19.1556          ?        ?      150.6        6.4       ?       ? 
1 1 1   18   15   60 o    295.0    3.8    0.0000   0.0000          ?        ?   870.9435  22.3483          ?        ?      295.0        3.8       ?       ? 
1 1 1   18   15   61 o     23.9   11.8    0.0000   0.0000          ?        ?   -45.3350  20.4327          ?        ?       23.9       11.8       ?       ? 
1 1 1   18   15   62 o     33.8   15.1    0.0000   0.0000          ?        ?    -8.9393  21.0712          ?        ?       33.8       15.1       ?       ? 
1 1 1   18   15   63 o    329.7    3.4    0.0000   0.0000          ?        ?  1088.0408  22.3483          ?        ?      329.7        3.4       ?       ? 
1 1 1   18   15   64 o     30.2   14.1    0.0000   0.0000          ?        ?   -19.7942  21.0712          ?        ?       30.2       14.1       ?       ? 
1 1 1   18   15   65 o    253.7    4.5    0.0000   0.0000          ?        ?   644.9069  22.9868          ?        ?      253.7        4.5       ?       ? 
1 1 1   18   15   66 o     47.4   17.0    0.0000   0.0000          ?        ?    19.7942  20.4327          ?        ?       47.4       17.0       ?       ? 
1 1 1   18   15   67 o    174.0    6.2    0.0000   0.0000          ?        ?   303.9363  21.7097          ?        ?      174.0        6.2       ?       ? 
1 1 1   18   15   68 o     31.7   14.6    0.0000   0.0000          ?        ?   -16.6016  21.7097          ?        ?       31.7       14.6       ?       ? 
1 1 1   18   15   69 o    106.6   10.2    0.0000   0.0000          ?        ?   114.9339  21.7097          ?        ?      106.6       10.2       ?       ? 
1 1 1   18   15   70 o    317.4    3.7    0.0000   0.0000          ?        ?  1009.5027  23.6253          ?        ?      317.4        3.7       ?       ? 
1 1 1   18   15   71 o    177.5    5.9    0.0000   0.0000          ?        ?   316.7067  21.0712          ?        ?      177.5        5.9       ?       ? 
1 1 1   18   15   72 o     71.5   15.2    0.0000   0.0000          ?        ?    54.9129  21.0712          ?        ?       71.5       15.2       ?       ? 
1 1 1   18   15   73 o     86.9   11.4    0.0000   0.0000          ?        ?    77.2611  19.7942          ?        ?       86.9       11.4       ?       ? 
1 1 1   18   15   74 o    122.7    8.3    0.0000   0.0000          ?        ?   152.6067  20.4327          ?        ?      122.7        8.3       ?       ? 
1 1 1   18   16    0 o   1669.6    9.1 27882.9609 303.9363 27882.9609 303.9363 27882.9609 303.9363     1669.6      9.1     1669.6        9.1     0.0     0.0 
1 1 1   18   16    1 o   1912.3    7.7    0.0000   0.0000          ?        ? 36574.5195 294.9970          ?        ?     1912.3        7.7       ?       ? 
1 1 1   18   16    2 o   1372.7    5.5    0.0000   0.0000          ?        ? 18844.6895 151.3296          ?        ?     1372.7        5.5       ?       ? 
1 1 1   18   16    3 o   1965.5    7.6    0.0000   0.0000          ?        ? 38640.1367 300.1052          ?        ?     1965.5        7.6       ?       ? 
1 1 1   18   16    4 o   1664.1    5.7    0.0000   0.0000          ?        ? 27696.5156 190.9180          ?        ?     1664.1        5.7       ?       ? 
1 1 1   18   16    5 o    301.1    2.1    0.0000   0.0000          ?        ?   906.7007  12.7704          ?        ?      301.1        2.1       ?       ? 
1 1 1   18   16    6 o    853.5    3.1    0.0000   0.0000          ?        ?  7284.2549  52.9973          ?        ?      853.5        3.1       ?       ? 
1 1 1   18   16    7 o    670.0    2.7    0.0000   0.0000          ?        ?  4488.8071  35.7572          ?        ?      670.0        2.7       ?       ? 
1 1 1   18   16    8 o   1850.7    6.5    0.0000   0.0000          ?        ? 34256.6836 238.8071          ?        ?     1850.7        6.5       ?       ? 
1 1 1   18   16    9 o    173.6    2.4    0.0000   0.0000          ?        ?   301.3822   8.3008          ?        ?      173.6        2.4       ?       ? 
1 1 1   18   16   10 o    923.8    3.7    0.0000   0.0000          ?        ?  8535.1182  68.3218          ?        ?      923.8        3.7       ?       ? 
1 1 1   18   16   11 f    296.2    2.7    0.0000   0.0000          ?        ?   877.3287  15.9630          ?        ?      296.2        2.7       ?       ? 
1 1 1   18   16   12 o    283.0    2.0    0.0000   0.0000          ?        ?   800.7061  11.4934          ?        ?      283.0        2.0       ?       ? 
1 1 1   18   16   13 o   1000.2    3.8    0.0000   0.0000          ?        ? 10003.7178  76.6226          ?        ?     1000.2        3.8       ?       ? 
1 1 1   18   16   14 o   1220.6    4.5    0.0000   0.0000          ?        ? 14900.5410 109.8257          ?        ?     1220.6        4.5       ?       ? 
1 1 1   18   16   15 o    466.2    2.3    0.0000   0.0000          ?        ?  2173.5276  21.7097          ?        ?      466.2        2.3       ?       ? 
1 1 1   18   16   16 o   1808.8    6.1    0.0000   0.0000          ?        ? 32723.5938 219.6514          ?        ?     1808.8        6.1       ?       ? 
1 1 1   18   16   17 o    294.5    2.6    0.0000   0.0000          ?        ?   867.1124  15.3245          ?        ?      294.5        2.6       ?       ? 
1 1 1   18   16   18 o     40.2   15.4    0.0000   0.0000          ?        ?    10.8549  17.2401          ?        ?       40.2       15.4       ?       ? 
1 1 1   18   16   19 o    456.7    2.4    0.0000   0.0000          ?        ?  2086.0503  22.3483          ?        ?      456.7        2.4       ?       ? 
1 1 1   18   16   20 o    927.6    3.4    0.0000   0.0000          ?        ?  8604.0791  63.2136          ?        ?      927.6        3.4       ?       ? 
1 1 1   18   16   21 o    415.1    2.5    0.0000   0.0000          ?        ?  1723.3699  20.4327          ?        ?      415.1        2.5       ?       ? 
1 1 1   18   16   22 o    664.6    2.8    0.0000   0.0000          ?        ?  4416.6543  37.0343          ?        ?      664.6        2.8       ?       ? 
1 1 1   18   16   23 o    593.8    2.6    0.0000   0.0000          ?        ?  3525.9165  31.2876          ?        ?      593.8        2.6       ?       ? 
1 1 1   18   16   24 o    581.7    2.5    0.0000   0.0000          ?        ?  3383.5264  29.3720          ?        ?      581.7        2.5       ?       ? 
1 1 1   18   16   25 o   1023.3    3.7    0.0000   0.0000          ?        ? 10472.3926  75.3456          ?        ?     1023.3        3.7       ?       ? 
1 1 1   18   16   26 o    600.1    2.7    0.0000   0.0000          ?        ?  3601.2620  31.9261          ?        ?      600.1        2.7       ?       ? 
1 1 1   18   16   27 o    617.7    2.8    0.0000   0.0000          ?        ?  3815.8052  35.1187          ?        ?      617.7        2.8       ?       ? 
1 1 1   18   16   28 o    295.0    3.0    0.0000   0.0000          ?        ?   870.3050  17.8786          ?        ?      295.0        3.0       ?       ? 
1 1 1   18   16   29 o    595.4    2.7    0.0000   0.0000          ?        ?  3545.0723  32.5646          ?        ?      595.4        2.7       ?       ? 
1 1 1   18   16   30 o    606.7    2.9    0.0000   0.0000          ?        ?  3681.0771  35.1187          ?        ?      606.7        2.9       ?       ? 
1 1 1   18   16   31 o    162.4    4.5    0.0000   0.0000          ?        ?   263.7094  14.6860          ?        ?      162.4        4.5       ?       ? 
1 1 1   18   16   32 o    371.6    2.8    0.0000   0.0000          ?        ?  1381.1223  21.0712          ?        ?      371.6        2.8       ?       ? 
1 1 1   18   16   33 o    670.8    2.8    0.0000   0.0000          ?        ?  4499.6621  37.0343          ?        ?      670.8        2.8       ?       ? 
1 1 1   18   16   34 o     22.9   11.4    0.0000   0.0000          ?        ?   -51.7203  20.4327          ?        ?       22.9       11.4       ?       ? 
1 1 1   18   16   35 o    956.7    3.5    0.0000   0.0000          ?        ?  9153.2070  66.4062          ?        ?      956.7        3.5       ?       ? 
1 1 1   18   16   36 o    913.7    3.6    0.0000   0.0000          ?        ?  8349.3086  65.7677          ?        ?      913.7        3.6       ?       ? 
1 1 1   18   16   37 o    574.6    2.8    0.0000   0.0000          ?        ?  3302.4338  31.9261          ?        ?      574.6        2.8       ?       ? 
1 1 1   18   16   38 o    574.3    2.7    0.0000   0.0000          ?        ?  3298.6025  30.6490          ?        ?      574.3        2.7       ?       ? 
1 1 1   18   16   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   16   40 f    695.3    3.0    0.0000   0.0000          ?        ?  4834.8857  42.1424          ?        ?      695.3        3.0       ?       ? 
1 1 1   18   16   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   16   42 o    917.2    3.4    0.0000   0.0000          ?        ?  8413.7988  61.9366          ?        ?      917.2        3.4       ?       ? 
1 1 1   18   16   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   16   44 o     87.8    9.8    0.0000   0.0000          ?        ?    77.2611  17.2401          ?        ?       87.8        9.8       ?       ? 
1 1 1   18   16   45 o    659.7    2.8    0.0000   0.0000          ?        ?  4352.8022  36.3957          ?        ?      659.7        2.8       ?       ? 
1 1 1   18   16   46 o    167.6    5.1    0.0000   0.0000          ?        ?   280.9495  17.2401          ?        ?      167.6        5.1       ?       ? 
1 1 1   18   16   47 o    130.2    6.9    0.0000   0.0000          ?        ?   169.8468  17.8786          ?        ?      130.2        6.9       ?       ? 
1 1 1   18   16   48 o    250.1    3.7    0.0000   0.0000          ?        ?   625.7512  18.5171          ?        ?      250.1        3.7       ?       ? 
1 1 1   18   16   49 o    229.3    3.8    0.0000   0.0000          ?        ?   526.1418  17.2401          ?        ?      229.3        3.8       ?       ? 
1 1 1   18   16   50 o    362.6    2.9    0.0000   0.0000          ?        ?  1315.3545  21.0712          ?        ?      362.6        2.9       ?       ? 
1 1 1   18   16   51 o     36.2   15.0    0.0000   0.0000          ?        ?     3.1926  17.8786          ?        ?       36.2       15.0       ?       ? 
1 1 1   18   16   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   16   53 o    281.9    3.4    0.0000   0.0000          ?        ?   794.9594  19.1556          ?        ?      281.9        3.4       ?       ? 
1 1 1   18   16   54 o    362.8    2.9    0.0000   0.0000          ?        ?  1316.6316  21.0712          ?        ?      362.8        2.9       ?       ? 
1 1 1   18   16   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   16   56 f    766.6    3.1    0.0000   0.0000          ?        ?  5879.5068  47.2506          ?        ?      766.6        3.1       ?       ? 
1 1 1   18   16   57 o    257.5    4.0    0.0000   0.0000          ?        ?   663.4240  20.4327          ?        ?      257.5        4.0       ?       ? 
1 1 1   18   16   58 o    218.4    4.4    0.0000   0.0000          ?        ?   477.6142  19.1556          ?        ?      218.4        4.4       ?       ? 
1 1 1   18   16   59 o    233.1    4.1    0.0000   0.0000          ?        ?   544.0204  19.1556          ?        ?      233.1        4.1       ?       ? 
1 1 1   18   16   60 o    169.7    5.6    0.0000   0.0000          ?        ?   288.6118  19.1556          ?        ?      169.7        5.6       ?       ? 
1 1 1   18   16   61 o    205.9    4.8    0.0000   0.0000          ?        ?   424.6169  19.7942          ?        ?      205.9        4.8       ?       ? 
1 1 1   18   16   62 o    210.8    4.7    0.0000   0.0000          ?        ?   445.0496  19.7942          ?        ?      210.8        4.7       ?       ? 
1 1 1   18   16   63 o     45.1   16.6    0.0000   0.0000          ?        ?    16.6016  19.7942          ?        ?       45.1       16.6       ?       ? 
1 1 1   18   16   64 o     20.5   10.4    0.0000   0.0000          ?        ?   -68.3218  20.4327          ?        ?       20.5       10.4       ?       ? 
1 1 1   18   16   65 o    161.3    6.3    0.0000   0.0000          ?        ?   261.1554  20.4327          ?        ?      161.3        6.3       ?       ? 
1 1 1   18   16   66 o    253.4    4.3    0.0000   0.0000          ?        ?   642.9913  21.7097          ?        ?      253.4        4.3       ?       ? 
1 1 1   18   16   67 o    142.3    7.4    0.0000   0.0000          ?        ?   203.6884  21.0712          ?        ?      142.3        7.4       ?       ? 
1 1 1   18   16   68 o    187.6    5.6    0.0000   0.0000          ?        ?   353.1024  21.0712          ?        ?      187.6        5.6       ?       ? 
1 1 1   18   16   69 o     47.2   17.0    0.0000   0.0000          ?        ?    19.7942  20.4327          ?        ?       47.2       17.0       ?       ? 
1 1 1   18   16   70 o    161.3    6.5    0.0000   0.0000          ?        ?   261.7939  21.0712          ?        ?      161.3        6.5       ?       ? 
1 1 1   18   16   71 o     24.6   12.0    0.0000   0.0000          ?        ?   -37.0343  19.7942          ?        ?       24.6       12.0       ?       ? 
1 1 1   18   16   72 o    130.9    7.6    0.0000   0.0000          ?        ?   173.0394  19.7942          ?        ?      130.9        7.6       ?       ? 
1 1 1   18   16   73 o    126.6    7.8    0.0000   0.0000          ?        ?   162.1845  19.7942          ?        ?      126.6        7.8       ?       ? 
1 1 1   18   16   74 o    111.5    8.9    0.0000   0.0000          ?        ?   126.4273  19.7942          ?        ?      111.5        8.9       ?       ? 
1 1 1   18   17    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   17    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   17    2 o   1339.1    6.1    0.0000   0.0000          ?        ? 17932.8789 162.8230          ?        ?     1339.1        6.1       ?       ? 
1 1 1   18   17    3 o   1704.2    7.2    0.0000   0.0000          ?        ? 29048.2637 245.1923          ?        ?     1704.2        7.2       ?       ? 
1 1 1   18   17    4 o    478.5    2.9    0.0000   0.0000          ?        ?  2289.7385  28.0950          ?        ?      478.5        2.9       ?       ? 
1 1 1   18   17    5 o    747.4    3.5    0.0000   0.0000          ?        ?  5586.4258  52.3588          ?        ?      747.4        3.5       ?       ? 
1 1 1   18   17    6 f    495.7    2.3    0.0000   0.0000          ?        ?  2457.6697  22.3483          ?        ?      495.7        2.3       ?       ? 
1 1 1   18   17    7 o    456.6    2.2    0.0000   0.0000          ?        ?  2084.7732  20.4327          ?        ?      456.6        2.2       ?       ? 
1 1 1   18   17    8 o    549.6    2.6    0.0000   0.0000          ?        ?  3020.2073  28.0950          ?        ?      549.6        2.6       ?       ? 
1 1 1   18   17    9 o   1115.8    4.1    0.0000   0.0000          ?        ? 12451.8105  91.9471          ?        ?     1115.8        4.1       ?       ? 
1 1 1   18   17   10 o    777.6    3.3    0.0000   0.0000          ?        ?  6046.1616  51.7203          ?        ?      777.6        3.3       ?       ? 
1 1 1   18   17   11 o    882.3    3.3    0.0000   0.0000          ?        ?  7784.2168  58.7440          ?        ?      882.3        3.3       ?       ? 
1 1 1   18   17   12 o    462.4    2.4    0.0000   0.0000          ?        ?  2137.7703  22.3483          ?        ?      462.4        2.4       ?       ? 
1 1 1   18   17   13 o   1081.4    3.8    0.0000   0.0000          ?        ? 11695.1621  82.3693          ?        ?     1081.4        3.8       ?       ? 
1 1 1   18   17   14 o   1377.1    5.0    0.0000   0.0000          ?        ? 18966.6465 137.2822          ?        ?     1377.1        5.0       ?       ? 
1 1 1   18   17   15 o    745.0    2.9    0.0000   0.0000          ?        ?  5550.0303  42.7809          ?        ?      745.0        2.9       ?       ? 
1 1 1   18   17   16 o    678.4    2.9    0.0000   0.0000          ?        ?  4601.8257  39.5883          ?        ?      678.4        2.9       ?       ? 
1 1 1   18   17   17 o   1707.5    5.8    0.0000   0.0000          ?        ? 29159.3691 197.3032          ?        ?     1707.5        5.8       ?       ? 
1 1 1   18   17   18 o   2045.1    7.7    0.0000   0.0000          ?        ? 41835.9375 316.0682          ?        ?     2045.1        7.7       ?       ? 
1 1 1   18   17   19 o    962.5    3.6    0.0000   0.0000          ?        ?  9264.9492  68.9603          ?        ?      962.5        3.6       ?       ? 
1 1 1   18   17   20 o   1029.2    3.6    0.0000   0.0000          ?        ? 10592.4355  74.7070          ?        ?     1029.2        3.6       ?       ? 
1 1 1   18   17   21 o   1390.4    4.7    0.0000   0.0000          ?        ? 19335.0742 131.5355          ?        ?     1390.4        4.7       ?       ? 
1 1 1   18   17   22 o    687.4    2.9    0.0000   0.0000          ?        ?  4725.6982  39.5883          ?        ?      687.4        2.9       ?       ? 
1 1 1   18   17   23 o    694.6    2.9    0.0000   0.0000          ?        ?  4825.3081  40.2269          ?        ?      694.6        2.9       ?       ? 
1 1 1   18   17   24 o   1088.9    4.0    0.0000   0.0000          ?        ? 11857.9854  86.2004          ?        ?     1088.9        4.0       ?       ? 
1 1 1   18   17   25 o   1419.1    4.9    0.0000   0.0000          ?        ? 20140.8887 139.1977          ?        ?     1419.1        4.9       ?       ? 
1 1 1   18   17   26 o    273.0    3.3    0.0000   0.0000          ?        ?   745.1547  17.8786          ?        ?      273.0        3.3       ?       ? 
1 1 1   18   17   27 o   1921.0    6.4    0.0000   0.0000          ?        ? 36911.6562 247.1079          ?        ?     1921.0        6.4       ?       ? 
1 1 1   18   17   28 o   1053.0    3.9    0.0000   0.0000          ?        ? 11088.5664  81.7308          ?        ?     1053.0        3.9       ?       ? 
1 1 1   18   17   29 o    729.5    3.1    0.0000   0.0000          ?        ?  5321.4395  44.6965          ?        ?      729.5        3.1       ?       ? 
1 1 1   18   17   30 o   1129.9    4.2    0.0000   0.0000          ?        ? 12767.2402  93.8627          ?        ?     1129.9        4.2       ?       ? 
1 1 1   18   17   31 o    314.4    2.6    0.0000   0.0000          ?        ?   988.4315  16.6016          ?        ?      314.4        2.6       ?       ? 
1 1 1   18   17   32 o    442.9    2.9    0.0000   0.0000          ?        ?  1962.1769  25.5409          ?        ?      442.9        2.9       ?       ? 
1 1 1   18   17   33 o    681.3    3.0    0.0000   0.0000          ?        ?  4642.6904  40.2269          ?        ?      681.3        3.0       ?       ? 
1 1 1   18   17   34 o    844.9    3.3    0.0000   0.0000          ?        ?  7139.3101  55.5514          ?        ?      844.9        3.3       ?       ? 
1 1 1   18   17   35 o    751.0    3.1    0.0000   0.0000          ?        ?  5641.3384  47.2506          ?        ?      751.0        3.1       ?       ? 
1 1 1   18   17   36 o    969.7    3.7    0.0000   0.0000          ?        ?  9404.7852  71.5144          ?        ?      969.7        3.7       ?       ? 
1 1 1   18   17   37 o   1147.2    4.1    0.0000   0.0000          ?        ? 13163.1230  93.8627          ?        ?     1147.2        4.1       ?       ? 
1 1 1   18   17   38 o    295.6    3.2    0.0000   0.0000          ?        ?   874.1360  19.1556          ?        ?      295.6        3.2       ?       ? 
1 1 1   18   17   39 o    971.3    3.5    0.0000   0.0000          ?        ?  9435.4336  67.6833          ?        ?      971.3        3.5       ?       ? 
1 1 1   18   17   40 o    504.4    2.5    0.0000   0.0000          ?        ?  2544.5088  25.5409          ?        ?      504.4        2.5       ?       ? 
1 1 1   18   17   41 o    350.3    2.8    0.0000   0.0000          ?        ?  1227.2385  19.7942          ?        ?      350.3        2.8       ?       ? 
1 1 1   18   17   42 o    682.0    2.8    0.0000   0.0000          ?        ?  4651.6299  38.3113          ?        ?      682.0        2.8       ?       ? 
1 1 1   18   17   43 o    435.7    2.8    0.0000   0.0000          ?        ?  1898.9633  24.2638          ?        ?      435.7        2.8       ?       ? 
1 1 1   18   17   44 o    779.5    3.1    0.0000   0.0000          ?        ?  6077.4487  48.5276          ?        ?      779.5        3.1       ?       ? 
1 1 1   18   17   45 o    508.5    2.6    0.0000   0.0000          ?        ?  2586.6511  26.1794          ?        ?      508.5        2.6       ?       ? 
1 1 1   18   17   46 o    239.8    3.9    0.0000   0.0000          ?        ?   575.3080  18.5171          ?        ?      239.8        3.9       ?       ? 
1 1 1   18   17   47 o    224.4    3.8    0.0000   0.0000          ?        ?   503.7936  17.2401          ?        ?      224.4        3.8       ?       ? 
1 1 1   18   17   48 o    606.8    2.8    0.0000   0.0000          ?        ?  3682.9927  33.8416          ?        ?      606.8        2.8       ?       ? 
1 1 1   18   17   49 o    176.5    4.9    0.0000   0.0000          ?        ?   311.5985  17.2401          ?        ?      176.5        4.9       ?       ? 
1 1 1   18   17   50 o    418.0    2.6    0.0000   0.0000          ?        ?  1747.6338  21.7097          ?        ?      418.0        2.6       ?       ? 
1 1 1   18   17   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   17   52 o    308.0    3.2    0.0000   0.0000          ?        ?   948.8432  19.7942          ?        ?      308.0        3.2       ?       ? 
1 1 1   18   17   53 o    318.8    3.2    0.0000   0.0000          ?        ?  1016.5264  20.4327          ?        ?      318.8        3.2       ?       ? 
1 1 1   18   17   54 o    423.4    2.8    0.0000   0.0000          ?        ?  1792.9686  23.6253          ?        ?      423.4        2.8       ?       ? 
1 1 1   18   17   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   17   56 o    115.0    8.0    0.0000   0.0000          ?        ?   132.8125  18.5171          ?        ?      115.0        8.0       ?       ? 
1 1 1   18   17   57 o    246.7    3.8    0.0000   0.0000          ?        ?   609.1497  18.5171          ?        ?      246.7        3.8       ?       ? 
1 1 1   18   17   58 o     46.0   15.7    0.0000   0.0000          ?        ?    19.7942  17.2401          ?        ?       46.0       15.7       ?       ? 
1 1 1   18   17   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   17   60 o    256.9    4.0    0.0000   0.0000          ?        ?   660.8699  20.4327          ?        ?      256.9        4.0       ?       ? 
1 1 1   18   17   61 o    292.3    3.6    0.0000   0.0000          ?        ?   854.9804  21.0712          ?        ?      292.3        3.6       ?       ? 
1 1 1   18   17   62 f    104.8    9.4    0.0000   0.0000          ?        ?   110.4642  19.7942          ?        ?      104.8        9.4       ?       ? 
1 1 1   18   17   63 o    387.6    3.0    0.0000   0.0000          ?        ?  1503.0798  23.6253          ?        ?      387.6        3.0       ?       ? 
1 1 1   18   17   64 o    110.6    9.2    0.0000   0.0000          ?        ?   123.2347  20.4327          ?        ?      110.6        9.2       ?       ? 
1 1 1   18   17   65 o    161.1    6.5    0.0000   0.0000          ?        ?   260.5168  21.0712          ?        ?      161.1        6.5       ?       ? 
1 1 1   18   17   66 o    295.2    3.7    0.0000   0.0000          ?        ?   872.8591  21.7097          ?        ?      295.2        3.7       ?       ? 
1 1 1   18   17   67 o     19.7   10.0    0.0000   0.0000          ?        ?   -75.3456  20.4327          ?        ?       19.7       10.0       ?       ? 
1 1 1   18   17   68 o    176.2    6.0    0.0000   0.0000          ?        ?   311.5985  21.0712          ?        ?      176.2        6.0       ?       ? 
1 1 1   18   17   69 o     24.4   12.0    0.0000   0.0000          ?        ?   -38.3113  19.7942          ?        ?       24.4       12.0       ?       ? 
1 1 1   18   17   70 o     21.8   10.9    0.0000   0.0000          ?        ?   -57.4669  20.4327          ?        ?       21.8       10.9       ?       ? 
1 1 1   18   17   71 o    229.1    4.9    0.0000   0.0000          ?        ?   526.7803  22.3483          ?        ?      229.1        4.9       ?       ? 
1 1 1   18   17   72 o     70.6   14.9    0.0000   0.0000          ?        ?    53.6358  20.4327          ?        ?       70.6       14.9       ?       ? 
1 1 1   18   17   73 o     39.2   16.2    0.0000   0.0000          ?        ?     6.3852  20.4327          ?        ?       39.2       16.2       ?       ? 
1 1 1   18   18    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   18    1 o    578.3    6.0 3345.8533  69.5989  3345.8533  69.5989  3345.8533  69.5989      578.3      6.0      578.3        6.0     0.0     0.0 
1 1 1   18   18    2 o   1567.0    9.1 24562.0117 284.1421 24562.0117 284.1421 24562.0117 284.1421     1567.0      9.1     1567.0        9.1     0.0     0.0 
1 1 1   18   18    3 o   2145.6   12.9 46054.0117 555.5138 46054.0117 555.5138 46054.0117 555.5138     2145.6     12.9     2145.6       12.9     0.0     0.0 
1 1 1   18   18    4 o   1069.5    6.5 11439.7529 139.1977 11439.7529 139.1977 11439.7529 139.1977     1069.5      6.5     1069.5        6.5     0.0     0.0 
1 1 1   18   18    5 o   2199.0   13.2 48375.6758 579.1391 48375.6758 579.1391 48375.6758 579.1391     2199.0     13.2     2199.0       13.2     0.0     0.0 
1 1 1   18   18    6 o   1428.8    7.4 20417.3672 211.3506 20417.3672 211.3506 20417.3672 211.3506     1428.8      7.4     1428.8        7.4     0.0     0.0 
1 1 1   18   18    7 o    461.8    3.1 2132.6624  28.7335  2132.6624  28.7335  2132.6624  28.7335      461.8      3.1      461.8        3.1     0.0     0.0 
1 1 1   18   18    8 o   1550.5    7.6 24045.4473 236.2530 24045.4473 236.2530 24045.4473 236.2530     1550.5      7.6     1550.5        7.6     0.0     0.0 
1 1 1   18   18    9 o    142.2    5.0  203.0499  14.0475   203.0499  14.0475   203.0499  14.0475      142.2      5.0      142.2        5.0     0.0     0.0 
1 1 1   18   18   10 o   1087.6    5.6 11831.1670 121.9576 11831.1670 121.9576 11831.1670 121.9576     1087.6      5.6     1087.6        5.6     0.0     0.0 
1 1 1   18   18   11 o    754.2    4.3 5689.2275  64.4907  5689.2275  64.4907  5689.2275  64.4907      754.2      4.3      754.2        4.3     0.0     0.0 
1 1 1   18   18   12 o   1197.9    6.4 14352.0498 153.8837 14352.0498 153.8837 14352.0498 153.8837     1197.9      6.4     1197.9        6.4     0.0     0.0 
1 1 1   18   18   13 o   2882.6   16.0 83147.0078 920.1097 83147.0078 920.1097 83147.0078 920.1097     2882.6     16.0     2882.6       16.0     0.0     0.0 
1 1 1   18   18   14 o   1046.6    6.8 10955.7539 143.0288 10955.7539 143.0288 10955.7539 143.0288     1046.6      6.8     1046.6        6.8     0.0     0.0 
1 1 1   18   18   15 o    616.8    4.6 3804.9504  56.8284  3804.9504  56.8284  3804.9504  56.8284      616.8      4.6      616.8        4.6     0.0     0.0 
1 1 1   18   18   16 o   1477.1    7.0 21822.1152 208.1580 21822.1152 208.1580 21822.1152 208.1580     1477.1      7.0     1477.1        7.0     0.0     0.0 
1 1 1   18   18   17 o    882.4    4.6 7786.7710  81.7308  7786.7710  81.7308  7786.7710  81.7308      882.4      4.6      882.4        4.6     0.0     0.0 
1 1 1   18   18   18 o   2040.0    9.4 41627.7773 384.3900 41627.7773 384.3900 41627.7773 384.3900     2040.0      9.4     2040.0        9.4     0.0     0.0 
1 1 1   18   18   19 o    376.8    3.5 1420.0720  26.1794  1420.0720  26.1794  1420.0720  26.1794      376.8      3.5      376.8        3.5     0.0     0.0 
1 1 1   18   18   20 o    974.5    5.0 9498.0088  97.6938  9498.0088  97.6938  9498.0088  97.6938      974.5      5.0      974.5        5.0     0.0     0.0 
1 1 1   18   18   21 o    297.1    4.3  883.0754  25.5409   883.0754  25.5409   883.0754  25.5409      297.1      4.3      297.1        4.3     0.0     0.0 
1 1 1   18   18   22 o    202.4    5.7  410.5694  22.9868   410.5694  22.9868   410.5694  22.9868      202.4      5.7      202.4        5.7     0.0     0.0 
1 1 1   18   18   23 o    201.5    5.2  406.7383  21.0712   406.7383  21.0712   406.7383  21.0712      201.5      5.2      201.5        5.2     0.0     0.0 
1 1 1   18   18   24 o   1273.1    6.2 16209.5107 158.9919 16209.5107 158.9919 16209.5107 158.9919     1273.1      6.2     1273.1        6.2     0.0     0.0 
1 1 1   18   18   25 o   1062.3    5.6 11285.8701 119.4035 11285.8701 119.4035 11285.8701 119.4035     1062.3      5.6     1062.3        5.6     0.0     0.0 
1 1 1   18   18   26 o   1501.1    7.5 22539.8125 224.7596 22539.8125 224.7596 22539.8125 224.7596     1501.1      7.5     1501.1        7.5     0.0     0.0 
1 1 1   18   18   27 o    514.2    3.8 2644.1182  38.9498  2644.1182  38.9498  2644.1182  38.9498      514.2      3.8      514.2        3.8     0.0     0.0 
1 1 1   18   18   28 o    592.4    4.0 3509.9534  47.2506  3509.9534  47.2506  3509.9534  47.2506      592.4      4.0      592.4        4.0     0.0     0.0 
1 1 1   18   18   29 o    126.6    9.2  162.8230  22.9868   162.8230  22.9868   162.8230  22.9868      126.6      9.2      126.6        9.2     0.0     0.0 
1 1 1   18   18   30 o    269.3    5.2  725.9991  28.0950   725.9991  28.0950   725.9991  28.0950      269.3      5.2      269.3        5.2     0.0     0.0 
1 1 1   18   18   31 o    140.1    7.3  197.9417  20.4327   197.9417  20.4327   197.9417  20.4327      140.1      7.3      140.1        7.3     0.0     0.0 
1 1 1   18   18   32 o    487.7    3.7 2379.1316  36.3957  2379.1316  36.3957  2379.1316  36.3957      487.7      3.7      487.7        3.7     0.0     0.0 
1 1 1   18   18   33 o   1106.3    5.8 12241.0977 128.3428 12241.0977 128.3428 12241.0977 128.3428     1106.3      5.8     1106.3        5.8     0.0     0.0 
1 1 1   18   18   34 o    411.4    3.7 1693.3594  30.6490  1693.3594  30.6490  1693.3594  30.6490      411.4      3.7      411.4        3.7     0.0     0.0 
1 1 1   18   18   35 o    788.0    4.4 6210.8999  69.5989  6210.8999  69.5989  6210.8999  69.5989      788.0      4.4      788.0        4.4     0.0     0.0 
1 1 1   18   18   36 o    373.5    4.0 1395.8083  30.0105  1395.8083  30.0105  1395.8083  30.0105      373.5      4.0      373.5        4.0     0.0     0.0 
1 1 1   18   18   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   18   38 o    691.3    4.3 4780.6113  59.3825  4780.6113  59.3825  4780.6113  59.3825      691.3      4.3      691.3        4.3     0.0     0.0 
1 1 1   18   18   39 o     17.5   12.9  -58.1055  26.1794   -58.1055  26.1794   -58.1055  26.1794       17.5     12.9       17.5       12.9     0.0     0.0 
1 1 1   18   18   40 o    911.0    4.8 8300.7812  87.4775  8300.7812  87.4775  8300.7812  87.4775      911.0      4.8      911.0        4.8     0.0     0.0 
1 1 1   18   18   41 o    600.7    3.8 3609.5627  45.9736  3609.5627  45.9736  3609.5627  45.9736      600.7      3.8      600.7        3.8     0.0     0.0 
1 1 1   18   18   42 o    488.1    3.9 2383.6011  37.6728  2383.6011  37.6728  2383.6011  37.6728      488.1      3.9      488.1        3.9     0.0     0.0 
1 1 1   18   18   43 o    320.5    4.9 1028.0198  31.2876  1028.0198  31.2876  1028.0198  31.2876      320.5      4.9      320.5        4.9     0.0     0.0 
1 1 1   18   18   44 o    475.4    3.7 2261.0051  35.1187  2261.0051  35.1187  2261.0051  35.1187      475.4      3.7      475.4        3.7     0.0     0.0 
1 1 1   18   18   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   18   46 o    135.4    8.8  185.8098  23.6253   185.8098  23.6253   185.8098  23.6253      135.4      8.8      135.4        8.8     0.0     0.0 
1 1 1   18   18   47 o     78.6   16.6   69.5989  22.9868    69.5989  22.9868    69.5989  22.9868       78.6     16.6       78.6       16.6     0.0     0.0 
1 1 1   18   18   48 o    298.7    4.7  893.2917  28.0950   893.2917  28.0950   893.2917  28.0950      298.7      4.7      298.7        4.7     0.0     0.0 
1 1 1   18   18   49 o     20.7   14.9  -35.1187  26.1794   -35.1187  26.1794   -35.1187  26.1794       20.7     14.9       20.7       14.9     0.0     0.0 
1 1 1   18   18   50 o    235.6    5.4  556.1523  25.5409   556.1523  25.5409   556.1523  25.5409      235.6      5.4      235.6        5.4     0.0     0.0 
1 1 1   18   18   51 o    440.5    4.0 1941.7443  35.1187  1941.7443  35.1187  1941.7443  35.1187      440.5      4.0      440.5        4.0     0.0     0.0 
1 1 1   18   18   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   18   53 o     40.3   23.7   19.7942  31.9261    19.7942  31.9261    19.7942  31.9261       40.3     23.7       40.3       23.7     0.0     0.0 
1 1 1   18   18   54 o    238.8    5.6  571.4769  26.8179   571.4769  26.8179   571.4769  26.8179      238.8      5.6      238.8        5.6     0.0     0.0 
1 1 1   18   18   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   18   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   18   57 o    474.0    3.9 2248.2346  37.0343  2248.2346  37.0343  2248.2346  37.0343      474.0      3.9      474.0        3.9     0.0     0.0 
1 1 1   18   18   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   18   59 o     83.6   17.8   79.1767  26.1794    79.1767  26.1794    79.1767  26.1794       83.6     17.8       83.6       17.8     0.0     0.0 
1 1 1   18   18   60 o    186.4    7.6  349.9099  28.0950   349.9099  28.0950   349.9099  28.0950      186.4      7.6      186.4        7.6     0.0     0.0 
1 1 1   18   18   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   18   62 o    309.3    5.0  958.4210  30.6490   958.4210  30.6490   958.4210  30.6490      309.3      5.0      309.3        5.0     0.0     0.0 
1 1 1   18   18   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   18   18   64 o    324.0    4.8 1051.6451  31.2876  1051.6451  31.2876  1051.6451  31.2876      324.0      4.8      324.0        4.8     0.0     0.0 
1 1 1   18   18   65 o    150.6    9.6  230.5063  28.7335   230.5063  28.7335   230.5063  28.7335      150.6      9.6      150.6        9.6     0.0     0.0 
1 1 1   18   18   66 f    119.2   12.0  147.4985  28.0950   147.4985  28.0950   147.4985  28.0950      119.2     12.0      119.2       12.0     0.0     0.0 
1 1 1   18   18   67 o     76.2   22.7   72.7915  30.0105    72.7915  30.0105    72.7915  30.0105       76.2     22.7       76.2       22.7     0.0     0.0 
1 1 1   18   18   68 o     53.6   24.9   43.4195  29.3720    43.4195  29.3720    43.4195  29.3720       53.6     24.9       53.6       24.9     0.0     0.0 
1 1 1   18   18   69 o    230.4    6.8  533.8041  31.2876   533.8041  31.2876   533.8041  31.2876      230.4      6.8      230.4        6.8     0.0     0.0 
1 1 1   18   18   70 o     33.3   21.0    7.6623  28.7335     7.6623  28.7335     7.6623  28.7335       33.3     21.0       33.3       21.0     0.0     0.0 
1 1 1   18   18   71 o     38.1   22.3   19.1556  28.0950    19.1556  28.0950    19.1556  28.0950       38.1     22.3       38.1       22.3     0.0     0.0 
1 1 1   18   18   72 o     20.2   14.5  -37.0343  26.1794   -37.0343  26.1794   -37.0343  26.1794       20.2     14.5       20.2       14.5     0.0     0.0 
1 1 1   18   18   73 o     22.8   16.1  -26.1794  27.4564   -26.1794  27.4564   -26.1794  27.4564       22.8     16.1       22.8       16.1     0.0     0.0 
1 1 1   19    0    0 o    305.5    3.2  933.5186  19.7942   933.5186  19.7942   933.5186  19.7942      305.5      3.2      305.5        3.2     0.0     0.0 
1 1 1   19    0    1 o    227.4    2.1  517.2025   9.5778   517.2025   9.5778   517.2025   9.5778      227.4      2.1      227.4        2.1     0.0     0.0 
1 1 1   19    0    2 o   1440.3    6.8 20749.3984 196.6647 20749.3984 196.6647 20749.3984 196.6647     1440.3      6.8     1440.3        6.8     0.0     0.0 
1 1 1   19    0    3 o    903.8    4.5 8169.8843  81.7308  8169.8843  81.7308  8169.8843  81.7308      903.8      4.5      903.8        4.5     0.0     0.0 
1 1 1   19    0    4 o    159.0    2.2  252.8546   7.0237   252.8546   7.0237   252.8546   7.0237      159.0      2.2      159.0        2.2     0.0     0.0 
1 1 1   19    0    5 o    426.0    2.6 1814.6786  22.3483  1814.6786  22.3483  1814.6786  22.3483      426.0      2.6      426.0        2.6     0.0     0.0 
1 1 1   19    0    6 o   1023.5    5.0 10477.5020 102.1635 10477.5020 102.1635 10477.5020 102.1635     1023.5      5.0     1023.5        5.0     0.0     0.0 
1 1 1   19    0    7 o    796.9    4.0 6350.7358  64.4907  6350.7358  64.4907  6350.7358  64.4907      796.9      4.0      796.9        4.0     0.0     0.0 
1 1 1   19    0    8 o    164.1    2.5  269.4561   8.3008   269.4561   8.3008   269.4561   8.3008      164.1      2.5      164.1        2.5     0.0     0.0 
1 1 1   19    0    9 o    280.0    2.2  784.1046  12.1319   784.1046  12.1319   784.1046  12.1319      280.0      2.2      280.0        2.2     0.0     0.0 
1 1 1   19    0   10 o    418.2    2.6 1748.9106  21.7097  1748.9106  21.7097  1748.9106  21.7097      418.2      2.6      418.2        2.6     0.0     0.0 
1 1 1   19    0   11 o   1146.1    5.5 13138.2217 125.1502 13138.2217 125.1502 13138.2217 125.1502     1146.1      5.5     1146.1        5.5     0.0     0.0 
1 1 1   19    0   12 o    439.2    2.6 1928.9739  22.9868  1928.9739  22.9868  1928.9739  22.9868      439.2      2.6      439.2        2.6     0.0     0.0 
1 1 1   19    0   13 o    511.2    2.9 2613.4690  29.3720  2613.4690  29.3720  2613.4690  29.3720      511.2      2.9      511.2        2.9     0.0     0.0 
1 1 1   19    0   14 o    874.6    4.3 7650.7656  75.9841  7650.7656  75.9841  7650.7656  75.9841      874.6      4.3      874.6        4.3     0.0     0.0 
1 1 1   19    0   15 o    287.0    2.6  823.6929  14.6860   823.6929  14.6860   823.6929  14.6860      287.0      2.6      287.0        2.6     0.0     0.0 
1 1 1   19    0   16 o   1423.9    6.7 20279.4473 190.2794 20279.4473 190.2794 20279.4473 190.2794     1423.9      6.7     1423.9        6.7     0.0     0.0 
1 1 1   19    0   17 o   1441.0    6.8 20768.5547 196.0261 20768.5547 196.0261 20768.5547 196.0261     1441.0      6.8     1441.0        6.8     0.0     0.0 
1 1 1   19    0   18 o     18.4   12.5   -6.3852  13.4090    -6.3852  13.4090    -6.3852  13.4090       18.4     12.5       18.4       12.5     0.0     0.0 
1 1 1   19    0   19 o    799.3    4.4 6389.6860  69.5989  6389.6860  69.5989  6389.6860  69.5989      799.3      4.4      799.3        4.4     0.0     0.0 
1 1 1   19    0   20 o     38.0   13.8   19.1556   9.5778    19.1556   9.5778    19.1556   9.5778       38.0     13.8       38.0       13.8     0.0     0.0 
1 1 1   19    0   21 o    429.2    2.8 1842.7734  24.2638  1842.7734  24.2638  1842.7734  24.2638      429.2      2.8      429.2        2.8     0.0     0.0 
1 1 1   19    0   22 o    686.9    4.0 4718.6748  54.9129  4718.6748  54.9129  4718.6748  54.9129      686.9      4.0      686.9        4.0     0.0     0.0 
1 1 1   19    0   23 o   2191.0   10.5 48018.1055 459.0970 48018.1055 459.0970 48018.1055 459.0970     2191.0     10.5     2191.0       10.5     0.0     0.0 
1 1 1   19    0   24 o    235.3    3.8  554.2368  17.8786   554.2368  17.8786   554.2368  17.8786      235.3      3.8      235.3        3.8     0.0     0.0 
1 1 1   19    0   25 o    425.4    3.1 1809.5702  26.1794  1809.5702  26.1794  1809.5702  26.1794      425.4      3.1      425.4        3.1     0.0     0.0 
1 1 1   19    0   26 o   1701.3    7.9 28948.0176 269.4561 28948.0176 269.4561 28948.0176 269.4561     1701.3      7.9     1701.3        7.9     0.0     0.0 
1 1 1   19    0   27 o   1167.5    6.5 13633.7139 152.6067 13633.7139 152.6067 13633.7139 152.6067     1167.5      6.5     1167.5        6.5     0.0     0.0 
1 1 1   19    0   28 o   2342.4   14.0 54891.7891 655.1232 54891.7891 655.1232 54891.7891 655.1232     2342.4     14.0     2342.4       14.0     0.0     0.0 
1 1 1   19    0   29 o   1685.4    7.8 28411.6582 264.3480 28411.6582 264.3480 28411.6582 264.3480     1685.4      7.8     1685.4        7.8     0.0     0.0 
1 1 1   19    0   30 o    267.9    4.4  718.3369  23.6253   718.3369  23.6253   718.3369  23.6253      267.9      4.4      267.9        4.4     0.0     0.0 
1 1 1   19    0   31 o   1186.9    6.1 14089.6191 144.3059 14089.6191 144.3059 14089.6191 144.3059     1186.9      6.1     1186.9        6.1     0.0     0.0 
1 1 1   19    0   32 o   1237.7    6.7 15322.6035 165.3771 15322.6035 165.3771 15322.6035 165.3771     1237.7      6.7     1237.7        6.7     0.0     0.0 
1 1 1   19    0   33 o    485.0    3.7 2352.9521  35.7572  2352.9521  35.7572  2352.9521  35.7572      485.0      3.7      485.0        3.7     0.0     0.0 
1 1 1   19    0   34 o    144.8    8.9  211.9892  25.5409   211.9892  25.5409   211.9892  25.5409      144.8      8.9      144.8        8.9     0.0     0.0 
1 1 1   19    0   35 o   1344.4    6.5 18075.9082 174.3164 18075.9082 174.3164 18075.9082 174.3164     1344.4      6.5     1344.4        6.5     0.0     0.0 
1 1 1   19    0   36 o    449.2    3.4 2018.3669  30.6490  2018.3669  30.6490  2018.3669  30.6490      449.2      3.4      449.2        3.4     0.0     0.0 
1 1 1   19    0   37 o     48.5   22.6   34.4802  24.2638    34.4802  24.2638    34.4802  24.2638       48.5     22.6       48.5       22.6     0.0     0.0 
1 1 1   19    0   38 o    601.7    3.9 3621.0559  47.2506  3621.0559  47.2506  3621.0559  47.2506      601.7      3.9      601.7        3.9     0.0     0.0 
1 1 1   19    0   39 o    589.1    4.6 3471.0034  54.2743  3471.0034  54.2743  3471.0034  54.2743      589.1      4.6      589.1        4.6     0.0     0.0 
1 1 1   19    0   40 o     23.7   17.5 -109.8257  48.5276  -109.8257  48.5276  -109.8257  48.5276       23.7     17.5       23.7       17.5     0.0     0.0 
1 1 1   19    0   41 o     31.0   21.3  -24.2638  40.8654   -24.2638  40.8654   -24.2638  40.8654       31.0     21.3       31.0       21.3     0.0     0.0 
1 1 1   19    0   42 o   1744.7    8.2 30449.1816 284.7806 30449.1816 284.7806 30449.1816 284.7806     1744.7      8.2     1744.7        8.2     0.0     0.0 
1 1 1   19    0   43 o    279.5    5.8  782.1890  32.5646   782.1890  32.5646   782.1890  32.5646      279.5      5.8      279.5        5.8     0.0     0.0 
1 1 1   19    0   44 o    430.0    4.2 1849.7972  35.7572  1849.7972  35.7572  1849.7972  35.7572      430.0      4.2      430.0        4.2     0.0     0.0 
1 1 1   19    0   45 o    187.9    6.5  354.3795  24.2638   354.3795  24.2638   354.3795  24.2638      187.9      6.5      187.9        6.5     0.0     0.0 
1 1 1   19    0   46 o    326.0    4.5 1063.7771  29.3720  1063.7771  29.3720  1063.7771  29.3720      326.0      4.5      326.0        4.5     0.0     0.0 
1 1 1   19    0   47 o    295.8    5.3  876.0516  31.2876   876.0516  31.2876   876.0516  31.2876      295.8      5.3      295.8        5.3     0.0     0.0 
1 1 1   19    0   48 o    586.9    3.9 3445.4626  45.9736  3445.4626  45.9736  3445.4626  45.9736      586.9      3.9      586.9        3.9     0.0     0.0 
1 1 1   19    0   49 o    935.3    4.8 8750.9385  90.6701  8750.9385  90.6701  8750.9385  90.6701      935.3      4.8      935.3        4.8     0.0     0.0 
1 1 1   19    0   50 o    404.5    3.9 1637.1694  31.9261  1637.1694  31.9261  1637.1694  31.9261      404.5      3.9      404.5        3.9     0.0     0.0 
1 1 1   19    0   51 o    108.9   12.3  123.2347  26.1794   123.2347  26.1794   123.2347  26.1794      108.9     12.3      108.9       12.3     0.0     0.0 
1 1 1   19    0   52 o    542.5    3.8 2943.5847  40.8654  2943.5847  40.8654  2943.5847  40.8654      542.5      3.8      542.5        3.8     0.0     0.0 
1 1 1   19    0   53 o    614.9    3.9 3781.9636  48.5276  3781.9636  48.5276  3781.9636  48.5276      614.9      3.9      614.9        3.9     0.0     0.0 
1 1 1   19    0   54 o    528.9    3.7 2798.6401  39.5883  2798.6401  39.5883  2798.6401  39.5883      528.9      3.7      528.9        3.7     0.0     0.0 
1 1 1   19    0   55 o    124.5   10.4  158.3534  25.5409   158.3534  25.5409   158.3534  25.5409      124.5     10.4      124.5       10.4     0.0     0.0 
1 1 1   19    0   56 o    190.6    7.2  365.2344  27.4564   365.2344  27.4564   365.2344  27.4564      190.6      7.2      190.6        7.2     0.0     0.0 
1 1 1   19    0   57 o    157.1    9.2  249.6619  28.7335   249.6619  28.7335   249.6619  28.7335      157.1      9.2      157.1        9.2     0.0     0.0 
1 1 1   19    0   58 o    392.8    3.9 1543.9453  30.6490  1543.9453  30.6490  1543.9453  30.6490      392.8      3.9      392.8        3.9     0.0     0.0 
1 1 1   19    0   59 o    358.7    4.2 1287.8981  30.0105  1287.8981  30.0105  1287.8981  30.0105      358.7      4.2      358.7        4.2     0.0     0.0 
1 1 1   19    0   60 o    212.9    6.0  454.6274  25.5409   454.6274  25.5409   454.6274  25.5409      212.9      6.0      212.9        6.0     0.0     0.0 
1 1 1   19    0   61 o    457.3    4.1 2092.4355  37.6728  2092.4355  37.6728  2092.4355  37.6728      457.3      4.1      457.3        4.1     0.0     0.0 
1 1 1   19    0   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    0   63 o    347.5    4.4 1208.7214  30.6490  1208.7214  30.6490  1208.7214  30.6490      347.5      4.4      347.5        4.4     0.0     0.0 
1 1 1   19    0   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    0   65 o     88.9   18.8   89.3930  29.3720    89.3930  29.3720    89.3930  29.3720       88.9     18.8       88.9       18.8     0.0     0.0 
1 1 1   19    0   66 o    313.6    4.7  984.6003  29.3720   984.6003  29.3720   984.6003  29.3720      313.6      4.7      313.6        4.7     0.0     0.0 
1 1 1   19    0   67 o    193.3    7.8  376.0892  30.0105   376.0892  30.0105   376.0892  30.0105      193.3      7.8      193.3        7.8     0.0     0.0 
1 1 1   19    0   68 o    376.5    4.5 1418.7950  33.8416  1418.7950  33.8416  1418.7950  33.8416      376.5      4.5      376.5        4.5     0.0     0.0 
1 1 1   19    0   69 o    101.2   16.6  109.8257  31.2876   109.8257  31.2876   109.8257  31.2876      101.2     16.6      101.2       16.6     0.0     0.0 
1 1 1   19    0   70 o    165.7    9.5  278.3954  31.2876   278.3954  31.2876   278.3954  31.2876      165.7      9.5      165.7        9.5     0.0     0.0 
1 1 1   19    0   71 o     94.3   16.7   97.0553  28.7335    97.0553  28.7335    97.0553  28.7335       94.3     16.7       94.3       16.7     0.0     0.0 
1 1 1   19    0   72 o     30.6   20.3   -4.4697  31.2876    -4.4697  31.2876    -4.4697  31.2876       30.6     20.3       30.6       20.3     0.0     0.0 
1 1 1   19    0   73 o     21.4   15.3  -32.5646  26.8179   -32.5646  26.8179   -32.5646  26.8179       21.4     15.3       21.4       15.3     0.0     0.0 
1 1 1   19    0   74 o     21.6   15.6  -47.8891  31.2876   -47.8891  31.2876   -47.8891  31.2876       21.6     15.6       21.6       15.6     0.0     0.0 
1 1 1   19    0   75 o    264.9    5.9  704.2894  31.2876   704.2894  31.2876   704.2894  31.2876      264.9      5.9      264.9        5.9     0.0     0.0 
1 1 1   19    0   76 o    168.1    8.4  286.0577  28.0950   286.0577  28.0950   286.0577  28.0950      168.1      8.4      168.1        8.4     0.0     0.0 
1 1 1   19    0   77 o    320.3    4.8 1028.6583  30.6490  1028.6583  30.6490  1028.6583  30.6490      320.3      4.8      320.3        4.8     0.0     0.0 
1 1 1   19    0   78 o     24.5   17.1  -23.6253  29.3720   -23.6253  29.3720   -23.6253  29.3720       24.5     17.1       24.5       17.1     0.0     0.0 
1 1 1   19    0   79 o    340.2    4.6 1160.1937  31.2876  1160.1937  31.2876  1160.1937  31.2876      340.2      4.6      340.2        4.6     0.0     0.0 
1 1 1   19    1    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    1    1 o    785.8    2.8    0.0000   0.0000          ?        ?  6175.1426  44.0580          ?        ?      785.8        2.8       ?       ? 
1 1 1   19    1    2 o    385.7    1.7    0.0000   0.0000          ?        ?  1487.7554  13.4090          ?        ?      385.7        1.7       ?       ? 
1 1 1   19    1    3 o    485.2    2.0    0.0000   0.0000          ?        ?  2354.2292  19.1556          ?        ?      485.2        2.0       ?       ? 
1 1 1   19    1    4 o    111.3    2.0    0.0000   0.0000          ?        ?   123.8732   4.4697          ?        ?      111.3        2.0       ?       ? 
1 1 1   19    1    5 o    874.8    3.1    0.0000   0.0000          ?        ?  7653.3198  54.2743          ?        ?      874.8        3.1       ?       ? 
1 1 1   19    1    6 o    262.0    1.5    0.0000   0.0000          ?        ?   686.4108   7.6623          ?        ?      262.0        1.5       ?       ? 
1 1 1   19    1    7 o    603.0    2.3    0.0000   0.0000          ?        ?  3636.3806  27.4564          ?        ?      603.0        2.3       ?       ? 
1 1 1   19    1    8 o    862.8    3.0    0.0000   0.0000          ?        ?  7445.1621  52.3588          ?        ?      862.8        3.0       ?       ? 
1 1 1   19    1    9 o    689.0    2.5    0.0000   0.0000          ?        ?  4746.7700  34.4802          ?        ?      689.0        2.5       ?       ? 
1 1 1   19    1   10 o    149.9    1.9    0.0000   0.0000          ?        ?   224.7596   5.7467          ?        ?      149.9        1.9       ?       ? 
1 1 1   19    1   11 f    302.7    1.6    0.0000   0.0000          ?        ?   916.2786   9.5778          ?        ?      302.7        1.6       ?       ? 
1 1 1   19    1   12 o   1577.8    5.2    0.0000   0.0000          ?        ? 24899.1504 164.1001          ?        ?     1577.8        5.2       ?       ? 
1 1 1   19    1   13 o    890.8    3.2    0.0000   0.0000          ?        ?  7935.5469  56.1899          ?        ?      890.8        3.2       ?       ? 
1 1 1   19    1   14 o    164.9    2.3    0.0000   0.0000          ?        ?   272.0102   7.6623          ?        ?      164.9        2.3       ?       ? 
1 1 1   19    1   15 o    891.8    3.2    0.0000   0.0000          ?        ?  7954.0635  57.4669          ?        ?      891.8        3.2       ?       ? 
1 1 1   19    1   16 o    737.6    2.7    0.0000   0.0000          ?        ?  5440.8428  40.2269          ?        ?      737.6        2.7       ?       ? 
1 1 1   19    1   17 o   1569.9    5.2    0.0000   0.0000          ?        ? 24649.4883 163.4615          ?        ?     1569.9        5.2       ?       ? 
1 1 1   19    1   18 o    775.6    2.8    0.0000   0.0000          ?        ?  6016.1509  43.4195          ?        ?      775.6        2.8       ?       ? 
1 1 1   19    1   19 o    697.4    2.7    0.0000   0.0000          ?        ?  4864.2578  37.0343          ?        ?      697.4        2.7       ?       ? 
1 1 1   19    1   20 o    401.6    2.1    0.0000   0.0000          ?        ?  1612.9056  16.6016          ?        ?      401.6        2.1       ?       ? 
1 1 1   19    1   21 o    786.5    3.0    0.0000   0.0000          ?        ?  6185.3589  47.8891          ?        ?      786.5        3.0       ?       ? 
1 1 1   19    1   22 o    228.3    2.2    0.0000   0.0000          ?        ?   521.0336  10.2163          ?        ?      228.3        2.2       ?       ? 
1 1 1   19    1   23 o   1355.0    4.5    0.0000   0.0000          ?        ? 18360.6895 123.2347          ?        ?     1355.0        4.5       ?       ? 
1 1 1   19    1   24 o   1226.0    4.3    0.0000   0.0000          ?        ? 15032.0762 104.7175          ?        ?     1226.0        4.3       ?       ? 
1 1 1   19    1   25 o   2037.3    7.4    0.0000   0.0000          ?        ? 41511.5703 302.6593          ?        ?     2037.3        7.4       ?       ? 
1 1 1   19    1   26 o   1251.2    4.3    0.0000   0.0000          ?        ? 15656.5498 107.2716          ?        ?     1251.2        4.3       ?       ? 
1 1 1   19    1   27 o   1351.8    4.5    0.0000   0.0000          ?        ? 18275.7656 122.5962          ?        ?     1351.8        4.5       ?       ? 
1 1 1   19    1   28 o    260.0    2.8    0.0000   0.0000          ?        ?   676.1944  14.6860          ?        ?      260.0        2.8       ?       ? 
1 1 1   19    1   29 o    698.3    2.8    0.0000   0.0000          ?        ?  4875.7510  38.9498          ?        ?      698.3        2.8       ?       ? 
1 1 1   19    1   30 o   1600.6    5.5    0.0000   0.0000          ?        ? 25621.3203 176.8705          ?        ?     1600.6        5.5       ?       ? 
1 1 1   19    1   31 o    498.9    2.6    0.0000   0.0000          ?        ?  2488.9573  25.5409          ?        ?      498.9        2.6       ?       ? 
1 1 1   19    1   32 o   1141.4    4.2    0.0000   0.0000          ?        ? 13029.6719  95.7782          ?        ?     1141.4        4.2       ?       ? 
1 1 1   19    1   33 o    210.3    3.8    0.0000   0.0000          ?        ?   442.4955  15.9630          ?        ?      210.3        3.8       ?       ? 
1 1 1   19    1   34 o    600.7    2.6    0.0000   0.0000          ?        ?  3608.9243  30.6490          ?        ?      600.7        2.6       ?       ? 
1 1 1   19    1   35 o    742.4    2.9    0.0000   0.0000          ?        ?  5512.3569  42.7809          ?        ?      742.4        2.9       ?       ? 
1 1 1   19    1   36 o   1203.4    4.2    0.0000   0.0000          ?        ? 14482.9473 101.5249          ?        ?     1203.4        4.2       ?       ? 
1 1 1   19    1   37 o    506.2    2.7    0.0000   0.0000          ?        ?  2562.3872  27.4564          ?        ?      506.2        2.7       ?       ? 
1 1 1   19    1   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    1   39 o   1304.8    4.9    0.0000   0.0000          ?        ? 17026.8184 128.9814          ?        ?     1304.8        4.9       ?       ? 
1 1 1   19    1   40 o    959.9    3.6    0.0000   0.0000          ?        ?  9214.5059  68.3218          ?        ?      959.9        3.6       ?       ? 
1 1 1   19    1   41 o   1265.1    4.5    0.0000   0.0000          ?        ? 16006.4600 113.0183          ?        ?     1265.1        4.5       ?       ? 
1 1 1   19    1   42 o   1654.0    5.4    0.0000   0.0000          ?        ? 27362.5664 180.0631          ?        ?     1654.0        5.4       ?       ? 
1 1 1   19    1   43 o    164.5    6.4    0.0000   0.0000          ?        ?   270.7332  21.0712          ?        ?      164.5        6.4       ?       ? 
1 1 1   19    1   44 o    528.9    2.7    0.0000   0.0000          ?        ?  2797.3633  28.0950          ?        ?      528.9        2.7       ?       ? 
1 1 1   19    1   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    1   46 o    509.1    3.0    0.0000   0.0000          ?        ?  2592.3977  30.6490          ?        ?      509.1        3.0       ?       ? 
1 1 1   19    1   47 o    311.2    3.2    0.0000   0.0000          ?        ?   968.6373  19.7942          ?        ?      311.2        3.2       ?       ? 
1 1 1   19    1   48 o    231.3    4.4    0.0000   0.0000          ?        ?   535.0811  20.4327          ?        ?      231.3        4.4       ?       ? 
1 1 1   19    1   49 o    249.0    4.0    0.0000   0.0000          ?        ?   620.0045  19.7942          ?        ?      249.0        4.0       ?       ? 
1 1 1   19    1   50 o    375.8    2.9    0.0000   0.0000          ?        ?  1412.4098  21.7097          ?        ?      375.8        2.9       ?       ? 
1 1 1   19    1   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    1   52 o    311.1    3.2    0.0000   0.0000          ?        ?   967.9988  19.7942          ?        ?      311.1        3.2       ?       ? 
1 1 1   19    1   53 o    257.8    3.8    0.0000   0.0000          ?        ?   664.7010  19.7942          ?        ?      257.8        3.8       ?       ? 
1 1 1   19    1   54 o    316.0    3.1    0.0000   0.0000          ?        ?   998.6478  19.7942          ?        ?      316.0        3.1       ?       ? 
1 1 1   19    1   55 o    281.9    3.4    0.0000   0.0000          ?        ?   794.9594  19.1556          ?        ?      281.9        3.4       ?       ? 
1 1 1   19    1   56 o    150.5    5.9    0.0000   0.0000          ?        ?   226.6752  17.8786          ?        ?      150.5        5.9       ?       ? 
1 1 1   19    1   57 o    286.2    3.5    0.0000   0.0000          ?        ?   819.2233  19.7942          ?        ?      286.2        3.5       ?       ? 
1 1 1   19    1   58 o    209.8    4.4    0.0000   0.0000          ?        ?   440.5799  18.5171          ?        ?      209.8        4.4       ?       ? 
1 1 1   19    1   59 o    262.3    3.8    0.0000   0.0000          ?        ?   688.3264  19.7942          ?        ?      262.3        3.8       ?       ? 
1 1 1   19    1   60 o    118.1    8.1    0.0000   0.0000          ?        ?   139.8362  19.1556          ?        ?      118.1        8.1       ?       ? 
1 1 1   19    1   61 o    156.1    5.9    0.0000   0.0000          ?        ?   243.9153  18.5171          ?        ?      156.1        5.9       ?       ? 
1 1 1   19    1   62 o    120.7    7.9    0.0000   0.0000          ?        ?   146.2215  19.1556          ?        ?      120.7        7.9       ?       ? 
1 1 1   19    1   63 o    105.2    9.1    0.0000   0.0000          ?        ?   111.1028  19.1556          ?        ?      105.2        9.1       ?       ? 
1 1 1   19    1   64 o     98.6   10.0    0.0000   0.0000          ?        ?    97.6938  19.7942          ?        ?       98.6       10.0       ?       ? 
1 1 1   19    1   65 o    169.1    5.9    0.0000   0.0000          ?        ?   286.6962  19.7942          ?        ?      169.1        5.9       ?       ? 
1 1 1   19    1   66 o    119.6    8.5    0.0000   0.0000          ?        ?   143.6674  20.4327          ?        ?      119.6        8.5       ?       ? 
1 1 1   19    1   67 o    337.5    3.4    0.0000   0.0000          ?        ?  1139.7611  22.9868          ?        ?      337.5        3.4       ?       ? 
1 1 1   19    1   68 o    136.5    7.5    0.0000   0.0000          ?        ?   187.0868  20.4327          ?        ?      136.5        7.5       ?       ? 
1 1 1   19    1   69 o    253.6    4.3    0.0000   0.0000          ?        ?   644.2683  21.7097          ?        ?      253.6        4.3       ?       ? 
1 1 1   19    1   70 o     98.1   10.7    0.0000   0.0000          ?        ?    97.0553  21.0712          ?        ?       98.1       10.7       ?       ? 
1 1 1   19    1   71 o    233.8    4.6    0.0000   0.0000          ?        ?   547.8516  21.7097          ?        ?      233.8        4.6       ?       ? 
1 1 1   19    1   72 o     27.7   13.3    0.0000   0.0000          ?        ?   -31.9261  21.7097          ?        ?       27.7       13.3       ?       ? 
1 1 1   19    1   73 o    245.4    4.3    0.0000   0.0000          ?        ?   603.4030  21.0712          ?        ?      245.4        4.3       ?       ? 
1 1 1   19    1   74 o     23.6   11.7    0.0000   0.0000          ?        ?   -45.9736  20.4327          ?        ?       23.6       11.7       ?       ? 
1 1 1   19    1   75 o    212.0    5.1    0.0000   0.0000          ?        ?   450.7963  21.7097          ?        ?      212.0        5.1       ?       ? 
1 1 1   19    1   76 o    272.1    4.0    0.0000   0.0000          ?        ?   741.9621  21.7097          ?        ?      272.1        4.0       ?       ? 
1 1 1   19    1   77 o     80.1   14.5    0.0000   0.0000          ?        ?    68.3218  22.3483          ?        ?       80.1       14.5       ?       ? 
1 1 1   19    1   78 f    138.2    6.9    0.0000   0.0000          ?        ?   192.8335  19.1556          ?        ?      138.2        6.9       ?       ? 
1 1 1   19    1   79 o    171.7    5.8    0.0000   0.0000          ?        ?   296.9126  19.7942          ?        ?      171.7        5.8       ?       ? 
1 1 1   19    2    0 o    553.8    3.1 3066.8193  33.8416  3066.8193  33.8416  3066.8193  33.8416      553.8      3.1      553.8        3.1     0.0     0.0 
1 1 1   19    2    1 o   1100.8    3.8    0.0000   0.0000          ?        ? 12117.8633  83.0078          ?        ?     1100.8        3.8       ?       ? 
1 1 1   19    2    2 o    737.9    2.7    0.0000   0.0000          ?        ?  5444.6738  39.5883          ?        ?      737.9        2.7       ?       ? 
1 1 1   19    2    3 o   1020.3    3.5    0.0000   0.0000          ?        ? 10409.8184  72.1529          ?        ?     1020.3        3.5       ?       ? 
1 1 1   19    2    4 o    243.8    1.4    0.0000   0.0000          ?        ?   594.4636   7.0237          ?        ?      243.8        1.4       ?       ? 
1 1 1   19    2    5 o    328.5    1.6    0.0000   0.0000          ?        ?  1079.1016  10.2163          ?        ?      328.5        1.6       ?       ? 
1 1 1   19    2    6 o    241.2    1.5    0.0000   0.0000          ?        ?   581.6932   7.0237          ?        ?      241.2        1.5       ?       ? 
1 1 1   19    2    7 o    291.0    1.6    0.0000   0.0000          ?        ?   846.6797   9.5778          ?        ?      291.0        1.6       ?       ? 
1 1 1   19    2    8 o    831.5    3.0    0.0000   0.0000          ?        ?  6913.9126  49.1662          ?        ?      831.5        3.0       ?       ? 
1 1 1   19    2    9 o   1595.4    5.3    0.0000   0.0000          ?        ? 25457.2188 167.9312          ?        ?     1595.4        5.3       ?       ? 
1 1 1   19    2   10 o   1523.0    5.1    0.0000   0.0000          ?        ? 23197.4902 153.8837          ?        ?     1523.0        5.1       ?       ? 
1 1 1   19    2   11 o    950.2    3.3    0.0000   0.0000          ?        ?  9028.6953  62.5751          ?        ?      950.2        3.3       ?       ? 
1 1 1   19    2   12 o    529.7    2.1    0.0000   0.0000          ?        ?  2806.3025  22.3483          ?        ?      529.7        2.1       ?       ? 
1 1 1   19    2   13 o    915.4    3.2    0.0000   0.0000          ?        ?  8379.3193  58.7440          ?        ?      915.4        3.2       ?       ? 
1 1 1   19    2   14 o     88.3    3.3    0.0000   0.0000          ?        ?    77.8996   5.7467          ?        ?       88.3        3.3       ?       ? 
1 1 1   19    2   15 o    316.1    1.8    0.0000   0.0000          ?        ?   999.2863  11.4934          ?        ?      316.1        1.8       ?       ? 
1 1 1   19    2   16 o    295.1    1.8    0.0000   0.0000          ?        ?   870.9435  10.8549          ?        ?      295.1        1.8       ?       ? 
1 1 1   19    2   17 o   1278.6    4.3    0.0000   0.0000          ?        ? 16348.7070 110.4642          ?        ?     1278.6        4.3       ?       ? 
1 1 1   19    2   18 o    698.2    2.7    0.0000   0.0000          ?        ?  4875.1128  37.0343          ?        ?      698.2        2.7       ?       ? 
1 1 1   19    2   19 o   2065.2    6.7    0.0000   0.0000          ?        ? 42656.4375 276.4799          ?        ?     2065.2        6.7       ?       ? 
1 1 1   19    2   20 o   2059.3    6.7    0.0000   0.0000          ?        ? 42415.7148 275.2028          ?        ?     2059.3        6.7       ?       ? 
1 1 1   19    2   21 o   1090.0    4.0    0.0000   0.0000          ?        ? 11881.6104  88.1160          ?        ?     1090.0        4.0       ?       ? 
1 1 1   19    2   22 o   2447.9    7.8    0.0000   0.0000          ?        ? 59936.1094 383.7515          ?        ?     2447.9        7.8       ?       ? 
1 1 1   19    2   23 f    855.8    3.1    0.0000   0.0000          ?        ?  7323.8433  52.9973          ?        ?      855.8        3.1       ?       ? 
1 1 1   19    2   24 o    652.9    2.7    0.0000   0.0000          ?        ?  4262.7700  35.7572          ?        ?      652.9        2.7       ?       ? 
1 1 1   19    2   25 o    908.5    3.3    0.0000   0.0000          ?        ?  8254.1689  60.6596          ?        ?      908.5        3.3       ?       ? 
1 1 1   19    2   26 o    768.5    2.9    0.0000   0.0000          ?        ?  5905.6865  44.6965          ?        ?      768.5        2.9       ?       ? 
1 1 1   19    2   27 o    632.2    2.6    0.0000   0.0000          ?        ?  3997.1453  33.2031          ?        ?      632.2        2.6       ?       ? 
1 1 1   19    2   28 o   1168.5    4.0    0.0000   0.0000          ?        ? 13654.1455  94.5012          ?        ?     1168.5        4.0       ?       ? 
1 1 1   19    2   29 o    529.7    2.5    0.0000   0.0000          ?        ?  2805.6641  26.1794          ?        ?      529.7        2.5       ?       ? 
1 1 1   19    2   30 o    904.4    3.5    0.0000   0.0000          ?        ?  8179.4619  63.8522          ?        ?      904.4        3.5       ?       ? 
1 1 1   19    2   31 o    784.3    3.3    0.0000   0.0000          ?        ?  6151.5176  51.7203          ?        ?      784.3        3.3       ?       ? 
1 1 1   19    2   32 o   1104.2    4.0    0.0000   0.0000          ?        ? 12193.2090  89.3930          ?        ?     1104.2        4.0       ?       ? 
1 1 1   19    2   33 o    719.9    2.9    0.0000   0.0000          ?        ?  5182.2412  42.1424          ?        ?      719.9        2.9       ?       ? 
1 1 1   19    2   34 o   1441.9    4.8    0.0000   0.0000          ?        ? 20792.1797 139.8362          ?        ?     1441.9        4.8       ?       ? 
1 1 1   19    2   35 o   1065.9    3.9    0.0000   0.0000          ?        ? 11361.2158  83.6463          ?        ?     1065.9        3.9       ?       ? 
1 1 1   19    2   36 o   1446.3    4.9    0.0000   0.0000          ?        ? 20920.5215 140.4748          ?        ?     1446.3        4.9       ?       ? 
1 1 1   19    2   37 o   1197.8    4.1    0.0000   0.0000          ?        ? 14349.4971  98.9709          ?        ?     1197.8        4.1       ?       ? 
1 1 1   19    2   38 o    428.5    2.7    0.0000   0.0000          ?        ?  1836.3882  22.9868          ?        ?      428.5        2.7       ?       ? 
1 1 1   19    2   39 o    415.7    2.8    0.0000   0.0000          ?        ?  1728.4781  23.6253          ?        ?      415.7        2.8       ?       ? 
1 1 1   19    2   40 o    464.8    2.9    0.0000   0.0000          ?        ?  2160.1187  26.8179          ?        ?      464.8        2.9       ?       ? 
1 1 1   19    2   41 o    539.8    3.0    0.0000   0.0000          ?        ?  2913.5742  31.9261          ?        ?      539.8        3.0       ?       ? 
1 1 1   19    2   42 o    325.4    3.4    0.0000   0.0000          ?        ?  1058.6688  22.3483          ?        ?      325.4        3.4       ?       ? 
1 1 1   19    2   43 o   1098.4    3.9    0.0000   0.0000          ?        ? 12065.5049  85.5619          ?        ?     1098.4        3.9       ?       ? 
1 1 1   19    2   44 o    233.6    4.1    0.0000   0.0000          ?        ?   545.9360  19.1556          ?        ?      233.6        4.1       ?       ? 
1 1 1   19    2   45 o    622.3    2.9    0.0000   0.0000          ?        ?  3872.6335  36.3957          ?        ?      622.3        2.9       ?       ? 
1 1 1   19    2   46 o    498.2    2.7    0.0000   0.0000          ?        ?  2482.5720  26.8179          ?        ?      498.2        2.7       ?       ? 
1 1 1   19    2   47 o    382.5    2.9    0.0000   0.0000          ?        ?  1463.4916  22.3483          ?        ?      382.5        2.9       ?       ? 
1 1 1   19    2   48 o    686.3    2.8    0.0000   0.0000          ?        ?  4710.3740  38.9498          ?        ?      686.3        2.8       ?       ? 
1 1 1   19    2   49 o   1099.4    3.9    0.0000   0.0000          ?        ? 12089.7686  84.9234          ?        ?     1099.4        3.9       ?       ? 
1 1 1   19    2   50 o     29.9   13.8    0.0000   0.0000          ?        ?   -15.3245  19.1556          ?        ?       29.9       13.8       ?       ? 
1 1 1   19    2   51 o     86.7    9.9    0.0000   0.0000          ?        ?    75.3456  17.2401          ?        ?       86.7        9.9       ?       ? 
1 1 1   19    2   52 o    168.5    5.5    0.0000   0.0000          ?        ?   284.1421  18.5171          ?        ?      168.5        5.5       ?       ? 
1 1 1   19    2   53 o    126.8    7.6    0.0000   0.0000          ?        ?   160.9075  19.1556          ?        ?      126.8        7.6       ?       ? 
1 1 1   19    2   54 o    507.9    2.6    0.0000   0.0000          ?        ?  2580.2659  26.8179          ?        ?      507.9        2.6       ?       ? 
1 1 1   19    2   55 o    229.9    4.2    0.0000   0.0000          ?        ?   528.6959  19.1556          ?        ?      229.9        4.2       ?       ? 
1 1 1   19    2   56 o    266.3    3.6    0.0000   0.0000          ?        ?   709.3975  19.1556          ?        ?      266.3        3.6       ?       ? 
1 1 1   19    2   57 o    182.5    5.2    0.0000   0.0000          ?        ?   333.3083  19.1556          ?        ?      182.5        5.2       ?       ? 
1 1 1   19    2   58 o    458.6    2.7    0.0000   0.0000          ?        ?  2103.2903  24.9023          ?        ?      458.6        2.7       ?       ? 
1 1 1   19    2   59 o    500.0    2.7    0.0000   0.0000          ?        ?  2500.4507  26.8179          ?        ?      500.0        2.7       ?       ? 
1 1 1   19    2   60 o    253.7    3.9    0.0000   0.0000          ?        ?   644.2683  19.7942          ?        ?      253.7        3.9       ?       ? 
1 1 1   19    2   61 o    491.9    2.7    0.0000   0.0000          ?        ?  2420.6355  26.8179          ?        ?      491.9        2.7       ?       ? 
1 1 1   19    2   62 o    164.6    5.6    0.0000   0.0000          ?        ?   271.3717  18.5171          ?        ?      164.6        5.6       ?       ? 
1 1 1   19    2   63 o    162.2    6.3    0.0000   0.0000          ?        ?   263.7094  20.4327          ?        ?      162.2        6.3       ?       ? 
1 1 1   19    2   64 o    273.8    3.7    0.0000   0.0000          ?        ?   750.2629  20.4327          ?        ?      273.8        3.7       ?       ? 
1 1 1   19    2   65 f    272.5    3.9    0.0000   0.0000          ?        ?   743.2392  21.0712          ?        ?      272.5        3.9       ?       ? 
1 1 1   19    2   66 o     21.7   10.8    0.0000   0.0000          ?        ?   -54.9129  19.7942          ?        ?       21.7       10.8       ?       ? 
1 1 1   19    2   67 o    115.5    9.4    0.0000   0.0000          ?        ?   134.0895  21.7097          ?        ?      115.5        9.4       ?       ? 
1 1 1   19    2   68 o    401.9    3.0    0.0000   0.0000          ?        ?  1616.0983  24.2638          ?        ?      401.9        3.0       ?       ? 
1 1 1   19    2   69 o     21.6   10.8    0.0000   0.0000          ?        ?   -55.5514  19.7942          ?        ?       21.6       10.8       ?       ? 
1 1 1   19    2   70 o    286.1    4.0    0.0000   0.0000          ?        ?   819.8618  22.9868          ?        ?      286.1        4.0       ?       ? 
1 1 1   19    2   71 o     38.4   16.2    0.0000   0.0000          ?        ?     2.5541  21.0712          ?        ?       38.4       16.2       ?       ? 
1 1 1   19    2   72 o    149.5    7.0    0.0000   0.0000          ?        ?   224.7596  21.0712          ?        ?      149.5        7.0       ?       ? 
1 1 1   19    2   73 o    186.7    5.5    0.0000   0.0000          ?        ?   349.9099  20.4327          ?        ?      186.7        5.5       ?       ? 
1 1 1   19    2   74 o    239.8    4.4    0.0000   0.0000          ?        ?   576.5850  21.0712          ?        ?      239.8        4.4       ?       ? 
1 1 1   19    2   75 o    160.1    6.6    0.0000   0.0000          ?        ?   257.9627  21.0712          ?        ?      160.1        6.6       ?       ? 
1 1 1   19    2   76 o     46.6   16.9    0.0000   0.0000          ?        ?    19.1556  20.4327          ?        ?       46.6       16.9       ?       ? 
1 1 1   19    2   77 o    102.5   10.9    0.0000   0.0000          ?        ?   107.2716  22.3483          ?        ?      102.5       10.9       ?       ? 
1 1 1   19    2   78 o    199.7    5.4    0.0000   0.0000          ?        ?   400.9916  21.7097          ?        ?      199.7        5.4       ?       ? 
1 1 1   19    3    0 o    479.8    2.7 2301.8704  26.1794  2301.8704  26.1794  2301.8704  26.1794      479.8      2.7      479.8        2.7     0.0     0.0 
1 1 1   19    3    1 f    754.2    2.7    0.0000   0.0000          ?        ?  5688.5894  40.8654          ?        ?      754.2        2.7       ?       ? 
1 1 1   19    3    2 o   1599.2    5.2    0.0000   0.0000          ?        ? 25576.6230 167.2927          ?        ?     1599.2        5.2       ?       ? 
1 1 1   19    3    3 o    104.5    2.1    0.0000   0.0000          ?        ?   109.1872   4.4697          ?        ?      104.5        2.1       ?       ? 
1 1 1   19    3    4 o    517.2    2.0    0.0000   0.0000          ?        ?  2674.7671  21.0712          ?        ?      517.2        2.0       ?       ? 
1 1 1   19    3    5 o   1015.4    3.5    0.0000   0.0000          ?        ? 10310.8477  71.5144          ?        ?     1015.4        3.5       ?       ? 
1 1 1   19    3    6 o    314.3    1.5    0.0000   0.0000          ?        ?   987.7929   9.5778          ?        ?      314.3        1.5       ?       ? 
1 1 1   19    3    7 o    511.5    2.1    0.0000   0.0000          ?        ?  2616.6616  21.0712          ?        ?      511.5        2.1       ?       ? 
1 1 1   19    3    8 o    285.3    1.7    0.0000   0.0000          ?        ?   814.1151   9.5778          ?        ?      285.3        1.7       ?       ? 
1 1 1   19    3    9 o    962.7    3.3    0.0000   0.0000          ?        ?  9267.5029  63.8522          ?        ?      962.7        3.3       ?       ? 
1 1 1   19    3   10 o   1004.4    3.5    0.0000   0.0000          ?        ? 10088.6416  69.5989          ?        ?     1004.4        3.5       ?       ? 
1 1 1   19    3   11 o    698.8    2.6    0.0000   0.0000          ?        ?  4882.7749  36.3957          ?        ?      698.8        2.6       ?       ? 
1 1 1   19    3   12 o   1375.0    4.6    0.0000   0.0000          ?        ? 18907.9023 125.7888          ?        ?     1375.0        4.6       ?       ? 
1 1 1   19    3   13 o    540.4    2.2    0.0000   0.0000          ?        ?  2919.9592  23.6253          ?        ?      540.4        2.2       ?       ? 
1 1 1   19    3   14 f    688.2    2.6    0.0000   0.0000          ?        ?  4736.5532  35.1187          ?        ?      688.2        2.6       ?       ? 
1 1 1   19    3   15 o    617.3    2.4    0.0000   0.0000          ?        ?  3810.6970  30.0105          ?        ?      617.3        2.4       ?       ? 
1 1 1   19    3   16 o   1152.9    3.9    0.0000   0.0000          ?        ? 13292.7432  90.6701          ?        ?     1152.9        3.9       ?       ? 
1 1 1   19    3   17 o   1333.5    4.5    0.0000   0.0000          ?        ? 17783.4668 118.7650          ?        ?     1333.5        4.5       ?       ? 
1 1 1   19    3   18 f   1687.7    5.5    0.0000   0.0000          ?        ? 28485.7285 186.4483          ?        ?     1687.7        5.5       ?       ? 
1 1 1   19    3   19 o    764.6    2.8    0.0000   0.0000          ?        ?  5845.6655  42.7809          ?        ?      764.6        2.8       ?       ? 
1 1 1   19    3   20 o   1244.3    4.6    0.0000   0.0000          ?        ? 15482.8730 115.5724          ?        ?     1244.3        4.6       ?       ? 
1 1 1   19    3   21 f    300.6    1.9    0.0000   0.0000          ?        ?   903.5081  11.4934          ?        ?      300.6        1.9       ?       ? 
1 1 1   19    3   22 o   1638.6    5.4    0.0000   0.0000          ?        ? 26853.0273 177.5090          ?        ?     1638.6        5.4       ?       ? 
1 1 1   19    3   23 f    676.9    2.8    0.0000   0.0000          ?        ?  4582.0312  38.3113          ?        ?      676.9        2.8       ?       ? 
1 1 1   19    3   24 o   1783.4    6.1    0.0000   0.0000          ?        ? 31809.8691 217.7359          ?        ?     1783.4        6.1       ?       ? 
1 1 1   19    3   25 o   2164.9    7.0    0.0000   0.0000          ?        ? 46874.5117 302.6593          ?        ?     2164.9        7.0       ?       ? 
1 1 1   19    3   26 o    444.6    2.2    0.0000   0.0000          ?        ?  1976.8630  19.7942          ?        ?      444.6        2.2       ?       ? 
1 1 1   19    3   27 o    391.1    2.1    0.0000   0.0000          ?        ?  1529.2593  16.6016          ?        ?      391.1        2.1       ?       ? 
1 1 1   19    3   28 f     58.2   15.2    0.0000   0.0000          ?        ?    35.1187  17.8786          ?        ?       58.2       15.2       ?       ? 
1 1 1   19    3   29 o    682.8    2.8    0.0000   0.0000          ?        ?  4662.4849  38.3113          ?        ?      682.8        2.8       ?       ? 
1 1 1   19    3   30 o    279.6    2.7    0.0000   0.0000          ?        ?   781.5505  15.3245          ?        ?      279.6        2.7       ?       ? 
1 1 1   19    3   31 o    464.8    2.6    0.0000   0.0000          ?        ?  2160.7571  24.2638          ?        ?      464.8        2.6       ?       ? 
1 1 1   19    3   32 f    966.2    3.4    0.0000   0.0000          ?        ?  9335.1865  66.4062          ?        ?      966.2        3.4       ?       ? 
1 1 1   19    3   33 o   1899.6    6.4    0.0000   0.0000          ?        ? 36089.8828 244.5538          ?        ?     1899.6        6.4       ?       ? 
1 1 1   19    3   34 o    432.2    3.0    0.0000   0.0000          ?        ?  1867.6758  26.1794          ?        ?      432.2        3.0       ?       ? 
1 1 1   19    3   35 o    446.7    2.4    0.0000   0.0000          ?        ?  1995.3801  21.7097          ?        ?      446.7        2.4       ?       ? 
1 1 1   19    3   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    3   37 o    919.4    3.5    0.0000   0.0000          ?        ?  8452.7500  63.8522          ?        ?      919.4        3.5       ?       ? 
1 1 1   19    3   38 o     20.4   10.2    0.0000   0.0000          ?        ?   -47.2506  17.2401          ?        ?       20.4       10.2       ?       ? 
1 1 1   19    3   39 o    606.9    2.7    0.0000   0.0000          ?        ?  3682.9927  32.5646          ?        ?      606.9        2.7       ?       ? 
1 1 1   19    3   40 o    305.7    3.6    0.0000   0.0000          ?        ?   934.7956  21.7097          ?        ?      305.7        3.6       ?       ? 
1 1 1   19    3   41 o    538.3    2.7    0.0000   0.0000          ?        ?  2897.6111  28.7335          ?        ?      538.3        2.7       ?       ? 
1 1 1   19    3   42 o   1120.8    3.9    0.0000   0.0000          ?        ? 12564.1895  88.1160          ?        ?     1120.8        3.9       ?       ? 
1 1 1   19    3   43 o    889.3    3.3    0.0000   0.0000          ?        ?  7908.7285  58.7440          ?        ?      889.3        3.3       ?       ? 
1 1 1   19    3   44 o   1109.3    3.9    0.0000   0.0000          ?        ? 12306.8662  86.8389          ?        ?     1109.3        3.9       ?       ? 
1 1 1   19    3   45 o     47.1   17.2    0.0000   0.0000          ?        ?    17.8786  21.0712          ?        ?       47.1       17.2       ?       ? 
1 1 1   19    3   46 o    619.8    2.9    0.0000   0.0000          ?        ?  3841.9846  36.3957          ?        ?      619.8        2.9       ?       ? 
1 1 1   19    3   47 f    316.3    3.1    0.0000   0.0000          ?        ?  1000.5634  19.7942          ?        ?      316.3        3.1       ?       ? 
1 1 1   19    3   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    3   49 o    185.0    5.0    0.0000   0.0000          ?        ?   342.2476  18.5171          ?        ?      185.0        5.0       ?       ? 
1 1 1   19    3   50 o    776.1    3.1    0.0000   0.0000          ?        ?  6025.0898  47.8891          ?        ?      776.1        3.1       ?       ? 
1 1 1   19    3   51 o    397.7    2.8    0.0000   0.0000          ?        ?  1582.2566  22.3483          ?        ?      397.7        2.8       ?       ? 
1 1 1   19    3   52 o    215.1    4.3    0.0000   0.0000          ?        ?   462.9282  18.5171          ?        ?      215.1        4.3       ?       ? 
1 1 1   19    3   53 o    558.8    2.7    0.0000   0.0000          ?        ?  3123.0093  30.6490          ?        ?      558.8        2.7       ?       ? 
1 1 1   19    3   54 o    373.8    3.0    0.0000   0.0000          ?        ?  1397.7238  22.3483          ?        ?      373.8        3.0       ?       ? 
1 1 1   19    3   55 o    493.8    2.7    0.0000   0.0000          ?        ?  2439.1526  26.1794          ?        ?      493.8        2.7       ?       ? 
1 1 1   19    3   56 o    896.3    3.4    0.0000   0.0000          ?        ?  8037.0713  60.6596          ?        ?      896.3        3.4       ?       ? 
1 1 1   19    3   57 o    313.0    3.3    0.0000   0.0000          ?        ?   980.1307  20.4327          ?        ?      313.0        3.3       ?       ? 
1 1 1   19    3   58 o     21.5   10.7    0.0000   0.0000          ?        ?   -56.8284  19.7942          ?        ?       21.5       10.7       ?       ? 
1 1 1   19    3   59 o    485.8    2.9    0.0000   0.0000          ?        ?  2360.6145  28.0950          ?        ?      485.8        2.9       ?       ? 
1 1 1   19    3   60 o    168.4    5.7    0.0000   0.0000          ?        ?   284.1421  19.1556          ?        ?      168.4        5.7       ?       ? 
1 1 1   19    3   61 o    429.8    2.9    0.0000   0.0000          ?        ?  1847.8816  24.9023          ?        ?      429.8        2.9       ?       ? 
1 1 1   19    3   62 o    285.3    3.6    0.0000   0.0000          ?        ?   814.7536  20.4327          ?        ?      285.3        3.6       ?       ? 
1 1 1   19    3   63 o    258.9    4.1    0.0000   0.0000          ?        ?   671.0862  21.0712          ?        ?      258.9        4.1       ?       ? 
1 1 1   19    3   64 o    111.3    8.9    0.0000   0.0000          ?        ?   124.5117  19.7942          ?        ?      111.3        8.9       ?       ? 
1 1 1   19    3   65 o     25.3   12.3    0.0000   0.0000          ?        ?   -34.4802  19.7942          ?        ?       25.3       12.3       ?       ? 
1 1 1   19    3   66 o    507.2    2.8    0.0000   0.0000          ?        ?  2573.8806  28.7335          ?        ?      507.2        2.8       ?       ? 
1 1 1   19    3   67 o    262.9    4.0    0.0000   0.0000          ?        ?   692.1575  21.0712          ?        ?      262.9        4.0       ?       ? 
1 1 1   19    3   68 o    260.2    4.4    0.0000   0.0000          ?        ?   678.1099  22.9868          ?        ?      260.2        4.4       ?       ? 
1 1 1   19    3   69 o    158.3    6.9    0.0000   0.0000          ?        ?   251.5775  21.7097          ?        ?      158.3        6.9       ?       ? 
1 1 1   19    3   70 o    238.3    4.6    0.0000   0.0000          ?        ?   568.9227  21.7097          ?        ?      238.3        4.6       ?       ? 
1 1 1   19    3   71 o     39.2   16.4    0.0000   0.0000          ?        ?     3.1926  21.7097          ?        ?       39.2       16.4       ?       ? 
1 1 1   19    3   72 o    121.0    8.7    0.0000   0.0000          ?        ?   147.4985  21.0712          ?        ?      121.0        8.7       ?       ? 
1 1 1   19    3   73 o     48.0   17.2    0.0000   0.0000          ?        ?    20.4327  21.0712          ?        ?       48.0       17.2       ?       ? 
1 1 1   19    3   74 o     72.7   15.0    0.0000   0.0000          ?        ?    56.1899  21.0712          ?        ?       72.7       15.0       ?       ? 
1 1 1   19    3   75 o     34.2   15.5    0.0000   0.0000          ?        ?   -12.1319  22.9868          ?        ?       34.2       15.5       ?       ? 
1 1 1   19    3   76 o    220.7    5.4    0.0000   0.0000          ?        ?   489.1075  23.6253          ?        ?      220.7        5.4       ?       ? 
1 1 1   19    3   77 o     36.9   15.7    0.0000   0.0000          ?        ?     1.2770  20.4327          ?        ?       36.9       15.7       ?       ? 
1 1 1   19    3   78 o    125.2    8.7    0.0000   0.0000          ?        ?   158.9919  21.7097          ?        ?      125.2        8.7       ?       ? 
1 1 1   19    4    0 o    458.7    2.7 2103.9287  24.9023  2103.9287  24.9023  2103.9287  24.9023      458.7      2.7      458.7        2.7     0.0     0.0 
1 1 1   19    4    1 o    967.2    3.4    0.0000   0.0000          ?        ?  9354.9805  65.1292          ?        ?      967.2        3.4       ?       ? 
1 1 1   19    4    2 o   1109.8    3.8    0.0000   0.0000          ?        ? 12318.3594  84.2849          ?        ?     1109.8        3.8       ?       ? 
1 1 1   19    4    3 o    377.6    1.7    0.0000   0.0000          ?        ?  1425.8188  12.7704          ?        ?      377.6        1.7       ?       ? 
1 1 1   19    4    4 o    748.5    2.7    0.0000   0.0000          ?        ?  5603.0273  40.8654          ?        ?      748.5        2.7       ?       ? 
1 1 1   19    4    5 f    747.5    2.7    0.0000   0.0000          ?        ?  5587.7026  40.8654          ?        ?      747.5        2.7       ?       ? 
1 1 1   19    4    6 o   1511.0    5.0    0.0000   0.0000          ?        ? 22835.4492 151.3296          ?        ?     1511.0        5.0       ?       ? 
1 1 1   19    4    7 o    832.1    3.0    0.0000   0.0000          ?        ?  6924.1289  49.1662          ?        ?      832.1        3.0       ?       ? 
1 1 1   19    4    8 o    980.1    3.4    0.0000   0.0000          ?        ?  9607.1963  66.4062          ?        ?      980.1        3.4       ?       ? 
1 1 1   19    4    9 o   1034.0    3.6    0.0000   0.0000          ?        ? 10692.6826  75.3456          ?        ?     1034.0        3.6       ?       ? 
1 1 1   19    4   10 o    720.0    2.6    0.0000   0.0000          ?        ?  5184.7954  37.6728          ?        ?      720.0        2.6       ?       ? 
1 1 1   19    4   11 o   1029.2    3.5    0.0000   0.0000          ?        ? 10592.4355  72.7915          ?        ?     1029.2        3.5       ?       ? 
1 1 1   19    4   12 o   1347.6    4.5    0.0000   0.0000          ?        ? 18161.4707 121.9576          ?        ?     1347.6        4.5       ?       ? 
1 1 1   19    4   13 o    624.2    2.5    0.0000   0.0000          ?        ?  3896.2590  30.6490          ?        ?      624.2        2.5       ?       ? 
1 1 1   19    4   14 f    615.2    2.3    0.0000   0.0000          ?        ?  3785.1560  28.7335          ?        ?      615.2        2.3       ?       ? 
1 1 1   19    4   15 o    696.5    2.6    0.0000   0.0000          ?        ?  4850.8486  36.3957          ?        ?      696.5        2.6       ?       ? 
1 1 1   19    4   16 o    422.8    2.0    0.0000   0.0000          ?        ?  1787.2220  16.6016          ?        ?      422.8        2.0       ?       ? 
1 1 1   19    4   17 o    760.0    2.8    0.0000   0.0000          ?        ?  5776.0664  42.1424          ?        ?      760.0        2.8       ?       ? 
1 1 1   19    4   18 o    860.5    3.1    0.0000   0.0000          ?        ?  7405.5742  52.9973          ?        ?      860.5        3.1       ?       ? 
1 1 1   19    4   19 o   1173.7    4.4    0.0000   0.0000          ?        ? 13775.4648 103.4405          ?        ?     1173.7        4.4       ?       ? 
1 1 1   19    4   20 o    911.3    3.3    0.0000   0.0000          ?        ?  8305.2500  60.6596          ?        ?      911.3        3.3       ?       ? 
1 1 1   19    4   21 o   1058.5    3.7    0.0000   0.0000          ?        ? 11205.4160  77.8996          ?        ?     1058.5        3.7       ?       ? 
1 1 1   19    4   22 o    221.6    2.3    0.0000   0.0000          ?        ?   491.0231  10.2163          ?        ?      221.6        2.3       ?       ? 
1 1 1   19    4   23 f   1719.3    5.9    0.0000   0.0000          ?        ? 29563.5508 203.0499          ?        ?     1719.3        5.9       ?       ? 
1 1 1   19    4   24 o   1076.7    3.9    0.0000   0.0000          ?        ? 11592.9980  84.2849          ?        ?     1076.7        3.9       ?       ? 
1 1 1   19    4   25 o   1397.1    4.7    0.0000   0.0000          ?        ? 19521.5215 131.5355          ?        ?     1397.1        4.7       ?       ? 
1 1 1   19    4   26 o   1354.9    4.6    0.0000   0.0000          ?        ? 18358.7734 123.8732          ?        ?     1354.9        4.6       ?       ? 
1 1 1   19    4   27 o    614.2    2.6    0.0000   0.0000          ?        ?  3773.0244  31.9261          ?        ?      614.2        2.6       ?       ? 
1 1 1   19    4   28 o   1098.3    3.9    0.0000   0.0000          ?        ? 12064.2275  86.2004          ?        ?     1098.3        3.9       ?       ? 
1 1 1   19    4   29 o   1037.1    3.8    0.0000   0.0000          ?        ? 10756.5352  79.1767          ?        ?     1037.1        3.8       ?       ? 
1 1 1   19    4   30 o    321.6    2.8    0.0000   0.0000          ?        ?  1034.4050  17.8786          ?        ?      321.6        2.8       ?       ? 
1 1 1   19    4   31 o   1121.7    4.1    0.0000   0.0000          ?        ? 12582.0684  91.3086          ?        ?     1121.7        4.1       ?       ? 
1 1 1   19    4   32 o    968.0    3.6    0.0000   0.0000          ?        ?  9370.3047  69.5989          ?        ?      968.0        3.6       ?       ? 
1 1 1   19    4   33 o    742.9    3.0    0.0000   0.0000          ?        ?  5518.7422  44.0580          ?        ?      742.9        3.0       ?       ? 
1 1 1   19    4   34 o   1477.8    5.1    0.0000   0.0000          ?        ? 21841.2715 150.6911          ?        ?     1477.8        5.1       ?       ? 
1 1 1   19    4   35 o    571.9    2.7    0.0000   0.0000          ?        ?  3271.1462  31.2876          ?        ?      571.9        2.7       ?       ? 
1 1 1   19    4   36 o    331.9    2.8    0.0000   0.0000          ?        ?  1101.4498  18.5171          ?        ?      331.9        2.8       ?       ? 
1 1 1   19    4   37 o    449.5    2.6    0.0000   0.0000          ?        ?  2020.2823  22.9868          ?        ?      449.5        2.6       ?       ? 
1 1 1   19    4   38 o    326.0    2.9    0.0000   0.0000          ?        ?  1062.5000  19.1556          ?        ?      326.0        2.9       ?       ? 
1 1 1   19    4   39 o    406.8    2.8    0.0000   0.0000          ?        ?  1655.0481  22.9868          ?        ?      406.8        2.8       ?       ? 
1 1 1   19    4   40 o    633.8    3.1    0.0000   0.0000          ?        ?  4016.9395  38.9498          ?        ?      633.8        3.1       ?       ? 
1 1 1   19    4   41 o    783.0    3.1    0.0000   0.0000          ?        ?  6131.7231  48.5276          ?        ?      783.0        3.1       ?       ? 
1 1 1   19    4   42 o   1390.0    4.7    0.0000   0.0000          ?        ? 19325.4961 130.2584          ?        ?     1390.0        4.7       ?       ? 
1 1 1   19    4   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    4   44 o    865.2    3.2    0.0000   0.0000          ?        ?  7486.0278  56.1899          ?        ?      865.2        3.2       ?       ? 
1 1 1   19    4   45 o    729.8    2.9    0.0000   0.0000          ?        ?  5327.1860  42.7809          ?        ?      729.8        2.9       ?       ? 
1 1 1   19    4   46 o    530.0    2.7    0.0000   0.0000          ?        ?  2809.4951  28.7335          ?        ?      530.0        2.7       ?       ? 
1 1 1   19    4   47 o   1127.2    3.9    0.0000   0.0000          ?        ? 12708.4961  88.7545          ?        ?     1127.2        3.9       ?       ? 
1 1 1   19    4   48 o    490.1    2.7    0.0000   0.0000          ?        ?  2402.7568  26.8179          ?        ?      490.1        2.7       ?       ? 
1 1 1   19    4   49 o    348.8    3.0    0.0000   0.0000          ?        ?  1217.0222  21.0712          ?        ?      348.8        3.0       ?       ? 
1 1 1   19    4   50 o    430.1    2.7    0.0000   0.0000          ?        ?  1849.7972  23.6253          ?        ?      430.1        2.7       ?       ? 
1 1 1   19    4   51 o    582.8    2.8    0.0000   0.0000          ?        ?  3397.5735  32.5646          ?        ?      582.8        2.8       ?       ? 
1 1 1   19    4   52 o    656.5    2.9    0.0000   0.0000          ?        ?  4310.6592  37.6728          ?        ?      656.5        2.9       ?       ? 
1 1 1   19    4   53 o    285.6    3.5    0.0000   0.0000          ?        ?   816.0306  19.7942          ?        ?      285.6        3.5       ?       ? 
1 1 1   19    4   54 o    396.4    3.0    0.0000   0.0000          ?        ?  1572.0403  23.6253          ?        ?      396.4        3.0       ?       ? 
1 1 1   19    4   55 o    341.3    3.1    0.0000   0.0000          ?        ?  1165.3020  21.0712          ?        ?      341.3        3.1       ?       ? 
1 1 1   19    4   56 o    200.0    4.6    0.0000   0.0000          ?        ?   400.3531  18.5171          ?        ?      200.0        4.6       ?       ? 
1 1 1   19    4   57 o     90.2   10.3    0.0000   0.0000          ?        ?    81.7308  18.5171          ?        ?       90.2       10.3       ?       ? 
1 1 1   19    4   58 o     57.0   15.7    0.0000   0.0000          ?        ?    33.8416  18.5171          ?        ?       57.0       15.7       ?       ? 
1 1 1   19    4   59 o    114.2    8.7    0.0000   0.0000          ?        ?   130.8969  19.7942          ?        ?      114.2        8.7       ?       ? 
1 1 1   19    4   60 o    119.2    8.0    0.0000   0.0000          ?        ?   142.3903  19.1556          ?        ?      119.2        8.0       ?       ? 
1 1 1   19    4   61 o     35.2   15.1    0.0000   0.0000          ?        ?    -1.2770  19.1556          ?        ?       35.2       15.1       ?       ? 
1 1 1   19    4   62 o    170.1    5.8    0.0000   0.0000          ?        ?   289.8888  19.7942          ?        ?      170.1        5.8       ?       ? 
1 1 1   19    4   63 o     19.1    9.7    0.0000   0.0000          ?        ?   -70.2374  19.1556          ?        ?       19.1        9.7       ?       ? 
1 1 1   19    4   64 o     81.9   12.5    0.0000   0.0000          ?        ?    67.6833  20.4327          ?        ?       81.9       12.5       ?       ? 
1 1 1   19    4   65 o    152.9    6.7    0.0000   0.0000          ?        ?   234.3374  20.4327          ?        ?      152.9        6.7       ?       ? 
1 1 1   19    4   66 o     45.6   16.7    0.0000   0.0000          ?        ?    17.2401  19.7942          ?        ?       45.6       16.7       ?       ? 
1 1 1   19    4   67 o    157.2    6.7    0.0000   0.0000          ?        ?   247.7464  21.0712          ?        ?      157.2        6.7       ?       ? 
1 1 1   19    4   68 o    356.2    3.5    0.0000   0.0000          ?        ?  1270.0195  24.9023          ?        ?      356.2        3.5       ?       ? 
1 1 1   19    4   69 o    208.4    5.4    0.0000   0.0000          ?        ?   435.4717  22.3483          ?        ?      208.4        5.4       ?       ? 
1 1 1   19    4   70 o    195.4    5.9    0.0000   0.0000          ?        ?   383.1130  22.9868          ?        ?      195.4        5.9       ?       ? 
1 1 1   19    4   71 o    126.9    8.8    0.0000   0.0000          ?        ?   162.1845  22.3483          ?        ?      126.9        8.8       ?       ? 
1 1 1   19    4   72 f     62.4   17.0    0.0000   0.0000          ?        ?    41.5039  21.7097          ?        ?       62.4       17.0       ?       ? 
1 1 1   19    4   73 o    174.3    6.6    0.0000   0.0000          ?        ?   305.2133  22.9868          ?        ?      174.3        6.6       ?       ? 
1 1 1   19    4   74 o    141.0    8.2    0.0000   0.0000          ?        ?   200.4958  22.9868          ?        ?      141.0        8.2       ?       ? 
1 1 1   19    4   75 o     57.9   18.0    0.0000   0.0000          ?        ?    35.1187  22.9868          ?        ?       57.9       18.0       ?       ? 
1 1 1   19    4   76 o     31.6   14.4    0.0000   0.0000          ?        ?   -10.8549  19.7942          ?        ?       31.6       14.4       ?       ? 
1 1 1   19    4   77 o     45.2   17.1    0.0000   0.0000          ?        ?    16.6016  21.0712          ?        ?       45.2       17.1       ?       ? 
1 1 1   19    4   78 o    112.2    9.7    0.0000   0.0000          ?        ?   128.3428  21.7097          ?        ?      112.2        9.7       ?       ? 
1 1 1   19    5    0 o   1551.0    7.3 24061.4102 225.3981 24061.4102 225.3981 24061.4102 225.3981     1551.0      7.3     1551.0        7.3     0.0     0.0 
1 1 1   19    5    1 o    708.1    2.6    0.0000   0.0000          ?        ?  5013.6719  37.0343          ?        ?      708.1        2.6       ?       ? 
1 1 1   19    5    2 o    978.0    3.4    0.0000   0.0000          ?        ?  9565.6924  66.4062          ?        ?      978.0        3.4       ?       ? 
1 1 1   19    5    3 o    558.3    2.2    0.0000   0.0000          ?        ?  3116.6240  24.2638          ?        ?      558.3        2.2       ?       ? 
1 1 1   19    5    4 o    923.8    3.2    0.0000   0.0000          ?        ?  8535.1182  60.0210          ?        ?      923.8        3.2       ?       ? 
1 1 1   19    5    5 o    694.7    2.6    0.0000   0.0000          ?        ?  4826.5850  35.7572          ?        ?      694.7        2.6       ?       ? 
1 1 1   19    5    6 o    383.4    1.8    0.0000   0.0000          ?        ?  1469.8767  14.0475          ?        ?      383.4        1.8       ?       ? 
1 1 1   19    5    7 o    422.8    1.8    0.0000   0.0000          ?        ?  1787.8606  15.3245          ?        ?      422.8        1.8       ?       ? 
1 1 1   19    5    8 o    548.0    2.2    0.0000   0.0000          ?        ?  3003.6057  23.6253          ?        ?      548.0        2.2       ?       ? 
1 1 1   19    5    9 o    619.2    2.4    0.0000   0.0000          ?        ?  3834.3223  30.0105          ?        ?      619.2        2.4       ?       ? 
1 1 1   19    5   10 o   1596.1    5.3    0.0000   0.0000          ?        ? 25478.2891 167.9312          ?        ?     1596.1        5.3       ?       ? 
1 1 1   19    5   11 o    179.9    2.0    0.0000   0.0000          ?        ?   323.7305   7.0237          ?        ?      179.9        2.0       ?       ? 
1 1 1   19    5   12 o    100.4    3.2    0.0000   0.0000          ?        ?   100.8864   6.3852          ?        ?      100.4        3.2       ?       ? 
1 1 1   19    5   13 o   1752.2    5.7    0.0000   0.0000          ?        ? 30705.8652 200.4958          ?        ?     1752.2        5.7       ?       ? 
1 1 1   19    5   14 o   1150.2    3.9    0.0000   0.0000          ?        ? 13229.5293  90.6701          ?        ?     1150.2        3.9       ?       ? 
1 1 1   19    5   15 o   1079.9    3.7    0.0000   0.0000          ?        ? 11663.2363  80.4537          ?        ?     1079.9        3.7       ?       ? 
1 1 1   19    5   16 o   1086.4    3.8    0.0000   0.0000          ?        ? 11802.4336  82.3693          ?        ?     1086.4        3.8       ?       ? 
1 1 1   19    5   17 o    436.9    2.0    0.0000   0.0000          ?        ?  1908.5411  17.8786          ?        ?      436.9        2.0       ?       ? 
1 1 1   19    5   18 o   1246.1    4.4    0.0000   0.0000          ?        ? 15529.4854 109.8257          ?        ?     1246.1        4.4       ?       ? 
1 1 1   19    5   19 o    481.8    2.2    0.0000   0.0000          ?        ?  2321.0261  21.0712          ?        ?      481.8        2.2       ?       ? 
1 1 1   19    5   20 o   1299.0    4.4    0.0000   0.0000          ?        ? 16874.8496 113.6568          ?        ?     1299.0        4.4       ?       ? 
1 1 1   19    5   21 o    299.8    2.3    0.0000   0.0000          ?        ?   899.0385  14.0475          ?        ?      299.8        2.3       ?       ? 
1 1 1   19    5   22 o    783.9    3.1    0.0000   0.0000          ?        ?  6145.7705  47.8891          ?        ?      783.9        3.1       ?       ? 
1 1 1   19    5   23 f   1198.8    4.2    0.0000   0.0000          ?        ? 14371.2061 100.2479          ?        ?     1198.8        4.2       ?       ? 
1 1 1   19    5   24 o    262.6    2.4    0.0000   0.0000          ?        ?   689.6033  12.7704          ?        ?      262.6        2.4       ?       ? 
1 1 1   19    5   25 o   1324.4    4.6    0.0000   0.0000          ?        ? 17540.1895 121.3191          ?        ?     1324.4        4.6       ?       ? 
1 1 1   19    5   26 o   1109.3    4.0    0.0000   0.0000          ?        ? 12306.8662  88.7545          ?        ?     1109.3        4.0       ?       ? 
1 1 1   19    5   27 o   1685.6    5.7    0.0000   0.0000          ?        ? 28416.1270 190.9180          ?        ?     1685.6        5.7       ?       ? 
1 1 1   19    5   28 o    173.8    4.4    0.0000   0.0000          ?        ?   302.0207  15.3245          ?        ?      173.8        4.4       ?       ? 
1 1 1   19    5   29 o   1041.1    4.0    0.0000   0.0000          ?        ? 10838.9043  83.6463          ?        ?     1041.1        4.0       ?       ? 
1 1 1   19    5   30 o    888.4    3.5    0.0000   0.0000          ?        ?  7892.1274  62.5751          ?        ?      888.4        3.5       ?       ? 
1 1 1   19    5   31 o    216.8    3.2    0.0000   0.0000          ?        ?   469.9519  14.0475          ?        ?      216.8        3.2       ?       ? 
1 1 1   19    5   32 o    693.0    2.9    0.0000   0.0000          ?        ?  4802.9600  39.5883          ?        ?      693.0        2.9       ?       ? 
1 1 1   19    5   33 o    713.1    2.9    0.0000   0.0000          ?        ?  5085.8247  41.5039          ?        ?      713.1        2.9       ?       ? 
1 1 1   19    5   34 o    724.0    3.0    0.0000   0.0000          ?        ?  5241.6240  42.7809          ?        ?      724.0        3.0       ?       ? 
1 1 1   19    5   35 o    492.8    2.6    0.0000   0.0000          ?        ?  2428.9363  25.5409          ?        ?      492.8        2.6       ?       ? 
1 1 1   19    5   36 o    122.2    8.1    0.0000   0.0000          ?        ?   149.4141  19.7942          ?        ?      122.2        8.1       ?       ? 
1 1 1   19    5   37 o    900.9    3.5    0.0000   0.0000          ?        ?  8117.5259  62.5751          ?        ?      900.9        3.5       ?       ? 
1 1 1   19    5   38 o    665.0    2.8    0.0000   0.0000          ?        ?  4422.4004  37.0343          ?        ?      665.0        2.8       ?       ? 
1 1 1   19    5   39 o   1248.3    4.3    0.0000   0.0000          ?        ? 15585.0361 107.2716          ?        ?     1248.3        4.3       ?       ? 
1 1 1   19    5   40 o    737.7    3.2    0.0000   0.0000          ?        ?  5442.1196  46.6121          ?        ?      737.7        3.2       ?       ? 
1 1 1   19    5   41 o    673.4    2.8    0.0000   0.0000          ?        ?  4534.7808  37.6728          ?        ?      673.4        2.8       ?       ? 
1 1 1   19    5   42 o    680.2    3.1    0.0000   0.0000          ?        ?  4626.7275  41.5039          ?        ?      680.2        3.1       ?       ? 
1 1 1   19    5   43 o    262.5    3.6    0.0000   0.0000          ?        ?   688.9648  19.1556          ?        ?      262.5        3.6       ?       ? 
1 1 1   19    5   44 o     21.0   10.5    0.0000   0.0000          ?        ?   -47.8891  17.8786          ?        ?       21.0       10.5       ?       ? 
1 1 1   19    5   45 o     24.9   12.0    0.0000   0.0000          ?        ?   -28.0950  17.8786          ?        ?       24.9       12.0       ?       ? 
1 1 1   19    5   46 o     18.8    9.5    0.0000   0.0000          ?        ?   -63.2136  17.8786          ?        ?       18.8        9.5       ?       ? 
1 1 1   19    5   47 o    361.8    2.9    0.0000   0.0000          ?        ?  1308.9694  21.0712          ?        ?      361.8        2.9       ?       ? 
1 1 1   19    5   48 o    505.2    2.7    0.0000   0.0000          ?        ?  2552.1709  26.8179          ?        ?      505.2        2.7       ?       ? 
1 1 1   19    5   49 o    450.2    2.8    0.0000   0.0000          ?        ?  2026.6676  24.9023          ?        ?      450.2        2.8       ?       ? 
1 1 1   19    5   50 o    243.9    3.8    0.0000   0.0000          ?        ?   595.1021  18.5171          ?        ?      243.9        3.8       ?       ? 
1 1 1   19    5   51 o    549.1    2.7    0.0000   0.0000          ?        ?  3015.7375  30.0105          ?        ?      549.1        2.7       ?       ? 
1 1 1   19    5   52 o    318.4    3.1    0.0000   0.0000          ?        ?  1013.9724  19.7942          ?        ?      318.4        3.1       ?       ? 
1 1 1   19    5   53 o    268.0    3.6    0.0000   0.0000          ?        ?   718.3369  19.1556          ?        ?      268.0        3.6       ?       ? 
1 1 1   19    5   54 o    274.3    3.7    0.0000   0.0000          ?        ?   752.8170  20.4327          ?        ?      274.3        3.7       ?       ? 
1 1 1   19    5   55 o    505.2    2.7    0.0000   0.0000          ?        ?  2552.8093  27.4564          ?        ?      505.2        2.7       ?       ? 
1 1 1   19    5   56 o    186.6    5.1    0.0000   0.0000          ?        ?   348.6328  19.1556          ?        ?      186.6        5.1       ?       ? 
1 1 1   19    5   57 o    185.9    5.2    0.0000   0.0000          ?        ?   346.0787  19.1556          ?        ?      185.9        5.2       ?       ? 
1 1 1   19    5   58 o    302.8    3.5    0.0000   0.0000          ?        ?   917.5555  21.0712          ?        ?      302.8        3.5       ?       ? 
1 1 1   19    5   59 o    595.9    2.8    0.0000   0.0000          ?        ?  3552.0957  33.8416          ?        ?      595.9        2.8       ?       ? 
1 1 1   19    5   60 o    194.5    5.3    0.0000   0.0000          ?        ?   378.6433  20.4327          ?        ?      194.5        5.3       ?       ? 
1 1 1   19    5   61 o    238.7    4.3    0.0000   0.0000          ?        ?   570.1998  20.4327          ?        ?      238.7        4.3       ?       ? 
1 1 1   19    5   62 o    454.2    2.9    0.0000   0.0000          ?        ?  2064.3403  26.1794          ?        ?      454.2        2.9       ?       ? 
1 1 1   19    5   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    5   64 o    209.6    4.7    0.0000   0.0000          ?        ?   439.9414  19.7942          ?        ?      209.6        4.7       ?       ? 
1 1 1   19    5   65 o     74.6   13.8    0.0000   0.0000          ?        ?    58.1055  19.7942          ?        ?       74.6       13.8       ?       ? 
1 1 1   19    5   66 o     30.2   14.0    0.0000   0.0000          ?        ?   -17.8786  20.4327          ?        ?       30.2       14.0       ?       ? 
1 1 1   19    5   67 o    277.7    3.9    0.0000   0.0000          ?        ?   771.9727  21.7097          ?        ?      277.7        3.9       ?       ? 
1 1 1   19    5   68 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    5   69 o    104.7   10.1    0.0000   0.0000          ?        ?   110.4642  21.0712          ?        ?      104.7       10.1       ?       ? 
1 1 1   19    5   70 o     48.8   17.5    0.0000   0.0000          ?        ?    21.0712  21.7097          ?        ?       48.8       17.5       ?       ? 
1 1 1   19    5   71 o     23.8   11.9    0.0000   0.0000          ?        ?   -56.1899  22.3483          ?        ?       23.8       11.9       ?       ? 
1 1 1   19    5   72 o     42.9   17.0    0.0000   0.0000          ?        ?    10.8549  21.7097          ?        ?       42.9       17.0       ?       ? 
1 1 1   19    5   73 o    212.5    5.0    0.0000   0.0000          ?        ?   452.7119  21.0712          ?        ?      212.5        5.0       ?       ? 
1 1 1   19    5   74 o    136.4    8.4    0.0000   0.0000          ?        ?   187.7254  22.9868          ?        ?      136.4        8.4       ?       ? 
1 1 1   19    5   75 o    218.0    5.0    0.0000   0.0000          ?        ?   476.9756  21.7097          ?        ?      218.0        5.0       ?       ? 
1 1 1   19    5   76 o    167.0    6.7    0.0000   0.0000          ?        ?   280.9495  22.3483          ?        ?      167.0        6.7       ?       ? 
1 1 1   19    5   77 o     63.6   16.8    0.0000   0.0000          ?        ?    44.0580  21.7097          ?        ?       63.6       16.8       ?       ? 
1 1 1   19    5   78 o     59.3   16.6    0.0000   0.0000          ?        ?    38.3113  20.4327          ?        ?       59.3       16.6       ?       ? 
1 1 1   19    6    0 o    843.2    4.3 7110.5767  72.1529  7110.5767  72.1529  7110.5767  72.1529      843.2      4.3      843.2        4.3     0.0     0.0 
1 1 1   19    6    1 o    918.9    3.3    0.0000   0.0000          ?        ?  8445.0869  60.0210          ?        ?      918.9        3.3       ?       ? 
1 1 1   19    6    2 o    811.2    2.9    0.0000   0.0000          ?        ?  6581.2422  47.2506          ?        ?      811.2        2.9       ?       ? 
1 1 1   19    6    3 o    392.6    1.8    0.0000   0.0000          ?        ?  1541.3911  14.0475          ?        ?      392.6        1.8       ?       ? 
1 1 1   19    6    4 o    472.7    2.0    0.0000   0.0000          ?        ?  2234.8257  19.1556          ?        ?      472.7        2.0       ?       ? 
1 1 1   19    6    5 o    892.2    3.1    0.0000   0.0000          ?        ?  7959.8105  54.9129          ?        ?      892.2        3.1       ?       ? 
1 1 1   19    6    6 o    724.0    2.7    0.0000   0.0000          ?        ?  5241.6240  38.9498          ?        ?      724.0        2.7       ?       ? 
1 1 1   19    6    7 o   1340.8    4.5    0.0000   0.0000          ?        ? 17980.1289 120.6806          ?        ?     1340.8        4.5       ?       ? 
1 1 1   19    6    8 f   1300.0    4.4    0.0000   0.0000          ?        ? 16901.6680 114.2954          ?        ?     1300.0        4.4       ?       ? 
1 1 1   19    6    9 o   1172.0    4.0    0.0000   0.0000          ?        ? 13737.1533  93.2242          ?        ?     1172.0        4.0       ?       ? 
1 1 1   19    6   10 o    287.2    1.7    0.0000   0.0000          ?        ?   824.9699   9.5778          ?        ?      287.2        1.7       ?       ? 
1 1 1   19    6   11 o    731.4    2.7    0.0000   0.0000          ?        ?  5348.8955  39.5883          ?        ?      731.4        2.7       ?       ? 
1 1 1   19    6   12 o   1458.3    4.9    0.0000   0.0000          ?        ? 21269.7949 142.3903          ?        ?     1458.3        4.9       ?       ? 
1 1 1   19    6   13 o    640.1    2.5    0.0000   0.0000          ?        ?  4096.7544  31.9261          ?        ?      640.1        2.5       ?       ? 
1 1 1   19    6   14 o   1730.5    5.7    0.0000   0.0000          ?        ? 29951.1348 197.9417          ?        ?     1730.5        5.7       ?       ? 
1 1 1   19    6   15 f   1409.8    4.7    0.0000   0.0000          ?        ? 19876.5391 133.4510          ?        ?     1409.8        4.7       ?       ? 
1 1 1   19    6   16 o    659.1    2.7    0.0000   0.0000          ?        ?  4344.5015  35.1187          ?        ?      659.1        2.7       ?       ? 
1 1 1   19    6   17 o   1529.6    5.3    0.0000   0.0000          ?        ? 23399.2637 161.5460          ?        ?     1529.6        5.3       ?       ? 
1 1 1   19    6   18 o   1647.3    5.5    0.0000   0.0000          ?        ? 27137.1699 182.6172          ?        ?     1647.3        5.5       ?       ? 
1 1 1   19    6   19 o    657.0    2.6    0.0000   0.0000          ?        ?  4316.4062  34.4802          ?        ?      657.0        2.6       ?       ? 
1 1 1   19    6   20 o    586.3    2.5    0.0000   0.0000          ?        ?  3437.1619  28.7335          ?        ?      586.3        2.5       ?       ? 
1 1 1   19    6   21 o   1246.9    4.4    0.0000   0.0000          ?        ? 15549.2783 108.5487          ?        ?     1246.9        4.4       ?       ? 
1 1 1   19    6   22 o    938.2    3.4    0.0000   0.0000          ?        ?  8803.2969  63.8522          ?        ?      938.2        3.4       ?       ? 
1 1 1   19    6   23 o   1521.2    5.2    0.0000   0.0000          ?        ? 23142.5781 157.7148          ?        ?     1521.2        5.2       ?       ? 
1 1 1   19    6   24 o    905.6    3.2    0.0000   0.0000          ?        ?  8201.1719  58.7440          ?        ?      905.6        3.2       ?       ? 
1 1 1   19    6   25 o   1393.2    4.8    0.0000   0.0000          ?        ? 19411.6973 134.0895          ?        ?     1393.2        4.8       ?       ? 
1 1 1   19    6   26 o   1532.7    5.3    0.0000   0.0000          ?        ? 23493.7637 162.8230          ?        ?     1532.7        5.3       ?       ? 
1 1 1   19    6   27 o   1204.0    4.2    0.0000   0.0000          ?        ? 14496.9941 101.5249          ?        ?     1204.0        4.2       ?       ? 
1 1 1   19    6   28 o    640.2    2.8    0.0000   0.0000          ?        ?  4098.6704  35.7572          ?        ?      640.2        2.8       ?       ? 
1 1 1   19    6   29 o   1303.2    4.6    0.0000   0.0000          ?        ? 16984.6758 120.0421          ?        ?     1303.2        4.6       ?       ? 
1 1 1   19    6   30 o    341.2    2.5    0.0000   0.0000          ?        ?  1164.0249  17.2401          ?        ?      341.2        2.5       ?       ? 
1 1 1   19    6   31 o    209.9    3.2    0.0000   0.0000          ?        ?   440.5799  13.4090          ?        ?      209.9        3.2       ?       ? 
1 1 1   19    6   32 o    640.3    2.7    0.0000   0.0000          ?        ?  4100.5859  34.4802          ?        ?      640.3        2.7       ?       ? 
1 1 1   19    6   33 o    847.5    3.5    0.0000   0.0000          ?        ?  7182.7300  58.7440          ?        ?      847.5        3.5       ?       ? 
1 1 1   19    6   34 o    393.1    2.5    0.0000   0.0000          ?        ?  1545.2223  19.7942          ?        ?      393.1        2.5       ?       ? 
1 1 1   19    6   35 o     61.6   14.7    0.0000   0.0000          ?        ?    39.5883  17.8786          ?        ?       61.6       14.7       ?       ? 
1 1 1   19    6   36 o    476.4    2.5    0.0000   0.0000          ?        ?  2269.9443  23.6253          ?        ?      476.4        2.5       ?       ? 
1 1 1   19    6   37 o    226.6    3.5    0.0000   0.0000          ?        ?   513.3714  15.9630          ?        ?      226.6        3.5       ?       ? 
1 1 1   19    6   38 o    444.8    2.6    0.0000   0.0000          ?        ?  1978.1399  22.9868          ?        ?      444.8        2.6       ?       ? 
1 1 1   19    6   39 o    514.5    2.6    0.0000   0.0000          ?        ?  2647.3108  26.8179          ?        ?      514.5        2.6       ?       ? 
1 1 1   19    6   40 f    454.6    2.9    0.0000   0.0000          ?        ?  2066.8945  26.1794          ?        ?      454.6        2.9       ?       ? 
1 1 1   19    6   41 o    555.4    2.6    0.0000   0.0000          ?        ?  3085.3367  29.3720          ?        ?      555.4        2.6       ?       ? 
1 1 1   19    6   42 o     70.1   14.6    0.0000   0.0000          ?        ?    51.0817  19.7942          ?        ?       70.1       14.6       ?       ? 
1 1 1   19    6   43 f   1079.0    3.8    0.0000   0.0000          ?        ? 11644.0801  82.3693          ?        ?     1079.0        3.8       ?       ? 
1 1 1   19    6   44 o    808.2    3.2    0.0000   0.0000          ?        ?  6532.7148  51.7203          ?        ?      808.2        3.2       ?       ? 
1 1 1   19    6   45 o    682.9    2.8    0.0000   0.0000          ?        ?  4663.7622  38.3113          ?        ?      682.9        2.8       ?       ? 
1 1 1   19    6   46 o    523.7    2.7    0.0000   0.0000          ?        ?  2743.0889  28.7335          ?        ?      523.7        2.7       ?       ? 
1 1 1   19    6   47 o     85.2   10.5    0.0000   0.0000          ?        ?    72.7915  17.8786          ?        ?       85.2       10.5       ?       ? 
1 1 1   19    6   48 o    239.0    4.0    0.0000   0.0000          ?        ?   571.4769  19.1556          ?        ?      239.0        4.0       ?       ? 
1 1 1   19    6   49 o    583.3    2.8    0.0000   0.0000          ?        ?  3402.6819  32.5646          ?        ?      583.3        2.8       ?       ? 
1 1 1   19    6   50 o     52.3   16.1    0.0000   0.0000          ?        ?    27.4564  18.5171          ?        ?       52.3       16.1       ?       ? 
1 1 1   19    6   51 o    311.4    3.3    0.0000   0.0000          ?        ?   969.9143  20.4327          ?        ?      311.4        3.3       ?       ? 
1 1 1   19    6   52 o    585.7    2.8    0.0000   0.0000          ?        ?  3430.7766  32.5646          ?        ?      585.7        2.8       ?       ? 
1 1 1   19    6   53 o     36.2   15.3    0.0000   0.0000          ?        ?     0.6385  19.1556          ?        ?       36.2       15.3       ?       ? 
1 1 1   19    6   54 o    274.0    3.7    0.0000   0.0000          ?        ?   750.9014  20.4327          ?        ?      274.0        3.7       ?       ? 
1 1 1   19    6   55 o    382.6    3.0    0.0000   0.0000          ?        ?  1464.1301  22.9868          ?        ?      382.6        3.0       ?       ? 
1 1 1   19    6   56 o    342.6    3.2    0.0000   0.0000          ?        ?  1174.2412  21.7097          ?        ?      342.6        3.2       ?       ? 
1 1 1   19    6   57 o    220.1    4.5    0.0000   0.0000          ?        ?   484.6379  19.7942          ?        ?      220.1        4.5       ?       ? 
1 1 1   19    6   58 o    340.4    3.2    0.0000   0.0000          ?        ?  1158.9167  21.7097          ?        ?      340.4        3.2       ?       ? 
1 1 1   19    6   59 o    119.2    7.8    0.0000   0.0000          ?        ?   142.3903  18.5171          ?        ?      119.2        7.8       ?       ? 
1 1 1   19    6   60 o     94.0    9.9    0.0000   0.0000          ?        ?    88.7545  18.5171          ?        ?       94.0        9.9       ?       ? 
1 1 1   19    6   61 o    267.0    3.6    0.0000   0.0000          ?        ?   713.2286  19.1556          ?        ?      267.0        3.6       ?       ? 
1 1 1   19    6   62 o    143.9    6.7    0.0000   0.0000          ?        ?   207.5195  19.1556          ?        ?      143.9        6.7       ?       ? 
1 1 1   19    6   63 o    111.0    9.2    0.0000   0.0000          ?        ?   123.8732  20.4327          ?        ?      111.0        9.2       ?       ? 
1 1 1   19    6   64 o    134.2    7.6    0.0000   0.0000          ?        ?   180.7016  20.4327          ?        ?      134.2        7.6       ?       ? 
1 1 1   19    6   65 o     54.9   16.9    0.0000   0.0000          ?        ?    30.6490  20.4327          ?        ?       54.9       16.9       ?       ? 
1 1 1   19    6   66 o    119.9    8.0    0.0000   0.0000          ?        ?   144.3059  19.1556          ?        ?      119.9        8.0       ?       ? 
1 1 1   19    6   67 o     25.2   12.2    0.0000   0.0000          ?        ?   -31.9261  19.1556          ?        ?       25.2       12.2       ?       ? 
1 1 1   19    6   68 o    152.4    6.5    0.0000   0.0000          ?        ?   233.0604  19.7942          ?        ?      152.4        6.5       ?       ? 
1 1 1   19    6   69 o    116.7    9.3    0.0000   0.0000          ?        ?   137.2822  21.7097          ?        ?      116.7        9.3       ?       ? 
1 1 1   19    6   70 o    171.3    6.2    0.0000   0.0000          ?        ?   294.3585  21.0712          ?        ?      171.3        6.2       ?       ? 
1 1 1   19    6   71 f    156.4    6.7    0.0000   0.0000          ?        ?   245.8308  21.0712          ?        ?      156.4        6.7       ?       ? 
1 1 1   19    6   72 o    411.7    3.2    0.0000   0.0000          ?        ?  1696.5520  26.1794          ?        ?      411.7        3.2       ?       ? 
1 1 1   19    6   73 o     30.0   14.1    0.0000   0.0000          ?        ?   -22.3483  21.7097          ?        ?       30.0       14.1       ?       ? 
1 1 1   19    6   74 o    314.9    3.8    0.0000   0.0000          ?        ?   993.5397  23.6253          ?        ?      314.9        3.8       ?       ? 
1 1 1   19    6   75 o     27.8   13.4    0.0000   0.0000          ?        ?   -30.6490  21.7097          ?        ?       27.8       13.4       ?       ? 
1 1 1   19    6   76 o    196.9    5.4    0.0000   0.0000          ?        ?   389.4982  21.0712          ?        ?      196.9        5.4       ?       ? 
1 1 1   19    6   77 o    151.6    6.7    0.0000   0.0000          ?        ?   231.7833  20.4327          ?        ?      151.6        6.7       ?       ? 
1 1 1   19    7    0 o     92.7    3.5   86.2004   6.3852    86.2004   6.3852    86.2004   6.3852       92.7      3.5       92.7        3.5     0.0     0.0 
1 1 1   19    7    1 o   1379.2    4.7    0.0000   0.0000          ?        ? 19023.4746 128.3428          ?        ?     1379.2        4.7       ?       ? 
1 1 1   19    7    2 o    182.6    1.7    0.0000   0.0000          ?        ?   333.3083   6.3852          ?        ?      182.6        1.7       ?       ? 
1 1 1   19    7    3 o    983.4    3.4    0.0000   0.0000          ?        ?  9671.6865  66.4062          ?        ?      983.4        3.4       ?       ? 
1 1 1   19    7    4 o   1183.9    4.0    0.0000   0.0000          ?        ? 14018.1035  95.7782          ?        ?     1183.9        4.0       ?       ? 
1 1 1   19    7    5 o    601.4    2.3    0.0000   0.0000          ?        ?  3616.5867  28.0950          ?        ?      601.4        2.3       ?       ? 
1 1 1   19    7    6 o    174.9    2.0    0.0000   0.0000          ?        ?   305.8519   7.0237          ?        ?      174.9        2.0       ?       ? 
1 1 1   19    7    7 o    316.3    1.8    0.0000   0.0000          ?        ?  1000.5634  11.4934          ?        ?      316.3        1.8       ?       ? 
1 1 1   19    7    8 o    575.7    2.2    0.0000   0.0000          ?        ?  3314.5657  25.5409          ?        ?      575.7        2.2       ?       ? 
1 1 1   19    7    9 o   1208.2    4.1    0.0000   0.0000          ?        ? 14599.1582  98.9709          ?        ?     1208.2        4.1       ?       ? 
1 1 1   19    7   10 o   1240.2    4.2    0.0000   0.0000          ?        ? 15382.6250 104.7175          ?        ?     1240.2        4.2       ?       ? 
1 1 1   19    7   11 o   1114.6    3.8    0.0000   0.0000          ?        ? 12423.0762  84.9234          ?        ?     1114.6        3.8       ?       ? 
1 1 1   19    7   12 f   1200.3    4.2    0.0000   0.0000          ?        ? 14406.9639 100.2479          ?        ?     1200.3        4.2       ?       ? 
1 1 1   19    7   13 o    413.5    2.0    0.0000   0.0000          ?        ?  1709.9608  16.6016          ?        ?      413.5        2.0       ?       ? 
1 1 1   19    7   14 o   1105.0    3.8    0.0000   0.0000          ?        ? 12211.0879  83.6463          ?        ?     1105.0        3.8       ?       ? 
1 1 1   19    7   15 o    943.9    3.6    0.0000   0.0000          ?        ?  8910.5693  67.6833          ?        ?      943.9        3.6       ?       ? 
1 1 1   19    7   16 o    454.2    2.1    0.0000   0.0000          ?        ?  2063.0635  19.1556          ?        ?      454.2        2.1       ?       ? 
1 1 1   19    7   17 o   1219.9    4.2    0.0000   0.0000          ?        ? 14881.3857 103.4405          ?        ?     1219.9        4.2       ?       ? 
1 1 1   19    7   18 o   2002.8    6.6    0.0000   0.0000          ?        ? 40117.0352 266.2635          ?        ?     2002.8        6.6       ?       ? 
1 1 1   19    7   19 o   1358.1    4.7    0.0000   0.0000          ?        ? 18446.8906 126.4273          ?        ?     1358.1        4.7       ?       ? 
1 1 1   19    7   20 o    583.4    2.6    0.0000   0.0000          ?        ?  3403.3203  30.0105          ?        ?      583.4        2.6       ?       ? 
1 1 1   19    7   21 o   1268.2    4.4    0.0000   0.0000          ?        ? 16084.9990 112.3798          ?        ?     1268.2        4.4       ?       ? 
1 1 1   19    7   22 o    901.5    3.4    0.0000   0.0000          ?        ?  8127.7417  61.2981          ?        ?      901.5        3.4       ?       ? 
1 1 1   19    7   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    7   24 o   1685.6    5.7    0.0000   0.0000          ?        ? 28416.1270 191.5565          ?        ?     1685.6        5.7       ?       ? 
1 1 1   19    7   25 o    440.1    2.8    0.0000   0.0000          ?        ?  1936.6360  24.2638          ?        ?      440.1        2.8       ?       ? 
1 1 1   19    7   26 o    986.0    3.5    0.0000   0.0000          ?        ?  9722.7686  69.5989          ?        ?      986.0        3.5       ?       ? 
1 1 1   19    7   27 o    637.1    2.8    0.0000   0.0000          ?        ?  4058.4434  35.1187          ?        ?      637.1        2.8       ?       ? 
1 1 1   19    7   28 o    312.9    2.8    0.0000   0.0000          ?        ?   978.8537  17.2401          ?        ?      312.9        2.8       ?       ? 
1 1 1   19    7   29 o   1584.9    5.5    0.0000   0.0000          ?        ? 25121.3574 174.9549          ?        ?     1584.9        5.5       ?       ? 
1 1 1   19    7   30 o    293.4    2.7    0.0000   0.0000          ?        ?   860.7272  15.9630          ?        ?      293.4        2.7       ?       ? 
1 1 1   19    7   31 o     93.9    7.1    0.0000   0.0000          ?        ?    88.1160  13.4090          ?        ?       93.9        7.1       ?       ? 
1 1 1   19    7   32 o    254.9    3.3    0.0000   0.0000          ?        ?   650.0150  16.6016          ?        ?      254.9        3.3       ?       ? 
1 1 1   19    7   33 o    451.3    2.8    0.0000   0.0000          ?        ?  2036.8840  25.5409          ?        ?      451.3        2.8       ?       ? 
1 1 1   19    7   34 o   1267.5    4.5    0.0000   0.0000          ?        ? 16067.1201 113.0183          ?        ?     1267.5        4.5       ?       ? 
1 1 1   19    7   35 o    231.6    3.6    0.0000   0.0000          ?        ?   536.3582  16.6016          ?        ?      231.6        3.6       ?       ? 
1 1 1   19    7   36 o   1322.3    4.6    0.0000   0.0000          ?        ? 17487.1914 121.9576          ?        ?     1322.3        4.6       ?       ? 
1 1 1   19    7   37 o    445.3    2.7    0.0000   0.0000          ?        ?  1982.6096  23.6253          ?        ?      445.3        2.7       ?       ? 
1 1 1   19    7   38 o    420.6    2.7    0.0000   0.0000          ?        ?  1769.3435  22.3483          ?        ?      420.6        2.7       ?       ? 
1 1 1   19    7   39 o   1117.2    4.0    0.0000   0.0000          ?        ? 12481.8213  90.0316          ?        ?     1117.2        4.0       ?       ? 
1 1 1   19    7   40 o    203.9    4.2    0.0000   0.0000          ?        ?   415.6776  17.2401          ?        ?      203.9        4.2       ?       ? 
1 1 1   19    7   41 o    398.2    2.9    0.0000   0.0000          ?        ?  1586.0876  22.9868          ?        ?      398.2        2.9       ?       ? 
1 1 1   19    7   42 o    536.2    2.7    0.0000   0.0000          ?        ?  2875.2627  29.3720          ?        ?      536.2        2.7       ?       ? 
1 1 1   19    7   43 o    784.1    3.3    0.0000   0.0000          ?        ?  6148.3247  51.7203          ?        ?      784.1        3.3       ?       ? 
1 1 1   19    7   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    7   45 o    485.1    2.9    0.0000   0.0000          ?        ?  2353.5908  28.0950          ?        ?      485.1        2.9       ?       ? 
1 1 1   19    7   46 o    466.8    2.8    0.0000   0.0000          ?        ?  2179.2742  26.1794          ?        ?      466.8        2.8       ?       ? 
1 1 1   19    7   47 o    704.8    2.9    0.0000   0.0000          ?        ?  4967.6982  40.8654          ?        ?      704.8        2.9       ?       ? 
1 1 1   19    7   48 o    208.5    4.3    0.0000   0.0000          ?        ?   434.8332  17.8786          ?        ?      208.5        4.3       ?       ? 
1 1 1   19    7   49 o    375.4    2.8    0.0000   0.0000          ?        ?  1409.8557  21.0712          ?        ?      375.4        2.8       ?       ? 
1 1 1   19    7   50 o    543.6    2.6    0.0000   0.0000          ?        ?  2955.0781  28.0950          ?        ?      543.6        2.6       ?       ? 
1 1 1   19    7   51 o    351.2    2.9    0.0000   0.0000          ?        ?  1233.6238  20.4327          ?        ?      351.2        2.9       ?       ? 
1 1 1   19    7   52 f    291.4    3.3    0.0000   0.0000          ?        ?   849.2338  19.1556          ?        ?      291.4        3.3       ?       ? 
1 1 1   19    7   53 o    170.6    5.6    0.0000   0.0000          ?        ?   291.1659  19.1556          ?        ?      170.6        5.6       ?       ? 
1 1 1   19    7   54 o    529.7    2.7    0.0000   0.0000          ?        ?  2806.3025  28.0950          ?        ?      529.7        2.7       ?       ? 
1 1 1   19    7   55 o    778.4    3.1    0.0000   0.0000          ?        ?  6060.2085  47.8891          ?        ?      778.4        3.1       ?       ? 
1 1 1   19    7   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    7   57 o    285.9    3.7    0.0000   0.0000          ?        ?   817.9462  21.0712          ?        ?      285.9        3.7       ?       ? 
1 1 1   19    7   58 o    696.4    2.9    0.0000   0.0000          ?        ?  4850.8486  40.8654          ?        ?      696.4        2.9       ?       ? 
1 1 1   19    7   59 o    443.1    2.7    0.0000   0.0000          ?        ?  1964.0925  24.2638          ?        ?      443.1        2.7       ?       ? 
1 1 1   19    7   60 o    264.2    3.7    0.0000   0.0000          ?        ?   698.5427  19.7942          ?        ?      264.2        3.7       ?       ? 
1 1 1   19    7   61 o     20.6   10.4    0.0000   0.0000          ?        ?   -63.2136  19.7942          ?        ?       20.6       10.4       ?       ? 
1 1 1   19    7   62 o    390.3    2.9    0.0000   0.0000          ?        ?  1524.1511  22.9868          ?        ?      390.3        2.9       ?       ? 
1 1 1   19    7   63 o     21.9   10.9    0.0000   0.0000          ?        ?   -45.9736  18.5171          ?        ?       21.9       10.9       ?       ? 
1 1 1   19    7   64 o     91.1   11.2    0.0000   0.0000          ?        ?    83.6463  20.4327          ?        ?       91.1       11.2       ?       ? 
1 1 1   19    7   65 o    109.9    9.0    0.0000   0.0000          ?        ?   121.3191  19.7942          ?        ?      109.9        9.0       ?       ? 
1 1 1   19    7   66 o    162.3    6.5    0.0000   0.0000          ?        ?   264.3480  21.0712          ?        ?      162.3        6.5       ?       ? 
1 1 1   19    7   67 o     27.7   13.2    0.0000   0.0000          ?        ?   -26.8179  20.4327          ?        ?       27.7       13.2       ?       ? 
1 1 1   19    7   68 o     37.9   15.9    0.0000   0.0000          ?        ?     2.5541  20.4327          ?        ?       37.9       15.9       ?       ? 
1 1 1   19    7   69 o    189.0    5.6    0.0000   0.0000          ?        ?   358.2106  21.0712          ?        ?      189.0        5.6       ?       ? 
1 1 1   19    7   70 o    239.5    4.4    0.0000   0.0000          ?        ?   574.6694  21.0712          ?        ?      239.5        4.4       ?       ? 
1 1 1   19    7   71 o    132.6    7.9    0.0000   0.0000          ?        ?   176.8705  21.0712          ?        ?      132.6        7.9       ?       ? 
1 1 1   19    7   72 o     28.1   13.4    0.0000   0.0000          ?        ?   -27.4564  21.0712          ?        ?       28.1       13.4       ?       ? 
1 1 1   19    7   73 o     21.5   10.8    0.0000   0.0000          ?        ?   -68.9603  21.7097          ?        ?       21.5       10.8       ?       ? 
1 1 1   19    7   74 o    166.2    6.3    0.0000   0.0000          ?        ?   277.7569  21.0712          ?        ?      166.2        6.3       ?       ? 
1 1 1   19    7   75 o    163.2    6.5    0.0000   0.0000          ?        ?   268.1791  21.0712          ?        ?      163.2        6.5       ?       ? 
1 1 1   19    7   76 f     21.1   10.6    0.0000   0.0000          ?        ?   -62.5751  20.4327          ?        ?       21.1       10.6       ?       ? 
1 1 1   19    7   77 o    126.3    8.1    0.0000   0.0000          ?        ?   161.5460  20.4327          ?        ?      126.3        8.1       ?       ? 
1 1 1   19    8    0 o   1182.0    5.7 13972.1299 134.7281 13972.1299 134.7281 13972.1299 134.7281     1182.0      5.7     1182.0        5.7     0.0     0.0 
1 1 1   19    8    1 o    962.3    3.4    0.0000   0.0000          ?        ?  9261.1182  65.1292          ?        ?      962.3        3.4       ?       ? 
1 1 1   19    8    2 o    968.1    3.4    0.0000   0.0000          ?        ?  9372.8594  66.4062          ?        ?      968.1        3.4       ?       ? 
1 1 1   19    8    3 o    757.5    2.7    0.0000   0.0000          ?        ?  5737.7554  41.5039          ?        ?      757.5        2.7       ?       ? 
1 1 1   19    8    4 o    680.8    2.5    0.0000   0.0000          ?        ?  4635.6670  34.4802          ?        ?      680.8        2.5       ?       ? 
1 1 1   19    8    5 o    902.9    3.2    0.0000   0.0000          ?        ?  8152.6445  57.4669          ?        ?      902.9        3.2       ?       ? 
1 1 1   19    8    6 o    955.7    3.3    0.0000   0.0000          ?        ?  9134.0518  63.8522          ?        ?      955.7        3.3       ?       ? 
1 1 1   19    8    7 o    215.9    1.6    0.0000   0.0000          ?        ?   466.1208   7.0237          ?        ?      215.9        1.6       ?       ? 
1 1 1   19    8    8 o    637.5    2.5    0.0000   0.0000          ?        ?  4063.5518  31.2876          ?        ?      637.5        2.5       ?       ? 
1 1 1   19    8    9 o    986.1    3.4    0.0000   0.0000          ?        ?  9723.4072  67.6833          ?        ?      986.1        3.4       ?       ? 
1 1 1   19    8   10 o    999.3    3.5    0.0000   0.0000          ?        ?  9985.8398  69.5989          ?        ?      999.3        3.5       ?       ? 
1 1 1   19    8   11 o    880.2    3.1    0.0000   0.0000          ?        ?  7748.4600  54.9129          ?        ?      880.2        3.1       ?       ? 
1 1 1   19    8   12 o     92.5    3.5    0.0000   0.0000          ?        ?    85.5619   6.3852          ?        ?       92.5        3.5       ?       ? 
1 1 1   19    8   13 o   1924.3    6.4    0.0000   0.0000          ?        ? 37035.5312 246.4693          ?        ?     1924.3        6.4       ?       ? 
1 1 1   19    8   14 o    306.6    2.3    0.0000   0.0000          ?        ?   939.9038  14.0475          ?        ?      306.6        2.3       ?       ? 
1 1 1   19    8   15 f    812.6    3.0    0.0000   0.0000          ?        ?  6602.9521  49.1662          ?        ?      812.6        3.0       ?       ? 
1 1 1   19    8   16 f   1357.3    4.7    0.0000   0.0000          ?        ? 18422.6250 127.0658          ?        ?     1357.3        4.7       ?       ? 
1 1 1   19    8   17 f   1570.0    5.2    0.0000   0.0000          ?        ? 24651.4043 164.1001          ?        ?     1570.0        5.2       ?       ? 
1 1 1   19    8   18 o    715.1    2.8    0.0000   0.0000          ?        ?  5113.9199  39.5883          ?        ?      715.1        2.8       ?       ? 
1 1 1   19    8   19 o   1045.2    3.7    0.0000   0.0000          ?        ? 10925.1055  77.8996          ?        ?     1045.2        3.7       ?       ? 
1 1 1   19    8   20 o    962.2    3.5    0.0000   0.0000          ?        ?  9257.9248  67.0448          ?        ?      962.2        3.5       ?       ? 
1 1 1   19    8   21 o   2256.4    8.2    0.0000   0.0000          ?        ? 50923.3789 370.9810          ?        ?     2256.4        8.2       ?       ? 
1 1 1   19    8   22 o   1597.0    6.0    0.0000   0.0000          ?        ? 25506.3848 190.9180          ?        ?     1597.0        6.0       ?       ? 
1 1 1   19    8   23 o   1858.5    6.3    0.0000   0.0000          ?        ? 34542.7422 235.6145          ?        ?     1858.5        6.3       ?       ? 
1 1 1   19    8   24 o    649.2    2.8    0.0000   0.0000          ?        ?  4214.8809  35.7572          ?        ?      649.2        2.8       ?       ? 
1 1 1   19    8   25 o    510.5    2.4    0.0000   0.0000          ?        ?  2605.8069  24.2638          ?        ?      510.5        2.4       ?       ? 
1 1 1   19    8   26 o   1103.7    4.0    0.0000   0.0000          ?        ? 12182.9922  87.4775          ?        ?     1103.7        4.0       ?       ? 
1 1 1   19    8   27 o    734.3    2.9    0.0000   0.0000          ?        ?  5392.3149  42.7809          ?        ?      734.3        2.9       ?       ? 
1 1 1   19    8   28 o   1090.5    3.9    0.0000   0.0000          ?        ? 11893.7422  84.9234          ?        ?     1090.5        3.9       ?       ? 
1 1 1   19    8   29 o   1164.8    4.2    0.0000   0.0000          ?        ? 13569.2236  98.3323          ?        ?     1164.8        4.2       ?       ? 
1 1 1   19    8   30 o    108.1    6.8    0.0000   0.0000          ?        ?   116.8494  14.6860          ?        ?      108.1        6.8       ?       ? 
1 1 1   19    8   31 o    845.2    3.3    0.0000   0.0000          ?        ?  7144.4185  56.1899          ?        ?      845.2        3.3       ?       ? 
1 1 1   19    8   32 o   1825.9    6.8    0.0000   0.0000          ?        ? 33346.1523 248.3849          ?        ?     1825.9        6.8       ?       ? 
1 1 1   19    8   33 o   1581.8    5.6    0.0000   0.0000          ?        ? 25024.3008 178.1475          ?        ?     1581.8        5.6       ?       ? 
1 1 1   19    8   34 o   1146.6    4.2    0.0000   0.0000          ?        ? 13148.4375  95.7782          ?        ?     1146.6        4.2       ?       ? 
1 1 1   19    8   35 o    498.2    2.6    0.0000   0.0000          ?        ?  2482.5720  26.1794          ?        ?      498.2        2.6       ?       ? 
1 1 1   19    8   36 o    854.2    3.3    0.0000   0.0000          ?        ?  7296.3862  56.8284          ?        ?      854.2        3.3       ?       ? 
1 1 1   19    8   37 o    729.0    3.2    0.0000   0.0000          ?        ?  5315.0542  47.2506          ?        ?      729.0        3.2       ?       ? 
1 1 1   19    8   38 o    172.8    5.7    0.0000   0.0000          ?        ?   298.8281  19.7942          ?        ?      172.8        5.7       ?       ? 
1 1 1   19    8   39 o    389.6    3.0    0.0000   0.0000          ?        ?  1517.7659  23.6253          ?        ?      389.6        3.0       ?       ? 
1 1 1   19    8   40 o    417.5    2.6    0.0000   0.0000          ?        ?  1743.1641  21.7097          ?        ?      417.5        2.6       ?       ? 
1 1 1   19    8   41 o    229.4    4.0    0.0000   0.0000          ?        ?   526.1418  18.5171          ?        ?      229.4        4.0       ?       ? 
1 1 1   19    8   42 o    765.8    3.2    0.0000   0.0000          ?        ?  5864.8213  48.5276          ?        ?      765.8        3.2       ?       ? 
1 1 1   19    8   43 o    234.4    4.1    0.0000   0.0000          ?        ?   549.7671  19.1556          ?        ?      234.4        4.1       ?       ? 
1 1 1   19    8   44 o    508.7    2.8    0.0000   0.0000          ?        ?  2587.9280  28.7335          ?        ?      508.7        2.8       ?       ? 
1 1 1   19    8   45 o    737.0    3.2    0.0000   0.0000          ?        ?  5432.5420  46.6121          ?        ?      737.0        3.2       ?       ? 
1 1 1   19    8   46 o    442.0    2.8    0.0000   0.0000          ?        ?  1953.8762  24.9023          ?        ?      442.0        2.8       ?       ? 
1 1 1   19    8   47 o    394.0    2.8    0.0000   0.0000          ?        ?  1552.2461  22.3483          ?        ?      394.0        2.8       ?       ? 
1 1 1   19    8   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    8   49 o    434.6    2.7    0.0000   0.0000          ?        ?  1888.7469  23.6253          ?        ?      434.6        2.7       ?       ? 
1 1 1   19    8   50 o    269.9    3.3    0.0000   0.0000          ?        ?   728.5532  17.8786          ?        ?      269.9        3.3       ?       ? 
1 1 1   19    8   51 o    457.8    2.6    0.0000   0.0000          ?        ?  2096.2664  23.6253          ?        ?      457.8        2.6       ?       ? 
1 1 1   19    8   52 o    232.4    4.1    0.0000   0.0000          ?        ?   540.1893  19.1556          ?        ?      232.4        4.1       ?       ? 
1 1 1   19    8   53 o    355.5    3.0    0.0000   0.0000          ?        ?  1264.2728  21.0712          ?        ?      355.5        3.0       ?       ? 
1 1 1   19    8   54 o    516.3    2.7    0.0000   0.0000          ?        ?  2666.4663  27.4564          ?        ?      516.3        2.7       ?       ? 
1 1 1   19    8   55 o    419.7    2.7    0.0000   0.0000          ?        ?  1761.6812  22.9868          ?        ?      419.7        2.7       ?       ? 
1 1 1   19    8   56 o    124.9    7.9    0.0000   0.0000          ?        ?   156.4378  19.7942          ?        ?      124.9        7.9       ?       ? 
1 1 1   19    8   57 o    504.7    2.7    0.0000   0.0000          ?        ?  2548.3398  26.8179          ?        ?      504.7        2.7       ?       ? 
1 1 1   19    8   58 o    324.6    3.1    0.0000   0.0000          ?        ?  1054.1992  20.4327          ?        ?      324.6        3.1       ?       ? 
1 1 1   19    8   59 o    306.2    3.4    0.0000   0.0000          ?        ?   937.9882  21.0712          ?        ?      306.2        3.4       ?       ? 
1 1 1   19    8   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    8   61 o    350.1    3.3    0.0000   0.0000          ?        ?  1226.6001  22.9868          ?        ?      350.1        3.3       ?       ? 
1 1 1   19    8   62 o    315.1    3.4    0.0000   0.0000          ?        ?   993.5397  21.7097          ?        ?      315.1        3.4       ?       ? 
1 1 1   19    8   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    8   64 o     99.8    9.9    0.0000   0.0000          ?        ?   100.2479  19.7942          ?        ?       99.8        9.9       ?       ? 
1 1 1   19    8   65 o    326.0    3.4    0.0000   0.0000          ?        ?  1063.7771  22.3483          ?        ?      326.0        3.4       ?       ? 
1 1 1   19    8   66 o    161.0    6.3    0.0000   0.0000          ?        ?   259.8783  20.4327          ?        ?      161.0        6.3       ?       ? 
1 1 1   19    8   67 o     32.3   14.6    0.0000   0.0000          ?        ?    -9.5778  19.7942          ?        ?       32.3       14.6       ?       ? 
1 1 1   19    8   68 o     22.8   11.3    0.0000   0.0000          ?        ?   -51.7203  20.4327          ?        ?       22.8       11.3       ?       ? 
1 1 1   19    8   69 o     41.6   17.0    0.0000   0.0000          ?        ?     7.0237  22.3483          ?        ?       41.6       17.0       ?       ? 
1 1 1   19    8   70 o    272.3    4.2    0.0000   0.0000          ?        ?   742.6006  22.9868          ?        ?      272.3        4.2       ?       ? 
1 1 1   19    8   71 o    238.9    4.7    0.0000   0.0000          ?        ?   572.1154  22.3483          ?        ?      238.9        4.7       ?       ? 
1 1 1   19    8   72 o     25.2   12.4    0.0000   0.0000          ?        ?   -47.2506  22.3483          ?        ?       25.2       12.4       ?       ? 
1 1 1   19    8   73 o     81.3   13.3    0.0000   0.0000          ?        ?    67.6833  21.7097          ?        ?       81.3       13.3       ?       ? 
1 1 1   19    8   74 o    376.9    3.0    0.0000   0.0000          ?        ?  1422.6262  22.9868          ?        ?      376.9        3.0       ?       ? 
1 1 1   19    8   75 f     33.8   15.0    0.0000   0.0000          ?        ?    -6.3852  20.4327          ?        ?       33.8       15.0       ?       ? 
1 1 1   19    8   76 o    292.1    4.0    0.0000   0.0000          ?        ?   855.6190  23.6253          ?        ?      292.1        4.0       ?       ? 
1 1 1   19    8   77 o    243.3    4.3    0.0000   0.0000          ?        ?   594.4636  21.0712          ?        ?      243.3        4.3       ?       ? 
1 1 1   19    9    0 o    631.1    3.7 3983.7366  47.2506  3983.7366  47.2506  3983.7366  47.2506      631.1      3.7      631.1        3.7     0.0     0.0 
1 1 1   19    9    1 o   2246.9    7.8    0.0000   0.0000          ?        ? 50495.5703 351.8254          ?        ?     2246.9        7.8       ?       ? 
1 1 1   19    9    2 o    367.1    2.0    0.0000   0.0000          ?        ?  1347.2806  14.6860          ?        ?      367.1        2.0       ?       ? 
1 1 1   19    9    3 o    557.2    2.2    0.0000   0.0000          ?        ?  3105.1306  24.9023          ?        ?      557.2        2.2       ?       ? 
1 1 1   19    9    4 o    572.3    2.5    0.0000   0.0000          ?        ?  3274.9775  28.0950          ?        ?      572.3        2.5       ?       ? 
1 1 1   19    9    5 o    790.8    2.9    0.0000   0.0000          ?        ?  6254.3193  45.9736          ?        ?      790.8        2.9       ?       ? 
1 1 1   19    9    6 o   1158.5    4.2    0.0000   0.0000          ?        ? 13423.0010  96.4168          ?        ?     1158.5        4.2       ?       ? 
1 1 1   19    9    7 o    707.6    2.8    0.0000   0.0000          ?        ?  5007.2866  38.9498          ?        ?      707.6        2.8       ?       ? 
1 1 1   19    9    8 o    187.7    2.4    0.0000   0.0000          ?        ?   352.4639   8.9393          ?        ?      187.7        2.4       ?       ? 
1 1 1   19    9    9 o    164.1    2.1    0.0000   0.0000          ?        ?   269.4561   7.0237          ?        ?      164.1        2.1       ?       ? 
1 1 1   19    9   10 o   1513.2    5.0    0.0000   0.0000          ?        ? 22899.9395 151.9681          ?        ?     1513.2        5.0       ?       ? 
1 1 1   19    9   11 o   1104.5    3.9    0.0000   0.0000          ?        ? 12200.8711  85.5619          ?        ?     1104.5        3.9       ?       ? 
1 1 1   19    9   12 o    373.7    2.1    0.0000   0.0000          ?        ?  1396.4468  15.3245          ?        ?      373.7        2.1       ?       ? 
1 1 1   19    9   13 o   1649.0    5.7    0.0000   0.0000          ?        ? 27195.9141 188.3639          ?        ?     1649.0        5.7       ?       ? 
1 1 1   19    9   14 o    901.5    3.3    0.0000   0.0000          ?        ?  8126.4644  59.3825          ?        ?      901.5        3.3       ?       ? 
1 1 1   19    9   15 o   1862.4    6.2    0.0000   0.0000          ?        ? 34690.2422 231.1448          ?        ?     1862.4        6.2       ?       ? 
1 1 1   19    9   16 o   1228.3    4.4    0.0000   0.0000          ?        ? 15088.9053 107.9102          ?        ?     1228.3        4.4       ?       ? 
1 1 1   19    9   17 f    340.9    2.2    0.0000   0.0000          ?        ?  1162.1094  14.6860          ?        ?      340.9        2.2       ?       ? 
1 1 1   19    9   18 o   1052.1    3.9    0.0000   0.0000          ?        ? 11068.7725  81.0922          ?        ?     1052.1        3.9       ?       ? 
1 1 1   19    9   19 o    629.1    2.6    0.0000   0.0000          ?        ?  3958.1958  32.5646          ?        ?      629.1        2.6       ?       ? 
1 1 1   19    9   20 o    660.0    2.7    0.0000   0.0000          ?        ?  4356.6328  35.7572          ?        ?      660.0        2.7       ?       ? 
1 1 1   19    9   21 o   1504.8    5.3    0.0000   0.0000          ?        ? 22645.8086 158.3534          ?        ?     1504.8        5.3       ?       ? 
1 1 1   19    9   22 o   1286.2    4.5    0.0000   0.0000          ?        ? 16543.4570 114.9339          ?        ?     1286.2        4.5       ?       ? 
1 1 1   19    9   23 o   2397.6    8.7    0.0000   0.0000          ?        ? 57498.8711 415.6776          ?        ?     2397.6        8.7       ?       ? 
1 1 1   19    9   24 o    818.5    3.2    0.0000   0.0000          ?        ?  6699.3687  52.9973          ?        ?      818.5        3.2       ?       ? 
1 1 1   19    9   25 f   2296.6    8.0    0.0000   0.0000          ?        ? 52755.2930 365.2344          ?        ?     2296.6        8.0       ?       ? 
1 1 1   19    9   26 o    872.0    3.3    0.0000   0.0000          ?        ?  7604.7925  56.8284          ?        ?      872.0        3.3       ?       ? 
1 1 1   19    9   27 o    619.8    2.6    0.0000   0.0000          ?        ?  3841.9846  32.5646          ?        ?      619.8        2.6       ?       ? 
1 1 1   19    9   28 o    682.9    2.8    0.0000   0.0000          ?        ?  4663.7622  38.3113          ?        ?      682.9        2.8       ?       ? 
1 1 1   19    9   29 o   1324.6    4.9    0.0000   0.0000          ?        ? 17547.2129 128.9814          ?        ?     1324.6        4.9       ?       ? 
1 1 1   19    9   30 o   1189.4    4.4    0.0000   0.0000          ?        ? 14148.3623 104.0790          ?        ?     1189.4        4.4       ?       ? 
1 1 1   19    9   31 o    829.6    3.4    0.0000   0.0000          ?        ?  6881.9863  56.8284          ?        ?      829.6        3.4       ?       ? 
1 1 1   19    9   32 o   1595.3    5.7    0.0000   0.0000          ?        ? 25454.6641 181.9787          ?        ?     1595.3        5.7       ?       ? 
1 1 1   19    9   33 o    602.7    3.0    0.0000   0.0000          ?        ?  3633.1880  36.3957          ?        ?      602.7        3.0       ?       ? 
1 1 1   19    9   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    9   35 o    634.4    3.0    0.0000   0.0000          ?        ?  4024.6018  37.6728          ?        ?      634.4        3.0       ?       ? 
1 1 1   19    9   36 o    756.3    3.3    0.0000   0.0000          ?        ?  5720.5156  50.4432          ?        ?      756.3        3.3       ?       ? 
1 1 1   19    9   37 o    938.0    3.4    0.0000   0.0000          ?        ?  8799.4668  64.4907          ?        ?      938.0        3.4       ?       ? 
1 1 1   19    9   38 f    780.2    3.2    0.0000   0.0000          ?        ?  6087.6655  49.8047          ?        ?      780.2        3.2       ?       ? 
1 1 1   19    9   39 o    134.6    6.2    0.0000   0.0000          ?        ?   181.3401  16.6016          ?        ?      134.6        6.2       ?       ? 
1 1 1   19    9   40 o    666.9    2.9    0.0000   0.0000          ?        ?  4447.3032  38.3113          ?        ?      666.9        2.9       ?       ? 
1 1 1   19    9   41 o    576.1    3.0    0.0000   0.0000          ?        ?  3319.6741  35.1187          ?        ?      576.1        3.0       ?       ? 
1 1 1   19    9   42 o    598.4    3.0    0.0000   0.0000          ?        ?  3581.4680  35.7572          ?        ?      598.4        3.0       ?       ? 
1 1 1   19    9   43 o    956.8    3.7    0.0000   0.0000          ?        ?  9157.0381  70.2374          ?        ?      956.8        3.7       ?       ? 
1 1 1   19    9   44 o    199.3    4.5    0.0000   0.0000          ?        ?   397.1605  17.8786          ?        ?      199.3        4.5       ?       ? 
1 1 1   19    9   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    9   46 o    859.5    3.2    0.0000   0.0000          ?        ?  7388.3335  54.9129          ?        ?      859.5        3.2       ?       ? 
1 1 1   19    9   47 o    375.1    2.8    0.0000   0.0000          ?        ?  1407.3016  21.0712          ?        ?      375.1        2.8       ?       ? 
1 1 1   19    9   48 o    231.6    4.1    0.0000   0.0000          ?        ?   536.3582  19.1556          ?        ?      231.6        4.1       ?       ? 
1 1 1   19    9   49 f    317.4    3.0    0.0000   0.0000          ?        ?  1007.5872  19.1556          ?        ?      317.4        3.0       ?       ? 
1 1 1   19    9   50 o    234.4    3.8    0.0000   0.0000          ?        ?   549.7671  17.8786          ?        ?      234.4        3.8       ?       ? 
1 1 1   19    9   51 o    236.6    3.8    0.0000   0.0000          ?        ?   559.9835  17.8786          ?        ?      236.6        3.8       ?       ? 
1 1 1   19    9   52 o    422.6    2.6    0.0000   0.0000          ?        ?  1786.5834  22.3483          ?        ?      422.6        2.6       ?       ? 
1 1 1   19    9   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    9   54 o    479.4    2.8    0.0000   0.0000          ?        ?  2298.6777  26.8179          ?        ?      479.4        2.8       ?       ? 
1 1 1   19    9   55 o    329.3    3.2    0.0000   0.0000          ?        ?  1084.8481  21.0712          ?        ?      329.3        3.2       ?       ? 
1 1 1   19    9   56 o     20.0   10.1    0.0000   0.0000          ?        ?   -58.7440  18.5171          ?        ?       20.0       10.1       ?       ? 
1 1 1   19    9   57 o    218.0    4.1    0.0000   0.0000          ?        ?   475.6986  17.8786          ?        ?      218.0        4.1       ?       ? 
1 1 1   19    9   58 o    154.8    5.8    0.0000   0.0000          ?        ?   240.0841  17.8786          ?        ?      154.8        5.8       ?       ? 
1 1 1   19    9   59 o     19.7   10.0    0.0000   0.0000          ?        ?   -70.8759  19.7942          ?        ?       19.7       10.0       ?       ? 
1 1 1   19    9   60 o    133.5    6.9    0.0000   0.0000          ?        ?   178.7861  18.5171          ?        ?      133.5        6.9       ?       ? 
1 1 1   19    9   61 o    143.7    6.4    0.0000   0.0000          ?        ?   206.8810  18.5171          ?        ?      143.7        6.4       ?       ? 
1 1 1   19    9   62 o    391.4    3.0    0.0000   0.0000          ?        ?  1532.4519  23.6253          ?        ?      391.4        3.0       ?       ? 
1 1 1   19    9   63 o    329.8    3.3    0.0000   0.0000          ?        ?  1088.6793  21.7097          ?        ?      329.8        3.3       ?       ? 
1 1 1   19    9   64 o    174.0    5.9    0.0000   0.0000          ?        ?   303.2978  20.4327          ?        ?      174.0        5.9       ?       ? 
1 1 1   19    9   65 o    157.4    6.3    0.0000   0.0000          ?        ?   248.3849  19.7942          ?        ?      157.4        6.3       ?       ? 
1 1 1   19    9   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19    9   67 o     31.0   14.3    0.0000   0.0000          ?        ?   -15.3245  20.4327          ?        ?       31.0       14.3       ?       ? 
1 1 1   19    9   68 o    229.0    4.7    0.0000   0.0000          ?        ?   525.5033  21.7097          ?        ?      229.0        4.7       ?       ? 
1 1 1   19    9   69 o    168.8    6.4    0.0000   0.0000          ?        ?   286.0577  21.7097          ?        ?      168.8        6.4       ?       ? 
1 1 1   19    9   70 o    311.4    3.7    0.0000   0.0000          ?        ?   971.1914  22.9868          ?        ?      311.4        3.7       ?       ? 
1 1 1   19    9   71 o     56.4   17.2    0.0000   0.0000          ?        ?    33.2031  21.0712          ?        ?       56.4       17.2       ?       ? 
1 1 1   19    9   72 o    171.7    6.1    0.0000   0.0000          ?        ?   296.2740  21.0712          ?        ?      171.7        6.1       ?       ? 
1 1 1   19    9   73 o     36.3   15.5    0.0000   0.0000          ?        ?     0.6385  19.7942          ?        ?       36.3       15.5       ?       ? 
1 1 1   19    9   74 o    163.2    6.5    0.0000   0.0000          ?        ?   268.1791  21.0712          ?        ?      163.2        6.5       ?       ? 
1 1 1   19    9   75 o     35.3   15.4    0.0000   0.0000          ?        ?    -2.5541  20.4327          ?        ?       35.3       15.4       ?       ? 
1 1 1   19    9   76 o     43.6   16.7    0.0000   0.0000          ?        ?    14.6860  20.4327          ?        ?       43.6       16.7       ?       ? 
1 1 1   19   10    0 o    500.0    3.5 2500.4507  35.1187  2500.4507  35.1187  2500.4507  35.1187      500.0      3.5      500.0        3.5     0.0     0.0 
1 1 1   19   10    1 o   1950.8    7.0    0.0000   0.0000          ?        ? 38062.2734 273.9258          ?        ?     1950.8        7.0       ?       ? 
1 1 1   19   10    2 o   1998.3    7.0    0.0000   0.0000          ?        ? 39937.6133 278.3954          ?        ?     1998.3        7.0       ?       ? 
1 1 1   19   10    3 o   1861.9    6.5    0.0000   0.0000          ?        ? 34671.0859 242.6382          ?        ?     1861.9        6.5       ?       ? 
1 1 1   19   10    4 o    946.2    3.5    0.0000   0.0000          ?        ?  8953.9893  65.7677          ?        ?      946.2        3.5       ?       ? 
1 1 1   19   10    5 o    565.3    2.3    0.0000   0.0000          ?        ?  3195.1621  26.1794          ?        ?      565.3        2.3       ?       ? 
1 1 1   19   10    6 o   1028.6    3.8    0.0000   0.0000          ?        ? 10580.9414  79.1767          ?        ?     1028.6        3.8       ?       ? 
1 1 1   19   10    7 o    790.7    2.9    0.0000   0.0000          ?        ?  6252.4038  46.6121          ?        ?      790.7        2.9       ?       ? 
1 1 1   19   10    8 o   1665.9    5.7    0.0000   0.0000          ?        ? 27754.6211 190.9180          ?        ?     1665.9        5.7       ?       ? 
1 1 1   19   10    9 o   2688.5    9.7    0.0000   0.0000          ?        ? 72304.2734 522.9492          ?        ?     2688.5        9.7       ?       ? 
1 1 1   19   10   10 o   1230.7    4.4    0.0000   0.0000          ?        ? 15148.2861 107.9102          ?        ?     1230.7        4.4       ?       ? 
1 1 1   19   10   11 o    493.2    2.2    0.0000   0.0000          ?        ?  2432.7673  21.7097          ?        ?      493.2        2.2       ?       ? 
1 1 1   19   10   12 o   2360.2    8.1    0.0000   0.0000          ?        ? 55716.1172 384.3900          ?        ?     2360.2        8.1       ?       ? 
1 1 1   19   10   13 o   1827.7    6.6    0.0000   0.0000          ?        ? 33408.7305 240.0841          ?        ?     1827.7        6.6       ?       ? 
1 1 1   19   10   14 f   1999.6    6.9    0.0000   0.0000          ?        ? 39990.6094 277.7569          ?        ?     1999.6        6.9       ?       ? 
1 1 1   19   10   15 o    429.0    2.2    0.0000   0.0000          ?        ?  1840.8578  19.1556          ?        ?      429.0        2.2       ?       ? 
1 1 1   19   10   16 o   1285.5    4.8    0.0000   0.0000          ?        ? 16526.8555 123.2347          ?        ?     1285.5        4.8       ?       ? 
1 1 1   19   10   17 f   1588.0    5.6    0.0000   0.0000          ?        ? 25218.4121 179.4246          ?        ?     1588.0        5.6       ?       ? 
1 1 1   19   10   18 o    283.8    2.4    0.0000   0.0000          ?        ?   805.1758  13.4090          ?        ?      283.8        2.4       ?       ? 
1 1 1   19   10   19 f   2382.7    8.6    0.0000   0.0000          ?        ? 56785.0078 411.2079          ?        ?     2382.7        8.6       ?       ? 
1 1 1   19   10   20 o    485.7    2.5    0.0000   0.0000          ?        ?  2359.3374  24.2638          ?        ?      485.7        2.5       ?       ? 
1 1 1   19   10   21 o    600.1    2.7    0.0000   0.0000          ?        ?  3601.2620  32.5646          ?        ?      600.1        2.7       ?       ? 
1 1 1   19   10   22 o   1066.9    4.0    0.0000   0.0000          ?        ? 11384.2021  85.5619          ?        ?     1066.9        4.0       ?       ? 
1 1 1   19   10   23 o   1589.5    5.4    0.0000   0.0000          ?        ? 25267.5781 172.4008          ?        ?     1589.5        5.4       ?       ? 
1 1 1   19   10   24 o   1244.5    4.6    0.0000   0.0000          ?        ? 15488.6191 115.5724          ?        ?     1244.5        4.6       ?       ? 
1 1 1   19   10   25 f    702.9    2.9    0.0000   0.0000          ?        ?  4941.5190  40.2269          ?        ?      702.9        2.9       ?       ? 
1 1 1   19   10   26 o    959.2    3.5    0.0000   0.0000          ?        ?  9201.0967  67.0448          ?        ?      959.2        3.5       ?       ? 
1 1 1   19   10   27 o    378.9    2.4    0.0000   0.0000          ?        ?  1436.0352  17.8786          ?        ?      378.9        2.4       ?       ? 
1 1 1   19   10   28 o   1116.3    4.0    0.0000   0.0000          ?        ? 12462.6650  88.7545          ?        ?     1116.3        4.0       ?       ? 
1 1 1   19   10   29 o     30.0   13.9    0.0000   0.0000          ?        ?   -17.2401  19.7942          ?        ?       30.0       13.9       ?       ? 
1 1 1   19   10   30 o   1046.8    4.0    0.0000   0.0000          ?        ? 10958.9473  83.6463          ?        ?     1046.8        4.0       ?       ? 
1 1 1   19   10   31 o    601.8    2.7    0.0000   0.0000          ?        ?  3621.6948  32.5646          ?        ?      601.8        2.7       ?       ? 
1 1 1   19   10   32 o   1106.6    4.3    0.0000   0.0000          ?        ? 12246.8447  94.5012          ?        ?     1106.6        4.3       ?       ? 
1 1 1   19   10   33 o    249.1    3.6    0.0000   0.0000          ?        ?   620.6430  17.8786          ?        ?      249.1        3.6       ?       ? 
1 1 1   19   10   34 o    718.1    2.9    0.0000   0.0000          ?        ?  5156.7007  42.1424          ?        ?      718.1        2.9       ?       ? 
1 1 1   19   10   35 f   1053.1    3.9    0.0000   0.0000          ?        ? 11091.1211  82.3693          ?        ?     1053.1        3.9       ?       ? 
1 1 1   19   10   36 o     20.9   10.5    0.0000   0.0000          ?        ?   -61.2981  19.7942          ?        ?       20.9       10.5       ?       ? 
1 1 1   19   10   37 o    330.0    2.9    0.0000   0.0000          ?        ?  1089.3180  19.1556          ?        ?      330.0        2.9       ?       ? 
1 1 1   19   10   38 o    710.4    3.1    0.0000   0.0000          ?        ?  5047.5137  43.4195          ?        ?      710.4        3.1       ?       ? 
1 1 1   19   10   39 o    467.6    2.7    0.0000   0.0000          ?        ?  2186.2981  24.9023          ?        ?      467.6        2.7       ?       ? 
1 1 1   19   10   40 o    202.6    4.4    0.0000   0.0000          ?        ?   410.5694  17.8786          ?        ?      202.6        4.4       ?       ? 
1 1 1   19   10   41 o    623.6    2.8    0.0000   0.0000          ?        ?  3888.5967  35.1187          ?        ?      623.6        2.8       ?       ? 
1 1 1   19   10   42 f    123.8    7.2    0.0000   0.0000          ?        ?   153.2452  17.8786          ?        ?      123.8        7.2       ?       ? 
1 1 1   19   10   43 o    379.3    2.9    0.0000   0.0000          ?        ?  1439.2277  22.3483          ?        ?      379.3        2.9       ?       ? 
1 1 1   19   10   44 o    745.7    3.0    0.0000   0.0000          ?        ?  5561.5234  44.6965          ?        ?      745.7        3.0       ?       ? 
1 1 1   19   10   45 o    649.3    2.9    0.0000   0.0000          ?        ?  4216.1582  37.0343          ?        ?      649.3        2.9       ?       ? 
1 1 1   19   10   46 o    445.6    3.2    0.0000   0.0000          ?        ?  1985.8022  28.7335          ?        ?      445.6        3.2       ?       ? 
1 1 1   19   10   47 o    488.9    2.6    0.0000   0.0000          ?        ?  2390.6250  25.5409          ?        ?      488.9        2.6       ?       ? 
1 1 1   19   10   48 o    471.4    2.6    0.0000   0.0000          ?        ?  2222.6938  24.9023          ?        ?      471.4        2.6       ?       ? 
1 1 1   19   10   49 o    788.0    3.0    0.0000   0.0000          ?        ?  6210.2612  47.8891          ?        ?      788.0        3.0       ?       ? 
1 1 1   19   10   50 o    215.1    4.3    0.0000   0.0000          ?        ?   462.9282  18.5171          ?        ?      215.1        4.3       ?       ? 
1 1 1   19   10   51 f    452.1    2.8    0.0000   0.0000          ?        ?  2044.5464  25.5409          ?        ?      452.1        2.8       ?       ? 
1 1 1   19   10   52 o    407.5    2.7    0.0000   0.0000          ?        ?  1660.7948  22.3483          ?        ?      407.5        2.7       ?       ? 
1 1 1   19   10   53 o    136.4    6.8    0.0000   0.0000          ?        ?   186.4483  18.5171          ?        ?      136.4        6.8       ?       ? 
1 1 1   19   10   54 o     69.7   12.8    0.0000   0.0000          ?        ?    50.4432  17.2401          ?        ?       69.7       12.8       ?       ? 
1 1 1   19   10   55 o    306.2    3.2    0.0000   0.0000          ?        ?   937.9882  19.7942          ?        ?      306.2        3.2       ?       ? 
1 1 1   19   10   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   10   57 o     20.8   10.4    0.0000   0.0000          ?        ?   -48.5276  17.8786          ?        ?       20.8       10.4       ?       ? 
1 1 1   19   10   58 o    138.0    6.7    0.0000   0.0000          ?        ?   190.9180  18.5171          ?        ?      138.0        6.7       ?       ? 
1 1 1   19   10   59 o    367.3    3.0    0.0000   0.0000          ?        ?  1349.8347  21.7097          ?        ?      367.3        3.0       ?       ? 
1 1 1   19   10   60 o     42.1   16.2    0.0000   0.0000          ?        ?    12.1319  19.1556          ?        ?       42.1       16.2       ?       ? 
1 1 1   19   10   61 o    545.8    2.7    0.0000   0.0000          ?        ?  2979.9805  30.0105          ?        ?      545.8        2.7       ?       ? 
1 1 1   19   10   62 o     21.6   10.8    0.0000   0.0000          ?        ?   -51.7203  19.1556          ?        ?       21.6       10.8       ?       ? 
1 1 1   19   10   63 o    278.3    3.8    0.0000   0.0000          ?        ?   775.1653  21.0712          ?        ?      278.3        3.8       ?       ? 
1 1 1   19   10   64 o    337.6    3.3    0.0000   0.0000          ?        ?  1140.3997  22.3483          ?        ?      337.6        3.3       ?       ? 
1 1 1   19   10   65 o    189.4    5.6    0.0000   0.0000          ?        ?   359.4877  21.0712          ?        ?      189.4        5.6       ?       ? 
1 1 1   19   10   66 o     22.4   11.1    0.0000   0.0000          ?        ?   -50.4432  19.7942          ?        ?       22.4       11.1       ?       ? 
1 1 1   19   10   67 o    306.2    3.6    0.0000   0.0000          ?        ?   938.6268  22.3483          ?        ?      306.2        3.6       ?       ? 
1 1 1   19   10   68 o     27.1   13.0    0.0000   0.0000          ?        ?   -29.3720  20.4327          ?        ?       27.1       13.0       ?       ? 
1 1 1   19   10   69 o    159.5    6.2    0.0000   0.0000          ?        ?   255.4086  19.7942          ?        ?      159.5        6.2       ?       ? 
1 1 1   19   10   70 o    113.4    9.0    0.0000   0.0000          ?        ?   129.6199  20.4327          ?        ?      113.4        9.0       ?       ? 
1 1 1   19   10   71 o    123.8    8.5    0.0000   0.0000          ?        ?   154.5222  21.0712          ?        ?      123.8        8.5       ?       ? 
1 1 1   19   10   72 o     28.4   13.5    0.0000   0.0000          ?        ?   -26.1794  21.0712          ?        ?       28.4       13.5       ?       ? 
1 1 1   19   10   73 o    108.5    9.7    0.0000   0.0000          ?        ?   119.4035  21.0712          ?        ?      108.5        9.7       ?       ? 
1 1 1   19   10   74 o    173.0    5.7    0.0000   0.0000          ?        ?   300.7437  19.7942          ?        ?      173.0        5.7       ?       ? 
1 1 1   19   10   75 o     33.6   15.1    0.0000   0.0000          ?        ?    -8.3008  21.0712          ?        ?       33.6       15.1       ?       ? 
1 1 1   19   10   76 o    134.6    7.4    0.0000   0.0000          ?        ?   183.2557  19.7942          ?        ?      134.6        7.4       ?       ? 
1 1 1   19   11    0 o   2008.1   10.7 40335.4102 431.0021 40335.4102 431.0021 40335.4102 431.0021     2008.1     10.7     2008.1       10.7     0.0     0.0 
1 1 1   19   11    1 o    724.4    3.3    0.0000   0.0000          ?        ?  5248.0093  47.8891          ?        ?      724.4        3.3       ?       ? 
1 1 1   19   11    2 o    209.3    3.1    0.0000   0.0000          ?        ?   438.0258  12.7704          ?        ?      209.3        3.1       ?       ? 
1 1 1   19   11    3 o   1249.2    4.8    0.0000   0.0000          ?        ? 15605.4688 119.4035          ?        ?     1249.2        4.8       ?       ? 
1 1 1   19   11    4 f    342.7    2.1    0.0000   0.0000          ?        ?  1174.2412  14.6860          ?        ?      342.7        2.1       ?       ? 
1 1 1   19   11    5 o   1402.2    5.1    0.0000   0.0000          ?        ? 19663.9121 141.7518          ?        ?     1402.2        5.1       ?       ? 
1 1 1   19   11    6 f    460.4    2.1    0.0000   0.0000          ?        ?  2119.8918  19.7942          ?        ?      460.4        2.1       ?       ? 
1 1 1   19   11    7 o   1004.8    3.9    0.0000   0.0000          ?        ? 10096.9424  79.1767          ?        ?     1004.8        3.9       ?       ? 
1 1 1   19   11    8 o    669.5    2.7    0.0000   0.0000          ?        ?  4481.7837  36.3957          ?        ?      669.5        2.7       ?       ? 
1 1 1   19   11    9 o    773.2    2.9    0.0000   0.0000          ?        ?  5979.1167  45.3350          ?        ?      773.2        2.9       ?       ? 
1 1 1   19   11   10 o    584.6    2.5    0.0000   0.0000          ?        ?  3417.3679  28.7335          ?        ?      584.6        2.5       ?       ? 
1 1 1   19   11   11 o    792.7    2.9    0.0000   0.0000          ?        ?  6283.6914  45.3350          ?        ?      792.7        2.9       ?       ? 
1 1 1   19   11   12 f    359.8    2.0    0.0000   0.0000          ?        ?  1294.9219  14.0475          ?        ?      359.8        2.0       ?       ? 
1 1 1   19   11   13 o    818.8    3.0    0.0000   0.0000          ?        ?  6703.8389  49.8047          ?        ?      818.8        3.0       ?       ? 
1 1 1   19   11   14 o    934.6    3.5    0.0000   0.0000          ?        ?  8734.3379  65.1292          ?        ?      934.6        3.5       ?       ? 
1 1 1   19   11   15 o   1398.9    4.8    0.0000   0.0000          ?        ? 19571.3262 135.3666          ?        ?     1398.9        4.8       ?       ? 
1 1 1   19   11   16 o   1148.8    4.1    0.0000   0.0000          ?        ? 13198.8809  93.2242          ?        ?     1148.8        4.1       ?       ? 
1 1 1   19   11   17 o   1080.7    3.8    0.0000   0.0000          ?        ? 11679.8369  81.7308          ?        ?     1080.7        3.8       ?       ? 
1 1 1   19   11   18 o    837.0    3.6    0.0000   0.0000          ?        ?  7005.2207  60.6596          ?        ?      837.0        3.6       ?       ? 
1 1 1   19   11   19 o   3119.8   15.4    0.0000   0.0000          ?        ? 97402.0000 963.5291          ?        ?     3119.8       15.4       ?       ? 
1 1 1   19   11   20 o    780.7    3.5    0.0000   0.0000          ?        ?  6094.6890  54.2743          ?        ?      780.7        3.5       ?       ? 
1 1 1   19   11   21 o   1132.3    4.3    0.0000   0.0000          ?        ? 12822.7910  96.4168          ?        ?     1132.3        4.3       ?       ? 
1 1 1   19   11   22 o     80.7    7.5    0.0000   0.0000          ?        ?    65.1292  12.1319          ?        ?       80.7        7.5       ?       ? 
1 1 1   19   11   23 o   1050.3    3.9    0.0000   0.0000          ?        ? 11031.7383  81.0922          ?        ?     1050.3        3.9       ?       ? 
1 1 1   19   11   24 o   1052.5    3.9    0.0000   0.0000          ?        ? 11077.7119  83.0078          ?        ?     1052.5        3.9       ?       ? 
1 1 1   19   11   25 o    730.0    3.0    0.0000   0.0000          ?        ?  5329.1016  43.4195          ?        ?      730.0        3.0       ?       ? 
1 1 1   19   11   26 o   1286.8    4.6    0.0000   0.0000          ?        ? 16560.6973 117.4880          ?        ?     1286.8        4.6       ?       ? 
1 1 1   19   11   27 o    793.2    3.3    0.0000   0.0000          ?        ?  6291.3535  51.7203          ?        ?      793.2        3.3       ?       ? 
1 1 1   19   11   28 o    986.9    3.8    0.0000   0.0000          ?        ?  9740.0088  74.0685          ?        ?      986.9        3.8       ?       ? 
1 1 1   19   11   29 o    618.8    2.7    0.0000   0.0000          ?        ?  3829.2144  33.8416          ?        ?      618.8        2.7       ?       ? 
1 1 1   19   11   30 o    962.5    3.6    0.0000   0.0000          ?        ?  9264.9492  68.9603          ?        ?      962.5        3.6       ?       ? 
1 1 1   19   11   31 o    595.0    2.9    0.0000   0.0000          ?        ?  3540.6025  34.4802          ?        ?      595.0        2.9       ?       ? 
1 1 1   19   11   32 o   1075.6    4.2    0.0000   0.0000          ?        ? 11571.2891  91.3086          ?        ?     1075.6        4.2       ?       ? 
1 1 1   19   11   33 o    209.7    4.3    0.0000   0.0000          ?        ?   439.9414  17.8786          ?        ?      209.7        4.3       ?       ? 
1 1 1   19   11   34 o    176.3    4.5    0.0000   0.0000          ?        ?   310.9600  15.9630          ?        ?      176.3        4.5       ?       ? 
1 1 1   19   11   35 o    752.0    3.2    0.0000   0.0000          ?        ?  5655.3862  48.5276          ?        ?      752.0        3.2       ?       ? 
1 1 1   19   11   36 o    556.4    2.9    0.0000   0.0000          ?        ?  3095.5527  31.9261          ?        ?      556.4        2.9       ?       ? 
1 1 1   19   11   37 f    431.2    2.8    0.0000   0.0000          ?        ?  1859.3750  24.2638          ?        ?      431.2        2.8       ?       ? 
1 1 1   19   11   38 o    659.1    3.0    0.0000   0.0000          ?        ?  4345.1396  39.5883          ?        ?      659.1        3.0       ?       ? 
1 1 1   19   11   39 o    326.0    3.1    0.0000   0.0000          ?        ?  1063.1385  20.4327          ?        ?      326.0        3.1       ?       ? 
1 1 1   19   11   40 o    566.8    2.8    0.0000   0.0000          ?        ?  3213.0410  31.2876          ?        ?      566.8        2.8       ?       ? 
1 1 1   19   11   41 o    546.2    2.8    0.0000   0.0000          ?        ?  2983.1731  30.6490          ?        ?      546.2        2.8       ?       ? 
1 1 1   19   11   42 o    440.4    2.8    0.0000   0.0000          ?        ?  1939.8286  24.2638          ?        ?      440.4        2.8       ?       ? 
1 1 1   19   11   43 o    324.1    3.2    0.0000   0.0000          ?        ?  1050.3680  20.4327          ?        ?      324.1        3.2       ?       ? 
1 1 1   19   11   44 o    190.2    4.7    0.0000   0.0000          ?        ?   362.0418  17.8786          ?        ?      190.2        4.7       ?       ? 
1 1 1   19   11   45 o    139.0    6.4    0.0000   0.0000          ?        ?   193.4720  17.8786          ?        ?      139.0        6.4       ?       ? 
1 1 1   19   11   46 o    254.7    3.6    0.0000   0.0000          ?        ?   648.7380  18.5171          ?        ?      254.7        3.6       ?       ? 
1 1 1   19   11   47 o    548.6    2.8    0.0000   0.0000          ?        ?  3010.6294  30.6490          ?        ?      548.6        2.8       ?       ? 
1 1 1   19   11   48 o    297.4    3.3    0.0000   0.0000          ?        ?   884.9910  19.7942          ?        ?      297.4        3.3       ?       ? 
1 1 1   19   11   49 o    160.3    5.6    0.0000   0.0000          ?        ?   257.3242  17.8786          ?        ?      160.3        5.6       ?       ? 
1 1 1   19   11   50 o    130.5    6.6    0.0000   0.0000          ?        ?   170.4853  17.2401          ?        ?      130.5        6.6       ?       ? 
1 1 1   19   11   51 o    293.2    3.3    0.0000   0.0000          ?        ?   860.0886  19.1556          ?        ?      293.2        3.3       ?       ? 
1 1 1   19   11   52 o    245.8    3.9    0.0000   0.0000          ?        ?   604.6799  19.1556          ?        ?      245.8        3.9       ?       ? 
1 1 1   19   11   53 o    305.8    3.2    0.0000   0.0000          ?        ?   935.4342  19.7942          ?        ?      305.8        3.2       ?       ? 
1 1 1   19   11   54 o     39.7   15.5    0.0000   0.0000          ?        ?     9.5778  17.8786          ?        ?       39.7       15.5       ?       ? 
1 1 1   19   11   55 o    214.8    4.3    0.0000   0.0000          ?        ?   461.6512  18.5171          ?        ?      214.8        4.3       ?       ? 
1 1 1   19   11   56 o    465.6    2.7    0.0000   0.0000          ?        ?  2168.4194  25.5409          ?        ?      465.6        2.7       ?       ? 
1 1 1   19   11   57 o     20.6   10.3    0.0000   0.0000          ?        ?   -54.2743  18.5171          ?        ?       20.6       10.3       ?       ? 
1 1 1   19   11   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   11   59 o    264.2    3.7    0.0000   0.0000          ?        ?   698.5427  19.7942          ?        ?      264.2        3.7       ?       ? 
1 1 1   19   11   60 o    123.3    7.8    0.0000   0.0000          ?        ?   152.6067  19.1556          ?        ?      123.3        7.8       ?       ? 
1 1 1   19   11   61 o    246.4    4.0    0.0000   0.0000          ?        ?   607.8726  19.7942          ?        ?      246.4        4.0       ?       ? 
1 1 1   19   11   62 o    182.6    5.4    0.0000   0.0000          ?        ?   333.9468  19.7942          ?        ?      182.6        5.4       ?       ? 
1 1 1   19   11   63 o    192.9    5.3    0.0000   0.0000          ?        ?   372.8966  20.4327          ?        ?      192.9        5.3       ?       ? 
1 1 1   19   11   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   11   65 f    257.0    4.1    0.0000   0.0000          ?        ?   661.5084  21.0712          ?        ?      257.0        4.1       ?       ? 
1 1 1   19   11   66 o     35.6   15.3    0.0000   0.0000          ?        ?    -1.2770  19.7942          ?        ?       35.6       15.3       ?       ? 
1 1 1   19   11   67 o    256.4    4.2    0.0000   0.0000          ?        ?   658.3158  21.7097          ?        ?      256.4        4.2       ?       ? 
1 1 1   19   11   68 o     20.0   10.1    0.0000   0.0000          ?        ?   -72.1529  20.4327          ?        ?       20.0       10.1       ?       ? 
1 1 1   19   11   69 o    329.1    3.4    0.0000   0.0000          ?        ?  1084.2097  22.3483          ?        ?      329.1        3.4       ?       ? 
1 1 1   19   11   70 o     49.3   17.0    0.0000   0.0000          ?        ?    22.9868  20.4327          ?        ?       49.3       17.0       ?       ? 
1 1 1   19   11   71 f    242.2    4.5    0.0000   0.0000          ?        ?   588.0784  21.7097          ?        ?      242.2        4.5       ?       ? 
1 1 1   19   11   72 o     46.7   16.9    0.0000   0.0000          ?        ?    19.1556  20.4327          ?        ?       46.7       16.9       ?       ? 
1 1 1   19   11   73 o    160.5    6.6    0.0000   0.0000          ?        ?   259.2398  21.0712          ?        ?      160.5        6.6       ?       ? 
1 1 1   19   11   74 f     47.0   16.7    0.0000   0.0000          ?        ?    20.4327  19.7942          ?        ?       47.0       16.7       ?       ? 
1 1 1   19   11   75 o     48.6   17.2    0.0000   0.0000          ?        ?    22.3483  21.0712          ?        ?       48.6       17.2       ?       ? 
1 1 1   19   11   76 o     53.7   17.0    0.0000   0.0000          ?        ?    30.6490  20.4327          ?        ?       53.7       17.0       ?       ? 
1 1 1   19   12    0 o    849.4    5.2 7215.9326  88.7545  7215.9326  88.7545  7215.9326  88.7545      849.4      5.2      849.4        5.2     0.0     0.0 
1 1 1   19   12    1 o    719.1    3.2    0.0000   0.0000          ?        ?  5171.3867  46.6121          ?        ?      719.1        3.2       ?       ? 
1 1 1   19   12    2 o   1634.5    6.3    0.0000   0.0000          ?        ? 26718.9375 206.8810          ?        ?     1634.5        6.3       ?       ? 
1 1 1   19   12    3 o   1837.5    6.8    0.0000   0.0000          ?        ? 33768.8555 249.6619          ?        ?     1837.5        6.8       ?       ? 
1 1 1   19   12    4 o   1528.2    5.6    0.0000   0.0000          ?        ? 23357.1211 170.4853          ?        ?     1528.2        5.6       ?       ? 
1 1 1   19   12    5 o    828.8    3.1    0.0000   0.0000          ?        ?  6869.2158  51.0817          ?        ?      828.8        3.1       ?       ? 
1 1 1   19   12    6 o   1242.3    4.2    0.0000   0.0000          ?        ? 15433.7070 104.0790          ?        ?     1242.3        4.2       ?       ? 
1 1 1   19   12    7 o   2165.1    7.2    0.0000   0.0000          ?        ? 46883.4492 310.9600          ?        ?     2165.1        7.2       ?       ? 
1 1 1   19   12    8 o   1015.8    3.6    0.0000   0.0000          ?        ? 10319.7861  72.7915          ?        ?     1015.8        3.6       ?       ? 
1 1 1   19   12    9 o    904.6    3.3    0.0000   0.0000          ?        ?  8183.2930  59.3825          ?        ?      904.6        3.3       ?       ? 
1 1 1   19   12   10 o    916.7    3.3    0.0000   0.0000          ?        ?  8403.5830  60.0210          ?        ?      916.7        3.3       ?       ? 
1 1 1   19   12   11 o    585.2    2.3    0.0000   0.0000          ?        ?  3424.3914  27.4564          ?        ?      585.2        2.3       ?       ? 
1 1 1   19   12   12 o    760.8    3.0    0.0000   0.0000          ?        ?  5787.5601  45.3350          ?        ?      760.8        3.0       ?       ? 
1 1 1   19   12   13 o    326.0    2.3    0.0000   0.0000          ?        ?  1062.5000  14.6860          ?        ?      326.0        2.3       ?       ? 
1 1 1   19   12   14 o    883.8    3.3    0.0000   0.0000          ?        ?  7811.0352  58.7440          ?        ?      883.8        3.3       ?       ? 
1 1 1   19   12   15 o   1334.6    4.5    0.0000   0.0000          ?        ? 17812.1992 120.0421          ?        ?     1334.6        4.5       ?       ? 
1 1 1   19   12   16 o   1666.3    5.6    0.0000   0.0000          ?        ? 27766.7520 187.7254          ?        ?     1666.3        5.6       ?       ? 
1 1 1   19   12   17 o    970.6    3.6    0.0000   0.0000          ?        ?  9420.1104  69.5989          ?        ?      970.6        3.6       ?       ? 
1 1 1   19   12   18 o   2339.6    8.7    0.0000   0.0000          ?        ? 54750.6719 409.2924          ?        ?     2339.6        8.7       ?       ? 
1 1 1   19   12   19 o    470.5    3.0    0.0000   0.0000          ?        ?  2213.7546  28.0950          ?        ?      470.5        3.0       ?       ? 
1 1 1   19   12   20 o    907.7    3.6    0.0000   0.0000          ?        ?  8240.1221  65.1292          ?        ?      907.7        3.6       ?       ? 
1 1 1   19   12   21 o    768.9    3.0    0.0000   0.0000          ?        ?  5912.0718  45.9736          ?        ?      768.9        3.0       ?       ? 
1 1 1   19   12   22 f   1048.2    3.9    0.0000   0.0000          ?        ? 10988.3184  81.0922          ?        ?     1048.2        3.9       ?       ? 
1 1 1   19   12   23 o    369.1    2.4    0.0000   0.0000          ?        ?  1362.6051  17.8786          ?        ?      369.1        2.4       ?       ? 
1 1 1   19   12   24 o    719.6    2.9    0.0000   0.0000          ?        ?  5178.4102  41.5039          ?        ?      719.6        2.9       ?       ? 
1 1 1   19   12   25 o    287.6    2.7    0.0000   0.0000          ?        ?   826.8855  15.3245          ?        ?      287.6        2.7       ?       ? 
1 1 1   19   12   26 o    488.9    2.4    0.0000   0.0000          ?        ?  2389.9863  22.9868          ?        ?      488.9        2.4       ?       ? 
1 1 1   19   12   27 o    316.8    2.7    0.0000   0.0000          ?        ?  1003.7560  17.2401          ?        ?      316.8        2.7       ?       ? 
1 1 1   19   12   28 o    436.9    2.4    0.0000   0.0000          ?        ?  1909.1797  21.0712          ?        ?      436.9        2.4       ?       ? 
1 1 1   19   12   29 o    623.2    2.7    0.0000   0.0000          ?        ?  3883.4885  33.8416          ?        ?      623.2        2.7       ?       ? 
1 1 1   19   12   30 o    270.4    3.1    0.0000   0.0000          ?        ?   731.1072  16.6016          ?        ?      270.4        3.1       ?       ? 
1 1 1   19   12   31 o    311.0    2.9    0.0000   0.0000          ?        ?   967.3603  17.8786          ?        ?      311.0        2.9       ?       ? 
1 1 1   19   12   32 o    451.6    2.7    0.0000   0.0000          ?        ?  2039.4380  24.2638          ?        ?      451.6        2.7       ?       ? 
1 1 1   19   12   33 o    509.1    2.8    0.0000   0.0000          ?        ?  2591.7593  28.7335          ?        ?      509.1        2.8       ?       ? 
1 1 1   19   12   34 o    714.7    3.0    0.0000   0.0000          ?        ?  5108.8115  43.4195          ?        ?      714.7        3.0       ?       ? 
1 1 1   19   12   35 o    863.6    3.5    0.0000   0.0000          ?        ?  7458.5708  61.2981          ?        ?      863.6        3.5       ?       ? 
1 1 1   19   12   36 o     95.2    9.1    0.0000   0.0000          ?        ?    90.6701  17.2401          ?        ?       95.2        9.1       ?       ? 
1 1 1   19   12   37 o    581.6    2.8    0.0000   0.0000          ?        ?  3382.8875  32.5646          ?        ?      581.6        2.8       ?       ? 
1 1 1   19   12   38 o    506.3    2.8    0.0000   0.0000          ?        ?  2563.6643  28.0950          ?        ?      506.3        2.8       ?       ? 
1 1 1   19   12   39 o    279.0    3.3    0.0000   0.0000          ?        ?   778.3578  18.5171          ?        ?      279.0        3.3       ?       ? 
1 1 1   19   12   40 o    404.1    2.7    0.0000   0.0000          ?        ?  1633.3384  21.7097          ?        ?      404.1        2.7       ?       ? 
1 1 1   19   12   41 o     17.2    8.7    0.0000   0.0000          ?        ?   -56.1899  15.3245          ?        ?       17.2        8.7       ?       ? 
1 1 1   19   12   42 f     42.2   15.8    0.0000   0.0000          ?        ?    13.4090  17.8786          ?        ?       42.2       15.8       ?       ? 
1 1 1   19   12   43 o    526.4    2.9    0.0000   0.0000          ?        ?  2771.1838  30.0105          ?        ?      526.4        2.9       ?       ? 
1 1 1   19   12   44 o    419.0    2.5    0.0000   0.0000          ?        ?  1755.9344  21.0712          ?        ?      419.0        2.5       ?       ? 
1 1 1   19   12   45 o    438.7    2.5    0.0000   0.0000          ?        ?  1925.1427  22.3483          ?        ?      438.7        2.5       ?       ? 
1 1 1   19   12   46 o    222.4    4.0    0.0000   0.0000          ?        ?   494.8542  17.8786          ?        ?      222.4        4.0       ?       ? 
1 1 1   19   12   47 o    472.2    2.8    0.0000   0.0000          ?        ?  2230.3560  26.8179          ?        ?      472.2        2.8       ?       ? 
1 1 1   19   12   48 o    520.6    2.7    0.0000   0.0000          ?        ?  2711.1628  28.0950          ?        ?      520.6        2.7       ?       ? 
1 1 1   19   12   49 f    379.8    2.9    0.0000   0.0000          ?        ?  1443.0588  21.7097          ?        ?      379.8        2.9       ?       ? 
1 1 1   19   12   50 o    170.2    5.1    0.0000   0.0000          ?        ?   289.8888  17.2401          ?        ?      170.2        5.1       ?       ? 
1 1 1   19   12   51 o    142.2    6.1    0.0000   0.0000          ?        ?   202.4114  17.2401          ?        ?      142.2        6.1       ?       ? 
1 1 1   19   12   52 o    305.0    3.4    0.0000   0.0000          ?        ?   930.3260  20.4327          ?        ?      305.0        3.4       ?       ? 
1 1 1   19   12   53 o    298.3    3.2    0.0000   0.0000          ?        ?   890.0991  19.1556          ?        ?      298.3        3.2       ?       ? 
1 1 1   19   12   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   12   55 o    614.2    2.8    0.0000   0.0000          ?        ?  3773.6628  33.8416          ?        ?      614.2        2.8       ?       ? 
1 1 1   19   12   56 o    455.3    2.7    0.0000   0.0000          ?        ?  2073.9182  24.2638          ?        ?      455.3        2.7       ?       ? 
1 1 1   19   12   57 o    202.7    4.7    0.0000   0.0000          ?        ?   411.2079  19.1556          ?        ?      202.7        4.7       ?       ? 
1 1 1   19   12   58 o     21.9   10.8    0.0000   0.0000          ?        ?   -42.1424  17.8786          ?        ?       21.9       10.8       ?       ? 
1 1 1   19   12   59 o    352.1    3.1    0.0000   0.0000          ?        ?  1240.6476  21.7097          ?        ?      352.1        3.1       ?       ? 
1 1 1   19   12   60 o    236.0    4.2    0.0000   0.0000          ?        ?   557.4294  19.7942          ?        ?      236.0        4.2       ?       ? 
1 1 1   19   12   61 o     35.1   15.1    0.0000   0.0000          ?        ?    -1.2770  19.1556          ?        ?       35.1       15.1       ?       ? 
1 1 1   19   12   62 o    321.8    3.3    0.0000   0.0000          ?        ?  1036.3207  21.0712          ?        ?      321.8        3.3       ?       ? 
1 1 1   19   12   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   12   64 o    380.8    3.1    0.0000   0.0000          ?        ?  1451.3596  23.6253          ?        ?      380.8        3.1       ?       ? 
1 1 1   19   12   65 o    121.4    8.4    0.0000   0.0000          ?        ?   148.1370  20.4327          ?        ?      121.4        8.4       ?       ? 
1 1 1   19   12   66 o    225.5    4.7    0.0000   0.0000          ?        ?   509.5403  21.0712          ?        ?      225.5        4.7       ?       ? 
1 1 1   19   12   67 o     98.7   10.7    0.0000   0.0000          ?        ?    98.3323  21.0712          ?        ?       98.7       10.7       ?       ? 
1 1 1   19   12   68 o     32.2   14.5    0.0000   0.0000          ?        ?    -9.5778  19.7942          ?        ?       32.2       14.5       ?       ? 
1 1 1   19   12   69 f    124.6    8.2    0.0000   0.0000          ?        ?   156.4378  20.4327          ?        ?      124.6        8.2       ?       ? 
1 1 1   19   12   70 o     30.5   14.1    0.0000   0.0000          ?        ?   -16.6016  20.4327          ?        ?       30.5       14.1       ?       ? 
1 1 1   19   12   71 o     67.8   15.4    0.0000   0.0000          ?        ?    49.1662  20.4327          ?        ?       67.8       15.4       ?       ? 
1 1 1   19   12   72 o     74.6   15.1    0.0000   0.0000          ?        ?    59.3825  21.7097          ?        ?       74.6       15.1       ?       ? 
1 1 1   19   12   73 o     40.2   16.1    0.0000   0.0000          ?        ?     8.9393  19.7942          ?        ?       40.2       16.1       ?       ? 
1 1 1   19   12   74 o     67.8   15.8    0.0000   0.0000          ?        ?    49.8047  21.0712          ?        ?       67.8       15.8       ?       ? 
1 1 1   19   12   75 o     30.6   14.1    0.0000   0.0000          ?        ?   -13.4090  19.7942          ?        ?       30.6       14.1       ?       ? 
1 1 1   19   13    0 o    282.3    3.2  797.5135  17.8786   797.5135  17.8786   797.5135  17.8786      282.3      3.2      282.3        3.2     0.0     0.0 
1 1 1   19   13    1 o   1783.3    6.5    0.0000   0.0000          ?        ? 31807.3164 230.5063          ?        ?     1783.3        6.5       ?       ? 
1 1 1   19   13    2 o   1944.3    7.4    0.0000   0.0000          ?        ? 37807.5039 286.0577          ?        ?     1944.3        7.4       ?       ? 
1 1 1   19   13    3 o    418.3    2.5    0.0000   0.0000          ?        ?  1749.5493  21.0712          ?        ?      418.3        2.5       ?       ? 
1 1 1   19   13    4 o   3026.2   11.9    0.0000   0.0000          ?        ? 91620.1875 718.9753          ?        ?     3026.2       11.9       ?       ? 
1 1 1   19   13    5 o   1750.5    6.0    0.0000   0.0000          ?        ? 30645.8457 210.7121          ?        ?     1750.5        6.0       ?       ? 
1 1 1   19   13    6 o   1304.8    4.4    0.0000   0.0000          ?        ? 17026.8184 114.9339          ?        ?     1304.8        4.4       ?       ? 
1 1 1   19   13    7 o   1436.2    5.0    0.0000   0.0000          ?        ? 20629.3574 144.3059          ?        ?     1436.2        5.0       ?       ? 
1 1 1   19   13    8 o   1371.3    4.7    0.0000   0.0000          ?        ? 18806.3770 129.6199          ?        ?     1371.3        4.7       ?       ? 
1 1 1   19   13    9 f   1595.3    5.3    0.0000   0.0000          ?        ? 25450.8320 168.5697          ?        ?     1595.3        5.3       ?       ? 
1 1 1   19   13   10 o    835.2    3.2    0.0000   0.0000          ?        ?  6975.8486  54.2743          ?        ?      835.2        3.2       ?       ? 
1 1 1   19   13   11 o    383.8    2.3    0.0000   0.0000          ?        ?  1473.0693  17.8786          ?        ?      383.8        2.3       ?       ? 
1 1 1   19   13   12 o    822.6    3.2    0.0000   0.0000          ?        ?  6767.6909  52.3588          ?        ?      822.6        3.2       ?       ? 
1 1 1   19   13   13 o    677.8    2.7    0.0000   0.0000          ?        ?  4594.8013  36.3957          ?        ?      677.8        2.7       ?       ? 
1 1 1   19   13   14 o    573.7    2.4    0.0000   0.0000          ?        ?  3290.9407  28.0950          ?        ?      573.7        2.4       ?       ? 
1 1 1   19   13   15 o   1142.2    3.9    0.0000   0.0000          ?        ? 13047.5508  90.0316          ?        ?     1142.2        3.9       ?       ? 
1 1 1   19   13   16 o   1004.6    3.8    0.0000   0.0000          ?        ? 10091.8340  75.3456          ?        ?     1004.6        3.8       ?       ? 
1 1 1   19   13   17 o    684.1    2.8    0.0000   0.0000          ?        ?  4679.7251  38.9498          ?        ?      684.1        2.8       ?       ? 
1 1 1   19   13   18 o    896.7    3.5    0.0000   0.0000          ?        ?  8041.5415  63.2136          ?        ?      896.7        3.5       ?       ? 
1 1 1   19   13   19 o   1409.3    4.9    0.0000   0.0000          ?        ? 19861.8535 137.2822          ?        ?     1409.3        4.9       ?       ? 
1 1 1   19   13   20 o   1322.7    4.6    0.0000   0.0000          ?        ? 17495.4922 121.3191          ?        ?     1322.7        4.6       ?       ? 
1 1 1   19   13   21 o   1345.1    4.6    0.0000   0.0000          ?        ? 18093.7871 123.8732          ?        ?     1345.1        4.6       ?       ? 
1 1 1   19   13   22 o   1296.9    4.5    0.0000   0.0000          ?        ? 16819.9355 116.8494          ?        ?     1296.9        4.5       ?       ? 
1 1 1   19   13   23 o    759.9    2.9    0.0000   0.0000          ?        ?  5775.4282  44.0580          ?        ?      759.9        2.9       ?       ? 
1 1 1   19   13   24 o    782.9    3.2    0.0000   0.0000          ?        ?  6129.8076  49.8047          ?        ?      782.9        3.2       ?       ? 
1 1 1   19   13   25 o    469.8    2.4    0.0000   0.0000          ?        ?  2206.7307  22.3483          ?        ?      469.8        2.4       ?       ? 
1 1 1   19   13   26 o   1225.5    4.3    0.0000   0.0000          ?        ? 15020.5820 104.7175          ?        ?     1225.5        4.3       ?       ? 
1 1 1   19   13   27 o   1345.9    4.6    0.0000   0.0000          ?        ? 18115.4980 124.5117          ?        ?     1345.9        4.6       ?       ? 
1 1 1   19   13   28 o    639.5    2.7    0.0000   0.0000          ?        ?  4089.7310  35.1187          ?        ?      639.5        2.7       ?       ? 
1 1 1   19   13   29 o    368.9    2.9    0.0000   0.0000          ?        ?  1360.6896  21.7097          ?        ?      368.9        2.9       ?       ? 
1 1 1   19   13   30 o    962.8    3.7    0.0000   0.0000          ?        ?  9271.3340  71.5144          ?        ?      962.8        3.7       ?       ? 
1 1 1   19   13   31 o    254.2    3.4    0.0000   0.0000          ?        ?   646.1838  17.2401          ?        ?      254.2        3.4       ?       ? 
1 1 1   19   13   32 o    354.6    2.7    0.0000   0.0000          ?        ?  1257.2490  19.1556          ?        ?      354.6        2.7       ?       ? 
1 1 1   19   13   33 o    266.5    3.5    0.0000   0.0000          ?        ?   710.0360  18.5171          ?        ?      266.5        3.5       ?       ? 
1 1 1   19   13   34 f    695.2    3.1    0.0000   0.0000          ?        ?  4832.9702  43.4195          ?        ?      695.2        3.1       ?       ? 
1 1 1   19   13   35 o    655.1    2.8    0.0000   0.0000          ?        ?  4292.1426  36.3957          ?        ?      655.1        2.8       ?       ? 
1 1 1   19   13   36 o    495.9    2.9    0.0000   0.0000          ?        ?  2458.9468  28.7335          ?        ?      495.9        2.9       ?       ? 
1 1 1   19   13   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   13   38 o    756.4    3.2    0.0000   0.0000          ?        ?  5722.4307  47.8891          ?        ?      756.4        3.2       ?       ? 
1 1 1   19   13   39 o     70.1   11.4    0.0000   0.0000          ?        ?    49.1662  15.9630          ?        ?       70.1       11.4       ?       ? 
1 1 1   19   13   40 o    738.0    2.9    0.0000   0.0000          ?        ?  5447.2280  43.4195          ?        ?      738.0        2.9       ?       ? 
1 1 1   19   13   41 o    173.8    4.6    0.0000   0.0000          ?        ?   302.0207  15.9630          ?        ?      173.8        4.6       ?       ? 
1 1 1   19   13   42 o    248.6    3.5    0.0000   0.0000          ?        ?   618.0889  17.2401          ?        ?      248.6        3.5       ?       ? 
1 1 1   19   13   43 o    331.8    3.0    0.0000   0.0000          ?        ?  1100.8113  19.7942          ?        ?      331.8        3.0       ?       ? 
1 1 1   19   13   44 o    474.1    2.8    0.0000   0.0000          ?        ?  2248.2346  26.8179          ?        ?      474.1        2.8       ?       ? 
1 1 1   19   13   45 o    803.0    3.1    0.0000   0.0000          ?        ?  6449.7070  49.8047          ?        ?      803.0        3.1       ?       ? 
1 1 1   19   13   46 o    659.5    2.7    0.0000   0.0000          ?        ?  4349.6094  35.7572          ?        ?      659.5        2.7       ?       ? 
1 1 1   19   13   47 o    321.4    3.0    0.0000   0.0000          ?        ?  1033.1281  19.1556          ?        ?      321.4        3.0       ?       ? 
1 1 1   19   13   48 o    434.3    2.9    0.0000   0.0000          ?        ?  1886.8314  24.9023          ?        ?      434.3        2.9       ?       ? 
1 1 1   19   13   49 o    248.3    3.7    0.0000   0.0000          ?        ?   616.8119  18.5171          ?        ?      248.3        3.7       ?       ? 
1 1 1   19   13   50 o    486.8    2.6    0.0000   0.0000          ?        ?  2370.1924  25.5409          ?        ?      486.8        2.6       ?       ? 
1 1 1   19   13   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   13   52 o    123.4    7.0    0.0000   0.0000          ?        ?   152.6067  17.2401          ?        ?      123.4        7.0       ?       ? 
1 1 1   19   13   53 o    343.9    3.0    0.0000   0.0000          ?        ?  1183.1805  20.4327          ?        ?      343.9        3.0       ?       ? 
1 1 1   19   13   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   13   55 o    559.2    2.7    0.0000   0.0000          ?        ?  3127.4788  30.0105          ?        ?      559.2        2.7       ?       ? 
1 1 1   19   13   56 o    271.6    3.5    0.0000   0.0000          ?        ?   738.1310  19.1556          ?        ?      271.6        3.5       ?       ? 
1 1 1   19   13   57 o    290.0    3.4    0.0000   0.0000          ?        ?   841.5715  19.7942          ?        ?      290.0        3.4       ?       ? 
1 1 1   19   13   58 o    362.0    3.0    0.0000   0.0000          ?        ?  1310.8849  21.7097          ?        ?      362.0        3.0       ?       ? 
1 1 1   19   13   59 o    134.2    6.9    0.0000   0.0000          ?        ?   180.7016  18.5171          ?        ?      134.2        6.9       ?       ? 
1 1 1   19   13   60 o    202.7    4.6    0.0000   0.0000          ?        ?   411.2079  18.5171          ?        ?      202.7        4.6       ?       ? 
1 1 1   19   13   61 f    313.9    3.4    0.0000   0.0000          ?        ?   985.8774  21.0712          ?        ?      313.9        3.4       ?       ? 
1 1 1   19   13   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   13   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   13   64 o    141.6    6.8    0.0000   0.0000          ?        ?   201.1343  19.1556          ?        ?      141.6        6.8       ?       ? 
1 1 1   19   13   65 f    130.3    7.8    0.0000   0.0000          ?        ?   170.4853  20.4327          ?        ?      130.3        7.8       ?       ? 
1 1 1   19   13   66 o     90.3   11.3    0.0000   0.0000          ?        ?    82.3693  20.4327          ?        ?       90.3       11.3       ?       ? 
1 1 1   19   13   67 o    122.1    8.6    0.0000   0.0000          ?        ?   150.0526  21.0712          ?        ?      122.1        8.6       ?       ? 
1 1 1   19   13   68 f    160.3    6.6    0.0000   0.0000          ?        ?   257.9627  21.0712          ?        ?      160.3        6.6       ?       ? 
1 1 1   19   13   69 o     86.8   12.1    0.0000   0.0000          ?        ?    76.6226  21.0712          ?        ?       86.8       12.1       ?       ? 
1 1 1   19   13   70 o    226.3    4.7    0.0000   0.0000          ?        ?   513.3714  21.0712          ?        ?      226.3        4.7       ?       ? 
1 1 1   19   13   71 o    140.4    7.3    0.0000   0.0000          ?        ?   198.5802  20.4327          ?        ?      140.4        7.3       ?       ? 
1 1 1   19   13   72 f     81.3   13.0    0.0000   0.0000          ?        ?    67.6833  21.0712          ?        ?       81.3       13.0       ?       ? 
1 1 1   19   13   73 o     90.1   11.7    0.0000   0.0000          ?        ?    83.0078  21.0712          ?        ?       90.1       11.7       ?       ? 
1 1 1   19   13   74 o     50.7   17.8    0.0000   0.0000          ?        ?    24.9023  22.3483          ?        ?       50.7       17.8       ?       ? 
1 1 1   19   13   75 o    146.2    7.0    0.0000   0.0000          ?        ?   215.8203  20.4327          ?        ?      146.2        7.0       ?       ? 
1 1 1   19   14    0 o   1055.0    6.7 11131.9863 140.4748 11131.9863 140.4748 11131.9863 140.4748     1055.0      6.7     1055.0        6.7     0.0     0.0 
1 1 1   19   14    1 o   1215.6    4.9    0.0000   0.0000          ?        ? 14777.3066 119.4035          ?        ?     1215.6        4.9       ?       ? 
1 1 1   19   14    2 o    586.2    2.9    0.0000   0.0000          ?        ?  3435.8848  34.4802          ?        ?      586.2        2.9       ?       ? 
1 1 1   19   14    3 f    329.9    2.4    0.0000   0.0000          ?        ?  1088.0408  15.9630          ?        ?      329.9        2.4       ?       ? 
1 1 1   19   14    4 o    814.0    3.3    0.0000   0.0000          ?        ?  6625.9385  54.2743          ?        ?      814.0        3.3       ?       ? 
1 1 1   19   14    5 o    748.9    3.0    0.0000   0.0000          ?        ?  5608.7739  44.6965          ?        ?      748.9        3.0       ?       ? 
1 1 1   19   14    6 o   1888.6    6.6    0.0000   0.0000          ?        ? 35671.6484 250.3005          ?        ?     1888.6        6.6       ?       ? 
1 1 1   19   14    7 o    880.3    3.4    0.0000   0.0000          ?        ?  7749.0981  59.3825          ?        ?      880.3        3.4       ?       ? 
1 1 1   19   14    8 o    532.6    3.1    0.0000   0.0000          ?        ?  2836.3132  32.5646          ?        ?      532.6        3.1       ?       ? 
1 1 1   19   14    9 o    835.2    3.4    0.0000   0.0000          ?        ?  6976.4873  57.4669          ?        ?      835.2        3.4       ?       ? 
1 1 1   19   14   10 o   1852.7    7.2    0.0000   0.0000          ?        ? 34331.3945 267.5406          ?        ?     1852.7        7.2       ?       ? 
1 1 1   19   14   11 o   1020.8    3.8    0.0000   0.0000          ?        ? 10420.6729  78.5382          ?        ?     1020.8        3.8       ?       ? 
1 1 1   19   14   12 o   1171.3    4.5    0.0000   0.0000          ?        ? 13719.9141 105.3561          ?        ?     1171.3        4.5       ?       ? 
1 1 1   19   14   13 o   1039.8    3.8    0.0000   0.0000          ?        ? 10812.0869  79.1767          ?        ?     1039.8        3.8       ?       ? 
1 1 1   19   14   14 o    620.6    2.7    0.0000   0.0000          ?        ?  3850.9238  33.2031          ?        ?      620.6        2.7       ?       ? 
1 1 1   19   14   15 o     69.2    8.3    0.0000   0.0000          ?        ?    47.8891  11.4934          ?        ?       69.2        8.3       ?       ? 
1 1 1   19   14   16 o    289.5    2.2    0.0000   0.0000          ?        ?   838.3789  12.7704          ?        ?      289.5        2.2       ?       ? 
1 1 1   19   14   17 f    652.5    2.8    0.0000   0.0000          ?        ?  4258.3008  36.3957          ?        ?      652.5        2.8       ?       ? 
1 1 1   19   14   18 o    373.6    2.6    0.0000   0.0000          ?        ?  1395.8083  19.1556          ?        ?      373.6        2.6       ?       ? 
1 1 1   19   14   19 f    606.1    3.1    0.0000   0.0000          ?        ?  3674.0537  37.0343          ?        ?      606.1        3.1       ?       ? 
1 1 1   19   14   20 o   1535.9    5.5    0.0000   0.0000          ?        ? 23594.0137 169.2082          ?        ?     1535.9        5.5       ?       ? 
1 1 1   19   14   21 f    839.3    3.2    0.0000   0.0000          ?        ?  7044.1704  54.2743          ?        ?      839.3        3.2       ?       ? 
1 1 1   19   14   22 o    562.4    2.7    0.0000   0.0000          ?        ?  3162.5977  30.6490          ?        ?      562.4        2.7       ?       ? 
1 1 1   19   14   23 o    920.1    3.6    0.0000   0.0000          ?        ?  8465.5205  66.4062          ?        ?      920.1        3.6       ?       ? 
1 1 1   19   14   24 o    931.0    3.5    0.0000   0.0000          ?        ?  8668.5693  64.4907          ?        ?      931.0        3.5       ?       ? 
1 1 1   19   14   25 o   1034.1    3.7    0.0000   0.0000          ?        ? 10693.3213  77.2611          ?        ?     1034.1        3.7       ?       ? 
1 1 1   19   14   26 o    789.2    3.1    0.0000   0.0000          ?        ?  6229.4170  49.1662          ?        ?      789.2        3.1       ?       ? 
1 1 1   19   14   27 o    528.0    2.8    0.0000   0.0000          ?        ?  2788.4241  30.0105          ?        ?      528.0        2.8       ?       ? 
1 1 1   19   14   28 o    816.8    3.2    0.0000   0.0000          ?        ?  6672.5508  51.7203          ?        ?      816.8        3.2       ?       ? 
1 1 1   19   14   29 o    376.7    2.5    0.0000   0.0000          ?        ?  1419.4336  18.5171          ?        ?      376.7        2.5       ?       ? 
1 1 1   19   14   30 o    548.4    2.9    0.0000   0.0000          ?        ?  3008.0754  31.2876          ?        ?      548.4        2.9       ?       ? 
1 1 1   19   14   31 o    736.6    3.2    0.0000   0.0000          ?        ?  5425.5186  46.6121          ?        ?      736.6        3.2       ?       ? 
1 1 1   19   14   32 o    845.2    3.7    0.0000   0.0000          ?        ?  7144.4185  61.9366          ?        ?      845.2        3.7       ?       ? 
1 1 1   19   14   33 o    995.3    3.8    0.0000   0.0000          ?        ?  9907.9395  76.6226          ?        ?      995.3        3.8       ?       ? 
1 1 1   19   14   34 o   1049.5    4.0    0.0000   0.0000          ?        ? 11015.1367  84.2849          ?        ?     1049.5        4.0       ?       ? 
1 1 1   19   14   35 o     89.3   11.1    0.0000   0.0000          ?        ?    79.8152  19.7942          ?        ?       89.3       11.1       ?       ? 
1 1 1   19   14   36 o    898.2    3.8    0.0000   0.0000          ?        ?  8068.3589  67.6833          ?        ?      898.2        3.8       ?       ? 
1 1 1   19   14   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   14   38 o    393.9    2.5    0.0000   0.0000          ?        ?  1551.6075  19.7942          ?        ?      393.9        2.5       ?       ? 
1 1 1   19   14   39 o     19.3    9.7    0.0000   0.0000          ?        ?   -54.9129  17.2401          ?        ?       19.3        9.7       ?       ? 
1 1 1   19   14   40 o    885.4    3.6    0.0000   0.0000          ?        ?  7840.4072  63.8522          ?        ?      885.4        3.6       ?       ? 
1 1 1   19   14   41 o    409.3    2.9    0.0000   0.0000          ?        ?  1675.4807  23.6253          ?        ?      409.3        2.9       ?       ? 
1 1 1   19   14   42 o    381.3    2.9    0.0000   0.0000          ?        ?  1453.9137  22.3483          ?        ?      381.3        2.9       ?       ? 
1 1 1   19   14   43 o    864.0    3.4    0.0000   0.0000          ?        ?  7466.2339  58.7440          ?        ?      864.0        3.4       ?       ? 
1 1 1   19   14   44 o     34.4   14.5    0.0000   0.0000          ?        ?     0.6385  17.2401          ?        ?       34.4       14.5       ?       ? 
1 1 1   19   14   45 o     18.5    9.4    0.0000   0.0000          ?        ?   -60.6596  17.2401          ?        ?       18.5        9.4       ?       ? 
1 1 1   19   14   46 o    485.2    2.6    0.0000   0.0000          ?        ?  2354.8677  25.5409          ?        ?      485.2        2.6       ?       ? 
1 1 1   19   14   47 o    443.1    2.7    0.0000   0.0000          ?        ?  1963.4540  24.2638          ?        ?      443.1        2.7       ?       ? 
1 1 1   19   14   48 o    674.4    3.2    0.0000   0.0000          ?        ?  4550.1050  42.7809          ?        ?      674.4        3.2       ?       ? 
1 1 1   19   14   49 o    139.7    6.2    0.0000   0.0000          ?        ?   195.3876  17.2401          ?        ?      139.7        6.2       ?       ? 
1 1 1   19   14   50 o    547.4    2.8    0.0000   0.0000          ?        ?  2997.2205  30.6490          ?        ?      547.4        2.8       ?       ? 
1 1 1   19   14   51 o    394.0    2.8    0.0000   0.0000          ?        ?  1552.8845  22.3483          ?        ?      394.0        2.8       ?       ? 
1 1 1   19   14   52 o    408.3    2.7    0.0000   0.0000          ?        ?  1667.8186  22.3483          ?        ?      408.3        2.7       ?       ? 
1 1 1   19   14   53 o    155.5    6.0    0.0000   0.0000          ?        ?   241.9997  18.5171          ?        ?      155.5        6.0       ?       ? 
1 1 1   19   14   54 o     25.8   12.3    0.0000   0.0000          ?        ?   -24.2638  17.8786          ?        ?       25.8       12.3       ?       ? 
1 1 1   19   14   55 o    317.3    3.2    0.0000   0.0000          ?        ?  1006.9486  20.4327          ?        ?      317.3        3.2       ?       ? 
1 1 1   19   14   56 o     88.0   10.9    0.0000   0.0000          ?        ?    77.8996  19.1556          ?        ?       88.0       10.9       ?       ? 
1 1 1   19   14   57 o    388.2    3.1    0.0000   0.0000          ?        ?  1507.5496  24.2638          ?        ?      388.2        3.1       ?       ? 
1 1 1   19   14   58 o    281.1    3.6    0.0000   0.0000          ?        ?   790.4898  20.4327          ?        ?      281.1        3.6       ?       ? 
1 1 1   19   14   59 f    297.4    3.4    0.0000   0.0000          ?        ?   884.9910  20.4327          ?        ?      297.4        3.4       ?       ? 
1 1 1   19   14   60 o    239.6    4.4    0.0000   0.0000          ?        ?   574.6694  21.0712          ?        ?      239.6        4.4       ?       ? 
1 1 1   19   14   61 o    268.8    3.8    0.0000   0.0000          ?        ?   723.4450  20.4327          ?        ?      268.8        3.8       ?       ? 
1 1 1   19   14   62 o    366.2    3.1    0.0000   0.0000          ?        ?  1342.1725  22.9868          ?        ?      366.2        3.1       ?       ? 
1 1 1   19   14   63 o     27.7   13.2    0.0000   0.0000          ?        ?   -24.2638  19.7942          ?        ?       27.7       13.2       ?       ? 
1 1 1   19   14   64 o    117.3    9.0    0.0000   0.0000          ?        ?   138.5592  21.0712          ?        ?      117.3        9.0       ?       ? 
1 1 1   19   14   65 o    186.8    5.8    0.0000   0.0000          ?        ?   349.9099  21.7097          ?        ?      186.8        5.8       ?       ? 
1 1 1   19   14   66 o     57.4   16.8    0.0000   0.0000          ?        ?    34.4802  20.4327          ?        ?       57.4       16.8       ?       ? 
1 1 1   19   14   67 o    207.8    5.2    0.0000   0.0000          ?        ?   432.9177  21.7097          ?        ?      207.8        5.2       ?       ? 
1 1 1   19   14   68 o     21.6   10.9    0.0000   0.0000          ?        ?   -63.8522  21.0712          ?        ?       21.6       10.9       ?       ? 
1 1 1   19   14   69 o    139.3    7.8    0.0000   0.0000          ?        ?   195.3876  21.7097          ?        ?      139.3        7.8       ?       ? 
1 1 1   19   14   70 o    123.4    8.8    0.0000   0.0000          ?        ?   153.8837  21.7097          ?        ?      123.4        8.8       ?       ? 
1 1 1   19   14   71 o     87.7   12.0    0.0000   0.0000          ?        ?    78.5382  21.0712          ?        ?       87.7       12.0       ?       ? 
1 1 1   19   14   72 o     83.9   12.6    0.0000   0.0000          ?        ?    72.1529  21.0712          ?        ?       83.9       12.6       ?       ? 
1 1 1   19   14   73 o     97.1   11.2    0.0000   0.0000          ?        ?    96.4168  21.7097          ?        ?       97.1       11.2       ?       ? 
1 1 1   19   14   74 o     31.3   14.2    0.0000   0.0000          ?        ?    -9.5778  19.1556          ?        ?       31.3       14.2       ?       ? 
1 1 1   19   15    0 o    270.5    6.3  733.0228  33.8416   733.0228  33.8416   733.0228  33.8416      270.5      6.3      270.5        6.3     0.0     0.0 
1 1 1   19   15    1 o    890.9    4.1    0.0000   0.0000          ?        ?  7936.8237  73.4300          ?        ?      890.9        4.1       ?       ? 
1 1 1   19   15    2 o   1621.1    6.8    0.0000   0.0000          ?        ? 26282.1895 220.2900          ?        ?     1621.1        6.8       ?       ? 
1 1 1   19   15    3 o    402.5    2.6    0.0000   0.0000          ?        ?  1619.9293  21.0712          ?        ?      402.5        2.6       ?       ? 
1 1 1   19   15    4 o   2089.1    8.1    0.0000   0.0000          ?        ? 43652.5312 336.5009          ?        ?     2089.1        8.1       ?       ? 
1 1 1   19   15    5 o    564.1    2.7    0.0000   0.0000          ?        ?  3182.3918  30.0105          ?        ?      564.1        2.7       ?       ? 
1 1 1   19   15    6 f    692.6    2.8    0.0000   0.0000          ?        ?  4797.2129  38.3113          ?        ?      692.6        2.8       ?       ? 
1 1 1   19   15    7 o   1350.1    5.1    0.0000   0.0000          ?        ? 18228.5156 136.6436          ?        ?     1350.1        5.1       ?       ? 
1 1 1   19   15    8 o    845.5    3.2    0.0000   0.0000          ?        ?  7148.2495  54.2743          ?        ?      845.5        3.2       ?       ? 
1 1 1   19   15    9 o    556.5    2.4    0.0000   0.0000          ?        ?  3096.8298  26.8179          ?        ?      556.5        2.4       ?       ? 
1 1 1   19   15   10 o    744.3    2.9    0.0000   0.0000          ?        ?  5539.8135  43.4195          ?        ?      744.3        2.9       ?       ? 
1 1 1   19   15   11 o    290.3    2.0    0.0000   0.0000          ?        ?   842.8486  11.4934          ?        ?      290.3        2.0       ?       ? 
1 1 1   19   15   12 o    768.3    2.9    0.0000   0.0000          ?        ?  5903.1323  44.6965          ?        ?      768.3        2.9       ?       ? 
1 1 1   19   15   13 o    635.6    2.7    0.0000   0.0000          ?        ?  4040.5647  33.8416          ?        ?      635.6        2.7       ?       ? 
1 1 1   19   15   14 o    819.6    3.2    0.0000   0.0000          ?        ?  6717.8857  52.9973          ?        ?      819.6        3.2       ?       ? 
1 1 1   19   15   15 o    468.5    2.4    0.0000   0.0000          ?        ?  2195.2373  22.3483          ?        ?      468.5        2.4       ?       ? 
1 1 1   19   15   16 o     65.4    8.8    0.0000   0.0000          ?        ?    42.7809  11.4934          ?        ?       65.4        8.8       ?       ? 
1 1 1   19   15   17 o   1534.6    5.3    0.0000   0.0000          ?        ? 23553.1465 163.4615          ?        ?     1534.6        5.3       ?       ? 
1 1 1   19   15   18 o    797.8    3.1    0.0000   0.0000          ?        ?  6365.4224  49.8047          ?        ?      797.8        3.1       ?       ? 
1 1 1   19   15   19 o    742.8    2.9    0.0000   0.0000          ?        ?  5517.4653  43.4195          ?        ?      742.8        2.9       ?       ? 
1 1 1   19   15   20 o    726.1    3.0    0.0000   0.0000          ?        ?  5272.2729  44.0580          ?        ?      726.1        3.0       ?       ? 
1 1 1   19   15   21 o   1318.8    4.6    0.0000   0.0000          ?        ? 17395.2441 122.5962          ?        ?     1318.8        4.6       ?       ? 
1 1 1   19   15   22 o    508.8    2.3    0.0000   0.0000          ?        ?  2589.2051  23.6253          ?        ?      508.8        2.3       ?       ? 
1 1 1   19   15   23 o    411.6    2.5    0.0000   0.0000          ?        ?  1693.9978  20.4327          ?        ?      411.6        2.5       ?       ? 
1 1 1   19   15   24 o    536.9    2.4    0.0000   0.0000          ?        ?  2882.2866  26.1794          ?        ?      536.9        2.4       ?       ? 
1 1 1   19   15   25 o   1143.2    4.0    0.0000   0.0000          ?        ? 13071.1758  90.6701          ?        ?     1143.2        4.0       ?       ? 
1 1 1   19   15   26 o    993.4    3.6    0.0000   0.0000          ?        ?  9868.9902  71.5144          ?        ?      993.4        3.6       ?       ? 
1 1 1   19   15   27 o    815.2    3.1    0.0000   0.0000          ?        ?  6645.7334  50.4432          ?        ?      815.2        3.1       ?       ? 
1 1 1   19   15   28 o   1034.9    3.7    0.0000   0.0000          ?        ? 10710.5615  77.2611          ?        ?     1034.9        3.7       ?       ? 
1 1 1   19   15   29 o    869.0    3.3    0.0000   0.0000          ?        ?  7551.7949  57.4669          ?        ?      869.0        3.3       ?       ? 
1 1 1   19   15   30 f    590.7    3.0    0.0000   0.0000          ?        ?  3488.8823  35.7572          ?        ?      590.7        3.0       ?       ? 
1 1 1   19   15   31 o    602.3    2.8    0.0000   0.0000          ?        ?  3627.4412  33.2031          ?        ?      602.3        2.8       ?       ? 
1 1 1   19   15   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   15   33 o     88.2    9.0    0.0000   0.0000          ?        ?    77.8996  15.9630          ?        ?       88.2        9.0       ?       ? 
1 1 1   19   15   34 o    455.1    3.1    0.0000   0.0000          ?        ?  2071.3640  28.0950          ?        ?      455.1        3.1       ?       ? 
1 1 1   19   15   35 o    324.5    3.0    0.0000   0.0000          ?        ?  1052.9221  19.1556          ?        ?      324.5        3.0       ?       ? 
1 1 1   19   15   36 o    776.5    3.2    0.0000   0.0000          ?        ?  6030.1982  49.8047          ?        ?      776.5        3.2       ?       ? 
1 1 1   19   15   37 f    838.3    3.3    0.0000   0.0000          ?        ?  7027.5688  54.9129          ?        ?      838.3        3.3       ?       ? 
1 1 1   19   15   38 o    232.0    3.6    0.0000   0.0000          ?        ?   538.2737  16.6016          ?        ?      232.0        3.6       ?       ? 
1 1 1   19   15   39 o    147.5    5.4    0.0000   0.0000          ?        ?   217.7359  15.9630          ?        ?      147.5        5.4       ?       ? 
1 1 1   19   15   40 o    350.2    2.7    0.0000   0.0000          ?        ?  1226.6001  19.1556          ?        ?      350.2        2.7       ?       ? 
1 1 1   19   15   41 o    502.3    2.6    0.0000   0.0000          ?        ?  2523.4375  26.1794          ?        ?      502.3        2.6       ?       ? 
1 1 1   19   15   42 o    287.9    3.3    0.0000   0.0000          ?        ?   828.8011  19.1556          ?        ?      287.9        3.3       ?       ? 
1 1 1   19   15   43 o    762.7    3.0    0.0000   0.0000          ?        ?  5818.2090  45.9736          ?        ?      762.7        3.0       ?       ? 
1 1 1   19   15   44 o    566.1    2.6    0.0000   0.0000          ?        ?  3204.7400  29.3720          ?        ?      566.1        2.6       ?       ? 
1 1 1   19   15   45 o    287.2    3.3    0.0000   0.0000          ?        ?   824.9699  19.1556          ?        ?      287.2        3.3       ?       ? 
1 1 1   19   15   46 o    336.8    2.8    0.0000   0.0000          ?        ?  1134.6530  19.1556          ?        ?      336.8        2.8       ?       ? 
1 1 1   19   15   47 o    681.7    2.9    0.0000   0.0000          ?        ?  4647.7993  38.9498          ?        ?      681.7        2.9       ?       ? 
1 1 1   19   15   48 o    444.7    2.7    0.0000   0.0000          ?        ?  1978.1399  24.2638          ?        ?      444.7        2.7       ?       ? 
1 1 1   19   15   49 o    498.5    2.7    0.0000   0.0000          ?        ?  2485.1262  26.8179          ?        ?      498.5        2.7       ?       ? 
1 1 1   19   15   50 o    217.7    4.3    0.0000   0.0000          ?        ?   474.4216  18.5171          ?        ?      217.7        4.3       ?       ? 
1 1 1   19   15   51 o     79.3   10.9    0.0000   0.0000          ?        ?    63.2136  17.2401          ?        ?       79.3       10.9       ?       ? 
1 1 1   19   15   52 o    522.8    2.6    0.0000   0.0000          ?        ?  2733.5112  27.4564          ?        ?      522.8        2.6       ?       ? 
1 1 1   19   15   53 o    473.3    2.6    0.0000   0.0000          ?        ?  2241.2109  24.9023          ?        ?      473.3        2.6       ?       ? 
1 1 1   19   15   54 o    212.7    4.4    0.0000   0.0000          ?        ?   452.7119  18.5171          ?        ?      212.7        4.4       ?       ? 
1 1 1   19   15   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   15   56 o    438.5    2.8    0.0000   0.0000          ?        ?  1923.2272  24.2638          ?        ?      438.5        2.8       ?       ? 
1 1 1   19   15   57 o    346.8    3.0    0.0000   0.0000          ?        ?  1203.6133  21.0712          ?        ?      346.8        3.0       ?       ? 
1 1 1   19   15   58 o    204.4    4.5    0.0000   0.0000          ?        ?   418.2317  18.5171          ?        ?      204.4        4.5       ?       ? 
1 1 1   19   15   59 o    361.5    3.0    0.0000   0.0000          ?        ?  1307.6923  21.7097          ?        ?      361.5        3.0       ?       ? 
1 1 1   19   15   60 o     85.0   11.3    0.0000   0.0000          ?        ?    72.7915  19.1556          ?        ?       85.0       11.3       ?       ? 
1 1 1   19   15   61 o    107.9    8.3    0.0000   0.0000          ?        ?   116.8494  17.8786          ?        ?      107.9        8.3       ?       ? 
1 1 1   19   15   62 o    230.5    4.3    0.0000   0.0000          ?        ?   531.8885  19.7942          ?        ?      230.5        4.3       ?       ? 
1 1 1   19   15   63 o    193.1    5.5    0.0000   0.0000          ?        ?   373.5352  21.0712          ?        ?      193.1        5.5       ?       ? 
1 1 1   19   15   64 f     30.0   14.1    0.0000   0.0000          ?        ?   -20.4327  21.0712          ?        ?       30.0       14.1       ?       ? 
1 1 1   19   15   65 o    197.8    5.3    0.0000   0.0000          ?        ?   392.0523  21.0712          ?        ?      197.8        5.3       ?       ? 
1 1 1   19   15   66 o    361.9    3.3    0.0000   0.0000          ?        ?  1310.8849  23.6253          ?        ?      361.9        3.3       ?       ? 
1 1 1   19   15   67 o     22.7   11.3    0.0000   0.0000          ?        ?   -60.0210  21.7097          ?        ?       22.7       11.3       ?       ? 
1 1 1   19   15   68 o    192.8    5.5    0.0000   0.0000          ?        ?   372.8966  21.0712          ?        ?      192.8        5.5       ?       ? 
1 1 1   19   15   69 o    116.1    8.5    0.0000   0.0000          ?        ?   136.0051  19.7942          ?        ?      116.1        8.5       ?       ? 
1 1 1   19   15   70 f     86.4   11.8    0.0000   0.0000          ?        ?    75.9841  20.4327          ?        ?       86.4       11.8       ?       ? 
1 1 1   19   15   71 o     23.2   11.5    0.0000   0.0000          ?        ?   -44.6965  19.7942          ?        ?       23.2       11.5       ?       ? 
1 1 1   19   15   72 o     20.5   10.4    0.0000   0.0000          ?        ?   -81.7308  22.3483          ?        ?       20.5       10.4       ?       ? 
1 1 1   19   15   73 o    275.2    3.8    0.0000   0.0000          ?        ?   759.2022  21.0712          ?        ?      275.2        3.8       ?       ? 
1 1 1   19   15   74 o     26.6   12.8    0.0000   0.0000          ?        ?   -27.4564  19.7942          ?        ?       26.6       12.8       ?       ? 
1 1 1   19   16    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   16    1 o   1922.7    8.1    0.0000   0.0000          ?        ? 36975.5078 310.3215          ?        ?     1922.7        8.1       ?       ? 
1 1 1   19   16    2 o   1472.0    5.9    0.0000   0.0000          ?        ? 21668.8711 174.3164          ?        ?     1472.0        5.9       ?       ? 
1 1 1   19   16    3 o    797.8    3.4    0.0000   0.0000          ?        ?  6365.4224  54.9129          ?        ?      797.8        3.4       ?       ? 
1 1 1   19   16    4 o   1251.8    4.8    0.0000   0.0000          ?        ? 15670.5977 119.4035          ?        ?     1251.8        4.8       ?       ? 
1 1 1   19   16    5 o   1042.9    3.9    0.0000   0.0000          ?        ? 10875.9395  82.3693          ?        ?     1042.9        3.9       ?       ? 
1 1 1   19   16    6 o   1169.1    4.3    0.0000   0.0000          ?        ? 13668.8320 100.2479          ?        ?     1169.1        4.3       ?       ? 
1 1 1   19   16    7 o    592.9    2.5    0.0000   0.0000          ?        ?  3515.0615  29.3720          ?        ?      592.9        2.5       ?       ? 
1 1 1   19   16    8 o   1547.7    5.3    0.0000   0.0000          ?        ? 23957.3320 162.8230          ?        ?     1547.7        5.3       ?       ? 
1 1 1   19   16    9 o   1490.9    5.3    0.0000   0.0000          ?        ? 22229.4922 157.7148          ?        ?     1490.9        5.3       ?       ? 
1 1 1   19   16   10 o    846.4    3.3    0.0000   0.0000          ?        ?  7164.8511  55.5514          ?        ?      846.4        3.3       ?       ? 
1 1 1   19   16   11 o    484.6    2.3    0.0000   0.0000          ?        ?  2348.4824  22.3483          ?        ?      484.6        2.3       ?       ? 
1 1 1   19   16   12 o    677.3    2.8    0.0000   0.0000          ?        ?  4587.1396  37.6728          ?        ?      677.3        2.8       ?       ? 
1 1 1   19   16   13 o    460.2    3.1    0.0000   0.0000          ?        ?  2117.9763  28.0950          ?        ?      460.2        3.1       ?       ? 
1 1 1   19   16   14 o    525.7    2.6    0.0000   0.0000          ?        ?  2764.1602  26.8179          ?        ?      525.7        2.6       ?       ? 
1 1 1   19   16   15 o    333.1    2.4    0.0000   0.0000          ?        ?  1109.7506  15.9630          ?        ?      333.1        2.4       ?       ? 
1 1 1   19   16   16 o   1078.8    3.9    0.0000   0.0000          ?        ? 11638.9727  84.2849          ?        ?     1078.8        3.9       ?       ? 
1 1 1   19   16   17 o    995.3    3.8    0.0000   0.0000          ?        ?  9906.6631  75.9841          ?        ?      995.3        3.8       ?       ? 
1 1 1   19   16   18 o    938.2    3.5    0.0000   0.0000          ?        ?  8802.6592  65.7677          ?        ?      938.2        3.5       ?       ? 
1 1 1   19   16   19 o    320.4    3.3    0.0000   0.0000          ?        ?  1026.7428  21.0712          ?        ?      320.4        3.3       ?       ? 
1 1 1   19   16   20 o    889.4    3.4    0.0000   0.0000          ?        ?  7910.6445  60.6596          ?        ?      889.4        3.4       ?       ? 
1 1 1   19   16   21 o    389.3    2.4    0.0000   0.0000          ?        ?  1515.8503  18.5171          ?        ?      389.3        2.4       ?       ? 
1 1 1   19   16   22 o    139.5    5.0    0.0000   0.0000          ?        ?   194.7491  14.0475          ?        ?      139.5        5.0       ?       ? 
1 1 1   19   16   23 o    708.5    2.8    0.0000   0.0000          ?        ?  5020.0571  39.5883          ?        ?      708.5        2.8       ?       ? 
1 1 1   19   16   24 o   1235.4    4.3    0.0000   0.0000          ?        ? 15263.2207 105.9946          ?        ?     1235.4        4.3       ?       ? 
1 1 1   19   16   25 o    193.4    4.6    0.0000   0.0000          ?        ?   374.1737  17.8786          ?        ?      193.4        4.6       ?       ? 
1 1 1   19   16   26 o    515.8    2.5    0.0000   0.0000          ?        ?  2660.0811  26.1794          ?        ?      515.8        2.5       ?       ? 
1 1 1   19   16   27 o   1052.6    3.9    0.0000   0.0000          ?        ? 11079.6270  81.7308          ?        ?     1052.6        3.9       ?       ? 
1 1 1   19   16   28 o   1461.2    4.9    0.0000   0.0000          ?        ? 21353.4395 144.3059          ?        ?     1461.2        4.9       ?       ? 
1 1 1   19   16   29 o   1039.4    3.7    0.0000   0.0000          ?        ? 10804.4238  77.2611          ?        ?     1039.4        3.7       ?       ? 
1 1 1   19   16   30 o    394.9    2.9    0.0000   0.0000          ?        ?  1559.2698  22.9868          ?        ?      394.9        2.9       ?       ? 
1 1 1   19   16   31 o    118.5    5.9    0.0000   0.0000          ?        ?   140.4748  14.0475          ?        ?      118.5        5.9       ?       ? 
1 1 1   19   16   32 o    854.8    3.3    0.0000   0.0000          ?        ?  7307.2417  56.8284          ?        ?      854.8        3.3       ?       ? 
1 1 1   19   16   33 o    435.2    2.8    0.0000   0.0000          ?        ?  1894.4938  24.2638          ?        ?      435.2        2.8       ?       ? 
1 1 1   19   16   34 o    602.7    3.2    0.0000   0.0000          ?        ?  3632.5498  38.9498          ?        ?      602.7        3.2       ?       ? 
1 1 1   19   16   35 o    860.1    3.3    0.0000   0.0000          ?        ?  7398.5498  56.8284          ?        ?      860.1        3.3       ?       ? 
1 1 1   19   16   36 f   1311.2    4.6    0.0000   0.0000          ?        ? 17197.3027 120.6806          ?        ?     1311.2        4.6       ?       ? 
1 1 1   19   16   37 o    564.4    2.8    0.0000   0.0000          ?        ?  3185.5845  31.2876          ?        ?      564.4        2.8       ?       ? 
1 1 1   19   16   38 o    286.2    3.1    0.0000   0.0000          ?        ?   819.2233  17.8786          ?        ?      286.2        3.1       ?       ? 
1 1 1   19   16   39 o    479.4    2.5    0.0000   0.0000          ?        ?  2298.6777  24.2638          ?        ?      479.4        2.5       ?       ? 
1 1 1   19   16   40 o    372.2    2.7    0.0000   0.0000          ?        ?  1385.5919  20.4327          ?        ?      372.2        2.7       ?       ? 
1 1 1   19   16   41 o    575.5    2.8    0.0000   0.0000          ?        ?  3312.6501  31.9261          ?        ?      575.5        2.8       ?       ? 
1 1 1   19   16   42 f    355.5    2.8    0.0000   0.0000          ?        ?  1264.2728  19.7942          ?        ?      355.5        2.8       ?       ? 
1 1 1   19   16   43 o    316.2    3.0    0.0000   0.0000          ?        ?   999.9249  19.1556          ?        ?      316.2        3.0       ?       ? 
1 1 1   19   16   44 o    262.9    3.6    0.0000   0.0000          ?        ?   691.5189  19.1556          ?        ?      262.9        3.6       ?       ? 
1 1 1   19   16   45 o    259.8    3.3    0.0000   0.0000          ?        ?   674.9174  17.2401          ?        ?      259.8        3.3       ?       ? 
1 1 1   19   16   46 o    216.4    4.1    0.0000   0.0000          ?        ?   468.6749  17.8786          ?        ?      216.4        4.1       ?       ? 
1 1 1   19   16   47 o    443.4    2.7    0.0000   0.0000          ?        ?  1966.0081  23.6253          ?        ?      443.4        2.7       ?       ? 
1 1 1   19   16   48 o    610.8    2.8    0.0000   0.0000          ?        ?  3731.5205  34.4802          ?        ?      610.8        2.8       ?       ? 
1 1 1   19   16   49 o    282.9    3.4    0.0000   0.0000          ?        ?   800.7061  19.1556          ?        ?      282.9        3.4       ?       ? 
1 1 1   19   16   50 o    189.2    4.6    0.0000   0.0000          ?        ?   358.2106  17.2401          ?        ?      189.2        4.6       ?       ? 
1 1 1   19   16   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   16   52 o    441.4    2.7    0.0000   0.0000          ?        ?  1948.7681  24.2638          ?        ?      441.4        2.7       ?       ? 
1 1 1   19   16   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   16   54 o     21.7   10.8    0.0000   0.0000          ?        ?   -43.4195  17.8786          ?        ?       21.7       10.8       ?       ? 
1 1 1   19   16   55 o    282.4    3.5    0.0000   0.0000          ?        ?   798.1520  19.7942          ?        ?      282.4        3.5       ?       ? 
1 1 1   19   16   56 o    344.3    3.1    0.0000   0.0000          ?        ?  1185.7346  21.0712          ?        ?      344.3        3.1       ?       ? 
1 1 1   19   16   57 o    213.4    4.6    0.0000   0.0000          ?        ?   455.9044  19.7942          ?        ?      213.4        4.6       ?       ? 
1 1 1   19   16   58 o    313.3    3.3    0.0000   0.0000          ?        ?   982.0463  20.4327          ?        ?      313.3        3.3       ?       ? 
1 1 1   19   16   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   16   60 o    101.8    9.1    0.0000   0.0000          ?        ?   104.0790  18.5171          ?        ?      101.8        9.1       ?       ? 
1 1 1   19   16   61 o    106.0    8.7    0.0000   0.0000          ?        ?   113.0183  18.5171          ?        ?      106.0        8.7       ?       ? 
1 1 1   19   16   62 o    139.5    6.9    0.0000   0.0000          ?        ?   195.3876  19.1556          ?        ?      139.5        6.9       ?       ? 
1 1 1   19   16   63 o    121.1    8.4    0.0000   0.0000          ?        ?   147.4985  20.4327          ?        ?      121.1        8.4       ?       ? 
1 1 1   19   16   64 o    153.2    6.5    0.0000   0.0000          ?        ?   235.6145  19.7942          ?        ?      153.2        6.5       ?       ? 
1 1 1   19   16   65 o     29.2   13.7    0.0000   0.0000          ?        ?   -21.0712  20.4327          ?        ?       29.2       13.7       ?       ? 
1 1 1   19   16   66 o    234.0    4.4    0.0000   0.0000          ?        ?   548.4901  20.4327          ?        ?      234.0        4.4       ?       ? 
1 1 1   19   16   67 o     96.3   10.6    0.0000   0.0000          ?        ?    93.8627  20.4327          ?        ?       96.3       10.6       ?       ? 
1 1 1   19   16   68 o     21.2   10.7    0.0000   0.0000          ?        ?   -61.9366  20.4327          ?        ?       21.2       10.7       ?       ? 
1 1 1   19   16   69 o    100.8    9.8    0.0000   0.0000          ?        ?   102.8020  19.7942          ?        ?      100.8        9.8       ?       ? 
1 1 1   19   16   70 o     37.8   15.6    0.0000   0.0000          ?        ?     5.1082  19.1556          ?        ?       37.8       15.6       ?       ? 
1 1 1   19   16   71 o    155.6    6.8    0.0000   0.0000          ?        ?   243.9153  21.0712          ?        ?      155.6        6.8       ?       ? 
1 1 1   19   16   72 o    100.8    9.8    0.0000   0.0000          ?        ?   103.4405  19.7942          ?        ?      100.8        9.8       ?       ? 
1 1 1   19   16   73 o     89.7   10.7    0.0000   0.0000          ?        ?    82.3693  19.1556          ?        ?       89.7       10.7       ?       ? 
1 1 1   19   17    0 o    200.3    8.6  403.5457  34.4802   403.5457  34.4802   403.5457  34.4802      200.3      8.6      200.3        8.6     0.0     0.0 
1 1 1   19   17    1 o   1148.6    5.8    0.0000   0.0000          ?        ? 13193.7725 133.4510          ?        ?     1148.6        5.8       ?       ? 
1 1 1   19   17    2 o    936.0    4.3    0.0000   0.0000          ?        ?  8761.7930  79.8152          ?        ?      936.0        4.3       ?       ? 
1 1 1   19   17    3 o    842.3    3.4    0.0000   0.0000          ?        ?  7094.6138  57.4669          ?        ?      842.3        3.4       ?       ? 
1 1 1   19   17    4 o   1857.5    7.0    0.0000   0.0000          ?        ? 34508.2617 261.7939          ?        ?     1857.5        7.0       ?       ? 
1 1 1   19   17    5 o   1630.3    5.9    0.0000   0.0000          ?        ? 26581.0156 193.4720          ?        ?     1630.3        5.9       ?       ? 
1 1 1   19   17    6 o   1184.3    4.3    0.0000   0.0000          ?        ? 14025.7666 102.8020          ?        ?     1184.3        4.3       ?       ? 
1 1 1   19   17    7 o    771.2    3.7    0.0000   0.0000          ?        ?  5948.4673  57.4669          ?        ?      771.2        3.7       ?       ? 
1 1 1   19   17    8 o    361.5    2.0    0.0000   0.0000          ?        ?  1307.0537  14.6860          ?        ?      361.5        2.0       ?       ? 
1 1 1   19   17    9 o    915.6    3.7    0.0000   0.0000          ?        ?  8383.1504  67.6833          ?        ?      915.6        3.7       ?       ? 
1 1 1   19   17   10 o     93.2    4.5    0.0000   0.0000          ?        ?    86.8389   8.3008          ?        ?       93.2        4.5       ?       ? 
1 1 1   19   17   11 o   1301.8    4.5    0.0000   0.0000          ?        ? 16948.9180 117.4880          ?        ?     1301.8        4.5       ?       ? 
1 1 1   19   17   12 o    584.7    2.4    0.0000   0.0000          ?        ?  3419.2832  28.0950          ?        ?      584.7        2.4       ?       ? 
1 1 1   19   17   13 o   1247.4    4.6    0.0000   0.0000          ?        ? 15562.0488 114.2954          ?        ?     1247.4        4.6       ?       ? 
1 1 1   19   17   14 o    854.7    3.4    0.0000   0.0000          ?        ?  7304.6875  57.4669          ?        ?      854.7        3.4       ?       ? 
1 1 1   19   17   15 o   1626.8    5.4    0.0000   0.0000          ?        ? 26468.6348 176.8705          ?        ?     1626.8        5.4       ?       ? 
1 1 1   19   17   16 o    965.7    3.6    0.0000   0.0000          ?        ?  9326.8848  68.9603          ?        ?      965.7        3.6       ?       ? 
1 1 1   19   17   17 o    720.3    2.8    0.0000   0.0000          ?        ?  5188.6265  40.8654          ?        ?      720.3        2.8       ?       ? 
1 1 1   19   17   18 o     32.3   13.4    0.0000   0.0000          ?        ?     2.5541  14.0475          ?        ?       32.3       13.4       ?       ? 
1 1 1   19   17   19 o   1398.1    4.7    0.0000   0.0000          ?        ? 19550.2559 132.1740          ?        ?     1398.1        4.7       ?       ? 
1 1 1   19   17   20 o    851.7    3.2    0.0000   0.0000          ?        ?  7253.6055  54.9129          ?        ?      851.7        3.2       ?       ? 
1 1 1   19   17   21 f    696.7    2.9    0.0000   0.0000          ?        ?  4854.0415  40.2269          ?        ?      696.7        2.9       ?       ? 
1 1 1   19   17   22 o   1720.8    5.8    0.0000   0.0000          ?        ? 29617.8262 201.1343          ?        ?     1720.8        5.8       ?       ? 
1 1 1   19   17   23 o    865.3    3.3    0.0000   0.0000          ?        ?  7488.5820  57.4669          ?        ?      865.3        3.3       ?       ? 
1 1 1   19   17   24 o     46.2   15.7    0.0000   0.0000          ?        ?    19.7942  17.2401          ?        ?       46.2       15.7       ?       ? 
1 1 1   19   17   25 o    854.4    3.2    0.0000   0.0000          ?        ?  7299.5791  54.2743          ?        ?      854.4        3.2       ?       ? 
1 1 1   19   17   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   17   27 o    479.5    2.5    0.0000   0.0000          ?        ?  2299.3164  23.6253          ?        ?      479.5        2.5       ?       ? 
1 1 1   19   17   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   17   29 o    914.5    3.4    0.0000   0.0000          ?        ?  8364.6338  61.2981          ?        ?      914.5        3.4       ?       ? 
1 1 1   19   17   30 o    218.8    4.2    0.0000   0.0000          ?        ?   478.8912  18.5171          ?        ?      218.8        4.2       ?       ? 
1 1 1   19   17   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   17   32 o    520.9    2.8    0.0000   0.0000          ?        ?  2713.0784  29.3720          ?        ?      520.9        2.8       ?       ? 
1 1 1   19   17   33 o    844.5    3.6    0.0000   0.0000          ?        ?  7133.5635  60.6596          ?        ?      844.5        3.6       ?       ? 
1 1 1   19   17   34 o    271.9    3.3    0.0000   0.0000          ?        ?   739.4081  17.8786          ?        ?      271.9        3.3       ?       ? 
1 1 1   19   17   35 f    567.7    2.6    0.0000   0.0000          ?        ?  3223.2571  30.0105          ?        ?      567.7        2.6       ?       ? 
1 1 1   19   17   36 o    329.1    3.5    0.0000   0.0000          ?        ?  1082.9327  22.9868          ?        ?      329.1        3.5       ?       ? 
1 1 1   19   17   37 o    698.1    2.9    0.0000   0.0000          ?        ?  4873.8354  40.2269          ?        ?      698.1        2.9       ?       ? 
1 1 1   19   17   38 o    396.5    2.7    0.0000   0.0000          ?        ?  1572.6788  21.7097          ?        ?      396.5        2.7       ?       ? 
1 1 1   19   17   39 o    461.6    2.6    0.0000   0.0000          ?        ?  2130.7468  24.2638          ?        ?      461.6        2.6       ?       ? 
1 1 1   19   17   40 o    147.7    5.8    0.0000   0.0000          ?        ?   218.3744  17.2401          ?        ?      147.7        5.8       ?       ? 
1 1 1   19   17   41 o    284.1    3.7    0.0000   0.0000          ?        ?   807.0914  21.0712          ?        ?      284.1        3.7       ?       ? 
1 1 1   19   17   42 o    662.1    2.7    0.0000   0.0000          ?        ?  4384.7280  35.7572          ?        ?      662.1        2.7       ?       ? 
1 1 1   19   17   43 o    147.3    5.9    0.0000   0.0000          ?        ?   217.0974  17.2401          ?        ?      147.3        5.9       ?       ? 
1 1 1   19   17   44 o    335.2    2.9    0.0000   0.0000          ?        ?  1123.7981  19.1556          ?        ?      335.2        2.9       ?       ? 
1 1 1   19   17   45 o    203.4    4.1    0.0000   0.0000          ?        ?   413.7620  16.6016          ?        ?      203.4        4.1       ?       ? 
1 1 1   19   17   46 o     18.9    9.6    0.0000   0.0000          ?        ?   -57.4669  17.2401          ?        ?       18.9        9.6       ?       ? 
1 1 1   19   17   47 o    390.3    2.6    0.0000   0.0000          ?        ?  1523.5127  20.4327          ?        ?      390.3        2.6       ?       ? 
1 1 1   19   17   48 o    599.0    2.7    0.0000   0.0000          ?        ?  3589.1299  31.9261          ?        ?      599.0        2.7       ?       ? 
1 1 1   19   17   49 o    298.7    3.5    0.0000   0.0000          ?        ?   892.6533  21.0712          ?        ?      298.7        3.5       ?       ? 
1 1 1   19   17   50 o    303.7    3.2    0.0000   0.0000          ?        ?   922.6638  19.1556          ?        ?      303.7        3.2       ?       ? 
1 1 1   19   17   51 o    315.2    3.0    0.0000   0.0000          ?        ?   994.1782  19.1556          ?        ?      315.2        3.0       ?       ? 
1 1 1   19   17   52 o    197.1    4.5    0.0000   0.0000          ?        ?   388.8597  17.8786          ?        ?      197.1        4.5       ?       ? 
1 1 1   19   17   53 o    849.2    3.2    0.0000   0.0000          ?        ?  7214.6562  53.6358          ?        ?      849.2        3.2       ?       ? 
1 1 1   19   17   54 o    228.3    4.1    0.0000   0.0000          ?        ?   521.6721  18.5171          ?        ?      228.3        4.1       ?       ? 
1 1 1   19   17   55 o    396.4    2.8    0.0000   0.0000          ?        ?  1572.0403  22.3483          ?        ?      396.4        2.8       ?       ? 
1 1 1   19   17   56 o    166.7    5.6    0.0000   0.0000          ?        ?   278.3954  18.5171          ?        ?      166.7        5.6       ?       ? 
1 1 1   19   17   57 o     96.3    9.3    0.0000   0.0000          ?        ?    93.2242  17.8786          ?        ?       96.3        9.3       ?       ? 
1 1 1   19   17   58 f    105.5    8.5    0.0000   0.0000          ?        ?   111.7413  17.8786          ?        ?      105.5        8.5       ?       ? 
1 1 1   19   17   59 o    490.9    2.7    0.0000   0.0000          ?        ?  2411.0576  26.8179          ?        ?      490.9        2.7       ?       ? 
1 1 1   19   17   60 o     26.3   12.6    0.0000   0.0000          ?        ?   -27.4564  19.1556          ?        ?       26.3       12.6       ?       ? 
1 1 1   19   17   61 f     98.1   10.4    0.0000   0.0000          ?        ?    97.0553  20.4327          ?        ?       98.1       10.4       ?       ? 
1 1 1   19   17   62 o     34.4   15.2    0.0000   0.0000          ?        ?    -5.7467  20.4327          ?        ?       34.4       15.2       ?       ? 
1 1 1   19   17   63 o    214.1    4.8    0.0000   0.0000          ?        ?   459.0970  20.4327          ?        ?      214.1        4.8       ?       ? 
1 1 1   19   17   64 o    359.0    3.1    0.0000   0.0000          ?        ?  1289.8137  22.3483          ?        ?      359.0        3.1       ?       ? 
1 1 1   19   17   65 o    165.4    6.2    0.0000   0.0000          ?        ?   274.5643  20.4327          ?        ?      165.4        6.2       ?       ? 
1 1 1   19   17   66 o    206.1    5.1    0.0000   0.0000          ?        ?   425.8939  21.0712          ?        ?      206.1        5.1       ?       ? 
1 1 1   19   17   67 o    185.3    5.7    0.0000   0.0000          ?        ?   344.8017  21.0712          ?        ?      185.3        5.7       ?       ? 
1 1 1   19   17   68 o     77.1   13.7    0.0000   0.0000          ?        ?    62.5751  20.4327          ?        ?       77.1       13.7       ?       ? 
1 1 1   19   17   69 f    123.0    8.0    0.0000   0.0000          ?        ?   152.6067  19.7942          ?        ?      123.0        8.0       ?       ? 
1 1 1   19   17   70 o     21.1   10.6    0.0000   0.0000          ?        ?   -58.1055  19.7942          ?        ?       21.1       10.6       ?       ? 
1 1 1   19   17   71 f    220.4    4.8    0.0000   0.0000          ?        ?   487.8305  21.0712          ?        ?      220.4        4.8       ?       ? 
1 1 1   19   17   72 o    111.8    9.4    0.0000   0.0000          ?        ?   127.0658  21.0712          ?        ?      111.8        9.4       ?       ? 
1 1 1   19   17   73 o     62.5   16.2    0.0000   0.0000          ?        ?    42.7809  20.4327          ?        ?       62.5       16.2       ?       ? 
1 1 1   19   18    0 o    409.9    4.4 1680.5890  35.7572  1680.5890  35.7572  1680.5890  35.7572      409.9      4.4      409.9        4.4     0.0     0.0 
1 1 1   19   18    1 o    990.3    4.6    0.0000   0.0000          ?        ?  9808.3301  91.9471          ?        ?      990.3        4.6       ?       ? 
1 1 1   19   18    2 o    506.6    3.2    0.0000   0.0000          ?        ?  2566.8569  31.9261          ?        ?      506.6        3.2       ?       ? 
1 1 1   19   18    3 o    485.8    3.1    0.0000   0.0000          ?        ?  2359.9761  30.0105          ?        ?      485.8        3.1       ?       ? 
1 1 1   19   18    4 o   1275.5    5.1    0.0000   0.0000          ?        ? 16270.1699 129.6199          ?        ?     1275.5        5.1       ?       ? 
1 1 1   19   18    5 o   1152.2    4.2    0.0000   0.0000          ?        ? 13276.1416  97.6938          ?        ?     1152.2        4.2       ?       ? 
1 1 1   19   18    6 f   1132.4    4.3    0.0000   0.0000          ?        ? 12823.4297  97.0553          ?        ?     1132.4        4.3       ?       ? 
1 1 1   19   18    7 o    630.2    2.6    0.0000   0.0000          ?        ?  3972.2429  33.2031          ?        ?      630.2        2.6       ?       ? 
1 1 1   19   18    8 o     11.6    5.8    0.0000   0.0000          ?        ?   -21.0712   6.3852          ?        ?       11.6        5.8       ?       ? 
1 1 1   19   18    9 o   1476.2    5.0    0.0000   0.0000          ?        ? 21792.7422 148.7755          ?        ?     1476.2        5.0       ?       ? 
1 1 1   19   18   10 o   1144.4    4.2    0.0000   0.0000          ?        ? 13097.9941  95.7782          ?        ?     1144.4        4.2       ?       ? 
1 1 1   19   18   11 o    544.7    2.6    0.0000   0.0000          ?        ?  2966.5715  28.0950          ?        ?      544.7        2.6       ?       ? 
1 1 1   19   18   12 o    258.9    2.6    0.0000   0.0000          ?        ?   670.4477  13.4090          ?        ?      258.9        2.6       ?       ? 
1 1 1   19   18   13 o    483.2    2.4    0.0000   0.0000          ?        ?  2334.4351  23.6253          ?        ?      483.2        2.4       ?       ? 
1 1 1   19   18   14 o   1939.0    6.5    0.0000   0.0000          ?        ? 37603.8164 251.5775          ?        ?     1939.0        6.5       ?       ? 
1 1 1   19   18   15 o    702.9    2.9    0.0000   0.0000          ?        ?  4940.2417  40.2269          ?        ?      702.9        2.9       ?       ? 
1 1 1   19   18   16 o   1196.6    4.2    0.0000   0.0000          ?        ? 14318.8477 101.5249          ?        ?     1196.6        4.2       ?       ? 
1 1 1   19   18   17 o    644.3    2.9    0.0000   0.0000          ?        ?  4151.6675  37.6728          ?        ?      644.3        2.9       ?       ? 
1 1 1   19   18   18 o    645.4    2.7    0.0000   0.0000          ?        ?  4165.7153  34.4802          ?        ?      645.4        2.7       ?       ? 
1 1 1   19   18   19 o    904.2    3.6    0.0000   0.0000          ?        ?  8176.9077  65.7677          ?        ?      904.2        3.6       ?       ? 
1 1 1   19   18   20 o   1073.6    3.8    0.0000   0.0000          ?        ? 11526.5918  81.0922          ?        ?     1073.6        3.8       ?       ? 
1 1 1   19   18   21 o    158.6    3.8    0.0000   0.0000          ?        ?   251.5775  12.1319          ?        ?      158.6        3.8       ?       ? 
1 1 1   19   18   22 o    853.8    3.3    0.0000   0.0000          ?        ?  7289.3628  56.1899          ?        ?      853.8        3.3       ?       ? 
1 1 1   19   18   23 o   1114.8    3.9    0.0000   0.0000          ?        ? 12429.4619  86.8389          ?        ?     1114.8        3.9       ?       ? 
1 1 1   19   18   24 o   1031.6    3.8    0.0000   0.0000          ?        ? 10642.2393  78.5382          ?        ?     1031.6        3.8       ?       ? 
1 1 1   19   18   25 o   1279.7    4.5    0.0000   0.0000          ?        ? 16378.7188 114.9339          ?        ?     1279.7        4.5       ?       ? 
1 1 1   19   18   26 o    727.2    3.0    0.0000   0.0000          ?        ?  5288.8745  43.4195          ?        ?      727.2        3.0       ?       ? 
1 1 1   19   18   27 o    604.0    2.8    0.0000   0.0000          ?        ?  3647.8740  33.8416          ?        ?      604.0        2.8       ?       ? 
1 1 1   19   18   28 o    414.1    2.5    0.0000   0.0000          ?        ?  1715.0691  20.4327          ?        ?      414.1        2.5       ?       ? 
1 1 1   19   18   29 o    741.6    3.0    0.0000   0.0000          ?        ?  5499.5869  44.6965          ?        ?      741.6        3.0       ?       ? 
1 1 1   19   18   30 o    378.3    2.7    0.0000   0.0000          ?        ?  1430.9270  20.4327          ?        ?      378.3        2.7       ?       ? 
1 1 1   19   18   31 o   1059.2    3.8    0.0000   0.0000          ?        ? 11220.7412  81.0922          ?        ?     1059.2        3.8       ?       ? 
1 1 1   19   18   32 o     72.3   11.5    0.0000   0.0000          ?        ?    52.3588  16.6016          ?        ?       72.3       11.5       ?       ? 
1 1 1   19   18   33 o    589.5    2.7    0.0000   0.0000          ?        ?  3475.4731  31.2876          ?        ?      589.5        2.7       ?       ? 
1 1 1   19   18   34 o    767.8    3.2    0.0000   0.0000          ?        ?  5896.1089  48.5276          ?        ?      767.8        3.2       ?       ? 
1 1 1   19   18   35 o    308.5    2.8    0.0000   0.0000          ?        ?   952.0358  17.2401          ?        ?      308.5        2.8       ?       ? 
1 1 1   19   18   36 o     68.2   11.2    0.0000   0.0000          ?        ?    46.6121  15.3245          ?        ?       68.2       11.2       ?       ? 
1 1 1   19   18   37 o    234.0    3.4    0.0000   0.0000          ?        ?   547.8516  15.9630          ?        ?      234.0        3.4       ?       ? 
1 1 1   19   18   38 o    588.0    2.7    0.0000   0.0000          ?        ?  3458.2329  31.2876          ?        ?      588.0        2.7       ?       ? 
1 1 1   19   18   39 o    372.6    3.0    0.0000   0.0000          ?        ?  1388.7845  22.3483          ?        ?      372.6        3.0       ?       ? 
1 1 1   19   18   40 o    325.4    2.8    0.0000   0.0000          ?        ?  1059.3074  18.5171          ?        ?      325.4        2.8       ?       ? 
1 1 1   19   18   41 o    697.1    2.8    0.0000   0.0000          ?        ?  4860.4268  39.5883          ?        ?      697.1        2.8       ?       ? 
1 1 1   19   18   42 o    388.6    2.7    0.0000   0.0000          ?        ?  1510.7422  21.0712          ?        ?      388.6        2.7       ?       ? 
1 1 1   19   18   43 o    708.5    2.9    0.0000   0.0000          ?        ?  5021.3340  41.5039          ?        ?      708.5        2.9       ?       ? 
1 1 1   19   18   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   18   45 o     26.0   12.4    0.0000   0.0000          ?        ?   -23.6253  17.8786          ?        ?       26.0       12.4       ?       ? 
1 1 1   19   18   46 o    260.0    3.3    0.0000   0.0000          ?        ?   676.1944  17.2401          ?        ?      260.0        3.3       ?       ? 
1 1 1   19   18   47 o    484.8    2.6    0.0000   0.0000          ?        ?  2350.3982  24.9023          ?        ?      484.8        2.6       ?       ? 
1 1 1   19   18   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   18   49 f    541.7    2.7    0.0000   0.0000          ?        ?  2935.2839  28.7335          ?        ?      541.7        2.7       ?       ? 
1 1 1   19   18   50 o    147.9    6.3    0.0000   0.0000          ?        ?   219.0129  18.5171          ?        ?      147.9        6.3       ?       ? 
1 1 1   19   18   51 o    553.0    2.9    0.0000   0.0000          ?        ?  3059.1572  32.5646          ?        ?      553.0        2.9       ?       ? 
1 1 1   19   18   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   18   53 o     86.2   10.4    0.0000   0.0000          ?        ?    74.7070  17.8786          ?        ?       86.2       10.4       ?       ? 
1 1 1   19   18   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   18   55 o    103.3    9.0    0.0000   0.0000          ?        ?   107.2716  18.5171          ?        ?      103.3        9.0       ?       ? 
1 1 1   19   18   56 o    145.7    6.1    0.0000   0.0000          ?        ?   212.6277  17.8786          ?        ?      145.7        6.1       ?       ? 
1 1 1   19   18   57 f    216.5    4.3    0.0000   0.0000          ?        ?   469.3134  18.5171          ?        ?      216.5        4.3       ?       ? 
1 1 1   19   18   58 o    276.0    3.5    0.0000   0.0000          ?        ?   762.3948  19.1556          ?        ?      276.0        3.5       ?       ? 
1 1 1   19   18   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   18   60 o    115.5    8.8    0.0000   0.0000          ?        ?   134.0895  20.4327          ?        ?      115.5        8.8       ?       ? 
1 1 1   19   18   61 o     21.1   10.6    0.0000   0.0000          ?        ?   -63.2136  20.4327          ?        ?       21.1       10.6       ?       ? 
1 1 1   19   18   62 o    539.1    2.8    0.0000   0.0000          ?        ?  2908.4661  30.0105          ?        ?      539.1        2.8       ?       ? 
1 1 1   19   18   63 o     20.7   10.4    0.0000   0.0000          ?        ?   -61.9366  19.7942          ?        ?       20.7       10.4       ?       ? 
1 1 1   19   18   64 o    225.2    4.5    0.0000   0.0000          ?        ?   508.2632  20.4327          ?        ?      225.2        4.5       ?       ? 
1 1 1   19   18   65 o    362.3    3.1    0.0000   0.0000          ?        ?  1314.0775  22.3483          ?        ?      362.3        3.1       ?       ? 
1 1 1   19   18   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   18   67 o     99.2   10.3    0.0000   0.0000          ?        ?    99.6094  20.4327          ?        ?       99.2       10.3       ?       ? 
1 1 1   19   18   68 o     27.3   13.0    0.0000   0.0000          ?        ?   -25.5409  19.7942          ?        ?       27.3       13.0       ?       ? 
1 1 1   19   18   69 o     78.6   13.0    0.0000   0.0000          ?        ?    63.2136  20.4327          ?        ?       78.6       13.0       ?       ? 
1 1 1   19   18   70 o    124.1    8.2    0.0000   0.0000          ?        ?   155.7993  20.4327          ?        ?      124.1        8.2       ?       ? 
1 1 1   19   18   71 o    161.8    6.5    0.0000   0.0000          ?        ?   263.7094  21.0712          ?        ?      161.8        6.5       ?       ? 
1 1 1   19   18   72 o     80.7   12.3    0.0000   0.0000          ?        ?    67.0448  19.7942          ?        ?       80.7       12.3       ?       ? 
1 1 1   19   19    0 o    235.9    6.8  558.0679  31.9261   558.0679  31.9261   558.0679  31.9261      235.9      6.8      235.9        6.8     0.0     0.0 
1 1 1   19   19    1 o    642.2    4.8 4124.8496  61.2981  4124.8496  61.2981  4124.8496  61.2981      642.2      4.8      642.2        4.8     0.0     0.0 
1 1 1   19   19    2 o    210.3    6.8  443.7725  28.7335   443.7725  28.7335   443.7725  28.7335      210.3      6.8      210.3        6.8     0.0     0.0 
1 1 1   19   19    3 o   1726.9    9.9 29831.0918 343.5246 29831.0918 343.5246 29831.0918 343.5246     1726.9      9.9     1726.9        9.9     0.0     0.0 
1 1 1   19   19    4 o    424.3    4.4 1800.6310  37.0343  1800.6310  37.0343  1800.6310  37.0343      424.3      4.4      424.3        4.4     0.0     0.0 
1 1 1   19   19    5 o   1657.3    9.0 27472.3926 297.5511 27472.3926 297.5511 27472.3926 297.5511     1657.3      9.0     1657.3        9.0     0.0     0.0 
1 1 1   19   19    6 o    178.9    3.2  320.5379  11.4934   320.5379  11.4934   320.5379  11.4934      178.9      3.2      178.9        3.2     0.0     0.0 
1 1 1   19   19    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   19    8 o    512.7    3.2 2628.7937  32.5646  2628.7937  32.5646  2628.7937  32.5646      512.7      3.2      512.7        3.2     0.0     0.0 
1 1 1   19   19    9 o     94.9   10.3   93.2242  19.1556    93.2242  19.1556    93.2242  19.1556       94.9     10.3       94.9       10.3     0.0     0.0 
1 1 1   19   19   10 o     28.7   17.3    8.3008  17.8786     8.3008  17.8786     8.3008  17.8786       28.7     17.3       28.7       17.3     0.0     0.0 
1 1 1   19   19   11 o    503.8    3.4 2538.1235  33.8416  2538.1235  33.8416  2538.1235  33.8416      503.8      3.4      503.8        3.4     0.0     0.0 
1 1 1   19   19   12 o    229.4    5.6  527.4188  25.5409   527.4188  25.5409   527.4188  25.5409      229.4      5.6      229.4        5.6     0.0     0.0 
1 1 1   19   19   13 o    911.1    4.6 8302.0576  84.2849  8302.0576  84.2849  8302.0576  84.2849      911.1      4.6      911.1        4.6     0.0     0.0 
1 1 1   19   19   14 f    596.6    4.1 3559.7581  48.5276  3559.7581  48.5276  3559.7581  48.5276      596.6      4.1      596.6        4.1     0.0     0.0 
1 1 1   19   19   15 o    872.4    5.3 7612.4546  92.5856  7612.4546  92.5856  7612.4546  92.5856      872.4      5.3      872.4        5.3     0.0     0.0 
1 1 1   19   19   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   19   17 o    195.8    5.4  384.3900  21.0712   384.3900  21.0712   384.3900  21.0712      195.8      5.4      195.8        5.4     0.0     0.0 
1 1 1   19   19   18 o    510.6    3.6 2607.7222  37.0343  2607.7222  37.0343  2607.7222  37.0343      510.6      3.6      510.6        3.6     0.0     0.0 
1 1 1   19   19   19 o    947.6    4.9 8980.8066  93.2242  8980.8066  93.2242  8980.8066  93.2242      947.6      4.9      947.6        4.9     0.0     0.0 
1 1 1   19   19   20 o    849.8    4.6 7222.3179  78.5382  7222.3179  78.5382  7222.3179  78.5382      849.8      4.6      849.8        4.6     0.0     0.0 
1 1 1   19   19   21 o     64.2   14.9   47.2506  16.6016    47.2506  16.6016    47.2506  16.6016       64.2     14.9       64.2       14.9     0.0     0.0 
1 1 1   19   19   22 o    701.2    4.1 4917.8936  57.4669  4917.8936  57.4669  4917.8936  57.4669      701.2      4.1      701.2        4.1     0.0     0.0 
1 1 1   19   19   23 o    379.2    3.6 1438.5892  27.4564  1438.5892  27.4564  1438.5892  27.4564      379.2      3.6      379.2        3.6     0.0     0.0 
1 1 1   19   19   24 o    525.2    3.8 2759.0520  39.5883  2759.0520  39.5883  2759.0520  39.5883      525.2      3.8      525.2        3.8     0.0     0.0 
1 1 1   19   19   25 o     27.4   20.5 -315.4297  91.3086  -315.4297  91.3086  -315.4297  91.3086       27.4     20.5       27.4       20.5     0.0     0.0 
1 1 1   19   19   26 o    561.5    3.9 3153.0198  43.4195  3153.0198  43.4195  3153.0198  43.4195      561.5      3.9      561.5        3.9     0.0     0.0 
1 1 1   19   19   27 o    565.7    3.6 3200.9089  40.2269  3200.9089  40.2269  3200.9089  40.2269      565.7      3.6      565.7        3.6     0.0     0.0 
1 1 1   19   19   28 o     14.7   10.9  -68.3218  22.9868   -68.3218  22.9868   -68.3218  22.9868       14.7     10.9       14.7       10.9     0.0     0.0 
1 1 1   19   19   29 o    696.2    4.2 4847.6562  58.1055  4847.6562  58.1055  4847.6562  58.1055      696.2      4.2      696.2        4.2     0.0     0.0 
1 1 1   19   19   30 o    479.5    4.3 2299.9551  40.8654  2299.9551  40.8654  2299.9551  40.8654      479.5      4.3      479.5        4.3     0.0     0.0 
1 1 1   19   19   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   19   32 o    415.1    3.8 1723.3699  31.9261  1723.3699  31.9261  1723.3699  31.9261      415.1      3.8      415.1        3.8     0.0     0.0 
1 1 1   19   19   33 o    414.5    4.1 1718.9003  33.8416  1718.9003  33.8416  1718.9003  33.8416      414.5      4.1      414.5        4.1     0.0     0.0 
1 1 1   19   19   34 o    316.1    4.1  999.9249  26.1794   999.9249  26.1794   999.9249  26.1794      316.1      4.1      316.1        4.1     0.0     0.0 
1 1 1   19   19   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   19   36 o    626.6    4.0 3927.5464  49.8047  3927.5464  49.8047  3927.5464  49.8047      626.6      4.0      626.6        4.0     0.0     0.0 
1 1 1   19   19   37 o    101.3   10.6  105.9946  21.0712   105.9946  21.0712   105.9946  21.0712      101.3     10.6      101.3       10.6     0.0     0.0 
1 1 1   19   19   38 o    529.1    3.8 2800.5559  40.2269  2800.5559  40.2269  2800.5559  40.2269      529.1      3.8      529.1        3.8     0.0     0.0 
1 1 1   19   19   39 o    320.2    4.3 1026.1042  27.4564  1026.1042  27.4564  1026.1042  27.4564      320.2      4.3      320.2        4.3     0.0     0.0 
1 1 1   19   19   40 o    132.3    8.8  177.5090  22.9868   177.5090  22.9868   177.5090  22.9868      132.3      8.8      132.3        8.8     0.0     0.0 
1 1 1   19   19   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   19   42 f    208.7    5.7  436.7488  23.6253   436.7488  23.6253   436.7488  23.6253      208.7      5.7      208.7        5.7     0.0     0.0 
1 1 1   19   19   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   19   44 o     60.6   21.5   48.5276  23.6253    48.5276  23.6253    48.5276  23.6253       60.6     21.5       60.6       21.5     0.0     0.0 
1 1 1   19   19   45 o    395.7    3.8 1566.9320  30.0105  1566.9320  30.0105  1566.9320  30.0105      395.7      3.8      395.7        3.8     0.0     0.0 
1 1 1   19   19   46 o     63.1   20.2   50.4432  22.3483    50.4432  22.3483    50.4432  22.3483       63.1     20.2       63.1       20.2     0.0     0.0 
1 1 1   19   19   47 o     14.4   10.7  -71.5144  22.9868   -71.5144  22.9868   -71.5144  22.9868       14.4     10.7       14.4       10.7     0.0     0.0 
1 1 1   19   19   48 o     40.7   21.7   24.2638  23.6253    24.2638  23.6253    24.2638  23.6253       40.7     21.7       40.7       21.7     0.0     0.0 
1 1 1   19   19   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   19   50 o    540.1    3.8 2918.0439  40.8654  2918.0439  40.8654  2918.0439  40.8654      540.1      3.8      540.1        3.8     0.0     0.0 
1 1 1   19   19   51 o    150.8    9.4  230.5063  28.0950   230.5063  28.0950   230.5063  28.0950      150.8      9.4      150.8        9.4     0.0     0.0 
1 1 1   19   19   52 o    149.1    8.2  224.7596  24.2638   224.7596  24.2638   224.7596  24.2638      149.1      8.2      149.1        8.2     0.0     0.0 
1 1 1   19   19   53 o    164.3    7.6  272.0102  24.9023   272.0102  24.9023   272.0102  24.9023      164.3      7.6      164.3        7.6     0.0     0.0 
1 1 1   19   19   54 f    176.6    7.6  314.1526  26.8179   314.1526  26.8179   314.1526  26.8179      176.6      7.6      176.6        7.6     0.0     0.0 
1 1 1   19   19   55 o    353.7    4.2 1252.1410  29.3720  1252.1410  29.3720  1252.1410  29.3720      353.7      4.2      353.7        4.2     0.0     0.0 
1 1 1   19   19   56 o    408.2    3.8 1667.8186  31.2876  1667.8186  31.2876  1667.8186  31.2876      408.2      3.8      408.2        3.8     0.0     0.0 
1 1 1   19   19   57 o     15.0   11.2  -85.5619  26.1794   -85.5619  26.1794   -85.5619  26.1794       15.0     11.2       15.0       11.2     0.0     0.0 
1 1 1   19   19   58 o     30.4   19.6    1.9156  26.8179     1.9156  26.8179     1.9156  26.8179       30.4     19.6       30.4       19.6     0.0     0.0 
1 1 1   19   19   59 o    207.9    6.8  434.1947  28.0950   434.1947  28.0950   434.1947  28.0950      207.9      6.8      207.9        6.8     0.0     0.0 
1 1 1   19   19   60 o    308.6    5.0  953.9513  30.6490   953.9513  30.6490   953.9513  30.6490      308.6      5.0      308.6        5.0     0.0     0.0 
1 1 1   19   19   61 o     40.7   22.6   23.6253  26.8179    23.6253  26.8179    23.6253  26.8179       40.7     22.6       40.7       22.6     0.0     0.0 
1 1 1   19   19   62 o    142.3    9.7  206.2425  27.4564   206.2425  27.4564   206.2425  27.4564      142.3      9.7      142.3        9.7     0.0     0.0 
1 1 1   19   19   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   19   19   64 o    112.4   12.8  132.1740  28.0950   132.1740  28.0950   132.1740  28.0950      112.4     12.8      112.4       12.8     0.0     0.0 
1 1 1   19   19   65 o     87.5   18.2   86.8389  28.0950    86.8389  28.0950    86.8389  28.0950       87.5     18.2       87.5       18.2     0.0     0.0 
1 1 1   19   19   66 o    266.9    6.0  715.1442  31.9261   715.1442  31.9261   715.1442  31.9261      266.9      6.0      266.9        6.0     0.0     0.0 
1 1 1   19   19   67 f     19.4   14.2  -53.6358  28.7335   -53.6358  28.7335   -53.6358  28.7335       19.4     14.2       19.4       14.2     0.0     0.0 
1 1 1   19   19   68 o    100.5   14.5  105.9946  28.0950   105.9946  28.0950   105.9946  28.0950      100.5     14.5      100.5       14.5     0.0     0.0 
1 1 1   19   19   69 o     59.6   24.8   51.7203  29.3720    51.7203  29.3720    51.7203  29.3720       59.6     24.8       59.6       24.8     0.0     0.0 
1 1 1   19   19   70 o    155.0    9.3  244.5538  28.7335   244.5538  28.7335   244.5538  28.7335      155.0      9.3      155.0        9.3     0.0     0.0 
1 1 1   19   19   71 o    105.0   14.1  118.1265  28.7335   118.1265  28.7335   118.1265  28.7335      105.0     14.1      105.0       14.1     0.0     0.0 
1 1 1   20    0    0 f   2026.4   13.2 41078.0117 533.8041 41078.0117 533.8041 41078.0117 533.8041     2026.4     13.2     2026.4       13.2     0.0     0.0 
1 1 1   20    0    1 o    452.4    2.7 2047.1003  24.2638  2047.1003  24.2638  2047.1003  24.2638      452.4      2.7      452.4        2.7     0.0     0.0 
1 1 1   20    0    2 o    617.9    3.4 3818.9978  41.5039  3818.9978  41.5039  3818.9978  41.5039      617.9      3.4      617.9        3.4     0.0     0.0 
1 1 1   20    0    3 o    685.3    3.6 4696.9648  49.1662  4696.9648  49.1662  4696.9648  49.1662      685.3      3.6      685.3        3.6     0.0     0.0 
1 1 1   20    0    4 o    219.7    2.2  482.7224   9.5778   482.7224   9.5778   482.7224   9.5778      219.7      2.2      219.7        2.2     0.0     0.0 
1 1 1   20    0    5 o    871.7    4.4 7599.6841  75.9841  7599.6841  75.9841  7599.6841  75.9841      871.7      4.4      871.7        4.4     0.0     0.0 
1 1 1   20    0    6 o     96.0    3.3   92.5856   6.3852    92.5856   6.3852    92.5856   6.3852       96.0      3.3       96.0        3.3     0.0     0.0 
1 1 1   20    0    7 o    185.6    2.4  344.8017   8.9393   344.8017   8.9393   344.8017   8.9393      185.6      2.4      185.6        2.4     0.0     0.0 
1 1 1   20    0    8 o    182.0    2.5  331.3927   8.9393   331.3927   8.9393   331.3927   8.9393      182.0      2.5      182.0        2.5     0.0     0.0 
1 1 1   20    0    9 o    613.7    3.3 3766.6392  40.8654  3766.6392  40.8654  3766.6392  40.8654      613.7      3.3      613.7        3.3     0.0     0.0 
1 1 1   20    0   10 o    492.0    2.8 2420.6355  27.4564  2420.6355  27.4564  2420.6355  27.4564      492.0      2.8      492.0        2.8     0.0     0.0 
1 1 1   20    0   11 o   1358.3    6.4 18453.2754 174.9549 18453.2754 174.9549 18453.2754 174.9549     1358.3      6.4     1358.3        6.4     0.0     0.0 
1 1 1   20    0   12 o    595.8    3.2 3550.1802  38.3113  3550.1802  38.3113  3550.1802  38.3113      595.8      3.2      595.8        3.2     0.0     0.0 
1 1 1   20    0   13 o    619.3    3.5 3835.5996  43.4195  3835.5996  43.4195  3835.5996  43.4195      619.3      3.5      619.3        3.5     0.0     0.0 
1 1 1   20    0   14 o   1067.8    5.2 11403.3574 111.1028 11403.3574 111.1028 11403.3574 111.1028     1067.8      5.2     1067.8        5.2     0.0     0.0 
1 1 1   20    0   15 o    652.9    3.5 4263.4092  45.9736  4263.4092  45.9736  4263.4092  45.9736      652.9      3.5      652.9        3.5     0.0     0.0 
1 1 1   20    0   16 f    800.5    4.1 6408.8418  66.4062  6408.8418  66.4062  6408.8418  66.4062      800.5      4.1      800.5        4.1     0.0     0.0 
1 1 1   20    0   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    0   18 o      9.5    7.1  -37.0343  10.8549   -37.0343  10.8549   -37.0343  10.8549        9.5      7.1        9.5        7.1     0.0     0.0 
1 1 1   20    0   19 o    403.6    2.6 1628.8687  21.0712  1628.8687  21.0712  1628.8687  21.0712      403.6      2.6      403.6        2.6     0.0     0.0 
1 1 1   20    0   20 o    103.8    5.3  108.5487  10.8549   108.5487  10.8549   108.5487  10.8549      103.8      5.3      103.8        5.3     0.0     0.0 
1 1 1   20    0   21 o    152.9    4.6  234.3374  14.0475   234.3374  14.0475   234.3374  14.0475      152.9      4.6      152.9        4.6     0.0     0.0 
1 1 1   20    0   22 o   1165.2    5.6 13578.8018 130.8969 13578.8018 130.8969 13578.8018 130.8969     1165.2      5.6     1165.2        5.6     0.0     0.0 
1 1 1   20    0   23 o    664.6    3.8 4417.9312  50.4432  4417.9312  50.4432  4417.9312  50.4432      664.6      3.8      664.6        3.8     0.0     0.0 
1 1 1   20    0   24 o   1275.6    7.1 16274.0000 180.7016 16274.0000 180.7016 16274.0000 180.7016     1275.6      7.1     1275.6        7.1     0.0     0.0 
1 1 1   20    0   25 o   1211.8    5.9 14686.6367 143.0288 14686.6367 143.0288 14686.6367 143.0288     1211.8      5.9     1211.8        5.9     0.0     0.0 
1 1 1   20    0   26 o    380.8    3.8 1450.7211  28.7335  1450.7211  28.7335  1450.7211  28.7335      380.8      3.8      380.8        3.8     0.0     0.0 
1 1 1   20    0   27 o    740.3    4.0 5481.7080  59.3825  5481.7080  59.3825  5481.7080  59.3825      740.3      4.0      740.3        4.0     0.0     0.0 
1 1 1   20    0   28 o   1152.9    5.8 13292.7432 134.7281 13292.7432 134.7281 13292.7432 134.7281     1152.9      5.8     1152.9        5.8     0.0     0.0 
1 1 1   20    0   29 o    807.7    4.2 6524.4141  68.3218  6524.4141  68.3218  6524.4141  68.3218      807.7      4.2      807.7        4.2     0.0     0.0 
1 1 1   20    0   30 o    128.7    8.8  167.9312  22.3483   167.9312  22.3483   167.9312  22.3483      128.7      8.8      128.7        8.8     0.0     0.0 
1 1 1   20    0   31 o    729.0    3.9 5315.6924  57.4669  5315.6924  57.4669  5315.6924  57.4669      729.0      3.9      729.0        3.9     0.0     0.0 
1 1 1   20    0   32 o     13.6   10.1  -82.3693  22.9868   -82.3693  22.9868   -82.3693  22.9868       13.6     10.1       13.6       10.1     0.0     0.0 
1 1 1   20    0   33 o    225.7    4.8  510.1788  21.7097   510.1788  21.7097   510.1788  21.7097      225.7      4.8      225.7        4.8     0.0     0.0 
1 1 1   20    0   34 o    296.9    4.0  881.7984  23.6253   881.7984  23.6253   881.7984  23.6253      296.9      4.0      296.9        4.0     0.0     0.0 
1 1 1   20    0   35 o    367.7    3.5 1352.3888  25.5409  1352.3888  25.5409  1352.3888  25.5409      367.7      3.5      367.7        3.5     0.0     0.0 
1 1 1   20    0   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    0   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    0   38 o    422.4    3.9 1784.6680  32.5646  1784.6680  32.5646  1784.6680  32.5646      422.4      3.9      422.4        3.9     0.0     0.0 
1 1 1   20    0   39 o    653.2    4.2 4267.8789  54.9129  4267.8789  54.9129  4267.8789  54.9129      653.2      4.2      653.2        4.2     0.0     0.0 
1 1 1   20    0   40 o   1128.2    5.8 12730.2051 130.8969 12730.2051 130.8969 12730.2051 130.8969     1128.2      5.8     1128.2        5.8     0.0     0.0 
1 1 1   20    0   41 o     25.9   17.8  -15.9630  28.0950   -15.9630  28.0950   -15.9630  28.0950       25.9     17.8       25.9       17.8     0.0     0.0 
1 1 1   20    0   42 o    199.9    7.9  401.6301  31.2876   401.6301  31.2876   401.6301  31.2876      199.9      7.9      199.9        7.9     0.0     0.0 
1 1 1   20    0   43 o    577.0    4.2 3330.5286  48.5276  3330.5286  48.5276  3330.5286  48.5276      577.0      4.2      577.0        4.2     0.0     0.0 
1 1 1   20    0   44 o    269.7    4.9  727.9147  26.1794   727.9147  26.1794   727.9147  26.1794      269.7      4.9      269.7        4.9     0.0     0.0 
1 1 1   20    0   45 o    873.4    4.8 7629.0566  84.2849  7629.0566  84.2849  7629.0566  84.2849      873.4      4.8      873.4        4.8     0.0     0.0 
1 1 1   20    0   46 o    213.5    6.3  457.1815  26.8179   457.1815  26.8179   457.1815  26.8179      213.5      6.3      213.5        6.3     0.0     0.0 
1 1 1   20    0   47 o    770.7    4.2 5941.4438  65.1292  5941.4438  65.1292  5941.4438  65.1292      770.7      4.2      770.7        4.2     0.0     0.0 
1 1 1   20    0   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    0   49 o    110.1   12.1  125.7888  26.1794   125.7888  26.1794   125.7888  26.1794      110.1     12.1      110.1       12.1     0.0     0.0 
1 1 1   20    0   50 o    298.0    5.5  889.4606  32.5646   889.4606  32.5646   889.4606  32.5646      298.0      5.5      298.0        5.5     0.0     0.0 
1 1 1   20    0   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    0   52 o    939.4    4.9 8826.9229  91.3086  8826.9229  91.3086  8826.9229  91.3086      939.4      4.9      939.4        4.9     0.0     0.0 
1 1 1   20    0   53 o    108.3   14.6  123.8732  30.6490   123.8732  30.6490   123.8732  30.6490      108.3     14.6      108.3       14.6     0.0     0.0 
1 1 1   20    0   54 o    307.8    5.0  948.2046  30.6490   948.2046  30.6490   948.2046  30.6490      307.8      5.0      307.8        5.0     0.0     0.0 
1 1 1   20    0   55 o    454.2    4.0 2063.7019  36.3957  2063.7019  36.3957  2063.7019  36.3957      454.2      4.0      454.2        4.0     0.0     0.0 
1 1 1   20    0   56 o    814.3    4.4 6633.6016  71.5144  6633.6016  71.5144  6633.6016  71.5144      814.3      4.4      814.3        4.4     0.0     0.0 
1 1 1   20    0   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    0   58 o    514.5    3.8 2647.9492  38.9498  2647.9492  38.9498  2647.9492  38.9498      514.5      3.8      514.5        3.8     0.0     0.0 
1 1 1   20    0   59 o    367.9    4.4 1354.3044  32.5646  1354.3044  32.5646  1354.3044  32.5646      367.9      4.4      367.9        4.4     0.0     0.0 
1 1 1   20    0   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    0   61 o     20.4   14.7  -36.3957  26.1794   -36.3957  26.1794   -36.3957  26.1794       20.4     14.7       20.4       14.7     0.0     0.0 
1 1 1   20    0   62 o    353.6    4.4 1251.5024  31.2876  1251.5024  31.2876  1251.5024  31.2876      353.6      4.4      353.6        4.4     0.0     0.0 
1 1 1   20    0   63 o    194.1    7.1  378.6433  27.4564   378.6433  27.4564   378.6433  27.4564      194.1      7.1      194.1        7.1     0.0     0.0 
1 1 1   20    0   64 o    180.1    6.8  326.2845  24.2638   326.2845  24.2638   326.2845  24.2638      180.1      6.8      180.1        6.8     0.0     0.0 
1 1 1   20    0   65 o     25.5   17.6  -18.5171  28.7335   -18.5171  28.7335   -18.5171  28.7335       25.5     17.6       25.5       17.6     0.0     0.0 
1 1 1   20    0   66 o     16.1   12.0  -84.9234  28.0950   -84.9234  28.0950   -84.9234  28.0950       16.1     12.0       16.1       12.0     0.0     0.0 
1 1 1   20    0   67 o    261.1    6.1  683.8566  31.9261   683.8566  31.9261   683.8566  31.9261      261.1      6.1      261.1        6.1     0.0     0.0 
1 1 1   20    0   68 o    304.7    5.5  930.3260  33.2031   930.3260  33.2031   930.3260  33.2031      304.7      5.5      304.7        5.5     0.0     0.0 
1 1 1   20    0   69 o    206.4    7.0  428.4480  28.7335   428.4480  28.7335   428.4480  28.7335      206.4      7.0      206.4        7.0     0.0     0.0 
1 1 1   20    0   70 o     93.9   17.8   97.6938  30.0105    97.6938  30.0105    97.6938  30.0105       93.9     17.8       93.9       17.8     0.0     0.0 
1 1 1   20    0   71 o    184.7    8.3  344.1632  30.6490   344.1632  30.6490   344.1632  30.6490      184.7      8.3      184.7        8.3     0.0     0.0 
1 1 1   20    0   72 o     24.0   16.9  -28.7335  30.0105   -28.7335  30.0105   -28.7335  30.0105       24.0     16.9       24.0       16.9     0.0     0.0 
1 1 1   20    0   73 o     90.3   18.9   92.5856  30.0105    92.5856  30.0105    92.5856  30.0105       90.3     18.9       90.3       18.9     0.0     0.0 
1 1 1   20    0   74 o     22.5   16.0  -30.6490  28.0950   -30.6490  28.0950   -30.6490  28.0950       22.5     16.0       22.5       16.0     0.0     0.0 
1 1 1   20    0   75 o    102.6   13.9  109.1872  28.0950   109.1872  28.0950   109.1872  28.0950      102.6     13.9      102.6       13.9     0.0     0.0 
1 1 1   20    0   76 o    102.3   15.4  111.1028  30.0105   111.1028  30.0105   111.1028  30.0105      102.3     15.4      102.3       15.4     0.0     0.0 
1 1 1   20    0   77 o     18.8   13.9  -67.6833  30.6490   -67.6833  30.6490   -67.6833  30.6490       18.8     13.9       18.8       13.9     0.0     0.0 
1 1 1   20    0   78 o     33.5   21.5    5.7467  31.2876     5.7467  31.2876     5.7467  31.2876       33.5     21.5       33.5       21.5     0.0     0.0 
1 1 1   20    1    0 o    108.9    2.9  118.7650   6.3852   118.7650   6.3852   118.7650   6.3852      108.9      2.9      108.9        2.9     0.0     0.0 
1 1 1   20    1    1 o    516.1    2.1    0.0000   0.0000          ?        ?  2663.9124  21.7097          ?        ?      516.1        2.1       ?       ? 
1 1 1   20    1    2 o    462.4    1.9    0.0000   0.0000          ?        ?  2137.7703  17.8786          ?        ?      462.4        1.9       ?       ? 
1 1 1   20    1    3 o   1408.6    4.7    0.0000   0.0000          ?        ? 19843.3359 132.8125          ?        ?     1408.6        4.7       ?       ? 
1 1 1   20    1    4 o    694.0    2.6    0.0000   0.0000          ?        ?  4817.0073  35.7572          ?        ?      694.0        2.6       ?       ? 
1 1 1   20    1    5 o   1164.0    4.0    0.0000   0.0000          ?        ? 13550.0684  92.5856          ?        ?     1164.0        4.0       ?       ? 
1 1 1   20    1    6 o    991.0    3.4    0.0000   0.0000          ?        ?  9820.4629  68.3218          ?        ?      991.0        3.4       ?       ? 
1 1 1   20    1    7 o   1214.4    4.1    0.0000   0.0000          ?        ? 14748.5732 100.2479          ?        ?     1214.4        4.1       ?       ? 
1 1 1   20    1    8 o    573.2    2.2    0.0000   0.0000          ?        ?  3285.8320  25.5409          ?        ?      573.2        2.2       ?       ? 
1 1 1   20    1    9 o    460.9    1.9    0.0000   0.0000          ?        ?  2124.3616  17.2401          ?        ?      460.9        1.9       ?       ? 
1 1 1   20    1   10 o   1051.4    3.6    0.0000   0.0000          ?        ? 11054.7256  75.9841          ?        ?     1051.4        3.6       ?       ? 
1 1 1   20    1   11 o   1241.0    4.2    0.0000   0.0000          ?        ? 15401.1416 104.0790          ?        ?     1241.0        4.2       ?       ? 
1 1 1   20    1   12 o    222.7    1.7    0.0000   0.0000          ?        ?   496.1313   7.6623          ?        ?      222.7        1.7       ?       ? 
1 1 1   20    1   13 o   1735.5    5.7    0.0000   0.0000          ?        ? 30124.1719 197.3032          ?        ?     1735.5        5.7       ?       ? 
1 1 1   20    1   14 o   1199.0    4.1    0.0000   0.0000          ?        ? 14378.2305  97.6938          ?        ?     1199.0        4.1       ?       ? 
1 1 1   20    1   15 o    608.8    2.5    0.0000   0.0000          ?        ?  3705.9797  30.0105          ?        ?      608.8        2.5       ?       ? 
1 1 1   20    1   16 o   1700.0    5.6    0.0000   0.0000          ?        ? 28904.5957 190.2794          ?        ?     1700.0        5.6       ?       ? 
1 1 1   20    1   17 o   1145.5    3.9    0.0000   0.0000          ?        ? 13123.5352  90.0316          ?        ?     1145.5        3.9       ?       ? 
1 1 1   20    1   18 o    838.8    3.0    0.0000   0.0000          ?        ?  7036.5083  51.0817          ?        ?      838.8        3.0       ?       ? 
1 1 1   20    1   19 o    412.6    1.9    0.0000   0.0000          ?        ?  1702.2987  15.9630          ?        ?      412.6        1.9       ?       ? 
1 1 1   20    1   20 f    371.9    2.1    0.0000   0.0000          ?        ?  1383.0378  15.9630          ?        ?      371.9        2.1       ?       ? 
1 1 1   20    1   21 o    822.5    3.0    0.0000   0.0000          ?        ?  6764.4980  49.8047          ?        ?      822.5        3.0       ?       ? 
1 1 1   20    1   22 o    650.3    2.6    0.0000   0.0000          ?        ?  4228.9287  33.2031          ?        ?      650.3        2.6       ?       ? 
1 1 1   20    1   23 o   1147.5    4.1    0.0000   0.0000          ?        ? 13167.5928  93.2242          ?        ?     1147.5        4.1       ?       ? 
1 1 1   20    1   24 o   1026.0    3.8    0.0000   0.0000          ?        ? 10527.3057  77.8996          ?        ?     1026.0        3.8       ?       ? 
1 1 1   20    1   25 o   1337.1    4.5    0.0000   0.0000          ?        ? 17879.8828 121.3191          ?        ?     1337.1        4.5       ?       ? 
1 1 1   20    1   26 f   1195.2    4.3    0.0000   0.0000          ?        ? 14285.0059 102.1635          ?        ?     1195.2        4.3       ?       ? 
1 1 1   20    1   27 o    907.3    3.5    0.0000   0.0000          ?        ?  8231.8203  63.2136          ?        ?      907.3        3.5       ?       ? 
1 1 1   20    1   28 o   1423.0    4.8    0.0000   0.0000          ?        ? 20251.3516 137.9207          ?        ?     1423.0        4.8       ?       ? 
1 1 1   20    1   29 o    618.3    2.6    0.0000   0.0000          ?        ?  3823.4675  32.5646          ?        ?      618.3        2.6       ?       ? 
1 1 1   20    1   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    1   31 o   1735.1    5.8    0.0000   0.0000          ?        ? 30110.7656 201.7728          ?        ?     1735.1        5.8       ?       ? 
1 1 1   20    1   32 o   1549.6    5.5    0.0000   0.0000          ?        ? 24014.7988 170.4853          ?        ?     1549.6        5.5       ?       ? 
1 1 1   20    1   33 o    806.8    3.1    0.0000   0.0000          ?        ?  6509.0898  49.8047          ?        ?      806.8        3.1       ?       ? 
1 1 1   20    1   34 o    357.6    2.8    0.0000   0.0000          ?        ?  1278.9589  19.7942          ?        ?      357.6        2.8       ?       ? 
1 1 1   20    1   35 o    802.8    3.1    0.0000   0.0000          ?        ?  6444.5986  49.1662          ?        ?      802.8        3.1       ?       ? 
1 1 1   20    1   36 o    702.7    2.9    0.0000   0.0000          ?        ?  4937.6875  40.8654          ?        ?      702.7        2.9       ?       ? 
1 1 1   20    1   37 o    781.7    3.0    0.0000   0.0000          ?        ?  6111.2905  47.2506          ?        ?      781.7        3.0       ?       ? 
1 1 1   20    1   38 o   1215.6    4.3    0.0000   0.0000          ?        ? 14778.5830 104.0790          ?        ?     1215.6        4.3       ?       ? 
1 1 1   20    1   39 o   1735.4    5.7    0.0000   0.0000          ?        ? 30122.2578 197.9417          ?        ?     1735.4        5.7       ?       ? 
1 1 1   20    1   40 o    309.6    3.5    0.0000   0.0000          ?        ?   958.4210  21.7097          ?        ?      309.6        3.5       ?       ? 
1 1 1   20    1   41 o    550.2    2.6    0.0000   0.0000          ?        ?  3027.2310  28.7335          ?        ?      550.2        2.6       ?       ? 
1 1 1   20    1   42 o    665.1    2.8    0.0000   0.0000          ?        ?  4423.6777  37.0343          ?        ?      665.1        2.8       ?       ? 
1 1 1   20    1   43 o    684.2    2.9    0.0000   0.0000          ?        ?  4682.2788  40.2269          ?        ?      684.2        2.9       ?       ? 
1 1 1   20    1   44 o    355.1    2.9    0.0000   0.0000          ?        ?  1261.0802  20.4327          ?        ?      355.1        2.9       ?       ? 
1 1 1   20    1   45 o    529.9    2.8    0.0000   0.0000          ?        ?  2808.2180  29.3720          ?        ?      529.9        2.8       ?       ? 
1 1 1   20    1   46 o    403.7    2.8    0.0000   0.0000          ?        ?  1629.5072  22.9868          ?        ?      403.7        2.8       ?       ? 
1 1 1   20    1   47 o    640.0    2.8    0.0000   0.0000          ?        ?  4096.7544  35.7572          ?        ?      640.0        2.8       ?       ? 
1 1 1   20    1   48 o    841.0    3.3    0.0000   0.0000          ?        ?  7073.5430  54.9129          ?        ?      841.0        3.3       ?       ? 
1 1 1   20    1   49 o    813.5    3.1    0.0000   0.0000          ?        ?  6618.9150  51.0817          ?        ?      813.5        3.1       ?       ? 
1 1 1   20    1   50 o    370.1    3.0    0.0000   0.0000          ?        ?  1369.6289  22.3483          ?        ?      370.1        3.0       ?       ? 
1 1 1   20    1   51 o    793.7    3.1    0.0000   0.0000          ?        ?  6300.2930  48.5276          ?        ?      793.7        3.1       ?       ? 
1 1 1   20    1   52 o    700.5    3.0    0.0000   0.0000          ?        ?  4907.6772  41.5039          ?        ?      700.5        3.0       ?       ? 
1 1 1   20    1   53 o    378.5    2.9    0.0000   0.0000          ?        ?  1432.8425  21.7097          ?        ?      378.5        2.9       ?       ? 
1 1 1   20    1   54 o    268.4    3.7    0.0000   0.0000          ?        ?   720.8909  19.7942          ?        ?      268.4        3.7       ?       ? 
1 1 1   20    1   55 o    426.0    2.8    0.0000   0.0000          ?        ?  1815.3169  23.6253          ?        ?      426.0        2.8       ?       ? 
1 1 1   20    1   56 o    429.9    2.7    0.0000   0.0000          ?        ?  1848.5201  23.6253          ?        ?      429.9        2.7       ?       ? 
1 1 1   20    1   57 o    347.8    3.0    0.0000   0.0000          ?        ?  1209.9985  21.0712          ?        ?      347.8        3.0       ?       ? 
1 1 1   20    1   58 f    277.4    3.5    0.0000   0.0000          ?        ?   770.0571  19.1556          ?        ?      277.4        3.5       ?       ? 
1 1 1   20    1   59 o    131.9    7.0    0.0000   0.0000          ?        ?   174.3164  18.5171          ?        ?      131.9        7.0       ?       ? 
1 1 1   20    1   60 o    431.4    2.8    0.0000   0.0000          ?        ?  1861.2905  24.2638          ?        ?      431.4        2.8       ?       ? 
1 1 1   20    1   61 o    208.7    4.4    0.0000   0.0000          ?        ?   436.1103  18.5171          ?        ?      208.7        4.4       ?       ? 
1 1 1   20    1   62 o    273.7    3.7    0.0000   0.0000          ?        ?   749.6244  20.4327          ?        ?      273.7        3.7       ?       ? 
1 1 1   20    1   63 o     34.8   14.9    0.0000   0.0000          ?        ?    -0.6385  18.5171          ?        ?       34.8       14.9       ?       ? 
1 1 1   20    1   64 f    113.6    8.7    0.0000   0.0000          ?        ?   129.6199  19.7942          ?        ?      113.6        8.7       ?       ? 
1 1 1   20    1   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    1   66 o    166.7    6.1    0.0000   0.0000          ?        ?   278.3954  20.4327          ?        ?      166.7        6.1       ?       ? 
1 1 1   20    1   67 o    491.2    2.9    0.0000   0.0000          ?        ?  2414.2502  28.0950          ?        ?      491.2        2.9       ?       ? 
1 1 1   20    1   68 o    178.8    6.1    0.0000   0.0000          ?        ?   320.5379  21.7097          ?        ?      178.8        6.1       ?       ? 
1 1 1   20    1   69 o    170.2    6.0    0.0000   0.0000          ?        ?   290.5273  20.4327          ?        ?      170.2        6.0       ?       ? 
1 1 1   20    1   70 o     21.1   10.7    0.0000   0.0000          ?        ?   -72.7915  21.7097          ?        ?       21.1       10.7       ?       ? 
1 1 1   20    1   71 o    140.1    7.3    0.0000   0.0000          ?        ?   197.3032  20.4327          ?        ?      140.1        7.3       ?       ? 
1 1 1   20    1   72 o     80.0   13.2    0.0000   0.0000          ?        ?    65.1292  21.0712          ?        ?       80.0       13.2       ?       ? 
1 1 1   20    1   73 o    149.5    7.0    0.0000   0.0000          ?        ?   224.7596  21.0712          ?        ?      149.5        7.0       ?       ? 
1 1 1   20    1   74 o     83.7   13.4    0.0000   0.0000          ?        ?    71.5144  22.3483          ?        ?       83.7       13.4       ?       ? 
1 1 1   20    1   75 o    139.9    7.5    0.0000   0.0000          ?        ?   197.3032  21.0712          ?        ?      139.9        7.5       ?       ? 
1 1 1   20    1   76 o    237.9    5.0    0.0000   0.0000          ?        ?   568.2842  23.6253          ?        ?      237.9        5.0       ?       ? 
1 1 1   20    1   77 o     48.6   16.8    0.0000   0.0000          ?        ?    22.9868  19.7942          ?        ?       48.6       16.8       ?       ? 
1 1 1   20    1   78 o    289.6    3.7    0.0000   0.0000          ?        ?   840.9330  21.7097          ?        ?      289.6        3.7       ?       ? 
1 1 1   20    2    0 o   1511.0    7.1 22836.0859 215.8203 22836.0859 215.8203 22836.0859 215.8203     1511.0      7.1     1511.0        7.1     0.0     0.0 
1 1 1   20    2    1 o    870.1    3.1    0.0000   0.0000          ?        ?  7570.3120  54.2743          ?        ?      870.1        3.1       ?       ? 
1 1 1   20    2    2 o    904.2    3.2    0.0000   0.0000          ?        ?  8176.2695  57.4669          ?        ?      904.2        3.2       ?       ? 
1 1 1   20    2    3 o    671.8    2.5    0.0000   0.0000          ?        ?  4513.7095  33.8416          ?        ?      671.8        2.5       ?       ? 
1 1 1   20    2    4 f    962.1    3.4    0.0000   0.0000          ?        ?  9257.2871  64.4907          ?        ?      962.1        3.4       ?       ? 
1 1 1   20    2    5 o    242.8    1.6    0.0000   0.0000          ?        ?   589.3555   7.6623          ?        ?      242.8        1.6       ?       ? 
1 1 1   20    2    6 o    409.7    1.9    0.0000   0.0000          ?        ?  1678.6733  15.3245          ?        ?      409.7        1.9       ?       ? 
1 1 1   20    2    7 f     41.5    6.2    0.0000   0.0000          ?        ?    17.2401   5.1082          ?        ?       41.5        6.2       ?       ? 
1 1 1   20    2    8 o   1928.5    6.3    0.0000   0.0000          ?        ? 37199.6289 241.3612          ?        ?     1928.5        6.3       ?       ? 
1 1 1   20    2    9 o    948.7    3.3    0.0000   0.0000          ?        ?  9000.6006  63.2136          ?        ?      948.7        3.3       ?       ? 
1 1 1   20    2   10 o   1624.9    5.4    0.0000   0.0000          ?        ? 26406.7012 174.3164          ?        ?     1624.9        5.4       ?       ? 
1 1 1   20    2   11 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    2   12 o    985.4    3.5    0.0000   0.0000          ?        ?  9710.6377  68.3218          ?        ?      985.4        3.5       ?       ? 
1 1 1   20    2   13 o    470.4    2.0    0.0000   0.0000          ?        ?  2213.1160  19.1556          ?        ?      470.4        2.0       ?       ? 
1 1 1   20    2   14 o    907.7    3.2    0.0000   0.0000          ?        ?  8239.4834  58.7440          ?        ?      907.7        3.2       ?       ? 
1 1 1   20    2   15 o   1091.8    3.7    0.0000   0.0000          ?        ? 11921.1992  81.7308          ?        ?     1091.8        3.7       ?       ? 
1 1 1   20    2   16 o    371.5    1.8    0.0000   0.0000          ?        ?  1380.4838  13.4090          ?        ?      371.5        1.8       ?       ? 
1 1 1   20    2   17 o    440.2    2.0    0.0000   0.0000          ?        ?  1937.9131  17.2401          ?        ?      440.2        2.0       ?       ? 
1 1 1   20    2   18 o    831.4    3.0    0.0000   0.0000          ?        ?  6912.6348  50.4432          ?        ?      831.4        3.0       ?       ? 
1 1 1   20    2   19 o    460.6    2.3    0.0000   0.0000          ?        ?  2121.1689  21.0712          ?        ?      460.6        2.3       ?       ? 
1 1 1   20    2   20 o    754.4    2.9    0.0000   0.0000          ?        ?  5691.7817  43.4195          ?        ?      754.4        2.9       ?       ? 
1 1 1   20    2   21 o   2097.5    6.8    0.0000   0.0000          ?        ? 44003.0781 286.0577          ?        ?     2097.5        6.8       ?       ? 
1 1 1   20    2   22 o    508.8    2.3    0.0000   0.0000          ?        ?  2589.2051  23.6253          ?        ?      508.8        2.3       ?       ? 
1 1 1   20    2   23 o    575.1    2.6    0.0000   0.0000          ?        ?  3307.5420  30.0105          ?        ?      575.1        2.6       ?       ? 
1 1 1   20    2   24 o    357.5    2.3    0.0000   0.0000          ?        ?  1278.3203  16.6016          ?        ?      357.5        2.3       ?       ? 
1 1 1   20    2   25 o   2242.6    7.2    0.0000   0.0000          ?        ? 50301.4570 325.0075          ?        ?     2242.6        7.2       ?       ? 
1 1 1   20    2   26 f    694.3    2.7    0.0000   0.0000          ?        ?  4820.1997  37.0343          ?        ?      694.3        2.7       ?       ? 
1 1 1   20    2   27 o   1716.7    5.6    0.0000   0.0000          ?        ? 29473.5195 192.1950          ?        ?     1716.7        5.6       ?       ? 
1 1 1   20    2   28 o    536.7    2.4    0.0000   0.0000          ?        ?  2881.0098  26.1794          ?        ?      536.7        2.4       ?       ? 
1 1 1   20    2   29 o   1718.0    5.8    0.0000   0.0000          ?        ? 29517.5762 197.9417          ?        ?     1718.0        5.8       ?       ? 
1 1 1   20    2   30 o    959.7    3.6    0.0000   0.0000          ?        ?  9211.3125  68.9603          ?        ?      959.7        3.6       ?       ? 
1 1 1   20    2   31 o   1178.4    4.4    0.0000   0.0000          ?        ? 13887.2061 104.7175          ?        ?     1178.4        4.4       ?       ? 
1 1 1   20    2   32 o    135.6    5.7    0.0000   0.0000          ?        ?   183.8942  15.3245          ?        ?      135.6        5.7       ?       ? 
1 1 1   20    2   33 o    146.2    5.0    0.0000   0.0000          ?        ?   213.9047  14.6860          ?        ?      146.2        5.0       ?       ? 
1 1 1   20    2   34 o    480.4    2.5    0.0000   0.0000          ?        ?  2307.6172  23.6253          ?        ?      480.4        2.5       ?       ? 
1 1 1   20    2   35 o   1047.4    3.7    0.0000   0.0000          ?        ? 10970.4395  78.5382          ?        ?     1047.4        3.7       ?       ? 
1 1 1   20    2   36 o    685.7    3.0    0.0000   0.0000          ?        ?  4701.4346  40.8654          ?        ?      685.7        3.0       ?       ? 
1 1 1   20    2   37 o   1244.4    4.3    0.0000   0.0000          ?        ? 15487.9814 107.9102          ?        ?     1244.4        4.3       ?       ? 
1 1 1   20    2   38 o    808.8    3.0    0.0000   0.0000          ?        ?  6542.2925  49.1662          ?        ?      808.8        3.0       ?       ? 
1 1 1   20    2   39 o    222.9    4.2    0.0000   0.0000          ?        ?   496.7698  18.5171          ?        ?      222.9        4.2       ?       ? 
1 1 1   20    2   40 f    695.2    2.9    0.0000   0.0000          ?        ?  4833.6089  40.2269          ?        ?      695.2        2.9       ?       ? 
1 1 1   20    2   41 o    131.5    6.8    0.0000   0.0000          ?        ?   173.0394  17.8786          ?        ?      131.5        6.8       ?       ? 
1 1 1   20    2   42 o    158.2    5.9    0.0000   0.0000          ?        ?   250.3005  18.5171          ?        ?      158.2        5.9       ?       ? 
1 1 1   20    2   43 o    823.3    3.1    0.0000   0.0000          ?        ?  6778.5454  51.0817          ?        ?      823.3        3.1       ?       ? 
1 1 1   20    2   44 o    402.0    3.1    0.0000   0.0000          ?        ?  1616.0983  24.9023          ?        ?      402.0        3.1       ?       ? 
1 1 1   20    2   45 o    405.9    2.8    0.0000   0.0000          ?        ?  1648.0244  22.9868          ?        ?      405.9        2.8       ?       ? 
1 1 1   20    2   46 o    780.2    3.0    0.0000   0.0000          ?        ?  6087.6655  47.2506          ?        ?      780.2        3.0       ?       ? 
1 1 1   20    2   47 o    298.5    3.1    0.0000   0.0000          ?        ?   891.3762  18.5171          ?        ?      298.5        3.1       ?       ? 
1 1 1   20    2   48 o    542.7    2.6    0.0000   0.0000          ?        ?  2945.5002  28.7335          ?        ?      542.7        2.6       ?       ? 
1 1 1   20    2   49 o    207.9    5.2    0.0000   0.0000          ?        ?   432.2791  21.7097          ?        ?      207.9        5.2       ?       ? 
1 1 1   20    2   50 o    108.9    8.8    0.0000   0.0000          ?        ?   118.7650  19.1556          ?        ?      108.9        8.8       ?       ? 
1 1 1   20    2   51 o    709.5    3.0    0.0000   0.0000          ?        ?  5035.3813  42.1424          ?        ?      709.5        3.0       ?       ? 
1 1 1   20    2   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    2   53 f    391.7    2.9    0.0000   0.0000          ?        ?  1534.3674  22.3483          ?        ?      391.7        2.9       ?       ? 
1 1 1   20    2   54 o    232.4    4.1    0.0000   0.0000          ?        ?   540.1893  19.1556          ?        ?      232.4        4.1       ?       ? 
1 1 1   20    2   55 f     88.1   10.9    0.0000   0.0000          ?        ?    77.8996  19.1556          ?        ?       88.1       10.9       ?       ? 
1 1 1   20    2   56 o    263.0    3.8    0.0000   0.0000          ?        ?   692.1575  19.7942          ?        ?      263.0        3.8       ?       ? 
1 1 1   20    2   57 o    216.0    4.4    0.0000   0.0000          ?        ?   466.7593  19.1556          ?        ?      216.0        4.4       ?       ? 
1 1 1   20    2   58 o    442.5    2.7    0.0000   0.0000          ?        ?  1958.9843  24.2638          ?        ?      442.5        2.7       ?       ? 
1 1 1   20    2   59 o     62.4   14.6    0.0000   0.0000          ?        ?    40.8654  17.8786          ?        ?       62.4       14.6       ?       ? 
1 1 1   20    2   60 o    184.0    5.2    0.0000   0.0000          ?        ?   339.0550  19.1556          ?        ?      184.0        5.2       ?       ? 
1 1 1   20    2   61 o    511.3    2.8    0.0000   0.0000          ?        ?  2615.3845  28.7335          ?        ?      511.3        2.8       ?       ? 
1 1 1   20    2   62 o    253.2    3.9    0.0000   0.0000          ?        ?   641.7142  19.7942          ?        ?      253.2        3.9       ?       ? 
1 1 1   20    2   63 o     36.0   15.3    0.0000   0.0000          ?        ?     0.6385  19.1556          ?        ?       36.0       15.3       ?       ? 
1 1 1   20    2   64 o    282.3    3.6    0.0000   0.0000          ?        ?   797.5135  20.4327          ?        ?      282.3        3.6       ?       ? 
1 1 1   20    2   65 o    205.9    5.1    0.0000   0.0000          ?        ?   424.6169  21.0712          ?        ?      205.9        5.1       ?       ? 
1 1 1   20    2   66 o    367.1    3.3    0.0000   0.0000          ?        ?  1348.5576  24.2638          ?        ?      367.1        3.3       ?       ? 
1 1 1   20    2   67 o    127.8    8.2    0.0000   0.0000          ?        ?   164.1001  21.0712          ?        ?      127.8        8.2       ?       ? 
1 1 1   20    2   68 o     26.0   12.7    0.0000   0.0000          ?        ?   -37.0343  21.0712          ?        ?       26.0       12.7       ?       ? 
1 1 1   20    2   69 o    213.6    5.1    0.0000   0.0000          ?        ?   457.1815  21.7097          ?        ?      213.6        5.1       ?       ? 
1 1 1   20    2   70 o     86.9   13.2    0.0000   0.0000          ?        ?    76.6226  22.9868          ?        ?       86.9       13.2       ?       ? 
1 1 1   20    2   71 o    146.3    7.2    0.0000   0.0000          ?        ?   215.1818  21.0712          ?        ?      146.3        7.2       ?       ? 
1 1 1   20    2   72 o    142.1    7.4    0.0000   0.0000          ?        ?   203.0499  21.0712          ?        ?      142.1        7.4       ?       ? 
1 1 1   20    2   73 o     55.1   17.2    0.0000   0.0000          ?        ?    31.2876  21.0712          ?        ?       55.1       17.2       ?       ? 
1 1 1   20    2   74 o    129.8    8.4    0.0000   0.0000          ?        ?   169.8468  21.7097          ?        ?      129.8        8.4       ?       ? 
1 1 1   20    2   75 o     28.5   13.6    0.0000   0.0000          ?        ?   -25.5409  21.0712          ?        ?       28.5       13.6       ?       ? 
1 1 1   20    2   76 o     55.7   17.5    0.0000   0.0000          ?        ?    32.5646  21.7097          ?        ?       55.7       17.5       ?       ? 
1 1 1   20    2   77 o     26.1   12.7    0.0000   0.0000          ?        ?   -38.3113  21.7097          ?        ?       26.1       12.7       ?       ? 
1 1 1   20    2   78 o    171.0    6.0    0.0000   0.0000          ?        ?   294.3585  20.4327          ?        ?      171.0        6.0       ?       ? 
1 1 1   20    3    0 o   1917.2    8.9 36767.9883 339.6935 36767.9883 339.6935 36767.9883 339.6935     1917.2      8.9     1917.2        8.9     0.0     0.0 
1 1 1   20    3    1 o    987.8    3.5    0.0000   0.0000          ?        ?  9758.5264  68.3218          ?        ?      987.8        3.5       ?       ? 
1 1 1   20    3    2 o    792.4    2.9    0.0000   0.0000          ?        ?  6278.5830  45.3350          ?        ?      792.4        2.9       ?       ? 
1 1 1   20    3    3 o    946.1    3.3    0.0000   0.0000          ?        ?  8950.7969  63.2136          ?        ?      946.1        3.3       ?       ? 
1 1 1   20    3    4 o    457.8    2.0    0.0000   0.0000          ?        ?  2096.2664  17.8786          ?        ?      457.8        2.0       ?       ? 
1 1 1   20    3    5 o    403.2    1.8    0.0000   0.0000          ?        ?  1625.6761  14.6860          ?        ?      403.2        1.8       ?       ? 
1 1 1   20    3    6 f    702.5    2.6    0.0000   0.0000          ?        ?  4935.7720  36.3957          ?        ?      702.5        2.6       ?       ? 
1 1 1   20    3    7 o    811.7    2.9    0.0000   0.0000          ?        ?  6588.9048  47.2506          ?        ?      811.7        2.9       ?       ? 
1 1 1   20    3    8 o    235.4    1.8    0.0000   0.0000          ?        ?   554.2368   8.3008          ?        ?      235.4        1.8       ?       ? 
1 1 1   20    3    9 o    460.9    1.9    0.0000   0.0000          ?        ?  2124.3616  17.8786          ?        ?      460.9        1.9       ?       ? 
1 1 1   20    3   10 o    429.1    2.0    0.0000   0.0000          ?        ?  1841.4963  17.2401          ?        ?      429.1        2.0       ?       ? 
1 1 1   20    3   11 o   1603.0    5.3    0.0000   0.0000          ?        ? 25698.5801 169.8468          ?        ?     1603.0        5.3       ?       ? 
1 1 1   20    3   12 o    626.6    2.4    0.0000   0.0000          ?        ?  3926.2695  30.0105          ?        ?      626.6        2.4       ?       ? 
1 1 1   20    3   13 o    630.7    2.5    0.0000   0.0000          ?        ?  3977.3513  31.2876          ?        ?      630.7        2.5       ?       ? 
1 1 1   20    3   14 o    611.9    2.3    0.0000   0.0000          ?        ?  3744.2910  28.7335          ?        ?      611.9        2.3       ?       ? 
1 1 1   20    3   15 o    334.8    1.9    0.0000   0.0000          ?        ?  1121.2440  12.7704          ?        ?      334.8        1.9       ?       ? 
1 1 1   20    3   16 f    942.0    3.3    0.0000   0.0000          ?        ?  8873.5352  62.5751          ?        ?      942.0        3.3       ?       ? 
1 1 1   20    3   17 o    457.2    2.0    0.0000   0.0000          ?        ?  2090.5198  18.5171          ?        ?      457.2        2.0       ?       ? 
1 1 1   20    3   18 o   1379.0    5.0    0.0000   0.0000          ?        ? 19019.0059 136.6436          ?        ?     1379.0        5.0       ?       ? 
1 1 1   20    3   19 o   1486.5    5.1    0.0000   0.0000          ?        ? 22097.9570 151.3296          ?        ?     1486.5        5.1       ?       ? 
1 1 1   20    3   20 o    663.7    2.5    0.0000   0.0000          ?        ?  4404.5220  33.8416          ?        ?      663.7        2.5       ?       ? 
1 1 1   20    3   21 o   1622.5    5.5    0.0000   0.0000          ?        ? 26326.2461 178.1475          ?        ?     1622.5        5.5       ?       ? 
1 1 1   20    3   22 o   1275.9    4.6    0.0000   0.0000          ?        ? 16279.7480 118.1265          ?        ?     1275.9        4.6       ?       ? 
1 1 1   20    3   23 o   1090.6    3.9    0.0000   0.0000          ?        ? 11895.0195  84.2849          ?        ?     1090.6        3.9       ?       ? 
1 1 1   20    3   24 o   1530.1    5.1    0.0000   0.0000          ?        ? 23415.2266 155.1608          ?        ?     1530.1        5.1       ?       ? 
1 1 1   20    3   25 o   1304.3    4.4    0.0000   0.0000          ?        ? 17012.1328 114.9339          ?        ?     1304.3        4.4       ?       ? 
1 1 1   20    3   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    3   27 o   1301.7    4.5    0.0000   0.0000          ?        ? 16944.4473 116.8494          ?        ?     1301.7        4.5       ?       ? 
1 1 1   20    3   28 o    627.6    2.7    0.0000   0.0000          ?        ?  3938.4014  33.8416          ?        ?      627.6        2.7       ?       ? 
1 1 1   20    3   29 o    814.5    3.1    0.0000   0.0000          ?        ?  6634.2397  51.0817          ?        ?      814.5        3.1       ?       ? 
1 1 1   20    3   30 o    845.9    3.3    0.0000   0.0000          ?        ?  7156.5508  55.5514          ?        ?      845.9        3.3       ?       ? 
1 1 1   20    3   31 o    590.1    2.8    0.0000   0.0000          ?        ?  3481.8584  32.5646          ?        ?      590.1        2.8       ?       ? 
1 1 1   20    3   32 o    770.9    3.1    0.0000   0.0000          ?        ?  5942.7207  47.2506          ?        ?      770.9        3.1       ?       ? 
1 1 1   20    3   33 o    653.2    2.8    0.0000   0.0000          ?        ?  4266.6016  37.0343          ?        ?      653.2        2.8       ?       ? 
1 1 1   20    3   34 o    536.6    2.6    0.0000   0.0000          ?        ?  2879.7324  28.0950          ?        ?      536.6        2.6       ?       ? 
1 1 1   20    3   35 o    619.8    2.9    0.0000   0.0000          ?        ?  3841.9846  35.7572          ?        ?      619.8        2.9       ?       ? 
1 1 1   20    3   36 f   1482.9    5.1    0.0000   0.0000          ?        ? 21993.2383 151.9681          ?        ?     1482.9        5.1       ?       ? 
1 1 1   20    3   37 o    716.0    2.9    0.0000   0.0000          ?        ?  5127.3286  41.5039          ?        ?      716.0        2.9       ?       ? 
1 1 1   20    3   38 o   1138.3    4.0    0.0000   0.0000          ?        ? 12959.4346  90.0316          ?        ?     1138.3        4.0       ?       ? 
1 1 1   20    3   39 o    142.5    6.1    0.0000   0.0000          ?        ?   203.0499  17.2401          ?        ?      142.5        6.1       ?       ? 
1 1 1   20    3   40 o    249.5    3.5    0.0000   0.0000          ?        ?   622.5586  17.2401          ?        ?      249.5        3.5       ?       ? 
1 1 1   20    3   41 o     22.7   11.2    0.0000   0.0000          ?        ?   -38.3113  17.8786          ?        ?       22.7       11.2       ?       ? 
1 1 1   20    3   42 o    442.4    2.8    0.0000   0.0000          ?        ?  1957.0687  24.9023          ?        ?      442.4        2.8       ?       ? 
1 1 1   20    3   43 o   1489.4    5.0    0.0000   0.0000          ?        ? 22188.6270 148.7755          ?        ?     1489.4        5.0       ?       ? 
1 1 1   20    3   44 o    445.5    2.9    0.0000   0.0000          ?        ?  1984.5251  25.5409          ?        ?      445.5        2.9       ?       ? 
1 1 1   20    3   45 o    431.8    2.7    0.0000   0.0000          ?        ?  1864.4832  23.6253          ?        ?      431.8        2.7       ?       ? 
1 1 1   20    3   46 o     64.6   13.8    0.0000   0.0000          ?        ?    43.4195  17.2401          ?        ?       64.6       13.8       ?       ? 
1 1 1   20    3   47 o    517.5    2.8    0.0000   0.0000          ?        ?  2677.9597  28.7335          ?        ?      517.5        2.8       ?       ? 
1 1 1   20    3   48 o    612.9    2.7    0.0000   0.0000          ?        ?  3757.0615  33.2031          ?        ?      612.9        2.7       ?       ? 
1 1 1   20    3   49 o    864.9    3.2    0.0000   0.0000          ?        ?  7482.1968  56.1899          ?        ?      864.9        3.2       ?       ? 
1 1 1   20    3   50 o    515.7    2.7    0.0000   0.0000          ?        ?  2660.0811  27.4564          ?        ?      515.7        2.7       ?       ? 
1 1 1   20    3   51 o    210.9    4.4    0.0000   0.0000          ?        ?   445.0496  18.5171          ?        ?      210.9        4.4       ?       ? 
1 1 1   20    3   52 f     23.8   11.7    0.0000   0.0000          ?        ?   -38.9498  19.1556          ?        ?       23.8       11.7       ?       ? 
1 1 1   20    3   53 o    698.5    2.9    0.0000   0.0000          ?        ?  4879.5825  40.8654          ?        ?      698.5        2.9       ?       ? 
1 1 1   20    3   54 o    164.1    5.6    0.0000   0.0000          ?        ?   269.4561  18.5171          ?        ?      164.1        5.6       ?       ? 
1 1 1   20    3   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    3   56 o    275.6    3.7    0.0000   0.0000          ?        ?   759.8408  20.4327          ?        ?      275.6        3.7       ?       ? 
1 1 1   20    3   57 o    738.9    3.1    0.0000   0.0000          ?        ?  5461.2754  45.3350          ?        ?      738.9        3.1       ?       ? 
1 1 1   20    3   58 o    410.6    2.8    0.0000   0.0000          ?        ?  1686.3357  22.9868          ?        ?      410.6        2.8       ?       ? 
1 1 1   20    3   59 o    305.1    3.2    0.0000   0.0000          ?        ?   930.9645  19.7942          ?        ?      305.1        3.2       ?       ? 
1 1 1   20    3   60 o    322.8    3.4    0.0000   0.0000          ?        ?  1042.7058  21.7097          ?        ?      322.8        3.4       ?       ? 
1 1 1   20    3   61 o    257.2    4.0    0.0000   0.0000          ?        ?   662.1469  20.4327          ?        ?      257.2        4.0       ?       ? 
1 1 1   20    3   62 o    249.0    4.0    0.0000   0.0000          ?        ?   620.6430  19.7942          ?        ?      249.0        4.0       ?       ? 
1 1 1   20    3   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    3   64 o    231.6    4.3    0.0000   0.0000          ?        ?   536.9967  19.7942          ?        ?      231.6        4.3       ?       ? 
1 1 1   20    3   65 o    479.7    2.7    0.0000   0.0000          ?        ?  2302.5090  26.1794          ?        ?      479.7        2.7       ?       ? 
1 1 1   20    3   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    3   67 o    116.8    9.3    0.0000   0.0000          ?        ?   137.2822  21.7097          ?        ?      116.8        9.3       ?       ? 
1 1 1   20    3   68 o    144.0    7.3    0.0000   0.0000          ?        ?   208.1580  21.0712          ?        ?      144.0        7.3       ?       ? 
1 1 1   20    3   69 o    189.3    5.7    0.0000   0.0000          ?        ?   359.4877  21.7097          ?        ?      189.3        5.7       ?       ? 
1 1 1   20    3   70 o    141.5    7.4    0.0000   0.0000          ?        ?   201.1343  21.0712          ?        ?      141.5        7.4       ?       ? 
1 1 1   20    3   71 o    157.8    7.1    0.0000   0.0000          ?        ?   250.3005  22.3483          ?        ?      157.8        7.1       ?       ? 
1 1 1   20    3   72 o     36.4   15.9    0.0000   0.0000          ?        ?    -3.1926  21.7097          ?        ?       36.4       15.9       ?       ? 
1 1 1   20    3   73 o     74.1   14.7    0.0000   0.0000          ?        ?    58.1055  21.0712          ?        ?       74.1       14.7       ?       ? 
1 1 1   20    3   74 o    172.5    6.1    0.0000   0.0000          ?        ?   298.8281  21.0712          ?        ?      172.5        6.1       ?       ? 
1 1 1   20    3   75 f    192.5    5.3    0.0000   0.0000          ?        ?   372.2581  20.4327          ?        ?      192.5        5.3       ?       ? 
1 1 1   20    3   76 o     31.1   14.3    0.0000   0.0000          ?        ?   -14.0475  20.4327          ?        ?       31.1       14.3       ?       ? 
1 1 1   20    3   77 o    177.2    5.8    0.0000   0.0000          ?        ?   316.0682  20.4327          ?        ?      177.2        5.8       ?       ? 
1 1 1   20    3   78 o    114.6    8.9    0.0000   0.0000          ?        ?   133.4510  20.4327          ?        ?      114.6        8.9       ?       ? 
1 1 1   20    4    0 o    385.2    2.6 1483.9242  19.7942  1483.9242  19.7942  1483.9242  19.7942      385.2      2.6      385.2        2.6     0.0     0.0 
1 1 1   20    4    1 o    224.6    1.6    0.0000   0.0000          ?        ?   504.4321   7.0237          ?        ?      224.6        1.6       ?       ? 
1 1 1   20    4    2 o    365.1    1.7    0.0000   0.0000          ?        ?  1333.2332  12.7704          ?        ?      365.1        1.7       ?       ? 
1 1 1   20    4    3 o    701.9    2.6    0.0000   0.0000          ?        ?  4926.8325  37.0343          ?        ?      701.9        2.6       ?       ? 
1 1 1   20    4    4 o   1309.1    4.4    0.0000   0.0000          ?        ? 17139.1973 116.2109          ?        ?     1309.1        4.4       ?       ? 
1 1 1   20    4    5 o    498.0    2.1    0.0000   0.0000          ?        ?  2480.0181  20.4327          ?        ?      498.0        2.1       ?       ? 
1 1 1   20    4    6 o   1438.2    4.8    0.0000   0.0000          ?        ? 20685.5469 138.5592          ?        ?     1438.2        4.8       ?       ? 
1 1 1   20    4    7 o    480.6    2.0    0.0000   0.0000          ?        ?  2309.5327  19.1556          ?        ?      480.6        2.0       ?       ? 
1 1 1   20    4    8 o   1353.2    4.6    0.0000   0.0000          ?        ? 18312.1602 123.2347          ?        ?     1353.2        4.6       ?       ? 
1 1 1   20    4    9 o    369.0    1.8    0.0000   0.0000          ?        ?  1361.3281  13.4090          ?        ?      369.0        1.8       ?       ? 
1 1 1   20    4   10 o    512.2    2.1    0.0000   0.0000          ?        ?  2623.6853  21.7097          ?        ?      512.2        2.1       ?       ? 
1 1 1   20    4   11 o    825.1    3.0    0.0000   0.0000          ?        ?  6807.9175  49.1662          ?        ?      825.1        3.0       ?       ? 
1 1 1   20    4   12 o   1413.0    4.7    0.0000   0.0000          ?        ? 19968.4863 133.4510          ?        ?     1413.0        4.7       ?       ? 
1 1 1   20    4   13 o   1380.5    4.6    0.0000   0.0000          ?        ? 19059.8711 128.3428          ?        ?     1380.5        4.6       ?       ? 
1 1 1   20    4   14 o    765.0    2.8    0.0000   0.0000          ?        ?  5852.6890  42.7809          ?        ?      765.0        2.8       ?       ? 
1 1 1   20    4   15 o    719.2    2.7    0.0000   0.0000          ?        ?  5172.0254  38.3113          ?        ?      719.2        2.7       ?       ? 
1 1 1   20    4   16 o   1254.8    4.2    0.0000   0.0000          ?        ? 15745.3037 105.9946          ?        ?     1254.8        4.2       ?       ? 
1 1 1   20    4   17 o   1023.6    3.7    0.0000   0.0000          ?        ? 10478.7783  76.6226          ?        ?     1023.6        3.7       ?       ? 
1 1 1   20    4   18 o   1195.0    4.3    0.0000   0.0000          ?        ? 14279.8975 102.1635          ?        ?     1195.0        4.3       ?       ? 
1 1 1   20    4   19 o    616.0    2.5    0.0000   0.0000          ?        ?  3794.0957  30.6490          ?        ?      616.0        2.5       ?       ? 
1 1 1   20    4   20 o   1001.5    3.6    0.0000   0.0000          ?        ? 10030.5361  71.5144          ?        ?     1001.5        3.6       ?       ? 
1 1 1   20    4   21 o   1331.6    4.7    0.0000   0.0000          ?        ? 17733.6621 124.5117          ?        ?     1331.6        4.7       ?       ? 
1 1 1   20    4   22 o    853.6    3.3    0.0000   0.0000          ?        ?  7286.8086  56.1899          ?        ?      853.6        3.3       ?       ? 
1 1 1   20    4   23 o    650.8    2.6    0.0000   0.0000          ?        ?  4235.3140  34.4802          ?        ?      650.8        2.6       ?       ? 
1 1 1   20    4   24 o    756.5    2.8    0.0000   0.0000          ?        ?  5723.7080  42.7809          ?        ?      756.5        2.8       ?       ? 
1 1 1   20    4   25 o   1848.7    6.2    0.0000   0.0000          ?        ? 34179.4219 228.5907          ?        ?     1848.7        6.2       ?       ? 
1 1 1   20    4   26 o     46.0   16.7    0.0000   0.0000          ?        ?    17.2401  19.7942          ?        ?       46.0       16.7       ?       ? 
1 1 1   20    4   27 o   1079.7    3.9    0.0000   0.0000          ?        ? 11658.1279  84.9234          ?        ?     1079.7        3.9       ?       ? 
1 1 1   20    4   28 o   1308.6    4.5    0.0000   0.0000          ?        ? 17124.5117 118.7650          ?        ?     1308.6        4.5       ?       ? 
1 1 1   20    4   29 o   1818.2    6.0    0.0000   0.0000          ?        ? 33063.2891 217.0974          ?        ?     1818.2        6.0       ?       ? 
1 1 1   20    4   30 o    968.6    4.1    0.0000   0.0000          ?        ?  9383.0752  79.8152          ?        ?      968.6        4.1       ?       ? 
1 1 1   20    4   31 o    562.6    2.8    0.0000   0.0000          ?        ?  3165.7900  31.2876          ?        ?      562.6        2.8       ?       ? 
1 1 1   20    4   32 o     55.7   18.1    0.0000   0.0000          ?        ?    30.0105  22.9868          ?        ?       55.7       18.1       ?       ? 
1 1 1   20    4   33 o   1530.9    5.2    0.0000   0.0000          ?        ? 23439.4902 157.7148          ?        ?     1530.9        5.2       ?       ? 
1 1 1   20    4   34 o    359.9    3.0    0.0000   0.0000          ?        ?  1295.5603  21.7097          ?        ?      359.9        3.0       ?       ? 
1 1 1   20    4   35 o    825.9    3.3    0.0000   0.0000          ?        ?  6821.3267  54.9129          ?        ?      825.9        3.3       ?       ? 
1 1 1   20    4   36 o    268.8    3.9    0.0000   0.0000          ?        ?   722.8065  21.0712          ?        ?      268.8        3.9       ?       ? 
1 1 1   20    4   37 o    770.5    3.0    0.0000   0.0000          ?        ?  5937.6128  46.6121          ?        ?      770.5        3.0       ?       ? 
1 1 1   20    4   38 o    902.4    3.3    0.0000   0.0000          ?        ?  8143.7051  58.7440          ?        ?      902.4        3.3       ?       ? 
1 1 1   20    4   39 o    439.8    3.0    0.0000   0.0000          ?        ?  1934.7206  26.1794          ?        ?      439.8        3.0       ?       ? 
1 1 1   20    4   40 o    129.6    6.9    0.0000   0.0000          ?        ?   167.9312  17.8786          ?        ?      129.6        6.9       ?       ? 
1 1 1   20    4   41 o    786.9    3.2    0.0000   0.0000          ?        ?  6192.3828  51.0817          ?        ?      786.9        3.2       ?       ? 
1 1 1   20    4   42 o    836.1    3.4    0.0000   0.0000          ?        ?  6991.1733  56.8284          ?        ?      836.1        3.4       ?       ? 
1 1 1   20    4   43 o    582.4    2.9    0.0000   0.0000          ?        ?  3392.4653  33.8416          ?        ?      582.4        2.9       ?       ? 
1 1 1   20    4   44 o    611.9    2.9    0.0000   0.0000          ?        ?  3744.2910  35.1187          ?        ?      611.9        2.9       ?       ? 
1 1 1   20    4   45 o    834.3    3.1    0.0000   0.0000          ?        ?  6961.8018  52.3588          ?        ?      834.3        3.1       ?       ? 
1 1 1   20    4   46 o    377.6    3.0    0.0000   0.0000          ?        ?  1425.8188  22.3483          ?        ?      377.6        3.0       ?       ? 
1 1 1   20    4   47 o    182.0    4.9    0.0000   0.0000          ?        ?   331.3927  17.8786          ?        ?      182.0        4.9       ?       ? 
1 1 1   20    4   48 o    137.2    6.5    0.0000   0.0000          ?        ?   188.3639  17.8786          ?        ?      137.2        6.5       ?       ? 
1 1 1   20    4   49 o    263.2    3.5    0.0000   0.0000          ?        ?   692.7960  18.5171          ?        ?      263.2        3.5       ?       ? 
1 1 1   20    4   50 o     29.4   13.3    0.0000   0.0000          ?        ?    -8.9393  16.6016          ?        ?       29.4       13.3       ?       ? 
1 1 1   20    4   51 o    383.4    2.7    0.0000   0.0000          ?        ?  1469.8767  21.0712          ?        ?      383.4        2.7       ?       ? 
1 1 1   20    4   52 o    280.2    3.4    0.0000   0.0000          ?        ?   785.3816  19.1556          ?        ?      280.2        3.4       ?       ? 
1 1 1   20    4   53 o    391.7    2.8    0.0000   0.0000          ?        ?  1534.3674  21.7097          ?        ?      391.7        2.8       ?       ? 
1 1 1   20    4   54 o    390.4    3.0    0.0000   0.0000          ?        ?  1524.7897  23.6253          ?        ?      390.4        3.0       ?       ? 
1 1 1   20    4   55 o     79.3   11.3    0.0000   0.0000          ?        ?    63.2136  17.8786          ?        ?       79.3       11.3       ?       ? 
1 1 1   20    4   56 o    121.9    7.6    0.0000   0.0000          ?        ?   148.7755  18.5171          ?        ?      121.9        7.6       ?       ? 
1 1 1   20    4   57 o    212.7    4.4    0.0000   0.0000          ?        ?   452.7119  18.5171          ?        ?      212.7        4.4       ?       ? 
1 1 1   20    4   58 o    465.1    2.7    0.0000   0.0000          ?        ?  2163.9497  24.9023          ?        ?      465.1        2.7       ?       ? 
1 1 1   20    4   59 o     47.0   16.5    0.0000   0.0000          ?        ?    19.7942  19.1556          ?        ?       47.0       16.5       ?       ? 
1 1 1   20    4   60 o    122.1    7.6    0.0000   0.0000          ?        ?   149.4141  18.5171          ?        ?      122.1        7.6       ?       ? 
1 1 1   20    4   61 f    451.2    3.0    0.0000   0.0000          ?        ?  2036.8840  26.8179          ?        ?      451.2        3.0       ?       ? 
1 1 1   20    4   62 o     20.6   10.4    0.0000   0.0000          ?        ?   -58.1055  19.1556          ?        ?       20.6       10.4       ?       ? 
1 1 1   20    4   63 o    145.6    6.6    0.0000   0.0000          ?        ?   212.6277  19.1556          ?        ?      145.6        6.6       ?       ? 
1 1 1   20    4   64 o    352.8    3.2    0.0000   0.0000          ?        ?  1245.7557  22.3483          ?        ?      352.8        3.2       ?       ? 
1 1 1   20    4   65 o    251.9    4.2    0.0000   0.0000          ?        ?   635.3290  21.0712          ?        ?      251.9        4.2       ?       ? 
1 1 1   20    4   66 o     23.8   11.7    0.0000   0.0000          ?        ?   -42.1424  19.7942          ?        ?       23.8       11.7       ?       ? 
1 1 1   20    4   67 o    261.7    3.9    0.0000   0.0000          ?        ?   685.7722  20.4327          ?        ?      261.7        3.9       ?       ? 
1 1 1   20    4   68 f    190.9    5.5    0.0000   0.0000          ?        ?   365.2344  21.0712          ?        ?      190.9        5.5       ?       ? 
1 1 1   20    4   69 o     89.6   11.0    0.0000   0.0000          ?        ?    81.0922  19.7942          ?        ?       89.6       11.0       ?       ? 
1 1 1   20    4   70 o    167.9    6.3    0.0000   0.0000          ?        ?   282.8651  21.0712          ?        ?      167.9        6.3       ?       ? 
1 1 1   20    4   71 o     98.2   11.0    0.0000   0.0000          ?        ?    97.6938  21.7097          ?        ?       98.2       11.0       ?       ? 
1 1 1   20    4   72 o     66.0   16.1    0.0000   0.0000          ?        ?    46.6121  21.0712          ?        ?       66.0       16.1       ?       ? 
1 1 1   20    4   73 o     92.1   11.4    0.0000   0.0000          ?        ?    86.2004  21.0712          ?        ?       92.1       11.4       ?       ? 
1 1 1   20    4   74 o    127.7    8.5    0.0000   0.0000          ?        ?   164.7386  21.7097          ?        ?      127.7        8.5       ?       ? 
1 1 1   20    4   75 o     98.8   11.6    0.0000   0.0000          ?        ?    99.6094  22.9868          ?        ?       98.8       11.6       ?       ? 
1 1 1   20    4   76 o     57.4   17.1    0.0000   0.0000          ?        ?    35.1187  21.0712          ?        ?       57.4       17.1       ?       ? 
1 1 1   20    4   77 o    328.0    3.6    0.0000   0.0000          ?        ?  1078.4630  23.6253          ?        ?      328.0        3.6       ?       ? 
1 1 1   20    4   78 o     28.8   13.6    0.0000   0.0000          ?        ?   -21.0712  20.4327          ?        ?       28.8       13.6       ?       ? 
1 1 1   20    5    0 o   1592.1    7.5 25353.1406 238.1686 25353.1406 238.1686 25353.1406 238.1686     1592.1      7.5     1592.1        7.5     0.0     0.0 
1 1 1   20    5    1 o    439.9    1.9    0.0000   0.0000          ?        ?  1935.3591  16.6016          ?        ?      439.9        1.9       ?       ? 
1 1 1   20    5    2 o    605.1    2.3    0.0000   0.0000          ?        ?  3661.2832  28.0950          ?        ?      605.1        2.3       ?       ? 
1 1 1   20    5    3 o    233.9    1.5    0.0000   0.0000          ?        ?   547.2130   7.0237          ?        ?      233.9        1.5       ?       ? 
1 1 1   20    5    4 f   1181.2    4.0    0.0000   0.0000          ?        ? 13952.9746  95.1397          ?        ?     1181.2        4.0       ?       ? 
1 1 1   20    5    5 f   1208.3    4.1    0.0000   0.0000          ?        ? 14601.0732  99.6094          ?        ?     1208.3        4.1       ?       ? 
1 1 1   20    5    6 o    661.2    2.5    0.0000   0.0000          ?        ?  4371.9575  33.2031          ?        ?      661.2        2.5       ?       ? 
1 1 1   20    5    7 o    388.9    2.0    0.0000   0.0000          ?        ?  1512.6577  15.3245          ?        ?      388.9        2.0       ?       ? 
1 1 1   20    5    8 o    793.5    2.9    0.0000   0.0000          ?        ?  6296.4614  45.9736          ?        ?      793.5        2.9       ?       ? 
1 1 1   20    5    9 o    325.9    1.8    0.0000   0.0000          ?        ?  1061.8615  11.4934          ?        ?      325.9        1.8       ?       ? 
1 1 1   20    5   10 o    626.8    2.4    0.0000   0.0000          ?        ?  3929.4622  30.6490          ?        ?      626.8        2.4       ?       ? 
1 1 1   20    5   11 o    907.1    3.2    0.0000   0.0000          ?        ?  8228.6279  58.7440          ?        ?      907.1        3.2       ?       ? 
1 1 1   20    5   12 o    556.3    2.2    0.0000   0.0000          ?        ?  3094.9143  24.9023          ?        ?      556.3        2.2       ?       ? 
1 1 1   20    5   13 o    829.1    3.0    0.0000   0.0000          ?        ?  6873.6855  49.8047          ?        ?      829.1        3.0       ?       ? 
1 1 1   20    5   14 o   2010.8    6.5    0.0000   0.0000          ?        ? 40438.2148 263.0709          ?        ?     2010.8        6.5       ?       ? 
1 1 1   20    5   15 o   1028.7    3.8    0.0000   0.0000          ?        ? 10582.2188  77.8996          ?        ?     1028.7        3.8       ?       ? 
1 1 1   20    5   16 o   1259.1    4.4    0.0000   0.0000          ?        ? 15853.2148 109.8257          ?        ?     1259.1        4.4       ?       ? 
1 1 1   20    5   17 o   1521.9    5.3    0.0000   0.0000          ?        ? 23163.0117 160.9075          ?        ?     1521.9        5.3       ?       ? 
1 1 1   20    5   18 o    731.5    2.9    0.0000   0.0000          ?        ?  5350.8110  42.1424          ?        ?      731.5        2.9       ?       ? 
1 1 1   20    5   19 o    539.9    2.4    0.0000   0.0000          ?        ?  2914.8513  25.5409          ?        ?      539.9        2.4       ?       ? 
1 1 1   20    5   20 o    717.3    2.9    0.0000   0.0000          ?        ?  5145.8457  41.5039          ?        ?      717.3        2.9       ?       ? 
1 1 1   20    5   21 o   1708.4    5.8    0.0000   0.0000          ?        ? 29190.0156 196.6647          ?        ?     1708.4        5.8       ?       ? 
1 1 1   20    5   22 o    246.0    3.1    0.0000   0.0000          ?        ?   605.3185  15.3245          ?        ?      246.0        3.1       ?       ? 
1 1 1   20    5   23 o   1115.0    3.9    0.0000   0.0000          ?        ? 12432.0156  86.8389          ?        ?     1115.0        3.9       ?       ? 
1 1 1   20    5   24 o    692.1    2.8    0.0000   0.0000          ?        ?  4790.1895  38.9498          ?        ?      692.1        2.8       ?       ? 
1 1 1   20    5   25 o    499.0    2.4    0.0000   0.0000          ?        ?  2490.2344  24.2638          ?        ?      499.0        2.4       ?       ? 
1 1 1   20    5   26 o    503.9    2.3    0.0000   0.0000          ?        ?  2539.4006  23.6253          ?        ?      503.9        2.3       ?       ? 
1 1 1   20    5   27 o    797.3    3.0    0.0000   0.0000          ?        ?  6356.4829  48.5276          ?        ?      797.3        3.0       ?       ? 
1 1 1   20    5   28 o    249.4    2.9    0.0000   0.0000          ?        ?   621.9200  14.6860          ?        ?      249.4        2.9       ?       ? 
1 1 1   20    5   29 o    981.8    3.9    0.0000   0.0000          ?        ?  9640.3994  77.2611          ?        ?      981.8        3.9       ?       ? 
1 1 1   20    5   30 o   1432.2    5.0    0.0000   0.0000          ?        ? 20513.7832 143.6674          ?        ?     1432.2        5.0       ?       ? 
1 1 1   20    5   31 o   1302.4    4.6    0.0000   0.0000          ?        ? 16964.8809 120.0421          ?        ?     1302.4        4.6       ?       ? 
1 1 1   20    5   32 o    758.2    2.9    0.0000   0.0000          ?        ?  5748.6104  44.0580          ?        ?      758.2        2.9       ?       ? 
1 1 1   20    5   33 o   1055.5    3.9    0.0000   0.0000          ?        ? 11142.2021  81.7308          ?        ?     1055.5        3.9       ?       ? 
1 1 1   20    5   34 o    592.8    2.8    0.0000   0.0000          ?        ?  3513.7844  33.2031          ?        ?      592.8        2.8       ?       ? 
1 1 1   20    5   35 o    363.5    2.6    0.0000   0.0000          ?        ?  1321.1012  19.1556          ?        ?      363.5        2.6       ?       ? 
1 1 1   20    5   36 o   1073.7    3.8    0.0000   0.0000          ?        ? 11529.7852  81.0922          ?        ?     1073.7        3.8       ?       ? 
1 1 1   20    5   37 o    280.2    3.5    0.0000   0.0000          ?        ?   785.3816  19.7942          ?        ?      280.2        3.5       ?       ? 
1 1 1   20    5   38 o   1328.4    4.5    0.0000   0.0000          ?        ? 17648.7383 120.0421          ?        ?     1328.4        4.5       ?       ? 
1 1 1   20    5   39 o   1024.4    3.7    0.0000   0.0000          ?        ? 10495.3799  75.3456          ?        ?     1024.4        3.7       ?       ? 
1 1 1   20    5   40 o    785.0    3.1    0.0000   0.0000          ?        ?  6162.3721  47.8891          ?        ?      785.0        3.1       ?       ? 
1 1 1   20    5   41 o    534.4    2.6    0.0000   0.0000          ?        ?  2856.1072  28.0950          ?        ?      534.4        2.6       ?       ? 
1 1 1   20    5   42 o    874.3    3.2    0.0000   0.0000          ?        ?  7645.0195  56.8284          ?        ?      874.3        3.2       ?       ? 
1 1 1   20    5   43 o    285.9    3.4    0.0000   0.0000          ?        ?   817.3077  19.1556          ?        ?      285.9        3.4       ?       ? 
1 1 1   20    5   44 o    511.5    2.7    0.0000   0.0000          ?        ?  2616.6616  27.4564          ?        ?      511.5        2.7       ?       ? 
1 1 1   20    5   45 o     24.0   11.7    0.0000   0.0000          ?        ?   -35.1187  18.5171          ?        ?       24.0       11.7       ?       ? 
1 1 1   20    5   46 o    166.2    5.4    0.0000   0.0000          ?        ?   276.4799  17.8786          ?        ?      166.2        5.4       ?       ? 
1 1 1   20    5   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    5   48 o    423.9    2.8    0.0000   0.0000          ?        ?  1797.4384  23.6253          ?        ?      423.9        2.8       ?       ? 
1 1 1   20    5   49 f    266.7    3.6    0.0000   0.0000          ?        ?   711.3131  19.1556          ?        ?      266.7        3.6       ?       ? 
1 1 1   20    5   50 o    226.1    4.1    0.0000   0.0000          ?        ?   511.4558  18.5171          ?        ?      226.1        4.1       ?       ? 
1 1 1   20    5   51 o    483.6    2.7    0.0000   0.0000          ?        ?  2338.9045  26.1794          ?        ?      483.6        2.7       ?       ? 
1 1 1   20    5   52 o    390.8    3.0    0.0000   0.0000          ?        ?  1527.3438  23.6253          ?        ?      390.8        3.0       ?       ? 
1 1 1   20    5   53 o    316.8    3.3    0.0000   0.0000          ?        ?  1003.7560  21.0712          ?        ?      316.8        3.3       ?       ? 
1 1 1   20    5   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    5   55 o    441.5    2.7    0.0000   0.0000          ?        ?  1949.4065  24.2638          ?        ?      441.5        2.7       ?       ? 
1 1 1   20    5   56 o    341.8    3.1    0.0000   0.0000          ?        ?  1168.4946  21.0712          ?        ?      341.8        3.1       ?       ? 
1 1 1   20    5   57 o    367.3    3.0    0.0000   0.0000          ?        ?  1349.1962  21.7097          ?        ?      367.3        3.0       ?       ? 
1 1 1   20    5   58 o    384.7    2.9    0.0000   0.0000          ?        ?  1480.7316  22.3483          ?        ?      384.7        2.9       ?       ? 
1 1 1   20    5   59 o    126.7    7.6    0.0000   0.0000          ?        ?   160.9075  19.1556          ?        ?      126.7        7.6       ?       ? 
1 1 1   20    5   60 o    207.3    4.8    0.0000   0.0000          ?        ?   430.3636  19.7942          ?        ?      207.3        4.8       ?       ? 
1 1 1   20    5   61 o     51.1   16.2    0.0000   0.0000          ?        ?    26.1794  18.5171          ?        ?       51.1       16.2       ?       ? 
1 1 1   20    5   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    5   63 o    282.2    3.8    0.0000   0.0000          ?        ?   796.8750  21.7097          ?        ?      282.2        3.8       ?       ? 
1 1 1   20    5   64 o    220.4    4.8    0.0000   0.0000          ?        ?   486.5535  21.0712          ?        ?      220.4        4.8       ?       ? 
1 1 1   20    5   65 o     88.2   11.9    0.0000   0.0000          ?        ?    78.5382  21.0712          ?        ?       88.2       11.9       ?       ? 
1 1 1   20    5   66 f     42.6   16.6    0.0000   0.0000          ?        ?    11.4934  20.4327          ?        ?       42.6       16.6       ?       ? 
1 1 1   20    5   67 o    126.5    8.6    0.0000   0.0000          ?        ?   160.9075  21.7097          ?        ?      126.5        8.6       ?       ? 
1 1 1   20    5   68 o     25.6   12.5    0.0000   0.0000          ?        ?   -38.9498  21.0712          ?        ?       25.6       12.5       ?       ? 
1 1 1   20    5   69 o    127.2    8.3    0.0000   0.0000          ?        ?   162.8230  21.0712          ?        ?      127.2        8.3       ?       ? 
1 1 1   20    5   70 o    211.6    5.1    0.0000   0.0000          ?        ?   448.8807  21.7097          ?        ?      211.6        5.1       ?       ? 
1 1 1   20    5   71 o    238.1    4.6    0.0000   0.0000          ?        ?   568.2842  21.7097          ?        ?      238.1        4.6       ?       ? 
1 1 1   20    5   72 o     88.9   12.2    0.0000   0.0000          ?        ?    80.4537  21.7097          ?        ?       88.9       12.2       ?       ? 
1 1 1   20    5   73 o    280.3    4.2    0.0000   0.0000          ?        ?   787.2972  23.6253          ?        ?      280.3        4.2       ?       ? 
1 1 1   20    5   74 o     44.5   17.4    0.0000   0.0000          ?        ?    13.4090  22.3483          ?        ?       44.5       17.4       ?       ? 
1 1 1   20    5   75 f     33.5   14.8    0.0000   0.0000          ?        ?    -5.7467  19.7942          ?        ?       33.5       14.8       ?       ? 
1 1 1   20    5   76 o    136.2    7.3    0.0000   0.0000          ?        ?   187.0868  19.7942          ?        ?      136.2        7.3       ?       ? 
1 1 1   20    5   77 o     29.4   13.7    0.0000   0.0000          ?        ?   -17.2401  19.7942          ?        ?       29.4       13.7       ?       ? 
1 1 1   20    6    0 o    465.5    2.9 2167.1423  26.8179  2167.1423  26.8179  2167.1423  26.8179      465.5      2.9      465.5        2.9     0.0     0.0 
1 1 1   20    6    1 o   1310.6    4.5    0.0000   0.0000          ?        ? 17178.7852 116.8494          ?        ?     1310.6        4.5       ?       ? 
1 1 1   20    6    2 o   1222.1    4.2    0.0000   0.0000          ?        ? 14937.5742 102.1635          ?        ?     1222.1        4.2       ?       ? 
1 1 1   20    6    3 o    589.0    2.3    0.0000   0.0000          ?        ?  3469.7266  26.8179          ?        ?      589.0        2.3       ?       ? 
1 1 1   20    6    4 o   1560.7    5.2    0.0000   0.0000          ?        ? 24360.8770 162.1845          ?        ?     1560.7        5.2       ?       ? 
1 1 1   20    6    5 o   1426.3    4.8    0.0000   0.0000          ?        ? 20345.2148 136.6436          ?        ?     1426.3        4.8       ?       ? 
1 1 1   20    6    6 o    908.5    3.2    0.0000   0.0000          ?        ?  8254.1689  58.7440          ?        ?      908.5        3.2       ?       ? 
1 1 1   20    6    7 o    933.7    3.4    0.0000   0.0000          ?        ?  8719.0127  62.5751          ?        ?      933.7        3.4       ?       ? 
1 1 1   20    6    8 o    453.6    2.0    0.0000   0.0000          ?        ?  2057.3167  17.8786          ?        ?      453.6        2.0       ?       ? 
1 1 1   20    6    9 o   1398.5    4.8    0.0000   0.0000          ?        ? 19559.1934 134.7281          ?        ?     1398.5        4.8       ?       ? 
1 1 1   20    6   10 o    497.6    2.2    0.0000   0.0000          ?        ?  2476.1868  21.7097          ?        ?      497.6        2.2       ?       ? 
1 1 1   20    6   11 o    578.6    2.3    0.0000   0.0000          ?        ?  3347.7688  26.8179          ?        ?      578.6        2.3       ?       ? 
1 1 1   20    6   12 o    421.0    2.0    0.0000   0.0000          ?        ?  1772.5361  16.6016          ?        ?      421.0        2.0       ?       ? 
1 1 1   20    6   13 o   1020.8    3.6    0.0000   0.0000          ?        ? 10420.0342  73.4300          ?        ?     1020.8        3.6       ?       ? 
1 1 1   20    6   14 o   1742.2    6.0    0.0000   0.0000          ?        ? 30355.9570 208.1580          ?        ?     1742.2        6.0       ?       ? 
1 1 1   20    6   15 o   1220.8    4.3    0.0000   0.0000          ?        ? 14903.7344 104.0790          ?        ?     1220.8        4.3       ?       ? 
1 1 1   20    6   16 o    995.3    3.6    0.0000   0.0000          ?        ?  9906.6631  70.8759          ?        ?      995.3        3.6       ?       ? 
1 1 1   20    6   17 o   1267.3    4.5    0.0000   0.0000          ?        ? 16060.7344 113.0183          ?        ?     1267.3        4.5       ?       ? 
1 1 1   20    6   18 f    708.8    2.8    0.0000   0.0000          ?        ?  5023.8882  39.5883          ?        ?      708.8        2.8       ?       ? 
1 1 1   20    6   19 o   2073.6    7.0    0.0000   0.0000          ?        ? 43005.7109 291.8044          ?        ?     2073.6        7.0       ?       ? 
1 1 1   20    6   20 o   1070.9    3.8    0.0000   0.0000          ?        ? 11469.7646  81.0922          ?        ?     1070.9        3.8       ?       ? 
1 1 1   20    6   21 o   1640.2    5.5    0.0000   0.0000          ?        ? 26905.3867 180.7016          ?        ?     1640.2        5.5       ?       ? 
1 1 1   20    6   22 o   1335.5    4.5    0.0000   0.0000          ?        ? 17837.1016 121.3191          ?        ?     1335.5        4.5       ?       ? 
1 1 1   20    6   23 o    966.5    3.5    0.0000   0.0000          ?        ?  9341.5713  67.6833          ?        ?      966.5        3.5       ?       ? 
1 1 1   20    6   24 o   1676.0    5.5    0.0000   0.0000          ?        ? 28093.0371 185.8098          ?        ?     1676.0        5.5       ?       ? 
1 1 1   20    6   25 o   1525.2    5.3    0.0000   0.0000          ?        ? 23263.8965 162.1845          ?        ?     1525.2        5.3       ?       ? 
1 1 1   20    6   26 o    126.8    5.0    0.0000   0.0000          ?        ?   160.9075  12.7704          ?        ?      126.8        5.0       ?       ? 
1 1 1   20    6   27 o   1043.1    3.7    0.0000   0.0000          ?        ? 10881.6855  76.6226          ?        ?     1043.1        3.7       ?       ? 
1 1 1   20    6   28 o   1479.4    5.3    0.0000   0.0000          ?        ? 21889.7988 157.0763          ?        ?     1479.4        5.3       ?       ? 
1 1 1   20    6   29 o   1113.9    4.0    0.0000   0.0000          ?        ? 12407.7520  88.7545          ?        ?     1113.9        4.0       ?       ? 
1 1 1   20    6   30 o    450.1    2.4    0.0000   0.0000          ?        ?  2026.0291  21.7097          ?        ?      450.1        2.4       ?       ? 
1 1 1   20    6   31 o    909.4    3.5    0.0000   0.0000          ?        ?  8270.1318  63.8522          ?        ?      909.4        3.5       ?       ? 
1 1 1   20    6   32 o    392.9    2.8    0.0000   0.0000          ?        ?  1543.9453  21.7097          ?        ?      392.9        2.8       ?       ? 
1 1 1   20    6   33 o   1177.4    4.1    0.0000   0.0000          ?        ? 13864.8584  97.6938          ?        ?     1177.4        4.1       ?       ? 
1 1 1   20    6   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    6   35 o    637.7    2.8    0.0000   0.0000          ?        ?  4067.3828  35.1187          ?        ?      637.7        2.8       ?       ? 
1 1 1   20    6   36 o    800.5    3.2    0.0000   0.0000          ?        ?  6408.8418  51.0817          ?        ?      800.5        3.2       ?       ? 
1 1 1   20    6   37 o    695.6    2.9    0.0000   0.0000          ?        ?  4839.3555  40.8654          ?        ?      695.6        2.9       ?       ? 
1 1 1   20    6   38 o    520.2    2.8    0.0000   0.0000          ?        ?  2706.0547  29.3720          ?        ?      520.2        2.8       ?       ? 
1 1 1   20    6   39 o    182.9    5.4    0.0000   0.0000          ?        ?   334.5853  19.7942          ?        ?      182.9        5.4       ?       ? 
1 1 1   20    6   40 f    759.0    3.2    0.0000   0.0000          ?        ?  5760.7422  49.1662          ?        ?      759.0        3.2       ?       ? 
1 1 1   20    6   41 o    554.1    2.7    0.0000   0.0000          ?        ?  3070.0120  30.0105          ?        ?      554.1        2.7       ?       ? 
1 1 1   20    6   42 o    448.2    2.7    0.0000   0.0000          ?        ?  2009.4276  24.2638          ?        ?      448.2        2.7       ?       ? 
1 1 1   20    6   43 o    605.1    2.7    0.0000   0.0000          ?        ?  3661.2832  33.2031          ?        ?      605.1        2.7       ?       ? 
1 1 1   20    6   44 o     19.1    9.6    0.0000   0.0000          ?        ?   -56.1899  17.2401          ?        ?       19.1        9.6       ?       ? 
1 1 1   20    6   45 o    174.9    4.9    0.0000   0.0000          ?        ?   305.8519  17.2401          ?        ?      174.9        4.9       ?       ? 
1 1 1   20    6   46 o    656.9    2.7    0.0000   0.0000          ?        ?  4315.7681  35.7572          ?        ?      656.9        2.7       ?       ? 
1 1 1   20    6   47 o    449.4    2.8    0.0000   0.0000          ?        ?  2020.2823  24.9023          ?        ?      449.4        2.8       ?       ? 
1 1 1   20    6   48 o    493.7    2.6    0.0000   0.0000          ?        ?  2437.2371  25.5409          ?        ?      493.7        2.6       ?       ? 
1 1 1   20    6   49 o    127.8    6.7    0.0000   0.0000          ?        ?   163.4615  17.2401          ?        ?      127.8        6.7       ?       ? 
1 1 1   20    6   50 o    223.0    3.9    0.0000   0.0000          ?        ?   497.4084  17.2401          ?        ?      223.0        3.9       ?       ? 
1 1 1   20    6   51 o    407.6    2.7    0.0000   0.0000          ?        ?  1661.4333  22.3483          ?        ?      407.6        2.7       ?       ? 
1 1 1   20    6   52 o    170.4    5.2    0.0000   0.0000          ?        ?   290.5273  17.8786          ?        ?      170.4        5.2       ?       ? 
1 1 1   20    6   53 o    413.9    3.1    0.0000   0.0000          ?        ?  1713.7920  25.5409          ?        ?      413.9        3.1       ?       ? 
1 1 1   20    6   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    6   55 o    251.7    3.9    0.0000   0.0000          ?        ?   634.0520  19.7942          ?        ?      251.7        3.9       ?       ? 
1 1 1   20    6   56 o    258.5    4.0    0.0000   0.0000          ?        ?   668.5321  20.4327          ?        ?      258.5        4.0       ?       ? 
1 1 1   20    6   57 o    467.1    2.9    0.0000   0.0000          ?        ?  2182.4668  27.4564          ?        ?      467.1        2.9       ?       ? 
1 1 1   20    6   58 o     27.0   13.0    0.0000   0.0000          ?        ?   -30.0105  20.4327          ?        ?       27.0       13.0       ?       ? 
1 1 1   20    6   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    6   60 o    369.6    3.1    0.0000   0.0000          ?        ?  1366.4363  22.9868          ?        ?      369.6        3.1       ?       ? 
1 1 1   20    6   61 o     27.5   13.0    0.0000   0.0000          ?        ?   -22.9868  19.1556          ?        ?       27.5       13.0       ?       ? 
1 1 1   20    6   62 o     20.3   10.2    0.0000   0.0000          ?        ?   -65.7677  19.7942          ?        ?       20.3       10.2       ?       ? 
1 1 1   20    6   63 o     59.4   16.2    0.0000   0.0000          ?        ?    37.0343  19.7942          ?        ?       59.4       16.2       ?       ? 
1 1 1   20    6   64 o    260.4    4.0    0.0000   0.0000          ?        ?   678.7485  21.0712          ?        ?      260.4        4.0       ?       ? 
1 1 1   20    6   65 o    325.9    3.5    0.0000   0.0000          ?        ?  1063.1385  22.9868          ?        ?      325.9        3.5       ?       ? 
1 1 1   20    6   66 o    180.2    6.0    0.0000   0.0000          ?        ?   325.6460  21.7097          ?        ?      180.2        6.0       ?       ? 
1 1 1   20    6   67 o     22.9   11.4    0.0000   0.0000          ?        ?   -51.0817  20.4327          ?        ?       22.9       11.4       ?       ? 
1 1 1   20    6   68 f    248.4    4.4    0.0000   0.0000          ?        ?   618.0889  21.7097          ?        ?      248.4        4.4       ?       ? 
1 1 1   20    6   69 o     42.7   17.0    0.0000   0.0000          ?        ?    10.2163  21.7097          ?        ?       42.7       17.0       ?       ? 
1 1 1   20    6   70 o     26.2   12.8    0.0000   0.0000          ?        ?   -38.9498  21.7097          ?        ?       26.2       12.8       ?       ? 
1 1 1   20    6   71 o     34.4   15.5    0.0000   0.0000          ?        ?   -10.2163  22.3483          ?        ?       34.4       15.5       ?       ? 
1 1 1   20    6   72 o     87.4   12.8    0.0000   0.0000          ?        ?    77.8996  22.3483          ?        ?       87.4       12.8       ?       ? 
1 1 1   20    6   73 o    224.3    4.8    0.0000   0.0000          ?        ?   504.4321  21.7097          ?        ?      224.3        4.8       ?       ? 
1 1 1   20    6   74 o     59.4   17.3    0.0000   0.0000          ?        ?    37.6728  21.7097          ?        ?       59.4       17.3       ?       ? 
1 1 1   20    6   75 o     88.7   11.9    0.0000   0.0000          ?        ?    80.4537  21.0712          ?        ?       88.7       11.9       ?       ? 
1 1 1   20    6   76 f     21.5   10.8    0.0000   0.0000          ?        ?   -59.3825  20.4327          ?        ?       21.5       10.8       ?       ? 
1 1 1   20    6   77 f     40.3   16.5    0.0000   0.0000          ?        ?     7.6623  21.0712          ?        ?       40.3       16.5       ?       ? 
1 1 1   20    7    0 o   1814.8    8.4 32941.3320 305.8519 32941.3320 305.8519 32941.3320 305.8519     1814.8      8.4     1814.8        8.4     0.0     0.0 
1 1 1   20    7    1 o    757.8    2.8    0.0000   0.0000          ?        ?  5742.8638  42.1424          ?        ?      757.8        2.8       ?       ? 
1 1 1   20    7    2 o   1646.2    5.4    0.0000   0.0000          ?        ? 27102.6895 178.7861          ?        ?     1646.2        5.4       ?       ? 
1 1 1   20    7    3 o    720.9    2.7    0.0000   0.0000          ?        ?  5197.5659  38.3113          ?        ?      720.9        2.7       ?       ? 
1 1 1   20    7    4 o    671.2    2.5    0.0000   0.0000          ?        ?  4505.4082  33.8416          ?        ?      671.2        2.5       ?       ? 
1 1 1   20    7    5 o    943.7    3.3    0.0000   0.0000          ?        ?  8906.0996  63.2136          ?        ?      943.7        3.3       ?       ? 
1 1 1   20    7    6 o   1272.7    4.4    0.0000   0.0000          ?        ? 16198.0166 111.7413          ?        ?     1272.7        4.4       ?       ? 
1 1 1   20    7    7 o    172.9    1.8    0.0000   0.0000          ?        ?   298.8281   6.3852          ?        ?      172.9        1.8       ?       ? 
1 1 1   20    7    8 o   2099.7    6.8    0.0000   0.0000          ?        ? 44093.1094 286.0577          ?        ?     2099.7        6.8       ?       ? 
1 1 1   20    7    9 o   1944.3    6.3    0.0000   0.0000          ?        ? 37810.0586 245.8308          ?        ?     1944.3        6.3       ?       ? 
1 1 1   20    7   10 o    280.1    1.7    0.0000   0.0000          ?        ?   784.7431   9.5778          ?        ?      280.1        1.7       ?       ? 
1 1 1   20    7   11 o   1433.0    4.8    0.0000   0.0000          ?        ? 20536.1328 137.2822          ?        ?     1433.0        4.8       ?       ? 
1 1 1   20    7   12 o   1329.1    4.7    0.0000   0.0000          ?        ? 17665.9766 123.8732          ?        ?     1329.1        4.7       ?       ? 
1 1 1   20    7   13 o    526.5    2.3    0.0000   0.0000          ?        ?  2771.8225  24.2638          ?        ?      526.5        2.3       ?       ? 
1 1 1   20    7   14 o   1071.2    3.7    0.0000   0.0000          ?        ? 11474.8721  79.8152          ?        ?     1071.2        3.7       ?       ? 
1 1 1   20    7   15 o   1680.7    5.7    0.0000   0.0000          ?        ? 28250.7500 190.9180          ?        ?     1680.7        5.7       ?       ? 
1 1 1   20    7   16 o   1326.1    4.7    0.0000   0.0000          ?        ? 17586.8008 123.8732          ?        ?     1326.1        4.7       ?       ? 
1 1 1   20    7   17 o    663.6    2.6    0.0000   0.0000          ?        ?  4403.2451  35.1187          ?        ?      663.6        2.6       ?       ? 
1 1 1   20    7   18 o    630.8    2.6    0.0000   0.0000          ?        ?  3978.6282  32.5646          ?        ?      630.8        2.6       ?       ? 
1 1 1   20    7   19 o    825.2    3.1    0.0000   0.0000          ?        ?  6809.8330  51.0817          ?        ?      825.2        3.1       ?       ? 
1 1 1   20    7   20 o    979.5    3.6    0.0000   0.0000          ?        ?  9593.7871  69.5989          ?        ?      979.5        3.6       ?       ? 
1 1 1   20    7   21 o    649.7    2.6    0.0000   0.0000          ?        ?  4220.6279  33.2031          ?        ?      649.7        2.6       ?       ? 
1 1 1   20    7   22 o    763.1    2.9    0.0000   0.0000          ?        ?  5823.3174  44.6965          ?        ?      763.1        2.9       ?       ? 
1 1 1   20    7   23 o   1645.8    5.5    0.0000   0.0000          ?        ? 27088.0020 179.4246          ?        ?     1645.8        5.5       ?       ? 
1 1 1   20    7   24 o    888.3    3.3    0.0000   0.0000          ?        ?  7891.4888  58.1055          ?        ?      888.3        3.3       ?       ? 
1 1 1   20    7   25 o   1252.2    4.5    0.0000   0.0000          ?        ? 15682.0908 111.7413          ?        ?     1252.2        4.5       ?       ? 
1 1 1   20    7   26 o    615.3    2.6    0.0000   0.0000          ?        ?  3785.7949  32.5646          ?        ?      615.3        2.6       ?       ? 
1 1 1   20    7   27 o    793.1    3.3    0.0000   0.0000          ?        ?  6290.7153  52.3588          ?        ?      793.1        3.3       ?       ? 
1 1 1   20    7   28 o    501.7    2.8    0.0000   0.0000          ?        ?  2517.0522  28.0950          ?        ?      501.7        2.8       ?       ? 
1 1 1   20    7   29 o    466.5    2.4    0.0000   0.0000          ?        ?  2176.0815  22.3483          ?        ?      466.5        2.4       ?       ? 
1 1 1   20    7   30 o    395.0    2.4    0.0000   0.0000          ?        ?  1560.5469  19.1556          ?        ?      395.0        2.4       ?       ? 
1 1 1   20    7   31 o    118.2    6.8    0.0000   0.0000          ?        ?   139.8362  15.9630          ?        ?      118.2        6.8       ?       ? 
1 1 1   20    7   32 o    305.3    2.9    0.0000   0.0000          ?        ?   932.2416  17.8786          ?        ?      305.3        2.9       ?       ? 
1 1 1   20    7   33 o    113.6    7.6    0.0000   0.0000          ?        ?   128.9814  17.2401          ?        ?      113.6        7.6       ?       ? 
1 1 1   20    7   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    7   35 o    658.5    2.8    0.0000   0.0000          ?        ?  4336.2002  37.0343          ?        ?      658.5        2.8       ?       ? 
1 1 1   20    7   36 o    698.7    3.2    0.0000   0.0000          ?        ?  4882.1362  44.0580          ?        ?      698.7        3.2       ?       ? 
1 1 1   20    7   37 o   1185.1    4.3    0.0000   0.0000          ?        ? 14045.5596 102.1635          ?        ?     1185.1        4.3       ?       ? 
1 1 1   20    7   38 o    634.8    2.7    0.0000   0.0000          ?        ?  4030.3486  34.4802          ?        ?      634.8        2.7       ?       ? 
1 1 1   20    7   39 o    195.7    4.4    0.0000   0.0000          ?        ?   383.1130  17.2401          ?        ?      195.7        4.4       ?       ? 
1 1 1   20    7   40 o     24.1   11.8    0.0000   0.0000          ?        ?   -34.4802  18.5171          ?        ?       24.1       11.8       ?       ? 
1 1 1   20    7   41 o    742.4    3.0    0.0000   0.0000          ?        ?  5511.7188  44.0580          ?        ?      742.4        3.0       ?       ? 
1 1 1   20    7   42 o    413.3    2.8    0.0000   0.0000          ?        ?  1708.0454  22.9868          ?        ?      413.3        2.8       ?       ? 
1 1 1   20    7   43 o    909.2    3.4    0.0000   0.0000          ?        ?  8266.9395  61.9366          ?        ?      909.2        3.4       ?       ? 
1 1 1   20    7   44 o    465.6    2.7    0.0000   0.0000          ?        ?  2168.4194  25.5409          ?        ?      465.6        2.7       ?       ? 
1 1 1   20    7   45 o    459.2    2.8    0.0000   0.0000          ?        ?  2109.0369  25.5409          ?        ?      459.2        2.8       ?       ? 
1 1 1   20    7   46 o    142.4    6.3    0.0000   0.0000          ?        ?   203.0499  17.8786          ?        ?      142.4        6.3       ?       ? 
1 1 1   20    7   47 o    275.9    3.5    0.0000   0.0000          ?        ?   761.1177  19.1556          ?        ?      275.9        3.5       ?       ? 
1 1 1   20    7   48 o    313.0    3.2    0.0000   0.0000          ?        ?   980.1307  19.7942          ?        ?      313.0        3.2       ?       ? 
1 1 1   20    7   49 o    131.0    6.8    0.0000   0.0000          ?        ?   171.7623  17.8786          ?        ?      131.0        6.8       ?       ? 
1 1 1   20    7   50 f    378.2    2.7    0.0000   0.0000          ?        ?  1430.9270  20.4327          ?        ?      378.2        2.7       ?       ? 
1 1 1   20    7   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20    7   52 o    496.5    2.6    0.0000   0.0000          ?        ?  2465.3320  26.1794          ?        ?      496.5        2.6       ?       ? 
1 1 1   20    7   53 o    162.3    5.7    0.0000   0.0000          ?        ?   263.7094  18.5171          ?        ?      162.3        5.7       ?       ? 
1 1 1   20    7   54 o    258.5    3.7    0.0000   0.0000          ?        ?   668.5321  19.1556          ?        ?      258.5        3.7       ?       ? 
1 1 1   20    7   55 o    217.6    4.4    0.0000   0.0000          ?        ?   473.7830  19.1556          ?        ?      217.6        4.4       ?       ? 
1 1 1   20    7   56 o     23.3   11.5    0.0000   0.0000          ?        ?   -45.3350  19.7942          ?        ?       23.3       11.5       ?       ? 
1 1 1   20    7   57 o    186.6    5.1    0.0000   0.0000          ?        ?   348.6328  19.1556          ?        ?      186.6        5.1       ?       ? 
1 1 1   20    7   58 o    364.4    3.1    0.0000   0.0000          ?        ?  1328.1250  22.3483          ?        ?      364.4        3.1       ?       ? 
1 1 1   20    7   59 o    422.4    2.9    0.0000   0.0000          ?        ?  1785.3065  24.9023          ?        ?      422.4        2.9       ?       ? 
1 1 1   20    7   60 o    135.9    7.3    0.0000   0.0000          ?        ?   185.1713  19.7942          ?        ?      135.9        7.3       ?       ? 
1 1 1   20    7   61 o    154.1    6.4    0.0000   0.0000          ?        ?   238.1686  19.7942          ?        ?      154.1        6.4       ?       ? 
1 1 1   20    7   62 o    129.4    7.7    0.0000   0.0000          ?        ?   167.9312  19.7942          ?        ?      129.4        7.7       ?       ? 
1 1 1   20    7   63 o    111.9    8.8    0.0000   0.0000          ?        ?   125.7888  19.7942          ?        ?      111.9        8.8       ?       ? 
1 1 1   20    7   64 o    193.0    5.0    0.0000   0.0000          ?        ?   372.8966  19.1556          ?        ?      193.0        5.0       ?       ? 
1 1 1   20    7   65 o    395.3    3.1    0.0000   0.0000          ?        ?  1563.7394  24.2638          ?        ?      395.3        3.1       ?       ? 
1 1 1   20    7   66 o    271.2    4.0    0.0000   0.0000          ?        ?   736.2155  21.7097          ?        ?      271.2        4.0       ?       ? 
1 1 1   20    7   67 o     32.0   14.6    0.0000   0.0000          ?        ?   -12.1319  20.4327          ?        ?       32.0       14.6       ?       ? 
1 1 1   20    7   68 o    155.9    6.8    0.0000   0.0000          ?        ?   243.9153  21.0712          ?        ?      155.9        6.8       ?       ? 
1 1 1   20    7   69 o    365.8    3.2    0.0000   0.0000          ?        ?  1339.6184  23.6253          ?        ?      365.8        3.2       ?       ? 
1 1 1   20    7   70 o    107.6    9.8    0.0000   0.0000          ?        ?   116.8494  21.0712          ?        ?      107.6        9.8       ?       ? 
1 1 1   20    7   71 o    200.4    5.4    0.0000   0.0000          ?        ?   402.9071  21.7097          ?        ?      200.4        5.4       ?       ? 
1 1 1   20    7   72 o     27.0   13.1    0.0000   0.0000          ?        ?   -37.6728  22.3483          ?        ?       27.0       13.1       ?       ? 
1 1 1   20    7   73 o    309.5    3.8    0.0000   0.0000          ?        ?   959.6980  23.6253          ?        ?      309.5        3.8       ?       ? 
1 1 1   20    7   74 o    142.2    7.2    0.0000   0.0000          ?        ?   203.6884  20.4327          ?        ?      142.2        7.2       ?       ? 
1 1 1   20    7   75 o    167.8    6.7    0.0000   0.0000          ?        ?   283.5036  22.3483          ?        ?      167.8        6.7       ?       ? 
1 1 1   20    7   76 o    215.3    5.3    0.0000   0.0000          ?        ?   466.1208  22.9868          ?        ?      215.3        5.3       ?       ? 
1 1 1   20    7   77 o    255.8    4.5    0.0000   0.0000          ?        ?   657.0388  22.9868          ?        ?      255.8        4.5       ?       ? 
1 1 1   20    8    0 o    326.0    2.5 1063.1385  16.6016  1063.1385  16.6016  1063.1385  16.6016      326.0      2.5      326.0        2.5     0.0     0.0 
1 1 1   20    8    1 o    782.5    2.9    0.0000   0.0000          ?        ?  6123.4224  45.3350          ?        ?      782.5        2.9       ?       ? 
1 1 1   20    8    2 o    410.0    1.9    0.0000   0.0000          ?        ?  1681.2274  15.9630          ?        ?      410.0        1.9       ?       ? 
1 1 1   20    8    3 o    668.9    2.6    0.0000   0.0000          ?        ?  4474.1211  35.1187          ?        ?      668.9        2.6       ?       ? 
1 1 1   20    8    4 o    915.1    3.2    0.0000   0.0000          ?        ?  8373.5732  59.3825          ?        ?      915.1        3.2       ?       ? 
1 1 1   20    8    5 o    836.1    3.0    0.0000   0.0000          ?        ?  6990.5352  50.4432          ?        ?      836.1        3.0       ?       ? 
1 1 1   20    8    6 o    652.7    2.5    0.0000   0.0000          ?        ?  4260.2163  33.2031          ?        ?      652.7        2.5       ?       ? 
1 1 1   20    8    7 o   1222.9    4.2    0.0000   0.0000          ?        ? 14954.8154 101.5249          ?        ?     1222.9        4.2       ?       ? 
1 1 1   20    8    8 o    880.7    3.2    0.0000   0.0000          ?        ?  7756.1221  55.5514          ?        ?      880.7        3.2       ?       ? 
1 1 1   20    8    9 o   1389.5    4.7    0.0000   0.0000          ?        ? 19309.5332 129.6199          ?        ?     1389.5        4.7       ?       ? 
1 1 1   20    8   10 o    961.4    3.6    0.0000   0.0000          ?        ?  9243.8770  68.3218          ?        ?      961.4        3.6       ?       ? 
1 1 1   20    8   11 o   1156.0    4.2    0.0000   0.0000          ?        ? 13363.6182  97.6938          ?        ?     1156.0        4.2       ?       ? 
1 1 1   20    8   12 o    526.0    2.2    0.0000   0.0000          ?        ?  2766.7141  23.6253          ?        ?      526.0        2.2       ?       ? 
1 1 1   20    8   13 f   1460.3    5.0    0.0000   0.0000          ?        ? 21327.2617 145.5829          ?        ?     1460.3        5.0       ?       ? 
1 1 1   20    8   14 o    216.6    2.4    0.0000   0.0000          ?        ?   469.3134  10.2163          ?        ?      216.6        2.4       ?       ? 
1 1 1   20    8   15 o   1608.6    5.7    0.0000   0.0000          ?        ? 25878.6426 183.2557          ?        ?     1608.6        5.7       ?       ? 
1 1 1   20    8   16 o    485.7    2.4    0.0000   0.0000          ?        ?  2358.6987  22.9868          ?        ?      485.7        2.4       ?       ? 
1 1 1   20    8   17 o    706.3    2.9    0.0000   0.0000          ?        ?  4988.7695  40.8654          ?        ?      706.3        2.9       ?       ? 
1 1 1   20    8   18 o    502.3    2.5    0.0000   0.0000          ?        ?  2522.7991  25.5409          ?        ?      502.3        2.5       ?       ? 
1 1 1   20    8   19 o     22.4   10.2    0.0000   0.0000          ?        ?    -7.0237  10.2163          ?        ?       22.4       10.2       ?       ? 
1 1 1   20    8   20 o   1211.3    4.5    0.0000   0.0000          ?        ? 14674.5039 107.9102          ?        ?     1211.3        4.5       ?       ? 
1 1 1   20    8   21 o   1470.5    4.9    0.0000   0.0000          ?        ? 21624.1738 144.9444          ?        ?     1470.5        4.9       ?       ? 
1 1 1   20    8   22 o     27.3   13.7    0.0000   0.0000          ?        ?  -100.2479  33.2031          ?        ?       27.3       13.7       ?       ? 
1 1 1   20    8   23 o    486.1    2.4    0.0000   0.0000          ?        ?  2362.5300  23.6253          ?        ?      486.1        2.4       ?       ? 
1 1 1   20    8   24 o    955.1    3.7    0.0000   0.0000          ?        ?  9121.9199  70.8759          ?        ?      955.1        3.7       ?       ? 
1 1 1   20    8   25 o    695.0    2.9    0.0000   0.0000          ?        ?  4830.4160  40.8654          ?        ?      695.0        2.9       ?       ? 
1 1 1   20    8   26 o   1299.8    4.6    0.0000   0.0000          ?        ? 16896.5586 120.6806          ?        ?     1299.8        4.6       ?       ? 
1 1 1   20    8   27 o    515.8    2.5    0.0000   0.0000          ?        ?  2660.0811  25.5409          ?        ?      515.8        2.5       ?       ? 
1 1 1   20    8   28 o    965.6    3.5    0.0000   0.0000          ?        ?  9324.9697  67.0448          ?        ?      965.6        3.5       ?       ? 
1 1 1   20    8   29 o    656.7    2.9    0.0000   0.0000          ?        ?  4312.5752  38.3113          ?        ?      656.7        2.9       ?       ? 
1 1 1   20    8   30 o    999.7    4.0    0.0000   0.0000          ?        ?  9995.4180  79.1767          ?        ?      999.7        4.0       ?       ? 
1 1 1   20    8   31 f    598.2    2.9    0.0000   0.0000          ?        ?  3578.9138  34.4802          ?        ?      598.2        2.9       ?       ? 
1 1 1   20    8   32 o   1349.6    5.0    0.0000   0.0000          ?        ? 18215.7461 136.0051          ?        ?     1349.6        5.0       ?       ? 
1 1 1   20    8   33 o   1606.0    5.9    0.0000   0.0000          ?        ? 25797.5508 189.0024          ?        ?     1606.0        5.9       ?       ? 
1 1 1   20    8   34 o    703.2    3.0    0.0000   0.0000          ?        ?  4945.3501  42.7809          ?        ?      703.2        3.0       ?       ? 
1 1 1   20    8   35 o   1082.6    4.2    0.0000   0.0000          ?        ? 11721.3408  90.6701          ?        ?     1082.6        4.2       ?       ? 
1 1 1   20    8   36 o     25.2   12.0    0.0000   0.0000          ?        ?   -21.7097  16.6016          ?        ?       25.2       12.0       ?       ? 
1 1 1   20    8   37 o    699.2    3.0    0.0000   0.0000          ?        ?  4889.1602  41.5039          ?        ?      699.2        3.0       ?       ? 
1 1 1   20    8   38 o    565.5    2.7    0.0000   0.0000          ?        ?  3197.7163  30.6490          ?        ?      565.5        2.7       ?       ? 
1 1 1   20    8   39 o   1131.3    4.0    0.0000   0.0000          ?        ? 12799.1660  90.6701          ?        ?     1131.3        4.0       ?       ? 
1 1 1   20    8   40 o   1090.2    3.9    0.0000   0.0000          ?        ? 11886.0801  84.2849          ?        ?     1090.2        3.9       ?       ? 
1 1 1   20    8   41 o     85.6   10.4    0.0000   0.0000          ?        ?    73.4300  17.8786          ?        ?       85.6       10.4       ?       ? 
1 1 1   20    8   42 o    638.1    2.7    0.0000   0.0000          ?        ?  4071.8525  34.4802          ?        ?      638.1        2.7       ?       ? 
1 1 1   20    8   43 o    229.6    4.3    0.0000   0.0000          ?        ?   527.4188  19.7942          ?        ?      229.6        4.3       ?       ? 
1 1 1   20    8   44 o    791.9    3.1    0.0000   0.0000          ?        ?  6271.5596  49.1662          ?        ?      791.9        3.1       ?       ? 
1 1 1   20    8   45 o    261.6    3.7    0.0000   0.0000          ?        ?   684.4952  19.1556          ?        ?      261.6        3.7       ?       ? 
1 1 1   20    8   46 o    157.6    5.5    0.0000   0.0000          ?        ?   248.3849  17.2401          ?        ?      157.6        5.5       ?       ? 
1 1 1   20    8   47 o    513.7    2.6    0.0000   0.0000          ?        ?  2639.6484  26.8179          ?        ?      513.7        2.6       ?       ? 
1 1 1   20    8   48 o    691.8    3.0    0.0000   0.0000          ?        ?  4786.9966  42.1424          ?        ?      691.8        3.0       ?       ? 
1 1 1   20    8   49 o    367.0    2.9    0.0000   0.0000          ?        ?  1347.2806  21.0712          ?        ?      367.0        2.9       ?       ? 
1 1 1   20    8   50 o    226.5    4.2    0.0000   0.0000          ?        ?   513.3714  19.1556          ?        ?      226.5        4.2       ?       ? 
1 1 1   20    8   51 o    249.2    3.8    0.0000   0.0000          ?        ?   621.2816  19.1556          ?        ?      249.2        3.8       ?       ? 
1 1 1   20    8   52 o    259.4    3.7    0.0000   0.0000          ?        ?   673.0018  19.1556          ?        ?      259.4        3.7       ?       ? 
1 1 1   20    8   53 o    254.8    4.1    0.0000   0.0000          ?        ?   649.3765  21.0712          ?        ?      254.8        4.1       ?       ? 
1 1 1   20    8   54 o    551.9    2.9    0.0000   0.0000          ?        ?  3046.3867  31.9261          ?        ?      551.9        2.9       ?       ? 
1 1 1   20    8   55 f    505.2    2.8    0.0000   0.0000          ?        ?  2553.4480  28.0950          ?        ?      505.2        2.8       ?       ? 
1 1 1   20    8   56 o     28.3   13.2    0.0000   0.0000          ?        ?   -17.8786  18.5171          ?        ?       28.3       13.2       ?       ? 
1 1 1   20    8   57 o    194.2    4.9    0.0000   0.0000          ?        ?   377.3663  19.1556          ?        ?      194.2        4.9       ?       ? 
1 1 1   20    8   58 o    259.5    3.8    0.0000   0.0000          ?        ?   673.6403  19.7942          ?        ?      259.5        3.8       ?       ? 
1 1 1   20    8   59 o    199.3    4.8    0.0000   0.0000          ?        ?   397.7990  19.1556          ?        ?      199.3        4.8       ?       ? 
1 1 1   20    8   60 o    193.3    4.8    0.0000   0.0000          ?        ?   374.1737  18.5171          ?        ?      193.3        4.8       ?       ? 
1 1 1   20    8   61 o    175.1    5.5    0.0000   0.0000          ?        ?   307.1289  19.1556          ?        ?      175.1        5.5       ?       ? 
1 1 1   20    8   62 o    134.2    7.4    0.0000   0.0000          ?        ?   180.7016  19.7942          ?        ?      134.2        7.4       ?       ? 
1 1 1   20    8   63 o    307.0    3.4    0.0000   0.0000          ?        ?   943.0964  21.0712          ?        ?      307.0        3.4       ?       ? 
1 1 1   20    8   64 o    129.6    7.9    0.0000   0.0000          ?        ?   168.5697  20.4327          ?        ?      129.6        7.9       ?       ? 
1 1 1   20    8   65 o     50.4   17.0    0.0000   0.0000          ?        ?    24.2638  20.4327          ?        ?       50.4       17.0       ?       ? 
1 1 1   20    8   66 o     99.1   10.6    0.0000   0.0000          ?        ?    98.9709  21.0712          ?        ?       99.1       10.6       ?       ? 
1 1 1   20    8   67 o    100.0   10.2    0.0000   0.0000          ?        ?   100.8864  20.4327          ?        ?      100.0       10.2       ?       ? 
1 1 1   20    8   68 o    550.6    2.8    0.0000   0.0000          ?        ?  3034.2549  31.2876          ?        ?      550.6        2.8       ?       ? 
1 1 1   20    8   69 o     23.1   11.5    0.0000   0.0000          ?        ?   -49.8047  20.4327          ?        ?       23.1       11.5       ?       ? 
1 1 1   20    8   70 o    233.9    4.6    0.0000   0.0000          ?        ?   548.4901  21.7097          ?        ?      233.9        4.6       ?       ? 
1 1 1   20    8   71 o     23.2   11.6    0.0000   0.0000          ?        ?   -52.3588  21.0712          ?        ?       23.2       11.6       ?       ? 
1 1 1   20    8   72 o    145.4    7.0    0.0000   0.0000          ?        ?   212.6277  20.4327          ?        ?      145.4        7.0       ?       ? 
1 1 1   20    8   73 o    210.2    5.3    0.0000   0.0000          ?        ?   443.7725  22.3483          ?        ?      210.2        5.3       ?       ? 
1 1 1   20    8   74 o     29.6   13.9    0.0000   0.0000          ?        ?   -21.0712  21.0712          ?        ?       29.6       13.9       ?       ? 
1 1 1   20    8   75 o    107.9    9.2    0.0000   0.0000          ?        ?   118.1265  19.7942          ?        ?      107.9        9.2       ?       ? 
1 1 1   20    8   76 o     21.1   10.6    0.0000   0.0000          ?        ?   -61.9366  20.4327          ?        ?       21.1       10.6       ?       ? 
1 1 1   20    9    0 o   1636.9    8.0 26799.3926 262.4324 26799.3926 262.4324 26799.3926 262.4324     1636.9      8.0     1636.9        8.0     0.0     0.0 
1 1 1   20    9    1 o    863.6    3.3    0.0000   0.0000          ?        ?  7458.5708  56.1899          ?        ?      863.6        3.3       ?       ? 
1 1 1   20    9    2 o    267.9    1.9    0.0000   0.0000          ?        ?   717.6983  10.2163          ?        ?      267.9        1.9       ?       ? 
1 1 1   20    9    3 o    263.8    1.8    0.0000   0.0000          ?        ?   695.9886   9.5778          ?        ?      263.8        1.8       ?       ? 
1 1 1   20    9    4 o   1900.3    6.4    0.0000   0.0000          ?        ? 36116.6992 241.9997          ?        ?     1900.3        6.4       ?       ? 
1 1 1   20    9    5 o    580.7    2.4    0.0000   0.0000          ?        ?  3372.6714  27.4564          ?        ?      580.7        2.4       ?       ? 
1 1 1   20    9    6 o   1174.0    4.0    0.0000   0.0000          ?        ? 13784.4053  94.5012          ?        ?     1174.0        4.0       ?       ? 
1 1 1   20    9    7 o    852.0    3.1    0.0000   0.0000          ?        ?  7259.9907  53.6358          ?        ?      852.0        3.1       ?       ? 
1 1 1   20    9    8 o   1759.5    6.0    0.0000   0.0000          ?        ? 30962.5527 212.6277          ?        ?     1759.5        6.0       ?       ? 
1 1 1   20    9    9 o    504.0    2.2    0.0000   0.0000          ?        ?  2540.0391  22.3483          ?        ?      504.0        2.2       ?       ? 
1 1 1   20    9   10 o   1124.2    3.9    0.0000   0.0000          ?        ? 12638.2588  88.7545          ?        ?     1124.2        3.9       ?       ? 
1 1 1   20    9   11 o    719.4    2.7    0.0000   0.0000          ?        ?  5175.2178  38.9498          ?        ?      719.4        2.7       ?       ? 
1 1 1   20    9   12 o    898.1    3.2    0.0000   0.0000          ?        ?  8065.8047  58.1055          ?        ?      898.1        3.2       ?       ? 
1 1 1   20    9   13 o    545.1    2.4    0.0000   0.0000          ?        ?  2971.6797  26.1794          ?        ?      545.1        2.4       ?       ? 
1 1 1   20    9   14 o    952.0    3.7    0.0000   0.0000          ?        ?  9063.8145  69.5989          ?        ?      952.0        3.7       ?       ? 
1 1 1   20    9   15 o    775.3    3.0    0.0000   0.0000          ?        ?  6010.4038  47.2506          ?        ?      775.3        3.0       ?       ? 
1 1 1   20    9   16 f   1157.5    4.3    0.0000   0.0000          ?        ? 13398.0996  99.6094          ?        ?     1157.5        4.3       ?       ? 
1 1 1   20    9   17 o    313.1    2.2    0.0000   0.0000          ?        ?   980.1307  14.0475          ?        ?      313.1        2.2       ?       ? 
1 1 1   20    9   18 o    922.2    3.5    0.0000   0.0000          ?        ?  8505.7461  65.1292          ?        ?      922.2        3.5       ?       ? 
1 1 1   20    9   19 o    475.4    2.4    0.0000   0.0000          ?        ?  2260.3665  22.9868          ?        ?      475.4        2.4       ?       ? 
1 1 1   20    9   20 o    882.8    3.4    0.0000   0.0000          ?        ?  7793.1562  59.3825          ?        ?      882.8        3.4       ?       ? 
1 1 1   20    9   21 o    691.5    3.0    0.0000   0.0000          ?        ?  4781.8887  40.8654          ?        ?      691.5        3.0       ?       ? 
1 1 1   20    9   22 o   1331.9    4.8    0.0000   0.0000          ?        ? 17740.6836 128.9814          ?        ?     1331.9        4.8       ?       ? 
1 1 1   20    9   23 o   1140.9    4.2    0.0000   0.0000          ?        ? 13016.2637  95.1397          ?        ?     1140.9        4.2       ?       ? 
1 1 1   20    9   24 o    720.1    2.9    0.0000   0.0000          ?        ?  5185.4341  42.1424          ?        ?      720.1        2.9       ?       ? 
1 1 1   20    9   25 o    850.9    3.6    0.0000   0.0000          ?        ?  7241.4736  61.9366          ?        ?      850.9        3.6       ?       ? 
1 1 1   20    9   26 o    682.5    2.8    0.0000   0.0000          ?        ?  4658.6538  38.3113          ?        ?      682.5        2.8       ?       ? 
1 1 1   20    9   27 o    699.3    2.9    0.0000   0.0000          ?        ?  4890.4375  40.8654          ?        ?      699.3        2.9       ?       ? 
1 1 1   20    9   28 o   1972.1    6.8    0.0000   0.0000          ?        ? 38898.7383 266.2635          ?        ?     1972.1        6.8       ?       ? 
1 1 1   20    9   29 o   1183.4    4.4    0.0000   0.0000          ?        ? 14006.6113 103.4405          ?        ?     1183.4        4.4       ?       ? 
1 1 1   20    9   30 o    524.3    2.6    0.0000   0.0000          ?        ?  2749.4741  27.4564          ?        ?      524.3        2.6       ?       ? 
1 1 1   20    9   31 o    542.8    2.7    0.0000   0.0000          ?        ?  2946.7773  29.3720          ?        ?      542.8        2.7       ?       ? 
1 1 1   20    9   32 o    689.5    2.8    0.0000   0.0000          ?        ?  4753.7935  38.9498          ?        ?      689.5        2.8       ?       ? 
1 1 1   20    9   33 o    232.0    4.3    0.0000   0.0000          ?        ?   538.2737  19.7942          ?        ?      232.0        4.3       ?       ? 
1 1 1   20    9   34 o    710.5    3.1    0.0000   0.0000          ?        ?  5048.7905  44.0580          ?        ?      710.5        3.1       ?       ? 
1 1 1   20    9   35 o   1504.7    5.1    0.0000   0.0000          ?        ? 22645.8086 154.5222          ?        ?     1504.7        5.1       ?       ? 
1 1 1   20    9   36 o   1663.1    5.9    0.0000   0.0000          ?        ? 27666.5039 196.0261          ?        ?     1663.1        5.9       ?       ? 
1 1 1   20    9   37 o    411.3    2.9    0.0000   0.0000          ?        ?  1692.0823  23.6253          ?        ?      411.3        2.9       ?       ? 
1 1 1   20    9   38 o    873.9    3.4    0.0000   0.0000          ?        ?  7637.9956  59.3825          ?        ?      873.9        3.4       ?       ? 
1 1 1   20    9   39 o    243.7    3.7    0.0000   0.0000          ?        ?   593.8251  17.8786          ?        ?      243.7        3.7       ?       ? 
1 1 1   20    9   40 o    115.2    7.8    0.0000   0.0000          ?        ?   132.8125  17.8786          ?        ?      115.2        7.8       ?       ? 
1 1 1   20    9   41 o    601.8    2.8    0.0000   0.0000          ?        ?  3621.6948  33.8416          ?        ?      601.8        2.8       ?       ? 
1 1 1   20    9   42 o    730.2    3.1    0.0000   0.0000          ?        ?  5332.9326  45.9736          ?        ?      730.2        3.1       ?       ? 
1 1 1   20    9   43 o    184.1    5.2    0.0000   0.0000          ?        ?   339.0550  19.1556          ?        ?      184.1        5.2       ?       ? 
1 1 1   20    9   44 o    622.8    2.8    0.0000   0.0000          ?        ?  3879.6572  35.1187          ?        ?      622.8        2.8       ?       ? 
1 1 1   20    9   45 f    101.3    8.8    0.0000   0.0000          ?        ?   102.8020  17.8786          ?        ?      101.3        8.8       ?       ? 
1 1 1   20    9   46 o    289.3    3.4    0.0000   0.0000          ?        ?   837.1019  19.7942          ?        ?      289.3        3.4       ?       ? 
1 1 1   20    9   47 o    330.0    3.4    0.0000   0.0000          ?        ?  1089.3180  22.3483          ?        ?      330.0        3.4       ?       ? 
1 1 1   20    9   48 o    434.5    3.0    0.0000   0.0000          ?        ?  1888.1085  26.1794          ?        ?      434.5        3.0       ?       ? 
1 1 1   20    9   49 o    235.1    4.2    0.0000   0.0000          ?        ?   552.9597  19.7942          ?        ?      235.1        4.2       ?       ? 
1 1 1   20    9   50 o    676.0    2.9    0.0000   0.0000          ?        ?  4570.5376  39.5883          ?        ?      676.0        2.9       ?       ? 
1 1 1   20    9   51 o    113.7    8.4    0.0000   0.0000          ?        ?   129.6199  19.1556          ?        ?      113.7        8.4       ?       ? 
1 1 1   20    9   52 f    485.3    2.6    0.0000   0.0000          ?        ?  2356.1448  25.5409          ?        ?      485.3        2.6       ?       ? 
1 1 1   20    9   53 o    269.6    3.4    0.0000   0.0000          ?        ?   727.2761  18.5171          ?        ?      269.6        3.4       ?       ? 
1 1 1   20    9   54 o     61.0   15.2    0.0000   0.0000          ?        ?    38.9498  18.5171          ?        ?       61.0       15.2       ?       ? 
1 1 1   20    9   55 o    328.4    3.2    0.0000   0.0000          ?        ?  1079.1016  21.0712          ?        ?      328.4        3.2       ?       ? 
1 1 1   20    9   56 o    548.6    2.6    0.0000   0.0000          ?        ?  3010.6294  28.7335          ?        ?      548.6        2.6       ?       ? 
1 1 1   20    9   57 o     26.3   12.6    0.0000   0.0000          ?        ?   -24.9023  18.5171          ?        ?       26.3       12.6       ?       ? 
1 1 1   20    9   58 o    228.2    4.1    0.0000   0.0000          ?        ?   521.0336  18.5171          ?        ?      228.2        4.1       ?       ? 
1 1 1   20    9   59 o    225.8    4.2    0.0000   0.0000          ?        ?   510.1788  19.1556          ?        ?      225.8        4.2       ?       ? 
1 1 1   20    9   60 o    237.7    4.0    0.0000   0.0000          ?        ?   565.7302  19.1556          ?        ?      237.7        4.0       ?       ? 
1 1 1   20    9   61 o    445.1    2.7    0.0000   0.0000          ?        ?  1981.9711  24.2638          ?        ?      445.1        2.7       ?       ? 
1 1 1   20    9   62 o    212.3    4.7    0.0000   0.0000          ?        ?   451.4348  19.7942          ?        ?      212.3        4.7       ?       ? 
1 1 1   20    9   63 o     75.4   14.1    0.0000   0.0000          ?        ?    59.3825  20.4327          ?        ?       75.4       14.1       ?       ? 
1 1 1   20    9   64 o    164.5    5.8    0.0000   0.0000          ?        ?   271.3717  19.1556          ?        ?      164.5        5.8       ?       ? 
1 1 1   20    9   65 f    263.9    4.0    0.0000   0.0000          ?        ?   697.2656  21.0712          ?        ?      263.9        4.0       ?       ? 
1 1 1   20    9   66 o    195.2    5.2    0.0000   0.0000          ?        ?   381.8359  20.4327          ?        ?      195.2        5.2       ?       ? 
1 1 1   20    9   67 o    236.4    4.5    0.0000   0.0000          ?        ?   559.9835  21.0712          ?        ?      236.4        4.5       ?       ? 
1 1 1   20    9   68 o    204.6    5.3    0.0000   0.0000          ?        ?   419.5087  21.7097          ?        ?      204.6        5.3       ?       ? 
1 1 1   20    9   69 o     82.0   12.5    0.0000   0.0000          ?        ?    68.3218  20.4327          ?        ?       82.0       12.5       ?       ? 
1 1 1   20    9   70 o    134.0    7.6    0.0000   0.0000          ?        ?   180.7016  20.4327          ?        ?      134.0        7.6       ?       ? 
1 1 1   20    9   71 o    222.4    4.7    0.0000   0.0000          ?        ?   496.1313  21.0712          ?        ?      222.4        4.7       ?       ? 
1 1 1   20    9   72 o     66.5   15.2    0.0000   0.0000          ?        ?    47.2506  19.7942          ?        ?       66.5       15.2       ?       ? 
1 1 1   20    9   73 o    118.4    8.9    0.0000   0.0000          ?        ?   141.7518  21.0712          ?        ?      118.4        8.9       ?       ? 
1 1 1   20    9   74 o    122.5    8.6    0.0000   0.0000          ?        ?   151.9681  21.0712          ?        ?      122.5        8.6       ?       ? 
1 1 1   20    9   75 o     40.5   16.2    0.0000   0.0000          ?        ?     9.5778  19.7942          ?        ?       40.5       16.2       ?       ? 
1 1 1   20    9   76 f    167.4    6.9    0.0000   0.0000          ?        ?   282.8651  22.9868          ?        ?      167.4        6.9       ?       ? 
1 1 1   20   10    0 o   1373.9    7.7 18880.4453 211.9892 18880.4453 211.9892 18880.4453 211.9892     1373.9      7.7     1373.9        7.7     0.0     0.0 
1 1 1   20   10    1 o   1189.4    4.8    0.0000   0.0000          ?        ? 14147.7236 113.6568          ?        ?     1189.4        4.8       ?       ? 
1 1 1   20   10    2 o   1384.3    5.6    0.0000   0.0000          ?        ? 19165.2266 155.7993          ?        ?     1384.3        5.6       ?       ? 
1 1 1   20   10    3 o   1439.2    5.6    0.0000   0.0000          ?        ? 20713.6406 161.5460          ?        ?     1439.2        5.6       ?       ? 
1 1 1   20   10    4 o   1466.8    5.5    0.0000   0.0000          ?        ? 21516.2637 162.1845          ?        ?     1466.8        5.5       ?       ? 
1 1 1   20   10    5 o    885.8    3.5    0.0000   0.0000          ?        ?  7847.4307  61.2981          ?        ?      885.8        3.5       ?       ? 
1 1 1   20   10    6 f   1648.6    6.0    0.0000   0.0000          ?        ? 27181.2266 196.6647          ?        ?     1648.6        6.0       ?       ? 
1 1 1   20   10    7 o   1166.2    4.2    0.0000   0.0000          ?        ? 13599.8711  97.0553          ?        ?     1166.2        4.2       ?       ? 
1 1 1   20   10    8 o   1119.2    3.9    0.0000   0.0000          ?        ? 12525.8789  86.2004          ?        ?     1119.2        3.9       ?       ? 
1 1 1   20   10    9 o    540.5    2.2    0.0000   0.0000          ?        ?  2921.2363  24.2638          ?        ?      540.5        2.2       ?       ? 
1 1 1   20   10   10 o   1117.8    3.9    0.0000   0.0000          ?        ? 12495.8682  87.4775          ?        ?     1117.8        3.9       ?       ? 
1 1 1   20   10   11 o   2322.0    8.0    0.0000   0.0000          ?        ? 53925.7070 372.2581          ?        ?     2322.0        8.0       ?       ? 
1 1 1   20   10   12 o    781.0    3.1    0.0000   0.0000          ?        ?  6099.1587  48.5276          ?        ?      781.0        3.1       ?       ? 
1 1 1   20   10   13 o   1029.0    3.8    0.0000   0.0000          ?        ? 10587.9648  79.1767          ?        ?     1029.0        3.8       ?       ? 
1 1 1   20   10   14 o    583.0    2.5    0.0000   0.0000          ?        ?  3399.4893  28.7335          ?        ?      583.0        2.5       ?       ? 
1 1 1   20   10   15 o    725.2    2.8    0.0000   0.0000          ?        ?  5259.5029  40.2269          ?        ?      725.2        2.8       ?       ? 
1 1 1   20   10   16 o   1319.1    4.4    0.0000   0.0000          ?        ? 17400.9902 115.5724          ?        ?     1319.1        4.4       ?       ? 
1 1 1   20   10   17 o   2113.4    7.2    0.0000   0.0000          ?        ? 44673.5273 303.9363          ?        ?     2113.4        7.2       ?       ? 
1 1 1   20   10   18 o    416.1    2.3    0.0000   0.0000          ?        ?  1731.6708  19.1556          ?        ?      416.1        2.3       ?       ? 
1 1 1   20   10   19 o   1271.0    4.4    0.0000   0.0000          ?        ? 16154.5967 113.0183          ?        ?     1271.0        4.4       ?       ? 
1 1 1   20   10   20 o    389.5    2.5    0.0000   0.0000          ?        ?  1517.1274  19.1556          ?        ?      389.5        2.5       ?       ? 
1 1 1   20   10   21 o    879.9    3.3    0.0000   0.0000          ?        ?  7742.0747  58.7440          ?        ?      879.9        3.3       ?       ? 
1 1 1   20   10   22 o   1420.3    4.9    0.0000   0.0000          ?        ? 20175.3672 140.4748          ?        ?     1420.3        4.9       ?       ? 
1 1 1   20   10   23 o   1415.2    5.0    0.0000   0.0000          ?        ? 20029.1465 141.1133          ?        ?     1415.2        5.0       ?       ? 
1 1 1   20   10   24 o    880.2    3.4    0.0000   0.0000          ?        ?  7748.4600  59.3825          ?        ?      880.2        3.4       ?       ? 
1 1 1   20   10   25 o    779.9    3.2    0.0000   0.0000          ?        ?  6082.5566  50.4432          ?        ?      779.9        3.2       ?       ? 
1 1 1   20   10   26 o    766.4    3.1    0.0000   0.0000          ?        ?  5874.3989  47.8891          ?        ?      766.4        3.1       ?       ? 
1 1 1   20   10   27 o    506.1    2.6    0.0000   0.0000          ?        ?  2561.7488  26.1794          ?        ?      506.1        2.6       ?       ? 
1 1 1   20   10   28 o    897.0    3.7    0.0000   0.0000          ?        ?  8046.6494  67.0448          ?        ?      897.0        3.7       ?       ? 
1 1 1   20   10   29 o    770.8    3.1    0.0000   0.0000          ?        ?  5942.0820  48.5276          ?        ?      770.8        3.1       ?       ? 
1 1 1   20   10   30 o    818.6    3.3    0.0000   0.0000          ?        ?  6700.6460  53.6358          ?        ?      818.6        3.3       ?       ? 
1 1 1   20   10   31 f    832.6    3.2    0.0000   0.0000          ?        ?  6933.0684  53.6358          ?        ?      832.6        3.2       ?       ? 
1 1 1   20   10   32 o    494.0    2.8    0.0000   0.0000          ?        ?  2440.4297  27.4564          ?        ?      494.0        2.8       ?       ? 
1 1 1   20   10   33 o    815.7    3.3    0.0000   0.0000          ?        ?  6654.0337  53.6358          ?        ?      815.7        3.3       ?       ? 
1 1 1   20   10   34 o     93.2    8.2    0.0000   0.0000          ?        ?    86.8389  15.3245          ?        ?       93.2        8.2       ?       ? 
1 1 1   20   10   35 o    336.8    2.9    0.0000   0.0000          ?        ?  1134.6530  19.7942          ?        ?      336.8        2.9       ?       ? 
1 1 1   20   10   36 o    239.8    3.9    0.0000   0.0000          ?        ?   575.3080  18.5171          ?        ?      239.8        3.9       ?       ? 
1 1 1   20   10   37 o    632.0    2.8    0.0000   0.0000          ?        ?  3994.5911  35.7572          ?        ?      632.0        2.8       ?       ? 
1 1 1   20   10   38 o    671.3    3.0    0.0000   0.0000          ?        ?  4507.3242  40.2269          ?        ?      671.3        3.0       ?       ? 
1 1 1   20   10   39 o     31.4   14.3    0.0000   0.0000          ?        ?   -12.7704  19.7942          ?        ?       31.4       14.3       ?       ? 
1 1 1   20   10   40 f    809.2    3.2    0.0000   0.0000          ?        ?  6548.6777  51.7203          ?        ?      809.2        3.2       ?       ? 
1 1 1   20   10   41 f    564.3    2.8    0.0000   0.0000          ?        ?  3184.3074  31.9261          ?        ?      564.3        2.8       ?       ? 
1 1 1   20   10   42 o    231.6    4.3    0.0000   0.0000          ?        ?   536.3582  19.7942          ?        ?      231.6        4.3       ?       ? 
1 1 1   20   10   43 o   1127.5    4.0    0.0000   0.0000          ?        ? 12714.8818  91.3086          ?        ?     1127.5        4.0       ?       ? 
1 1 1   20   10   44 o    155.5    6.0    0.0000   0.0000          ?        ?   241.9997  18.5171          ?        ?      155.5        6.0       ?       ? 
1 1 1   20   10   45 o    175.9    5.3    0.0000   0.0000          ?        ?   309.6830  18.5171          ?        ?      175.9        5.3       ?       ? 
1 1 1   20   10   46 o    355.2    3.0    0.0000   0.0000          ?        ?  1261.7188  21.0712          ?        ?      355.2        3.0       ?       ? 
1 1 1   20   10   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   10   48 o    447.0    2.9    0.0000   0.0000          ?        ?  1998.5726  26.1794          ?        ?      447.0        2.9       ?       ? 
1 1 1   20   10   49 o    203.7    4.7    0.0000   0.0000          ?        ?   415.0391  19.1556          ?        ?      203.7        4.7       ?       ? 
1 1 1   20   10   50 o    385.6    2.9    0.0000   0.0000          ?        ?  1487.1168  22.3483          ?        ?      385.6        2.9       ?       ? 
1 1 1   20   10   51 o    342.2    3.0    0.0000   0.0000          ?        ?  1171.0486  20.4327          ?        ?      342.2        3.0       ?       ? 
1 1 1   20   10   52 o    280.1    3.3    0.0000   0.0000          ?        ?   784.7431  18.5171          ?        ?      280.1        3.3       ?       ? 
1 1 1   20   10   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   10   54 o    127.7    7.2    0.0000   0.0000          ?        ?   163.4615  18.5171          ?        ?      127.7        7.2       ?       ? 
1 1 1   20   10   55 o    409.3    2.8    0.0000   0.0000          ?        ?  1676.1193  22.9868          ?        ?      409.3        2.8       ?       ? 
1 1 1   20   10   56 o    652.6    2.8    0.0000   0.0000          ?        ?  4260.8545  37.0343          ?        ?      652.6        2.8       ?       ? 
1 1 1   20   10   57 o    135.9    7.0    0.0000   0.0000          ?        ?   185.1713  19.1556          ?        ?      135.9        7.0       ?       ? 
1 1 1   20   10   58 o    196.3    4.9    0.0000   0.0000          ?        ?   385.6671  19.1556          ?        ?      196.3        4.9       ?       ? 
1 1 1   20   10   59 o    110.2    8.7    0.0000   0.0000          ?        ?   121.9576  19.1556          ?        ?      110.2        8.7       ?       ? 
1 1 1   20   10   60 o    128.6    7.7    0.0000   0.0000          ?        ?   166.0156  19.7942          ?        ?      128.6        7.7       ?       ? 
1 1 1   20   10   61 o    137.8    6.7    0.0000   0.0000          ?        ?   190.2794  18.5171          ?        ?      137.8        6.7       ?       ? 
1 1 1   20   10   62 o    307.7    3.4    0.0000   0.0000          ?        ?   947.5660  21.0712          ?        ?      307.7        3.4       ?       ? 
1 1 1   20   10   63 o    731.5    3.0    0.0000   0.0000          ?        ?  5354.0039  44.0580          ?        ?      731.5        3.0       ?       ? 
1 1 1   20   10   64 o    144.5    7.3    0.0000   0.0000          ?        ?   209.4351  21.0712          ?        ?      144.5        7.3       ?       ? 
1 1 1   20   10   65 o     22.5   11.2    0.0000   0.0000          ?        ?   -45.9736  19.1556          ?        ?       22.5       11.2       ?       ? 
1 1 1   20   10   66 o    265.8    3.8    0.0000   0.0000          ?        ?   707.4820  20.4327          ?        ?      265.8        3.8       ?       ? 
1 1 1   20   10   67 o    353.6    3.2    0.0000   0.0000          ?        ?  1251.5024  22.3483          ?        ?      353.6        3.2       ?       ? 
1 1 1   20   10   68 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   10   69 o     95.6   11.4    0.0000   0.0000          ?        ?    92.5856  21.7097          ?        ?       95.6       11.4       ?       ? 
1 1 1   20   10   70 o     52.1   16.8    0.0000   0.0000          ?        ?    27.4564  19.7942          ?        ?       52.1       16.8       ?       ? 
1 1 1   20   10   71 o     57.3   17.1    0.0000   0.0000          ?        ?    34.4802  21.0712          ?        ?       57.3       17.1       ?       ? 
1 1 1   20   10   72 o    202.7    5.2    0.0000   0.0000          ?        ?   412.4850  21.0712          ?        ?      202.7        5.2       ?       ? 
1 1 1   20   10   73 o     26.0   12.7    0.0000   0.0000          ?        ?   -36.3957  21.0712          ?        ?       26.0       12.7       ?       ? 
1 1 1   20   10   74 o    119.7    8.3    0.0000   0.0000          ?        ?   144.9444  19.7942          ?        ?      119.7        8.3       ?       ? 
1 1 1   20   10   75 o     90.0   11.4    0.0000   0.0000          ?        ?    83.0078  20.4327          ?        ?       90.0       11.4       ?       ? 
1 1 1   20   11    0 o   2041.2   10.4 41676.9453 422.7013 41676.9453 422.7013 41676.9453 422.7013     2041.2     10.4     2041.2       10.4     0.0     0.0 
1 1 1   20   11    1 o   1033.3    4.0    0.0000   0.0000          ?        ? 10676.7197  81.7308          ?        ?     1033.3        4.0       ?       ? 
1 1 1   20   11    2 f   1041.8    3.9    0.0000   0.0000          ?        ? 10854.2295  81.0922          ?        ?     1041.8        3.9       ?       ? 
1 1 1   20   11    3 f    983.8    3.7    0.0000   0.0000          ?        ?  9678.0723  72.7915          ?        ?      983.8        3.7       ?       ? 
1 1 1   20   11    4 o    370.1    2.1    0.0000   0.0000          ?        ?  1369.6289  15.3245          ?        ?      370.1        2.1       ?       ? 
1 1 1   20   11    5 o   1246.1    4.3    0.0000   0.0000          ?        ? 15527.5693 107.9102          ?        ?     1246.1        4.3       ?       ? 
1 1 1   20   11    6 o    591.9    2.3    0.0000   0.0000          ?        ?  3502.9294  27.4564          ?        ?      591.9        2.3       ?       ? 
1 1 1   20   11    7 o   1734.1    5.7    0.0000   0.0000          ?        ? 30073.0898 197.3032          ?        ?     1734.1        5.7       ?       ? 
1 1 1   20   11    8 o   1302.4    4.4    0.0000   0.0000          ?        ? 16963.6035 114.2954          ?        ?     1302.4        4.4       ?       ? 
1 1 1   20   11    9 o   1013.4    3.6    0.0000   0.0000          ?        ? 10269.3438  73.4300          ?        ?     1013.4        3.6       ?       ? 
1 1 1   20   11   10 o    709.2    3.0    0.0000   0.0000          ?        ?  5030.2734  42.7809          ?        ?      709.2        3.0       ?       ? 
1 1 1   20   11   11 o   1160.1    4.3    0.0000   0.0000          ?        ? 13459.3965  98.9709          ?        ?     1160.1        4.3       ?       ? 
1 1 1   20   11   12 o   2459.1    8.7    0.0000   0.0000          ?        ? 60484.5977 427.1710          ?        ?     2459.1        8.7       ?       ? 
1 1 1   20   11   13 f   1134.6    4.0    0.0000   0.0000          ?        ? 12874.5117  90.6701          ?        ?     1134.6        4.0       ?       ? 
1 1 1   20   11   14 o   1219.9    4.2    0.0000   0.0000          ?        ? 14882.0234 101.5249          ?        ?     1219.9        4.2       ?       ? 
1 1 1   20   11   15 o    436.9    2.2    0.0000   0.0000          ?        ?  1908.5411  19.1556          ?        ?      436.9        2.2       ?       ? 
1 1 1   20   11   16 o   1127.4    4.1    0.0000   0.0000          ?        ? 12711.0498  92.5856          ?        ?     1127.4        4.1       ?       ? 
1 1 1   20   11   17 o   2116.9    7.7    0.0000   0.0000          ?        ? 44821.6641 326.9231          ?        ?     2116.9        7.7       ?       ? 
1 1 1   20   11   18 o   1385.4    4.9    0.0000   0.0000          ?        ? 19194.5996 135.3666          ?        ?     1385.4        4.9       ?       ? 
1 1 1   20   11   19 o   1079.9    4.1    0.0000   0.0000          ?        ? 11661.9590  88.1160          ?        ?     1079.9        4.1       ?       ? 
1 1 1   20   11   20 o    512.2    2.5    0.0000   0.0000          ?        ?  2623.6853  25.5409          ?        ?      512.2        2.5       ?       ? 
1 1 1   20   11   21 o    771.5    3.2    0.0000   0.0000          ?        ?  5951.6602  49.8047          ?        ?      771.5        3.2       ?       ? 
1 1 1   20   11   22 o   1386.8    4.8    0.0000   0.0000          ?        ? 19232.9102 133.4510          ?        ?     1386.8        4.8       ?       ? 
1 1 1   20   11   23 o   1650.0    5.7    0.0000   0.0000          ?        ? 27228.4766 188.3639          ?        ?     1650.0        5.7       ?       ? 
1 1 1   20   11   24 o   1122.7    4.1    0.0000   0.0000          ?        ? 12605.0557  91.9471          ?        ?     1122.7        4.1       ?       ? 
1 1 1   20   11   25 o    530.2    2.6    0.0000   0.0000          ?        ?  2811.4106  27.4564          ?        ?      530.2        2.6       ?       ? 
1 1 1   20   11   26 o    247.6    2.8    0.0000   0.0000          ?        ?   612.9808  14.0475          ?        ?      247.6        2.8       ?       ? 
1 1 1   20   11   27 o    249.3    2.8    0.0000   0.0000          ?        ?   621.2816  14.0475          ?        ?      249.3        2.8       ?       ? 
1 1 1   20   11   28 o   1265.1    4.5    0.0000   0.0000          ?        ? 16006.4600 113.6568          ?        ?     1265.1        4.5       ?       ? 
1 1 1   20   11   29 o    821.6    3.4    0.0000   0.0000          ?        ?  6750.4502  56.1899          ?        ?      821.6        3.4       ?       ? 
1 1 1   20   11   30 o   1098.4    4.2    0.0000   0.0000          ?        ? 12066.1426  91.9471          ?        ?     1098.4        4.2       ?       ? 
1 1 1   20   11   31 o    402.4    2.5    0.0000   0.0000          ?        ?  1619.2909  20.4327          ?        ?      402.4        2.5       ?       ? 
1 1 1   20   11   32 o    342.8    3.3    0.0000   0.0000          ?        ?  1174.8798  22.3483          ?        ?      342.8        3.3       ?       ? 
1 1 1   20   11   33 f    935.4    3.6    0.0000   0.0000          ?        ?  8750.3008  67.0448          ?        ?      935.4        3.6       ?       ? 
1 1 1   20   11   34 o    625.9    2.9    0.0000   0.0000          ?        ?  3917.9685  36.3957          ?        ?      625.9        2.9       ?       ? 
1 1 1   20   11   35 f    219.1    3.8    0.0000   0.0000          ?        ?   480.1682  16.6016          ?        ?      219.1        3.8       ?       ? 
1 1 1   20   11   36 o    405.8    2.8    0.0000   0.0000          ?        ?  1646.7472  22.9868          ?        ?      405.8        2.8       ?       ? 
1 1 1   20   11   37 o   1118.5    4.1    0.0000   0.0000          ?        ? 12513.1084  91.9471          ?        ?     1118.5        4.1       ?       ? 
1 1 1   20   11   38 o    620.7    2.8    0.0000   0.0000          ?        ?  3853.4780  35.1187          ?        ?      620.7        2.8       ?       ? 
1 1 1   20   11   39 o    484.6    2.7    0.0000   0.0000          ?        ?  2348.4824  26.1794          ?        ?      484.6        2.7       ?       ? 
1 1 1   20   11   40 o    653.5    2.9    0.0000   0.0000          ?        ?  4271.0713  37.6728          ?        ?      653.5        2.9       ?       ? 
1 1 1   20   11   41 o    419.5    2.8    0.0000   0.0000          ?        ?  1759.7656  23.6253          ?        ?      419.5        2.8       ?       ? 
1 1 1   20   11   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   11   43 o    634.9    2.8    0.0000   0.0000          ?        ?  4031.6257  35.7572          ?        ?      634.9        2.8       ?       ? 
1 1 1   20   11   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   11   45 o    634.2    2.9    0.0000   0.0000          ?        ?  4022.6863  36.3957          ?        ?      634.2        2.9       ?       ? 
1 1 1   20   11   46 o    404.3    3.0    0.0000   0.0000          ?        ?  1634.6154  24.2638          ?        ?      404.3        3.0       ?       ? 
1 1 1   20   11   47 f    292.7    3.3    0.0000   0.0000          ?        ?   856.8960  19.1556          ?        ?      292.7        3.3       ?       ? 
1 1 1   20   11   48 f    420.6    2.7    0.0000   0.0000          ?        ?  1769.3435  22.9868          ?        ?      420.6        2.7       ?       ? 
1 1 1   20   11   49 o    624.3    2.8    0.0000   0.0000          ?        ?  3898.1746  34.4802          ?        ?      624.3        2.8       ?       ? 
1 1 1   20   11   50 o    309.7    3.2    0.0000   0.0000          ?        ?   959.6980  19.7942          ?        ?      309.7        3.2       ?       ? 
1 1 1   20   11   51 o    342.3    3.1    0.0000   0.0000          ?        ?  1172.3258  21.0712          ?        ?      342.3        3.1       ?       ? 
1 1 1   20   11   52 o    113.2    7.9    0.0000   0.0000          ?        ?   128.3428  17.8786          ?        ?      113.2        7.9       ?       ? 
1 1 1   20   11   53 o    425.0    2.8    0.0000   0.0000          ?        ?  1806.3777  23.6253          ?        ?      425.0        2.8       ?       ? 
1 1 1   20   11   54 o    192.4    4.6    0.0000   0.0000          ?        ?   370.3425  17.8786          ?        ?      192.4        4.6       ?       ? 
1 1 1   20   11   55 o    144.8    6.2    0.0000   0.0000          ?        ?   210.0736  17.8786          ?        ?      144.8        6.2       ?       ? 
1 1 1   20   11   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   11   57 o    367.2    2.9    0.0000   0.0000          ?        ?  1348.5576  21.0712          ?        ?      367.2        2.9       ?       ? 
1 1 1   20   11   58 o    360.5    3.0    0.0000   0.0000          ?        ?  1300.0300  21.7097          ?        ?      360.5        3.0       ?       ? 
1 1 1   20   11   59 o    352.7    3.1    0.0000   0.0000          ?        ?  1244.4786  21.7097          ?        ?      352.7        3.1       ?       ? 
1 1 1   20   11   60 o    479.0    2.7    0.0000   0.0000          ?        ?  2295.4854  25.5409          ?        ?      479.0        2.7       ?       ? 
1 1 1   20   11   61 f    338.9    3.1    0.0000   0.0000          ?        ?  1149.3389  21.0712          ?        ?      338.9        3.1       ?       ? 
1 1 1   20   11   62 o    116.1    8.0    0.0000   0.0000          ?        ?   135.3666  18.5171          ?        ?      116.1        8.0       ?       ? 
1 1 1   20   11   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   11   64 o    357.8    3.3    0.0000   0.0000          ?        ?  1280.8744  23.6253          ?        ?      357.8        3.3       ?       ? 
1 1 1   20   11   65 o     43.2   16.7    0.0000   0.0000          ?        ?    12.7704  20.4327          ?        ?       43.2       16.7       ?       ? 
1 1 1   20   11   66 o    362.7    3.2    0.0000   0.0000          ?        ?  1316.6316  22.9868          ?        ?      362.7        3.2       ?       ? 
1 1 1   20   11   67 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   11   68 o     68.0   15.8    0.0000   0.0000          ?        ?    49.1662  21.0712          ?        ?       68.0       15.8       ?       ? 
1 1 1   20   11   69 o     89.4   11.8    0.0000   0.0000          ?        ?    81.0922  21.0712          ?        ?       89.4       11.8       ?       ? 
1 1 1   20   11   70 o     30.3   14.1    0.0000   0.0000          ?        ?   -19.1556  21.0712          ?        ?       30.3       14.1       ?       ? 
1 1 1   20   11   71 o    125.5    8.4    0.0000   0.0000          ?        ?   158.9919  21.0712          ?        ?      125.5        8.4       ?       ? 
1 1 1   20   11   72 o     31.8   14.5    0.0000   0.0000          ?        ?   -12.1319  20.4327          ?        ?       31.8       14.5       ?       ? 
1 1 1   20   11   73 o    160.5    6.4    0.0000   0.0000          ?        ?   259.2398  20.4327          ?        ?      160.5        6.4       ?       ? 
1 1 1   20   11   74 o     40.8   16.2    0.0000   0.0000          ?        ?    10.2163  19.7942          ?        ?       40.8       16.2       ?       ? 
1 1 1   20   11   75 o    159.6    6.0    0.0000   0.0000          ?        ?   256.6857  19.1556          ?        ?      159.6        6.0       ?       ? 
1 1 1   20   12    0 o    934.9    5.3 8741.9990  98.9709  8741.9990  98.9709  8741.9990  98.9709      934.9      5.3      934.9        5.3     0.0     0.0 
1 1 1   20   12    1 o   1433.3    5.3    0.0000   0.0000          ?        ? 20545.0723 151.3296          ?        ?     1433.3        5.3       ?       ? 
1 1 1   20   12    2 o   2082.2    8.1    0.0000   0.0000          ?        ? 43364.5586 337.1394          ?        ?     2082.2        8.1       ?       ? 
1 1 1   20   12    3 o   1149.9    4.4    0.0000   0.0000          ?        ? 13223.1436 100.2479          ?        ?     1149.9        4.4       ?       ? 
1 1 1   20   12    4 o   1288.3    4.6    0.0000   0.0000          ?        ? 16598.3691 117.4880          ?        ?     1288.3        4.6       ?       ? 
1 1 1   20   12    5 o    601.0    2.4    0.0000   0.0000          ?        ?  3612.1169  29.3720          ?        ?      601.0        2.4       ?       ? 
1 1 1   20   12    6 o   1297.4    4.5    0.0000   0.0000          ?        ? 16833.3457 116.8494          ?        ?     1297.4        4.5       ?       ? 
1 1 1   20   12    7 o    807.1    3.1    0.0000   0.0000          ?        ?  6513.5591  49.8047          ?        ?      807.1        3.1       ?       ? 
1 1 1   20   12    8 o   1479.0    5.3    0.0000   0.0000          ?        ? 21877.0273 156.4378          ?        ?     1479.0        5.3       ?       ? 
1 1 1   20   12    9 o    352.1    2.3    0.0000   0.0000          ?        ?  1240.0090  15.9630          ?        ?      352.1        2.3       ?       ? 
1 1 1   20   12   10 o    784.7    3.1    0.0000   0.0000          ?        ?  6157.9028  48.5276          ?        ?      784.7        3.1       ?       ? 
1 1 1   20   12   11 o   2239.0    7.4    0.0000   0.0000          ?        ? 50139.9102 330.7542          ?        ?     2239.0        7.4       ?       ? 
1 1 1   20   12   12 o   1230.5    4.3    0.0000   0.0000          ?        ? 15142.5400 104.7175          ?        ?     1230.5        4.3       ?       ? 
1 1 1   20   12   13 o   1041.9    3.7    0.0000   0.0000          ?        ? 10855.5059  77.2611          ?        ?     1041.9        3.7       ?       ? 
1 1 1   20   12   14 o    690.1    2.8    0.0000   0.0000          ?        ?  4762.7329  38.3113          ?        ?      690.1        2.8       ?       ? 
1 1 1   20   12   15 f    883.3    3.4    0.0000   0.0000          ?        ?  7802.0957  59.3825          ?        ?      883.3        3.4       ?       ? 
1 1 1   20   12   16 o   1856.2    6.9    0.0000   0.0000          ?        ? 34459.7344 255.4086          ?        ?     1856.2        6.9       ?       ? 
1 1 1   20   12   17 o    901.7    3.4    0.0000   0.0000          ?        ?  8130.9346  61.9366          ?        ?      901.7        3.4       ?       ? 
1 1 1   20   12   18 o    277.8    2.8    0.0000   0.0000          ?        ?   771.9727  15.3245          ?        ?      277.8        2.8       ?       ? 
1 1 1   20   12   19 o    807.4    3.2    0.0000   0.0000          ?        ?  6519.9443  51.7203          ?        ?      807.4        3.2       ?       ? 
1 1 1   20   12   20 o    349.8    2.4    0.0000   0.0000          ?        ?  1223.4075  16.6016          ?        ?      349.8        2.4       ?       ? 
1 1 1   20   12   21 o   1238.7    4.5    0.0000   0.0000          ?        ? 15344.3135 112.3798          ?        ?     1238.7        4.5       ?       ? 
1 1 1   20   12   22 o   1515.5    5.2    0.0000   0.0000          ?        ? 22970.1758 158.3534          ?        ?     1515.5        5.2       ?       ? 
1 1 1   20   12   23 f   1137.8    4.0    0.0000   0.0000          ?        ? 12946.0264  90.6701          ?        ?     1137.8        4.0       ?       ? 
1 1 1   20   12   24 o   1248.3    4.3    0.0000   0.0000          ?        ? 15584.3975 107.9102          ?        ?     1248.3        4.3       ?       ? 
1 1 1   20   12   25 o    380.8    2.3    0.0000   0.0000          ?        ?  1450.0826  17.8786          ?        ?      380.8        2.3       ?       ? 
1 1 1   20   12   26 o    553.2    2.5    0.0000   0.0000          ?        ?  3060.4341  27.4564          ?        ?      553.2        2.5       ?       ? 
1 1 1   20   12   27 o    186.0    3.8    0.0000   0.0000          ?        ?   346.0787  14.0475          ?        ?      186.0        3.8       ?       ? 
1 1 1   20   12   28 o    979.4    4.1    0.0000   0.0000          ?        ?  9592.5107  80.4537          ?        ?      979.4        4.1       ?       ? 
1 1 1   20   12   29 o    723.6    2.9    0.0000   0.0000          ?        ?  5236.5156  42.1424          ?        ?      723.6        2.9       ?       ? 
1 1 1   20   12   30 o   1005.6    3.8    0.0000   0.0000          ?        ? 10112.9062  75.9841          ?        ?     1005.6        3.8       ?       ? 
1 1 1   20   12   31 o   1595.3    5.9    0.0000   0.0000          ?        ? 25455.9414 187.0868          ?        ?     1595.3        5.9       ?       ? 
1 1 1   20   12   32 o    647.5    2.9    0.0000   0.0000          ?        ?  4192.5327  37.0343          ?        ?      647.5        2.9       ?       ? 
1 1 1   20   12   33 o    982.5    3.9    0.0000   0.0000          ?        ?  9653.1699  75.9841          ?        ?      982.5        3.9       ?       ? 
1 1 1   20   12   34 o    608.6    2.7    0.0000   0.0000          ?        ?  3704.0637  33.2031          ?        ?      608.6        2.7       ?       ? 
1 1 1   20   12   35 o    143.4    5.3    0.0000   0.0000          ?        ?   205.6040  15.3245          ?        ?      143.4        5.3       ?       ? 
1 1 1   20   12   36 o    762.9    3.1    0.0000   0.0000          ?        ?  5821.4019  46.6121          ?        ?      762.9        3.1       ?       ? 
1 1 1   20   12   37 o    694.2    2.9    0.0000   0.0000          ?        ?  4818.9229  40.2269          ?        ?      694.2        2.9       ?       ? 
1 1 1   20   12   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   12   39 o    430.4    2.5    0.0000   0.0000          ?        ?  1852.3513  21.7097          ?        ?      430.4        2.5       ?       ? 
1 1 1   20   12   40 o    443.3    2.8    0.0000   0.0000          ?        ?  1965.3695  24.9023          ?        ?      443.3        2.8       ?       ? 
1 1 1   20   12   41 o    611.2    2.8    0.0000   0.0000          ?        ?  3736.6287  33.8416          ?        ?      611.2        2.8       ?       ? 
1 1 1   20   12   42 o    706.6    3.0    0.0000   0.0000          ?        ?  4993.8774  42.1424          ?        ?      706.6        3.0       ?       ? 
1 1 1   20   12   43 o    426.3    2.8    0.0000   0.0000          ?        ?  1817.2325  24.2638          ?        ?      426.3        2.8       ?       ? 
1 1 1   20   12   44 f    354.3    3.1    0.0000   0.0000          ?        ?  1255.3335  21.7097          ?        ?      354.3        3.1       ?       ? 
1 1 1   20   12   45 o    808.6    3.2    0.0000   0.0000          ?        ?  6539.7383  51.0817          ?        ?      808.6        3.2       ?       ? 
1 1 1   20   12   46 o    482.5    2.6    0.0000   0.0000          ?        ?  2328.6885  25.5409          ?        ?      482.5        2.6       ?       ? 
1 1 1   20   12   47 o    141.3    6.1    0.0000   0.0000          ?        ?   199.8573  17.2401          ?        ?      141.3        6.1       ?       ? 
1 1 1   20   12   48 o    575.6    2.7    0.0000   0.0000          ?        ?  3313.9272  31.2876          ?        ?      575.6        2.7       ?       ? 
1 1 1   20   12   49 o    361.0    2.8    0.0000   0.0000          ?        ?  1303.2227  20.4327          ?        ?      361.0        2.8       ?       ? 
1 1 1   20   12   50 o    308.3    3.0    0.0000   0.0000          ?        ?   950.7587  18.5171          ?        ?      308.3        3.0       ?       ? 
1 1 1   20   12   51 o    121.9    7.6    0.0000   0.0000          ?        ?   148.7755  18.5171          ?        ?      121.9        7.6       ?       ? 
1 1 1   20   12   52 o    370.4    2.8    0.0000   0.0000          ?        ?  1372.1830  20.4327          ?        ?      370.4        2.8       ?       ? 
1 1 1   20   12   53 o    746.5    3.0    0.0000   0.0000          ?        ?  5574.2939  44.0580          ?        ?      746.5        3.0       ?       ? 
1 1 1   20   12   54 o    390.8    2.8    0.0000   0.0000          ?        ?  1527.3438  21.7097          ?        ?      390.8        2.8       ?       ? 
1 1 1   20   12   55 o    265.9    3.6    0.0000   0.0000          ?        ?   707.4820  19.1556          ?        ?      265.9        3.6       ?       ? 
1 1 1   20   12   56 o     70.4   14.1    0.0000   0.0000          ?        ?    51.7203  19.1556          ?        ?       70.4       14.1       ?       ? 
1 1 1   20   12   57 o    340.0    3.1    0.0000   0.0000          ?        ?  1156.3627  21.0712          ?        ?      340.0        3.1       ?       ? 
1 1 1   20   12   58 o    319.0    3.2    0.0000   0.0000          ?        ?  1018.4420  20.4327          ?        ?      319.0        3.2       ?       ? 
1 1 1   20   12   59 o     69.1   13.4    0.0000   0.0000          ?        ?    49.8047  17.8786          ?        ?       69.1       13.4       ?       ? 
1 1 1   20   12   60 o    131.3    7.3    0.0000   0.0000          ?        ?   173.0394  19.1556          ?        ?      131.3        7.3       ?       ? 
1 1 1   20   12   61 o    210.4    4.6    0.0000   0.0000          ?        ?   443.1340  19.1556          ?        ?      210.4        4.6       ?       ? 
1 1 1   20   12   62 o    316.6    3.4    0.0000   0.0000          ?        ?  1003.1175  21.7097          ?        ?      316.6        3.4       ?       ? 
1 1 1   20   12   63 o    198.5    5.0    0.0000   0.0000          ?        ?   394.6064  19.7942          ?        ?      198.5        5.0       ?       ? 
1 1 1   20   12   64 o    250.2    4.1    0.0000   0.0000          ?        ?   627.0282  20.4327          ?        ?      250.2        4.1       ?       ? 
1 1 1   20   12   65 o     20.6   10.4    0.0000   0.0000          ?        ?   -62.5751  19.7942          ?        ?       20.6       10.4       ?       ? 
1 1 1   20   12   66 o    339.8    3.4    0.0000   0.0000          ?        ?  1155.7241  22.9868          ?        ?      339.8        3.4       ?       ? 
1 1 1   20   12   67 o    206.9    5.2    0.0000   0.0000          ?        ?   429.0865  21.7097          ?        ?      206.9        5.2       ?       ? 
1 1 1   20   12   68 o    118.9    8.3    0.0000   0.0000          ?        ?   142.3903  19.7942          ?        ?      118.9        8.3       ?       ? 
1 1 1   20   12   69 o     86.6   11.1    0.0000   0.0000          ?        ?    75.9841  19.1556          ?        ?       86.6       11.1       ?       ? 
1 1 1   20   12   70 o     40.9   16.4    0.0000   0.0000          ?        ?     8.9393  20.4327          ?        ?       40.9       16.4       ?       ? 
1 1 1   20   12   71 o    149.0    6.9    0.0000   0.0000          ?        ?   223.4826  20.4327          ?        ?      149.0        6.9       ?       ? 
1 1 1   20   12   72 o    155.8    7.0    0.0000   0.0000          ?        ?   244.5538  21.7097          ?        ?      155.8        7.0       ?       ? 
1 1 1   20   12   73 o    157.6    6.9    0.0000   0.0000          ?        ?   250.3005  21.7097          ?        ?      157.6        6.9       ?       ? 
1 1 1   20   12   74 o    102.9   10.2    0.0000   0.0000          ?        ?   107.9102  21.0712          ?        ?      102.9       10.2       ?       ? 
1 1 1   20   12   75 o     40.2   16.5    0.0000   0.0000          ?        ?     7.6623  21.0712          ?        ?       40.2       16.5       ?       ? 
1 1 1   20   13    0 f     23.7   15.2    1.2770  15.9630     1.2770  15.9630     1.2770  15.9630       23.7     15.2       23.7       15.2     0.0     0.0 
1 1 1   20   13    1 o    756.2    3.5    0.0000   0.0000          ?        ?  5717.9609  53.6358          ?        ?      756.2        3.5       ?       ? 
1 1 1   20   13    2 o   1782.0    6.8    0.0000   0.0000          ?        ? 31761.3438 243.2767          ?        ?     1782.0        6.8       ?       ? 
1 1 1   20   13    3 o    190.6    2.7    0.0000   0.0000          ?        ?   363.3188  10.2163          ?        ?      190.6        2.7       ?       ? 
1 1 1   20   13    4 o   1090.0    4.5    0.0000   0.0000          ?        ? 11882.2490  97.0553          ?        ?     1090.0        4.5       ?       ? 
1 1 1   20   13    5 o    274.6    3.1    0.0000   0.0000          ?        ?   754.0941  17.2401          ?        ?      274.6        3.1       ?       ? 
1 1 1   20   13    6 o   1729.4    6.6    0.0000   0.0000          ?        ? 29912.1855 226.6752          ?        ?     1729.4        6.6       ?       ? 
1 1 1   20   13    7 o    531.0    2.5    0.0000   0.0000          ?        ?  2819.7114  26.1794          ?        ?      531.0        2.5       ?       ? 
1 1 1   20   13    8 o   1784.9    6.4    0.0000   0.0000          ?        ? 31862.2285 229.8678          ?        ?     1784.9        6.4       ?       ? 
1 1 1   20   13    9 o    240.5    2.5    0.0000   0.0000          ?        ?   578.5006  12.1319          ?        ?      240.5        2.5       ?       ? 
1 1 1   20   13   10 o    894.9    3.4    0.0000   0.0000          ?        ?  8008.3379  60.6596          ?        ?      894.9        3.4       ?       ? 
1 1 1   20   13   11 o    984.2    3.5    0.0000   0.0000          ?        ?  9686.3730  69.5989          ?        ?      984.2        3.5       ?       ? 
1 1 1   20   13   12 o    649.7    2.7    0.0000   0.0000          ?        ?  4220.6279  34.4802          ?        ?      649.7        2.7       ?       ? 
1 1 1   20   13   13 o    455.1    2.2    0.0000   0.0000          ?        ?  2071.3640  20.4327          ?        ?      455.1        2.2       ?       ? 
1 1 1   20   13   14 o   1115.8    4.1    0.0000   0.0000          ?        ? 12451.1719  92.5856          ?        ?     1115.8        4.1       ?       ? 
1 1 1   20   13   15 o    892.8    3.5    0.0000   0.0000          ?        ?  7970.6660  62.5751          ?        ?      892.8        3.5       ?       ? 
1 1 1   20   13   16 f    535.9    2.5    0.0000   0.0000          ?        ?  2871.4319  26.8179          ?        ?      535.9        2.5       ?       ? 
1 1 1   20   13   17 o    743.6    3.0    0.0000   0.0000          ?        ?  5530.2358  44.6965          ?        ?      743.6        3.0       ?       ? 
1 1 1   20   13   18 o   1885.0    6.5    0.0000   0.0000          ?        ? 35538.1992 243.2767          ?        ?     1885.0        6.5       ?       ? 
1 1 1   20   13   19 o    375.3    2.6    0.0000   0.0000          ?        ?  1408.5787  19.1556          ?        ?      375.3        2.6       ?       ? 
1 1 1   20   13   20 o    514.8    2.4    0.0000   0.0000          ?        ?  2649.8647  24.9023          ?        ?      514.8        2.4       ?       ? 
1 1 1   20   13   21 o    500.7    2.6    0.0000   0.0000          ?        ?  2507.4746  25.5409          ?        ?      500.7        2.6       ?       ? 
1 1 1   20   13   22 o    623.6    2.8    0.0000   0.0000          ?        ?  3889.2351  34.4802          ?        ?      623.6        2.8       ?       ? 
1 1 1   20   13   23 o   1501.7    5.3    0.0000   0.0000          ?        ? 22553.2227 158.3534          ?        ?     1501.7        5.3       ?       ? 
1 1 1   20   13   24 o   1177.9    4.2    0.0000   0.0000          ?        ? 13875.0752  98.9709          ?        ?     1177.9        4.2       ?       ? 
1 1 1   20   13   25 o    912.6    3.4    0.0000   0.0000          ?        ?  8328.2383  61.9366          ?        ?      912.6        3.4       ?       ? 
1 1 1   20   13   26 f    563.9    2.7    0.0000   0.0000          ?        ?  3179.8376  30.6490          ?        ?      563.9        2.7       ?       ? 
1 1 1   20   13   27 o   1333.2    4.7    0.0000   0.0000          ?        ? 17775.8027 125.1502          ?        ?     1333.2        4.7       ?       ? 
1 1 1   20   13   28 o    795.1    3.3    0.0000   0.0000          ?        ?  6322.0024  52.3588          ?        ?      795.1        3.3       ?       ? 
1 1 1   20   13   29 o    802.3    3.2    0.0000   0.0000          ?        ?  6436.9365  51.0817          ?        ?      802.3        3.2       ?       ? 
1 1 1   20   13   30 o    490.9    2.6    0.0000   0.0000          ?        ?  2409.7805  25.5409          ?        ?      490.9        2.6       ?       ? 
1 1 1   20   13   31 o   1127.8    4.1    0.0000   0.0000          ?        ? 12720.6279  91.9471          ?        ?     1127.8        4.1       ?       ? 
1 1 1   20   13   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   13   33 o    494.0    2.6    0.0000   0.0000          ?        ?  2440.4297  26.1794          ?        ?      494.0        2.6       ?       ? 
1 1 1   20   13   34 o    527.9    2.7    0.0000   0.0000          ?        ?  2786.5083  28.7335          ?        ?      527.9        2.7       ?       ? 
1 1 1   20   13   35 o   1037.3    3.8    0.0000   0.0000          ?        ? 10760.3662  77.8996          ?        ?     1037.3        3.8       ?       ? 
1 1 1   20   13   36 f    377.2    2.9    0.0000   0.0000          ?        ?  1422.6262  21.7097          ?        ?      377.2        2.9       ?       ? 
1 1 1   20   13   37 o    321.9    3.0    0.0000   0.0000          ?        ?  1036.3207  19.1556          ?        ?      321.9        3.0       ?       ? 
1 1 1   20   13   38 o    744.0    3.0    0.0000   0.0000          ?        ?  5535.9824  45.3350          ?        ?      744.0        3.0       ?       ? 
1 1 1   20   13   39 o    402.1    2.7    0.0000   0.0000          ?        ?  1617.3752  21.7097          ?        ?      402.1        2.7       ?       ? 
1 1 1   20   13   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   13   41 o    266.1    3.4    0.0000   0.0000          ?        ?   708.1205  17.8786          ?        ?      266.1        3.4       ?       ? 
1 1 1   20   13   42 o    240.6    3.7    0.0000   0.0000          ?        ?   579.1391  17.8786          ?        ?      240.6        3.7       ?       ? 
1 1 1   20   13   43 o    314.8    3.0    0.0000   0.0000          ?        ?   990.9855  19.1556          ?        ?      314.8        3.0       ?       ? 
1 1 1   20   13   44 o    511.7    2.8    0.0000   0.0000          ?        ?  2618.5771  28.7335          ?        ?      511.7        2.8       ?       ? 
1 1 1   20   13   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   13   46 o    529.6    2.8    0.0000   0.0000          ?        ?  2805.6641  29.3720          ?        ?      529.6        2.8       ?       ? 
1 1 1   20   13   47 f    178.4    5.0    0.0000   0.0000          ?        ?   318.6223  17.8786          ?        ?      178.4        5.0       ?       ? 
1 1 1   20   13   48 o    267.5    3.5    0.0000   0.0000          ?        ?   715.7827  18.5171          ?        ?      267.5        3.5       ?       ? 
1 1 1   20   13   49 o    202.6    4.4    0.0000   0.0000          ?        ?   410.5694  17.8786          ?        ?      202.6        4.4       ?       ? 
1 1 1   20   13   50 o    208.0    4.5    0.0000   0.0000          ?        ?   432.9177  18.5171          ?        ?      208.0        4.5       ?       ? 
1 1 1   20   13   51 o    329.9    3.1    0.0000   0.0000          ?        ?  1088.6793  20.4327          ?        ?      329.9        3.1       ?       ? 
1 1 1   20   13   52 o    108.0    8.3    0.0000   0.0000          ?        ?   116.8494  17.8786          ?        ?      108.0        8.3       ?       ? 
1 1 1   20   13   53 o    136.9    7.0    0.0000   0.0000          ?        ?   187.7254  19.1556          ?        ?      136.9        7.0       ?       ? 
1 1 1   20   13   54 o    487.3    2.7    0.0000   0.0000          ?        ?  2375.3005  26.1794          ?        ?      487.3        2.7       ?       ? 
1 1 1   20   13   55 o    147.9    6.0    0.0000   0.0000          ?        ?   219.0129  17.8786          ?        ?      147.9        6.0       ?       ? 
1 1 1   20   13   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   13   57 o    370.4    2.9    0.0000   0.0000          ?        ?  1372.8215  21.7097          ?        ?      370.4        2.9       ?       ? 
1 1 1   20   13   58 f    417.6    2.8    0.0000   0.0000          ?        ?  1744.4412  23.6253          ?        ?      417.6        2.8       ?       ? 
1 1 1   20   13   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   13   60 o    338.5    3.2    0.0000   0.0000          ?        ?  1146.7849  21.7097          ?        ?      338.5        3.2       ?       ? 
1 1 1   20   13   61 o    263.9    3.7    0.0000   0.0000          ?        ?   697.2656  19.7942          ?        ?      263.9        3.7       ?       ? 
1 1 1   20   13   62 o    399.9    2.9    0.0000   0.0000          ?        ?  1600.1353  22.9868          ?        ?      399.9        2.9       ?       ? 
1 1 1   20   13   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   13   64 o    302.9    3.7    0.0000   0.0000          ?        ?   918.1941  22.3483          ?        ?      302.9        3.7       ?       ? 
1 1 1   20   13   65 o    242.0    4.5    0.0000   0.0000          ?        ?   586.8014  21.7097          ?        ?      242.0        4.5       ?       ? 
1 1 1   20   13   66 o     25.0   12.3    0.0000   0.0000          ?        ?   -42.1424  21.0712          ?        ?       25.0       12.3       ?       ? 
1 1 1   20   13   67 o     74.4   13.8    0.0000   0.0000          ?        ?    58.1055  19.7942          ?        ?       74.4       13.8       ?       ? 
1 1 1   20   13   68 o    122.2    8.9    0.0000   0.0000          ?        ?   150.6911  21.7097          ?        ?      122.2        8.9       ?       ? 
1 1 1   20   13   69 o    322.4    3.7    0.0000   0.0000          ?        ?  1040.7903  23.6253          ?        ?      322.4        3.7       ?       ? 
1 1 1   20   13   70 f    170.4    6.4    0.0000   0.0000          ?        ?   291.8044  21.7097          ?        ?      170.4        6.4       ?       ? 
1 1 1   20   13   71 o     37.3   15.9    0.0000   0.0000          ?        ?     0.6385  21.0712          ?        ?       37.3       15.9       ?       ? 
1 1 1   20   13   72 o     43.5   16.5    0.0000   0.0000          ?        ?    14.6860  19.7942          ?        ?       43.5       16.5       ?       ? 
1 1 1   20   13   73 o    159.6    6.4    0.0000   0.0000          ?        ?   256.6857  20.4327          ?        ?      159.6        6.4       ?       ? 
1 1 1   20   13   74 o     20.2   10.2    0.0000   0.0000          ?        ?   -65.1292  19.7942          ?        ?       20.2       10.2       ?       ? 
1 1 1   20   14    0 o   2489.8   14.9 62016.4141 743.2392 62016.4141 743.2392 62016.4141 743.2392     2489.8     14.9     2489.8       14.9     0.0     0.0 
1 1 1   20   14    1 o   1748.4    7.1    0.0000   0.0000          ?        ? 30573.6934 248.3849          ?        ?     1748.4        7.1       ?       ? 
1 1 1   20   14    2 o    730.6    3.4    0.0000   0.0000          ?        ?  5338.6792  49.8047          ?        ?      730.6        3.4       ?       ? 
1 1 1   20   14    3 o   1299.4    5.4    0.0000   0.0000          ?        ? 16885.0645 139.8362          ?        ?     1299.4        5.4       ?       ? 
1 1 1   20   14    4 o    586.9    2.8    0.0000   0.0000          ?        ?  3444.8242  33.2031          ?        ?      586.9        2.8       ?       ? 
1 1 1   20   14    5 f    392.4    2.4    0.0000   0.0000          ?        ?  1540.1141  19.1556          ?        ?      392.4        2.4       ?       ? 
1 1 1   20   14    6 o   1212.3    4.8    0.0000   0.0000          ?        ? 14698.7676 116.2109          ?        ?     1212.3        4.8       ?       ? 
1 1 1   20   14    7 o   1847.7    6.4    0.0000   0.0000          ?        ? 34143.6641 237.5300          ?        ?     1847.7        6.4       ?       ? 
1 1 1   20   14    8 o   2125.0    7.0    0.0000   0.0000          ?        ? 45161.3555 298.1896          ?        ?     2125.0        7.0       ?       ? 
1 1 1   20   14    9 o   1878.8    6.7    0.0000   0.0000          ?        ? 35305.7734 252.2160          ?        ?     1878.8        6.7       ?       ? 
1 1 1   20   14   10 o   1198.9    4.0    0.0000   0.0000          ?        ? 14375.0381  96.4168          ?        ?     1198.9        4.0       ?       ? 
1 1 1   20   14   11 o     70.6    8.1    0.0000   0.0000          ?        ?    49.8047  11.4934          ?        ?       70.6        8.1       ?       ? 
1 1 1   20   14   12 o   1093.0    4.1    0.0000   0.0000          ?        ? 11948.0166  88.7545          ?        ?     1093.0        4.1       ?       ? 
1 1 1   20   14   13 o    976.5    3.7    0.0000   0.0000          ?        ?  9535.6816  72.7915          ?        ?      976.5        3.7       ?       ? 
1 1 1   20   14   14 o   1136.5    4.0    0.0000   0.0000          ?        ? 12917.2930  91.9471          ?        ?     1136.5        4.0       ?       ? 
1 1 1   20   14   15 o   1542.8    5.5    0.0000   0.0000          ?        ? 23804.7246 170.4853          ?        ?     1542.8        5.5       ?       ? 
1 1 1   20   14   16 o   1659.7    5.5    0.0000   0.0000          ?        ? 27550.9297 182.6172          ?        ?     1659.7        5.5       ?       ? 
1 1 1   20   14   17 o    381.6    3.2    0.0000   0.0000          ?        ?  1456.4679  24.2638          ?        ?      381.6        3.2       ?       ? 
1 1 1   20   14   18 o    658.0    3.0    0.0000   0.0000          ?        ?  4329.1768  39.5883          ?        ?      658.0        3.0       ?       ? 
1 1 1   20   14   19 o   1243.9    4.5    0.0000   0.0000          ?        ? 15473.2949 111.1028          ?        ?     1243.9        4.5       ?       ? 
1 1 1   20   14   20 o   1390.3    4.8    0.0000   0.0000          ?        ? 19332.5195 133.4510          ?        ?     1390.3        4.8       ?       ? 
1 1 1   20   14   21 o     90.7    7.0    0.0000   0.0000          ?        ?    82.3693  12.7704          ?        ?       90.7        7.0       ?       ? 
1 1 1   20   14   22 f   1571.6    5.4    0.0000   0.0000          ?        ? 24703.1250 168.5697          ?        ?     1571.6        5.4       ?       ? 
1 1 1   20   14   23 o    361.5    2.4    0.0000   0.0000          ?        ?  1307.0537  17.2401          ?        ?      361.5        2.4       ?       ? 
1 1 1   20   14   24 o   1285.0    4.4    0.0000   0.0000          ?        ? 16513.4453 113.6568          ?        ?     1285.0        4.4       ?       ? 
1 1 1   20   14   25 o    739.2    3.0    0.0000   0.0000          ?        ?  5465.1069  44.0580          ?        ?      739.2        3.0       ?       ? 
1 1 1   20   14   26 o    766.3    3.0    0.0000   0.0000          ?        ?  5872.4834  45.9736          ?        ?      766.3        3.0       ?       ? 
1 1 1   20   14   27 o    813.8    3.1    0.0000   0.0000          ?        ?  6623.3853  51.0817          ?        ?      813.8        3.1       ?       ? 
1 1 1   20   14   28 o    613.1    2.8    0.0000   0.0000          ?        ?  3759.6152  34.4802          ?        ?      613.1        2.8       ?       ? 
1 1 1   20   14   29 o    839.9    3.2    0.0000   0.0000          ?        ?  7054.3872  54.2743          ?        ?      839.9        3.2       ?       ? 
1 1 1   20   14   30 o    935.4    3.5    0.0000   0.0000          ?        ?  8750.9385  65.1292          ?        ?      935.4        3.5       ?       ? 
1 1 1   20   14   31 o    825.3    3.2    0.0000   0.0000          ?        ?  6811.7490  52.9973          ?        ?      825.3        3.2       ?       ? 
1 1 1   20   14   32 o    201.5    3.8    0.0000   0.0000          ?        ?   406.0997  15.3245          ?        ?      201.5        3.8       ?       ? 
1 1 1   20   14   33 o    349.9    3.1    0.0000   0.0000          ?        ?  1224.6844  21.7097          ?        ?      349.9        3.1       ?       ? 
1 1 1   20   14   34 o    809.2    3.2    0.0000   0.0000          ?        ?  6548.0391  52.3588          ?        ?      809.2        3.2       ?       ? 
1 1 1   20   14   35 o    227.3    3.8    0.0000   0.0000          ?        ?   516.5640  17.2401          ?        ?      227.3        3.8       ?       ? 
1 1 1   20   14   36 o    770.7    3.1    0.0000   0.0000          ?        ?  5940.1665  47.8891          ?        ?      770.7        3.1       ?       ? 
1 1 1   20   14   37 o   1205.2    4.2    0.0000   0.0000          ?        ? 14528.2832 102.1635          ?        ?     1205.2        4.2       ?       ? 
1 1 1   20   14   38 o   1061.6    3.9    0.0000   0.0000          ?        ? 11272.4609  83.6463          ?        ?     1061.6        3.9       ?       ? 
1 1 1   20   14   39 o    132.2    6.8    0.0000   0.0000          ?        ?   174.9549  17.8786          ?        ?      132.2        6.8       ?       ? 
1 1 1   20   14   40 o    370.0    2.8    0.0000   0.0000          ?        ?  1368.9904  20.4327          ?        ?      370.0        2.8       ?       ? 
1 1 1   20   14   41 o    578.5    2.6    0.0000   0.0000          ?        ?  3347.1304  30.6490          ?        ?      578.5        2.6       ?       ? 
1 1 1   20   14   42 o    354.6    2.8    0.0000   0.0000          ?        ?  1257.2490  19.7942          ?        ?      354.6        2.8       ?       ? 
1 1 1   20   14   43 o    287.1    3.2    0.0000   0.0000          ?        ?   824.3315  18.5171          ?        ?      287.1        3.2       ?       ? 
1 1 1   20   14   44 o     37.1   14.6    0.0000   0.0000          ?        ?     7.6623  15.9630          ?        ?       37.1       14.6       ?       ? 
1 1 1   20   14   45 o    459.2    2.8    0.0000   0.0000          ?        ?  2109.0369  25.5409          ?        ?      459.2        2.8       ?       ? 
1 1 1   20   14   46 o    187.2    4.6    0.0000   0.0000          ?        ?   350.5484  17.2401          ?        ?      187.2        4.6       ?       ? 
1 1 1   20   14   47 o    367.1    2.8    0.0000   0.0000          ?        ?  1347.9192  20.4327          ?        ?      367.1        2.8       ?       ? 
1 1 1   20   14   48 o    354.7    2.8    0.0000   0.0000          ?        ?  1258.5261  19.7942          ?        ?      354.7        2.8       ?       ? 
1 1 1   20   14   49 o    413.4    2.7    0.0000   0.0000          ?        ?  1709.3225  22.3483          ?        ?      413.4        2.7       ?       ? 
1 1 1   20   14   50 o    460.8    2.6    0.0000   0.0000          ?        ?  2123.7229  24.2638          ?        ?      460.8        2.6       ?       ? 
1 1 1   20   14   51 o     65.9   13.5    0.0000   0.0000          ?        ?    45.3350  17.2401          ?        ?       65.9       13.5       ?       ? 
1 1 1   20   14   52 o    152.1    5.9    0.0000   0.0000          ?        ?   231.7833  17.8786          ?        ?      152.1        5.9       ?       ? 
1 1 1   20   14   53 o     55.9   15.5    0.0000   0.0000          ?        ?    32.5646  17.8786          ?        ?       55.9       15.5       ?       ? 
1 1 1   20   14   54 o    187.1    4.8    0.0000   0.0000          ?        ?   350.5484  17.8786          ?        ?      187.1        4.8       ?       ? 
1 1 1   20   14   55 o    104.0    8.6    0.0000   0.0000          ?        ?   108.5487  17.8786          ?        ?      104.0        8.6       ?       ? 
1 1 1   20   14   56 f    112.5    8.2    0.0000   0.0000          ?        ?   127.0658  18.5171          ?        ?      112.5        8.2       ?       ? 
1 1 1   20   14   57 o    485.9    2.7    0.0000   0.0000          ?        ?  2361.8914  26.1794          ?        ?      485.9        2.7       ?       ? 
1 1 1   20   14   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   14   59 o    279.7    3.7    0.0000   0.0000          ?        ?   782.8275  20.4327          ?        ?      279.7        3.7       ?       ? 
1 1 1   20   14   60 o    117.5    8.2    0.0000   0.0000          ?        ?   138.5592  19.1556          ?        ?      117.5        8.2       ?       ? 
1 1 1   20   14   61 o     27.8   13.1    0.0000   0.0000          ?        ?   -21.7097  19.1556          ?        ?       27.8       13.1       ?       ? 
1 1 1   20   14   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   14   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   14   64 f    186.5    5.5    0.0000   0.0000          ?        ?   348.6328  20.4327          ?        ?      186.5        5.5       ?       ? 
1 1 1   20   14   65 o    409.2    3.0    0.0000   0.0000          ?        ?  1676.1193  24.2638          ?        ?      409.2        3.0       ?       ? 
1 1 1   20   14   66 o     25.9   12.6    0.0000   0.0000          ?        ?   -37.6728  21.0712          ?        ?       25.9       12.6       ?       ? 
1 1 1   20   14   67 o     30.9   14.2    0.0000   0.0000          ?        ?   -15.3245  20.4327          ?        ?       30.9       14.2       ?       ? 
1 1 1   20   14   68 o    160.2    6.6    0.0000   0.0000          ?        ?   257.9627  21.0712          ?        ?      160.2        6.6       ?       ? 
1 1 1   20   14   69 o     95.6   10.4    0.0000   0.0000          ?        ?    92.5856  19.7942          ?        ?       95.6       10.4       ?       ? 
1 1 1   20   14   70 o     40.0   16.1    0.0000   0.0000          ?        ?     8.3008  19.7942          ?        ?       40.0       16.1       ?       ? 
1 1 1   20   14   71 o     61.1   16.0    0.0000   0.0000          ?        ?    40.2269  19.7942          ?        ?       61.1       16.0       ?       ? 
1 1 1   20   14   72 o     21.2   10.7    0.0000   0.0000          ?        ?   -61.2981  20.4327          ?        ?       21.2       10.7       ?       ? 
1 1 1   20   14   73 o    106.9    9.3    0.0000   0.0000          ?        ?   116.2109  19.7942          ?        ?      106.9        9.3       ?       ? 
1 1 1   20   14   74 o    183.9    5.6    0.0000   0.0000          ?        ?   340.3320  20.4327          ?        ?      183.9        5.6       ?       ? 
1 1 1   20   15    0 o   2156.5   12.3 46520.1328 528.6959 46520.1328 528.6959 46520.1328 528.6959     2156.5     12.3     2156.5       12.3     0.0     0.0 
1 1 1   20   15    1 o    313.7    3.0    0.0000   0.0000          ?        ?   983.9619  18.5171          ?        ?      313.7        3.0       ?       ? 
1 1 1   20   15    2 o   1156.4    4.5    0.0000   0.0000          ?        ? 13373.1963 104.7175          ?        ?     1156.4        4.5       ?       ? 
1 1 1   20   15    3 o   1366.1    5.1    0.0000   0.0000          ?        ? 18664.6270 138.5592          ?        ?     1366.1        5.1       ?       ? 
1 1 1   20   15    4 o    599.6    2.7    0.0000   0.0000          ?        ?  3594.8767  32.5646          ?        ?      599.6        2.7       ?       ? 
1 1 1   20   15    5 o    388.6    2.7    0.0000   0.0000          ?        ?  1510.1036  21.0712          ?        ?      388.6        2.7       ?       ? 
1 1 1   20   15    6 o    250.9    2.3    0.0000   0.0000          ?        ?   629.5823  11.4934          ?        ?      250.9        2.3       ?       ? 
1 1 1   20   15    7 o    830.1    3.1    0.0000   0.0000          ?        ?  6890.9253  51.7203          ?        ?      830.1        3.1       ?       ? 
1 1 1   20   15    8 o   1374.7    4.6    0.0000   0.0000          ?        ? 18899.6016 127.7043          ?        ?     1374.7        4.6       ?       ? 
1 1 1   20   15    9 o    803.3    2.9    0.0000   0.0000          ?        ?  6453.5381  47.2506          ?        ?      803.3        2.9       ?       ? 
1 1 1   20   15   10 o   1757.7    6.0    0.0000   0.0000          ?        ? 30900.6152 211.3506          ?        ?     1757.7        6.0       ?       ? 
1 1 1   20   15   11 o    568.0    2.4    0.0000   0.0000          ?        ?  3225.8113  27.4564          ?        ?      568.0        2.4       ?       ? 
1 1 1   20   15   12 o    633.8    3.3    0.0000   0.0000          ?        ?  4016.9395  41.5039          ?        ?      633.8        3.3       ?       ? 
1 1 1   20   15   13 f    520.6    2.4    0.0000   0.0000          ?        ?  2710.5244  24.9023          ?        ?      520.6        2.4       ?       ? 
1 1 1   20   15   14 o    484.1    2.4    0.0000   0.0000          ?        ?  2343.3743  22.9868          ?        ?      484.1        2.4       ?       ? 
1 1 1   20   15   15 o   1564.1    5.5    0.0000   0.0000          ?        ? 24466.2324 171.1238          ?        ?     1564.1        5.5       ?       ? 
1 1 1   20   15   16 o    157.6    4.9    0.0000   0.0000          ?        ?   248.3849  15.3245          ?        ?      157.6        4.9       ?       ? 
1 1 1   20   15   17 o   1035.8    3.7    0.0000   0.0000          ?        ? 10730.3555  77.2611          ?        ?     1035.8        3.7       ?       ? 
1 1 1   20   15   18 o   1249.3    4.5    0.0000   0.0000          ?        ? 15609.9375 112.3798          ?        ?     1249.3        4.5       ?       ? 
1 1 1   20   15   19 o    845.1    3.2    0.0000   0.0000          ?        ?  7141.8643  53.6358          ?        ?      845.1        3.2       ?       ? 
1 1 1   20   15   20 o   1555.5    5.4    0.0000   0.0000          ?        ? 24200.6094 168.5697          ?        ?     1555.5        5.4       ?       ? 
1 1 1   20   15   21 o    682.5    2.8    0.0000   0.0000          ?        ?  4658.0151  37.6728          ?        ?      682.5        2.8       ?       ? 
1 1 1   20   15   22 o    284.3    2.8    0.0000   0.0000          ?        ?   808.3683  15.9630          ?        ?      284.3        2.8       ?       ? 
1 1 1   20   15   23 o    463.8    2.3    0.0000   0.0000          ?        ?  2151.1792  21.7097          ?        ?      463.8        2.3       ?       ? 
1 1 1   20   15   24 o    122.2    6.0    0.0000   0.0000          ?        ?   149.4141  14.6860          ?        ?      122.2        6.0       ?       ? 
1 1 1   20   15   25 f    483.2    2.6    0.0000   0.0000          ?        ?  2335.0737  25.5409          ?        ?      483.2        2.6       ?       ? 
1 1 1   20   15   26 o   1031.3    3.7    0.0000   0.0000          ?        ? 10637.1318  77.2611          ?        ?     1031.3        3.7       ?       ? 
1 1 1   20   15   27 o    989.8    3.6    0.0000   0.0000          ?        ?  9796.8379  70.8759          ?        ?      989.8        3.6       ?       ? 
1 1 1   20   15   28 o    309.7    2.6    0.0000   0.0000          ?        ?   959.0594  15.9630          ?        ?      309.7        2.6       ?       ? 
1 1 1   20   15   29 o    195.7    3.8    0.0000   0.0000          ?        ?   383.1130  14.6860          ?        ?      195.7        3.8       ?       ? 
1 1 1   20   15   30 o    227.8    3.5    0.0000   0.0000          ?        ?   519.1181  15.9630          ?        ?      227.8        3.5       ?       ? 
1 1 1   20   15   31 o    561.0    2.6    0.0000   0.0000          ?        ?  3147.2729  29.3720          ?        ?      561.0        2.6       ?       ? 
1 1 1   20   15   32 o    680.2    3.1    0.0000   0.0000          ?        ?  4626.7275  42.1424          ?        ?      680.2        3.1       ?       ? 
1 1 1   20   15   33 o     20.9   10.3    0.0000   0.0000          ?        ?   -30.0105  14.6860          ?        ?       20.9       10.3       ?       ? 
1 1 1   20   15   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   15   35 o    615.1    2.8    0.0000   0.0000          ?        ?  3783.2407  33.8416          ?        ?      615.1        2.8       ?       ? 
1 1 1   20   15   36 o    204.5    4.1    0.0000   0.0000          ?        ?   418.2317  16.6016          ?        ?      204.5        4.1       ?       ? 
1 1 1   20   15   37 o    560.0    2.7    0.0000   0.0000          ?        ?  3136.4182  30.6490          ?        ?      560.0        2.7       ?       ? 
1 1 1   20   15   38 o    209.7    4.1    0.0000   0.0000          ?        ?   439.9414  17.2401          ?        ?      209.7        4.1       ?       ? 
1 1 1   20   15   39 o    902.8    3.5    0.0000   0.0000          ?        ?  8152.0054  62.5751          ?        ?      902.8        3.5       ?       ? 
1 1 1   20   15   40 o    291.6    3.2    0.0000   0.0000          ?        ?   850.5108  18.5171          ?        ?      291.6        3.2       ?       ? 
1 1 1   20   15   41 o    490.5    2.7    0.0000   0.0000          ?        ?  2406.5879  26.1794          ?        ?      490.5        2.7       ?       ? 
1 1 1   20   15   42 o    441.3    2.7    0.0000   0.0000          ?        ?  1948.1295  23.6253          ?        ?      441.3        2.7       ?       ? 
1 1 1   20   15   43 o    173.7    5.0    0.0000   0.0000          ?        ?   302.0207  17.2401          ?        ?      173.7        5.0       ?       ? 
1 1 1   20   15   44 o    424.2    2.6    0.0000   0.0000          ?        ?  1799.3539  22.3483          ?        ?      424.2        2.6       ?       ? 
1 1 1   20   15   45 o    538.2    2.6    0.0000   0.0000          ?        ?  2896.9727  28.0950          ?        ?      538.2        2.6       ?       ? 
1 1 1   20   15   46 o    378.7    2.7    0.0000   0.0000          ?        ?  1434.7581  20.4327          ?        ?      378.7        2.7       ?       ? 
1 1 1   20   15   47 o    250.6    3.6    0.0000   0.0000          ?        ?   628.3053  17.8786          ?        ?      250.6        3.6       ?       ? 
1 1 1   20   15   48 o    205.4    4.2    0.0000   0.0000          ?        ?   422.0628  17.2401          ?        ?      205.4        4.2       ?       ? 
1 1 1   20   15   49 o    368.6    2.9    0.0000   0.0000          ?        ?  1358.7740  21.0712          ?        ?      368.6        2.9       ?       ? 
1 1 1   20   15   50 o    447.7    2.6    0.0000   0.0000          ?        ?  2004.9579  23.6253          ?        ?      447.7        2.6       ?       ? 
1 1 1   20   15   51 o    232.4    3.8    0.0000   0.0000          ?        ?   540.1893  17.8786          ?        ?      232.4        3.8       ?       ? 
1 1 1   20   15   52 o    374.7    2.8    0.0000   0.0000          ?        ?  1404.7476  21.0712          ?        ?      374.7        2.8       ?       ? 
1 1 1   20   15   53 o    341.5    3.1    0.0000   0.0000          ?        ?  1166.5790  21.0712          ?        ?      341.5        3.1       ?       ? 
1 1 1   20   15   54 o    223.9    4.3    0.0000   0.0000          ?        ?   501.8780  19.1556          ?        ?      223.9        4.3       ?       ? 
1 1 1   20   15   55 o     93.0    9.6    0.0000   0.0000          ?        ?    86.8389  17.8786          ?        ?       93.0        9.6       ?       ? 
1 1 1   20   15   56 o    144.6    6.4    0.0000   0.0000          ?        ?   209.4351  18.5171          ?        ?      144.6        6.4       ?       ? 
1 1 1   20   15   57 f     86.1   10.7    0.0000   0.0000          ?        ?    74.7070  18.5171          ?        ?       86.1       10.7       ?       ? 
1 1 1   20   15   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   15   59 o     81.6   11.4    0.0000   0.0000          ?        ?    67.0448  18.5171          ?        ?       81.6       11.4       ?       ? 
1 1 1   20   15   60 o    387.0    3.0    0.0000   0.0000          ?        ?  1498.6102  22.9868          ?        ?      387.0        3.0       ?       ? 
1 1 1   20   15   61 o    153.3    6.2    0.0000   0.0000          ?        ?   235.6145  19.1556          ?        ?      153.3        6.2       ?       ? 
1 1 1   20   15   62 o     58.9   16.3    0.0000   0.0000          ?        ?    36.3957  19.7942          ?        ?       58.9       16.3       ?       ? 
1 1 1   20   15   63 o     23.8   11.8    0.0000   0.0000          ?        ?   -49.1662  21.0712          ?        ?       23.8       11.8       ?       ? 
1 1 1   20   15   64 o    494.2    2.8    0.0000   0.0000          ?        ?  2443.6223  27.4564          ?        ?      494.2        2.8       ?       ? 
1 1 1   20   15   65 o    214.9    4.9    0.0000   0.0000          ?        ?   462.9282  21.0712          ?        ?      214.9        4.9       ?       ? 
1 1 1   20   15   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   15   67 o    299.5    3.7    0.0000   0.0000          ?        ?   898.3999  22.3483          ?        ?      299.5        3.7       ?       ? 
1 1 1   20   15   68 o     28.9   13.6    0.0000   0.0000          ?        ?   -21.7097  20.4327          ?        ?       28.9       13.6       ?       ? 
1 1 1   20   15   69 o    202.6    5.2    0.0000   0.0000          ?        ?   411.8464  21.0712          ?        ?      202.6        5.2       ?       ? 
1 1 1   20   15   70 o    226.3    4.8    0.0000   0.0000          ?        ?   514.0099  21.7097          ?        ?      226.3        4.8       ?       ? 
1 1 1   20   15   71 o     20.8   10.5    0.0000   0.0000          ?        ?   -65.1292  20.4327          ?        ?       20.8       10.5       ?       ? 
1 1 1   20   15   72 o    380.6    3.2    0.0000   0.0000          ?        ?  1451.3596  24.2638          ?        ?      380.6        3.2       ?       ? 
1 1 1   20   15   73 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   16    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   16    1 o   1111.7    4.8    0.0000   0.0000          ?        ? 12359.8633 106.6331          ?        ?     1111.7        4.8       ?       ? 
1 1 1   20   16    2 o   1386.8    5.6    0.0000   0.0000          ?        ? 19234.8242 154.5222          ?        ?     1386.8        5.6       ?       ? 
1 1 1   20   16    3 o    339.0    2.8    0.0000   0.0000          ?        ?  1149.3389  19.1556          ?        ?      339.0        2.8       ?       ? 
1 1 1   20   16    4 o   1730.9    6.8    0.0000   0.0000          ?        ? 29963.9062 234.3374          ?        ?     1730.9        6.8       ?       ? 
1 1 1   20   16    5 o   1281.5    4.8    0.0000   0.0000          ?        ? 16424.6914 121.9576          ?        ?     1281.5        4.8       ?       ? 
1 1 1   20   16    6 o   1511.1    5.8    0.0000   0.0000          ?        ? 22836.0859 174.9549          ?        ?     1511.1        5.8       ?       ? 
1 1 1   20   16    7 o    658.0    2.6    0.0000   0.0000          ?        ?  4329.1768  33.8416          ?        ?      658.0        2.6       ?       ? 
1 1 1   20   16    8 o    831.5    3.0    0.0000   0.0000          ?        ?  6913.9126  49.8047          ?        ?      831.5        3.0       ?       ? 
1 1 1   20   16    9 o   1421.9    5.2    0.0000   0.0000          ?        ? 20219.4258 147.4985          ?        ?     1421.9        5.2       ?       ? 
1 1 1   20   16   10 o    647.9    2.8    0.0000   0.0000          ?        ?  4198.2798  35.7572          ?        ?      647.9        2.8       ?       ? 
1 1 1   20   16   11 o    349.6    2.0    0.0000   0.0000          ?        ?  1222.1304  14.0475          ?        ?      349.6        2.0       ?       ? 
1 1 1   20   16   12 o   1380.2    4.9    0.0000   0.0000          ?        ? 19052.2090 134.0895          ?        ?     1380.2        4.9       ?       ? 
1 1 1   20   16   13 o    883.0    3.6    0.0000   0.0000          ?        ?  7796.9873  63.2136          ?        ?      883.0        3.6       ?       ? 
1 1 1   20   16   14 o    606.5    2.8    0.0000   0.0000          ?        ?  3678.5229  33.8416          ?        ?      606.5        2.8       ?       ? 
1 1 1   20   16   15 o   1083.4    4.0    0.0000   0.0000          ?        ? 11737.3047  86.2004          ?        ?     1083.4        4.0       ?       ? 
1 1 1   20   16   16 o   2104.9    7.2    0.0000   0.0000          ?        ? 44315.3164 302.0207          ?        ?     2104.9        7.2       ?       ? 
1 1 1   20   16   17 o    722.8    3.0    0.0000   0.0000          ?        ?  5224.3838  42.7809          ?        ?      722.8        3.0       ?       ? 
1 1 1   20   16   18 o   1507.7    5.5    0.0000   0.0000          ?        ? 22735.2012 166.6541          ?        ?     1507.7        5.5       ?       ? 
1 1 1   20   16   19 o     25.8   12.0    0.0000   0.0000          ?        ?   -12.7704  14.6860          ?        ?       25.8       12.0       ?       ? 
1 1 1   20   16   20 o    638.8    2.7    0.0000   0.0000          ?        ?  4080.7915  35.1187          ?        ?      638.8        2.7       ?       ? 
1 1 1   20   16   21 o   1102.6    3.9    0.0000   0.0000          ?        ? 12158.7285  86.2004          ?        ?     1102.6        3.9       ?       ? 
1 1 1   20   16   22 o    425.2    2.3    0.0000   0.0000          ?        ?  1808.2933  19.7942          ?        ?      425.2        2.3       ?       ? 
1 1 1   20   16   23 o    971.5    3.5    0.0000   0.0000          ?        ?  9439.2656  67.6833          ?        ?      971.5        3.5       ?       ? 
1 1 1   20   16   24 o    250.4    2.9    0.0000   0.0000          ?        ?   627.0282  14.6860          ?        ?      250.4        2.9       ?       ? 
1 1 1   20   16   25 o    714.6    2.9    0.0000   0.0000          ?        ?  5106.2573  41.5039          ?        ?      714.6        2.9       ?       ? 
1 1 1   20   16   26 o   1306.0    4.4    0.0000   0.0000          ?        ? 17059.3828 115.5724          ?        ?     1306.0        4.4       ?       ? 
1 1 1   20   16   27 o    665.9    2.8    0.0000   0.0000          ?        ?  4434.5327  37.0343          ?        ?      665.9        2.8       ?       ? 
1 1 1   20   16   28 o    699.8    2.9    0.0000   0.0000          ?        ?  4898.0991  40.8654          ?        ?      699.8        2.9       ?       ? 
1 1 1   20   16   29 o    423.8    2.6    0.0000   0.0000          ?        ?  1796.1613  22.3483          ?        ?      423.8        2.6       ?       ? 
1 1 1   20   16   30 o    566.4    2.6    0.0000   0.0000          ?        ?  3207.9326  30.0105          ?        ?      566.4        2.6       ?       ? 
1 1 1   20   16   31 o    340.1    2.6    0.0000   0.0000          ?        ?  1157.0012  17.8786          ?        ?      340.1        2.6       ?       ? 
1 1 1   20   16   32 o    628.4    2.8    0.0000   0.0000          ?        ?  3948.6179  35.1187          ?        ?      628.4        2.8       ?       ? 
1 1 1   20   16   33 o    714.1    2.9    0.0000   0.0000          ?        ?  5099.2334  41.5039          ?        ?      714.1        2.9       ?       ? 
1 1 1   20   16   34 o    668.5    3.0    0.0000   0.0000          ?        ?  4469.0132  39.5883          ?        ?      668.5        3.0       ?       ? 
1 1 1   20   16   35 o    308.3    3.0    0.0000   0.0000          ?        ?   950.7587  18.5171          ?        ?      308.3        3.0       ?       ? 
1 1 1   20   16   36 o    248.5    3.5    0.0000   0.0000          ?        ?   617.4504  17.2401          ?        ?      248.5        3.5       ?       ? 
1 1 1   20   16   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   16   38 o   1029.2    3.8    0.0000   0.0000          ?        ? 10594.3506  78.5382          ?        ?     1029.2        3.8       ?       ? 
1 1 1   20   16   39 o    194.9    4.3    0.0000   0.0000          ?        ?   379.9204  16.6016          ?        ?      194.9        4.3       ?       ? 
1 1 1   20   16   40 o    594.5    2.7    0.0000   0.0000          ?        ?  3534.8555  31.9261          ?        ?      594.5        2.7       ?       ? 
1 1 1   20   16   41 o    237.4    3.6    0.0000   0.0000          ?        ?   563.8146  17.2401          ?        ?      237.4        3.6       ?       ? 
1 1 1   20   16   42 o    276.3    3.0    0.0000   0.0000          ?        ?   763.6719  16.6016          ?        ?      276.3        3.0       ?       ? 
1 1 1   20   16   43 o    201.9    4.3    0.0000   0.0000          ?        ?   408.0153  17.2401          ?        ?      201.9        4.3       ?       ? 
1 1 1   20   16   44 o    143.3    5.8    0.0000   0.0000          ?        ?   205.6040  16.6016          ?        ?      143.3        5.8       ?       ? 
1 1 1   20   16   45 o    568.9    2.6    0.0000   0.0000          ?        ?  3237.3047  30.0105          ?        ?      568.9        2.6       ?       ? 
1 1 1   20   16   46 o    178.1    4.8    0.0000   0.0000          ?        ?   317.3452  17.2401          ?        ?      178.1        4.8       ?       ? 
1 1 1   20   16   47 o    315.4    3.0    0.0000   0.0000          ?        ?   994.8167  19.1556          ?        ?      315.4        3.0       ?       ? 
1 1 1   20   16   48 o    341.4    2.9    0.0000   0.0000          ?        ?  1165.9406  19.7942          ?        ?      341.4        2.9       ?       ? 
1 1 1   20   16   49 o    172.2    5.0    0.0000   0.0000          ?        ?   296.9126  17.2401          ?        ?      172.2        5.0       ?       ? 
1 1 1   20   16   50 o    118.7    7.3    0.0000   0.0000          ?        ?   141.1133  17.2401          ?        ?      118.7        7.3       ?       ? 
1 1 1   20   16   51 f    530.9    2.8    0.0000   0.0000          ?        ?  2819.7114  29.3720          ?        ?      530.9        2.8       ?       ? 
1 1 1   20   16   52 f    245.8    3.8    0.0000   0.0000          ?        ?   604.6799  18.5171          ?        ?      245.8        3.8       ?       ? 
1 1 1   20   16   53 o    295.6    3.1    0.0000   0.0000          ?        ?   874.1360  18.5171          ?        ?      295.6        3.1       ?       ? 
1 1 1   20   16   54 o     67.9   12.7    0.0000   0.0000          ?        ?    47.8891  16.6016          ?        ?       67.9       12.7       ?       ? 
1 1 1   20   16   55 o     62.4   14.1    0.0000   0.0000          ?        ?    40.8654  17.2401          ?        ?       62.4       14.1       ?       ? 
1 1 1   20   16   56 o    195.3    4.9    0.0000   0.0000          ?        ?   381.8359  19.1556          ?        ?      195.3        4.9       ?       ? 
1 1 1   20   16   57 o     32.3   14.2    0.0000   0.0000          ?        ?    -5.1082  17.8786          ?        ?       32.3       14.2       ?       ? 
1 1 1   20   16   58 o    315.8    3.2    0.0000   0.0000          ?        ?   998.0093  20.4327          ?        ?      315.8        3.2       ?       ? 
1 1 1   20   16   59 o    209.5    4.6    0.0000   0.0000          ?        ?   439.3029  19.1556          ?        ?      209.5        4.6       ?       ? 
1 1 1   20   16   60 o    188.1    5.3    0.0000   0.0000          ?        ?   354.3795  19.7942          ?        ?      188.1        5.3       ?       ? 
1 1 1   20   16   61 o    134.9    7.6    0.0000   0.0000          ?        ?   182.6172  20.4327          ?        ?      134.9        7.6       ?       ? 
1 1 1   20   16   62 o    265.5    3.8    0.0000   0.0000          ?        ?   705.5664  20.4327          ?        ?      265.5        3.8       ?       ? 
1 1 1   20   16   63 o     32.3   14.5    0.0000   0.0000          ?        ?    -9.5778  19.7942          ?        ?       32.3       14.5       ?       ? 
1 1 1   20   16   64 o     47.0   16.9    0.0000   0.0000          ?        ?    19.1556  20.4327          ?        ?       47.0       16.9       ?       ? 
1 1 1   20   16   65 o    242.3    4.5    0.0000   0.0000          ?        ?   588.0784  21.7097          ?        ?      242.3        4.5       ?       ? 
1 1 1   20   16   66 o     81.6   12.5    0.0000   0.0000          ?        ?    67.6833  20.4327          ?        ?       81.6       12.5       ?       ? 
1 1 1   20   16   67 o     26.0   12.6    0.0000   0.0000          ?        ?   -33.8416  20.4327          ?        ?       26.0       12.6       ?       ? 
1 1 1   20   16   68 o    262.7    4.1    0.0000   0.0000          ?        ?   691.5189  21.7097          ?        ?      262.7        4.1       ?       ? 
1 1 1   20   16   69 o    121.9    8.4    0.0000   0.0000          ?        ?   150.0526  20.4327          ?        ?      121.9        8.4       ?       ? 
1 1 1   20   16   70 o     76.9   13.8    0.0000   0.0000          ?        ?    62.5751  20.4327          ?        ?       76.9       13.8       ?       ? 
1 1 1   20   16   71 o     57.3   16.8    0.0000   0.0000          ?        ?    35.1187  20.4327          ?        ?       57.3       16.8       ?       ? 
1 1 1   20   16   72 o     93.8   10.9    0.0000   0.0000          ?        ?    90.0316  20.4327          ?        ?       93.8       10.9       ?       ? 
1 1 1   20   16   73 o    105.6    9.7    0.0000   0.0000          ?        ?   113.6568  20.4327          ?        ?      105.6        9.7       ?       ? 
1 1 1   20   17    0 o    122.5    8.2  151.9681  19.7942   151.9681  19.7942   151.9681  19.7942      122.5      8.2      122.5        8.2     0.0     0.0 
1 1 1   20   17    1 o    615.1    3.2    0.0000   0.0000          ?        ?  3783.2407  39.5883          ?        ?      615.1        3.2       ?       ? 
1 1 1   20   17    2 o    750.7    3.4    0.0000   0.0000          ?        ?  5636.2305  51.7203          ?        ?      750.7        3.4       ?       ? 
1 1 1   20   17    3 o    467.1    2.7    0.0000   0.0000          ?        ?  2181.8284  25.5409          ?        ?      467.1        2.7       ?       ? 
1 1 1   20   17    4 o    937.5    3.9    0.0000   0.0000          ?        ?  8789.8887  73.4300          ?        ?      937.5        3.9       ?       ? 
1 1 1   20   17    5 o   1333.8    5.1    0.0000   0.0000          ?        ? 17791.1289 135.3666          ?        ?     1333.8        5.1       ?       ? 
1 1 1   20   17    6 o     76.6   10.4    0.0000   0.0000          ?        ?    58.7440  15.9630          ?        ?       76.6       10.4       ?       ? 
1 1 1   20   17    7 o   1180.4    4.2    0.0000   0.0000          ?        ? 13934.4580 100.2479          ?        ?     1180.4        4.2       ?       ? 
1 1 1   20   17    8 o    250.9    2.0    0.0000   0.0000          ?        ?   629.5823  10.2163          ?        ?      250.9        2.0       ?       ? 
1 1 1   20   17    9 o    188.9    3.2    0.0000   0.0000          ?        ?   356.9336  12.1319          ?        ?      188.9        3.2       ?       ? 
1 1 1   20   17   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   17   11 o   1336.9    4.6    0.0000   0.0000          ?        ? 17874.1367 121.9576          ?        ?     1336.9        4.6       ?       ? 
1 1 1   20   17   12 o   1332.1    4.5    0.0000   0.0000          ?        ? 17747.0703 120.6806          ?        ?     1332.1        4.5       ?       ? 
1 1 1   20   17   13 o   1690.8    5.8    0.0000   0.0000          ?        ? 28592.3594 197.3032          ?        ?     1690.8        5.8       ?       ? 
1 1 1   20   17   14 o   1130.5    4.0    0.0000   0.0000          ?        ? 12781.9258  90.6701          ?        ?     1130.5        4.0       ?       ? 
1 1 1   20   17   15 o    592.7    2.7    0.0000   0.0000          ?        ?  3513.1460  31.9261          ?        ?      592.7        2.7       ?       ? 
1 1 1   20   17   16 o   1553.1    5.2    0.0000   0.0000          ?        ? 24122.7070 161.5460          ?        ?     1553.1        5.2       ?       ? 
1 1 1   20   17   17 o    230.9    2.8    0.0000   0.0000          ?        ?   533.1656  12.7704          ?        ?      230.9        2.8       ?       ? 
1 1 1   20   17   18 o   1095.1    3.9    0.0000   0.0000          ?        ? 11993.3516  86.2004          ?        ?     1095.1        3.9       ?       ? 
1 1 1   20   17   19 o    525.5    2.5    0.0000   0.0000          ?        ?  2761.6060  26.1794          ?        ?      525.5        2.5       ?       ? 
1 1 1   20   17   20 o    585.7    2.6    0.0000   0.0000          ?        ?  3430.1382  30.6490          ?        ?      585.7        2.6       ?       ? 
1 1 1   20   17   21 o    779.8    3.2    0.0000   0.0000          ?        ?  6080.6416  49.1662          ?        ?      779.8        3.2       ?       ? 
1 1 1   20   17   22 o    209.9    3.3    0.0000   0.0000          ?        ?   440.5799  14.0475          ?        ?      209.9        3.3       ?       ? 
1 1 1   20   17   23 o    618.6    2.7    0.0000   0.0000          ?        ?  3827.2988  33.8416          ?        ?      618.6        2.7       ?       ? 
1 1 1   20   17   24 o     91.1    7.4    0.0000   0.0000          ?        ?    83.0078  13.4090          ?        ?       91.1        7.4       ?       ? 
1 1 1   20   17   25 o    868.4    3.2    0.0000   0.0000          ?        ?  7542.2173  56.1899          ?        ?      868.4        3.2       ?       ? 
1 1 1   20   17   26 o    898.9    3.4    0.0000   0.0000          ?        ?  8080.4912  60.6596          ?        ?      898.9        3.4       ?       ? 
1 1 1   20   17   27 o     94.9    7.1    0.0000   0.0000          ?        ?    90.0316  13.4090          ?        ?       94.9        7.1       ?       ? 
1 1 1   20   17   28 o    539.8    2.6    0.0000   0.0000          ?        ?  2913.5742  28.0950          ?        ?      539.8        2.6       ?       ? 
1 1 1   20   17   29 o    495.9    2.4    0.0000   0.0000          ?        ?  2458.9468  24.2638          ?        ?      495.9        2.4       ?       ? 
1 1 1   20   17   30 o    139.5    4.8    0.0000   0.0000          ?        ?   194.7491  13.4090          ?        ?      139.5        4.8       ?       ? 
1 1 1   20   17   31 f   1103.7    3.8    0.0000   0.0000          ?        ? 12183.6309  84.9234          ?        ?     1103.7        3.8       ?       ? 
1 1 1   20   17   32 o    250.9    3.6    0.0000   0.0000          ?        ?   629.5823  17.8786          ?        ?      250.9        3.6       ?       ? 
1 1 1   20   17   33 o     55.4   14.3    0.0000   0.0000          ?        ?    31.9261  15.9630          ?        ?       55.4       14.3       ?       ? 
1 1 1   20   17   34 o    601.2    2.8    0.0000   0.0000          ?        ?  3614.6707  33.2031          ?        ?      601.2        2.8       ?       ? 
1 1 1   20   17   35 o    543.8    2.6    0.0000   0.0000          ?        ?  2957.6323  28.0950          ?        ?      543.8        2.6       ?       ? 
1 1 1   20   17   36 o    875.2    3.4    0.0000   0.0000          ?        ?  7661.6211  60.0210          ?        ?      875.2        3.4       ?       ? 
1 1 1   20   17   37 f    264.0    3.4    0.0000   0.0000          ?        ?   697.2656  17.8786          ?        ?      264.0        3.4       ?       ? 
1 1 1   20   17   38 o    468.3    2.7    0.0000   0.0000          ?        ?  2193.3218  25.5409          ?        ?      468.3        2.7       ?       ? 
1 1 1   20   17   39 o    448.9    2.5    0.0000   0.0000          ?        ?  2015.1743  22.3483          ?        ?      448.9        2.5       ?       ? 
1 1 1   20   17   40 o    263.1    3.2    0.0000   0.0000          ?        ?   692.1575  16.6016          ?        ?      263.1        3.2       ?       ? 
1 1 1   20   17   41 o    541.1    2.6    0.0000   0.0000          ?        ?  2928.2603  28.0950          ?        ?      541.1        2.6       ?       ? 
1 1 1   20   17   42 o    472.6    2.7    0.0000   0.0000          ?        ?  2234.1870  25.5409          ?        ?      472.6        2.7       ?       ? 
1 1 1   20   17   43 f    447.8    2.6    0.0000   0.0000          ?        ?  2005.5964  23.6253          ?        ?      447.8        2.6       ?       ? 
1 1 1   20   17   44 o    211.7    3.9    0.0000   0.0000          ?        ?   448.2422  16.6016          ?        ?      211.7        3.9       ?       ? 
1 1 1   20   17   45 o    278.7    3.3    0.0000   0.0000          ?        ?   777.0808  18.5171          ?        ?      278.7        3.3       ?       ? 
1 1 1   20   17   46 o    168.3    4.9    0.0000   0.0000          ?        ?   283.5036  16.6016          ?        ?      168.3        4.9       ?       ? 
1 1 1   20   17   47 o    346.0    2.8    0.0000   0.0000          ?        ?  1197.2280  19.1556          ?        ?      346.0        2.8       ?       ? 
1 1 1   20   17   48 o    129.0    6.4    0.0000   0.0000          ?        ?   166.6541  16.6016          ?        ?      129.0        6.4       ?       ? 
1 1 1   20   17   49 o    264.7    3.5    0.0000   0.0000          ?        ?   701.0967  18.5171          ?        ?      264.7        3.5       ?       ? 
1 1 1   20   17   50 f    259.7    3.4    0.0000   0.0000          ?        ?   674.9174  17.8786          ?        ?      259.7        3.4       ?       ? 
1 1 1   20   17   51 o    364.6    3.0    0.0000   0.0000          ?        ?  1330.0405  21.7097          ?        ?      364.6        3.0       ?       ? 
1 1 1   20   17   52 o    100.0    8.6    0.0000   0.0000          ?        ?   100.2479  17.2401          ?        ?      100.0        8.6       ?       ? 
1 1 1   20   17   53 o     58.9   15.5    0.0000   0.0000          ?        ?    36.3957  18.5171          ?        ?       58.9       15.5       ?       ? 
1 1 1   20   17   54 o    572.3    2.7    0.0000   0.0000          ?        ?  3276.8931  31.2876          ?        ?      572.3        2.7       ?       ? 
1 1 1   20   17   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   17   56 o     24.0   11.7    0.0000   0.0000          ?        ?   -34.4802  18.5171          ?        ?       24.0       11.7       ?       ? 
1 1 1   20   17   57 o    576.6    2.8    0.0000   0.0000          ?        ?  3326.6978  32.5646          ?        ?      576.6        2.8       ?       ? 
1 1 1   20   17   58 f     62.3   15.9    0.0000   0.0000          ?        ?    40.8654  19.7942          ?        ?       62.3       15.9       ?       ? 
1 1 1   20   17   59 o    281.0    3.7    0.0000   0.0000          ?        ?   790.4898  21.0712          ?        ?      281.0        3.7       ?       ? 
1 1 1   20   17   60 o    189.9    5.2    0.0000   0.0000          ?        ?   361.4032  19.7942          ?        ?      189.9        5.2       ?       ? 
1 1 1   20   17   61 o    193.7    5.1    0.0000   0.0000          ?        ?   376.0892  19.7942          ?        ?      193.7        5.1       ?       ? 
1 1 1   20   17   62 o     78.6   12.6    0.0000   0.0000          ?        ?    62.5751  19.7942          ?        ?       78.6       12.6       ?       ? 
1 1 1   20   17   63 o    292.9    3.7    0.0000   0.0000          ?        ?   858.8116  21.7097          ?        ?      292.9        3.7       ?       ? 
1 1 1   20   17   64 o    383.5    3.2    0.0000   0.0000          ?        ?  1471.7924  24.2638          ?        ?      383.5        3.2       ?       ? 
1 1 1   20   17   65 o    204.1    5.0    0.0000   0.0000          ?        ?   417.5931  20.4327          ?        ?      204.1        5.0       ?       ? 
1 1 1   20   17   66 o     30.1   13.9    0.0000   0.0000          ?        ?   -15.9630  19.7942          ?        ?       30.1       13.9       ?       ? 
1 1 1   20   17   67 o     85.3   12.4    0.0000   0.0000          ?        ?    74.0685  21.0712          ?        ?       85.3       12.4       ?       ? 
1 1 1   20   17   68 o     40.9   16.4    0.0000   0.0000          ?        ?     8.9393  20.4327          ?        ?       40.9       16.4       ?       ? 
1 1 1   20   17   69 o    204.5    4.8    0.0000   0.0000          ?        ?   419.5087  19.7942          ?        ?      204.5        4.8       ?       ? 
1 1 1   20   17   70 o     38.4   15.7    0.0000   0.0000          ?        ?     6.3852  19.1556          ?        ?       38.4       15.7       ?       ? 
1 1 1   20   17   71 o     54.8   16.6    0.0000   0.0000          ?        ?    31.9261  19.7942          ?        ?       54.8       16.6       ?       ? 
1 1 1   20   17   72 o     70.9   14.9    0.0000   0.0000          ?        ?    54.2743  20.4327          ?        ?       70.9       14.9       ?       ? 
1 1 1   20   18    0 o   1442.7    8.6 20820.2734 248.3849 20820.2734 248.3849 20820.2734 248.3849     1442.7      8.6     1442.7        8.6     0.0     0.0 
1 1 1   20   18    1 o    249.9    4.9    0.0000   0.0000          ?        ?   624.4742  24.2638          ?        ?      249.9        4.9       ?       ? 
1 1 1   20   18    2 o   1649.2    7.0    0.0000   0.0000          ?        ? 27205.4922 231.1448          ?        ?     1649.2        7.0       ?       ? 
1 1 1   20   18    3 o    857.5    4.2    0.0000   0.0000          ?        ?  7353.8530  71.5144          ?        ?      857.5        4.2       ?       ? 
1 1 1   20   18    4 o    282.4    2.1    0.0000   0.0000          ?        ?   797.5135  12.1319          ?        ?      282.4        2.1       ?       ? 
1 1 1   20   18    5 o   1426.4    5.7    0.0000   0.0000          ?        ? 20347.7676 162.8230          ?        ?     1426.4        5.7       ?       ? 
1 1 1   20   18    6 o   1589.1    6.2    0.0000   0.0000          ?        ? 25258.0000 198.5802          ?        ?     1589.1        6.2       ?       ? 
1 1 1   20   18    7 o   1200.9    4.6    0.0000   0.0000          ?        ? 14422.9268 109.8257          ?        ?     1200.9        4.6       ?       ? 
1 1 1   20   18    8 f   1407.3    4.7    0.0000   0.0000          ?        ? 19807.5801 132.8125          ?        ?     1407.3        4.7       ?       ? 
1 1 1   20   18    9 o    671.3    2.7    0.0000   0.0000          ?        ?  4506.6855  36.3957          ?        ?      671.3        2.7       ?       ? 
1 1 1   20   18   10 o   1373.4    4.8    0.0000   0.0000          ?        ? 18865.1211 132.1740          ?        ?     1373.4        4.8       ?       ? 
1 1 1   20   18   11 o    699.9    2.9    0.0000   0.0000          ?        ?  4899.3765  40.2269          ?        ?      699.9        2.9       ?       ? 
1 1 1   20   18   12 o    298.4    2.4    0.0000   0.0000          ?        ?   890.7377  14.0475          ?        ?      298.4        2.4       ?       ? 
1 1 1   20   18   13 o    797.6    3.1    0.0000   0.0000          ?        ?  6361.5908  49.1662          ?        ?      797.6        3.1       ?       ? 
1 1 1   20   18   14 o    139.3    4.6    0.0000   0.0000          ?        ?   194.1106  12.7704          ?        ?      139.3        4.6       ?       ? 
1 1 1   20   18   15 o   2025.2    6.7    0.0000   0.0000          ?        ? 41023.7344 273.2873          ?        ?     2025.2        6.7       ?       ? 
1 1 1   20   18   16 o    387.8    2.5    0.0000   0.0000          ?        ?  1503.7184  19.1556          ?        ?      387.8        2.5       ?       ? 
1 1 1   20   18   17 o   1011.6    3.8    0.0000   0.0000          ?        ? 10234.2246  76.6226          ?        ?     1011.6        3.8       ?       ? 
1 1 1   20   18   18 o    714.3    2.9    0.0000   0.0000          ?        ?  5102.4263  41.5039          ?        ?      714.3        2.9       ?       ? 
1 1 1   20   18   19 o   1030.8    3.7    0.0000   0.0000          ?        ? 10626.9160  76.6226          ?        ?     1030.8        3.7       ?       ? 
1 1 1   20   18   20 o    692.0    3.0    0.0000   0.0000          ?        ?  4789.5508  40.8654          ?        ?      692.0        3.0       ?       ? 
1 1 1   20   18   21 o    447.0    2.7    0.0000   0.0000          ?        ?  1998.5726  24.2638          ?        ?      447.0        2.7       ?       ? 
1 1 1   20   18   22 o    631.7    2.7    0.0000   0.0000          ?        ?  3990.1218  33.8416          ?        ?      631.7        2.7       ?       ? 
1 1 1   20   18   23 f    254.2    2.9    0.0000   0.0000          ?        ?   646.1838  14.6860          ?        ?      254.2        2.9       ?       ? 
1 1 1   20   18   24 o    498.1    2.7    0.0000   0.0000          ?        ?  2480.6565  26.8179          ?        ?      498.1        2.7       ?       ? 
1 1 1   20   18   25 o    816.8    3.2    0.0000   0.0000          ?        ?  6671.9126  52.9973          ?        ?      816.8        3.2       ?       ? 
1 1 1   20   18   26 o    985.4    3.6    0.0000   0.0000          ?        ?  9711.2754  71.5144          ?        ?      985.4        3.6       ?       ? 
1 1 1   20   18   27 o    395.6    2.7    0.0000   0.0000          ?        ?  1565.0166  21.0712          ?        ?      395.6        2.7       ?       ? 
1 1 1   20   18   28 o    673.2    2.8    0.0000   0.0000          ?        ?  4532.2266  37.6728          ?        ?      673.2        2.8       ?       ? 
1 1 1   20   18   29 o    668.8    2.8    0.0000   0.0000          ?        ?  4473.4824  37.0343          ?        ?      668.8        2.8       ?       ? 
1 1 1   20   18   30 o    495.6    2.5    0.0000   0.0000          ?        ?  2456.3928  24.9023          ?        ?      495.6        2.5       ?       ? 
1 1 1   20   18   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   18   32 o    657.9    2.9    0.0000   0.0000          ?        ?  4329.1768  37.6728          ?        ?      657.9        2.9       ?       ? 
1 1 1   20   18   33 o    680.3    2.8    0.0000   0.0000          ?        ?  4628.6436  38.3113          ?        ?      680.3        2.8       ?       ? 
1 1 1   20   18   34 o    646.5    2.8    0.0000   0.0000          ?        ?  4180.4014  36.3957          ?        ?      646.5        2.8       ?       ? 
1 1 1   20   18   35 o    126.3    5.8    0.0000   0.0000          ?        ?   159.6304  14.6860          ?        ?      126.3        5.8       ?       ? 
1 1 1   20   18   36 o    326.1    2.8    0.0000   0.0000          ?        ?  1063.7771  18.5171          ?        ?      326.1        2.8       ?       ? 
1 1 1   20   18   37 o    287.1    3.0    0.0000   0.0000          ?        ?   824.3315  17.2401          ?        ?      287.1        3.0       ?       ? 
1 1 1   20   18   38 o    309.7    2.8    0.0000   0.0000          ?        ?   959.0594  17.2401          ?        ?      309.7        2.8       ?       ? 
1 1 1   20   18   39 o    548.6    2.6    0.0000   0.0000          ?        ?  3009.9910  28.0950          ?        ?      548.6        2.6       ?       ? 
1 1 1   20   18   40 o    419.7    2.5    0.0000   0.0000          ?        ?  1761.6812  21.0712          ?        ?      419.7        2.5       ?       ? 
1 1 1   20   18   41 o    161.3    5.5    0.0000   0.0000          ?        ?   260.5168  17.8786          ?        ?      161.3        5.5       ?       ? 
1 1 1   20   18   42 o    653.5    2.7    0.0000   0.0000          ?        ?  4271.0713  35.7572          ?        ?      653.5        2.7       ?       ? 
1 1 1   20   18   43 o    461.3    2.6    0.0000   0.0000          ?        ?  2128.1924  24.2638          ?        ?      461.3        2.6       ?       ? 
1 1 1   20   18   44 o    552.3    2.7    0.0000   0.0000          ?        ?  3051.4949  30.0105          ?        ?      552.3        2.7       ?       ? 
1 1 1   20   18   45 o    189.9    4.5    0.0000   0.0000          ?        ?   360.7647  17.2401          ?        ?      189.9        4.5       ?       ? 
1 1 1   20   18   46 o    438.3    2.5    0.0000   0.0000          ?        ?  1921.3115  22.3483          ?        ?      438.3        2.5       ?       ? 
1 1 1   20   18   47 o    262.1    3.4    0.0000   0.0000          ?        ?   687.0493  17.8786          ?        ?      262.1        3.4       ?       ? 
1 1 1   20   18   48 o    323.1    2.9    0.0000   0.0000          ?        ?  1043.9829  18.5171          ?        ?      323.1        2.9       ?       ? 
1 1 1   20   18   49 o    259.6    3.6    0.0000   0.0000          ?        ?   674.2788  18.5171          ?        ?      259.6        3.6       ?       ? 
1 1 1   20   18   50 o    395.3    2.7    0.0000   0.0000          ?        ?  1563.1010  21.0712          ?        ?      395.3        2.7       ?       ? 
1 1 1   20   18   51 o    235.6    4.1    0.0000   0.0000          ?        ?   555.5138  19.1556          ?        ?      235.6        4.1       ?       ? 
1 1 1   20   18   52 o    653.4    2.9    0.0000   0.0000          ?        ?  4270.4326  37.6728          ?        ?      653.4        2.9       ?       ? 
1 1 1   20   18   53 o    389.2    2.7    0.0000   0.0000          ?        ?  1515.2118  21.0712          ?        ?      389.2        2.7       ?       ? 
1 1 1   20   18   54 o    446.3    2.7    0.0000   0.0000          ?        ?  1992.8260  24.2638          ?        ?      446.3        2.7       ?       ? 
1 1 1   20   18   55 o    474.5    2.6    0.0000   0.0000          ?        ?  2252.0659  24.9023          ?        ?      474.5        2.6       ?       ? 
1 1 1   20   18   56 o    563.2    2.7    0.0000   0.0000          ?        ?  3172.8140  30.0105          ?        ?      563.2        2.7       ?       ? 
1 1 1   20   18   57 f     51.1   16.2    0.0000   0.0000          ?        ?    26.1794  18.5171          ?        ?       51.1       16.2       ?       ? 
1 1 1   20   18   58 o    109.6    8.7    0.0000   0.0000          ?        ?   120.6806  19.1556          ?        ?      109.6        8.7       ?       ? 
1 1 1   20   18   59 o    339.7    3.2    0.0000   0.0000          ?        ?  1155.0856  21.7097          ?        ?      339.7        3.2       ?       ? 
1 1 1   20   18   60 o    267.3    4.1    0.0000   0.0000          ?        ?   715.1442  21.7097          ?        ?      267.3        4.1       ?       ? 
1 1 1   20   18   61 o    117.1    8.5    0.0000   0.0000          ?        ?   137.9207  19.7942          ?        ?      117.1        8.5       ?       ? 
1 1 1   20   18   62 o     56.8   16.1    0.0000   0.0000          ?        ?    33.8416  19.1556          ?        ?       56.8       16.1       ?       ? 
1 1 1   20   18   63 o     94.1   10.5    0.0000   0.0000          ?        ?    89.3930  19.7942          ?        ?       94.1       10.5       ?       ? 
1 1 1   20   18   64 o    147.2    6.9    0.0000   0.0000          ?        ?   217.7359  20.4327          ?        ?      147.2        6.9       ?       ? 
1 1 1   20   18   65 o    268.5    4.0    0.0000   0.0000          ?        ?   722.1680  21.7097          ?        ?      268.5        4.0       ?       ? 
1 1 1   20   18   66 o     25.4   12.3    0.0000   0.0000          ?        ?   -33.8416  19.7942          ?        ?       25.4       12.3       ?       ? 
1 1 1   20   18   67 o     68.3   15.3    0.0000   0.0000          ?        ?    49.8047  20.4327          ?        ?       68.3       15.3       ?       ? 
1 1 1   20   18   68 o    156.1    6.5    0.0000   0.0000          ?        ?   245.1923  20.4327          ?        ?      156.1        6.5       ?       ? 
1 1 1   20   18   69 o    175.3    6.0    0.0000   0.0000          ?        ?   309.0445  21.0712          ?        ?      175.3        6.0       ?       ? 
1 1 1   20   18   70 o    497.6    2.8    0.0000   0.0000          ?        ?  2479.3794  28.0950          ?        ?      497.6        2.8       ?       ? 
1 1 1   20   18   71 o    139.9    7.8    0.0000   0.0000          ?        ?   197.9417  21.7097          ?        ?      139.9        7.8       ?       ? 
1 1 1   20   19    0 o     17.6   13.1 -116.8494  35.7572  -116.8494  35.7572  -116.8494  35.7572       17.6     13.1       17.6       13.1     0.0     0.0 
1 1 1   20   19    1 o    620.7    3.4    0.0000   0.0000          ?        ?  3852.8396  42.1424          ?        ?      620.7        3.4       ?       ? 
1 1 1   20   19    2 o    670.1    3.4    0.0000   0.0000          ?        ?  4490.7227  45.9736          ?        ?      670.1        3.4       ?       ? 
1 1 1   20   19    3 o   1405.1    6.2    0.0000   0.0000          ?        ? 19745.6426 174.9549          ?        ?     1405.1        6.2       ?       ? 
1 1 1   20   19    4 o    224.9    3.0    0.0000   0.0000          ?        ?   505.7091  13.4090          ?        ?      224.9        3.0       ?       ? 
1 1 1   20   19    5 o   1398.0    5.6    0.0000   0.0000          ?        ? 19545.7852 157.0763          ?        ?     1398.0        5.6       ?       ? 
1 1 1   20   19    6 o    980.5    4.1    0.0000   0.0000          ?        ?  9614.2197  80.4537          ?        ?      980.5        4.1       ?       ? 
1 1 1   20   19    7 o   1866.2    6.4    0.0000   0.0000          ?        ? 34832.6328 237.5300          ?        ?     1866.2        6.4       ?       ? 
1 1 1   20   19    8 o     66.9    5.3    0.0000   0.0000          ?        ?    44.6965   7.0237          ?        ?       66.9        5.3       ?       ? 
1 1 1   20   19    9 o   1160.8    4.0    0.0000   0.0000          ?        ? 13474.7227  91.9471          ?        ?     1160.8        4.0       ?       ? 
1 1 1   20   19   10 o    327.0    2.2    0.0000   0.0000          ?        ?  1069.5237  14.6860          ?        ?      327.0        2.2       ?       ? 
1 1 1   20   19   11 o    683.7    3.0    0.0000   0.0000          ?        ?  4675.2554  40.8654          ?        ?      683.7        3.0       ?       ? 
1 1 1   20   19   12 o   1249.1    4.3    0.0000   0.0000          ?        ? 15604.1914 106.6331          ?        ?     1249.1        4.3       ?       ? 
1 1 1   20   19   13 o    325.5    2.2    0.0000   0.0000          ?        ?  1059.3074  14.0475          ?        ?      325.5        2.2       ?       ? 
1 1 1   20   19   14 o   1076.7    3.8    0.0000   0.0000          ?        ? 11594.2764  81.0922          ?        ?     1076.7        3.8       ?       ? 
1 1 1   20   19   15 o   1055.5    3.7    0.0000   0.0000          ?        ? 11142.2021  78.5382          ?        ?     1055.5        3.7       ?       ? 
1 1 1   20   19   16 o    595.7    2.5    0.0000   0.0000          ?        ?  3548.2646  30.0105          ?        ?      595.7        2.5       ?       ? 
1 1 1   20   19   17 o   1227.2    4.2    0.0000   0.0000          ?        ? 15060.8096 103.4405          ?        ?     1227.2        4.2       ?       ? 
1 1 1   20   19   18 o   1433.8    4.9    0.0000   0.0000          ?        ? 20560.3965 139.1977          ?        ?     1433.8        4.9       ?       ? 
1 1 1   20   19   19 o   1061.5    3.8    0.0000   0.0000          ?        ? 11269.2686  80.4537          ?        ?     1061.5        3.8       ?       ? 
1 1 1   20   19   20 o   1123.1    3.9    0.0000   0.0000          ?        ? 12615.2715  88.1160          ?        ?     1123.1        3.9       ?       ? 
1 1 1   20   19   21 f    963.6    3.5    0.0000   0.0000          ?        ?  9285.3809  67.6833          ?        ?      963.6        3.5       ?       ? 
1 1 1   20   19   22 o    325.7    2.4    0.0000   0.0000          ?        ?  1060.5845  15.3245          ?        ?      325.7        2.4       ?       ? 
1 1 1   20   19   23 o    893.5    3.3    0.0000   0.0000          ?        ?  7984.7129  59.3825          ?        ?      893.5        3.3       ?       ? 
1 1 1   20   19   24 o    882.0    3.3    0.0000   0.0000          ?        ?  7780.3862  58.1055          ?        ?      882.0        3.3       ?       ? 
1 1 1   20   19   25 o   1211.2    4.2    0.0000   0.0000          ?        ? 14673.2266 102.1635          ?        ?     1211.2        4.2       ?       ? 
1 1 1   20   19   26 o   1384.2    4.7    0.0000   0.0000          ?        ? 19163.9492 130.8969          ?        ?     1384.2        4.7       ?       ? 
1 1 1   20   19   27 o    362.7    2.7    0.0000   0.0000          ?        ?  1315.3545  19.7942          ?        ?      362.7        2.7       ?       ? 
1 1 1   20   19   28 o   1081.9    4.0    0.0000   0.0000          ?        ? 11706.6553  85.5619          ?        ?     1081.9        4.0       ?       ? 
1 1 1   20   19   29 o    641.0    2.8    0.0000   0.0000          ?        ?  4108.8867  35.7572          ?        ?      641.0        2.8       ?       ? 
1 1 1   20   19   30 o    435.8    2.6    0.0000   0.0000          ?        ?  1899.6018  22.9868          ?        ?      435.8        2.6       ?       ? 
1 1 1   20   19   31 o    409.5    2.7    0.0000   0.0000          ?        ?  1677.3964  21.7097          ?        ?      409.5        2.7       ?       ? 
1 1 1   20   19   32 o    638.4    2.9    0.0000   0.0000          ?        ?  4075.6833  36.3957          ?        ?      638.4        2.9       ?       ? 
1 1 1   20   19   33 o    925.1    3.5    0.0000   0.0000          ?        ?  8559.3828  65.1292          ?        ?      925.1        3.5       ?       ? 
1 1 1   20   19   34 o    912.0    3.4    0.0000   0.0000          ?        ?  8319.2988  61.9366          ?        ?      912.0        3.4       ?       ? 
1 1 1   20   19   35 o    538.0    2.7    0.0000   0.0000          ?        ?  2895.0571  28.7335          ?        ?      538.0        2.7       ?       ? 
1 1 1   20   19   36 o    398.6    2.6    0.0000   0.0000          ?        ?  1588.6418  21.0712          ?        ?      398.6        2.6       ?       ? 
1 1 1   20   19   37 o    495.0    2.5    0.0000   0.0000          ?        ?  2450.6460  24.9023          ?        ?      495.0        2.5       ?       ? 
1 1 1   20   19   38 o    282.0    2.9    0.0000   0.0000          ?        ?   795.5980  16.6016          ?        ?      282.0        2.9       ?       ? 
1 1 1   20   19   39 o    521.1    2.7    0.0000   0.0000          ?        ?  2715.6323  28.0950          ?        ?      521.1        2.7       ?       ? 
1 1 1   20   19   40 o    215.3    3.6    0.0000   0.0000          ?        ?   463.5667  15.3245          ?        ?      215.3        3.6       ?       ? 
1 1 1   20   19   41 o     20.7   10.2    0.0000   0.0000          ?        ?   -30.6490  14.6860          ?        ?       20.7       10.2       ?       ? 
1 1 1   20   19   42 o    402.0    2.6    0.0000   0.0000          ?        ?  1616.7367  21.0712          ?        ?      402.0        2.6       ?       ? 
1 1 1   20   19   43 o    308.9    3.1    0.0000   0.0000          ?        ?   954.5898  19.1556          ?        ?      308.9        3.1       ?       ? 
1 1 1   20   19   44 o    290.7    3.3    0.0000   0.0000          ?        ?   845.4026  19.1556          ?        ?      290.7        3.3       ?       ? 
1 1 1   20   19   45 o    291.3    3.1    0.0000   0.0000          ?        ?   848.5952  17.8786          ?        ?      291.3        3.1       ?       ? 
1 1 1   20   19   46 o    551.6    2.6    0.0000   0.0000          ?        ?  3043.1941  28.7335          ?        ?      551.6        2.6       ?       ? 
1 1 1   20   19   47 o    186.1    4.6    0.0000   0.0000          ?        ?   346.7172  17.2401          ?        ?      186.1        4.6       ?       ? 
1 1 1   20   19   48 o     19.6    9.8    0.0000   0.0000          ?        ?   -47.8891  16.6016          ?        ?       19.6        9.8       ?       ? 
1 1 1   20   19   49 o    245.2    3.6    0.0000   0.0000          ?        ?   601.4874  17.8786          ?        ?      245.2        3.6       ?       ? 
1 1 1   20   19   50 o     23.4   11.4    0.0000   0.0000          ?        ?   -31.2876  17.2401          ?        ?       23.4       11.4       ?       ? 
1 1 1   20   19   51 o    508.4    2.6    0.0000   0.0000          ?        ?  2586.0127  26.8179          ?        ?      508.4        2.6       ?       ? 
1 1 1   20   19   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   19   53 o     42.8   15.8    0.0000   0.0000          ?        ?    14.6860  17.8786          ?        ?       42.8       15.8       ?       ? 
1 1 1   20   19   54 o    156.4    5.9    0.0000   0.0000          ?        ?   245.1923  18.5171          ?        ?      156.4        5.9       ?       ? 
1 1 1   20   19   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   19   56 o    218.4    4.2    0.0000   0.0000          ?        ?   477.6142  18.5171          ?        ?      218.4        4.2       ?       ? 
1 1 1   20   19   57 o     92.6   10.0    0.0000   0.0000          ?        ?    86.2004  18.5171          ?        ?       92.6       10.0       ?       ? 
1 1 1   20   19   58 o    147.8    6.5    0.0000   0.0000          ?        ?   219.0129  19.1556          ?        ?      147.8        6.5       ?       ? 
1 1 1   20   19   59 o     36.0   15.1    0.0000   0.0000          ?        ?     1.9156  18.5171          ?        ?       36.0       15.1       ?       ? 
1 1 1   20   19   60 o    112.4    8.8    0.0000   0.0000          ?        ?   127.0658  19.7942          ?        ?      112.4        8.8       ?       ? 
1 1 1   20   19   61 o    272.7    3.6    0.0000   0.0000          ?        ?   744.5162  19.7942          ?        ?      272.7        3.6       ?       ? 
1 1 1   20   19   62 o    118.9    8.6    0.0000   0.0000          ?        ?   142.3903  20.4327          ?        ?      118.9        8.6       ?       ? 
1 1 1   20   19   63 o    156.5    6.3    0.0000   0.0000          ?        ?   245.8308  19.7942          ?        ?      156.5        6.3       ?       ? 
1 1 1   20   19   64 f    449.1    2.9    0.0000   0.0000          ?        ?  2019.0055  26.1794          ?        ?      449.1        2.9       ?       ? 
1 1 1   20   19   65 o    235.8    4.5    0.0000   0.0000          ?        ?   557.4294  21.0712          ?        ?      235.8        4.5       ?       ? 
1 1 1   20   19   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   19   67 o     36.6   15.5    0.0000   0.0000          ?        ?     1.2770  19.7942          ?        ?       36.6       15.5       ?       ? 
1 1 1   20   19   68 o    256.4    4.2    0.0000   0.0000          ?        ?   658.9543  21.7097          ?        ?      256.4        4.2       ?       ? 
1 1 1   20   19   69 o    238.0    4.6    0.0000   0.0000          ?        ?   568.2842  21.7097          ?        ?      238.0        4.6       ?       ? 
1 1 1   20   19   70 o    195.7    5.4    0.0000   0.0000          ?        ?   385.0285  21.0712          ?        ?      195.7        5.4       ?       ? 
1 1 1   20   19   71 f    114.9    8.6    0.0000   0.0000          ?        ?   134.0895  19.7942          ?        ?      114.9        8.6       ?       ? 
1 1 1   20   20    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   20    1 o   1694.3    9.9 28716.8711 336.5009 28716.8711 336.5009 28716.8711 336.5009     1694.3      9.9     1694.3        9.9     0.0     0.0 
1 1 1   20   20    2 o    370.5    7.2 1374.7371  53.6358  1374.7371  53.6358  1374.7371  53.6358      370.5      7.2      370.5        7.2     0.0     0.0 
1 1 1   20   20    3 f   1797.7   10.5 32328.9883 376.0892 32328.9883 376.0892 32328.9883 376.0892     1797.7     10.5     1797.7       10.5     0.0     0.0 
1 1 1   20   20    4 o    549.3    4.8 3017.6533  52.3588  3017.6533  52.3588  3017.6533  52.3588      549.3      4.8      549.3        4.8     0.0     0.0 
1 1 1   20   20    5 o   1278.1    6.8 16337.8525 173.0394 16337.8525 173.0394 16337.8525 173.0394     1278.1      6.8     1278.1        6.8     0.0     0.0 
1 1 1   20   20    6 o   1794.1    9.1 32196.8145 326.2845 32196.8145 326.2845 32196.8145 326.2845     1794.1      9.1     1794.1        9.1     0.0     0.0 
1 1 1   20   20    7 o    262.1    2.8  687.0493  14.6860   687.0493  14.6860   687.0493  14.6860      262.1      2.8      262.1        2.8     0.0     0.0 
1 1 1   20   20    8 o    912.1    4.6 8321.2139  84.2849  8321.2139  84.2849  8321.2139  84.2849      912.1      4.6      912.1        4.6     0.0     0.0 
1 1 1   20   20    9 o   1013.3    5.0 10269.9824 102.1635 10269.9824 102.1635 10269.9824 102.1635     1013.3      5.0     1013.3        5.0     0.0     0.0 
1 1 1   20   20   10 f     15.8   11.3  -18.5171  14.6860   -18.5171  14.6860   -18.5171  14.6860       15.8     11.3       15.8       11.3     0.0     0.0 
1 1 1   20   20   11 f    900.6    4.6 8111.1406  83.0078  8111.1406  83.0078  8111.1406  83.0078      900.6      4.6      900.6        4.6     0.0     0.0 
1 1 1   20   20   12 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   20   13 o    702.4    3.9 4934.4951  54.9129  4934.4951  54.9129  4934.4951  54.9129      702.4      3.9      702.4        3.9     0.0     0.0 
1 1 1   20   20   14 o    954.5    4.9 9112.3418  92.5856  9112.3418  92.5856  9112.3418  92.5856      954.5      4.9      954.5        4.9     0.0     0.0 
1 1 1   20   20   15 o   1102.3    5.8 12152.3438 127.0658 12152.3438 127.0658 12152.3438 127.0658     1102.3      5.8     1102.3        5.8     0.0     0.0 
1 1 1   20   20   16 o    857.0    4.5 7345.5527  76.6226  7345.5527  76.6226  7345.5527  76.6226      857.0      4.5      857.0        4.5     0.0     0.0 
1 1 1   20   20   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   20   18 o    760.5    4.6 5784.3677  70.2374  5784.3677  70.2374  5784.3677  70.2374      760.5      4.6      760.5        4.6     0.0     0.0 
1 1 1   20   20   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   20   20 o    736.4    4.1 5422.9639  60.0210  5422.9639  60.0210  5422.9639  60.0210      736.4      4.1      736.4        4.1     0.0     0.0 
1 1 1   20   20   21 o    393.9    3.4 1552.2461  26.8179  1552.2461  26.8179  1552.2461  26.8179      393.9      3.4      393.9        3.4     0.0     0.0 
1 1 1   20   20   22 o    297.5    3.9  885.6295  22.9868   885.6295  22.9868   885.6295  22.9868      297.5      3.9      297.5        3.9     0.0     0.0 
1 1 1   20   20   23 o    270.9    4.1  734.2999  22.3483   734.2999  22.3483   734.2999  22.3483      270.9      4.1      270.9        4.1     0.0     0.0 
1 1 1   20   20   24 o    588.8    3.6 3467.1724  42.7809  3467.1724  42.7809  3467.1724  42.7809      588.8      3.6      588.8        3.6     0.0     0.0 
1 1 1   20   20   25 f    956.8    5.0 9157.0381  95.1397  9157.0381  95.1397  9157.0381  95.1397      956.8      5.0      956.8        5.0     0.0     0.0 
1 1 1   20   20   26 o    193.0    7.3  374.1737  28.0950   374.1737  28.0950   374.1737  28.0950      193.0      7.3      193.0        7.3     0.0     0.0 
1 1 1   20   20   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   20   28 o    258.3    4.7  667.8936  24.2638   667.8936  24.2638   667.8936  24.2638      258.3      4.7      258.3        4.7     0.0     0.0 
1 1 1   20   20   29 o   1508.3    7.2 22756.9102 215.8203 22756.9102 215.8203 22756.9102 215.8203     1508.3      7.2     1508.3        7.2     0.0     0.0 
1 1 1   20   20   30 o    444.8    3.8 1979.4170  33.8416  1979.4170  33.8416  1979.4170  33.8416      444.8      3.8      444.8        3.8     0.0     0.0 
1 1 1   20   20   31 o    568.3    3.8 3230.2808  43.4195  3230.2808  43.4195  3230.2808  43.4195      568.3      3.8      568.3        3.8     0.0     0.0 
1 1 1   20   20   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   20   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   20   34 f    328.6    4.3 1080.3785  28.0950  1080.3785  28.0950  1080.3785  28.0950      328.6      4.3      328.6        4.3     0.0     0.0 
1 1 1   20   20   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   20   36 o    448.5    3.7 2011.9817  33.2031  2011.9817  33.2031  2011.9817  33.2031      448.5      3.7      448.5        3.7     0.0     0.0 
1 1 1   20   20   37 o     81.1   15.9   72.7915  22.9868    72.7915  22.9868    72.7915  22.9868       81.1     15.9       81.1       15.9     0.0     0.0 
1 1 1   20   20   38 o    412.7    3.8 1703.5756  31.2876  1703.5756  31.2876  1703.5756  31.2876      412.7      3.8      412.7        3.8     0.0     0.0 
1 1 1   20   20   39 o     13.5   10.1  -78.5382  22.3483   -78.5382  22.3483   -78.5382  22.3483       13.5     10.1       13.5       10.1     0.0     0.0 
1 1 1   20   20   40 o     67.9   18.0   54.9129  21.0712    54.9129  21.0712    54.9129  21.0712       67.9     18.0       67.9       18.0     0.0     0.0 
1 1 1   20   20   41 o    489.8    3.8 2400.2026  37.0343  2400.2026  37.0343  2400.2026  37.0343      489.8      3.8      489.8        3.8     0.0     0.0 
1 1 1   20   20   42 o    375.3    3.7 1409.2172  27.4564  1409.2172  27.4564  1409.2172  27.4564      375.3      3.7      375.3        3.7     0.0     0.0 
1 1 1   20   20   43 o    540.3    3.7 2919.9592  39.5883  2919.9592  39.5883  2919.9592  39.5883      540.3      3.7      540.3        3.7     0.0     0.0 
1 1 1   20   20   44 o    697.2    4.1 4862.3423  57.4669  4862.3423  57.4669  4862.3423  57.4669      697.2      4.1      697.2        4.1     0.0     0.0 
1 1 1   20   20   45 o    486.1    3.9 2364.4456  37.6728  2364.4456  37.6728  2364.4456  37.6728      486.1      3.9      486.1        3.9     0.0     0.0 
1 1 1   20   20   46 o    675.3    4.0 4562.2368  53.6358  4562.2368  53.6358  4562.2368  53.6358      675.3      4.0      675.3        4.0     0.0     0.0 
1 1 1   20   20   47 f    359.3    4.0 1291.7292  28.7335  1291.7292  28.7335  1291.7292  28.7335      359.3      4.0      359.3        4.0     0.0     0.0 
1 1 1   20   20   48 o    196.6    6.3  388.2211  24.9023   388.2211  24.9023   388.2211  24.9023      196.6      6.3      196.6        6.3     0.0     0.0 
1 1 1   20   20   49 o    366.6    4.0 1344.7266  29.3720  1344.7266  29.3720  1344.7266  29.3720      366.6      4.0      366.6        4.0     0.0     0.0 
1 1 1   20   20   50 o     18.1   13.3  -52.9973  26.1794   -52.9973  26.1794   -52.9973  26.1794       18.1     13.3       18.1       13.3     0.0     0.0 
1 1 1   20   20   51 f    211.1    5.8  446.9651  24.2638   446.9651  24.2638   446.9651  24.2638      211.1      5.8      211.1        5.8     0.0     0.0 
1 1 1   20   20   52 o    201.9    6.2  409.2924  24.9023   409.2924  24.9023   409.2924  24.9023      201.9      6.2      201.9        6.2     0.0     0.0 
1 1 1   20   20   53 o    105.6   12.1  116.2109  24.9023   116.2109  24.9023   116.2109  24.9023      105.6     12.1      105.6       12.1     0.0     0.0 
1 1 1   20   20   54 o    234.9    5.3  552.9597  24.9023   552.9597  24.9023   552.9597  24.9023      234.9      5.3      234.9        5.3     0.0     0.0 
1 1 1   20   20   55 o     16.4   12.2  -61.2981  24.9023   -61.2981  24.9023   -61.2981  24.9023       16.4     12.2       16.4       12.2     0.0     0.0 
1 1 1   20   20   56 o    265.1    5.3  704.2894  28.0950   704.2894  28.0950   704.2894  28.0950      265.1      5.3      265.1        5.3     0.0     0.0 
1 1 1   20   20   57 o    590.4    4.4 3488.2437  52.3588  3488.2437  52.3588  3488.2437  52.3588      590.4      4.4      590.4        4.4     0.0     0.0 
1 1 1   20   20   58 o    418.6    4.0 1753.3804  33.2031  1753.3804  33.2031  1753.3804  33.2031      418.6      4.0      418.6        4.0     0.0     0.0 
1 1 1   20   20   59 o    214.2    6.7  461.0126  28.7335   461.0126  28.7335   461.0126  28.7335      214.2      6.7      214.2        6.7     0.0     0.0 
1 1 1   20   20   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   20   20   61 o     68.6   23.4   61.9366  28.7335    61.9366  28.7335    61.9366  28.7335       68.6     23.4       68.6       23.4     0.0     0.0 
1 1 1   20   20   62 o    228.7    6.4  525.5033  29.3720   525.5033  29.3720   525.5033  29.3720      228.7      6.4      228.7        6.4     0.0     0.0 
1 1 1   20   20   63 o    147.2   10.1  220.9285  29.3720   220.9285  29.3720   220.9285  29.3720      147.2     10.1      147.2       10.1     0.0     0.0 
1 1 1   20   20   64 o    136.4   10.4  190.2794  28.0950   190.2794  28.0950   190.2794  28.0950      136.4     10.4      136.4       10.4     0.0     0.0 
1 1 1   20   20   65 o     36.4   22.0   14.6860  28.7335    14.6860  28.7335    14.6860  28.7335       36.4     22.0       36.4       22.0     0.0     0.0 
1 1 1   20   20   66 o     18.7   13.7  -53.6358  27.4564   -53.6358  27.4564   -53.6358  27.4564       18.7     13.7       18.7       13.7     0.0     0.0 
1 1 1   20   20   67 o     59.4   24.5   51.0817  28.7335    51.0817  28.7335    51.0817  28.7335       59.4     24.5       59.4       24.5     0.0     0.0 
1 1 1   20   20   68 o    117.1   13.4  144.3059  30.6490   144.3059  30.6490   144.3059  30.6490      117.1     13.4      117.1       13.4     0.0     0.0 
1 1 1   20   20   69 o     21.9   15.8  -42.7809  30.6490   -42.7809  30.6490   -42.7809  30.6490       21.9     15.8       21.9       15.8     0.0     0.0 
1 1 1   20   20   70 o     57.3   24.3   48.5276  28.0950    48.5276  28.0950    48.5276  28.0950       57.3     24.3       57.3       24.3     0.0     0.0 
1 1 1   21    0    0 o    427.6    3.7 1828.7260  31.9261  1828.7260  31.9261  1828.7260  31.9261      427.6      3.7      427.6        3.7     0.0     0.0 
1 1 1   21    0    1 o    509.8    2.9 2599.4216  30.0105  2599.4216  30.0105  2599.4216  30.0105      509.8      2.9      509.8        2.9     0.0     0.0 
1 1 1   21    0    2 o    893.3    4.4 7980.8818  78.5382  7980.8818  78.5382  7980.8818  78.5382      893.3      4.4      893.3        4.4     0.0     0.0 
1 1 1   21    0    3 o   1694.7    7.9 28725.8105 268.1791 28725.8105 268.1791 28725.8105 268.1791     1694.7      7.9     1694.7        7.9     0.0     0.0 
1 1 1   21    0    4 o    299.8    2.1  899.0385  12.7704   899.0385  12.7704   899.0385  12.7704      299.8      2.1      299.8        2.1     0.0     0.0 
1 1 1   21    0    5 o   1150.4    5.6 13235.2764 127.7043 13235.2764 127.7043 13235.2764 127.7043     1150.4      5.6     1150.4        5.6     0.0     0.0 
1 1 1   21    0    6 o    722.7    3.8 5223.1069  54.2743  5223.1069  54.2743  5223.1069  54.2743      722.7      3.8      722.7        3.8     0.0     0.0 
1 1 1   21    0    7 o    654.2    3.5 4280.6489  45.3350  4280.6489  45.3350  4280.6489  45.3350      654.2      3.5      654.2        3.5     0.0     0.0 
1 1 1   21    0    8 o    996.1    4.9 9923.2646  97.6938  9923.2646  97.6938  9923.2646  97.6938      996.1      4.9      996.1        4.9     0.0     0.0 
1 1 1   21    0    9 o     98.6    3.6   97.6938   7.0237    97.6938   7.0237    97.6938   7.0237       98.6      3.6       98.6        3.6     0.0     0.0 
1 1 1   21    0   10 o    191.6    2.7  367.1499  10.2163   367.1499  10.2163   367.1499  10.2163      191.6      2.7      191.6        2.7     0.0     0.0 
1 1 1   21    0   11 o    429.2    2.6 1842.7734  22.3483  1842.7734  22.3483  1842.7734  22.3483      429.2      2.6      429.2        2.6     0.0     0.0 
1 1 1   21    0   12 o    300.7    2.3  904.1467  14.0475   904.1467  14.0475   904.1467  14.0475      300.7      2.3      300.7        2.3     0.0     0.0 
1 1 1   21    0   13 o   1534.6    7.3 23555.0625 222.8441 23555.0625 222.8441 23555.0625 222.8441     1534.6      7.3     1534.6        7.3     0.0     0.0 
1 1 1   21    0   14 o   1100.9    5.4 12120.4170 118.1265 12120.4170 118.1265 12120.4170 118.1265     1100.9      5.4     1100.9        5.4     0.0     0.0 
1 1 1   21    0   15 o   1405.3    6.7 19750.7500 187.7254 19750.7500 187.7254 19750.7500 187.7254     1405.3      6.7     1405.3        6.7     0.0     0.0 
1 1 1   21    0   16 o   1056.8    5.2 11169.6592 109.1872 11169.6592 109.1872 11169.6592 109.1872     1056.8      5.2     1056.8        5.2     0.0     0.0 
1 1 1   21    0   17 o   1327.4    6.4 17621.2812 168.5697 17621.2812 168.5697 17621.2812 168.5697     1327.4      6.4     1327.4        6.4     0.0     0.0 
1 1 1   21    0   18 o    961.3    4.7 9241.3242  90.6701  9241.3242  90.6701  9241.3242  90.6701      961.3      4.7      961.3        4.7     0.0     0.0 
1 1 1   21    0   19 o    756.9    4.3 5729.4546  65.1292  5729.4546  65.1292  5729.4546  65.1292      756.9      4.3      756.9        4.3     0.0     0.0 
1 1 1   21    0   20 o    379.7    2.9 1441.7819  22.3483  1441.7819  22.3483  1441.7819  22.3483      379.7      2.9      379.7        2.9     0.0     0.0 
1 1 1   21    0   21 o   1626.8    7.6 26469.9141 246.4693 26469.9141 246.4693 26469.9141 246.4693     1626.8      7.6     1626.8        7.6     0.0     0.0 
1 1 1   21    0   22 o    441.9    3.1 1953.2377  27.4564  1953.2377  27.4564  1953.2377  27.4564      441.9      3.1      441.9        3.1     0.0     0.0 
1 1 1   21    0   23 o    503.8    3.6 2538.1235  36.3957  2538.1235  36.3957  2538.1235  36.3957      503.8      3.6      503.8        3.6     0.0     0.0 
1 1 1   21    0   24 o    560.7    3.4 3144.0806  38.3113  3144.0806  38.3113  3144.0806  38.3113      560.7      3.4      560.7        3.4     0.0     0.0 
1 1 1   21    0   25 o    564.6    3.7 3188.1384  41.5039  3188.1384  41.5039  3188.1384  41.5039      564.6      3.7      564.6        3.7     0.0     0.0 
1 1 1   21    0   26 o   1758.1    8.1 30914.0254 285.4192 30914.0254 285.4192 30914.0254 285.4192     1758.1      8.1     1758.1        8.1     0.0     0.0 
1 1 1   21    0   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    0   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    0   29 f    474.8    3.6 2254.6199  34.4802  2254.6199  34.4802  2254.6199  34.4802      474.8      3.6      474.8        3.6     0.0     0.0 
1 1 1   21    0   30 o    389.5    3.4 1517.1274  26.1794  1517.1274  26.1794  1517.1274  26.1794      389.5      3.4      389.5        3.4     0.0     0.0 
1 1 1   21    0   31 o    923.9    4.7 8537.6729  86.8389  8537.6729  86.8389  8537.6729  86.8389      923.9      4.7      923.9        4.7     0.0     0.0 
1 1 1   21    0   32 f    350.1    3.6 1225.9615  25.5409  1225.9615  25.5409  1225.9615  25.5409      350.1      3.6      350.1        3.6     0.0     0.0 
1 1 1   21    0   33 o    482.9    3.8 2332.5195  37.0343  2332.5195  37.0343  2332.5195  37.0343      482.9      3.8      482.9        3.8     0.0     0.0 
1 1 1   21    0   34 o   1113.0    5.8 12389.2354 128.9814 12389.2354 128.9814 12389.2354 128.9814     1113.0      5.8     1113.0        5.8     0.0     0.0 
1 1 1   21    0   35 o    843.0    4.6 7106.7456  77.2611  7106.7456  77.2611  7106.7456  77.2611      843.0      4.6      843.0        4.6     0.0     0.0 
1 1 1   21    0   36 o    294.3    4.2  866.4738  24.9023   866.4738  24.9023   866.4738  24.9023      294.3      4.2      294.3        4.2     0.0     0.0 
1 1 1   21    0   37 o    470.3    4.1 2212.4775  38.9498  2212.4775  38.9498  2212.4775  38.9498      470.3      4.1      470.3        4.1     0.0     0.0 
1 1 1   21    0   38 o   1514.0    7.3 22928.0352 220.9285 22928.0352 220.9285 22928.0352 220.9285     1514.0      7.3     1514.0        7.3     0.0     0.0 
1 1 1   21    0   39 o   1055.2    5.4 11136.4551 113.6568 11136.4551 113.6568 11136.4551 113.6568     1055.2      5.4     1055.2        5.4     0.0     0.0 
1 1 1   21    0   40 o    557.0    3.7 3102.5767  41.5039  3102.5767  41.5039  3102.5767  41.5039      557.0      3.7      557.0        3.7     0.0     0.0 
1 1 1   21    0   41 o   1223.6    6.3 14974.6084 153.2452 14974.6084 153.2452 14974.6084 153.2452     1223.6      6.3     1223.6        6.3     0.0     0.0 
1 1 1   21    0   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    0   43 o    626.7    4.1 3928.1851  51.7203  3928.1851  51.7203  3928.1851  51.7203      626.7      4.1      626.7        4.1     0.0     0.0 
1 1 1   21    0   44 o    148.1    8.5  221.5670  24.9023   221.5670  24.9023   221.5670  24.9023      148.1      8.5      148.1        8.5     0.0     0.0 
1 1 1   21    0   45 o    481.4    4.3 2317.8335  41.5039  2317.8335  41.5039  2317.8335  41.5039      481.4      4.3      481.4        4.3     0.0     0.0 
1 1 1   21    0   46 o    332.1    4.5 1103.3654  30.0105  1103.3654  30.0105  1103.3654  30.0105      332.1      4.5      332.1        4.5     0.0     0.0 
1 1 1   21    0   47 o    781.2    4.3 6104.2666  67.6833  6104.2666  67.6833  6104.2666  67.6833      781.2      4.3      781.2        4.3     0.0     0.0 
1 1 1   21    0   48 o    642.3    4.0 4126.1270  51.7203  4126.1270  51.7203  4126.1270  51.7203      642.3      4.0      642.3        4.0     0.0     0.0 
1 1 1   21    0   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    0   50 f    489.0    4.0 2391.9021  38.9498  2391.9021  38.9498  2391.9021  38.9498      489.0      4.0      489.0        4.0     0.0     0.0 
1 1 1   21    0   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    0   52 o    395.9    4.5 1568.2091  35.7572  1568.2091  35.7572  1568.2091  35.7572      395.9      4.5      395.9        4.5     0.0     0.0 
1 1 1   21    0   53 o    232.8    5.8  543.3819  26.8179   543.3819  26.8179   543.3819  26.8179      232.8      5.8      232.8        5.8     0.0     0.0 
1 1 1   21    0   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    0   55 o    258.8    5.4  671.0862  28.0950   671.0862  28.0950   671.0862  28.0950      258.8      5.4      258.8        5.4     0.0     0.0 
1 1 1   21    0   56 o    248.8    5.3  620.0045  26.1794   620.0045  26.1794   620.0045  26.1794      248.8      5.3      248.8        5.3     0.0     0.0 
1 1 1   21    0   57 o    133.7    9.9  181.9787  26.1794   181.9787  26.1794   181.9787  26.1794      133.7      9.9      133.7        9.9     0.0     0.0 
1 1 1   21    0   58 o    193.2    6.6  374.8122  25.5409   374.8122  25.5409   374.8122  25.5409      193.2      6.6      193.2        6.6     0.0     0.0 
1 1 1   21    0   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    0   60 o     17.5   12.9  -61.9366  26.8179   -61.9366  26.8179   -61.9366  26.8179       17.5     12.9       17.5       12.9     0.0     0.0 
1 1 1   21    0   61 o     22.3   15.8  -26.1794  26.1794   -26.1794  26.1794   -26.1794  26.1794       22.3     15.8       22.3       15.8     0.0     0.0 
1 1 1   21    0   62 o     21.0   15.1  -37.6728  27.4564   -37.6728  27.4564   -37.6728  27.4564       21.0     15.1       21.0       15.1     0.0     0.0 
1 1 1   21    0   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    0   64 o    125.8   11.6  162.8230  28.7335   162.8230  28.7335   162.8230  28.7335      125.8     11.6      125.8       11.6     0.0     0.0 
1 1 1   21    0   65 o     26.4   17.9  -12.1319  27.4564   -12.1319  27.4564   -12.1319  27.4564       26.4     17.9       26.4       17.9     0.0     0.0 
1 1 1   21    0   66 o     25.6   17.4  -12.1319  26.1794   -12.1319  26.1794   -12.1319  26.1794       25.6     17.4       25.6       17.4     0.0     0.0 
1 1 1   21    0   67 o     29.5   19.5   -3.8311  28.7335    -3.8311  28.7335    -3.8311  28.7335       29.5     19.5       29.5       19.5     0.0     0.0 
1 1 1   21    0   68 o    278.0    5.4  774.5267  30.0105   774.5267  30.0105   774.5267  30.0105      278.0      5.4      278.0        5.4     0.0     0.0 
1 1 1   21    0   69 o     32.7   20.6    7.0237  27.4564     7.0237  27.4564     7.0237  27.4564       32.7     20.6       32.7       20.6     0.0     0.0 
1 1 1   21    0   70 o     15.9   11.9  -99.6094  30.0105   -99.6094  30.0105   -99.6094  30.0105       15.9     11.9       15.9       11.9     0.0     0.0 
1 1 1   21    0   71 o     98.5   16.9  105.3561  30.6490   105.3561  30.6490   105.3561  30.6490       98.5     16.9       98.5       16.9     0.0     0.0 
1 1 1   21    0   72 o     33.4   21.3    5.1082  30.6490     5.1082  30.6490     5.1082  30.6490       33.4     21.3       33.4       21.3     0.0     0.0 
1 1 1   21    0   73 o     90.4   19.8   93.8627  31.2876    93.8627  31.2876    93.8627  31.2876       90.4     19.8       90.4       19.8     0.0     0.0 
1 1 1   21    0   74 o    106.0   13.9  119.4035  28.7335   119.4035  28.7335   119.4035  28.7335      106.0     13.9      106.0       13.9     0.0     0.0 
1 1 1   21    0   75 o     61.8   24.0   53.6358  28.0950    53.6358  28.0950    53.6358  28.0950       61.8     24.0       61.8       24.0     0.0     0.0 
1 1 1   21    0   76 f    103.4   13.2  109.8257  27.4564   109.8257  27.4564   109.8257  27.4564      103.4     13.2      103.4       13.2     0.0     0.0 
1 1 1   21    0   77 o     16.4   12.2  -97.0553  30.6490   -97.0553  30.6490   -97.0553  30.6490       16.4     12.2       16.4       12.2     0.0     0.0 
1 1 1   21    0   78 o    113.2   14.8  137.2822  32.5646   137.2822  32.5646   137.2822  32.5646      113.2     14.8      113.2       14.8     0.0     0.0 
1 1 1   21    1    0 o    894.1    4.5 7995.5674  79.8152  7995.5674  79.8152  7995.5674  79.8152      894.1      4.5      894.1        4.5     0.0     0.0 
1 1 1   21    1    1 o    408.3    1.8    0.0000   0.0000          ?        ?  1667.1801  14.6860          ?        ?      408.3        1.8       ?       ? 
1 1 1   21    1    2 o   1362.9    4.6    0.0000   0.0000          ?        ? 18575.8711 124.5117          ?        ?     1362.9        4.6       ?       ? 
1 1 1   21    1    3 o   1135.4    3.9    0.0000   0.0000          ?        ? 12891.7520  88.7545          ?        ?     1135.4        3.9       ?       ? 
1 1 1   21    1    4 f    691.0    2.6    0.0000   0.0000          ?        ?  4775.5034  35.7572          ?        ?      691.0        2.6       ?       ? 
1 1 1   21    1    5 o   1283.1    4.4    0.0000   0.0000          ?        ? 16464.2793 111.7413          ?        ?     1283.1        4.4       ?       ? 
1 1 1   21    1    6 o   1319.6    4.5    0.0000   0.0000          ?        ? 17415.0391 117.4880          ?        ?     1319.6        4.5       ?       ? 
1 1 1   21    1    7 o   1002.8    3.5    0.0000   0.0000          ?        ? 10056.7158  70.2374          ?        ?     1002.8        3.5       ?       ? 
1 1 1   21    1    8 o   1562.0    5.2    0.0000   0.0000          ?        ? 24400.4648 161.5460          ?        ?     1562.0        5.2       ?       ? 
1 1 1   21    1    9 o    336.2    1.7    0.0000   0.0000          ?        ?  1130.1832  11.4934          ?        ?      336.2        1.7       ?       ? 
1 1 1   21    1   10 o    998.7    3.5    0.0000   0.0000          ?        ?  9973.7080  69.5989          ?        ?      998.7        3.5       ?       ? 
1 1 1   21    1   11 o   1378.6    4.6    0.0000   0.0000          ?        ? 19006.8730 127.7043          ?        ?     1378.6        4.6       ?       ? 
1 1 1   21    1   12 o    628.9    2.4    0.0000   0.0000          ?        ?  3955.6414  30.0105          ?        ?      628.9        2.4       ?       ? 
1 1 1   21    1   13 f   1152.0    3.9    0.0000   0.0000          ?        ? 13271.0332  90.0316          ?        ?     1152.0        3.9       ?       ? 
1 1 1   21    1   14 o   1484.8    5.0    0.0000   0.0000          ?        ? 22048.1523 147.4985          ?        ?     1484.8        5.0       ?       ? 
1 1 1   21    1   15 o    870.1    3.1    0.0000   0.0000          ?        ?  7570.3120  53.6358          ?        ?      870.1        3.1       ?       ? 
1 1 1   21    1   16 f    521.4    2.2    0.0000   0.0000          ?        ?  2718.1865  22.9868          ?        ?      521.4        2.2       ?       ? 
1 1 1   21    1   17 o   1587.5    5.2    0.0000   0.0000          ?        ? 25202.4492 166.6541          ?        ?     1587.5        5.2       ?       ? 
1 1 1   21    1   18 o   1534.1    5.4    0.0000   0.0000          ?        ? 23537.8223 166.6541          ?        ?     1534.1        5.4       ?       ? 
1 1 1   21    1   19 o    843.7    3.1    0.0000   0.0000          ?        ?  7118.8779  52.3588          ?        ?      843.7        3.1       ?       ? 
1 1 1   21    1   20 o    899.1    3.2    0.0000   0.0000          ?        ?  8083.6836  57.4669          ?        ?      899.1        3.2       ?       ? 
1 1 1   21    1   21 o   1231.4    4.2    0.0000   0.0000          ?        ? 15164.8887 103.4405          ?        ?     1231.4        4.2       ?       ? 
1 1 1   21    1   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    1   23 o   1855.4    6.1    0.0000   0.0000          ?        ? 34427.1719 225.3981          ?        ?     1855.4        6.1       ?       ? 
1 1 1   21    1   24 o   1458.6    4.9    0.0000   0.0000          ?        ? 21277.4570 143.6674          ?        ?     1458.6        4.9       ?       ? 
1 1 1   21    1   25 o    886.5    3.2    0.0000   0.0000          ?        ?  7858.2852  56.8284          ?        ?      886.5        3.2       ?       ? 
1 1 1   21    1   26 o   1001.5    3.5    0.0000   0.0000          ?        ? 10031.1748  70.2374          ?        ?     1001.5        3.5       ?       ? 
1 1 1   21    1   27 o    894.6    3.4    0.0000   0.0000          ?        ?  8002.5918  61.2981          ?        ?      894.6        3.4       ?       ? 
1 1 1   21    1   28 o    795.9    3.0    0.0000   0.0000          ?        ?  6335.4116  47.2506          ?        ?      795.9        3.0       ?       ? 
1 1 1   21    1   29 o    226.6    3.1    0.0000   0.0000          ?        ?   513.3714  14.0475          ?        ?      226.6        3.1       ?       ? 
1 1 1   21    1   30 o   1142.3    4.2    0.0000   0.0000          ?        ? 13048.8281  95.7782          ?        ?     1142.3        4.2       ?       ? 
1 1 1   21    1   31 o    414.7    2.8    0.0000   0.0000          ?        ?  1719.5387  22.9868          ?        ?      414.7        2.8       ?       ? 
1 1 1   21    1   32 o    734.7    3.0    0.0000   0.0000          ?        ?  5397.4233  43.4195          ?        ?      734.7        3.0       ?       ? 
1 1 1   21    1   33 o   1105.3    4.1    0.0000   0.0000          ?        ? 12217.4727  90.6701          ?        ?     1105.3        4.1       ?       ? 
1 1 1   21    1   34 o    379.4    2.9    0.0000   0.0000          ?        ?  1439.2277  21.7097          ?        ?      379.4        2.9       ?       ? 
1 1 1   21    1   35 o    657.9    3.0    0.0000   0.0000          ?        ?  4328.5381  38.9498          ?        ?      657.9        3.0       ?       ? 
1 1 1   21    1   36 o    684.1    2.8    0.0000   0.0000          ?        ?  4679.7251  38.9498          ?        ?      684.1        2.8       ?       ? 
1 1 1   21    1   37 o   1017.6    3.7    0.0000   0.0000          ?        ? 10355.5439  75.3456          ?        ?     1017.6        3.7       ?       ? 
1 1 1   21    1   38 o    614.6    3.0    0.0000   0.0000          ?        ?  3778.1326  37.0343          ?        ?      614.6        3.0       ?       ? 
1 1 1   21    1   39 o    754.0    3.0    0.0000   0.0000          ?        ?  5684.7578  44.6965          ?        ?      754.0        3.0       ?       ? 
1 1 1   21    1   40 o    169.3    5.5    0.0000   0.0000          ?        ?   286.6962  18.5171          ?        ?      169.3        5.5       ?       ? 
1 1 1   21    1   41 o    186.2    4.6    0.0000   0.0000          ?        ?   346.7172  17.2401          ?        ?      186.2        4.6       ?       ? 
1 1 1   21    1   42 o    279.1    3.3    0.0000   0.0000          ?        ?   778.9964  18.5171          ?        ?      279.1        3.3       ?       ? 
1 1 1   21    1   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    1   44 o   1228.0    4.2    0.0000   0.0000          ?        ? 15082.5195 103.4405          ?        ?     1228.0        4.2       ?       ? 
1 1 1   21    1   45 f    431.3    3.0    0.0000   0.0000          ?        ?  1860.0134  25.5409          ?        ?      431.3        3.0       ?       ? 
1 1 1   21    1   46 o    786.6    3.3    0.0000   0.0000          ?        ?  6187.9131  51.7203          ?        ?      786.6        3.3       ?       ? 
1 1 1   21    1   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    1   48 o    254.7    3.9    0.0000   0.0000          ?        ?   648.7380  19.7942          ?        ?      254.7        3.9       ?       ? 
1 1 1   21    1   49 o    452.8    2.6    0.0000   0.0000          ?        ?  2050.9316  23.6253          ?        ?      452.8        2.6       ?       ? 
1 1 1   21    1   50 o    583.1    3.0    0.0000   0.0000          ?        ?  3400.1277  34.4802          ?        ?      583.1        3.0       ?       ? 
1 1 1   21    1   51 o    842.2    3.2    0.0000   0.0000          ?        ?  7094.6138  54.2743          ?        ?      842.2        3.2       ?       ? 
1 1 1   21    1   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    1   53 o    262.7    3.5    0.0000   0.0000          ?        ?   690.2419  18.5171          ?        ?      262.7        3.5       ?       ? 
1 1 1   21    1   54 o    131.9    6.8    0.0000   0.0000          ?        ?   174.3164  17.8786          ?        ?      131.9        6.8       ?       ? 
1 1 1   21    1   55 o    289.2    3.3    0.0000   0.0000          ?        ?   836.4633  19.1556          ?        ?      289.2        3.3       ?       ? 
1 1 1   21    1   56 o    241.3    3.8    0.0000   0.0000          ?        ?   582.3317  18.5171          ?        ?      241.3        3.8       ?       ? 
1 1 1   21    1   57 o    318.9    3.2    0.0000   0.0000          ?        ?  1017.1650  20.4327          ?        ?      318.9        3.2       ?       ? 
1 1 1   21    1   58 o    214.9    4.5    0.0000   0.0000          ?        ?   462.2897  19.1556          ?        ?      214.9        4.5       ?       ? 
1 1 1   21    1   59 o    375.3    2.9    0.0000   0.0000          ?        ?  1409.2172  21.7097          ?        ?      375.3        2.9       ?       ? 
1 1 1   21    1   60 o    269.0    3.7    0.0000   0.0000          ?        ?   724.0836  19.7942          ?        ?      269.0        3.7       ?       ? 
1 1 1   21    1   61 o    293.1    3.5    0.0000   0.0000          ?        ?   859.4501  20.4327          ?        ?      293.1        3.5       ?       ? 
1 1 1   21    1   62 o    271.2    3.6    0.0000   0.0000          ?        ?   736.2155  19.7942          ?        ?      271.2        3.6       ?       ? 
1 1 1   21    1   63 o    327.4    3.2    0.0000   0.0000          ?        ?  1072.7163  21.0712          ?        ?      327.4        3.2       ?       ? 
1 1 1   21    1   64 o     22.6   11.2    0.0000   0.0000          ?        ?   -49.1662  19.7942          ?        ?       22.6       11.2       ?       ? 
1 1 1   21    1   65 o    181.7    5.8    0.0000   0.0000          ?        ?   330.7542  21.0712          ?        ?      181.7        5.8       ?       ? 
1 1 1   21    1   66 o    280.0    3.6    0.0000   0.0000          ?        ?   784.7431  20.4327          ?        ?      280.0        3.6       ?       ? 
1 1 1   21    1   67 o    302.2    3.6    0.0000   0.0000          ?        ?   914.3630  21.7097          ?        ?      302.2        3.6       ?       ? 
1 1 1   21    1   68 o    119.8    8.3    0.0000   0.0000          ?        ?   144.3059  19.7942          ?        ?      119.8        8.3       ?       ? 
1 1 1   21    1   69 o    359.7    3.3    0.0000   0.0000          ?        ?  1294.9219  23.6253          ?        ?      359.7        3.3       ?       ? 
1 1 1   21    1   70 o     51.0   17.3    0.0000   0.0000          ?        ?    24.9023  21.0712          ?        ?       51.0       17.3       ?       ? 
1 1 1   21    1   71 o    231.1    4.4    0.0000   0.0000          ?        ?   535.0811  20.4327          ?        ?      231.1        4.4       ?       ? 
1 1 1   21    1   72 o     29.7   13.9    0.0000   0.0000          ?        ?   -19.1556  20.4327          ?        ?       29.7       13.9       ?       ? 
1 1 1   21    1   73 o     46.4   17.2    0.0000   0.0000          ?        ?    17.8786  21.0712          ?        ?       46.4       17.2       ?       ? 
1 1 1   21    1   74 o     74.4   14.7    0.0000   0.0000          ?        ?    58.7440  21.0712          ?        ?       74.4       14.7       ?       ? 
1 1 1   21    1   75 o    124.4    8.7    0.0000   0.0000          ?        ?   156.4378  21.7097          ?        ?      124.4        8.7       ?       ? 
1 1 1   21    1   76 o    172.8    6.7    0.0000   0.0000          ?        ?   300.7437  22.9868          ?        ?      172.8        6.7       ?       ? 
1 1 1   21    1   77 o    113.6    8.7    0.0000   0.0000          ?        ?   130.8969  19.7942          ?        ?      113.6        8.7       ?       ? 
1 1 1   21    1   78 o    110.5    9.5    0.0000   0.0000          ?        ?   124.5117  21.0712          ?        ?      110.5        9.5       ?       ? 
1 1 1   21    2    0 o    182.0    2.6  331.3927   9.5778   331.3927   9.5778   331.3927   9.5778      182.0      2.6      182.0        2.6     0.0     0.0 
1 1 1   21    2    1 o    974.5    3.4    0.0000   0.0000          ?        ?  9498.0088  67.0448          ?        ?      974.5        3.4       ?       ? 
1 1 1   21    2    2 o    700.6    2.6    0.0000   0.0000          ?        ?  4908.3159  37.0343          ?        ?      700.6        2.6       ?       ? 
1 1 1   21    2    3 o   1243.3    4.2    0.0000   0.0000          ?        ? 15458.6084 105.3561          ?        ?     1243.3        4.2       ?       ? 
1 1 1   21    2    4 o    933.0    3.3    0.0000   0.0000          ?        ?  8704.9658  61.9366          ?        ?      933.0        3.3       ?       ? 
1 1 1   21    2    5 f    138.4    1.8    0.0000   0.0000          ?        ?   191.5565   5.1082          ?        ?      138.4        1.8       ?       ? 
1 1 1   21    2    6 o   1382.9    4.6    0.0000   0.0000          ?        ? 19125.0000 128.3428          ?        ?     1382.9        4.6       ?       ? 
1 1 1   21    2    7 o   2048.4    6.7    0.0000   0.0000          ?        ? 41970.0273 272.6487          ?        ?     2048.4        6.7       ?       ? 
1 1 1   21    2    8 o    460.1    1.9    0.0000   0.0000          ?        ?  2116.6992  17.8786          ?        ?      460.1        1.9       ?       ? 
1 1 1   21    2    9 o   1166.2    4.0    0.0000   0.0000          ?        ? 13601.1494  93.2242          ?        ?     1166.2        4.0       ?       ? 
1 1 1   21    2   10 o    578.5    2.3    0.0000   0.0000          ?        ?  3346.4917  26.1794          ?        ?      578.5        2.3       ?       ? 
1 1 1   21    2   11 f    961.2    3.4    0.0000   0.0000          ?        ?  9240.0459  65.1292          ?        ?      961.2        3.4       ?       ? 
1 1 1   21    2   12 o    172.7    2.4    0.0000   0.0000          ?        ?   298.1896   8.3008          ?        ?      172.7        2.4       ?       ? 
1 1 1   21    2   13 o    152.0    2.3    0.0000   0.0000          ?        ?   231.1448   7.0237          ?        ?      152.0        2.3       ?       ? 
1 1 1   21    2   14 o   1281.3    4.3    0.0000   0.0000          ?        ? 16418.3066 110.4642          ?        ?     1281.3        4.3       ?       ? 
1 1 1   21    2   15 o    235.3    1.9    0.0000   0.0000          ?        ?   553.5982   8.9393          ?        ?      235.3        1.9       ?       ? 
1 1 1   21    2   16 o    731.9    2.7    0.0000   0.0000          ?        ?  5356.5581  39.5883          ?        ?      731.9        2.7       ?       ? 
1 1 1   21    2   17 o    334.7    2.1    0.0000   0.0000          ?        ?  1119.9669  14.0475          ?        ?      334.7        2.1       ?       ? 
1 1 1   21    2   18 o    619.2    2.5    0.0000   0.0000          ?        ?  3834.3223  31.2876          ?        ?      619.2        2.5       ?       ? 
1 1 1   21    2   19 o    549.2    2.3    0.0000   0.0000          ?        ?  3016.3762  24.9023          ?        ?      549.2        2.3       ?       ? 
1 1 1   21    2   20 o    524.5    2.2    0.0000   0.0000          ?        ?  2751.3896  22.9868          ?        ?      524.5        2.2       ?       ? 
1 1 1   21    2   21 o    759.8    3.0    0.0000   0.0000          ?        ?  5772.8740  45.3350          ?        ?      759.8        3.0       ?       ? 
1 1 1   21    2   22 o    577.2    2.3    0.0000   0.0000          ?        ?  3331.1675  26.8179          ?        ?      577.2        2.3       ?       ? 
1 1 1   21    2   23 o   1869.6    6.4    0.0000   0.0000          ?        ? 34957.1445 238.8071          ?        ?     1869.6        6.4       ?       ? 
1 1 1   21    2   24 o   1217.2    4.2    0.0000   0.0000          ?        ? 14816.2549 102.8020          ?        ?     1217.2        4.2       ?       ? 
1 1 1   21    2   25 o   1586.8    5.3    0.0000   0.0000          ?        ? 25181.3770 167.2927          ?        ?     1586.8        5.3       ?       ? 
1 1 1   21    2   26 o   1034.1    3.7    0.0000   0.0000          ?        ? 10694.5986  76.6226          ?        ?     1034.1        3.7       ?       ? 
1 1 1   21    2   27 o   1548.8    5.2    0.0000   0.0000          ?        ? 23989.2578 159.6304          ?        ?     1548.8        5.2       ?       ? 
1 1 1   21    2   28 o   1373.1    5.0    0.0000   0.0000          ?        ? 18856.1836 138.5592          ?        ?     1373.1        5.0       ?       ? 
1 1 1   21    2   29 o    703.0    2.8    0.0000   0.0000          ?        ?  4942.1572  39.5883          ?        ?      703.0        2.8       ?       ? 
1 1 1   21    2   30 o    807.0    3.1    0.0000   0.0000          ?        ?  6512.9204  50.4432          ?        ?      807.0        3.1       ?       ? 
1 1 1   21    2   31 o   1565.8    5.4    0.0000   0.0000          ?        ? 24521.1465 170.4853          ?        ?     1565.8        5.4       ?       ? 
1 1 1   21    2   32 o    862.1    3.4    0.0000   0.0000          ?        ?  7433.0303  58.7440          ?        ?      862.1        3.4       ?       ? 
1 1 1   21    2   33 o    733.6    3.1    0.0000   0.0000          ?        ?  5381.4600  45.3350          ?        ?      733.6        3.1       ?       ? 
1 1 1   21    2   34 o    273.4    2.9    0.0000   0.0000          ?        ?   747.7088  15.9630          ?        ?      273.4        2.9       ?       ? 
1 1 1   21    2   35 o   2075.7    6.9    0.0000   0.0000          ?        ? 43095.7383 286.6962          ?        ?     2075.7        6.9       ?       ? 
1 1 1   21    2   36 o    428.3    2.9    0.0000   0.0000          ?        ?  1834.4725  24.9023          ?        ?      428.3        2.9       ?       ? 
1 1 1   21    2   37 o    263.4    3.6    0.0000   0.0000          ?        ?   694.0730  19.1556          ?        ?      263.4        3.6       ?       ? 
1 1 1   21    2   38 o    709.0    3.0    0.0000   0.0000          ?        ?  5027.7192  42.7809          ?        ?      709.0        3.0       ?       ? 
1 1 1   21    2   39 o    588.1    2.7    0.0000   0.0000          ?        ?  3458.8718  31.9261          ?        ?      588.1        2.7       ?       ? 
1 1 1   21    2   40 o    447.7    2.9    0.0000   0.0000          ?        ?  2004.3193  25.5409          ?        ?      447.7        2.9       ?       ? 
1 1 1   21    2   41 o    604.1    2.7    0.0000   0.0000          ?        ?  3649.1511  32.5646          ?        ?      604.1        2.7       ?       ? 
1 1 1   21    2   42 o    501.0    3.1    0.0000   0.0000          ?        ?  2510.6670  31.2876          ?        ?      501.0        3.1       ?       ? 
1 1 1   21    2   43 o    540.0    2.7    0.0000   0.0000          ?        ?  2916.1284  29.3720          ?        ?      540.0        2.7       ?       ? 
1 1 1   21    2   44 o   1566.7    5.2    0.0000   0.0000          ?        ? 24553.7109 162.8230          ?        ?     1566.7        5.2       ?       ? 
1 1 1   21    2   45 o    399.5    3.0    0.0000   0.0000          ?        ?  1596.3041  23.6253          ?        ?      399.5        3.0       ?       ? 
1 1 1   21    2   46 o    533.4    2.6    0.0000   0.0000          ?        ?  2845.2524  28.0950          ?        ?      533.4        2.6       ?       ? 
1 1 1   21    2   47 o    186.7    4.8    0.0000   0.0000          ?        ?   348.6328  17.8786          ?        ?      186.7        4.8       ?       ? 
1 1 1   21    2   48 o    572.0    2.7    0.0000   0.0000          ?        ?  3271.7849  30.6490          ?        ?      572.0        2.7       ?       ? 
1 1 1   21    2   49 o    669.2    2.8    0.0000   0.0000          ?        ?  4479.2290  37.0343          ?        ?      669.2        2.8       ?       ? 
1 1 1   21    2   50 o    633.4    2.8    0.0000   0.0000          ?        ?  4012.4700  35.7572          ?        ?      633.4        2.8       ?       ? 
1 1 1   21    2   51 o    636.6    2.8    0.0000   0.0000          ?        ?  4053.3352  35.7572          ?        ?      636.6        2.8       ?       ? 
1 1 1   21    2   52 o    388.2    2.7    0.0000   0.0000          ?        ?  1507.5496  21.0712          ?        ?      388.2        2.7       ?       ? 
1 1 1   21    2   53 o    170.2    5.3    0.0000   0.0000          ?        ?   289.8888  17.8786          ?        ?      170.2        5.3       ?       ? 
1 1 1   21    2   54 o    315.4    3.0    0.0000   0.0000          ?        ?   994.8167  19.1556          ?        ?      315.4        3.0       ?       ? 
1 1 1   21    2   55 o     53.2   16.1    0.0000   0.0000          ?        ?    28.7335  18.5171          ?        ?       53.2       16.1       ?       ? 
1 1 1   21    2   56 o    442.6    2.8    0.0000   0.0000          ?        ?  1959.6228  24.9023          ?        ?      442.6        2.8       ?       ? 
1 1 1   21    2   57 o    110.9    8.4    0.0000   0.0000          ?        ?   123.2347  18.5171          ?        ?      110.9        8.4       ?       ? 
1 1 1   21    2   58 o    186.3    5.0    0.0000   0.0000          ?        ?   347.3558  18.5171          ?        ?      186.3        5.0       ?       ? 
1 1 1   21    2   59 o     85.5   11.2    0.0000   0.0000          ?        ?    73.4300  19.1556          ?        ?       85.5       11.2       ?       ? 
1 1 1   21    2   60 o    219.0    4.4    0.0000   0.0000          ?        ?   480.1682  19.1556          ?        ?      219.0        4.4       ?       ? 
1 1 1   21    2   61 o    206.1    4.6    0.0000   0.0000          ?        ?   425.2554  19.1556          ?        ?      206.1        4.6       ?       ? 
1 1 1   21    2   62 o     69.0   13.9    0.0000   0.0000          ?        ?    49.8047  18.5171          ?        ?       69.0       13.9       ?       ? 
1 1 1   21    2   63 o    367.2    3.1    0.0000   0.0000          ?        ?  1349.1962  22.9868          ?        ?      367.2        3.1       ?       ? 
1 1 1   21    2   64 o     52.4   16.7    0.0000   0.0000          ?        ?    27.4564  19.7942          ?        ?       52.4       16.7       ?       ? 
1 1 1   21    2   65 o     75.5   13.6    0.0000   0.0000          ?        ?    59.3825  19.7942          ?        ?       75.5       13.6       ?       ? 
1 1 1   21    2   66 o     27.6   13.2    0.0000   0.0000          ?        ?   -27.4564  20.4327          ?        ?       27.6       13.2       ?       ? 
1 1 1   21    2   67 o    162.1    6.5    0.0000   0.0000          ?        ?   263.7094  21.0712          ?        ?      162.1        6.5       ?       ? 
1 1 1   21    2   68 o    288.3    3.9    0.0000   0.0000          ?        ?   831.9937  22.3483          ?        ?      288.3        3.9       ?       ? 
1 1 1   21    2   69 o     29.5   13.8    0.0000   0.0000          ?        ?   -17.8786  19.7942          ?        ?       29.5       13.8       ?       ? 
1 1 1   21    2   70 f    281.4    3.9    0.0000   0.0000          ?        ?   793.0438  21.7097          ?        ?      281.4        3.9       ?       ? 
1 1 1   21    2   71 o     99.2   10.6    0.0000   0.0000          ?        ?    99.6094  21.0712          ?        ?       99.2       10.6       ?       ? 
1 1 1   21    2   72 o     48.1   17.0    0.0000   0.0000          ?        ?    21.0712  20.4327          ?        ?       48.1       17.0       ?       ? 
1 1 1   21    2   73 o    180.7    6.2    0.0000   0.0000          ?        ?   328.2001  22.3483          ?        ?      180.7        6.2       ?       ? 
1 1 1   21    2   74 o    162.8    6.1    0.0000   0.0000          ?        ?   266.2635  19.7942          ?        ?      162.8        6.1       ?       ? 
1 1 1   21    2   75 o     73.7   15.2    0.0000   0.0000          ?        ?    58.1055  21.7097          ?        ?       73.7       15.2       ?       ? 
1 1 1   21    2   76 o    340.3    3.5    0.0000   0.0000          ?        ?  1160.1937  23.6253          ?        ?      340.3        3.5       ?       ? 
1 1 1   21    2   77 o     91.4   11.5    0.0000   0.0000          ?        ?    85.5619  21.0712          ?        ?       91.4       11.5       ?       ? 
1 1 1   21    2   78 o     50.3   16.5    0.0000   0.0000          ?        ?    26.1794  19.1556          ?        ?       50.3       16.5       ?       ? 
1 1 1   21    3    0 o   1179.4    5.7 13911.4707 134.7281 13911.4707 134.7281 13911.4707 134.7281     1179.4      5.7     1179.4        5.7     0.0     0.0 
1 1 1   21    3    1 o   1248.4    4.2    0.0000   0.0000          ?        ? 15585.6738 105.9946          ?        ?     1248.4        4.2       ?       ? 
1 1 1   21    3    2 o    709.6    2.6    0.0000   0.0000          ?        ?  5036.0200  37.0343          ?        ?      709.6        2.6       ?       ? 
1 1 1   21    3    3 o   1701.2    5.6    0.0000   0.0000          ?        ? 28945.4629 190.9180          ?        ?     1701.2        5.6       ?       ? 
1 1 1   21    3    4 o    237.2    1.6    0.0000   0.0000          ?        ?   562.5375   7.6623          ?        ?      237.2        1.6       ?       ? 
1 1 1   21    3    5 o    488.3    2.0    0.0000   0.0000          ?        ?  2384.8782  19.7942          ?        ?      488.3        2.0       ?       ? 
1 1 1   21    3    6 o   1042.6    3.6    0.0000   0.0000          ?        ? 10871.4688  75.3456          ?        ?     1042.6        3.6       ?       ? 
1 1 1   21    3    7 o    758.2    2.8    0.0000   0.0000          ?        ?  5748.6104  42.7809          ?        ?      758.2        2.8       ?       ? 
1 1 1   21    3    8 o    564.7    2.3    0.0000   0.0000          ?        ?  3188.7769  25.5409          ?        ?      564.7        2.3       ?       ? 
1 1 1   21    3    9 o   1033.3    3.6    0.0000   0.0000          ?        ? 10677.9971  74.7070          ?        ?     1033.3        3.6       ?       ? 
1 1 1   21    3   10 o   1297.6    4.4    0.0000   0.0000          ?        ? 16838.4551 114.2954          ?        ?     1297.6        4.4       ?       ? 
1 1 1   21    3   11 o    998.2    3.5    0.0000   0.0000          ?        ?  9965.4062  68.9603          ?        ?      998.2        3.5       ?       ? 
1 1 1   21    3   12 o   1901.4    6.2    0.0000   0.0000          ?        ? 36160.1172 236.2530          ?        ?     1901.4        6.2       ?       ? 
1 1 1   21    3   13 o    470.8    2.0    0.0000   0.0000          ?        ?  2216.3086  19.1556          ?        ?      470.8        2.0       ?       ? 
1 1 1   21    3   14 o    986.1    3.5    0.0000   0.0000          ?        ?  9725.3223  68.3218          ?        ?      986.1        3.5       ?       ? 
1 1 1   21    3   15 o   1379.9    4.6    0.0000   0.0000          ?        ? 19041.9922 127.0658          ?        ?     1379.9        4.6       ?       ? 
1 1 1   21    3   16 o    931.0    3.5    0.0000   0.0000          ?        ?  8668.5693  65.7677          ?        ?      931.0        3.5       ?       ? 
1 1 1   21    3   17 o   1613.2    5.6    0.0000   0.0000          ?        ? 26026.1406 179.4246          ?        ?     1613.2        5.6       ?       ? 
1 1 1   21    3   18 o    316.8    2.0    0.0000   0.0000          ?        ?  1003.7560  12.7704          ?        ?      316.8        2.0       ?       ? 
1 1 1   21    3   19 o    502.5    2.2    0.0000   0.0000          ?        ?  2524.7144  22.3483          ?        ?      502.5        2.2       ?       ? 
1 1 1   21    3   20 o    649.2    2.7    0.0000   0.0000          ?        ?  4214.8809  35.1187          ?        ?      649.2        2.7       ?       ? 
1 1 1   21    3   21 o    318.9    2.2    0.0000   0.0000          ?        ?  1017.1650  14.0475          ?        ?      318.9        2.2       ?       ? 
1 1 1   21    3   22 o    337.6    2.5    0.0000   0.0000          ?        ?  1139.7611  16.6016          ?        ?      337.6        2.5       ?       ? 
1 1 1   21    3   23 o    715.5    2.8    0.0000   0.0000          ?        ?  5119.6665  40.2269          ?        ?      715.5        2.8       ?       ? 
1 1 1   21    3   24 o   1199.6    4.1    0.0000   0.0000          ?        ? 14391.0010  98.3323          ?        ?     1199.6        4.1       ?       ? 
1 1 1   21    3   25 o   1616.1    5.5    0.0000   0.0000          ?        ? 26120.0039 178.1475          ?        ?     1616.1        5.5       ?       ? 
1 1 1   21    3   26 o    669.2    2.7    0.0000   0.0000          ?        ?  4477.9521  36.3957          ?        ?      669.2        2.7       ?       ? 
1 1 1   21    3   27 o   1658.6    5.7    0.0000   0.0000          ?        ? 27512.6191 189.0024          ?        ?     1658.6        5.7       ?       ? 
1 1 1   21    3   28 o    631.8    2.8    0.0000   0.0000          ?        ?  3991.3984  35.1187          ?        ?      631.8        2.8       ?       ? 
1 1 1   21    3   29 f   1107.8    3.8    0.0000   0.0000          ?        ? 12273.6621  84.9234          ?        ?     1107.8        3.8       ?       ? 
1 1 1   21    3   30 o    620.0    2.8    0.0000   0.0000          ?        ?  3844.5386  35.1187          ?        ?      620.0        2.8       ?       ? 
1 1 1   21    3   31 f   1961.9    6.5    0.0000   0.0000          ?        ? 38499.0234 256.0471          ?        ?     1961.9        6.5       ?       ? 
1 1 1   21    3   32 o    468.3    3.1    0.0000   0.0000          ?        ?  2192.6831  28.7335          ?        ?      468.3        3.1       ?       ? 
1 1 1   21    3   33 o    689.7    2.9    0.0000   0.0000          ?        ?  4757.6245  40.2269          ?        ?      689.7        2.9       ?       ? 
1 1 1   21    3   34 o   1268.8    4.5    0.0000   0.0000          ?        ? 16099.6836 113.6568          ?        ?     1268.8        4.5       ?       ? 
1 1 1   21    3   35 o    913.5    3.5    0.0000   0.0000          ?        ?  8344.8389  64.4907          ?        ?      913.5        3.5       ?       ? 
1 1 1   21    3   36 o    703.6    3.1    0.0000   0.0000          ?        ?  4950.4580  44.0580          ?        ?      703.6        3.1       ?       ? 
1 1 1   21    3   37 o   1070.8    3.8    0.0000   0.0000          ?        ? 11466.5713  81.0922          ?        ?     1070.8        3.8       ?       ? 
1 1 1   21    3   38 o   1356.0    4.6    0.0000   0.0000          ?        ? 18390.0625 123.8732          ?        ?     1356.0        4.6       ?       ? 
1 1 1   21    3   39 o    579.4    2.7    0.0000   0.0000          ?        ?  3356.7083  31.2876          ?        ?      579.4        2.7       ?       ? 
1 1 1   21    3   40 o    264.3    3.6    0.0000   0.0000          ?        ?   698.5427  19.1556          ?        ?      264.3        3.6       ?       ? 
1 1 1   21    3   41 o    138.8    6.2    0.0000   0.0000          ?        ?   192.8335  17.2401          ?        ?      138.8        6.2       ?       ? 
1 1 1   21    3   42 o    320.3    3.4    0.0000   0.0000          ?        ?  1026.1042  21.7097          ?        ?      320.3        3.4       ?       ? 
1 1 1   21    3   43 o    974.0    3.7    0.0000   0.0000          ?        ?  9487.7930  72.1529          ?        ?      974.0        3.7       ?       ? 
1 1 1   21    3   44 o    693.8    3.0    0.0000   0.0000          ?        ?  4814.4531  42.1424          ?        ?      693.8        3.0       ?       ? 
1 1 1   21    3   45 o    599.5    2.7    0.0000   0.0000          ?        ?  3594.8767  32.5646          ?        ?      599.5        2.7       ?       ? 
1 1 1   21    3   46 o    730.9    3.0    0.0000   0.0000          ?        ?  5342.5107  43.4195          ?        ?      730.9        3.0       ?       ? 
1 1 1   21    3   47 o    211.4    4.2    0.0000   0.0000          ?        ?   446.9651  17.8786          ?        ?      211.4        4.2       ?       ? 
1 1 1   21    3   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    3   49 o    368.3    2.8    0.0000   0.0000          ?        ?  1356.8584  20.4327          ?        ?      368.3        2.8       ?       ? 
1 1 1   21    3   50 o    610.8    2.8    0.0000   0.0000          ?        ?  3731.5205  33.8416          ?        ?      610.8        2.8       ?       ? 
1 1 1   21    3   51 o    362.6    3.1    0.0000   0.0000          ?        ?  1315.3545  22.3483          ?        ?      362.6        3.1       ?       ? 
1 1 1   21    3   52 o     94.8    9.1    0.0000   0.0000          ?        ?    90.0316  17.2401          ?        ?       94.8        9.1       ?       ? 
1 1 1   21    3   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    3   54 f    522.0    2.9    0.0000   0.0000          ?        ?  2725.8489  30.0105          ?        ?      522.0        2.9       ?       ? 
1 1 1   21    3   55 o    456.4    2.7    0.0000   0.0000          ?        ?  2083.4961  24.2638          ?        ?      456.4        2.7       ?       ? 
1 1 1   21    3   56 o    679.7    2.9    0.0000   0.0000          ?        ?  4620.9810  39.5883          ?        ?      679.7        2.9       ?       ? 
1 1 1   21    3   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    3   58 o    297.6    3.4    0.0000   0.0000          ?        ?   886.2681  20.4327          ?        ?      297.6        3.4       ?       ? 
1 1 1   21    3   59 o    359.3    2.9    0.0000   0.0000          ?        ?  1291.7292  21.0712          ?        ?      359.3        2.9       ?       ? 
1 1 1   21    3   60 o    163.4    6.1    0.0000   0.0000          ?        ?   267.5406  19.7942          ?        ?      163.4        6.1       ?       ? 
1 1 1   21    3   61 f    194.0    4.9    0.0000   0.0000          ?        ?   376.7278  19.1556          ?        ?      194.0        4.9       ?       ? 
1 1 1   21    3   62 o    176.9    5.4    0.0000   0.0000          ?        ?   313.5141  19.1556          ?        ?      176.9        5.4       ?       ? 
1 1 1   21    3   63 o    253.7    4.0    0.0000   0.0000          ?        ?   644.2683  20.4327          ?        ?      253.7        4.0       ?       ? 
1 1 1   21    3   64 o    155.6    6.4    0.0000   0.0000          ?        ?   242.6382  19.7942          ?        ?      155.6        6.4       ?       ? 
1 1 1   21    3   65 o    250.9    4.1    0.0000   0.0000          ?        ?   630.2208  20.4327          ?        ?      250.9        4.1       ?       ? 
1 1 1   21    3   66 o    382.2    3.1    0.0000   0.0000          ?        ?  1461.5759  23.6253          ?        ?      382.2        3.1       ?       ? 
1 1 1   21    3   67 o     25.4   12.4    0.0000   0.0000          ?        ?   -37.0343  20.4327          ?        ?       25.4       12.4       ?       ? 
1 1 1   21    3   68 o     60.3   16.8    0.0000   0.0000          ?        ?    38.3113  21.0712          ?        ?       60.3       16.8       ?       ? 
1 1 1   21    3   69 o     21.2   10.7    0.0000   0.0000          ?        ?   -62.5751  20.4327          ?        ?       21.2       10.7       ?       ? 
1 1 1   21    3   70 o    273.8    4.1    0.0000   0.0000          ?        ?   750.9014  22.3483          ?        ?      273.8        4.1       ?       ? 
1 1 1   21    3   71 o    184.0    5.7    0.0000   0.0000          ?        ?   339.6935  21.0712          ?        ?      184.0        5.7       ?       ? 
1 1 1   21    3   72 o     23.9   11.8    0.0000   0.0000          ?        ?   -44.6965  20.4327          ?        ?       23.9       11.8       ?       ? 
1 1 1   21    3   73 o     55.2   17.5    0.0000   0.0000          ?        ?    31.2876  21.7097          ?        ?       55.2       17.5       ?       ? 
1 1 1   21    3   74 o    172.6    6.5    0.0000   0.0000          ?        ?   299.4666  22.3483          ?        ?      172.6        6.5       ?       ? 
1 1 1   21    3   75 o     46.5   17.7    0.0000   0.0000          ?        ?    16.6016  22.9868          ?        ?       46.5       17.7       ?       ? 
1 1 1   21    3   76 o    286.2    3.9    0.0000   0.0000          ?        ?   821.1389  22.3483          ?        ?      286.2        3.9       ?       ? 
1 1 1   21    3   77 o    109.8    9.3    0.0000   0.0000          ?        ?   122.5962  20.4327          ?        ?      109.8        9.3       ?       ? 
1 1 1   21    4    0 o    194.9    2.5  379.9204   9.5778   379.9204   9.5778   379.9204   9.5778      194.9      2.5      194.9        2.5     0.0     0.0 
1 1 1   21    4    1 o    712.6    2.6    0.0000   0.0000          ?        ?  5077.5239  37.6728          ?        ?      712.6        2.6       ?       ? 
1 1 1   21    4    2 o    327.4    1.7    0.0000   0.0000          ?        ?  1072.0778  10.8549          ?        ?      327.4        1.7       ?       ? 
1 1 1   21    4    3 o    638.5    2.5    0.0000   0.0000          ?        ?  4076.3223  31.2876          ?        ?      638.5        2.5       ?       ? 
1 1 1   21    4    4 o    677.1    2.6    0.0000   0.0000          ?        ?  4585.2236  35.1187          ?        ?      677.1        2.6       ?       ? 
1 1 1   21    4    5 o   1412.3    4.8    0.0000   0.0000          ?        ? 19946.7773 134.7281          ?        ?     1412.3        4.8       ?       ? 
1 1 1   21    4    6 o    687.5    2.6    0.0000   0.0000          ?        ?  4726.9756  36.3957          ?        ?      687.5        2.6       ?       ? 
1 1 1   21    4    7 o    990.5    3.5    0.0000   0.0000          ?        ?  9810.8848  68.9603          ?        ?      990.5        3.5       ?       ? 
1 1 1   21    4    8 o    484.8    2.0    0.0000   0.0000          ?        ?  2350.3982  19.7942          ?        ?      484.8        2.0       ?       ? 
1 1 1   21    4    9 o    738.3    2.8    0.0000   0.0000          ?        ?  5451.6978  40.8654          ?        ?      738.3        2.8       ?       ? 
1 1 1   21    4   10 o   1052.7    3.6    0.0000   0.0000          ?        ? 11082.1816  75.9841          ?        ?     1052.7        3.6       ?       ? 
1 1 1   21    4   11 o   1513.0    5.1    0.0000   0.0000          ?        ? 22894.8320 153.2452          ?        ?     1513.0        5.1       ?       ? 
1 1 1   21    4   12 o   1639.6    5.4    0.0000   0.0000          ?        ? 26884.9531 177.5090          ?        ?     1639.6        5.4       ?       ? 
1 1 1   21    4   13 o   1167.7    4.0    0.0000   0.0000          ?        ? 13636.9062  93.2242          ?        ?     1167.7        4.0       ?       ? 
1 1 1   21    4   14 o    659.1    2.7    0.0000   0.0000          ?        ?  4343.8623  35.1187          ?        ?      659.1        2.7       ?       ? 
1 1 1   21    4   15 o   1334.2    4.8    0.0000   0.0000          ?        ? 17801.3438 128.3428          ?        ?     1334.2        4.8       ?       ? 
1 1 1   21    4   16 o    778.7    3.0    0.0000   0.0000          ?        ?  6063.4014  46.6121          ?        ?      778.7        3.0       ?       ? 
1 1 1   21    4   17 o    774.2    2.8    0.0000   0.0000          ?        ?  5994.4409  44.0580          ?        ?      774.2        2.8       ?       ? 
1 1 1   21    4   18 o    189.8    2.5    0.0000   0.0000          ?        ?   360.1262   9.5778          ?        ?      189.8        2.5       ?       ? 
1 1 1   21    4   19 o   2030.6    6.9    0.0000   0.0000          ?        ? 41239.5586 280.9495          ?        ?     2030.6        6.9       ?       ? 
1 1 1   21    4   20 o   1078.4    3.8    0.0000   0.0000          ?        ? 11630.6719  83.0078          ?        ?     1078.4        3.8       ?       ? 
1 1 1   21    4   21 o   2868.7   10.9    0.0000   0.0000          ?        ? 82324.5938 626.3897          ?        ?     2868.7       10.9       ?       ? 
1 1 1   21    4   22 o   1401.5    4.9    0.0000   0.0000          ?        ? 19644.7578 137.2822          ?        ?     1401.5        4.9       ?       ? 
1 1 1   21    4   23 o   2331.1    7.5    0.0000   0.0000          ?        ? 54349.6836 349.9099          ?        ?     2331.1        7.5       ?       ? 
1 1 1   21    4   24 o   1229.9    4.3    0.0000   0.0000          ?        ? 15127.2168 105.9946          ?        ?     1229.9        4.3       ?       ? 
1 1 1   21    4   25 o    823.3    3.2    0.0000   0.0000          ?        ?  6779.1836  52.3588          ?        ?      823.3        3.2       ?       ? 
1 1 1   21    4   26 o   1117.8    4.0    0.0000   0.0000          ?        ? 12496.5068  88.7545          ?        ?     1117.8        4.0       ?       ? 
1 1 1   21    4   27 o    656.9    2.8    0.0000   0.0000          ?        ?  4315.1289  36.3957          ?        ?      656.9        2.8       ?       ? 
1 1 1   21    4   28 o   1667.6    5.6    0.0000   0.0000          ?        ? 27813.3633 188.3639          ?        ?     1667.6        5.6       ?       ? 
1 1 1   21    4   29 o    918.8    3.5    0.0000   0.0000          ?        ?  8442.5322  63.8522          ?        ?      918.8        3.5       ?       ? 
1 1 1   21    4   30 o    726.8    2.9    0.0000   0.0000          ?        ?  5281.8511  41.5039          ?        ?      726.8        2.9       ?       ? 
1 1 1   21    4   31 o   2349.2    7.9    0.0000   0.0000          ?        ? 55202.7500 372.2581          ?        ?     2349.2        7.9       ?       ? 
1 1 1   21    4   32 o   1121.4    4.2    0.0000   0.0000          ?        ? 12575.6836  93.8627          ?        ?     1121.4        4.2       ?       ? 
1 1 1   21    4   33 o    213.7    4.5    0.0000   0.0000          ?        ?   456.5430  19.1556          ?        ?      213.7        4.5       ?       ? 
1 1 1   21    4   34 f   1540.6    5.2    0.0000   0.0000          ?        ? 23737.6797 161.5460          ?        ?     1540.6        5.2       ?       ? 
1 1 1   21    4   35 o    928.2    3.5    0.0000   0.0000          ?        ?  8615.5723  65.1292          ?        ?      928.2        3.5       ?       ? 
1 1 1   21    4   36 o    492.6    2.6    0.0000   0.0000          ?        ?  2427.0208  25.5409          ?        ?      492.6        2.6       ?       ? 
1 1 1   21    4   37 o    839.0    3.2    0.0000   0.0000          ?        ?  7039.0625  54.2743          ?        ?      839.0        3.2       ?       ? 
1 1 1   21    4   38 o    473.0    2.7    0.0000   0.0000          ?        ?  2237.3796  25.5409          ?        ?      473.0        2.7       ?       ? 
1 1 1   21    4   39 o   1574.7    5.3    0.0000   0.0000          ?        ? 24802.7344 167.9312          ?        ?     1574.7        5.3       ?       ? 
1 1 1   21    4   40 o    793.7    3.2    0.0000   0.0000          ?        ?  6300.2930  50.4432          ?        ?      793.7        3.2       ?       ? 
1 1 1   21    4   41 o    392.3    2.8    0.0000   0.0000          ?        ?  1538.8372  22.3483          ?        ?      392.3        2.8       ?       ? 
1 1 1   21    4   42 f    824.7    3.2    0.0000   0.0000          ?        ?  6802.8096  52.9973          ?        ?      824.7        3.2       ?       ? 
1 1 1   21    4   43 o    709.6    2.9    0.0000   0.0000          ?        ?  5035.3813  41.5039          ?        ?      709.6        2.9       ?       ? 
1 1 1   21    4   44 o    255.9    4.0    0.0000   0.0000          ?        ?   655.1232  20.4327          ?        ?      255.9        4.0       ?       ? 
1 1 1   21    4   45 o    750.5    2.9    0.0000   0.0000          ?        ?  5633.0381  44.0580          ?        ?      750.5        2.9       ?       ? 
1 1 1   21    4   46 o     47.6   15.7    0.0000   0.0000          ?        ?    21.7097  17.2401          ?        ?       47.6       15.7       ?       ? 
1 1 1   21    4   47 o     18.3    9.3    0.0000   0.0000          ?        ?   -62.5751  17.2401          ?        ?       18.3        9.3       ?       ? 
1 1 1   21    4   48 f    209.1    4.3    0.0000   0.0000          ?        ?   437.3873  17.8786          ?        ?      209.1        4.3       ?       ? 
1 1 1   21    4   49 f    121.1    7.1    0.0000   0.0000          ?        ?   146.8600  17.2401          ?        ?      121.1        7.1       ?       ? 
1 1 1   21    4   50 o    421.6    2.7    0.0000   0.0000          ?        ?  1777.6442  22.9868          ?        ?      421.6        2.7       ?       ? 
1 1 1   21    4   51 o    301.3    3.3    0.0000   0.0000          ?        ?   907.9777  19.7942          ?        ?      301.3        3.3       ?       ? 
1 1 1   21    4   52 f    524.8    2.7    0.0000   0.0000          ?        ?  2755.2207  28.7335          ?        ?      524.8        2.7       ?       ? 
1 1 1   21    4   53 o    159.3    5.6    0.0000   0.0000          ?        ?   254.1316  17.8786          ?        ?      159.3        5.6       ?       ? 
1 1 1   21    4   54 o    394.5    2.8    0.0000   0.0000          ?        ?  1556.7157  22.3483          ?        ?      394.5        2.8       ?       ? 
1 1 1   21    4   55 o    196.6    4.9    0.0000   0.0000          ?        ?   386.9441  19.1556          ?        ?      196.6        4.9       ?       ? 
1 1 1   21    4   56 o    437.4    2.7    0.0000   0.0000          ?        ?  1913.6494  23.6253          ?        ?      437.4        2.7       ?       ? 
1 1 1   21    4   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    4   58 o    298.7    3.3    0.0000   0.0000          ?        ?   892.6533  19.7942          ?        ?      298.7        3.3       ?       ? 
1 1 1   21    4   59 o    155.6    6.2    0.0000   0.0000          ?        ?   242.6382  19.1556          ?        ?      155.6        6.2       ?       ? 
1 1 1   21    4   60 o    319.8    3.2    0.0000   0.0000          ?        ?  1023.5502  20.4327          ?        ?      319.8        3.2       ?       ? 
1 1 1   21    4   61 o    291.4    3.6    0.0000   0.0000          ?        ?   849.8723  21.0712          ?        ?      291.4        3.6       ?       ? 
1 1 1   21    4   62 o    142.5    6.7    0.0000   0.0000          ?        ?   203.6884  19.1556          ?        ?      142.5        6.7       ?       ? 
1 1 1   21    4   63 o    177.2    5.8    0.0000   0.0000          ?        ?   314.7912  20.4327          ?        ?      177.2        5.8       ?       ? 
1 1 1   21    4   64 o    434.6    2.9    0.0000   0.0000          ?        ?  1889.3855  25.5409          ?        ?      434.6        2.9       ?       ? 
1 1 1   21    4   65 o    127.1    7.8    0.0000   0.0000          ?        ?   162.1845  19.7942          ?        ?      127.1        7.8       ?       ? 
1 1 1   21    4   66 o    293.8    3.8    0.0000   0.0000          ?        ?   863.9198  22.3483          ?        ?      293.8        3.8       ?       ? 
1 1 1   21    4   67 o     50.7   17.3    0.0000   0.0000          ?        ?    24.2638  21.0712          ?        ?       50.7       17.3       ?       ? 
1 1 1   21    4   68 o    246.6    4.5    0.0000   0.0000          ?        ?   609.1497  22.3483          ?        ?      246.6        4.5       ?       ? 
1 1 1   21    4   69 o     39.9   16.6    0.0000   0.0000          ?        ?     4.4697  21.7097          ?        ?       39.9       16.6       ?       ? 
1 1 1   21    4   70 o    202.7    5.2    0.0000   0.0000          ?        ?   411.8464  21.0712          ?        ?      202.7        5.2       ?       ? 
1 1 1   21    4   71 o    242.6    4.7    0.0000   0.0000          ?        ?   589.9940  22.9868          ?        ?      242.6        4.7       ?       ? 
1 1 1   21    4   72 o     84.5   12.8    0.0000   0.0000          ?        ?    72.7915  21.7097          ?        ?       84.5       12.8       ?       ? 
1 1 1   21    4   73 o    194.5    5.6    0.0000   0.0000          ?        ?   379.9204  21.7097          ?        ?      194.5        5.6       ?       ? 
1 1 1   21    4   74 o     36.0   15.5    0.0000   0.0000          ?        ?    -1.2770  20.4327          ?        ?       36.0       15.5       ?       ? 
1 1 1   21    4   75 o    167.2    6.5    0.0000   0.0000          ?        ?   281.5880  21.7097          ?        ?      167.2        6.5       ?       ? 
1 1 1   21    4   76 o     69.1   15.6    0.0000   0.0000          ?        ?    51.7203  21.0712          ?        ?       69.1       15.6       ?       ? 
1 1 1   21    4   77 o     22.0   11.0    0.0000   0.0000          ?        ?   -60.0210  21.0712          ?        ?       22.0       11.0       ?       ? 
1 1 1   21    5    0 o    464.8    3.0 2160.7571  27.4564  2160.7571  27.4564  2160.7571  27.4564      464.8      3.0      464.8        3.0     0.0     0.0 
1 1 1   21    5    1 o    778.3    2.9    0.0000   0.0000          ?        ?  6058.2930  44.6965          ?        ?      778.3        2.9       ?       ? 
1 1 1   21    5    2 f   1189.6    4.1    0.0000   0.0000          ?        ? 14151.5547  97.0553          ?        ?     1189.6        4.1       ?       ? 
1 1 1   21    5    3 o    377.7    1.8    0.0000   0.0000          ?        ?  1426.4573  13.4090          ?        ?      377.7        1.8       ?       ? 
1 1 1   21    5    4 o   1778.8    5.9    0.0000   0.0000          ?        ? 31644.4922 208.7966          ?        ?     1778.8        5.9       ?       ? 
1 1 1   21    5    5 o    534.7    2.1    0.0000   0.0000          ?        ?  2858.6614  22.9868          ?        ?      534.7        2.1       ?       ? 
1 1 1   21    5    6 o   1618.2    5.4    0.0000   0.0000          ?        ? 26187.6855 173.6779          ?        ?     1618.2        5.4       ?       ? 
1 1 1   21    5    7 o   1346.7    4.6    0.0000   0.0000          ?        ? 18137.8457 122.5962          ?        ?     1346.7        4.6       ?       ? 
1 1 1   21    5    8 o    836.5    3.0    0.0000   0.0000          ?        ?  6998.1973  49.8047          ?        ?      836.5        3.0       ?       ? 
1 1 1   21    5    9 o    843.9    3.0    0.0000   0.0000          ?        ?  7122.7090  51.0817          ?        ?      843.9        3.0       ?       ? 
1 1 1   21    5   10 f   1166.6    4.0    0.0000   0.0000          ?        ? 13610.0889  93.2242          ?        ?     1166.6        4.0       ?       ? 
1 1 1   21    5   11 o    566.3    2.3    0.0000   0.0000          ?        ?  3207.2939  25.5409          ?        ?      566.3        2.3       ?       ? 
1 1 1   21    5   12 o    857.8    3.1    0.0000   0.0000          ?        ?  7357.6851  53.6358          ?        ?      857.8        3.1       ?       ? 
1 1 1   21    5   13 o    657.0    2.8    0.0000   0.0000          ?        ?  4316.4062  36.3957          ?        ?      657.0        2.8       ?       ? 
1 1 1   21    5   14 o   1355.6    4.7    0.0000   0.0000          ?        ? 18378.5684 127.7043          ?        ?     1355.6        4.7       ?       ? 
1 1 1   21    5   15 o    830.1    3.2    0.0000   0.0000          ?        ?  6890.2866  52.3588          ?        ?      830.1        3.2       ?       ? 
1 1 1   21    5   16 o   1717.9    5.6    0.0000   0.0000          ?        ? 29515.6621 193.4720          ?        ?     1717.9        5.6       ?       ? 
1 1 1   21    5   17 o    244.6    2.5    0.0000   0.0000          ?        ?   598.2947  12.1319          ?        ?      244.6        2.5       ?       ? 
1 1 1   21    5   18 f   1172.0    4.2    0.0000   0.0000          ?        ? 13736.5156  98.3323          ?        ?     1172.0        4.2       ?       ? 
1 1 1   21    5   19 o    519.0    2.3    0.0000   0.0000          ?        ?  2693.2842  24.2638          ?        ?      519.0        2.3       ?       ? 
1 1 1   21    5   20 f   1431.9    5.0    0.0000   0.0000          ?        ? 20504.2070 144.3059          ?        ?     1431.9        5.0       ?       ? 
1 1 1   21    5   21 o    793.0    3.0    0.0000   0.0000          ?        ?  6288.1611  47.2506          ?        ?      793.0        3.0       ?       ? 
1 1 1   21    5   22 o   1671.3    5.5    0.0000   0.0000          ?        ? 27933.4062 185.1713          ?        ?     1671.3        5.5       ?       ? 
1 1 1   21    5   23 o   1641.9    5.6    0.0000   0.0000          ?        ? 26960.2969 183.8942          ?        ?     1641.9        5.6       ?       ? 
1 1 1   21    5   24 o   1426.8    4.8    0.0000   0.0000          ?        ? 20357.9844 136.6436          ?        ?     1426.8        4.8       ?       ? 
1 1 1   21    5   25 o   1432.0    5.0    0.0000   0.0000          ?        ? 20508.6758 143.6674          ?        ?     1432.0        5.0       ?       ? 
1 1 1   21    5   26 o   1913.4    6.7    0.0000   0.0000          ?        ? 36617.3008 255.4086          ?        ?     1913.4        6.7       ?       ? 
1 1 1   21    5   27 o    305.5    2.5    0.0000   0.0000          ?        ?   933.5186  15.3245          ?        ?      305.5        2.5       ?       ? 
1 1 1   21    5   28 o    576.9    2.8    0.0000   0.0000          ?        ?  3327.9749  31.9261          ?        ?      576.9        2.8       ?       ? 
1 1 1   21    5   29 o    905.6    3.4    0.0000   0.0000          ?        ?  8201.1719  61.9366          ?        ?      905.6        3.4       ?       ? 
1 1 1   21    5   30 o    374.9    2.6    0.0000   0.0000          ?        ?  1405.3861  19.7942          ?        ?      374.9        2.6       ?       ? 
1 1 1   21    5   31 o    323.1    3.3    0.0000   0.0000          ?        ?  1043.9829  21.0712          ?        ?      323.1        3.3       ?       ? 
1 1 1   21    5   32 f    459.1    2.6    0.0000   0.0000          ?        ?  2107.7600  24.2638          ?        ?      459.1        2.6       ?       ? 
1 1 1   21    5   33 o    510.2    2.6    0.0000   0.0000          ?        ?  2603.2527  26.1794          ?        ?      510.2        2.6       ?       ? 
1 1 1   21    5   34 o    571.1    2.7    0.0000   0.0000          ?        ?  3261.5684  30.6490          ?        ?      571.1        2.7       ?       ? 
1 1 1   21    5   35 o    641.1    2.9    0.0000   0.0000          ?        ?  4110.8022  37.6728          ?        ?      641.1        2.9       ?       ? 
1 1 1   21    5   36 o    846.5    3.4    0.0000   0.0000          ?        ?  7166.7671  57.4669          ?        ?      846.5        3.4       ?       ? 
1 1 1   21    5   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    5   38 f    520.6    2.7    0.0000   0.0000          ?        ?  2709.8857  28.0950          ?        ?      520.6        2.7       ?       ? 
1 1 1   21    5   39 o    268.0    3.8    0.0000   0.0000          ?        ?   718.3369  20.4327          ?        ?      268.0        3.8       ?       ? 
1 1 1   21    5   40 o    562.4    2.7    0.0000   0.0000          ?        ?  3163.2361  30.6490          ?        ?      562.4        2.7       ?       ? 
1 1 1   21    5   41 o    463.9    2.8    0.0000   0.0000          ?        ?  2151.8179  26.1794          ?        ?      463.9        2.8       ?       ? 
1 1 1   21    5   42 f    443.7    2.6    0.0000   0.0000          ?        ?  1968.5621  22.9868          ?        ?      443.7        2.6       ?       ? 
1 1 1   21    5   43 o    585.7    2.8    0.0000   0.0000          ?        ?  3430.7766  32.5646          ?        ?      585.7        2.8       ?       ? 
1 1 1   21    5   44 o     59.8   16.2    0.0000   0.0000          ?        ?    37.0343  19.7942          ?        ?       59.8       16.2       ?       ? 
1 1 1   21    5   45 o   1173.0    4.1    0.0000   0.0000          ?        ? 13763.3340  95.1397          ?        ?     1173.0        4.1       ?       ? 
1 1 1   21    5   46 o    192.1    4.7    0.0000   0.0000          ?        ?   369.0655  17.8786          ?        ?      192.1        4.7       ?       ? 
1 1 1   21    5   47 o    289.4    3.1    0.0000   0.0000          ?        ?   837.7404  17.8786          ?        ?      289.4        3.1       ?       ? 
1 1 1   21    5   48 o    605.1    2.6    0.0000   0.0000          ?        ?  3661.9216  31.9261          ?        ?      605.1        2.6       ?       ? 
1 1 1   21    5   49 o    381.9    2.8    0.0000   0.0000          ?        ?  1459.0220  21.7097          ?        ?      381.9        2.8       ?       ? 
1 1 1   21    5   50 o    495.8    2.8    0.0000   0.0000          ?        ?  2458.9468  28.0950          ?        ?      495.8        2.8       ?       ? 
1 1 1   21    5   51 o    464.9    2.7    0.0000   0.0000          ?        ?  2162.0342  24.9023          ?        ?      464.9        2.7       ?       ? 
1 1 1   21    5   52 o    269.3    3.4    0.0000   0.0000          ?        ?   725.3605  18.5171          ?        ?      269.3        3.4       ?       ? 
1 1 1   21    5   53 o    295.2    3.5    0.0000   0.0000          ?        ?   871.5820  20.4327          ?        ?      295.2        3.5       ?       ? 
1 1 1   21    5   54 o    737.3    3.0    0.0000   0.0000          ?        ?  5437.6499  44.0580          ?        ?      737.3        3.0       ?       ? 
1 1 1   21    5   55 o    424.5    2.9    0.0000   0.0000          ?        ?  1802.5465  24.2638          ?        ?      424.5        2.9       ?       ? 
1 1 1   21    5   56 o    143.9    6.7    0.0000   0.0000          ?        ?   207.5195  19.1556          ?        ?      143.9        6.7       ?       ? 
1 1 1   21    5   57 o    244.0    4.2    0.0000   0.0000          ?        ?   595.7407  20.4327          ?        ?      244.0        4.2       ?       ? 
1 1 1   21    5   58 o    288.4    3.5    0.0000   0.0000          ?        ?   831.9937  20.4327          ?        ?      288.4        3.5       ?       ? 
1 1 1   21    5   59 o     20.8   10.5    0.0000   0.0000          ?        ?   -56.8284  19.1556          ?        ?       20.8       10.5       ?       ? 
1 1 1   21    5   60 o    255.2    4.0    0.0000   0.0000          ?        ?   651.9305  20.4327          ?        ?      255.2        4.0       ?       ? 
1 1 1   21    5   61 o     62.8   14.9    0.0000   0.0000          ?        ?    41.5039  18.5171          ?        ?       62.8       14.9       ?       ? 
1 1 1   21    5   62 o    201.1    4.9    0.0000   0.0000          ?        ?   404.8227  19.7942          ?        ?      201.1        4.9       ?       ? 
1 1 1   21    5   63 o    282.1    3.6    0.0000   0.0000          ?        ?   796.2365  20.4327          ?        ?      282.1        3.6       ?       ? 
1 1 1   21    5   64 o    115.0    8.6    0.0000   0.0000          ?        ?   132.8125  19.7942          ?        ?      115.0        8.6       ?       ? 
1 1 1   21    5   65 o    154.7    6.6    0.0000   0.0000          ?        ?   240.0841  20.4327          ?        ?      154.7        6.6       ?       ? 
1 1 1   21    5   66 o    108.4    9.1    0.0000   0.0000          ?        ?   118.1265  19.7942          ?        ?      108.4        9.1       ?       ? 
1 1 1   21    5   67 o     55.6   16.6    0.0000   0.0000          ?        ?    31.9261  19.7942          ?        ?       55.6       16.6       ?       ? 
1 1 1   21    5   68 o    115.9    9.4    0.0000   0.0000          ?        ?   135.3666  21.7097          ?        ?      115.9        9.4       ?       ? 
1 1 1   21    5   69 o     27.4   13.1    0.0000   0.0000          ?        ?   -28.0950  20.4327          ?        ?       27.4       13.1       ?       ? 
1 1 1   21    5   70 o    145.4    7.2    0.0000   0.0000          ?        ?   212.6277  21.0712          ?        ?      145.4        7.2       ?       ? 
1 1 1   21    5   71 f     90.0   12.1    0.0000   0.0000          ?        ?    82.3693  21.7097          ?        ?       90.0       12.1       ?       ? 
1 1 1   21    5   72 o    146.5    7.2    0.0000   0.0000          ?        ?   215.8203  21.0712          ?        ?      146.5        7.2       ?       ? 
1 1 1   21    5   73 o    147.3    7.4    0.0000   0.0000          ?        ?   218.3744  21.7097          ?        ?      147.3        7.4       ?       ? 
1 1 1   21    5   74 o    148.1    7.1    0.0000   0.0000          ?        ?   220.9285  21.0712          ?        ?      148.1        7.1       ?       ? 
1 1 1   21    5   75 o    180.2    5.7    0.0000   0.0000          ?        ?   326.2845  20.4327          ?        ?      180.2        5.7       ?       ? 
1 1 1   21    5   76 o     77.7   14.5    0.0000   0.0000          ?        ?    64.4907  21.7097          ?        ?       77.7       14.5       ?       ? 
1 1 1   21    5   77 o    210.1    5.0    0.0000   0.0000          ?        ?   443.7725  21.0712          ?        ?      210.1        5.0       ?       ? 
1 1 1   21    6    0 f   1090.1    5.4 11885.4414 117.4880 11885.4414 117.4880 11885.4414 117.4880     1090.1      5.4     1090.1        5.4     0.0     0.0 
1 1 1   21    6    1 o    965.5    3.4    0.0000   0.0000          ?        ?  9322.4160  65.7677          ?        ?      965.5        3.4       ?       ? 
1 1 1   21    6    2 o    940.3    3.4    0.0000   0.0000          ?        ?  8842.2480  63.2136          ?        ?      940.3        3.4       ?       ? 
1 1 1   21    6    3 o    429.7    1.9    0.0000   0.0000          ?        ?  1846.6046  16.6016          ?        ?      429.7        1.9       ?       ? 
1 1 1   21    6    4 o    365.7    1.9    0.0000   0.0000          ?        ?  1337.0642  14.0475          ?        ?      365.7        1.9       ?       ? 
1 1 1   21    6    5 o    316.3    1.8    0.0000   0.0000          ?        ?  1000.5634  11.4934          ?        ?      316.3        1.8       ?       ? 
1 1 1   21    6    6 o   1086.6    3.7    0.0000   0.0000          ?        ? 11806.9033  80.4537          ?        ?     1086.6        3.7       ?       ? 
1 1 1   21    6    7 o    286.8    2.0    0.0000   0.0000          ?        ?   822.4159  11.4934          ?        ?      286.8        2.0       ?       ? 
1 1 1   21    6    8 o    898.8    3.2    0.0000   0.0000          ?        ?  8079.2144  58.1055          ?        ?      898.8        3.2       ?       ? 
1 1 1   21    6    9 o   1326.8    4.5    0.0000   0.0000          ?        ? 17605.9570 118.1265          ?        ?     1326.8        4.5       ?       ? 
1 1 1   21    6   10 o   1342.1    4.5    0.0000   0.0000          ?        ? 18014.6113 121.3191          ?        ?     1342.1        4.5       ?       ? 
1 1 1   21    6   11 o    862.2    3.3    0.0000   0.0000          ?        ?  7434.3076  56.1899          ?        ?      862.2        3.3       ?       ? 
1 1 1   21    6   12 o   1297.5    4.5    0.0000   0.0000          ?        ? 16836.5391 116.2109          ?        ?     1297.5        4.5       ?       ? 
1 1 1   21    6   13 o    452.7    2.2    0.0000   0.0000          ?        ?  2049.0159  19.7942          ?        ?      452.7        2.2       ?       ? 
1 1 1   21    6   14 o    441.9    2.1    0.0000   0.0000          ?        ?  1952.5990  18.5171          ?        ?      441.9        2.1       ?       ? 
1 1 1   21    6   15 o   1700.9    5.6    0.0000   0.0000          ?        ? 28934.6074 189.6409          ?        ?     1700.9        5.6       ?       ? 
1 1 1   21    6   16 o   1918.3    6.3    0.0000   0.0000          ?        ? 36803.1094 240.0841          ?        ?     1918.3        6.3       ?       ? 
1 1 1   21    6   17 o    584.1    2.6    0.0000   0.0000          ?        ?  3411.6211  30.0105          ?        ?      584.1        2.6       ?       ? 
1 1 1   21    6   18 o   1068.9    3.9    0.0000   0.0000          ?        ? 11425.7061  83.0078          ?        ?     1068.9        3.9       ?       ? 
1 1 1   21    6   19 o    562.3    2.4    0.0000   0.0000          ?        ?  3161.3206  27.4564          ?        ?      562.3        2.4       ?       ? 
1 1 1   21    6   20 o   1053.4    3.7    0.0000   0.0000          ?        ? 11096.8672  77.8996          ?        ?     1053.4        3.7       ?       ? 
1 1 1   21    6   21 o    239.2    3.3    0.0000   0.0000          ?        ?   572.1154  15.9630          ?        ?      239.2        3.3       ?       ? 
1 1 1   21    6   22 o    198.0    3.1    0.0000   0.0000          ?        ?   392.0523  12.1319          ?        ?      198.0        3.1       ?       ? 
1 1 1   21    6   23 o   1234.6    4.2    0.0000   0.0000          ?        ? 15242.7881 104.0790          ?        ?     1234.6        4.2       ?       ? 
1 1 1   21    6   24 o    826.9    3.1    0.0000   0.0000          ?        ?  6837.2900  51.7203          ?        ?      826.9        3.1       ?       ? 
1 1 1   21    6   25 o    942.5    3.7    0.0000   0.0000          ?        ?  8883.7520  68.9603          ?        ?      942.5        3.7       ?       ? 
1 1 1   21    6   26 o    959.6    3.5    0.0000   0.0000          ?        ?  9209.3975  67.6833          ?        ?      959.6        3.5       ?       ? 
1 1 1   21    6   27 o    878.8    3.4    0.0000   0.0000          ?        ?  7723.5576  59.3825          ?        ?      878.8        3.4       ?       ? 
1 1 1   21    6   28 o    403.2    2.9    0.0000   0.0000          ?        ?  1625.6761  23.6253          ?        ?      403.2        2.9       ?       ? 
1 1 1   21    6   29 o    253.7    3.0    0.0000   0.0000          ?        ?   643.6298  15.3245          ?        ?      253.7        3.0       ?       ? 
1 1 1   21    6   30 o    294.5    2.9    0.0000   0.0000          ?        ?   867.1124  17.2401          ?        ?      294.5        2.9       ?       ? 
1 1 1   21    6   31 o    654.5    2.8    0.0000   0.0000          ?        ?  4283.8418  37.0343          ?        ?      654.5        2.8       ?       ? 
1 1 1   21    6   32 o   1024.0    3.6    0.0000   0.0000          ?        ? 10485.8018  74.0685          ?        ?     1024.0        3.6       ?       ? 
1 1 1   21    6   33 f   1061.8    4.0    0.0000   0.0000          ?        ? 11275.6533  84.2849          ?        ?     1061.8        4.0       ?       ? 
1 1 1   21    6   34 o    770.3    3.2    0.0000   0.0000          ?        ?  5933.7812  49.8047          ?        ?      770.3        3.2       ?       ? 
1 1 1   21    6   35 o    833.1    3.3    0.0000   0.0000          ?        ?  6940.7300  54.9129          ?        ?      833.1        3.3       ?       ? 
1 1 1   21    6   36 o    379.9    2.7    0.0000   0.0000          ?        ?  1443.0588  20.4327          ?        ?      379.9        2.7       ?       ? 
1 1 1   21    6   37 o    469.7    2.7    0.0000   0.0000          ?        ?  2206.0923  25.5409          ?        ?      469.7        2.7       ?       ? 
1 1 1   21    6   38 f    689.9    2.8    0.0000   0.0000          ?        ?  4759.5405  38.9498          ?        ?      689.9        2.8       ?       ? 
1 1 1   21    6   39 o   1094.1    3.9    0.0000   0.0000          ?        ? 11972.9189  85.5619          ?        ?     1094.1        3.9       ?       ? 
1 1 1   21    6   40 o   1407.9    4.8    0.0000   0.0000          ?        ? 19824.8203 134.0895          ?        ?     1407.9        4.8       ?       ? 
1 1 1   21    6   41 o    113.0    8.2    0.0000   0.0000          ?        ?   127.7043  18.5171          ?        ?      113.0        8.2       ?       ? 
1 1 1   21    6   42 o    205.7    4.2    0.0000   0.0000          ?        ?   423.3398  17.2401          ?        ?      205.7        4.2       ?       ? 
1 1 1   21    6   43 o    169.7    5.1    0.0000   0.0000          ?        ?   287.9732  17.2401          ?        ?      169.7        5.1       ?       ? 
1 1 1   21    6   44 f    214.4    4.3    0.0000   0.0000          ?        ?   459.7356  18.5171          ?        ?      214.4        4.3       ?       ? 
1 1 1   21    6   45 o    408.3    2.9    0.0000   0.0000          ?        ?  1667.1801  23.6253          ?        ?      408.3        2.9       ?       ? 
1 1 1   21    6   46 o    232.3    3.8    0.0000   0.0000          ?        ?   539.5508  17.8786          ?        ?      232.3        3.8       ?       ? 
1 1 1   21    6   47 o    535.9    2.9    0.0000   0.0000          ?        ?  2872.7087  30.6490          ?        ?      535.9        2.9       ?       ? 
1 1 1   21    6   48 o    310.2    3.3    0.0000   0.0000          ?        ?   962.2521  20.4327          ?        ?      310.2        3.3       ?       ? 
1 1 1   21    6   49 o    384.1    3.1    0.0000   0.0000          ?        ?  1475.6235  23.6253          ?        ?      384.1        3.1       ?       ? 
1 1 1   21    6   50 o    106.5    8.7    0.0000   0.0000          ?        ?   113.6568  18.5171          ?        ?      106.5        8.7       ?       ? 
1 1 1   21    6   51 o    953.5    3.5    0.0000   0.0000          ?        ?  9095.1025  67.0448          ?        ?      953.5        3.5       ?       ? 
1 1 1   21    6   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    6   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    6   54 o    252.6    3.7    0.0000   0.0000          ?        ?   638.5216  18.5171          ?        ?      252.6        3.7       ?       ? 
1 1 1   21    6   55 o    204.6    4.4    0.0000   0.0000          ?        ?   418.8702  17.8786          ?        ?      204.6        4.4       ?       ? 
1 1 1   21    6   56 o    169.0    5.5    0.0000   0.0000          ?        ?   286.0577  18.5171          ?        ?      169.0        5.5       ?       ? 
1 1 1   21    6   57 o    164.0    5.8    0.0000   0.0000          ?        ?   269.4561  19.1556          ?        ?      164.0        5.8       ?       ? 
1 1 1   21    6   58 o    284.9    3.5    0.0000   0.0000          ?        ?   812.1995  19.7942          ?        ?      284.9        3.5       ?       ? 
1 1 1   21    6   59 o     54.5   16.0    0.0000   0.0000          ?        ?    30.6490  18.5171          ?        ?       54.5       16.0       ?       ? 
1 1 1   21    6   60 o    149.3    6.2    0.0000   0.0000          ?        ?   223.4826  18.5171          ?        ?      149.3        6.2       ?       ? 
1 1 1   21    6   61 o     72.6   13.7    0.0000   0.0000          ?        ?    54.9129  19.1556          ?        ?       72.6       13.7       ?       ? 
1 1 1   21    6   62 o    163.2    5.9    0.0000   0.0000          ?        ?   266.9020  19.1556          ?        ?      163.2        5.9       ?       ? 
1 1 1   21    6   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    6   64 o    221.9    4.6    0.0000   0.0000          ?        ?   492.9387  20.4327          ?        ?      221.9        4.6       ?       ? 
1 1 1   21    6   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    6   66 o    112.4    8.8    0.0000   0.0000          ?        ?   127.0658  19.7942          ?        ?      112.4        8.8       ?       ? 
1 1 1   21    6   67 o    121.1    8.4    0.0000   0.0000          ?        ?   147.4985  20.4327          ?        ?      121.1        8.4       ?       ? 
1 1 1   21    6   68 o     24.4   12.0    0.0000   0.0000          ?        ?   -42.1424  20.4327          ?        ?       24.4       12.0       ?       ? 
1 1 1   21    6   69 o     35.0   15.2    0.0000   0.0000          ?        ?    -2.5541  19.7942          ?        ?       35.0       15.2       ?       ? 
1 1 1   21    6   70 o     94.2   11.5    0.0000   0.0000          ?        ?    90.0316  21.7097          ?        ?       94.2       11.5       ?       ? 
1 1 1   21    6   71 o     43.0   16.7    0.0000   0.0000          ?        ?    12.7704  20.4327          ?        ?       43.0       16.7       ?       ? 
1 1 1   21    6   72 o    207.9    5.1    0.0000   0.0000          ?        ?   433.5562  21.0712          ?        ?      207.9        5.1       ?       ? 
1 1 1   21    6   73 o    130.4    8.3    0.0000   0.0000          ?        ?   171.7623  21.7097          ?        ?      130.4        8.3       ?       ? 
1 1 1   21    6   74 o     21.0   10.6    0.0000   0.0000          ?        ?   -67.6833  21.0712          ?        ?       21.0       10.6       ?       ? 
1 1 1   21    6   75 o     26.5   12.9    0.0000   0.0000          ?        ?   -36.3957  21.7097          ?        ?       26.5       12.9       ?       ? 
1 1 1   21    6   76 o    267.8    4.3    0.0000   0.0000          ?        ?   719.6138  22.9868          ?        ?      267.8        4.3       ?       ? 
1 1 1   21    7    0 o   2010.8    9.3 40441.4062 372.8966 40441.4062 372.8966 40441.4062 372.8966     2010.8      9.3     2010.8        9.3     0.0     0.0 
1 1 1   21    7    1 o    931.2    3.3    0.0000   0.0000          ?        ?  8672.4004  61.9366          ?        ?      931.2        3.3       ?       ? 
1 1 1   21    7    2 o    993.6    3.5    0.0000   0.0000          ?        ?  9873.4600  68.9603          ?        ?      993.6        3.5       ?       ? 
1 1 1   21    7    3 o    864.5    3.1    0.0000   0.0000          ?        ?  7473.8955  54.2743          ?        ?      864.5        3.1       ?       ? 
1 1 1   21    7    4 o   1091.8    3.7    0.0000   0.0000          ?        ? 11920.5605  80.4537          ?        ?     1091.8        3.7       ?       ? 
1 1 1   21    7    5 o   2346.7    7.6    0.0000   0.0000          ?        ? 55082.0664 355.0180          ?        ?     2346.7        7.6       ?       ? 
1 1 1   21    7    6 o    901.6    3.2    0.0000   0.0000          ?        ?  8128.3804  58.1055          ?        ?      901.6        3.2       ?       ? 
1 1 1   21    7    7 o   1527.7    5.1    0.0000   0.0000          ?        ? 23341.7969 155.1608          ?        ?     1527.7        5.1       ?       ? 
1 1 1   21    7    8 f   1282.3    4.5    0.0000   0.0000          ?        ? 16443.8477 116.2109          ?        ?     1282.3        4.5       ?       ? 
1 1 1   21    7    9 o   1392.1    4.9    0.0000   0.0000          ?        ? 19381.0469 136.6436          ?        ?     1392.1        4.9       ?       ? 
1 1 1   21    7   10 o   1593.9    5.5    0.0000   0.0000          ?        ? 25407.4141 176.8705          ?        ?     1593.9        5.5       ?       ? 
1 1 1   21    7   11 f   1176.0    4.1    0.0000   0.0000          ?        ? 13831.0176  96.4168          ?        ?     1176.0        4.1       ?       ? 
1 1 1   21    7   12 o    890.0    3.3    0.0000   0.0000          ?        ?  7921.4990  58.7440          ?        ?      890.0        3.3       ?       ? 
1 1 1   21    7   13 o   2120.0    7.3    0.0000   0.0000          ?        ? 44951.9219 311.5985          ?        ?     2120.0        7.3       ?       ? 
1 1 1   21    7   14 o   1335.3    4.6    0.0000   0.0000          ?        ? 17830.0781 123.2347          ?        ?     1335.3        4.6       ?       ? 
1 1 1   21    7   15 o   1280.2    4.6    0.0000   0.0000          ?        ? 16389.5742 116.8494          ?        ?     1280.2        4.6       ?       ? 
1 1 1   21    7   16 o    344.3    2.0    0.0000   0.0000          ?        ?  1185.7346  14.0475          ?        ?      344.3        2.0       ?       ? 
1 1 1   21    7   17 o   1637.0    5.8    0.0000   0.0000          ?        ? 26798.7520 189.6409          ?        ?     1637.0        5.8       ?       ? 
1 1 1   21    7   18 o    765.6    3.0    0.0000   0.0000          ?        ?  5861.6284  46.6121          ?        ?      765.6        3.0       ?       ? 
1 1 1   21    7   19 o   1391.3    4.8    0.0000   0.0000          ?        ? 19358.0605 132.8125          ?        ?     1391.3        4.8       ?       ? 
1 1 1   21    7   20 o   1867.2    6.1    0.0000   0.0000          ?        ? 34869.0273 228.5907          ?        ?     1867.2        6.1       ?       ? 
1 1 1   21    7   21 o   1466.1    5.0    0.0000   0.0000          ?        ? 21495.8301 147.4985          ?        ?     1466.1        5.0       ?       ? 
1 1 1   21    7   22 f   1029.5    3.6    0.0000   0.0000          ?        ? 10598.8203  74.7070          ?        ?     1029.5        3.6       ?       ? 
1 1 1   21    7   23 f    758.4    2.9    0.0000   0.0000          ?        ?  5751.8027  44.6965          ?        ?      758.4        2.9       ?       ? 
1 1 1   21    7   24 o    836.3    3.2    0.0000   0.0000          ?        ?  6994.3662  54.2743          ?        ?      836.3        3.2       ?       ? 
1 1 1   21    7   25 o   1416.3    4.9    0.0000   0.0000          ?        ? 20059.7969 139.1977          ?        ?     1416.3        4.9       ?       ? 
1 1 1   21    7   26 o    972.3    3.6    0.0000   0.0000          ?        ?  9453.3125  69.5989          ?        ?      972.3        3.6       ?       ? 
1 1 1   21    7   27 o   2270.8    8.8    0.0000   0.0000          ?        ? 51582.3320 397.7990          ?        ?     2270.8        8.8       ?       ? 
1 1 1   21    7   28 o   1670.4    5.7    0.0000   0.0000          ?        ? 27907.8652 190.2794          ?        ?     1670.4        5.7       ?       ? 
1 1 1   21    7   29 o    677.1    2.7    0.0000   0.0000          ?        ?  4584.5854  37.0343          ?        ?      677.1        2.7       ?       ? 
1 1 1   21    7   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    7   31 o   1136.4    4.3    0.0000   0.0000          ?        ? 12916.0156  97.0553          ?        ?     1136.4        4.3       ?       ? 
1 1 1   21    7   32 o    955.5    3.6    0.0000   0.0000          ?        ?  9129.5830  68.3218          ?        ?      955.5        3.6       ?       ? 
1 1 1   21    7   33 o    508.3    2.8    0.0000   0.0000          ?        ?  2584.0972  28.0950          ?        ?      508.3        2.8       ?       ? 
1 1 1   21    7   34 o   1047.5    4.0    0.0000   0.0000          ?        ? 10972.9941  83.6463          ?        ?     1047.5        4.0       ?       ? 
1 1 1   21    7   35 o    626.2    2.8    0.0000   0.0000          ?        ?  3921.7998  35.1187          ?        ?      626.2        2.8       ?       ? 
1 1 1   21    7   36 o    482.6    2.8    0.0000   0.0000          ?        ?  2329.3269  26.8179          ?        ?      482.6        2.8       ?       ? 
1 1 1   21    7   37 o    291.8    3.1    0.0000   0.0000          ?        ?   851.7878  17.8786          ?        ?      291.8        3.1       ?       ? 
1 1 1   21    7   38 o    363.1    2.8    0.0000   0.0000          ?        ?  1318.5471  20.4327          ?        ?      363.1        2.8       ?       ? 
1 1 1   21    7   39 o    759.5    3.1    0.0000   0.0000          ?        ?  5769.0430  46.6121          ?        ?      759.5        3.1       ?       ? 
1 1 1   21    7   40 o    314.4    3.0    0.0000   0.0000          ?        ?   988.4315  19.1556          ?        ?      314.4        3.0       ?       ? 
1 1 1   21    7   41 o    981.7    3.6    0.0000   0.0000          ?        ?  9639.1221  71.5144          ?        ?      981.7        3.6       ?       ? 
1 1 1   21    7   42 o    464.9    2.6    0.0000   0.0000          ?        ?  2161.3958  24.2638          ?        ?      464.9        2.6       ?       ? 
1 1 1   21    7   43 o    151.4    5.9    0.0000   0.0000          ?        ?   229.2293  17.8786          ?        ?      151.4        5.9       ?       ? 
1 1 1   21    7   44 o    601.9    2.7    0.0000   0.0000          ?        ?  3623.6104  31.9261          ?        ?      601.9        2.7       ?       ? 
1 1 1   21    7   45 o    114.4    7.0    0.0000   0.0000          ?        ?   130.8969  15.9630          ?        ?      114.4        7.0       ?       ? 
1 1 1   21    7   46 o    329.1    2.9    0.0000   0.0000          ?        ?  1082.9327  19.1556          ?        ?      329.1        2.9       ?       ? 
1 1 1   21    7   47 f    624.5    2.8    0.0000   0.0000          ?        ?  3900.7288  34.4802          ?        ?      624.5        2.8       ?       ? 
1 1 1   21    7   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    7   49 o    681.4    3.0    0.0000   0.0000          ?        ?  4643.9678  40.8654          ?        ?      681.4        3.0       ?       ? 
1 1 1   21    7   50 o    606.4    2.8    0.0000   0.0000          ?        ?  3677.8845  34.4802          ?        ?      606.4        2.8       ?       ? 
1 1 1   21    7   51 o     35.3   14.7    0.0000   0.0000          ?        ?     2.5541  17.2401          ?        ?       35.3       14.7       ?       ? 
1 1 1   21    7   52 o    491.2    2.9    0.0000   0.0000          ?        ?  2412.9731  28.0950          ?        ?      491.2        2.9       ?       ? 
1 1 1   21    7   53 o    306.2    3.1    0.0000   0.0000          ?        ?   937.9882  19.1556          ?        ?      306.2        3.1       ?       ? 
1 1 1   21    7   54 o    364.3    2.8    0.0000   0.0000          ?        ?  1327.4865  20.4327          ?        ?      364.3        2.8       ?       ? 
1 1 1   21    7   55 o    408.0    2.8    0.0000   0.0000          ?        ?  1665.2643  22.9868          ?        ?      408.0        2.8       ?       ? 
1 1 1   21    7   56 o     24.2   11.8    0.0000   0.0000          ?        ?   -30.6490  17.8786          ?        ?       24.2       11.8       ?       ? 
1 1 1   21    7   57 o    208.6    4.6    0.0000   0.0000          ?        ?   435.4717  19.1556          ?        ?      208.6        4.6       ?       ? 
1 1 1   21    7   58 o     24.4   11.8    0.0000   0.0000          ?        ?   -30.0105  17.8786          ?        ?       24.4       11.8       ?       ? 
1 1 1   21    7   59 f    287.5    3.4    0.0000   0.0000          ?        ?   826.8855  19.7942          ?        ?      287.5        3.4       ?       ? 
1 1 1   21    7   60 o    249.9    4.0    0.0000   0.0000          ?        ?   625.1127  19.7942          ?        ?      249.9        4.0       ?       ? 
1 1 1   21    7   61 o    182.1    5.3    0.0000   0.0000          ?        ?   332.0312  19.1556          ?        ?      182.1        5.3       ?       ? 
1 1 1   21    7   62 o    103.9    9.5    0.0000   0.0000          ?        ?   108.5487  19.7942          ?        ?      103.9        9.5       ?       ? 
1 1 1   21    7   63 o    151.6    6.3    0.0000   0.0000          ?        ?   230.5063  19.1556          ?        ?      151.6        6.3       ?       ? 
1 1 1   21    7   64 o    575.3    2.7    0.0000   0.0000          ?        ?  3310.7346  31.2876          ?        ?      575.3        2.7       ?       ? 
1 1 1   21    7   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    7   66 o    264.9    4.1    0.0000   0.0000          ?        ?   702.3738  21.7097          ?        ?      264.9        4.1       ?       ? 
1 1 1   21    7   67 o     34.1   15.1    0.0000   0.0000          ?        ?    -6.3852  20.4327          ?        ?       34.1       15.1       ?       ? 
1 1 1   21    7   68 o    205.5    5.1    0.0000   0.0000          ?        ?   423.3398  21.0712          ?        ?      205.5        5.1       ?       ? 
1 1 1   21    7   69 o    135.0    7.3    0.0000   0.0000          ?        ?   183.2557  19.7942          ?        ?      135.0        7.3       ?       ? 
1 1 1   21    7   70 o     91.6   11.2    0.0000   0.0000          ?        ?    84.9234  20.4327          ?        ?       91.6       11.2       ?       ? 
1 1 1   21    7   71 o     27.2   13.0    0.0000   0.0000          ?        ?   -28.7335  20.4327          ?        ?       27.2       13.0       ?       ? 
1 1 1   21    7   72 o     97.5   10.8    0.0000   0.0000          ?        ?    96.4168  21.0712          ?        ?       97.5       10.8       ?       ? 
1 1 1   21    7   73 o    128.5    8.2    0.0000   0.0000          ?        ?   166.6541  21.0712          ?        ?      128.5        8.2       ?       ? 
1 1 1   21    7   74 o    128.7    8.2    0.0000   0.0000          ?        ?   167.2927  21.0712          ?        ?      128.7        8.2       ?       ? 
1 1 1   21    7   75 o    103.5   10.5    0.0000   0.0000          ?        ?   109.1872  21.7097          ?        ?      103.5       10.5       ?       ? 
1 1 1   21    7   76 o    201.0    5.1    0.0000   0.0000          ?        ?   406.0997  20.4327          ?        ?      201.0        5.1       ?       ? 
1 1 1   21    8    0 o    394.4    3.0 1555.4387  23.6253  1555.4387  23.6253  1555.4387  23.6253      394.4      3.0      394.4        3.0     0.0     0.0 
1 1 1   21    8    1 o   2138.9    7.3    0.0000   0.0000          ?        ? 45755.8203 310.9600          ?        ?     2138.9        7.3       ?       ? 
1 1 1   21    8    2 o   1462.5    5.0    0.0000   0.0000          ?        ? 21391.1133 146.2215          ?        ?     1462.5        5.0       ?       ? 
1 1 1   21    8    3 o   1402.3    4.8    0.0000   0.0000          ?        ? 19665.1895 136.0051          ?        ?     1402.3        4.8       ?       ? 
1 1 1   21    8    4 o    658.4    2.6    0.0000   0.0000          ?        ?  4335.5620  33.8416          ?        ?      658.4        2.6       ?       ? 
1 1 1   21    8    5 o    922.9    3.5    0.0000   0.0000          ?        ?  8517.8789  63.8522          ?        ?      922.9        3.5       ?       ? 
1 1 1   21    8    6 o    744.2    3.0    0.0000   0.0000          ?        ?  5538.5366  44.0580          ?        ?      744.2        3.0       ?       ? 
1 1 1   21    8    7 o   1157.7    4.1    0.0000   0.0000          ?        ? 13402.5693  93.8627          ?        ?     1157.7        4.1       ?       ? 
1 1 1   21    8    8 o   1771.5    5.8    0.0000   0.0000          ?        ? 31385.8906 206.8810          ?        ?     1771.5        5.8       ?       ? 
1 1 1   21    8    9 o   1968.5    6.6    0.0000   0.0000          ?        ? 38756.9844 257.9627          ?        ?     1968.5        6.6       ?       ? 
1 1 1   21    8   10 o    989.9    3.5    0.0000   0.0000          ?        ?  9799.3906  70.2374          ?        ?      989.9        3.5       ?       ? 
1 1 1   21    8   11 o   1295.7    4.5    0.0000   0.0000          ?        ? 16789.2871 116.2109          ?        ?     1295.7        4.5       ?       ? 
1 1 1   21    8   12 o   1112.6    3.9    0.0000   0.0000          ?        ? 12380.2959  86.2004          ?        ?     1112.6        3.9       ?       ? 
1 1 1   21    8   13 o   1778.8    6.1    0.0000   0.0000          ?        ? 31644.4922 217.7359          ?        ?     1778.8        6.1       ?       ? 
1 1 1   21    8   14 o   2124.3    7.5    0.0000   0.0000          ?        ? 45133.2617 320.5379          ?        ?     2124.3        7.5       ?       ? 
1 1 1   21    8   15 o   1653.6    5.7    0.0000   0.0000          ?        ? 27347.2422 188.3639          ?        ?     1653.6        5.7       ?       ? 
1 1 1   21    8   16 o   1592.0    5.5    0.0000   0.0000          ?        ? 25348.0312 175.5934          ?        ?     1592.0        5.5       ?       ? 
1 1 1   21    8   17 o    917.7    3.6    0.0000   0.0000          ?        ?  8422.7383  65.7677          ?        ?      917.7        3.6       ?       ? 
1 1 1   21    8   18 o   1456.8    5.2    0.0000   0.0000          ?        ? 21223.8203 151.9681          ?        ?     1456.8        5.2       ?       ? 
1 1 1   21    8   19 o    737.1    3.0    0.0000   0.0000          ?        ?  5433.1807  44.0580          ?        ?      737.1        3.0       ?       ? 
1 1 1   21    8   20 o   1288.1    4.6    0.0000   0.0000          ?        ? 16591.9844 117.4880          ?        ?     1288.1        4.6       ?       ? 
1 1 1   21    8   21 o    214.3    4.2    0.0000   0.0000          ?        ?   459.0970  17.8786          ?        ?      214.3        4.2       ?       ? 
1 1 1   21    8   22 o   1288.5    4.6    0.0000   0.0000          ?        ? 16604.1152 118.1265          ?        ?     1288.5        4.6       ?       ? 
1 1 1   21    8   23 o    834.6    3.5    0.0000   0.0000          ?        ?  6965.6328  58.7440          ?        ?      834.6        3.5       ?       ? 
1 1 1   21    8   24 o    797.3    3.2    0.0000   0.0000          ?        ?  6357.7598  51.7203          ?        ?      797.3        3.2       ?       ? 
1 1 1   21    8   25 o   1139.8    4.4    0.0000   0.0000          ?        ? 12993.2764 100.2479          ?        ?     1139.8        4.4       ?       ? 
1 1 1   21    8   26 o   1019.6    3.7    0.0000   0.0000          ?        ? 10395.7705  75.3456          ?        ?     1019.6        3.7       ?       ? 
1 1 1   21    8   27 o   1330.7    4.7    0.0000   0.0000          ?        ? 17708.1211 125.1502          ?        ?     1330.7        4.7       ?       ? 
1 1 1   21    8   28 o    993.8    3.8    0.0000   0.0000          ?        ?  9876.6523  74.7070          ?        ?      993.8        3.8       ?       ? 
1 1 1   21    8   29 o   1439.4    5.3    0.0000   0.0000          ?        ? 20721.9434 151.3296          ?        ?     1439.4        5.3       ?       ? 
1 1 1   21    8   30 o   1265.1    4.4    0.0000   0.0000          ?        ? 16005.8213 112.3798          ?        ?     1265.1        4.4       ?       ? 
1 1 1   21    8   31 o    911.4    3.6    0.0000   0.0000          ?        ?  8307.8047  66.4062          ?        ?      911.4        3.6       ?       ? 
1 1 1   21    8   32 f    837.1    3.3    0.0000   0.0000          ?        ?  7007.1367  55.5514          ?        ?      837.1        3.3       ?       ? 
1 1 1   21    8   33 o    918.5    3.6    0.0000   0.0000          ?        ?  8437.4248  66.4062          ?        ?      918.5        3.6       ?       ? 
1 1 1   21    8   34 f    516.2    2.7    0.0000   0.0000          ?        ?  2665.1892  28.0950          ?        ?      516.2        2.7       ?       ? 
1 1 1   21    8   35 o   1291.4    4.5    0.0000   0.0000          ?        ? 16678.1855 116.8494          ?        ?     1291.4        4.5       ?       ? 
1 1 1   21    8   36 o    345.7    2.9    0.0000   0.0000          ?        ?  1195.3125  19.7942          ?        ?      345.7        2.9       ?       ? 
1 1 1   21    8   37 o    135.6    6.4    0.0000   0.0000          ?        ?   183.8942  17.2401          ?        ?      135.6        6.4       ?       ? 
1 1 1   21    8   38 o    387.1    3.0    0.0000   0.0000          ?        ?  1498.6102  22.9868          ?        ?      387.1        3.0       ?       ? 
1 1 1   21    8   39 o    181.7    4.4    0.0000   0.0000          ?        ?   330.1157  15.9630          ?        ?      181.7        4.4       ?       ? 
1 1 1   21    8   40 o    131.8    6.5    0.0000   0.0000          ?        ?   173.6779  17.2401          ?        ?      131.8        6.5       ?       ? 
1 1 1   21    8   41 o    653.4    2.9    0.0000   0.0000          ?        ?  4269.7944  37.6728          ?        ?      653.4        2.9       ?       ? 
1 1 1   21    8   42 o    674.0    2.9    0.0000   0.0000          ?        ?  4543.7197  39.5883          ?        ?      674.0        2.9       ?       ? 
1 1 1   21    8   43 o    180.3    4.6    0.0000   0.0000          ?        ?   325.0075  16.6016          ?        ?      180.3        4.6       ?       ? 
1 1 1   21    8   44 o    364.3    3.0    0.0000   0.0000          ?        ?  1327.4865  21.7097          ?        ?      364.3        3.0       ?       ? 
1 1 1   21    8   45 o    699.3    2.9    0.0000   0.0000          ?        ?  4891.0757  40.8654          ?        ?      699.3        2.9       ?       ? 
1 1 1   21    8   46 o    662.4    2.7    0.0000   0.0000          ?        ?  4388.5591  35.7572          ?        ?      662.4        2.7       ?       ? 
1 1 1   21    8   47 o    425.4    2.8    0.0000   0.0000          ?        ?  1809.5702  23.6253          ?        ?      425.4        2.8       ?       ? 
1 1 1   21    8   48 o    530.9    2.9    0.0000   0.0000          ?        ?  2819.0730  30.6490          ?        ?      530.9        2.9       ?       ? 
1 1 1   21    8   49 o    326.4    3.1    0.0000   0.0000          ?        ?  1065.6925  20.4327          ?        ?      326.4        3.1       ?       ? 
1 1 1   21    8   50 o    610.2    2.9    0.0000   0.0000          ?        ?  3723.8582  35.7572          ?        ?      610.2        2.9       ?       ? 
1 1 1   21    8   51 o    612.5    2.8    0.0000   0.0000          ?        ?  3752.5918  33.8416          ?        ?      612.5        2.8       ?       ? 
1 1 1   21    8   52 o    638.4    2.9    0.0000   0.0000          ?        ?  4076.9607  36.3957          ?        ?      638.4        2.9       ?       ? 
1 1 1   21    8   53 o     89.5   10.0    0.0000   0.0000          ?        ?    80.4537  17.8786          ?        ?       89.5       10.0       ?       ? 
1 1 1   21    8   54 o    379.2    2.9    0.0000   0.0000          ?        ?  1438.5892  21.7097          ?        ?      379.2        2.9       ?       ? 
1 1 1   21    8   55 o    222.1    4.3    0.0000   0.0000          ?        ?   493.5772  19.1556          ?        ?      222.1        4.3       ?       ? 
1 1 1   21    8   56 o    699.6    2.9    0.0000   0.0000          ?        ?  4895.5454  40.2269          ?        ?      699.6        2.9       ?       ? 
1 1 1   21    8   57 o    236.8    3.9    0.0000   0.0000          ?        ?   561.2605  18.5171          ?        ?      236.8        3.9       ?       ? 
1 1 1   21    8   58 o    143.5    6.5    0.0000   0.0000          ?        ?   206.2425  18.5171          ?        ?      143.5        6.5       ?       ? 
1 1 1   21    8   59 o     32.4   14.4    0.0000   0.0000          ?        ?    -6.3852  18.5171          ?        ?       32.4       14.4       ?       ? 
1 1 1   21    8   60 o     39.4   15.7    0.0000   0.0000          ?        ?     8.3008  18.5171          ?        ?       39.4       15.7       ?       ? 
1 1 1   21    8   61 o     21.2   10.6    0.0000   0.0000          ?        ?   -49.8047  18.5171          ?        ?       21.2       10.6       ?       ? 
1 1 1   21    8   62 o    432.9    2.9    0.0000   0.0000          ?        ?  1874.6996  24.9023          ?        ?      432.9        2.9       ?       ? 
1 1 1   21    8   63 o    234.3    4.8    0.0000   0.0000          ?        ?   549.7671  22.3483          ?        ?      234.3        4.8       ?       ? 
1 1 1   21    8   64 o    183.9    5.9    0.0000   0.0000          ?        ?   339.0550  21.7097          ?        ?      183.9        5.9       ?       ? 
1 1 1   21    8   65 o     57.5   16.7    0.0000   0.0000          ?        ?    34.4802  20.4327          ?        ?       57.5       16.7       ?       ? 
1 1 1   21    8   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    8   67 o     65.8   15.7    0.0000   0.0000          ?        ?    45.9736  20.4327          ?        ?       65.8       15.7       ?       ? 
1 1 1   21    8   68 o    237.1    4.7    0.0000   0.0000          ?        ?   563.1760  22.3483          ?        ?      237.1        4.7       ?       ? 
1 1 1   21    8   69 o    172.3    6.7    0.0000   0.0000          ?        ?   298.1896  22.9868          ?        ?      172.3        6.7       ?       ? 
1 1 1   21    8   70 o     72.3   15.5    0.0000   0.0000          ?        ?    55.5514  21.7097          ?        ?       72.3       15.5       ?       ? 
1 1 1   21    8   71 o    241.3    4.6    0.0000   0.0000          ?        ?   583.6088  22.3483          ?        ?      241.3        4.6       ?       ? 
1 1 1   21    8   72 o     95.2   10.7    0.0000   0.0000          ?        ?    91.9471  20.4327          ?        ?       95.2       10.7       ?       ? 
1 1 1   21    8   73 o    246.2    4.7    0.0000   0.0000          ?        ?   607.8726  22.9868          ?        ?      246.2        4.7       ?       ? 
1 1 1   21    8   74 o     45.7   17.5    0.0000   0.0000          ?        ?    15.9630  22.3483          ?        ?       45.7       17.5       ?       ? 
1 1 1   21    8   75 o     31.1   14.4    0.0000   0.0000          ?        ?   -17.8786  21.7097          ?        ?       31.1       14.4       ?       ? 
1 1 1   21    8   76 o    104.6   10.1    0.0000   0.0000          ?        ?   111.7413  21.0712          ?        ?      104.6       10.1       ?       ? 
1 1 1   21    9    0 o    588.0    4.1 3457.5947  47.8891  3457.5947  47.8891  3457.5947  47.8891      588.0      4.1      588.0        4.1     0.0     0.0 
1 1 1   21    9    1 o    319.6    2.4    0.0000   0.0000          ?        ?  1021.6346  15.3245          ?        ?      319.6        2.4       ?       ? 
1 1 1   21    9    2 o    821.9    3.3    0.0000   0.0000          ?        ?  6755.5586  53.6358          ?        ?      821.9        3.3       ?       ? 
1 1 1   21    9    3 o    791.3    3.0    0.0000   0.0000          ?        ?  6261.3428  47.2506          ?        ?      791.3        3.0       ?       ? 
1 1 1   21    9    4 o   1150.5    4.1    0.0000   0.0000          ?        ? 13236.5537  93.2242          ?        ?     1150.5        4.1       ?       ? 
1 1 1   21    9    5 o   1267.7    4.4    0.0000   0.0000          ?        ? 16070.9502 111.7413          ?        ?     1267.7        4.4       ?       ? 
1 1 1   21    9    6 o    973.8    3.5    0.0000   0.0000          ?        ?  9483.9619  68.9603          ?        ?      973.8        3.5       ?       ? 
1 1 1   21    9    7 o    824.2    3.1    0.0000   0.0000          ?        ?  6793.8701  51.7203          ?        ?      824.2        3.1       ?       ? 
1 1 1   21    9    8 o    485.6    2.2    0.0000   0.0000          ?        ?  2358.0603  21.0712          ?        ?      485.6        2.2       ?       ? 
1 1 1   21    9    9 o    901.8    3.3    0.0000   0.0000          ?        ?  8133.4888  59.3825          ?        ?      901.8        3.3       ?       ? 
1 1 1   21    9   10 o   1990.4    6.8    0.0000   0.0000          ?        ? 39622.8203 271.3717          ?        ?     1990.4        6.8       ?       ? 
1 1 1   21    9   11 o   1768.2    6.1    0.0000   0.0000          ?        ? 31267.7656 214.5433          ?        ?     1768.2        6.1       ?       ? 
1 1 1   21    9   12 o    843.1    3.2    0.0000   0.0000          ?        ?  7108.6616  54.2743          ?        ?      843.1        3.2       ?       ? 
1 1 1   21    9   13 o   2001.6    6.7    0.0000   0.0000          ?        ? 40069.7852 266.2635          ?        ?     2001.6        6.7       ?       ? 
1 1 1   21    9   14 o   1241.2    4.2    0.0000   0.0000          ?        ? 15407.5264 105.3561          ?        ?     1241.2        4.2       ?       ? 
1 1 1   21    9   15 o    962.0    3.6    0.0000   0.0000          ?        ?  9254.0947  68.3218          ?        ?      962.0        3.6       ?       ? 
1 1 1   21    9   16 o   1669.0    5.8    0.0000   0.0000          ?        ? 27856.7852 192.8335          ?        ?     1669.0        5.8       ?       ? 
1 1 1   21    9   17 o    809.0    3.1    0.0000   0.0000          ?        ?  6544.2085  49.8047          ?        ?      809.0        3.1       ?       ? 
1 1 1   21    9   18 o    735.8    2.8    0.0000   0.0000          ?        ?  5414.6636  41.5039          ?        ?      735.8        2.8       ?       ? 
1 1 1   21    9   19 o    153.1    4.0    0.0000   0.0000          ?        ?   234.3374  12.1319          ?        ?      153.1        4.0       ?       ? 
1 1 1   21    9   20 o    730.6    2.8    0.0000   0.0000          ?        ?  5338.0410  40.8654          ?        ?      730.6        2.8       ?       ? 
1 1 1   21    9   21 o   1245.9    4.3    0.0000   0.0000          ?        ? 15522.4609 106.6331          ?        ?     1245.9        4.3       ?       ? 
1 1 1   21    9   22 o   1107.8    3.9    0.0000   0.0000          ?        ? 12272.3857  87.4775          ?        ?     1107.8        3.9       ?       ? 
1 1 1   21    9   23 o    825.0    3.1    0.0000   0.0000          ?        ?  6807.2788  50.4432          ?        ?      825.0        3.1       ?       ? 
1 1 1   21    9   24 o   1695.6    5.6    0.0000   0.0000          ?        ? 28753.2676 190.2794          ?        ?     1695.6        5.6       ?       ? 
1 1 1   21    9   25 o   1114.3    4.1    0.0000   0.0000          ?        ? 12417.9688  91.3086          ?        ?     1114.3        4.1       ?       ? 
1 1 1   21    9   26 o   1348.5    4.9    0.0000   0.0000          ?        ? 18187.6484 131.5355          ?        ?     1348.5        4.9       ?       ? 
1 1 1   21    9   27 o    744.0    2.9    0.0000   0.0000          ?        ?  5535.9824  43.4195          ?        ?      744.0        2.9       ?       ? 
1 1 1   21    9   28 o    575.5    2.9    0.0000   0.0000          ?        ?  3312.6501  33.2031          ?        ?      575.5        2.9       ?       ? 
1 1 1   21    9   29 o   1538.6    5.5    0.0000   0.0000          ?        ? 23676.3828 168.5697          ?        ?     1538.6        5.5       ?       ? 
1 1 1   21    9   30 o   1061.5    4.0    0.0000   0.0000          ?        ? 11268.6299  85.5619          ?        ?     1061.5        4.0       ?       ? 
1 1 1   21    9   31 o    287.4    3.1    0.0000   0.0000          ?        ?   826.2469  17.8786          ?        ?      287.4        3.1       ?       ? 
1 1 1   21    9   32 o    839.6    3.4    0.0000   0.0000          ?        ?  7049.9170  56.8284          ?        ?      839.6        3.4       ?       ? 
1 1 1   21    9   33 o    440.1    2.8    0.0000   0.0000          ?        ?  1937.2745  24.2638          ?        ?      440.1        2.8       ?       ? 
1 1 1   21    9   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    9   35 o    159.4    6.0    0.0000   0.0000          ?        ?   254.1316  19.1556          ?        ?      159.4        6.0       ?       ? 
1 1 1   21    9   36 o    388.7    3.0    0.0000   0.0000          ?        ?  1510.7422  22.9868          ?        ?      388.7        3.0       ?       ? 
1 1 1   21    9   37 o   1202.2    4.3    0.0000   0.0000          ?        ? 14454.8525 102.8020          ?        ?     1202.2        4.3       ?       ? 
1 1 1   21    9   38 o    387.7    2.8    0.0000   0.0000          ?        ?  1503.0798  21.7097          ?        ?      387.7        2.8       ?       ? 
1 1 1   21    9   39 o     43.5   15.6    0.0000   0.0000          ?        ?    15.9630  17.2401          ?        ?       43.5       15.6       ?       ? 
1 1 1   21    9   40 o    649.9    2.9    0.0000   0.0000          ?        ?  4223.8208  38.3113          ?        ?      649.9        2.9       ?       ? 
1 1 1   21    9   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    9   42 f    684.9    2.9    0.0000   0.0000          ?        ?  4691.8569  40.2269          ?        ?      684.9        2.9       ?       ? 
1 1 1   21    9   43 o    510.3    2.6    0.0000   0.0000          ?        ?  2604.5298  26.8179          ?        ?      510.3        2.6       ?       ? 
1 1 1   21    9   44 o    326.1    3.1    0.0000   0.0000          ?        ?  1063.7771  20.4327          ?        ?      326.1        3.1       ?       ? 
1 1 1   21    9   45 o    103.5    8.0    0.0000   0.0000          ?        ?   107.2716  16.6016          ?        ?      103.5        8.0       ?       ? 
1 1 1   21    9   46 o    445.6    2.9    0.0000   0.0000          ?        ?  1985.8022  25.5409          ?        ?      445.6        2.9       ?       ? 
1 1 1   21    9   47 o    687.9    3.1    0.0000   0.0000          ?        ?  4732.7222  42.7809          ?        ?      687.9        3.1       ?       ? 
1 1 1   21    9   48 o    289.9    3.4    0.0000   0.0000          ?        ?   840.9330  19.7942          ?        ?      289.9        3.4       ?       ? 
1 1 1   21    9   49 o    325.9    3.0    0.0000   0.0000          ?        ?  1062.5000  19.7942          ?        ?      325.9        3.0       ?       ? 
1 1 1   21    9   50 o    134.6    6.6    0.0000   0.0000          ?        ?   181.3401  17.8786          ?        ?      134.6        6.6       ?       ? 
1 1 1   21    9   51 o    258.6    3.5    0.0000   0.0000          ?        ?   669.1707  17.8786          ?        ?      258.6        3.5       ?       ? 
1 1 1   21    9   52 o    507.8    2.7    0.0000   0.0000          ?        ?  2579.6274  27.4564          ?        ?      507.8        2.7       ?       ? 
1 1 1   21    9   53 o    467.4    2.7    0.0000   0.0000          ?        ?  2185.0210  25.5409          ?        ?      467.4        2.7       ?       ? 
1 1 1   21    9   54 f    480.8    2.6    0.0000   0.0000          ?        ?  2312.0869  24.9023          ?        ?      480.8        2.6       ?       ? 
1 1 1   21    9   55 f    303.5    3.4    0.0000   0.0000          ?        ?   921.3867  20.4327          ?        ?      303.5        3.4       ?       ? 
1 1 1   21    9   56 o     27.6   13.0    0.0000   0.0000          ?        ?   -20.4327  18.5171          ?        ?       27.6       13.0       ?       ? 
1 1 1   21    9   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21    9   58 o    245.5    3.9    0.0000   0.0000          ?        ?   603.4030  19.1556          ?        ?      245.5        3.9       ?       ? 
1 1 1   21    9   59 o    126.1    7.6    0.0000   0.0000          ?        ?   159.6304  19.1556          ?        ?      126.1        7.6       ?       ? 
1 1 1   21    9   60 o     32.5   14.5    0.0000   0.0000          ?        ?    -7.6623  19.1556          ?        ?       32.5       14.5       ?       ? 
1 1 1   21    9   61 o     87.6   11.3    0.0000   0.0000          ?        ?    77.2611  19.7942          ?        ?       87.6       11.3       ?       ? 
1 1 1   21    9   62 o    292.1    3.7    0.0000   0.0000          ?        ?   853.7034  21.7097          ?        ?      292.1        3.7       ?       ? 
1 1 1   21    9   63 f    662.4    3.1    0.0000   0.0000          ?        ?  4389.8364  40.8654          ?        ?      662.4        3.1       ?       ? 
1 1 1   21    9   64 o    237.4    4.4    0.0000   0.0000          ?        ?   564.4531  21.0712          ?        ?      237.4        4.4       ?       ? 
1 1 1   21    9   65 o    318.1    3.5    0.0000   0.0000          ?        ?  1012.6953  22.3483          ?        ?      318.1        3.5       ?       ? 
1 1 1   21    9   66 o     85.9   11.9    0.0000   0.0000          ?        ?    74.7070  20.4327          ?        ?       85.9       11.9       ?       ? 
1 1 1   21    9   67 o     73.0   15.0    0.0000   0.0000          ?        ?    56.1899  21.0712          ?        ?       73.0       15.0       ?       ? 
1 1 1   21    9   68 o    129.4    8.1    0.0000   0.0000          ?        ?   168.5697  21.0712          ?        ?      129.4        8.1       ?       ? 
1 1 1   21    9   69 o     26.6   12.9    0.0000   0.0000          ?        ?   -33.8416  21.0712          ?        ?       26.6       12.9       ?       ? 
1 1 1   21    9   70 o    293.5    3.9    0.0000   0.0000          ?        ?   862.6428  22.9868          ?        ?      293.5        3.9       ?       ? 
1 1 1   21    9   71 o     36.9   16.0    0.0000   0.0000          ?        ?    -1.9156  21.7097          ?        ?       36.9       16.0       ?       ? 
1 1 1   21    9   72 o     41.7   16.8    0.0000   0.0000          ?        ?     8.9393  21.7097          ?        ?       41.7       16.8       ?       ? 
1 1 1   21    9   73 o    144.0    8.0    0.0000   0.0000          ?        ?   209.4351  22.9868          ?        ?      144.0        8.0       ?       ? 
1 1 1   21    9   74 o    184.8    6.0    0.0000   0.0000          ?        ?   343.5246  22.3483          ?        ?      184.8        6.0       ?       ? 
1 1 1   21    9   75 o     34.6   15.4    0.0000   0.0000          ?        ?    -7.0237  21.7097          ?        ?       34.6       15.4       ?       ? 
1 1 1   21   10    0 o    817.9    4.6 6690.4297  75.9841  6690.4297  75.9841  6690.4297  75.9841      817.9      4.6      817.9        4.6     0.0     0.0 
1 1 1   21   10    1 o   1227.7    4.5    0.0000   0.0000          ?        ? 15073.5801 110.4642          ?        ?     1227.7        4.5       ?       ? 
1 1 1   21   10    2 o    899.0    3.4    0.0000   0.0000          ?        ?  8082.4072  60.6596          ?        ?      899.0        3.4       ?       ? 
1 1 1   21   10    3 o    303.4    2.3    0.0000   0.0000          ?        ?   920.7482  14.0475          ?        ?      303.4        2.3       ?       ? 
1 1 1   21   10    4 o    927.3    3.3    0.0000   0.0000          ?        ?  8598.3320  61.9366          ?        ?      927.3        3.3       ?       ? 
1 1 1   21   10    5 o    376.9    1.9    0.0000   0.0000          ?        ?  1420.7106  14.6860          ?        ?      376.9        1.9       ?       ? 
1 1 1   21   10    6 o   2152.2    7.2    0.0000   0.0000          ?        ? 46327.9375 308.4059          ?        ?     2152.2        7.2       ?       ? 
1 1 1   21   10    7 o   1264.7    4.5    0.0000   0.0000          ?        ? 15996.2432 114.9339          ?        ?     1264.7        4.5       ?       ? 
1 1 1   21   10    8 o    887.0    3.3    0.0000   0.0000          ?        ?  7868.5024  58.7440          ?        ?      887.0        3.3       ?       ? 
1 1 1   21   10    9 o    330.4    2.0    0.0000   0.0000          ?        ?  1091.8719  13.4090          ?        ?      330.4        2.0       ?       ? 
1 1 1   21   10   10 o   2168.7    7.7    0.0000   0.0000          ?        ? 47039.8867 334.5853          ?        ?     2168.7        7.7       ?       ? 
1 1 1   21   10   11 o   1580.5    5.5    0.0000   0.0000          ?        ? 24982.7969 173.0394          ?        ?     1580.5        5.5       ?       ? 
1 1 1   21   10   12 o    469.1    2.2    0.0000   0.0000          ?        ?  2200.3455  21.0712          ?        ?      469.1        2.2       ?       ? 
1 1 1   21   10   13 o    908.9    3.3    0.0000   0.0000          ?        ?  8261.1934  60.6596          ?        ?      908.9        3.3       ?       ? 
1 1 1   21   10   14 o    771.1    3.1    0.0000   0.0000          ?        ?  5945.9136  47.8891          ?        ?      771.1        3.1       ?       ? 
1 1 1   21   10   15 f   1468.4    5.1    0.0000   0.0000          ?        ? 21564.1523 150.0526          ?        ?     1468.4        5.1       ?       ? 
1 1 1   21   10   16 o    968.0    3.7    0.0000   0.0000          ?        ?  9370.9434  70.8759          ?        ?      968.0        3.7       ?       ? 
1 1 1   21   10   17 o    557.9    2.6    0.0000   0.0000          ?        ?  3112.1543  28.7335          ?        ?      557.9        2.6       ?       ? 
1 1 1   21   10   18 o   1133.2    4.0    0.0000   0.0000          ?        ? 12843.2246  91.3086          ?        ?     1133.2        4.0       ?       ? 
1 1 1   21   10   19 o    779.9    3.0    0.0000   0.0000          ?        ?  6083.1958  46.6121          ?        ?      779.9        3.0       ?       ? 
1 1 1   21   10   20 o   1462.9    5.3    0.0000   0.0000          ?        ? 21402.6055 154.5222          ?        ?     1462.9        5.3       ?       ? 
1 1 1   21   10   21 o    991.0    3.9    0.0000   0.0000          ?        ?  9820.4629  77.2611          ?        ?      991.0        3.9       ?       ? 
1 1 1   21   10   22 o   1031.2    4.0    0.0000   0.0000          ?        ? 10634.5781  82.3693          ?        ?     1031.2        4.0       ?       ? 
1 1 1   21   10   23 o    878.6    3.5    0.0000   0.0000          ?        ?  7719.7266  60.6596          ?        ?      878.6        3.5       ?       ? 
1 1 1   21   10   24 o    233.0    3.6    0.0000   0.0000          ?        ?   542.7434  16.6016          ?        ?      233.0        3.6       ?       ? 
1 1 1   21   10   25 o    233.2    3.8    0.0000   0.0000          ?        ?   544.0204  17.8786          ?        ?      233.2        3.8       ?       ? 
1 1 1   21   10   26 o   1788.4    6.5    0.0000   0.0000          ?        ? 31990.5723 232.4219          ?        ?     1788.4        6.5       ?       ? 
1 1 1   21   10   27 o   1466.6    5.3    0.0000   0.0000          ?        ? 21512.4336 156.4378          ?        ?     1466.6        5.3       ?       ? 
1 1 1   21   10   28 o   1423.8    4.9    0.0000   0.0000          ?        ? 20273.0625 139.1977          ?        ?     1423.8        4.9       ?       ? 
1 1 1   21   10   29 o    927.0    3.6    0.0000   0.0000          ?        ?  8594.5010  67.0448          ?        ?      927.0        3.6       ?       ? 
1 1 1   21   10   30 o    421.1    3.3    0.0000   0.0000          ?        ?  1773.1747  27.4564          ?        ?      421.1        3.3       ?       ? 
1 1 1   21   10   31 o    485.7    2.6    0.0000   0.0000          ?        ?  2358.6987  25.5409          ?        ?      485.7        2.6       ?       ? 
1 1 1   21   10   32 o   1285.6    4.7    0.0000   0.0000          ?        ? 16530.0488 121.3191          ?        ?     1285.6        4.7       ?       ? 
1 1 1   21   10   33 o     32.8   14.1    0.0000   0.0000          ?        ?    -1.2770  16.6016          ?        ?       32.8       14.1       ?       ? 
1 1 1   21   10   34 o    716.9    2.9    0.0000   0.0000          ?        ?  5140.0991  42.1424          ?        ?      716.9        2.9       ?       ? 
1 1 1   21   10   35 o    678.6    3.0    0.0000   0.0000          ?        ?  4605.0181  40.2269          ?        ?      678.6        3.0       ?       ? 
1 1 1   21   10   36 o    808.8    3.4    0.0000   0.0000          ?        ?  6541.6543  54.9129          ?        ?      808.8        3.4       ?       ? 
1 1 1   21   10   37 o    576.5    2.8    0.0000   0.0000          ?        ?  3324.1433  32.5646          ?        ?      576.5        2.8       ?       ? 
1 1 1   21   10   38 o    362.4    2.7    0.0000   0.0000          ?        ?  1313.4390  19.7942          ?        ?      362.4        2.7       ?       ? 
1 1 1   21   10   39 o     25.9   12.2    0.0000   0.0000          ?        ?   -19.1556  16.6016          ?        ?       25.9       12.2       ?       ? 
1 1 1   21   10   40 o   1051.1    3.8    0.0000   0.0000          ?        ? 11050.2549  80.4537          ?        ?     1051.1        3.8       ?       ? 
1 1 1   21   10   41 f    909.2    3.5    0.0000   0.0000          ?        ?  8267.5781  64.4907          ?        ?      909.2        3.5       ?       ? 
1 1 1   21   10   42 o    727.6    3.0    0.0000   0.0000          ?        ?  5295.2598  44.0580          ?        ?      727.6        3.0       ?       ? 
1 1 1   21   10   43 o    378.3    2.8    0.0000   0.0000          ?        ?  1431.5654  21.0712          ?        ?      378.3        2.8       ?       ? 
1 1 1   21   10   44 o    582.8    2.7    0.0000   0.0000          ?        ?  3396.9351  31.2876          ?        ?      582.8        2.7       ?       ? 
1 1 1   21   10   45 o    392.9    2.8    0.0000   0.0000          ?        ?  1543.9453  21.7097          ?        ?      392.9        2.8       ?       ? 
1 1 1   21   10   46 o    129.0    6.4    0.0000   0.0000          ?        ?   166.6541  16.6016          ?        ?      129.0        6.4       ?       ? 
1 1 1   21   10   47 o     22.9   11.2    0.0000   0.0000          ?        ?   -30.6490  16.6016          ?        ?       22.9       11.2       ?       ? 
1 1 1   21   10   48 o    200.8    4.5    0.0000   0.0000          ?        ?   403.5457  17.8786          ?        ?      200.8        4.5       ?       ? 
1 1 1   21   10   49 o    366.1    3.1    0.0000   0.0000          ?        ?  1340.8954  22.3483          ?        ?      366.1        3.1       ?       ? 
1 1 1   21   10   50 o    349.4    2.9    0.0000   0.0000          ?        ?  1220.8533  20.4327          ?        ?      349.4        2.9       ?       ? 
1 1 1   21   10   51 o    311.8    3.3    0.0000   0.0000          ?        ?   972.4684  20.4327          ?        ?      311.8        3.3       ?       ? 
1 1 1   21   10   52 o    189.0    4.9    0.0000   0.0000          ?        ?   357.5721  18.5171          ?        ?      189.0        4.9       ?       ? 
1 1 1   21   10   53 o    463.2    2.8    0.0000   0.0000          ?        ?  2146.0713  26.1794          ?        ?      463.2        2.8       ?       ? 
1 1 1   21   10   54 o    345.5    3.1    0.0000   0.0000          ?        ?  1194.0354  21.7097          ?        ?      345.5        3.1       ?       ? 
1 1 1   21   10   55 o    789.1    3.2    0.0000   0.0000          ?        ?  6229.4170  50.4432          ?        ?      789.1        3.2       ?       ? 
1 1 1   21   10   56 o    131.4    7.5    0.0000   0.0000          ?        ?   173.0394  19.7942          ?        ?      131.4        7.5       ?       ? 
1 1 1   21   10   57 o    317.0    3.3    0.0000   0.0000          ?        ?  1005.6716  21.0712          ?        ?      317.0        3.3       ?       ? 
1 1 1   21   10   58 o    203.8    4.9    0.0000   0.0000          ?        ?   415.6776  19.7942          ?        ?      203.8        4.9       ?       ? 
1 1 1   21   10   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   10   60 o     97.9    9.8    0.0000   0.0000          ?        ?    96.4168  19.1556          ?        ?       97.9        9.8       ?       ? 
1 1 1   21   10   61 o    266.2    4.1    0.0000   0.0000          ?        ?   709.3975  21.7097          ?        ?      266.2        4.1       ?       ? 
1 1 1   21   10   62 o     84.5   12.5    0.0000   0.0000          ?        ?    72.1529  21.0712          ?        ?       84.5       12.5       ?       ? 
1 1 1   21   10   63 o    242.0    4.4    0.0000   0.0000          ?        ?   586.1629  21.0712          ?        ?      242.0        4.4       ?       ? 
1 1 1   21   10   64 o    188.2    5.6    0.0000   0.0000          ?        ?   355.0180  21.0712          ?        ?      188.2        5.6       ?       ? 
1 1 1   21   10   65 o    201.0    5.2    0.0000   0.0000          ?        ?   404.8227  21.0712          ?        ?      201.0        5.2       ?       ? 
1 1 1   21   10   66 o    110.9    9.5    0.0000   0.0000          ?        ?   123.8732  21.0712          ?        ?      110.9        9.5       ?       ? 
1 1 1   21   10   67 o    185.4    5.9    0.0000   0.0000          ?        ?   344.8017  21.7097          ?        ?      185.4        5.9       ?       ? 
1 1 1   21   10   68 o    115.3    9.4    0.0000   0.0000          ?        ?   134.0895  21.7097          ?        ?      115.3        9.4       ?       ? 
1 1 1   21   10   69 o    163.0    6.7    0.0000   0.0000          ?        ?   266.9020  21.7097          ?        ?      163.0        6.7       ?       ? 
1 1 1   21   10   70 o     22.1   11.1    0.0000   0.0000          ?        ?   -63.8522  21.7097          ?        ?       22.1       11.1       ?       ? 
1 1 1   21   10   71 o     99.0   11.0    0.0000   0.0000          ?        ?    99.6094  21.7097          ?        ?       99.0       11.0       ?       ? 
1 1 1   21   10   72 o    144.1    7.5    0.0000   0.0000          ?        ?   209.4351  21.7097          ?        ?      144.1        7.5       ?       ? 
1 1 1   21   10   73 o     76.4   13.9    0.0000   0.0000          ?        ?    61.9366  20.4327          ?        ?       76.4       13.9       ?       ? 
1 1 1   21   10   74 o    153.4    7.3    0.0000   0.0000          ?        ?   237.5300  22.3483          ?        ?      153.4        7.3       ?       ? 
1 1 1   21   10   75 o    116.1    9.3    0.0000   0.0000          ?        ?   137.2822  21.7097          ?        ?      116.1        9.3       ?       ? 
1 1 1   21   11    0 o   1124.9    6.1 12656.7754 137.9207 12656.7754 137.9207 12656.7754 137.9207     1124.9      6.1     1124.9        6.1     0.0     0.0 
1 1 1   21   11    1 o    588.8    2.8    0.0000   0.0000          ?        ?  3467.1724  32.5646          ?        ?      588.8        2.8       ?       ? 
1 1 1   21   11    2 o    620.8    2.8    0.0000   0.0000          ?        ?  3854.1165  35.1187          ?        ?      620.8        2.8       ?       ? 
1 1 1   21   11    3 o   1290.7    4.9    0.0000   0.0000          ?        ? 16659.0293 127.7043          ?        ?     1290.7        4.9       ?       ? 
1 1 1   21   11    4 o   1072.4    4.1    0.0000   0.0000          ?        ? 11501.0508  87.4775          ?        ?     1072.4        4.1       ?       ? 
1 1 1   21   11    5 o   2167.6    8.1    0.0000   0.0000          ?        ? 46992.0000 351.1869          ?        ?     2167.6        8.1       ?       ? 
1 1 1   21   11    6 o    741.2    3.2    0.0000   0.0000          ?        ?  5493.2017  47.2506          ?        ?      741.2        3.2       ?       ? 
1 1 1   21   11    7 o   1281.5    4.9    0.0000   0.0000          ?        ? 16424.0527 125.1502          ?        ?     1281.5        4.9       ?       ? 
1 1 1   21   11    8 o    413.6    2.2    0.0000   0.0000          ?        ?  1710.5994  17.8786          ?        ?      413.6        2.2       ?       ? 
1 1 1   21   11    9 o   1265.3    4.3    0.0000   0.0000          ?        ? 16010.2910 109.1872          ?        ?     1265.3        4.3       ?       ? 
1 1 1   21   11   10 o   1217.8    4.1    0.0000   0.0000          ?        ? 14832.2178 100.8864          ?        ?     1217.8        4.1       ?       ? 
1 1 1   21   11   11 o    237.6    2.3    0.0000   0.0000          ?        ?   564.4531  10.8549          ?        ?      237.6        2.3       ?       ? 
1 1 1   21   11   12 o   1882.5    6.3    0.0000   0.0000          ?        ? 35440.5039 236.8915          ?        ?     1882.5        6.3       ?       ? 
1 1 1   21   11   13 o    840.4    3.3    0.0000   0.0000          ?        ?  7063.3257  54.9129          ?        ?      840.4        3.3       ?       ? 
1 1 1   21   11   14 o    246.8    2.6    0.0000   0.0000          ?        ?   609.1497  12.7704          ?        ?      246.8        2.6       ?       ? 
1 1 1   21   11   15 o    376.7    2.4    0.0000   0.0000          ?        ?  1418.7950  17.8786          ?        ?      376.7        2.4       ?       ? 
1 1 1   21   11   16 o    883.2    3.3    0.0000   0.0000          ?        ?  7800.8184  58.1055          ?        ?      883.2        3.3       ?       ? 
1 1 1   21   11   17 o    666.0    2.8    0.0000   0.0000          ?        ?  4435.8101  37.6728          ?        ?      666.0        2.8       ?       ? 
1 1 1   21   11   18 o   1256.2    4.4    0.0000   0.0000          ?        ? 15782.3389 110.4642          ?        ?     1256.2        4.4       ?       ? 
1 1 1   21   11   19 o    935.0    3.4    0.0000   0.0000          ?        ?  8743.2773  63.2136          ?        ?      935.0        3.4       ?       ? 
1 1 1   21   11   20 o    688.8    2.9    0.0000   0.0000          ?        ?  4744.2158  39.5883          ?        ?      688.8        2.9       ?       ? 
1 1 1   21   11   21 o    157.8    4.0    0.0000   0.0000          ?        ?   249.0234  12.7704          ?        ?      157.8        4.0       ?       ? 
1 1 1   21   11   22 o   1339.3    4.6    0.0000   0.0000          ?        ? 17937.9883 124.5117          ?        ?     1339.3        4.6       ?       ? 
1 1 1   21   11   23 o    358.5    2.6    0.0000   0.0000          ?        ?  1285.3440  18.5171          ?        ?      358.5        2.6       ?       ? 
1 1 1   21   11   24 o    330.9    2.6    0.0000   0.0000          ?        ?  1095.0646  17.2401          ?        ?      330.9        2.6       ?       ? 
1 1 1   21   11   25 o    334.4    2.4    0.0000   0.0000          ?        ?  1118.0514  15.9630          ?        ?      334.4        2.4       ?       ? 
1 1 1   21   11   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   11   27 o    429.8    2.5    0.0000   0.0000          ?        ?  1847.2430  21.7097          ?        ?      429.8        2.5       ?       ? 
1 1 1   21   11   28 o    309.9    2.7    0.0000   0.0000          ?        ?   960.3365  16.6016          ?        ?      309.9        2.7       ?       ? 
1 1 1   21   11   29 o   1160.0    4.2    0.0000   0.0000          ?        ? 13456.8438  97.6938          ?        ?     1160.0        4.2       ?       ? 
1 1 1   21   11   30 o   1196.5    4.3    0.0000   0.0000          ?        ? 14316.9316 103.4405          ?        ?     1196.5        4.3       ?       ? 
1 1 1   21   11   31 o    850.9    3.3    0.0000   0.0000          ?        ?  7240.8354  56.8284          ?        ?      850.9        3.3       ?       ? 
1 1 1   21   11   32 o    730.3    3.0    0.0000   0.0000          ?        ?  5334.2100  44.0580          ?        ?      730.3        3.0       ?       ? 
1 1 1   21   11   33 o   1464.6    4.9    0.0000   0.0000          ?        ? 21454.9648 144.3059          ?        ?     1464.6        4.9       ?       ? 
1 1 1   21   11   34 o    180.6    4.2    0.0000   0.0000          ?        ?   326.2845  15.3245          ?        ?      180.6        4.2       ?       ? 
1 1 1   21   11   35 o     65.2   13.2    0.0000   0.0000          ?        ?    44.0580  16.6016          ?        ?       65.2       13.2       ?       ? 
1 1 1   21   11   36 o    905.9    3.4    0.0000   0.0000          ?        ?  8206.9189  61.9366          ?        ?      905.9        3.4       ?       ? 
1 1 1   21   11   37 o    417.2    2.8    0.0000   0.0000          ?        ?  1740.6100  23.6253          ?        ?      417.2        2.8       ?       ? 
1 1 1   21   11   38 o    778.8    3.1    0.0000   0.0000          ?        ?  6065.3169  48.5276          ?        ?      778.8        3.1       ?       ? 
1 1 1   21   11   39 o    610.7    2.8    0.0000   0.0000          ?        ?  3729.6047  34.4802          ?        ?      610.7        2.8       ?       ? 
1 1 1   21   11   40 o    138.6    6.2    0.0000   0.0000          ?        ?   192.1950  17.2401          ?        ?      138.6        6.2       ?       ? 
1 1 1   21   11   41 o    281.4    3.2    0.0000   0.0000          ?        ?   791.7668  17.8786          ?        ?      281.4        3.2       ?       ? 
1 1 1   21   11   42 o    466.4    2.7    0.0000   0.0000          ?        ?  2175.4434  24.9023          ?        ?      466.4        2.7       ?       ? 
1 1 1   21   11   43 o    147.1    5.6    0.0000   0.0000          ?        ?   216.4588  16.6016          ?        ?      147.1        5.6       ?       ? 
1 1 1   21   11   44 o    328.5    2.8    0.0000   0.0000          ?        ?  1079.1016  18.5171          ?        ?      328.5        2.8       ?       ? 
1 1 1   21   11   45 o    160.8    5.0    0.0000   0.0000          ?        ?   258.6013  15.9630          ?        ?      160.8        5.0       ?       ? 
1 1 1   21   11   46 o    280.3    3.4    0.0000   0.0000          ?        ?   786.0201  19.1556          ?        ?      280.3        3.4       ?       ? 
1 1 1   21   11   47 o    412.2    2.6    0.0000   0.0000          ?        ?  1699.1061  21.7097          ?        ?      412.2        2.6       ?       ? 
1 1 1   21   11   48 o    227.7    3.9    0.0000   0.0000          ?        ?   518.4796  17.8786          ?        ?      227.7        3.9       ?       ? 
1 1 1   21   11   49 o    105.6    8.5    0.0000   0.0000          ?        ?   111.7413  17.8786          ?        ?      105.6        8.5       ?       ? 
1 1 1   21   11   50 o    362.5    2.8    0.0000   0.0000          ?        ?  1314.0775  20.4327          ?        ?      362.5        2.8       ?       ? 
1 1 1   21   11   51 o    330.2    3.0    0.0000   0.0000          ?        ?  1090.5950  19.7942          ?        ?      330.2        3.0       ?       ? 
1 1 1   21   11   52 o    139.0    6.4    0.0000   0.0000          ?        ?   193.4720  17.8786          ?        ?      139.0        6.4       ?       ? 
1 1 1   21   11   53 o    400.5    2.9    0.0000   0.0000          ?        ?  1604.6049  22.9868          ?        ?      400.5        2.9       ?       ? 
1 1 1   21   11   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   11   55 o    260.8    3.7    0.0000   0.0000          ?        ?   680.6641  19.1556          ?        ?      260.8        3.7       ?       ? 
1 1 1   21   11   56 o    368.7    3.0    0.0000   0.0000          ?        ?  1360.0510  22.3483          ?        ?      368.7        3.0       ?       ? 
1 1 1   21   11   57 o     58.4   15.6    0.0000   0.0000          ?        ?    35.7572  18.5171          ?        ?       58.4       15.6       ?       ? 
1 1 1   21   11   58 o     27.0   12.9    0.0000   0.0000          ?        ?   -24.9023  19.1556          ?        ?       27.0       12.9       ?       ? 
1 1 1   21   11   59 o    326.1    3.4    0.0000   0.0000          ?        ?  1064.4155  22.3483          ?        ?      326.1        3.4       ?       ? 
1 1 1   21   11   60 o    338.7    3.2    0.0000   0.0000          ?        ?  1148.0619  21.7097          ?        ?      338.7        3.2       ?       ? 
1 1 1   21   11   61 o    191.6    5.3    0.0000   0.0000          ?        ?   367.7885  20.4327          ?        ?      191.6        5.3       ?       ? 
1 1 1   21   11   62 o     69.2   14.7    0.0000   0.0000          ?        ?    50.4432  19.7942          ?        ?       69.2       14.7       ?       ? 
1 1 1   21   11   63 o    320.5    3.2    0.0000   0.0000          ?        ?  1028.0198  20.4327          ?        ?      320.5        3.2       ?       ? 
1 1 1   21   11   64 o     59.3   16.2    0.0000   0.0000          ?        ?    37.0343  19.7942          ?        ?       59.3       16.2       ?       ? 
1 1 1   21   11   65 o     57.9   16.7    0.0000   0.0000          ?        ?    35.1187  20.4327          ?        ?       57.9       16.7       ?       ? 
1 1 1   21   11   66 o    221.7    4.6    0.0000   0.0000          ?        ?   492.3002  20.4327          ?        ?      221.7        4.6       ?       ? 
1 1 1   21   11   67 o     37.3   15.8    0.0000   0.0000          ?        ?     1.2770  20.4327          ?        ?       37.3       15.8       ?       ? 
1 1 1   21   11   68 o    493.5    3.0    0.0000   0.0000          ?        ?  2437.8755  29.3720          ?        ?      493.5        3.0       ?       ? 
1 1 1   21   11   69 o    159.0    7.0    0.0000   0.0000          ?        ?   254.1316  22.3483          ?        ?      159.0        7.0       ?       ? 
1 1 1   21   11   70 o    100.6   11.1    0.0000   0.0000          ?        ?   102.8020  22.3483          ?        ?      100.6       11.1       ?       ? 
1 1 1   21   11   71 o     32.0   14.7    0.0000   0.0000          ?        ?   -15.3245  21.7097          ?        ?       32.0       14.7       ?       ? 
1 1 1   21   11   72 o    161.8    6.9    0.0000   0.0000          ?        ?   263.7094  22.3483          ?        ?      161.8        6.9       ?       ? 
1 1 1   21   11   73 o     29.1   13.9    0.0000   0.0000          ?        ?   -27.4564  22.3483          ?        ?       29.1       13.9       ?       ? 
1 1 1   21   11   74 o    110.6    9.5    0.0000   0.0000          ?        ?   124.5117  21.0712          ?        ?      110.6        9.5       ?       ? 
1 1 1   21   11   75 o    161.8    6.5    0.0000   0.0000          ?        ?   264.3480  21.0712          ?        ?      161.8        6.5       ?       ? 
1 1 1   21   12    0 o    459.6    4.2 2112.8679  38.9498  2112.8679  38.9498  2112.8679  38.9498      459.6      4.2      459.6        4.2     0.0     0.0 
1 1 1   21   12    1 o    914.8    4.3    0.0000   0.0000          ?        ?  8368.4639  79.1767          ?        ?      914.8        4.3       ?       ? 
1 1 1   21   12    2 o   1720.4    7.5    0.0000   0.0000          ?        ? 29603.7773 259.2398          ?        ?     1720.4        7.5       ?       ? 
1 1 1   21   12    3 o   1282.3    5.6    0.0000   0.0000          ?        ? 16445.1250 143.0288          ?        ?     1282.3        5.6       ?       ? 
1 1 1   21   12    4 o    644.1    2.9    0.0000   0.0000          ?        ?  4149.1133  37.6728          ?        ?      644.1        2.9       ?       ? 
1 1 1   21   12    5 o   1167.3    4.4    0.0000   0.0000          ?        ? 13627.3281 102.1635          ?        ?     1167.3        4.4       ?       ? 
1 1 1   21   12    6 o   1365.2    5.0    0.0000   0.0000          ?        ? 18638.4453 137.2822          ?        ?     1365.2        5.0       ?       ? 
1 1 1   21   12    7 o   1275.3    4.5    0.0000   0.0000          ?        ? 16263.7852 115.5724          ?        ?     1275.3        4.5       ?       ? 
1 1 1   21   12    8 o   1768.8    5.9    0.0000   0.0000          ?        ? 31288.1992 208.7966          ?        ?     1768.8        5.9       ?       ? 
1 1 1   21   12    9 o   1753.3    5.9    0.0000   0.0000          ?        ? 30742.2637 205.6040          ?        ?     1753.3        5.9       ?       ? 
1 1 1   21   12   10 o   1350.4    4.7    0.0000   0.0000          ?        ? 18236.8164 125.7888          ?        ?     1350.4        4.7       ?       ? 
1 1 1   21   12   11 o    560.2    2.5    0.0000   0.0000          ?        ?  3138.3337  27.4564          ?        ?      560.2        2.5       ?       ? 
1 1 1   21   12   12 o   1311.8    4.6    0.0000   0.0000          ?        ? 17208.1582 121.3191          ?        ?     1311.8        4.6       ?       ? 
1 1 1   21   12   13 o   1216.2    4.4    0.0000   0.0000          ?        ? 14791.3535 106.6331          ?        ?     1216.2        4.4       ?       ? 
1 1 1   21   12   14 o    340.7    2.1    0.0000   0.0000          ?        ?  1160.8323  14.0475          ?        ?      340.7        2.1       ?       ? 
1 1 1   21   12   15 o   1702.0    5.6    0.0000   0.0000          ?        ? 28971.0039 191.5565          ?        ?     1702.0        5.6       ?       ? 
1 1 1   21   12   16 f   1471.4    5.1    0.0000   0.0000          ?        ? 21650.9922 149.4141          ?        ?     1471.4        5.1       ?       ? 
1 1 1   21   12   17 o   1402.4    4.7    0.0000   0.0000          ?        ? 19670.2969 132.1740          ?        ?     1402.4        4.7       ?       ? 
1 1 1   21   12   18 o    524.2    2.6    0.0000   0.0000          ?        ?  2748.1970  26.8179          ?        ?      524.2        2.6       ?       ? 
1 1 1   21   12   19 o   1163.5    4.1    0.0000   0.0000          ?        ? 13537.9355  95.7782          ?        ?     1163.5        4.1       ?       ? 
1 1 1   21   12   20 o   1508.9    5.2    0.0000   0.0000          ?        ? 22769.6816 156.4378          ?        ?     1508.9        5.2       ?       ? 
1 1 1   21   12   21 o    317.8    2.7    0.0000   0.0000          ?        ?  1010.1412  17.2401          ?        ?      317.8        2.7       ?       ? 
1 1 1   21   12   22 o    980.9    3.8    0.0000   0.0000          ?        ?  9623.1592  74.0685          ?        ?      980.9        3.8       ?       ? 
1 1 1   21   12   23 o    593.6    2.7    0.0000   0.0000          ?        ?  3524.0010  31.9261          ?        ?      593.6        2.7       ?       ? 
1 1 1   21   12   24 o    772.4    3.1    0.0000   0.0000          ?        ?  5966.9844  47.8891          ?        ?      772.4        3.1       ?       ? 
1 1 1   21   12   25 o   1210.3    4.3    0.0000   0.0000          ?        ? 14650.2393 104.0790          ?        ?     1210.3        4.3       ?       ? 
1 1 1   21   12   26 o    522.1    2.6    0.0000   0.0000          ?        ?  2726.4873  26.8179          ?        ?      522.1        2.6       ?       ? 
1 1 1   21   12   27 o    616.5    2.6    0.0000   0.0000          ?        ?  3800.4807  32.5646          ?        ?      616.5        2.6       ?       ? 
1 1 1   21   12   28 o   1053.7    3.9    0.0000   0.0000          ?        ? 11103.2529  82.3693          ?        ?     1053.7        3.9       ?       ? 
1 1 1   21   12   29 o    537.8    2.7    0.0000   0.0000          ?        ?  2892.5029  28.7335          ?        ?      537.8        2.7       ?       ? 
1 1 1   21   12   30 o    524.5    2.7    0.0000   0.0000          ?        ?  2750.7510  28.7335          ?        ?      524.5        2.7       ?       ? 
1 1 1   21   12   31 o    282.8    3.2    0.0000   0.0000          ?        ?   800.0676  17.8786          ?        ?      282.8        3.2       ?       ? 
1 1 1   21   12   32 o   1336.3    4.8    0.0000   0.0000          ?        ? 17858.8105 128.3428          ?        ?     1336.3        4.8       ?       ? 
1 1 1   21   12   33 o    600.1    2.8    0.0000   0.0000          ?        ?  3601.2620  33.2031          ?        ?      600.1        2.8       ?       ? 
1 1 1   21   12   34 o    469.8    2.6    0.0000   0.0000          ?        ?  2207.3694  24.2638          ?        ?      469.8        2.6       ?       ? 
1 1 1   21   12   35 o    327.3    3.1    0.0000   0.0000          ?        ?  1071.4393  20.4327          ?        ?      327.3        3.1       ?       ? 
1 1 1   21   12   36 o    344.9    3.1    0.0000   0.0000          ?        ?  1189.5658  21.7097          ?        ?      344.9        3.1       ?       ? 
1 1 1   21   12   37 o    643.6    2.9    0.0000   0.0000          ?        ?  4142.0898  37.0343          ?        ?      643.6        2.9       ?       ? 
1 1 1   21   12   38 f    367.8    3.0    0.0000   0.0000          ?        ?  1353.0273  21.7097          ?        ?      367.8        3.0       ?       ? 
1 1 1   21   12   39 o    477.6    2.6    0.0000   0.0000          ?        ?  2280.7993  24.9023          ?        ?      477.6        2.6       ?       ? 
1 1 1   21   12   40 o    380.8    2.7    0.0000   0.0000          ?        ?  1450.0826  20.4327          ?        ?      380.8        2.7       ?       ? 
1 1 1   21   12   41 o    466.7    2.7    0.0000   0.0000          ?        ?  2177.9973  24.9023          ?        ?      466.7        2.7       ?       ? 
1 1 1   21   12   42 o    868.7    3.3    0.0000   0.0000          ?        ?  7548.6025  57.4669          ?        ?      868.7        3.3       ?       ? 
1 1 1   21   12   43 o    541.2    2.7    0.0000   0.0000          ?        ?  2928.8987  28.7335          ?        ?      541.2        2.7       ?       ? 
1 1 1   21   12   44 o    650.3    2.9    0.0000   0.0000          ?        ?  4230.2056  37.6728          ?        ?      650.3        2.9       ?       ? 
1 1 1   21   12   45 o     23.0   11.4    0.0000   0.0000          ?        ?   -43.4195  19.1556          ?        ?       23.0       11.4       ?       ? 
1 1 1   21   12   46 o    429.2    2.8    0.0000   0.0000          ?        ?  1842.1349  23.6253          ?        ?      429.2        2.8       ?       ? 
1 1 1   21   12   47 o    127.0    6.8    0.0000   0.0000          ?        ?   161.5460  17.2401          ?        ?      127.0        6.8       ?       ? 
1 1 1   21   12   48 o    581.8    2.9    0.0000   0.0000          ?        ?  3386.0801  33.2031          ?        ?      581.8        2.9       ?       ? 
1 1 1   21   12   49 o    102.2    8.4    0.0000   0.0000          ?        ?   104.7175  17.2401          ?        ?      102.2        8.4       ?       ? 
1 1 1   21   12   50 f    522.5    2.7    0.0000   0.0000          ?        ?  2730.9570  28.7335          ?        ?      522.5        2.7       ?       ? 
1 1 1   21   12   51 o    300.6    3.3    0.0000   0.0000          ?        ?   904.1467  19.7942          ?        ?      300.6        3.3       ?       ? 
1 1 1   21   12   52 o     25.2   12.1    0.0000   0.0000          ?        ?   -26.8179  17.8786          ?        ?       25.2       12.1       ?       ? 
1 1 1   21   12   53 o    367.7    3.0    0.0000   0.0000          ?        ?  1352.3888  21.7097          ?        ?      367.7        3.0       ?       ? 
1 1 1   21   12   54 o    306.6    3.2    0.0000   0.0000          ?        ?   940.5424  19.7942          ?        ?      306.6        3.2       ?       ? 
1 1 1   21   12   55 o    425.0    2.9    0.0000   0.0000          ?        ?  1807.0162  24.2638          ?        ?      425.0        2.9       ?       ? 
1 1 1   21   12   56 o    233.1    4.2    0.0000   0.0000          ?        ?   544.0204  19.7942          ?        ?      233.1        4.2       ?       ? 
1 1 1   21   12   57 o    148.5    6.0    0.0000   0.0000          ?        ?   220.9285  17.8786          ?        ?      148.5        6.0       ?       ? 
1 1 1   21   12   58 o    199.0    4.7    0.0000   0.0000          ?        ?   396.5219  18.5171          ?        ?      199.0        4.7       ?       ? 
1 1 1   21   12   59 o     76.3   12.1    0.0000   0.0000          ?        ?    58.7440  18.5171          ?        ?       76.3       12.1       ?       ? 
1 1 1   21   12   60 o    398.3    2.9    0.0000   0.0000          ?        ?  1587.3647  22.9868          ?        ?      398.3        2.9       ?       ? 
1 1 1   21   12   61 o    144.7    6.6    0.0000   0.0000          ?        ?   210.0736  19.1556          ?        ?      144.7        6.6       ?       ? 
1 1 1   21   12   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   12   63 o    186.9    5.1    0.0000   0.0000          ?        ?   349.9099  19.1556          ?        ?      186.9        5.1       ?       ? 
1 1 1   21   12   64 o    298.8    3.6    0.0000   0.0000          ?        ?   893.9303  21.7097          ?        ?      298.8        3.6       ?       ? 
1 1 1   21   12   65 o    376.1    3.2    0.0000   0.0000          ?        ?  1415.6024  24.2638          ?        ?      376.1        3.2       ?       ? 
1 1 1   21   12   66 o    310.3    3.7    0.0000   0.0000          ?        ?   964.1677  22.9868          ?        ?      310.3        3.7       ?       ? 
1 1 1   21   12   67 o    237.7    4.6    0.0000   0.0000          ?        ?   566.3687  21.7097          ?        ?      237.7        4.6       ?       ? 
1 1 1   21   12   68 o     99.2   10.9    0.0000   0.0000          ?        ?    99.6094  21.7097          ?        ?       99.2       10.9       ?       ? 
1 1 1   21   12   69 o     87.0   13.2    0.0000   0.0000          ?        ?    77.2611  22.9868          ?        ?       87.0       13.2       ?       ? 
1 1 1   21   12   70 o    185.8    5.8    0.0000   0.0000          ?        ?   346.7172  21.7097          ?        ?      185.8        5.8       ?       ? 
1 1 1   21   12   71 o    192.0    5.5    0.0000   0.0000          ?        ?   370.3425  21.0712          ?        ?      192.0        5.5       ?       ? 
1 1 1   21   12   72 o    145.9    7.2    0.0000   0.0000          ?        ?   214.5433  21.0712          ?        ?      145.9        7.2       ?       ? 
1 1 1   21   12   73 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   12   74 o    162.3    6.3    0.0000   0.0000          ?        ?   265.6250  20.4327          ?        ?      162.3        6.3       ?       ? 
1 1 1   21   13    0 o    554.6    3.7 3075.7588  40.8654  3075.7588  40.8654  3075.7588  40.8654      554.6      3.7      554.6        3.7     0.0     0.0 
1 1 1   21   13    1 o   1161.1    4.5    0.0000   0.0000          ?        ? 13482.3838 103.4405          ?        ?     1161.1        4.5       ?       ? 
1 1 1   21   13    2 o   1614.2    6.0    0.0000   0.0000          ?        ? 26060.6211 192.1950          ?        ?     1614.2        6.0       ?       ? 
1 1 1   21   13    3 o    610.7    2.6    0.0000   0.0000          ?        ?  3729.6047  31.9261          ?        ?      610.7        2.6       ?       ? 
1 1 1   21   13    4 o   1233.1    4.5    0.0000   0.0000          ?        ? 15206.3926 111.1028          ?        ?     1233.1        4.5       ?       ? 
1 1 1   21   13    5 o   1251.0    4.5    0.0000   0.0000          ?        ? 15650.8047 113.6568          ?        ?     1251.0        4.5       ?       ? 
1 1 1   21   13    6 o    930.3    3.4    0.0000   0.0000          ?        ?  8655.1611  63.8522          ?        ?      930.3        3.4       ?       ? 
1 1 1   21   13    7 o   1550.1    5.4    0.0000   0.0000          ?        ? 24029.4844 166.6541          ?        ?     1550.1        5.4       ?       ? 
1 1 1   21   13    8 o    911.8    3.4    0.0000   0.0000          ?        ?  8314.1904  61.2981          ?        ?      911.8        3.4       ?       ? 
1 1 1   21   13    9 o    956.5    3.6    0.0000   0.0000          ?        ?  9149.3770  69.5989          ?        ?      956.5        3.6       ?       ? 
1 1 1   21   13   10 o   1786.7    6.4    0.0000   0.0000          ?        ? 31928.6348 229.2293          ?        ?     1786.7        6.4       ?       ? 
1 1 1   21   13   11 o    416.6    2.1    0.0000   0.0000          ?        ?  1735.5017  17.8786          ?        ?      416.6        2.1       ?       ? 
1 1 1   21   13   12 o    345.3    2.4    0.0000   0.0000          ?        ?  1192.1199  16.6016          ?        ?      345.3        2.4       ?       ? 
1 1 1   21   13   13 o    709.5    2.7    0.0000   0.0000          ?        ?  5033.4658  38.9498          ?        ?      709.5        2.7       ?       ? 
1 1 1   21   13   14 o   2002.5    6.7    0.0000   0.0000          ?        ? 40104.9023 268.8176          ?        ?     2002.5        6.7       ?       ? 
1 1 1   21   13   15 o    419.7    2.3    0.0000   0.0000          ?        ?  1761.6812  19.1556          ?        ?      419.7        2.3       ?       ? 
1 1 1   21   13   16 o    986.2    3.7    0.0000   0.0000          ?        ?  9726.6006  73.4300          ?        ?      986.2        3.7       ?       ? 
1 1 1   21   13   17 o   1352.8    4.6    0.0000   0.0000          ?        ? 18301.9453 125.1502          ?        ?     1352.8        4.6       ?       ? 
1 1 1   21   13   18 o   1515.1    5.1    0.0000   0.0000          ?        ? 22957.4062 155.7993          ?        ?     1515.1        5.1       ?       ? 
1 1 1   21   13   19 o    139.8    4.3    0.0000   0.0000          ?        ?   195.3876  12.1319          ?        ?      139.8        4.3       ?       ? 
1 1 1   21   13   20 o    482.4    2.5    0.0000   0.0000          ?        ?  2327.4114  24.2638          ?        ?      482.4        2.5       ?       ? 
1 1 1   21   13   21 o   1741.0    5.9    0.0000   0.0000          ?        ? 30316.3672 206.2425          ?        ?     1741.0        5.9       ?       ? 
1 1 1   21   13   22 o   1247.3    4.3    0.0000   0.0000          ?        ? 15558.2188 107.9102          ?        ?     1247.3        4.3       ?       ? 
1 1 1   21   13   23 o    199.1    3.7    0.0000   0.0000          ?        ?   396.5219  14.6860          ?        ?      199.1        3.7       ?       ? 
1 1 1   21   13   24 o    315.7    2.5    0.0000   0.0000          ?        ?   996.7323  15.9630          ?        ?      315.7        2.5       ?       ? 
1 1 1   21   13   25 o   1136.0    4.0    0.0000   0.0000          ?        ? 12906.4375  90.6701          ?        ?     1136.0        4.0       ?       ? 
1 1 1   21   13   26 o    327.9    2.7    0.0000   0.0000          ?        ?  1075.2704  17.8786          ?        ?      327.9        2.7       ?       ? 
1 1 1   21   13   27 o   1793.8    6.2    0.0000   0.0000          ?        ? 32185.3223 223.4826          ?        ?     1793.8        6.2       ?       ? 
1 1 1   21   13   28 o   1670.0    5.9    0.0000   0.0000          ?        ? 27893.8164 196.6647          ?        ?     1670.0        5.9       ?       ? 
1 1 1   21   13   29 o   1100.3    4.3    0.0000   0.0000          ?        ? 12107.0088  94.5012          ?        ?     1100.3        4.3       ?       ? 
1 1 1   21   13   30 o    646.4    3.1    0.0000   0.0000          ?        ?  4179.1240  39.5883          ?        ?      646.4        3.1       ?       ? 
1 1 1   21   13   31 f    452.9    2.5    0.0000   0.0000          ?        ?  2051.5698  22.9868          ?        ?      452.9        2.5       ?       ? 
1 1 1   21   13   32 o     18.9    9.4    0.0000   0.0000          ?        ?   -40.2269  14.6860          ?        ?       18.9        9.4       ?       ? 
1 1 1   21   13   33 o    565.2    2.7    0.0000   0.0000          ?        ?  3195.1621  30.6490          ?        ?      565.2        2.7       ?       ? 
1 1 1   21   13   34 o     29.5   13.2    0.0000   0.0000          ?        ?    -7.0237  15.9630          ?        ?       29.5       13.2       ?       ? 
1 1 1   21   13   35 o    297.6    3.4    0.0000   0.0000          ?        ?   885.6295  20.4327          ?        ?      297.6        3.4       ?       ? 
1 1 1   21   13   36 o    504.0    2.8    0.0000   0.0000          ?        ?  2540.0391  28.0950          ?        ?      504.0        2.8       ?       ? 
1 1 1   21   13   37 o    289.5    3.2    0.0000   0.0000          ?        ?   838.3789  18.5171          ?        ?      289.5        3.2       ?       ? 
1 1 1   21   13   38 o    912.0    3.5    0.0000   0.0000          ?        ?  8319.2988  64.4907          ?        ?      912.0        3.5       ?       ? 
1 1 1   21   13   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   13   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   13   41 o    311.6    3.0    0.0000   0.0000          ?        ?   971.1914  18.5171          ?        ?      311.6        3.0       ?       ? 
1 1 1   21   13   42 o    502.8    2.6    0.0000   0.0000          ?        ?  2527.9070  26.1794          ?        ?      502.8        2.6       ?       ? 
1 1 1   21   13   43 o     50.0   15.6    0.0000   0.0000          ?        ?    24.9023  17.2401          ?        ?       50.0       15.6       ?       ? 
1 1 1   21   13   44 o    349.0    2.7    0.0000   0.0000          ?        ?  1218.2993  19.1556          ?        ?      349.0        2.7       ?       ? 
1 1 1   21   13   45 o    184.8    4.7    0.0000   0.0000          ?        ?   341.6091  17.2401          ?        ?      184.8        4.7       ?       ? 
1 1 1   21   13   46 o    213.0    4.2    0.0000   0.0000          ?        ?   453.9889  17.8786          ?        ?      213.0        4.2       ?       ? 
1 1 1   21   13   47 o    300.9    3.3    0.0000   0.0000          ?        ?   905.4237  19.7942          ?        ?      300.9        3.3       ?       ? 
1 1 1   21   13   48 o     38.5   15.2    0.0000   0.0000          ?        ?     8.3008  17.2401          ?        ?       38.5       15.2       ?       ? 
1 1 1   21   13   49 f    431.7    2.7    0.0000   0.0000          ?        ?  1864.4832  23.6253          ?        ?      431.7        2.7       ?       ? 
1 1 1   21   13   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   13   51 o    198.7    4.5    0.0000   0.0000          ?        ?   395.2449  17.8786          ?        ?      198.7        4.5       ?       ? 
1 1 1   21   13   52 o    348.9    2.9    0.0000   0.0000          ?        ?  1217.6608  20.4327          ?        ?      348.9        2.9       ?       ? 
1 1 1   21   13   53 o    349.9    3.1    0.0000   0.0000          ?        ?  1224.6844  21.7097          ?        ?      349.9        3.1       ?       ? 
1 1 1   21   13   54 o    177.0    5.1    0.0000   0.0000          ?        ?   313.5141  17.8786          ?        ?      177.0        5.1       ?       ? 
1 1 1   21   13   55 o    313.1    3.2    0.0000   0.0000          ?        ?   980.7693  19.7942          ?        ?      313.1        3.2       ?       ? 
1 1 1   21   13   56 o    509.4    2.6    0.0000   0.0000          ?        ?  2596.2290  26.8179          ?        ?      509.4        2.6       ?       ? 
1 1 1   21   13   57 o    332.7    3.2    0.0000   0.0000          ?        ?  1107.8350  21.0712          ?        ?      332.7        3.2       ?       ? 
1 1 1   21   13   58 o    107.9    8.6    0.0000   0.0000          ?        ?   116.8494  18.5171          ?        ?      107.9        8.6       ?       ? 
1 1 1   21   13   59 o     82.7   11.6    0.0000   0.0000          ?        ?    68.9603  19.1556          ?        ?       82.7       11.6       ?       ? 
1 1 1   21   13   60 o    219.6    4.5    0.0000   0.0000          ?        ?   482.7224  19.7942          ?        ?      219.6        4.5       ?       ? 
1 1 1   21   13   61 o    159.4    6.0    0.0000   0.0000          ?        ?   254.7701  19.1556          ?        ?      159.4        6.0       ?       ? 
1 1 1   21   13   62 o    125.8    7.6    0.0000   0.0000          ?        ?   158.9919  19.1556          ?        ?      125.8        7.6       ?       ? 
1 1 1   21   13   63 o    188.0    5.6    0.0000   0.0000          ?        ?   354.3795  21.0712          ?        ?      188.0        5.6       ?       ? 
1 1 1   21   13   64 o    207.7    5.1    0.0000   0.0000          ?        ?   432.2791  21.0712          ?        ?      207.7        5.1       ?       ? 
1 1 1   21   13   65 o    136.0    7.7    0.0000   0.0000          ?        ?   185.8098  21.0712          ?        ?      136.0        7.7       ?       ? 
1 1 1   21   13   66 f     71.7   14.8    0.0000   0.0000          ?        ?    54.2743  20.4327          ?        ?       71.7       14.8       ?       ? 
1 1 1   21   13   67 o     49.8   17.0    0.0000   0.0000          ?        ?    23.6253  20.4327          ?        ?       49.8       17.0       ?       ? 
1 1 1   21   13   68 o    236.6    4.5    0.0000   0.0000          ?        ?   561.2605  21.0712          ?        ?      236.6        4.5       ?       ? 
1 1 1   21   13   69 o     54.0   17.0    0.0000   0.0000          ?        ?    30.0105  20.4327          ?        ?       54.0       17.0       ?       ? 
1 1 1   21   13   70 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   13   71 f    147.6    7.4    0.0000   0.0000          ?        ?   219.6514  21.7097          ?        ?      147.6        7.4       ?       ? 
1 1 1   21   13   72 o     28.9   13.5    0.0000   0.0000          ?        ?   -19.1556  19.7942          ?        ?       28.9       13.5       ?       ? 
1 1 1   21   13   73 o    193.4    5.4    0.0000   0.0000          ?        ?   376.0892  21.0712          ?        ?      193.4        5.4       ?       ? 
1 1 1   21   13   74 o     34.5   15.0    0.0000   0.0000          ?        ?    -1.2770  19.1556          ?        ?       34.5       15.0       ?       ? 
1 1 1   21   14    0 o    480.4    4.5 2308.8943  42.7809  2308.8943  42.7809  2308.8943  42.7809      480.4      4.5      480.4        4.5     0.0     0.0 
1 1 1   21   14    1 o    456.3    2.7    0.0000   0.0000          ?        ?  2082.2190  24.2638          ?        ?      456.3        2.7       ?       ? 
1 1 1   21   14    2 o    288.7    2.8    0.0000   0.0000          ?        ?   833.2708  15.9630          ?        ?      288.7        2.8       ?       ? 
1 1 1   21   14    3 o    870.1    3.6    0.0000   0.0000          ?        ?  7571.5898  62.5751          ?        ?      870.1        3.6       ?       ? 
1 1 1   21   14    4 o   1137.0    4.2    0.0000   0.0000          ?        ? 12928.1475  95.7782          ?        ?     1137.0        4.2       ?       ? 
1 1 1   21   14    5 o   1091.9    3.9    0.0000   0.0000          ?        ? 11923.7529  86.2004          ?        ?     1091.9        3.9       ?       ? 
1 1 1   21   14    6 f    172.1    2.6    0.0000   0.0000          ?        ?   296.2740   8.9393          ?        ?      172.1        2.6       ?       ? 
1 1 1   21   14    7 o    347.9    2.5    0.0000   0.0000          ?        ?  1210.6371  17.2401          ?        ?      347.9        2.5       ?       ? 
1 1 1   21   14    8 o   1095.2    4.1    0.0000   0.0000          ?        ? 11994.6289  88.7545          ?        ?     1095.2        4.1       ?       ? 
1 1 1   21   14    9 o    296.3    2.2    0.0000   0.0000          ?        ?   877.9672  12.7704          ?        ?      296.3        2.2       ?       ? 
1 1 1   21   14   10 o    427.2    2.2    0.0000   0.0000          ?        ?  1824.8948  19.1556          ?        ?      427.2        2.2       ?       ? 
1 1 1   21   14   11 o   1319.8    4.8    0.0000   0.0000          ?        ? 17420.7852 125.7888          ?        ?     1319.8        4.8       ?       ? 
1 1 1   21   14   12 o   1873.6    6.3    0.0000   0.0000          ?        ? 35110.3906 234.3374          ?        ?     1873.6        6.3       ?       ? 
1 1 1   21   14   13 o    380.2    2.2    0.0000   0.0000          ?        ?  1445.6129  16.6016          ?        ?      380.2        2.2       ?       ? 
1 1 1   21   14   14 o    437.2    2.2    0.0000   0.0000          ?        ?  1911.0951  19.1556          ?        ?      437.2        2.2       ?       ? 
1 1 1   21   14   15 o   1870.5    6.3    0.0000   0.0000          ?        ? 34994.8164 235.6145          ?        ?     1870.5        6.3       ?       ? 
1 1 1   21   14   16 o    890.5    3.3    0.0000   0.0000          ?        ?  7931.0771  59.3825          ?        ?      890.5        3.3       ?       ? 
1 1 1   21   14   17 o   1660.6    5.6    0.0000   0.0000          ?        ? 27579.0273 187.0868          ?        ?     1660.6        5.6       ?       ? 
1 1 1   21   14   18 o    870.5    3.4    0.0000   0.0000          ?        ?  7578.6133  58.7440          ?        ?      870.5        3.4       ?       ? 
1 1 1   21   14   19 o   1751.4    5.9    0.0000   0.0000          ?        ? 30677.7715 206.8810          ?        ?     1751.4        5.9       ?       ? 
1 1 1   21   14   20 o    925.6    3.4    0.0000   0.0000          ?        ?  8567.6836  63.2136          ?        ?      925.6        3.4       ?       ? 
1 1 1   21   14   21 o   1234.5    4.6    0.0000   0.0000          ?        ? 15242.1504 113.0183          ?        ?     1234.5        4.6       ?       ? 
1 1 1   21   14   22 o   1587.1    5.3    0.0000   0.0000          ?        ? 25192.2324 168.5697          ?        ?     1587.1        5.3       ?       ? 
1 1 1   21   14   23 o   1040.1    3.8    0.0000   0.0000          ?        ? 10818.4727  79.1767          ?        ?     1040.1        3.8       ?       ? 
1 1 1   21   14   24 o   1388.7    4.7    0.0000   0.0000          ?        ? 19285.9062 131.5355          ?        ?     1388.7        4.7       ?       ? 
1 1 1   21   14   25 o   1706.1    5.7    0.0000   0.0000          ?        ? 29113.3945 192.8335          ?        ?     1706.1        5.7       ?       ? 
1 1 1   21   14   26 o    685.8    2.8    0.0000   0.0000          ?        ?  4703.3501  38.9498          ?        ?      685.8        2.8       ?       ? 
1 1 1   21   14   27 o    904.6    3.4    0.0000   0.0000          ?        ?  8183.9312  60.6596          ?        ?      904.6        3.4       ?       ? 
1 1 1   21   14   28 o    336.1    2.7    0.0000   0.0000          ?        ?  1129.5447  17.8786          ?        ?      336.1        2.7       ?       ? 
1 1 1   21   14   29 o     24.3   11.5    0.0000   0.0000          ?        ?   -17.2401  14.6860          ?        ?       24.3       11.5       ?       ? 
1 1 1   21   14   30 o    351.9    2.6    0.0000   0.0000          ?        ?  1238.7319  18.5171          ?        ?      351.9        2.6       ?       ? 
1 1 1   21   14   31 o    268.1    3.1    0.0000   0.0000          ?        ?   718.9753  16.6016          ?        ?      268.1        3.1       ?       ? 
1 1 1   21   14   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   14   33 o    105.4    7.3    0.0000   0.0000          ?        ?   111.1028  15.3245          ?        ?      105.4        7.3       ?       ? 
1 1 1   21   14   34 f    213.2    4.0    0.0000   0.0000          ?        ?   454.6274  17.2401          ?        ?      213.2        4.0       ?       ? 
1 1 1   21   14   35 o    556.9    2.6    0.0000   0.0000          ?        ?  3101.2996  28.7335          ?        ?      556.9        2.6       ?       ? 
1 1 1   21   14   36 o    688.7    2.9    0.0000   0.0000          ?        ?  4742.9385  40.2269          ?        ?      688.7        2.9       ?       ? 
1 1 1   21   14   37 o    993.6    3.6    0.0000   0.0000          ?        ?  9874.0986  72.1529          ?        ?      993.6        3.6       ?       ? 
1 1 1   21   14   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   14   39 o    703.0    3.0    0.0000   0.0000          ?        ?  4943.4346  41.5039          ?        ?      703.0        3.0       ?       ? 
1 1 1   21   14   40 o    676.2    2.8    0.0000   0.0000          ?        ?  4573.0918  38.3113          ?        ?      676.2        2.8       ?       ? 
1 1 1   21   14   41 o     21.6   10.6    0.0000   0.0000          ?        ?   -33.2031  15.9630          ?        ?       21.6       10.6       ?       ? 
1 1 1   21   14   42 o    185.0    4.5    0.0000   0.0000          ?        ?   342.2476  16.6016          ?        ?      185.0        4.5       ?       ? 
1 1 1   21   14   43 o    331.2    2.9    0.0000   0.0000          ?        ?  1096.9802  19.1556          ?        ?      331.2        2.9       ?       ? 
1 1 1   21   14   44 o    420.5    2.7    0.0000   0.0000          ?        ?  1768.7050  22.3483          ?        ?      420.5        2.7       ?       ? 
1 1 1   21   14   45 o    154.5    5.4    0.0000   0.0000          ?        ?   238.8071  16.6016          ?        ?      154.5        5.4       ?       ? 
1 1 1   21   14   46 o    305.0    3.1    0.0000   0.0000          ?        ?   930.3260  19.1556          ?        ?      305.0        3.1       ?       ? 
1 1 1   21   14   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   14   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   14   49 o    137.2    6.1    0.0000   0.0000          ?        ?   188.3639  16.6016          ?        ?      137.2        6.1       ?       ? 
1 1 1   21   14   50 o    200.2    4.6    0.0000   0.0000          ?        ?   400.9916  18.5171          ?        ?      200.2        4.6       ?       ? 
1 1 1   21   14   51 o    379.0    2.8    0.0000   0.0000          ?        ?  1436.6737  21.0712          ?        ?      379.0        2.8       ?       ? 
1 1 1   21   14   52 o    219.6    4.2    0.0000   0.0000          ?        ?   482.7224  18.5171          ?        ?      219.6        4.2       ?       ? 
1 1 1   21   14   53 o    139.9    6.2    0.0000   0.0000          ?        ?   196.0261  17.2401          ?        ?      139.9        6.2       ?       ? 
1 1 1   21   14   54 o    179.1    5.0    0.0000   0.0000          ?        ?   321.1764  17.8786          ?        ?      179.1        5.0       ?       ? 
1 1 1   21   14   55 o     28.4   13.2    0.0000   0.0000          ?        ?   -15.3245  17.8786          ?        ?       28.4       13.2       ?       ? 
1 1 1   21   14   56 o    555.7    2.7    0.0000   0.0000          ?        ?  3089.1675  30.0105          ?        ?      555.7        2.7       ?       ? 
1 1 1   21   14   57 o    261.9    3.9    0.0000   0.0000          ?        ?   686.4108  20.4327          ?        ?      261.9        3.9       ?       ? 
1 1 1   21   14   58 o    405.9    2.9    0.0000   0.0000          ?        ?  1648.0244  23.6253          ?        ?      405.9        2.9       ?       ? 
1 1 1   21   14   59 o    529.4    2.7    0.0000   0.0000          ?        ?  2804.3870  28.7335          ?        ?      529.4        2.7       ?       ? 
1 1 1   21   14   60 o    125.1    7.7    0.0000   0.0000          ?        ?   157.0763  19.1556          ?        ?      125.1        7.7       ?       ? 
1 1 1   21   14   61 o     21.3   10.7    0.0000   0.0000          ?        ?   -57.4669  19.7942          ?        ?       21.3       10.7       ?       ? 
1 1 1   21   14   62 o    219.8    4.6    0.0000   0.0000          ?        ?   483.9994  20.4327          ?        ?      219.8        4.6       ?       ? 
1 1 1   21   14   63 o    490.9    2.8    0.0000   0.0000          ?        ?  2411.6963  27.4564          ?        ?      490.9        2.8       ?       ? 
1 1 1   21   14   64 o    139.0    7.6    0.0000   0.0000          ?        ?   194.1106  21.0712          ?        ?      139.0        7.6       ?       ? 
1 1 1   21   14   65 o    161.3    6.5    0.0000   0.0000          ?        ?   261.1554  21.0712          ?        ?      161.3        6.5       ?       ? 
1 1 1   21   14   66 o     26.1   12.7    0.0000   0.0000          ?        ?   -33.2031  20.4327          ?        ?       26.1       12.7       ?       ? 
1 1 1   21   14   67 o     51.7   17.3    0.0000   0.0000          ?        ?    26.1794  21.0712          ?        ?       51.7       17.3       ?       ? 
1 1 1   21   14   68 o     63.2   16.5    0.0000   0.0000          ?        ?    42.7809  21.0712          ?        ?       63.2       16.5       ?       ? 
1 1 1   21   14   69 o    285.6    3.9    0.0000   0.0000          ?        ?   817.3077  22.3483          ?        ?      285.6        3.9       ?       ? 
1 1 1   21   14   70 f     62.1   15.9    0.0000   0.0000          ?        ?    41.5039  19.7942          ?        ?       62.1       15.9       ?       ? 
1 1 1   21   14   71 o    112.6    8.8    0.0000   0.0000          ?        ?   128.3428  19.7942          ?        ?      112.6        8.8       ?       ? 
1 1 1   21   14   72 o    213.7    4.8    0.0000   0.0000          ?        ?   458.4586  20.4327          ?        ?      213.7        4.8       ?       ? 
1 1 1   21   14   73 o    159.5    6.6    0.0000   0.0000          ?        ?   256.6857  21.0712          ?        ?      159.5        6.6       ?       ? 
1 1 1   21   15    0 o    840.1    5.1 7059.4951  85.5619  7059.4951  85.5619  7059.4951  85.5619      840.1      5.1      840.1        5.1     0.0     0.0 
1 1 1   21   15    1 o    733.5    3.1    0.0000   0.0000          ?        ?  5380.8218  45.3350          ?        ?      733.5        3.1       ?       ? 
1 1 1   21   15    2 o    650.1    2.8    0.0000   0.0000          ?        ?  4227.0132  37.0343          ?        ?      650.1        2.8       ?       ? 
1 1 1   21   15    3 o    539.8    2.6    0.0000   0.0000          ?        ?  2913.5742  28.0950          ?        ?      539.8        2.6       ?       ? 
1 1 1   21   15    4 o    727.9    3.0    0.0000   0.0000          ?        ?  5299.0913  43.4195          ?        ?      727.9        3.0       ?       ? 
1 1 1   21   15    5 o    742.6    3.1    0.0000   0.0000          ?        ?  5514.9111  46.6121          ?        ?      742.6        3.1       ?       ? 
1 1 1   21   15    6 o    506.6    2.6    0.0000   0.0000          ?        ?  2566.2183  26.1794          ?        ?      506.6        2.6       ?       ? 
1 1 1   21   15    7 o   1216.9    4.5    0.0000   0.0000          ?        ? 14809.8701 109.8257          ?        ?     1216.9        4.5       ?       ? 
1 1 1   21   15    8 o    607.3    2.6    0.0000   0.0000          ?        ?  3688.1008  31.2876          ?        ?      607.3        2.6       ?       ? 
1 1 1   21   15    9 o    559.3    3.1    0.0000   0.0000          ?        ?  3128.7559  34.4802          ?        ?      559.3        3.1       ?       ? 
1 1 1   21   15   10 o    632.9    2.6    0.0000   0.0000          ?        ?  4005.4460  33.2031          ?        ?      632.9        2.6       ?       ? 
1 1 1   21   15   11 o    235.7    2.4    0.0000   0.0000          ?        ?   555.5138  11.4934          ?        ?      235.7        2.4       ?       ? 
1 1 1   21   15   12 o   1203.7    4.2    0.0000   0.0000          ?        ? 14489.9717 102.1635          ?        ?     1203.7        4.2       ?       ? 
1 1 1   21   15   13 o    397.9    2.3    0.0000   0.0000          ?        ?  1582.8950  18.5171          ?        ?      397.9        2.3       ?       ? 
1 1 1   21   15   14 o   1195.8    4.3    0.0000   0.0000          ?        ? 14299.6914 102.1635          ?        ?     1195.8        4.3       ?       ? 
1 1 1   21   15   15 o   2353.3    8.0    0.0000   0.0000          ?        ? 55396.2227 374.8122          ?        ?     2353.3        8.0       ?       ? 
1 1 1   21   15   16 o    745.5    3.0    0.0000   0.0000          ?        ?  5557.6924  44.0580          ?        ?      745.5        3.0       ?       ? 
1 1 1   21   15   17 o   2113.1    7.2    0.0000   0.0000          ?        ? 44663.9492 305.8519          ?        ?     2113.1        7.2       ?       ? 
1 1 1   21   15   18 o   1556.3    5.3    0.0000   0.0000          ?        ? 24222.3184 164.7386          ?        ?     1556.3        5.3       ?       ? 
1 1 1   21   15   19 o   1152.8    4.1    0.0000   0.0000          ?        ? 13290.1885  95.1397          ?        ?     1152.8        4.1       ?       ? 
1 1 1   21   15   20 o    541.8    2.5    0.0000   0.0000          ?        ?  2935.9224  27.4564          ?        ?      541.8        2.5       ?       ? 
1 1 1   21   15   21 o    917.1    3.4    0.0000   0.0000          ?        ?  8410.6064  61.9366          ?        ?      917.1        3.4       ?       ? 
1 1 1   21   15   22 o    649.0    2.7    0.0000   0.0000          ?        ?  4212.3271  35.1187          ?        ?      649.0        2.7       ?       ? 
1 1 1   21   15   23 o    715.5    2.9    0.0000   0.0000          ?        ?  5119.6665  40.8654          ?        ?      715.5        2.9       ?       ? 
1 1 1   21   15   24 o    819.5    3.1    0.0000   0.0000          ?        ?  6715.9707  51.0817          ?        ?      819.5        3.1       ?       ? 
1 1 1   21   15   25 o   1048.4    3.7    0.0000   0.0000          ?        ? 10991.5117  78.5382          ?        ?     1048.4        3.7       ?       ? 
1 1 1   21   15   26 o   1066.9    3.8    0.0000   0.0000          ?        ? 11382.9248  80.4537          ?        ?     1066.9        3.8       ?       ? 
1 1 1   21   15   27 o    585.2    2.6    0.0000   0.0000          ?        ?  3424.3914  30.6490          ?        ?      585.2        2.6       ?       ? 
1 1 1   21   15   28 o    410.6    2.4    0.0000   0.0000          ?        ?  1686.3357  19.7942          ?        ?      410.6        2.4       ?       ? 
1 1 1   21   15   29 o    621.5    2.7    0.0000   0.0000          ?        ?  3863.0559  33.2031          ?        ?      621.5        2.7       ?       ? 
1 1 1   21   15   30 o    454.7    2.8    0.0000   0.0000          ?        ?  2067.5330  25.5409          ?        ?      454.7        2.8       ?       ? 
1 1 1   21   15   31 o    604.7    2.7    0.0000   0.0000          ?        ?  3657.4519  32.5646          ?        ?      604.7        2.7       ?       ? 
1 1 1   21   15   32 o    534.2    2.6    0.0000   0.0000          ?        ?  2853.5532  28.0950          ?        ?      534.2        2.6       ?       ? 
1 1 1   21   15   33 o    310.3    3.0    0.0000   0.0000          ?        ?   962.8906  18.5171          ?        ?      310.3        3.0       ?       ? 
1 1 1   21   15   34 o    766.1    3.1    0.0000   0.0000          ?        ?  5869.9292  47.8891          ?        ?      766.1        3.1       ?       ? 
1 1 1   21   15   35 o    353.0    2.6    0.0000   0.0000          ?        ?  1246.3942  18.5171          ?        ?      353.0        2.6       ?       ? 
1 1 1   21   15   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   15   37 o    361.1    2.7    0.0000   0.0000          ?        ?  1303.8611  19.7942          ?        ?      361.1        2.7       ?       ? 
1 1 1   21   15   38 o     30.3   13.3    0.0000   0.0000          ?        ?    -3.8311  15.3245          ?        ?       30.3       13.3       ?       ? 
1 1 1   21   15   39 o    684.2    2.8    0.0000   0.0000          ?        ?  4682.2788  38.3113          ?        ?      684.2        2.8       ?       ? 
1 1 1   21   15   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   15   41 o    465.0    2.5    0.0000   0.0000          ?        ?  2162.6729  22.9868          ?        ?      465.0        2.5       ?       ? 
1 1 1   21   15   42 o    394.7    2.5    0.0000   0.0000          ?        ?  1557.9928  19.7942          ?        ?      394.7        2.5       ?       ? 
1 1 1   21   15   43 o    261.0    3.3    0.0000   0.0000          ?        ?   681.3026  17.2401          ?        ?      261.0        3.3       ?       ? 
1 1 1   21   15   44 o    469.7    2.7    0.0000   0.0000          ?        ?  2206.7307  24.9023          ?        ?      469.7        2.7       ?       ? 
1 1 1   21   15   45 o    197.5    4.4    0.0000   0.0000          ?        ?   390.1367  17.2401          ?        ?      197.5        4.4       ?       ? 
1 1 1   21   15   46 o    500.3    2.6    0.0000   0.0000          ?        ?  2503.0049  26.1794          ?        ?      500.3        2.6       ?       ? 
1 1 1   21   15   47 f    796.7    3.2    0.0000   0.0000          ?        ?  6349.4590  51.0817          ?        ?      796.7        3.2       ?       ? 
1 1 1   21   15   48 o    272.2    3.5    0.0000   0.0000          ?        ?   741.3236  19.1556          ?        ?      272.2        3.5       ?       ? 
1 1 1   21   15   49 o    519.2    2.9    0.0000   0.0000          ?        ?  2696.4768  30.0105          ?        ?      519.2        2.9       ?       ? 
1 1 1   21   15   50 o     62.0   14.2    0.0000   0.0000          ?        ?    40.2269  17.2401          ?        ?       62.0       14.2       ?       ? 
1 1 1   21   15   51 o    543.8    2.8    0.0000   0.0000          ?        ?  2957.6323  30.0105          ?        ?      543.8        2.8       ?       ? 
1 1 1   21   15   52 o    292.4    3.3    0.0000   0.0000          ?        ?   855.6190  19.1556          ?        ?      292.4        3.3       ?       ? 
1 1 1   21   15   53 o     57.9   14.8    0.0000   0.0000          ?        ?    35.1187  17.2401          ?        ?       57.9       14.8       ?       ? 
1 1 1   21   15   54 o    171.3    5.2    0.0000   0.0000          ?        ?   293.7199  17.8786          ?        ?      171.3        5.2       ?       ? 
1 1 1   21   15   55 o    188.0    4.8    0.0000   0.0000          ?        ?   353.7410  17.8786          ?        ?      188.0        4.8       ?       ? 
1 1 1   21   15   56 o    252.0    3.7    0.0000   0.0000          ?        ?   635.3290  18.5171          ?        ?      252.0        3.7       ?       ? 
1 1 1   21   15   57 o    323.4    3.1    0.0000   0.0000          ?        ?  1046.5369  19.7942          ?        ?      323.4        3.1       ?       ? 
1 1 1   21   15   58 o    139.3    7.1    0.0000   0.0000          ?        ?   194.7491  19.7942          ?        ?      139.3        7.1       ?       ? 
1 1 1   21   15   59 o    562.9    2.8    0.0000   0.0000          ?        ?  3170.2598  31.2876          ?        ?      562.9        2.8       ?       ? 
1 1 1   21   15   60 o     36.9   15.6    0.0000   0.0000          ?        ?     1.2770  19.7942          ?        ?       36.9       15.6       ?       ? 
1 1 1   21   15   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   15   62 o    120.9    8.2    0.0000   0.0000          ?        ?   146.8600  19.7942          ?        ?      120.9        8.2       ?       ? 
1 1 1   21   15   63 o     27.2   13.1    0.0000   0.0000          ?        ?   -28.7335  20.4327          ?        ?       27.2       13.1       ?       ? 
1 1 1   21   15   64 o    344.6    3.2    0.0000   0.0000          ?        ?  1188.2888  22.3483          ?        ?      344.6        3.2       ?       ? 
1 1 1   21   15   65 o    280.3    4.0    0.0000   0.0000          ?        ?   786.6586  22.3483          ?        ?      280.3        4.0       ?       ? 
1 1 1   21   15   66 o    212.5    5.3    0.0000   0.0000          ?        ?   452.7119  22.3483          ?        ?      212.5        5.3       ?       ? 
1 1 1   21   15   67 o    195.1    5.6    0.0000   0.0000          ?        ?   381.8359  21.7097          ?        ?      195.1        5.6       ?       ? 
1 1 1   21   15   68 f    168.3    6.3    0.0000   0.0000          ?        ?   284.7806  21.0712          ?        ?      168.3        6.3       ?       ? 
1 1 1   21   15   69 o     28.2   13.4    0.0000   0.0000          ?        ?   -24.2638  20.4327          ?        ?       28.2       13.4       ?       ? 
1 1 1   21   15   70 o     20.0   10.1    0.0000   0.0000          ?        ?   -67.0448  19.7942          ?        ?       20.0       10.1       ?       ? 
1 1 1   21   15   71 o     29.0   13.6    0.0000   0.0000          ?        ?   -21.0712  20.4327          ?        ?       29.0       13.6       ?       ? 
1 1 1   21   15   72 f    122.2    8.4    0.0000   0.0000          ?        ?   151.3296  20.4327          ?        ?      122.2        8.4       ?       ? 
1 1 1   21   15   73 o     41.7   16.3    0.0000   0.0000          ?        ?    12.1319  19.7942          ?        ?       41.7       16.3       ?       ? 
1 1 1   21   16    0 o    902.6    5.6 8147.5361 101.5249  8147.5361 101.5249  8147.5361 101.5249      902.6      5.6      902.6        5.6     0.0     0.0 
1 1 1   21   16    1 f    448.6    2.8    0.0000   0.0000          ?        ?  2012.6202  24.9023          ?        ?      448.6        2.8       ?       ? 
1 1 1   21   16    2 o    493.0    3.1    0.0000   0.0000          ?        ?  2430.2134  30.6490          ?        ?      493.0        3.1       ?       ? 
1 1 1   21   16    3 o   1079.5    4.6    0.0000   0.0000          ?        ? 11654.2969 100.2479          ?        ?     1079.5        4.6       ?       ? 
1 1 1   21   16    4 o    704.7    3.4    0.0000   0.0000          ?        ?  4966.4209  47.2506          ?        ?      704.7        3.4       ?       ? 
1 1 1   21   16    5 o    869.0    3.6    0.0000   0.0000          ?        ?  7551.7949  61.9366          ?        ?      869.0        3.6       ?       ? 
1 1 1   21   16    6 o   1710.5    6.4    0.0000   0.0000          ?        ? 29263.4453 218.3744          ?        ?     1710.5        6.4       ?       ? 
1 1 1   21   16    7 o    469.4    2.2    0.0000   0.0000          ?        ?  2203.5381  20.4327          ?        ?      469.4        2.2       ?       ? 
1 1 1   21   16    8 o    534.1    2.3    0.0000   0.0000          ?        ?  2852.2761  24.2638          ?        ?      534.1        2.3       ?       ? 
1 1 1   21   16    9 o    495.6    2.3    0.0000   0.0000          ?        ?  2456.3928  22.9868          ?        ?      495.6        2.3       ?       ? 
1 1 1   21   16   10 o    758.6    2.9    0.0000   0.0000          ?        ?  5754.3569  44.0580          ?        ?      758.6        2.9       ?       ? 
1 1 1   21   16   11 o   1967.3    6.6    0.0000   0.0000          ?        ? 38711.0117 257.9627          ?        ?     1967.3        6.6       ?       ? 
1 1 1   21   16   12 o    577.3    2.4    0.0000   0.0000          ?        ?  3332.4446  28.0950          ?        ?      577.3        2.4       ?       ? 
1 1 1   21   16   13 o   1407.2    5.0    0.0000   0.0000          ?        ? 19804.3867 141.7518          ?        ?     1407.2        5.0       ?       ? 
1 1 1   21   16   14 o    491.4    3.1    0.0000   0.0000          ?        ?  2414.8889  30.0105          ?        ?      491.4        3.1       ?       ? 
1 1 1   21   16   15 o    299.3    2.9    0.0000   0.0000          ?        ?   895.8459  17.2401          ?        ?      299.3        2.9       ?       ? 
1 1 1   21   16   16 o    801.4    3.2    0.0000   0.0000          ?        ?  6422.2505  51.0817          ?        ?      801.4        3.2       ?       ? 
1 1 1   21   16   17 f    998.2    3.8    0.0000   0.0000          ?        ?  9964.7686  76.6226          ?        ?      998.2        3.8       ?       ? 
1 1 1   21   16   18 o    539.1    3.0    0.0000   0.0000          ?        ?  2906.5505  31.9261          ?        ?      539.1        3.0       ?       ? 
1 1 1   21   16   19 o    580.0    2.5    0.0000   0.0000          ?        ?  3364.3706  29.3720          ?        ?      580.0        2.5       ?       ? 
1 1 1   21   16   20 o   1404.9    4.7    0.0000   0.0000          ?        ? 19739.2578 133.4510          ?        ?     1404.9        4.7       ?       ? 
1 1 1   21   16   21 o    804.2    3.1    0.0000   0.0000          ?        ?  6466.9468  49.8047          ?        ?      804.2        3.1       ?       ? 
1 1 1   21   16   22 o    908.8    3.3    0.0000   0.0000          ?        ?  8259.2773  60.6596          ?        ?      908.8        3.3       ?       ? 
1 1 1   21   16   23 o    763.3    3.0    0.0000   0.0000          ?        ?  5825.8716  45.3350          ?        ?      763.3        3.0       ?       ? 
1 1 1   21   16   24 o    646.4    2.7    0.0000   0.0000          ?        ?  4178.4858  35.1187          ?        ?      646.4        2.7       ?       ? 
1 1 1   21   16   25 o    630.9    2.6    0.0000   0.0000          ?        ?  3979.9053  32.5646          ?        ?      630.9        2.6       ?       ? 
1 1 1   21   16   26 o    472.2    2.4    0.0000   0.0000          ?        ?  2229.7175  22.9868          ?        ?      472.2        2.4       ?       ? 
1 1 1   21   16   27 o    641.1    2.8    0.0000   0.0000          ?        ?  4110.8022  35.7572          ?        ?      641.1        2.8       ?       ? 
1 1 1   21   16   28 o    525.8    2.5    0.0000   0.0000          ?        ?  2764.7986  26.1794          ?        ?      525.8        2.5       ?       ? 
1 1 1   21   16   29 o    563.7    2.6    0.0000   0.0000          ?        ?  3177.2837  29.3720          ?        ?      563.7        2.6       ?       ? 
1 1 1   21   16   30 o    488.8    2.5    0.0000   0.0000          ?        ?  2389.3479  24.2638          ?        ?      488.8        2.5       ?       ? 
1 1 1   21   16   31 o     20.9   10.3    0.0000   0.0000          ?        ?   -33.2031  15.3245          ?        ?       20.9       10.3       ?       ? 
1 1 1   21   16   32 o    705.6    3.0    0.0000   0.0000          ?        ?  4979.8301  42.7809          ?        ?      705.6        3.0       ?       ? 
1 1 1   21   16   33 o    607.3    2.7    0.0000   0.0000          ?        ?  3688.1008  33.2031          ?        ?      607.3        2.7       ?       ? 
1 1 1   21   16   34 o    466.8    2.5    0.0000   0.0000          ?        ?  2179.2742  22.9868          ?        ?      466.8        2.5       ?       ? 
1 1 1   21   16   35 o    126.8    6.3    0.0000   0.0000          ?        ?   160.9075  15.9630          ?        ?      126.8        6.3       ?       ? 
1 1 1   21   16   36 o    210.8    3.9    0.0000   0.0000          ?        ?   444.4110  16.6016          ?        ?      210.8        3.9       ?       ? 
1 1 1   21   16   37 o    174.1    4.6    0.0000   0.0000          ?        ?   303.2978  15.9630          ?        ?      174.1        4.6       ?       ? 
1 1 1   21   16   38 o    261.0    3.2    0.0000   0.0000          ?        ?   681.3026  16.6016          ?        ?      261.0        3.2       ?       ? 
1 1 1   21   16   39 o    244.0    3.7    0.0000   0.0000          ?        ?   595.7407  17.8786          ?        ?      244.0        3.7       ?       ? 
1 1 1   21   16   40 o    258.0    3.3    0.0000   0.0000          ?        ?   665.9781  17.2401          ?        ?      258.0        3.3       ?       ? 
1 1 1   21   16   41 o    181.6    4.6    0.0000   0.0000          ?        ?   330.1157  16.6016          ?        ?      181.6        4.6       ?       ? 
1 1 1   21   16   42 o    341.9    2.9    0.0000   0.0000          ?        ?  1169.1332  19.7942          ?        ?      341.9        2.9       ?       ? 
1 1 1   21   16   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   16   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   16   45 o    707.6    2.9    0.0000   0.0000          ?        ?  5007.9248  40.8654          ?        ?      707.6        2.9       ?       ? 
1 1 1   21   16   46 o    200.5    4.3    0.0000   0.0000          ?        ?   402.2686  17.2401          ?        ?      200.5        4.3       ?       ? 
1 1 1   21   16   47 o    266.8    3.4    0.0000   0.0000          ?        ?   711.9516  17.8786          ?        ?      266.8        3.4       ?       ? 
1 1 1   21   16   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   16   49 o    178.4    5.0    0.0000   0.0000          ?        ?   318.6223  17.8786          ?        ?      178.4        5.0       ?       ? 
1 1 1   21   16   50 o     80.5   10.3    0.0000   0.0000          ?        ?    65.1292  16.6016          ?        ?       80.5       10.3       ?       ? 
1 1 1   21   16   51 o    338.6    3.0    0.0000   0.0000          ?        ?  1146.7849  20.4327          ?        ?      338.6        3.0       ?       ? 
1 1 1   21   16   52 o    141.9    6.5    0.0000   0.0000          ?        ?   201.7728  18.5171          ?        ?      141.9        6.5       ?       ? 
1 1 1   21   16   53 o    313.8    3.2    0.0000   0.0000          ?        ?   985.2389  19.7942          ?        ?      313.8        3.2       ?       ? 
1 1 1   21   16   54 o     45.2   15.4    0.0000   0.0000          ?        ?    19.1556  16.6016          ?        ?       45.2       15.4       ?       ? 
1 1 1   21   16   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   16   56 o    436.0    2.6    0.0000   0.0000          ?        ?  1901.5173  22.9868          ?        ?      436.0        2.6       ?       ? 
1 1 1   21   16   57 o     71.2   13.9    0.0000   0.0000          ?        ?    52.9973  19.1556          ?        ?       71.2       13.9       ?       ? 
1 1 1   21   16   58 o    524.3    2.8    0.0000   0.0000          ?        ?  2750.1128  29.3720          ?        ?      524.3        2.8       ?       ? 
1 1 1   21   16   59 o    188.6    5.2    0.0000   0.0000          ?        ?   356.2951  19.7942          ?        ?      188.6        5.2       ?       ? 
1 1 1   21   16   60 o    170.1    5.8    0.0000   0.0000          ?        ?   289.8888  19.7942          ?        ?      170.1        5.8       ?       ? 
1 1 1   21   16   61 o    366.0    3.1    0.0000   0.0000          ?        ?  1340.2568  22.3483          ?        ?      366.0        3.1       ?       ? 
1 1 1   21   16   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   16   63 o    244.7    4.2    0.0000   0.0000          ?        ?   599.5718  20.4327          ?        ?      244.7        4.2       ?       ? 
1 1 1   21   16   64 f     40.7   16.4    0.0000   0.0000          ?        ?     8.3008  20.4327          ?        ?       40.7       16.4       ?       ? 
1 1 1   21   16   65 f    115.0    9.2    0.0000   0.0000          ?        ?   133.4510  21.0712          ?        ?      115.0        9.2       ?       ? 
1 1 1   21   16   66 o    306.7    3.7    0.0000   0.0000          ?        ?   941.8194  22.9868          ?        ?      306.7        3.7       ?       ? 
1 1 1   21   16   67 o     28.1   13.4    0.0000   0.0000          ?        ?   -27.4564  21.0712          ?        ?       28.1       13.4       ?       ? 
1 1 1   21   16   68 o    231.8    4.4    0.0000   0.0000          ?        ?   538.9123  20.4327          ?        ?      231.8        4.4       ?       ? 
1 1 1   21   16   69 o     31.6   14.4    0.0000   0.0000          ?        ?   -10.8549  19.7942          ?        ?       31.6       14.4       ?       ? 
1 1 1   21   16   70 o    107.0    9.9    0.0000   0.0000          ?        ?   116.2109  21.0712          ?        ?      107.0        9.9       ?       ? 
1 1 1   21   16   71 o    171.6    5.8    0.0000   0.0000          ?        ?   296.2740  19.7942          ?        ?      171.6        5.8       ?       ? 
1 1 1   21   16   72 o     54.2   16.7    0.0000   0.0000          ?        ?    31.2876  19.7942          ?        ?       54.2       16.7       ?       ? 
1 1 1   21   17    0 o    732.7    5.1 5369.3286  74.0685  5369.3286  74.0685  5369.3286  74.0685      732.7      5.1      732.7        5.1     0.0     0.0 
1 1 1   21   17    1 o   1057.3    5.0    0.0000   0.0000          ?        ? 11179.2373 104.7175          ?        ?     1057.3        5.0       ?       ? 
1 1 1   21   17    2 o    626.2    3.2    0.0000   0.0000          ?        ?  3921.1611  39.5883          ?        ?      626.2        3.2       ?       ? 
1 1 1   21   17    3 o   1587.8    6.5    0.0000   0.0000          ?        ? 25216.4961 204.9654          ?        ?     1587.8        6.5       ?       ? 
1 1 1   21   17    4 o   1109.3    4.3    0.0000   0.0000          ?        ? 12306.2275  95.7782          ?        ?     1109.3        4.3       ?       ? 
1 1 1   21   17    5 o   1596.4    6.0    0.0000   0.0000          ?        ? 25489.1445 190.2794          ?        ?     1596.4        6.0       ?       ? 
1 1 1   21   17    6 o    633.3    2.9    0.0000   0.0000          ?        ?  4010.5542  36.3957          ?        ?      633.3        2.9       ?       ? 
1 1 1   21   17    7 o   1033.2    4.0    0.0000   0.0000          ?        ? 10676.7197  82.3693          ?        ?     1033.2        4.0       ?       ? 
1 1 1   21   17    8 o    642.6    2.5    0.0000   0.0000          ?        ?  4129.9580  32.5646          ?        ?      642.6        2.5       ?       ? 
1 1 1   21   17    9 o    693.4    2.7    0.0000   0.0000          ?        ?  4808.7061  37.0343          ?        ?      693.4        2.7       ?       ? 
1 1 1   21   17   10 o    975.6    3.7    0.0000   0.0000          ?        ?  9517.8027  71.5144          ?        ?      975.6        3.7       ?       ? 
1 1 1   21   17   11 o   1055.5    3.9    0.0000   0.0000          ?        ? 11140.9258  82.3693          ?        ?     1055.5        3.9       ?       ? 
1 1 1   21   17   12 o    293.2    2.4    0.0000   0.0000          ?        ?   859.4501  14.0475          ?        ?      293.2        2.4       ?       ? 
1 1 1   21   17   13 o     47.6   10.9    0.0000   0.0000          ?        ?    23.6253  10.2163          ?        ?       47.6       10.9       ?       ? 
1 1 1   21   17   14 o   1566.2    5.4    0.0000   0.0000          ?        ? 24533.2773 170.4853          ?        ?     1566.2        5.4       ?       ? 
1 1 1   21   17   15 o    386.5    2.5    0.0000   0.0000          ?        ?  1494.1406  19.1556          ?        ?      386.5        2.5       ?       ? 
1 1 1   21   17   16 o    752.0    3.1    0.0000   0.0000          ?        ?  5655.3862  45.9736          ?        ?      752.0        3.1       ?       ? 
1 1 1   21   17   17 o    556.3    2.5    0.0000   0.0000          ?        ?  3094.9143  28.0950          ?        ?      556.3        2.5       ?       ? 
1 1 1   21   17   18 o    764.3    3.1    0.0000   0.0000          ?        ?  5842.4727  47.2506          ?        ?      764.3        3.1       ?       ? 
1 1 1   21   17   19 o    464.7    2.3    0.0000   0.0000          ?        ?  2159.4802  21.7097          ?        ?      464.7        2.3       ?       ? 
1 1 1   21   17   20 o    882.3    3.4    0.0000   0.0000          ?        ?  7784.2168  60.0210          ?        ?      882.3        3.4       ?       ? 
1 1 1   21   17   21 o    566.5    2.6    0.0000   0.0000          ?        ?  3209.2097  29.3720          ?        ?      566.5        2.6       ?       ? 
1 1 1   21   17   22 o    484.9    2.4    0.0000   0.0000          ?        ?  2351.0366  23.6253          ?        ?      484.9        2.4       ?       ? 
1 1 1   21   17   23 o    477.7    2.4    0.0000   0.0000          ?        ?  2282.0762  22.9868          ?        ?      477.7        2.4       ?       ? 
1 1 1   21   17   24 o    697.6    2.7    0.0000   0.0000          ?        ?  4866.1733  38.3113          ?        ?      697.6        2.7       ?       ? 
1 1 1   21   17   25 o    265.7    2.8    0.0000   0.0000          ?        ?   706.2049  14.6860          ?        ?      265.7        2.8       ?       ? 
1 1 1   21   17   26 o    648.1    2.8    0.0000   0.0000          ?        ?  4200.1953  36.3957          ?        ?      648.1        2.8       ?       ? 
1 1 1   21   17   27 o    713.0    2.9    0.0000   0.0000          ?        ?  5083.9092  40.8654          ?        ?      713.0        2.9       ?       ? 
1 1 1   21   17   28 o    129.6    5.7    0.0000   0.0000          ?        ?   167.9312  14.6860          ?        ?      129.6        5.7       ?       ? 
1 1 1   21   17   29 o   1007.8    3.6    0.0000   0.0000          ?        ? 10156.9629  73.4300          ?        ?     1007.8        3.6       ?       ? 
1 1 1   21   17   30 o    749.9    3.1    0.0000   0.0000          ?        ?  5623.4600  45.9736          ?        ?      749.9        3.1       ?       ? 
1 1 1   21   17   31 o    859.8    3.2    0.0000   0.0000          ?        ?  7394.0806  55.5514          ?        ?      859.8        3.2       ?       ? 
1 1 1   21   17   32 o    684.5    2.9    0.0000   0.0000          ?        ?  4686.1104  40.2269          ?        ?      684.5        2.9       ?       ? 
1 1 1   21   17   33 o    809.3    3.2    0.0000   0.0000          ?        ?  6549.9551  52.3588          ?        ?      809.3        3.2       ?       ? 
1 1 1   21   17   34 o    699.6    2.8    0.0000   0.0000          ?        ?  4894.9067  38.9498          ?        ?      699.6        2.8       ?       ? 
1 1 1   21   17   35 o    507.6    2.5    0.0000   0.0000          ?        ?  2577.0732  24.9023          ?        ?      507.6        2.5       ?       ? 
1 1 1   21   17   36 o    244.4    3.4    0.0000   0.0000          ?        ?   597.6562  16.6016          ?        ?      244.4        3.4       ?       ? 
1 1 1   21   17   37 f    812.0    3.1    0.0000   0.0000          ?        ?  6594.0127  50.4432          ?        ?      812.0        3.1       ?       ? 
1 1 1   21   17   38 o    142.7    5.6    0.0000   0.0000          ?        ?   203.6884  15.9630          ?        ?      142.7        5.6       ?       ? 
1 1 1   21   17   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   17   40 o    531.0    2.6    0.0000   0.0000          ?        ?  2819.7114  28.0950          ?        ?      531.0        2.6       ?       ? 
1 1 1   21   17   41 o    308.6    2.9    0.0000   0.0000          ?        ?   952.6743  17.8786          ?        ?      308.6        2.9       ?       ? 
1 1 1   21   17   42 o    305.6    3.1    0.0000   0.0000          ?        ?   934.1572  19.1556          ?        ?      305.6        3.1       ?       ? 
1 1 1   21   17   43 o    425.8    2.7    0.0000   0.0000          ?        ?  1813.4014  22.9868          ?        ?      425.8        2.7       ?       ? 
1 1 1   21   17   44 o    546.5    2.7    0.0000   0.0000          ?        ?  2987.6426  29.3720          ?        ?      546.5        2.7       ?       ? 
1 1 1   21   17   45 o    274.1    3.3    0.0000   0.0000          ?        ?   751.5399  17.8786          ?        ?      274.1        3.3       ?       ? 
1 1 1   21   17   46 o    410.0    2.6    0.0000   0.0000          ?        ?  1681.2274  21.7097          ?        ?      410.0        2.6       ?       ? 
1 1 1   21   17   47 o    208.5    4.0    0.0000   0.0000          ?        ?   434.8332  16.6016          ?        ?      208.5        4.0       ?       ? 
1 1 1   21   17   48 o    277.0    3.3    0.0000   0.0000          ?        ?   767.5030  18.5171          ?        ?      277.0        3.3       ?       ? 
1 1 1   21   17   49 o    426.6    2.7    0.0000   0.0000          ?        ?  1820.4252  22.9868          ?        ?      426.6        2.7       ?       ? 
1 1 1   21   17   50 o    222.2    4.0    0.0000   0.0000          ?        ?   494.2158  17.8786          ?        ?      222.2        4.0       ?       ? 
1 1 1   21   17   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   17   52 o    554.3    2.8    0.0000   0.0000          ?        ?  3073.2046  30.6490          ?        ?      554.3        2.8       ?       ? 
1 1 1   21   17   53 o    305.4    3.0    0.0000   0.0000          ?        ?   932.8801  18.5171          ?        ?      305.4        3.0       ?       ? 
1 1 1   21   17   54 o    382.4    2.8    0.0000   0.0000          ?        ?  1462.8530  21.7097          ?        ?      382.4        2.8       ?       ? 
1 1 1   21   17   55 f    243.7    3.8    0.0000   0.0000          ?        ?   594.4636  18.5171          ?        ?      243.7        3.8       ?       ? 
1 1 1   21   17   56 o    140.7    7.0    0.0000   0.0000          ?        ?   198.5802  19.7942          ?        ?      140.7        7.0       ?       ? 
1 1 1   21   17   57 o    171.6    5.4    0.0000   0.0000          ?        ?   294.9970  18.5171          ?        ?      171.6        5.4       ?       ? 
1 1 1   21   17   58 o    250.7    3.9    0.0000   0.0000          ?        ?   628.9438  19.7942          ?        ?      250.7        3.9       ?       ? 
1 1 1   21   17   59 o     72.0   13.8    0.0000   0.0000          ?        ?    54.2743  19.1556          ?        ?       72.0       13.8       ?       ? 
1 1 1   21   17   60 o    320.3    3.2    0.0000   0.0000          ?        ?  1026.7428  20.4327          ?        ?      320.3        3.2       ?       ? 
1 1 1   21   17   61 o     24.1   11.8    0.0000   0.0000          ?        ?   -37.0343  19.1556          ?        ?       24.1       11.8       ?       ? 
1 1 1   21   17   62 o     23.7   11.7    0.0000   0.0000          ?        ?   -38.9498  19.1556          ?        ?       23.7       11.7       ?       ? 
1 1 1   21   17   63 f    377.9    3.1    0.0000   0.0000          ?        ?  1429.6499  23.6253          ?        ?      377.9        3.1       ?       ? 
1 1 1   21   17   64 o     96.3   10.6    0.0000   0.0000          ?        ?    93.8627  20.4327          ?        ?       96.3       10.6       ?       ? 
1 1 1   21   17   65 o     31.3   14.4    0.0000   0.0000          ?        ?   -15.9630  21.0712          ?        ?       31.3       14.4       ?       ? 
1 1 1   21   17   66 o     75.6   13.6    0.0000   0.0000          ?        ?    60.0210  19.7942          ?        ?       75.6       13.6       ?       ? 
1 1 1   21   17   67 o     56.8   17.1    0.0000   0.0000          ?        ?    33.8416  21.0712          ?        ?       56.8       17.1       ?       ? 
1 1 1   21   17   68 o     28.2   13.4    0.0000   0.0000          ?        ?   -24.2638  20.4327          ?        ?       28.2       13.4       ?       ? 
1 1 1   21   17   69 o     62.5   15.8    0.0000   0.0000          ?        ?    42.1424  19.7942          ?        ?       62.5       15.8       ?       ? 
1 1 1   21   17   70 o    199.5    5.1    0.0000   0.0000          ?        ?   399.7145  20.4327          ?        ?      199.5        5.1       ?       ? 
1 1 1   21   17   71 o     53.5   17.0    0.0000   0.0000          ?        ?    30.0105  20.4327          ?        ?       53.5       17.0       ?       ? 
1 1 1   21   18    0 o    789.2    5.4 6229.4170  85.5619  6229.4170  85.5619  6229.4170  85.5619      789.2      5.4      789.2        5.4     0.0     0.0 
1 1 1   21   18    1 o    604.9    3.2    0.0000   0.0000          ?        ?  3658.7290  38.9498          ?        ?      604.9        3.2       ?       ? 
1 1 1   21   18    2 o    968.9    4.3    0.0000   0.0000          ?        ?  9388.8223  82.3693          ?        ?      968.9        4.3       ?       ? 
1 1 1   21   18    3 o   1034.8    4.0    0.0000   0.0000          ?        ? 10709.2842  83.0078          ?        ?     1034.8        4.0       ?       ? 
1 1 1   21   18    4 o    948.1    3.8    0.0000   0.0000          ?        ?  8989.7461  72.1529          ?        ?      948.1        3.8       ?       ? 
1 1 1   21   18    5 o    772.0    3.4    0.0000   0.0000          ?        ?  5959.9609  52.3588          ?        ?      772.0        3.4       ?       ? 
1 1 1   21   18    6 o   1076.3    4.1    0.0000   0.0000          ?        ? 11585.9746  88.1160          ?        ?     1076.3        4.1       ?       ? 
1 1 1   21   18    7 o    513.6    2.8    0.0000   0.0000          ?        ?  2637.7329  28.7335          ?        ?      513.6        2.8       ?       ? 
1 1 1   21   18    8 o    841.7    3.3    0.0000   0.0000          ?        ?  7085.0356  56.1899          ?        ?      841.7        3.3       ?       ? 
1 1 1   21   18    9 o    389.3    2.0    0.0000   0.0000          ?        ?  1515.2118  15.3245          ?        ?      389.3        2.0       ?       ? 
1 1 1   21   18   10 o    558.9    2.6    0.0000   0.0000          ?        ?  3124.2861  29.3720          ?        ?      558.9        2.6       ?       ? 
1 1 1   21   18   11 o   1290.5    4.5    0.0000   0.0000          ?        ? 16656.4766 116.8494          ?        ?     1290.5        4.5       ?       ? 
1 1 1   21   18   12 o   1637.7    5.6    0.0000   0.0000          ?        ? 26824.2930 181.9787          ?        ?     1637.7        5.6       ?       ? 
1 1 1   21   18   13 o    367.0    2.3    0.0000   0.0000          ?        ?  1346.6421  17.2401          ?        ?      367.0        2.3       ?       ? 
1 1 1   21   18   14 o   1771.3    5.9    0.0000   0.0000          ?        ? 31378.8672 207.5195          ?        ?     1771.3        5.9       ?       ? 
1 1 1   21   18   15 o   1999.9    6.7    0.0000   0.0000          ?        ? 40003.3789 266.2635          ?        ?     1999.9        6.7       ?       ? 
1 1 1   21   18   16 f    850.2    3.2    0.0000   0.0000          ?        ?  7228.0649  54.9129          ?        ?      850.2        3.2       ?       ? 
1 1 1   21   18   17 o   1168.5    4.2    0.0000   0.0000          ?        ? 13656.0615  97.0553          ?        ?     1168.5        4.2       ?       ? 
1 1 1   21   18   18 o    935.8    3.4    0.0000   0.0000          ?        ?  8757.9629  63.2136          ?        ?      935.8        3.4       ?       ? 
1 1 1   21   18   19 o   1251.9    4.3    0.0000   0.0000          ?        ? 15675.0664 108.5487          ?        ?     1251.9        4.3       ?       ? 
1 1 1   21   18   20 o   1105.0    4.0    0.0000   0.0000          ?        ? 12211.7266  88.1160          ?        ?     1105.0        4.0       ?       ? 
1 1 1   21   18   21 o    575.7    2.6    0.0000   0.0000          ?        ?  3313.9272  29.3720          ?        ?      575.7        2.6       ?       ? 
1 1 1   21   18   22 o    375.0    2.5    0.0000   0.0000          ?        ?  1406.6632  18.5171          ?        ?      375.0        2.5       ?       ? 
1 1 1   21   18   23 o   1056.7    3.9    0.0000   0.0000          ?        ? 11166.4668  83.0078          ?        ?     1056.7        3.9       ?       ? 
1 1 1   21   18   24 o   1062.5    3.9    0.0000   0.0000          ?        ? 11289.7012  82.3693          ?        ?     1062.5        3.9       ?       ? 
1 1 1   21   18   25 f   1158.5    4.2    0.0000   0.0000          ?        ? 13423.0010  96.4168          ?        ?     1158.5        4.2       ?       ? 
1 1 1   21   18   26 o    669.2    2.9    0.0000   0.0000          ?        ?  4479.2290  38.9498          ?        ?      669.2        2.9       ?       ? 
1 1 1   21   18   27 o    488.7    2.6    0.0000   0.0000          ?        ?  2388.0708  25.5409          ?        ?      488.7        2.6       ?       ? 
1 1 1   21   18   28 o   1237.4    4.3    0.0000   0.0000          ?        ? 15313.6641 105.9946          ?        ?     1237.4        4.3       ?       ? 
1 1 1   21   18   29 o    545.7    2.6    0.0000   0.0000          ?        ?  2978.0649  28.7335          ?        ?      545.7        2.6       ?       ? 
1 1 1   21   18   30 o    794.2    3.2    0.0000   0.0000          ?        ?  6307.9551  50.4432          ?        ?      794.2        3.2       ?       ? 
1 1 1   21   18   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   18   32 o    661.3    2.8    0.0000   0.0000          ?        ?  4373.8730  37.6728          ?        ?      661.3        2.8       ?       ? 
1 1 1   21   18   33 o    353.6    2.6    0.0000   0.0000          ?        ?  1250.2253  18.5171          ?        ?      353.6        2.6       ?       ? 
1 1 1   21   18   34 o    292.9    3.1    0.0000   0.0000          ?        ?   858.1730  17.8786          ?        ?      292.9        3.1       ?       ? 
1 1 1   21   18   35 o    254.2    3.3    0.0000   0.0000          ?        ?   646.1838  16.6016          ?        ?      254.2        3.3       ?       ? 
1 1 1   21   18   36 o    218.4    3.8    0.0000   0.0000          ?        ?   476.9756  16.6016          ?        ?      218.4        3.8       ?       ? 
1 1 1   21   18   37 o    512.9    2.6    0.0000   0.0000          ?        ?  2631.3477  26.1794          ?        ?      512.9        2.6       ?       ? 
1 1 1   21   18   38 o    343.1    2.8    0.0000   0.0000          ?        ?  1177.4338  19.1556          ?        ?      343.1        2.8       ?       ? 
1 1 1   21   18   39 o    666.9    2.8    0.0000   0.0000          ?        ?  4448.5801  37.0343          ?        ?      666.9        2.8       ?       ? 
1 1 1   21   18   40 o    264.5    3.3    0.0000   0.0000          ?        ?   699.8197  17.2401          ?        ?      264.5        3.3       ?       ? 
1 1 1   21   18   41 o    136.9    6.3    0.0000   0.0000          ?        ?   187.7254  17.2401          ?        ?      136.9        6.3       ?       ? 
1 1 1   21   18   42 f    423.7    2.6    0.0000   0.0000          ?        ?  1795.5229  22.3483          ?        ?      423.7        2.6       ?       ? 
1 1 1   21   18   43 o    403.1    2.6    0.0000   0.0000          ?        ?  1625.0376  21.0712          ?        ?      403.1        2.6       ?       ? 
1 1 1   21   18   44 o    239.8    3.6    0.0000   0.0000          ?        ?   575.3080  17.2401          ?        ?      239.8        3.6       ?       ? 
1 1 1   21   18   45 o    590.8    2.6    0.0000   0.0000          ?        ?  3490.7979  31.2876          ?        ?      590.8        2.6       ?       ? 
1 1 1   21   18   46 o    192.2    4.5    0.0000   0.0000          ?        ?   369.7040  17.2401          ?        ?      192.2        4.5       ?       ? 
1 1 1   21   18   47 o    249.3    3.5    0.0000   0.0000          ?        ?   621.9200  17.2401          ?        ?      249.3        3.5       ?       ? 
1 1 1   21   18   48 o     18.5    9.3    0.0000   0.0000          ?        ?   -51.0817  15.9630          ?        ?       18.5        9.3       ?       ? 
1 1 1   21   18   49 o     56.8   14.5    0.0000   0.0000          ?        ?    33.8416  16.6016          ?        ?       56.8       14.5       ?       ? 
1 1 1   21   18   50 o    389.4    2.7    0.0000   0.0000          ?        ?  1516.4889  21.0712          ?        ?      389.4        2.7       ?       ? 
1 1 1   21   18   51 o    331.2    3.0    0.0000   0.0000          ?        ?  1097.6187  19.7942          ?        ?      331.2        3.0       ?       ? 
1 1 1   21   18   52 o    181.1    4.9    0.0000   0.0000          ?        ?   328.2001  17.8786          ?        ?      181.1        4.9       ?       ? 
1 1 1   21   18   53 o    261.4    3.5    0.0000   0.0000          ?        ?   683.8566  18.5171          ?        ?      261.4        3.5       ?       ? 
1 1 1   21   18   54 o    294.1    3.3    0.0000   0.0000          ?        ?   865.1968  19.1556          ?        ?      294.1        3.3       ?       ? 
1 1 1   21   18   55 o    170.5    5.4    0.0000   0.0000          ?        ?   291.1659  18.5171          ?        ?      170.5        5.4       ?       ? 
1 1 1   21   18   56 f    296.1    3.5    0.0000   0.0000          ?        ?   877.3287  20.4327          ?        ?      296.1        3.5       ?       ? 
1 1 1   21   18   57 o     22.1   11.0    0.0000   0.0000          ?        ?   -52.3588  19.7942          ?        ?       22.1       11.0       ?       ? 
1 1 1   21   18   58 o    250.9    3.9    0.0000   0.0000          ?        ?   630.2208  19.7942          ?        ?      250.9        3.9       ?       ? 
1 1 1   21   18   59 o     29.0   13.6    0.0000   0.0000          ?        ?   -19.7942  19.7942          ?        ?       29.0       13.6       ?       ? 
1 1 1   21   18   60 o    304.2    3.5    0.0000   0.0000          ?        ?   926.4949  21.0712          ?        ?      304.2        3.5       ?       ? 
1 1 1   21   18   61 o    164.1    6.2    0.0000   0.0000          ?        ?   270.0946  20.4327          ?        ?      164.1        6.2       ?       ? 
1 1 1   21   18   62 o     51.4   16.8    0.0000   0.0000          ?        ?    26.1794  19.7942          ?        ?       51.4       16.8       ?       ? 
1 1 1   21   18   63 o    159.5    6.2    0.0000   0.0000          ?        ?   255.4086  19.7942          ?        ?      159.5        6.2       ?       ? 
1 1 1   21   18   64 o     91.6   10.8    0.0000   0.0000          ?        ?    84.9234  19.7942          ?        ?       91.6       10.8       ?       ? 
1 1 1   21   18   65 o    124.3    8.2    0.0000   0.0000          ?        ?   155.7993  20.4327          ?        ?      124.3        8.2       ?       ? 
1 1 1   21   18   66 o     30.0   13.8    0.0000   0.0000          ?        ?   -14.0475  19.1556          ?        ?       30.0       13.8       ?       ? 
1 1 1   21   18   67 o     52.6   17.0    0.0000   0.0000          ?        ?    28.0950  20.4327          ?        ?       52.6       17.0       ?       ? 
1 1 1   21   18   68 o    125.8    7.6    0.0000   0.0000          ?        ?   159.6304  19.1556          ?        ?      125.8        7.6       ?       ? 
1 1 1   21   18   69 o    152.8    6.5    0.0000   0.0000          ?        ?   234.9760  19.7942          ?        ?      152.8        6.5       ?       ? 
1 1 1   21   18   70 o    187.4    5.5    0.0000   0.0000          ?        ?   353.1024  20.4327          ?        ?      187.4        5.5       ?       ? 
1 1 1   21   18   71 o    136.8    7.0    0.0000   0.0000          ?        ?   189.0024  19.1556          ?        ?      136.8        7.0       ?       ? 
1 1 1   21   19    0 o    760.4    5.6 5783.7290  84.9234  5783.7290  84.9234  5783.7290  84.9234      760.4      5.6      760.4        5.6     0.0     0.0 
1 1 1   21   19    1 f   1242.1    5.7    0.0000   0.0000          ?        ? 15430.5146 142.3903          ?        ?     1242.1        5.7       ?       ? 
1 1 1   21   19    2 o    195.4    3.9    0.0000   0.0000          ?        ?   381.8359  15.3245          ?        ?      195.4        3.9       ?       ? 
1 1 1   21   19    3 o    478.3    3.9    0.0000   0.0000          ?        ?  2287.8230  37.6728          ?        ?      478.3        3.9       ?       ? 
1 1 1   21   19    4 o   1763.9    7.0    0.0000   0.0000          ?        ? 31121.5449 245.1923          ?        ?     1763.9        7.0       ?       ? 
1 1 1   21   19    5 o    669.9    3.2    0.0000   0.0000          ?        ?  4487.5298  42.7809          ?        ?      669.9        3.2       ?       ? 
1 1 1   21   19    6 o    425.4    2.6    0.0000   0.0000          ?        ?  1809.5702  22.3483          ?        ?      425.4        2.6       ?       ? 
1 1 1   21   19    7 o    207.8    2.9    0.0000   0.0000          ?        ?   431.6406  12.1319          ?        ?      207.8        2.9       ?       ? 
1 1 1   21   19    8 o   1191.7    4.1    0.0000   0.0000          ?        ? 14202.6367  98.3323          ?        ?     1191.7        4.1       ?       ? 
1 1 1   21   19    9 f    565.0    2.4    0.0000   0.0000          ?        ?  3191.9695  27.4564          ?        ?      565.0        2.4       ?       ? 
1 1 1   21   19   10 o    860.2    3.2    0.0000   0.0000          ?        ?  7399.1890  54.2743          ?        ?      860.2        3.2       ?       ? 
1 1 1   21   19   11 o    634.1    2.6    0.0000   0.0000          ?        ?  4020.7708  33.2031          ?        ?      634.1        2.6       ?       ? 
1 1 1   21   19   12 o    947.9    3.5    0.0000   0.0000          ?        ?  8986.5537  66.4062          ?        ?      947.9        3.5       ?       ? 
1 1 1   21   19   13 o   1267.4    4.3    0.0000   0.0000          ?        ? 16063.9277 109.8257          ?        ?     1267.4        4.3       ?       ? 
1 1 1   21   19   14 o    484.9    2.6    0.0000   0.0000          ?        ?  2351.0366  24.9023          ?        ?      484.9        2.6       ?       ? 
1 1 1   21   19   15 o    826.2    3.1    0.0000   0.0000          ?        ?  6826.4346  51.7203          ?        ?      826.2        3.1       ?       ? 
1 1 1   21   19   16 o    111.0    5.5    0.0000   0.0000          ?        ?   123.2347  12.1319          ?        ?      111.0        5.5       ?       ? 
1 1 1   21   19   17 o    512.6    2.6    0.0000   0.0000          ?        ?  2628.1550  26.1794          ?        ?      512.6        2.6       ?       ? 
1 1 1   21   19   18 o    119.0    5.6    0.0000   0.0000          ?        ?   141.7518  13.4090          ?        ?      119.0        5.6       ?       ? 
1 1 1   21   19   19 o    812.9    3.1    0.0000   0.0000          ?        ?  6608.6987  51.0817          ?        ?      812.9        3.1       ?       ? 
1 1 1   21   19   20 o    737.7    2.9    0.0000   0.0000          ?        ?  5442.7583  42.7809          ?        ?      737.7        2.9       ?       ? 
1 1 1   21   19   21 o    532.7    2.5    0.0000   0.0000          ?        ?  2837.5901  26.8179          ?        ?      532.7        2.5       ?       ? 
1 1 1   21   19   22 o    355.4    2.5    0.0000   0.0000          ?        ?  1262.9958  17.8786          ?        ?      355.4        2.5       ?       ? 
1 1 1   21   19   23 o    286.0    2.9    0.0000   0.0000          ?        ?   817.9462  16.6016          ?        ?      286.0        2.9       ?       ? 
1 1 1   21   19   24 o    334.7    2.6    0.0000   0.0000          ?        ?  1120.6055  17.2401          ?        ?      334.7        2.6       ?       ? 
1 1 1   21   19   25 o    520.1    2.6    0.0000   0.0000          ?        ?  2705.4163  26.8179          ?        ?      520.1        2.6       ?       ? 
1 1 1   21   19   26 o     37.3   14.9    0.0000   0.0000          ?        ?     7.0237  16.6016          ?        ?       37.3       14.9       ?       ? 
1 1 1   21   19   27 o    673.2    3.0    0.0000   0.0000          ?        ?  4532.8652  40.2269          ?        ?      673.2        3.0       ?       ? 
1 1 1   21   19   28 o    146.7    5.2    0.0000   0.0000          ?        ?   215.1818  15.3245          ?        ?      146.7        5.2       ?       ? 
1 1 1   21   19   29 o    361.0    2.9    0.0000   0.0000          ?        ?  1303.2227  21.0712          ?        ?      361.0        2.9       ?       ? 
1 1 1   21   19   30 o    236.9    3.5    0.0000   0.0000          ?        ?   561.2605  16.6016          ?        ?      236.9        3.5       ?       ? 
1 1 1   21   19   31 o    489.3    2.4    0.0000   0.0000          ?        ?  2394.4561  23.6253          ?        ?      489.3        2.4       ?       ? 
1 1 1   21   19   32 o    655.3    2.8    0.0000   0.0000          ?        ?  4294.6963  37.0343          ?        ?      655.3        2.8       ?       ? 
1 1 1   21   19   33 o    407.1    2.6    0.0000   0.0000          ?        ?  1657.6022  21.0712          ?        ?      407.1        2.6       ?       ? 
1 1 1   21   19   34 o    282.8    3.2    0.0000   0.0000          ?        ?   800.0676  17.8786          ?        ?      282.8        3.2       ?       ? 
1 1 1   21   19   35 o    671.1    2.8    0.0000   0.0000          ?        ?  4504.1318  37.6728          ?        ?      671.1        2.8       ?       ? 
1 1 1   21   19   36 o    497.5    2.6    0.0000   0.0000          ?        ?  2475.5483  25.5409          ?        ?      497.5        2.6       ?       ? 
1 1 1   21   19   37 o    473.2    2.6    0.0000   0.0000          ?        ?  2239.2954  24.2638          ?        ?      473.2        2.6       ?       ? 
1 1 1   21   19   38 o    219.7    3.6    0.0000   0.0000          ?        ?   482.7224  15.9630          ?        ?      219.7        3.6       ?       ? 
1 1 1   21   19   39 o    284.7    3.0    0.0000   0.0000          ?        ?   810.9225  17.2401          ?        ?      284.7        3.0       ?       ? 
1 1 1   21   19   40 o     50.1   14.9    0.0000   0.0000          ?        ?    25.5409  15.9630          ?        ?       50.1       14.9       ?       ? 
1 1 1   21   19   41 o    644.3    2.9    0.0000   0.0000          ?        ?  4152.3062  37.6728          ?        ?      644.3        2.9       ?       ? 
1 1 1   21   19   42 o    378.3    2.7    0.0000   0.0000          ?        ?  1431.5654  20.4327          ?        ?      378.3        2.7       ?       ? 
1 1 1   21   19   43 o    357.8    2.8    0.0000   0.0000          ?        ?  1280.2358  19.7942          ?        ?      357.8        2.8       ?       ? 
1 1 1   21   19   44 o    123.2    6.7    0.0000   0.0000          ?        ?   151.9681  16.6016          ?        ?      123.2        6.7       ?       ? 
1 1 1   21   19   45 o    198.1    4.4    0.0000   0.0000          ?        ?   392.6908  17.2401          ?        ?      198.1        4.4       ?       ? 
1 1 1   21   19   46 o    201.0    4.6    0.0000   0.0000          ?        ?   404.1842  18.5171          ?        ?      201.0        4.6       ?       ? 
1 1 1   21   19   47 o    594.9    2.8    0.0000   0.0000          ?        ?  3539.9641  33.8416          ?        ?      594.9        2.8       ?       ? 
1 1 1   21   19   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   19   49 o    350.3    2.9    0.0000   0.0000          ?        ?  1227.2385  20.4327          ?        ?      350.3        2.9       ?       ? 
1 1 1   21   19   50 o    182.5    4.5    0.0000   0.0000          ?        ?   333.3083  16.6016          ?        ?      182.5        4.5       ?       ? 
1 1 1   21   19   51 o     52.3   15.4    0.0000   0.0000          ?        ?    28.0950  17.2401          ?        ?       52.3       15.4       ?       ? 
1 1 1   21   19   52 o     36.2   14.9    0.0000   0.0000          ?        ?     4.4697  17.2401          ?        ?       36.2       14.9       ?       ? 
1 1 1   21   19   53 o    179.6    5.0    0.0000   0.0000          ?        ?   323.0919  17.8786          ?        ?      179.6        5.0       ?       ? 
1 1 1   21   19   54 o     19.9   10.0    0.0000   0.0000          ?        ?   -54.2743  17.8786          ?        ?       19.9       10.0       ?       ? 
1 1 1   21   19   55 o    164.4    5.6    0.0000   0.0000          ?        ?   270.7332  18.5171          ?        ?      164.4        5.6       ?       ? 
1 1 1   21   19   56 o    185.9    5.2    0.0000   0.0000          ?        ?   346.0787  19.1556          ?        ?      185.9        5.2       ?       ? 
1 1 1   21   19   57 o    491.4    3.0    0.0000   0.0000          ?        ?  2416.1658  29.3720          ?        ?      491.4        3.0       ?       ? 
1 1 1   21   19   58 o    171.2    5.8    0.0000   0.0000          ?        ?   293.7199  19.7942          ?        ?      171.2        5.8       ?       ? 
1 1 1   21   19   59 o    212.6    4.7    0.0000   0.0000          ?        ?   452.7119  19.7942          ?        ?      212.6        4.7       ?       ? 
1 1 1   21   19   60 o    147.7    6.9    0.0000   0.0000          ?        ?   219.0129  20.4327          ?        ?      147.7        6.9       ?       ? 
1 1 1   21   19   61 o     95.8   10.3    0.0000   0.0000          ?        ?    92.5856  19.7942          ?        ?       95.8       10.3       ?       ? 
1 1 1   21   19   62 o    193.2    5.3    0.0000   0.0000          ?        ?   374.1737  20.4327          ?        ?      193.2        5.3       ?       ? 
1 1 1   21   19   63 o     34.3   15.2    0.0000   0.0000          ?        ?    -5.7467  20.4327          ?        ?       34.3       15.2       ?       ? 
1 1 1   21   19   64 o    228.4    4.6    0.0000   0.0000          ?        ?   522.9492  21.0712          ?        ?      228.4        4.6       ?       ? 
1 1 1   21   19   65 o     87.2   11.7    0.0000   0.0000          ?        ?    77.2611  20.4327          ?        ?       87.2       11.7       ?       ? 
1 1 1   21   19   66 o     88.2   11.6    0.0000   0.0000          ?        ?    79.1767  20.4327          ?        ?       88.2       11.6       ?       ? 
1 1 1   21   19   67 o    153.9    6.4    0.0000   0.0000          ?        ?   238.1686  19.7942          ?        ?      153.9        6.4       ?       ? 
1 1 1   21   19   68 o    185.3    5.3    0.0000   0.0000          ?        ?   344.8017  19.7942          ?        ?      185.3        5.3       ?       ? 
1 1 1   21   19   69 f    171.4    6.0    0.0000   0.0000          ?        ?   295.6355  20.4327          ?        ?      171.4        6.0       ?       ? 
1 1 1   21   19   70 o    144.9    7.1    0.0000   0.0000          ?        ?   211.9892  20.4327          ?        ?      144.9        7.1       ?       ? 
1 1 1   21   20    0 o    235.5    7.1  556.1523  33.2031   556.1523  33.2031   556.1523  33.2031      235.5      7.1      235.5        7.1     0.0     0.0 
1 1 1   21   20    1 o   1255.0    5.4    0.0000   0.0000          ?        ? 15752.9678 136.0051          ?        ?     1255.0        5.4       ?       ? 
1 1 1   21   20    2 o   1092.0    4.8    0.0000   0.0000          ?        ? 11925.0293 104.7175          ?        ?     1092.0        4.8       ?       ? 
1 1 1   21   20    3 o    300.6    3.1    0.0000   0.0000          ?        ?   903.5081  18.5171          ?        ?      300.6        3.1       ?       ? 
1 1 1   21   20    4 o    673.3    3.3    0.0000   0.0000          ?        ?  4534.1421  44.0580          ?        ?      673.3        3.3       ?       ? 
1 1 1   21   20    5 o    442.4    2.5    0.0000   0.0000          ?        ?  1957.0687  22.3483          ?        ?      442.4        2.5       ?       ? 
1 1 1   21   20    6 o    570.4    3.0    0.0000   0.0000          ?        ?  3253.9062  33.8416          ?        ?      570.4        3.0       ?       ? 
1 1 1   21   20    7 o   1298.9    4.6    0.0000   0.0000          ?        ? 16872.9336 119.4035          ?        ?     1298.9        4.6       ?       ? 
1 1 1   21   20    8 o   1151.0    4.0    0.0000   0.0000          ?        ? 13248.6846  93.2242          ?        ?     1151.0        4.0       ?       ? 
1 1 1   21   20    9 o   1326.4    4.6    0.0000   0.0000          ?        ? 17595.7402 123.2347          ?        ?     1326.4        4.6       ?       ? 
1 1 1   21   20   10 o    779.8    3.2    0.0000   0.0000          ?        ?  6081.9185  49.8047          ?        ?      779.8        3.2       ?       ? 
1 1 1   21   20   11 f    778.5    3.0    0.0000   0.0000          ?        ?  6060.8472  45.9736          ?        ?      778.5        3.0       ?       ? 
1 1 1   21   20   12 o    891.3    3.3    0.0000   0.0000          ?        ?  7944.4858  58.7440          ?        ?      891.3        3.3       ?       ? 
1 1 1   21   20   13 o    811.9    3.2    0.0000   0.0000          ?        ?  6592.7358  51.7203          ?        ?      811.9        3.2       ?       ? 
1 1 1   21   20   14 o    364.3    2.3    0.0000   0.0000          ?        ?  1327.4865  16.6016          ?        ?      364.3        2.3       ?       ? 
1 1 1   21   20   15 o    594.3    2.6    0.0000   0.0000          ?        ?  3532.3018  31.2876          ?        ?      594.3        2.6       ?       ? 
1 1 1   21   20   16 o    306.1    2.4    0.0000   0.0000          ?        ?   936.7112  14.6860          ?        ?      306.1        2.4       ?       ? 
1 1 1   21   20   17 o    695.5    2.8    0.0000   0.0000          ?        ?  4837.4395  38.3113          ?        ?      695.5        2.8       ?       ? 
1 1 1   21   20   18 o    938.4    3.6    0.0000   0.0000          ?        ?  8806.4902  68.3218          ?        ?      938.4        3.6       ?       ? 
1 1 1   21   20   19 o    870.5    3.2    0.0000   0.0000          ?        ?  7578.6133  56.1899          ?        ?      870.5        3.2       ?       ? 
1 1 1   21   20   20 o    366.3    2.4    0.0000   0.0000          ?        ?  1341.5339  17.2401          ?        ?      366.3        2.4       ?       ? 
1 1 1   21   20   21 o    485.9    2.4    0.0000   0.0000          ?        ?  2361.2529  23.6253          ?        ?      485.9        2.4       ?       ? 
1 1 1   21   20   22 o    975.1    3.6    0.0000   0.0000          ?        ?  9509.5029  70.8759          ?        ?      975.1        3.6       ?       ? 
1 1 1   21   20   23 o    898.9    3.3    0.0000   0.0000          ?        ?  8081.7681  59.3825          ?        ?      898.9        3.3       ?       ? 
1 1 1   21   20   24 o    252.3    2.8    0.0000   0.0000          ?        ?   636.6060  14.0475          ?        ?      252.3        2.8       ?       ? 
1 1 1   21   20   25 o     64.9    9.8    0.0000   0.0000          ?        ?    42.1424  12.7704          ?        ?       64.9        9.8       ?       ? 
1 1 1   21   20   26 o    561.4    2.6    0.0000   0.0000          ?        ?  3151.7427  28.7335          ?        ?      561.4        2.6       ?       ? 
1 1 1   21   20   27 o    761.1    3.0    0.0000   0.0000          ?        ?  5792.6685  45.9736          ?        ?      761.1        3.0       ?       ? 
1 1 1   21   20   28 o    783.3    3.0    0.0000   0.0000          ?        ?  6135.5547  47.2506          ?        ?      783.3        3.0       ?       ? 
1 1 1   21   20   29 o    385.9    2.5    0.0000   0.0000          ?        ?  1489.6710  19.1556          ?        ?      385.9        2.5       ?       ? 
1 1 1   21   20   30 o    155.3    4.3    0.0000   0.0000          ?        ?   241.3612  13.4090          ?        ?      155.3        4.3       ?       ? 
1 1 1   21   20   31 o    324.1    2.7    0.0000   0.0000          ?        ?  1050.3680  17.2401          ?        ?      324.1        2.7       ?       ? 
1 1 1   21   20   32 o    386.0    2.7    0.0000   0.0000          ?        ?  1490.3094  21.0712          ?        ?      386.0        2.7       ?       ? 
1 1 1   21   20   33 o    344.8    2.8    0.0000   0.0000          ?        ?  1188.9272  19.1556          ?        ?      344.8        2.8       ?       ? 
1 1 1   21   20   34 o    659.8    3.0    0.0000   0.0000          ?        ?  4353.4404  38.9498          ?        ?      659.8        3.0       ?       ? 
1 1 1   21   20   35 o    516.2    2.5    0.0000   0.0000          ?        ?  2664.5508  25.5409          ?        ?      516.2        2.5       ?       ? 
1 1 1   21   20   36 o    405.0    2.6    0.0000   0.0000          ?        ?  1640.3621  21.0712          ?        ?      405.0        2.6       ?       ? 
1 1 1   21   20   37 o    453.0    2.5    0.0000   0.0000          ?        ?  2052.2085  22.9868          ?        ?      453.0        2.5       ?       ? 
1 1 1   21   20   38 o    635.3    2.8    0.0000   0.0000          ?        ?  4036.7339  35.7572          ?        ?      635.3        2.8       ?       ? 
1 1 1   21   20   39 o     31.4   13.5    0.0000   0.0000          ?        ?    -1.2770  15.3245          ?        ?       31.4       13.5       ?       ? 
1 1 1   21   20   40 o    226.0    3.7    0.0000   0.0000          ?        ?   510.8173  16.6016          ?        ?      226.0        3.7       ?       ? 
1 1 1   21   20   41 o    571.1    2.6    0.0000   0.0000          ?        ?  3262.2070  30.0105          ?        ?      571.1        2.6       ?       ? 
1 1 1   21   20   42 o    300.0    3.0    0.0000   0.0000          ?        ?   900.3155  17.8786          ?        ?      300.0        3.0       ?       ? 
1 1 1   21   20   43 o    505.0    2.6    0.0000   0.0000          ?        ?  2550.8938  26.1794          ?        ?      505.0        2.6       ?       ? 
1 1 1   21   20   44 o    182.9    4.5    0.0000   0.0000          ?        ?   334.5853  16.6016          ?        ?      182.9        4.5       ?       ? 
1 1 1   21   20   45 o     26.2   12.7    0.0000   0.0000          ?        ?   -30.6490  19.7942          ?        ?       26.2       12.7       ?       ? 
1 1 1   21   20   46 o   1018.3    3.8    0.0000   0.0000          ?        ? 10374.0605  76.6226          ?        ?     1018.3        3.8       ?       ? 
1 1 1   21   20   47 o    484.0    3.0    0.0000   0.0000          ?        ?  2343.3743  28.7335          ?        ?      484.0        3.0       ?       ? 
1 1 1   21   20   48 o    185.3    4.8    0.0000   0.0000          ?        ?   343.5246  17.8786          ?        ?      185.3        4.8       ?       ? 
1 1 1   21   20   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   20   50 o     21.4   10.6    0.0000   0.0000          ?        ?   -37.6728  16.6016          ?        ?       21.4       10.6       ?       ? 
1 1 1   21   20   51 o    224.5    4.0    0.0000   0.0000          ?        ?   504.4321  17.8786          ?        ?      224.5        4.0       ?       ? 
1 1 1   21   20   52 o     37.1   14.8    0.0000   0.0000          ?        ?     7.0237  16.6016          ?        ?       37.1       14.8       ?       ? 
1 1 1   21   20   53 o    185.6    4.8    0.0000   0.0000          ?        ?   344.8017  17.8786          ?        ?      185.6        4.8       ?       ? 
1 1 1   21   20   54 o     26.3   12.4    0.0000   0.0000          ?        ?   -19.7942  17.2401          ?        ?       26.3       12.4       ?       ? 
1 1 1   21   20   55 o     61.8   15.1    0.0000   0.0000          ?        ?    40.2269  18.5171          ?        ?       61.8       15.1       ?       ? 
1 1 1   21   20   56 o     22.0   10.9    0.0000   0.0000          ?        ?   -45.3350  18.5171          ?        ?       22.0       10.9       ?       ? 
1 1 1   21   20   57 o    276.3    3.5    0.0000   0.0000          ?        ?   764.3104  19.1556          ?        ?      276.3        3.5       ?       ? 
1 1 1   21   20   58 o    231.0    4.4    0.0000   0.0000          ?        ?   534.4426  20.4327          ?        ?      231.0        4.4       ?       ? 
1 1 1   21   20   59 o     44.3   16.6    0.0000   0.0000          ?        ?    15.3245  19.7942          ?        ?       44.3       16.6       ?       ? 
1 1 1   21   20   60 o     22.5   11.2    0.0000   0.0000          ?        ?   -45.9736  19.1556          ?        ?       22.5       11.2       ?       ? 
1 1 1   21   20   61 o    370.1    3.1    0.0000   0.0000          ?        ?  1370.9059  22.9868          ?        ?      370.1        3.1       ?       ? 
1 1 1   21   20   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   20   63 o    329.9    3.3    0.0000   0.0000          ?        ?  1089.3180  21.7097          ?        ?      329.9        3.3       ?       ? 
1 1 1   21   20   64 f     19.6    9.9    0.0000   0.0000          ?        ?   -70.8759  19.7942          ?        ?       19.6        9.9       ?       ? 
1 1 1   21   20   65 o    229.8    4.6    0.0000   0.0000          ?        ?   529.3344  21.0712          ?        ?      229.8        4.6       ?       ? 
1 1 1   21   20   66 o     29.8   13.8    0.0000   0.0000          ?        ?   -16.6016  19.7942          ?        ?       29.8       13.8       ?       ? 
1 1 1   21   20   67 o    258.9    4.2    0.0000   0.0000          ?        ?   672.3633  21.7097          ?        ?      258.9        4.2       ?       ? 
1 1 1   21   20   68 o     24.1   11.9    0.0000   0.0000          ?        ?   -39.5883  19.7942          ?        ?       24.1       11.9       ?       ? 
1 1 1   21   20   69 o    197.3    5.3    0.0000   0.0000          ?        ?   391.4138  21.0712          ?        ?      197.3        5.3       ?       ? 
1 1 1   21   20   70 o    143.9    7.1    0.0000   0.0000          ?        ?   209.4351  20.4327          ?        ?      143.9        7.1       ?       ? 
1 1 1   21   21    0 o    553.6    7.8 3066.8193  86.2004  3066.8193  86.2004  3066.8193  86.2004      553.6      7.8      553.6        7.8     0.0     0.0 
1 1 1   21   21    1 o   1257.9    8.2 15827.0352 205.6040 15827.0352 205.6040 15827.0352 205.6040     1257.9      8.2     1257.9        8.2     0.0     0.0 
1 1 1   21   21    2 o   1461.7    8.6 21370.6797 251.5775 21370.6797 251.5775 21370.6797 251.5775     1461.7      8.6     1461.7        8.6     0.0     0.0 
1 1 1   21   21    3 o    295.9    6.3  876.6902  37.0343   876.6902  37.0343   876.6902  37.0343      295.9      6.3      295.9        6.3     0.0     0.0 
1 1 1   21   21    4 o   1049.8    6.2 11022.1602 130.2584 11022.1602 130.2584 11022.1602 130.2584     1049.8      6.2     1049.8        6.2     0.0     0.0 
1 1 1   21   21    5 o   1428.4    7.4 20406.5117 211.9892 20406.5117 211.9892 20406.5117 211.9892     1428.4      7.4     1428.4        7.4     0.0     0.0 
1 1 1   21   21    6 o   1037.2    5.7 10759.0898 118.1265 10759.0898 118.1265 10759.0898 118.1265     1037.2      5.7     1037.2        5.7     0.0     0.0 
1 1 1   21   21    7 o   1597.4    8.3 25524.2637 264.3480 25524.2637 264.3480 25524.2637 264.3480     1597.4      8.3     1597.4        8.3     0.0     0.0 
1 1 1   21   21    8 o    736.8    3.9 5429.9883  57.4669  5429.9883  57.4669  5429.9883  57.4669      736.8      3.9      736.8        3.9     0.0     0.0 
1 1 1   21   21    9 o   1137.5    5.6 12940.2793 127.0658 12940.2793 127.0658 12940.2793 127.0658     1137.5      5.6     1137.5        5.6     0.0     0.0 
1 1 1   21   21   10 o    362.2    2.9 1312.1620  21.0712  1312.1620  21.0712  1312.1620  21.0712      362.2      2.9      362.2        2.9     0.0     0.0 
1 1 1   21   21   11 o    601.8    3.7 3621.6948  44.6965  3621.6948  44.6965  3621.6948  44.6965      601.8      3.7      601.8        3.7     0.0     0.0 
1 1 1   21   21   12 o     17.1   11.8   -8.3008  12.7704    -8.3008  12.7704    -8.3008  12.7704       17.1     11.8       17.1       11.8     0.0     0.0 
1 1 1   21   21   13 o     64.9   12.0   45.9736  14.0475    45.9736  14.0475    45.9736  14.0475       64.9     12.0       64.9       12.0     0.0     0.0 
1 1 1   21   21   14 o   1401.9    6.7 19656.2500 187.7254 19656.2500 187.7254 19656.2500 187.7254     1401.9      6.7     1401.9        6.7     0.0     0.0 
1 1 1   21   21   15 o   1519.8    7.2 23102.9883 219.0129 23102.9883 219.0129 23102.9883 219.0129     1519.8      7.2     1519.8        7.2     0.0     0.0 
1 1 1   21   21   16 f    697.9    3.9 4871.9199  54.9129  4871.9199  54.9129  4871.9199  54.9129      697.9      3.9      697.9        3.9     0.0     0.0 
1 1 1   21   21   17 o    509.2    3.7 2593.0364  37.6728  2593.0364  37.6728  2593.0364  37.6728      509.2      3.7      509.2        3.7     0.0     0.0 
1 1 1   21   21   18 o   2399.1   11.4 57586.9883 549.1286 57586.9883 549.1286 57586.9883 549.1286     2399.1     11.4     2399.1       11.4     0.0     0.0 
1 1 1   21   21   19 o    843.8    4.5 7120.7930  75.9841  7120.7930  75.9841  7120.7930  75.9841      843.8      4.5      843.8        4.5     0.0     0.0 
1 1 1   21   21   20 o     83.9   17.7   79.1767  26.1794    79.1767  26.1794    79.1767  26.1794       83.9     17.7       83.9       17.7     0.0     0.0 
1 1 1   21   21   21 o    486.3    3.4 2365.7227  33.2031  2365.7227  33.2031  2365.7227  33.2031      486.3      3.4      486.3        3.4     0.0     0.0 
1 1 1   21   21   22 o    376.5    3.6 1418.1566  27.4564  1418.1566  27.4564  1418.1566  27.4564      376.5      3.6      376.5        3.6     0.0     0.0 
1 1 1   21   21   23 o     81.1   11.3   67.6833  17.8786    67.6833  17.8786    67.6833  17.8786       81.1     11.3       81.1       11.3     0.0     0.0 
1 1 1   21   21   24 o     70.6   13.7   54.9129  17.2401    54.9129  17.2401    54.9129  17.2401       70.6     13.7       70.6       13.7     0.0     0.0 
1 1 1   21   21   25 o    589.6    3.7 3476.7502  43.4195  3476.7502  43.4195  3476.7502  43.4195      589.6      3.7      589.6        3.7     0.0     0.0 
1 1 1   21   21   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   21   27 o    176.6    5.8  312.8756  20.4327   312.8756  20.4327   312.8756  20.4327      176.6      5.8      176.6        5.8     0.0     0.0 
1 1 1   21   21   28 o   1371.5    6.7 18815.9551 182.6172 18815.9551 182.6172 18815.9551 182.6172     1371.5      6.7     1371.5        6.7     0.0     0.0 
1 1 1   21   21   29 o    586.5    3.8 3440.3545  44.6965  3440.3545  44.6965  3440.3545  44.6965      586.5      3.8      586.5        3.8     0.0     0.0 
1 1 1   21   21   30 o    704.8    4.1 4968.9756  58.1055  4968.9756  58.1055  4968.9756  58.1055      704.8      4.1      704.8        4.1     0.0     0.0 
1 1 1   21   21   31 o    338.5    4.1 1146.1464  27.4564  1146.1464  27.4564  1146.1464  27.4564      338.5      4.1      338.5        4.1     0.0     0.0 
1 1 1   21   21   32 o    513.5    3.8 2637.0942  38.9498  2637.0942  38.9498  2637.0942  38.9498      513.5      3.8      513.5        3.8     0.0     0.0 
1 1 1   21   21   33 o     22.5   15.4  -10.2163  20.4327   -10.2163  20.4327   -10.2163  20.4327       22.5     15.4       22.5       15.4     0.0     0.0 
1 1 1   21   21   34 o    521.1    3.8 2716.2710  39.5883  2716.2710  39.5883  2716.2710  39.5883      521.1      3.8      521.1        3.8     0.0     0.0 
1 1 1   21   21   35 o    570.7    4.0 3258.3757  45.3350  3258.3757  45.3350  3258.3757  45.3350      570.7      4.0      570.7        4.0     0.0     0.0 
1 1 1   21   21   36 o    295.1    4.3  871.5820  25.5409   871.5820  25.5409   871.5820  25.5409      295.1      4.3      295.1        4.3     0.0     0.0 
1 1 1   21   21   37 o    258.7    4.6  669.8092  23.6253   669.8092  23.6253   669.8092  23.6253      258.7      4.6      258.7        4.6     0.0     0.0 
1 1 1   21   21   38 o    230.0    5.4  529.9730  24.9023   529.9730  24.9023   529.9730  24.9023      230.0      5.4      230.0        5.4     0.0     0.0 
1 1 1   21   21   39 o     25.4   16.9   -5.1082  22.3483    -5.1082  22.3483    -5.1082  22.3483       25.4     16.9       25.4       16.9     0.0     0.0 
1 1 1   21   21   40 o     17.5   12.7  -40.2269  22.3483   -40.2269  22.3483   -40.2269  22.3483       17.5     12.7       17.5       12.7     0.0     0.0 
1 1 1   21   21   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   21   42 o     15.8   11.6  -45.9736  21.0712   -45.9736  21.0712   -45.9736  21.0712       15.8     11.6       15.8       11.6     0.0     0.0 
1 1 1   21   21   43 o    201.5    5.9  407.3768  23.6253   407.3768  23.6253   407.3768  23.6253      201.5      5.9      201.5        5.9     0.0     0.0 
1 1 1   21   21   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   21   45 o     34.7   20.1   15.3245  22.3483    15.3245  22.3483    15.3245  22.3483       34.7     20.1       34.7       20.1     0.0     0.0 
1 1 1   21   21   46 o    477.1    4.1 2277.6067  38.9498  2277.6067  38.9498  2277.6067  38.9498      477.1      4.1      477.1        4.1     0.0     0.0 
1 1 1   21   21   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   21   48 o     36.6   21.2   17.2401  24.9023    17.2401  24.9023    17.2401  24.9023       36.6     21.2       36.6       21.2     0.0     0.0 
1 1 1   21   21   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   21   21   50 o    291.6    4.8  851.7878  28.0950   851.7878  28.0950   851.7878  28.0950      291.6      4.8      291.6        4.8     0.0     0.0 
1 1 1   21   21   51 o     14.1   10.6  -88.7545  24.9023   -88.7545  24.9023   -88.7545  24.9023       14.1     10.6       14.1       10.6     0.0     0.0 
1 1 1   21   21   52 o     17.2   12.6  -54.2743  24.9023   -54.2743  24.9023   -54.2743  24.9023       17.2     12.6       17.2       12.6     0.0     0.0 
1 1 1   21   21   53 o     20.9   14.8  -24.9023  23.6253   -24.9023  23.6253   -24.9023  23.6253       20.9     14.8       20.9       14.8     0.0     0.0 
1 1 1   21   21   54 o     70.1   20.5   60.6596  24.9023    60.6596  24.9023    60.6596  24.9023       70.1     20.5       70.1       20.5     0.0     0.0 
1 1 1   21   21   55 o     28.1   18.5   -2.5541  25.5409    -2.5541  25.5409    -2.5541  25.5409       28.1     18.5       28.1       18.5     0.0     0.0 
1 1 1   21   21   56 o     15.6   11.6  -81.7308  26.8179   -81.7308  26.8179   -81.7308  26.8179       15.6     11.6       15.6       11.6     0.0     0.0 
1 1 1   21   21   57 o    208.7    7.1  438.0258  29.3720   438.0258  29.3720   438.0258  29.3720      208.7      7.1      208.7        7.1     0.0     0.0 
1 1 1   21   21   58 o    257.8    5.8  666.6166  30.0105   666.6166  30.0105   666.6166  30.0105      257.8      5.8      257.8        5.8     0.0     0.0 
1 1 1   21   21   59 o    308.8    5.1  955.2284  31.2876   955.2284  31.2876   955.2284  31.2876      308.8      5.1      308.8        5.1     0.0     0.0 
1 1 1   21   21   60 o    454.3    4.3 2066.2561  38.9498  2066.2561  38.9498  2066.2561  38.9498      454.3      4.3      454.3        4.3     0.0     0.0 
1 1 1   21   21   61 o     18.0   13.3  -56.1899  26.8179   -56.1899  26.8179   -56.1899  26.8179       18.0     13.3       18.0       13.3     0.0     0.0 
1 1 1   21   21   62 o     74.6   22.2   69.5989  28.7335    69.5989  28.7335    69.5989  28.7335       74.6     22.2       74.6       22.2     0.0     0.0 
1 1 1   21   21   63 o     21.7   15.6  -35.1187  28.0950   -35.1187  28.0950   -35.1187  28.0950       21.7     15.6       21.7       15.6     0.0     0.0 
1 1 1   21   21   64 o     27.4   18.4   -7.6623  27.4564    -7.6623  27.4564    -7.6623  27.4564       27.4     18.4       27.4       18.4     0.0     0.0 
1 1 1   21   21   65 o     33.3   20.8    8.9393  27.4564     8.9393  27.4564     8.9393  27.4564       33.3     20.8       33.3       20.8     0.0     0.0 
1 1 1   21   21   66 o     24.2   16.9  -21.7097  28.0950   -21.7097  28.0950   -21.7097  28.0950       24.2     16.9       24.2       16.9     0.0     0.0 
1 1 1   21   21   67 o    106.4   13.8  116.8494  29.3720   116.8494  29.3720   116.8494  29.3720      106.4     13.8      106.4       13.8     0.0     0.0 
1 1 1   21   21   68 o    146.6    9.9  219.6514  28.7335   219.6514  28.7335   219.6514  28.7335      146.6      9.9      146.6        9.9     0.0     0.0 
1 1 1   21   21   69 o    167.4    8.0  284.1421  26.8179   284.1421  26.8179   284.1421  26.8179      167.4      8.0      167.4        8.0     0.0     0.0 
1 1 1   22    0    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    0    1 o    238.5    2.1  568.9227  10.2163   568.9227  10.2163   568.9227  10.2163      238.5      2.1      238.5        2.1     0.0     0.0 
1 1 1   22    0    2 o    935.6    4.6 8754.1318  86.8389  8754.1318  86.8389  8754.1318  86.8389      935.6      4.6      935.6        4.6     0.0     0.0 
1 1 1   22    0    3 o   1582.5    7.4 25047.9258 235.6145 25047.9258 235.6145 25047.9258 235.6145     1582.5      7.4     1582.5        7.4     0.0     0.0 
1 1 1   22    0    4 o    332.5    2.4 1105.9194  15.9630  1105.9194  15.9630  1105.9194  15.9630      332.5      2.4      332.5        2.4     0.0     0.0 
1 1 1   22    0    5 f    175.6    2.5  308.4059   8.9393   308.4059   8.9393   308.4059   8.9393      175.6      2.5      175.6        2.5     0.0     0.0 
1 1 1   22    0    6 o    614.6    3.3 3778.1326  40.8654  3778.1326  40.8654  3778.1326  40.8654      614.6      3.3      614.6        3.3     0.0     0.0 
1 1 1   22    0    7 o   1604.3    7.5 25741.3594 240.7227 25741.3594 240.7227 25741.3594 240.7227     1604.3      7.5     1604.3        7.5     0.0     0.0 
1 1 1   22    0    8 o    588.2    3.2 3460.1489  37.6728  3460.1489  37.6728  3460.1489  37.6728      588.2      3.2      588.2        3.2     0.0     0.0 
1 1 1   22    0    9 o    164.1    2.9  269.4561   9.5778   269.4561   9.5778   269.4561   9.5778      164.1      2.9      164.1        2.9     0.0     0.0 
1 1 1   22    0   10 f    356.0    2.5 1267.4655  17.8786  1267.4655  17.8786  1267.4655  17.8786      356.0      2.5      356.0        2.5     0.0     0.0 
1 1 1   22    0   11 o    518.6    3.0 2689.4531  30.6490  2689.4531  30.6490  2689.4531  30.6490      518.6      3.0      518.6        3.0     0.0     0.0 
1 1 1   22    0   12 o     10.6    7.8  -17.8786   8.9393   -17.8786   8.9393   -17.8786   8.9393       10.6      7.8       10.6        7.8     0.0     0.0 
1 1 1   22    0   13 o    446.0    2.9 1989.6334  25.5409  1989.6334  25.5409  1989.6334  25.5409      446.0      2.9      446.0        2.9     0.0     0.0 
1 1 1   22    0   14 o    596.0    3.3 3552.0957  39.5883  3552.0957  39.5883  3552.0957  39.5883      596.0      3.3      596.0        3.3     0.0     0.0 
1 1 1   22    0   15 o   1264.0    6.1 15979.0039 153.8837 15979.0039 153.8837 15979.0039 153.8837     1264.0      6.1     1264.0        6.1     0.0     0.0 
1 1 1   22    0   16 o   1109.8    5.4 12318.3594 120.6806 12318.3594 120.6806 12318.3594 120.6806     1109.8      5.4     1109.8        5.4     0.0     0.0 
1 1 1   22    0   17 o    294.5    3.8  867.7509  22.3483   867.7509  22.3483   867.7509  22.3483      294.5      3.8      294.5        3.8     0.0     0.0 
1 1 1   22    0   18 o    132.5    5.1  176.2320  13.4090   176.2320  13.4090   176.2320  13.4090      132.5      5.1      132.5        5.1     0.0     0.0 
1 1 1   22    0   19 o   2309.5   10.5 53351.0391 483.9994 53351.0391 483.9994 53351.0391 483.9994     2309.5     10.5     2309.5       10.5     0.0     0.0 
1 1 1   22    0   20 o    539.9    3.2 2915.4897  34.4802  2915.4897  34.4802  2915.4897  34.4802      539.9      3.2      539.9        3.2     0.0     0.0 
1 1 1   22    0   21 o   1321.5    6.6 17465.4824 173.6779 17465.4824 173.6779 17465.4824 173.6779     1321.5      6.6     1321.5        6.6     0.0     0.0 
1 1 1   22    0   22 o     61.2   13.1   42.1424  14.0475    42.1424  14.0475    42.1424  14.0475       61.2     13.1       61.2       13.1     0.0     0.0 
1 1 1   22    0   23 o   1594.1    7.5 25413.8008 239.4456 25413.8008 239.4456 25413.8008 239.4456     1594.1      7.5     1594.1        7.5     0.0     0.0 
1 1 1   22    0   24 o   1516.6    7.2 23004.6582 217.7359 23004.6582 217.7359 23004.6582 217.7359     1516.6      7.2     1516.6        7.2     0.0     0.0 
1 1 1   22    0   25 f   2223.2   10.2 49438.1758 452.7119 49438.1758 452.7119 49438.1758 452.7119     2223.2     10.2     2223.2       10.2     0.0     0.0 
1 1 1   22    0   26 o   1271.0    6.4 16155.8740 162.1845 16155.8740 162.1845 16155.8740 162.1845     1271.0      6.4     1271.0        6.4     0.0     0.0 
1 1 1   22    0   27 o    245.1    4.4  601.4874  21.7097   601.4874  21.7097   601.4874  21.7097      245.1      4.4      245.1        4.4     0.0     0.0 
1 1 1   22    0   28 o    597.5    3.6 3569.9744  42.7809  3569.9744  42.7809  3569.9744  42.7809      597.5      3.6      597.5        3.6     0.0     0.0 
1 1 1   22    0   29 o    530.9    3.9 2819.0730  41.5039  2819.0730  41.5039  2819.0730  41.5039      530.9      3.9      530.9        3.9     0.0     0.0 
1 1 1   22    0   30 o    463.0    3.2 2144.1555  29.3720  2144.1555  29.3720  2144.1555  29.3720      463.0      3.2      463.0        3.2     0.0     0.0 
1 1 1   22    0   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    0   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    0   33 o    256.2    4.5  657.0388  22.9868   657.0388  22.9868   657.0388  22.9868      256.2      4.5      256.2        4.5     0.0     0.0 
1 1 1   22    0   34 o    481.4    4.0 2317.8335  38.9498  2317.8335  38.9498  2317.8335  38.9498      481.4      4.0      481.4        4.0     0.0     0.0 
1 1 1   22    0   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    0   36 o    391.2    3.6 1530.5364  28.0950  1530.5364  28.0950  1530.5364  28.0950      391.2      3.6      391.2        3.6     0.0     0.0 
1 1 1   22    0   37 o    737.0    4.4 5432.5420  64.4907  5432.5420  64.4907  5432.5420  64.4907      737.0      4.4      737.0        4.4     0.0     0.0 
1 1 1   22    0   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    0   39 o    965.5    5.2 9324.3320 100.8864  9324.3320 100.8864  9324.3320 100.8864      965.5      5.2      965.5        5.2     0.0     0.0 
1 1 1   22    0   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    0   41 o    645.7    4.2 4170.1846  53.6358  4170.1846  53.6358  4170.1846  53.6358      645.7      4.2      645.7        4.2     0.0     0.0 
1 1 1   22    0   42 o    255.1    5.4  651.9305  27.4564   651.9305  27.4564   651.9305  27.4564      255.1      5.4      255.1        5.4     0.0     0.0 
1 1 1   22    0   43 o    313.4    4.4  982.6848  27.4564   982.6848  27.4564   982.6848  27.4564      313.4      4.4      313.4        4.4     0.0     0.0 
1 1 1   22    0   44 o    652.6    4.0 4260.2163  51.7203  4260.2163  51.7203  4260.2163  51.7203      652.6      4.0      652.6        4.0     0.0     0.0 
1 1 1   22    0   45 o    132.9   10.5  180.0631  27.4564   180.0631  27.4564   180.0631  27.4564      132.9     10.5      132.9       10.5     0.0     0.0 
1 1 1   22    0   46 o    175.9    6.7  310.9600  23.6253   310.9600  23.6253   310.9600  23.6253      175.9      6.7      175.9        6.7     0.0     0.0 
1 1 1   22    0   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    0   48 o    229.9    6.0  529.9730  27.4564   529.9730  27.4564   529.9730  27.4564      229.9      6.0      229.9        6.0     0.0     0.0 
1 1 1   22    0   49 o    510.8    3.9 2609.6379  40.2269  2609.6379  40.2269  2609.6379  40.2269      510.8      3.9      510.8        3.9     0.0     0.0 
1 1 1   22    0   50 o    368.0    4.3 1354.9429  31.2876  1354.9429  31.2876  1354.9429  31.2876      368.0      4.3      368.0        4.3     0.0     0.0 
1 1 1   22    0   51 o    583.8    3.9 3409.0671  45.3350  3409.0671  45.3350  3409.0671  45.3350      583.8      3.9      583.8        3.9     0.0     0.0 
1 1 1   22    0   52 o    245.0    5.6  601.4874  27.4564   601.4874  27.4564   601.4874  27.4564      245.0      5.6      245.0        5.6     0.0     0.0 
1 1 1   22    0   53 o     43.5   22.0   28.0950  23.6253    28.0950  23.6253    28.0950  23.6253       43.5     22.0       43.5       22.0     0.0     0.0 
1 1 1   22    0   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    0   55 o    373.3    3.9 1394.5312  29.3720  1394.5312  29.3720  1394.5312  29.3720      373.3      3.9      373.3        3.9     0.0     0.0 
1 1 1   22    0   56 o    308.8    4.3  954.5898  26.8179   954.5898  26.8179   954.5898  26.8179      308.8      4.3      308.8        4.3     0.0     0.0 
1 1 1   22    0   57 o     18.9   13.7  -44.0580  25.5409   -44.0580  25.5409   -44.0580  25.5409       18.9     13.7       18.9       13.7     0.0     0.0 
1 1 1   22    0   58 o     76.0   19.5   68.3218  25.5409    68.3218  25.5409    68.3218  25.5409       76.0     19.5       76.0       19.5     0.0     0.0 
1 1 1   22    0   59 o    248.1    5.4  616.8119  26.8179   616.8119  26.8179   616.8119  26.8179      248.1      5.4      248.1        5.4     0.0     0.0 
1 1 1   22    0   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    0   61 o    153.7    8.4  238.8071  25.5409   238.8071  25.5409   238.8071  25.5409      153.7      8.4      153.7        8.4     0.0     0.0 
1 1 1   22    0   62 o    301.7    4.9  911.8089  29.3720   911.8089  29.3720   911.8089  29.3720      301.7      4.9      301.7        4.9     0.0     0.0 
1 1 1   22    0   63 o     85.7   18.8   83.6463  28.0950    83.6463  28.0950    83.6463  28.0950       85.7     18.8       85.7       18.8     0.0     0.0 
1 1 1   22    0   64 o     19.0   13.9  -51.7203  27.4564   -51.7203  27.4564   -51.7203  27.4564       19.0     13.9       19.0       13.9     0.0     0.0 
1 1 1   22    0   65 o    101.8   15.0  108.5487  29.3720   108.5487  29.3720   108.5487  29.3720      101.8     15.0      101.8       15.0     0.0     0.0 
1 1 1   22    0   66 o    227.1    6.6  517.8410  30.0105   517.8410  30.0105   517.8410  30.0105      227.1      6.6      227.1        6.6     0.0     0.0 
1 1 1   22    0   67 o    112.0   13.4  131.5355  29.3720   131.5355  29.3720   131.5355  29.3720      112.0     13.4      112.0       13.4     0.0     0.0 
1 1 1   22    0   68 o     17.4   12.8  -58.7440  26.1794   -58.7440  26.1794   -58.7440  26.1794       17.4     12.8       17.4       12.8     0.0     0.0 
1 1 1   22    0   69 o     44.3   24.2   28.7335  30.0105    28.7335  30.0105    28.7335  30.0105       44.3     24.2       44.3       24.2     0.0     0.0 
1 1 1   22    0   70 o     17.4   12.9  -80.4537  30.0105   -80.4537  30.0105   -80.4537  30.0105       17.4     12.9       17.4       12.9     0.0     0.0 
1 1 1   22    0   71 o     64.2   23.7   56.1899  28.0950    56.1899  28.0950    56.1899  28.0950       64.2     23.7       64.2       23.7     0.0     0.0 
1 1 1   22    0   72 o     32.0   20.8    1.2770  30.6490     1.2770  30.6490     1.2770  30.6490       32.0     20.8       32.0       20.8     0.0     0.0 
1 1 1   22    0   73 o     50.4   25.8   38.9498  32.5646    38.9498  32.5646    38.9498  32.5646       50.4     25.8       50.4       25.8     0.0     0.0 
1 1 1   22    0   74 o     24.9   17.3  -18.5171  28.0950   -18.5171  28.0950   -18.5171  28.0950       24.9     17.3       24.9       17.3     0.0     0.0 
1 1 1   22    0   75 f     39.1   23.0   19.7942  30.0105    19.7942  30.0105    19.7942  30.0105       39.1     23.0       39.1       23.0     0.0     0.0 
1 1 1   22    0   76 o     35.5   22.0   12.1319  30.0105    12.1319  30.0105    12.1319  30.0105       35.5     22.0       35.5       22.0     0.0     0.0 
1 1 1   22    0   77 o    242.5    6.1  591.2710  29.3720   591.2710  29.3720   591.2710  29.3720      242.5      6.1      242.5        6.1     0.0     0.0 
1 1 1   22    0   78 o     18.4   13.5  -61.9366  28.7335   -61.9366  28.7335   -61.9366  28.7335       18.4     13.5       18.4       13.5     0.0     0.0 
1 1 1   22    1    0 o    219.5    2.3  482.0838  10.2163   482.0838  10.2163   482.0838  10.2163      219.5      2.3      219.5        2.3     0.0     0.0 
1 1 1   22    1    1 o    510.0    2.1    0.0000   0.0000          ?        ?  2601.3372  21.7097          ?        ?      510.0        2.1       ?       ? 
1 1 1   22    1    2 o    178.7    1.8    0.0000   0.0000          ?        ?   319.2608   6.3852          ?        ?      178.7        1.8       ?       ? 
1 1 1   22    1    3 o   1373.5    4.6    0.0000   0.0000          ?        ? 18867.0371 127.0658          ?        ?     1373.5        4.6       ?       ? 
1 1 1   22    1    4 o    953.7    3.4    0.0000   0.0000          ?        ?  9095.7402  64.4907          ?        ?      953.7        3.4       ?       ? 
1 1 1   22    1    5 o    668.0    2.5    0.0000   0.0000          ?        ?  4461.9893  33.8416          ?        ?      668.0        2.5       ?       ? 
1 1 1   22    1    6 f    351.5    1.8    0.0000   0.0000          ?        ?  1235.5393  12.7704          ?        ?      351.5        1.8       ?       ? 
1 1 1   22    1    7 o    450.5    2.0    0.0000   0.0000          ?        ?  2029.8602  17.8786          ?        ?      450.5        2.0       ?       ? 
1 1 1   22    1    8 o    682.8    2.6    0.0000   0.0000          ?        ?  4661.8462  35.1187          ?        ?      682.8        2.6       ?       ? 
1 1 1   22    1    9 o    300.6    1.7    0.0000   0.0000          ?        ?   903.5081  10.2163          ?        ?      300.6        1.7       ?       ? 
1 1 1   22    1   10 o   1114.1    3.8    0.0000   0.0000          ?        ? 12412.2217  85.5619          ?        ?     1114.1        3.8       ?       ? 
1 1 1   22    1   11 o    210.8    2.0    0.0000   0.0000          ?        ?   444.4110   8.3008          ?        ?      210.8        2.0       ?       ? 
1 1 1   22    1   12 o    451.4    2.0    0.0000   0.0000          ?        ?  2037.5226  17.8786          ?        ?      451.4        2.0       ?       ? 
1 1 1   22    1   13 o   1767.7    5.8    0.0000   0.0000          ?        ? 31251.8027 204.9654          ?        ?     1767.7        5.8       ?       ? 
1 1 1   22    1   14 o   1025.6    3.6    0.0000   0.0000          ?        ? 10519.0059  73.4300          ?        ?     1025.6        3.6       ?       ? 
1 1 1   22    1   15 o    598.6    2.4    0.0000   0.0000          ?        ?  3583.3835  28.7335          ?        ?      598.6        2.4       ?       ? 
1 1 1   22    1   16 o    475.9    2.2    0.0000   0.0000          ?        ?  2264.8362  21.0712          ?        ?      475.9        2.2       ?       ? 
1 1 1   22    1   17 o   1288.0    4.5    0.0000   0.0000          ?        ? 16591.3457 114.9339          ?        ?     1288.0        4.5       ?       ? 
1 1 1   22    1   18 o   1224.7    4.2    0.0000   0.0000          ?        ? 14998.8730 102.8020          ?        ?     1224.7        4.2       ?       ? 
1 1 1   22    1   19 o    920.5    3.3    0.0000   0.0000          ?        ?  8473.1816  60.0210          ?        ?      920.5        3.3       ?       ? 
1 1 1   22    1   20 o   1313.4    4.5    0.0000   0.0000          ?        ? 17250.9375 119.4035          ?        ?     1313.4        4.5       ?       ? 
1 1 1   22    1   21 o    910.4    3.4    0.0000   0.0000          ?        ?  8288.6494  62.5751          ?        ?      910.4        3.4       ?       ? 
1 1 1   22    1   22 o   1352.2    4.6    0.0000   0.0000          ?        ? 18286.6211 123.8732          ?        ?     1352.2        4.6       ?       ? 
1 1 1   22    1   23 o    908.8    3.4    0.0000   0.0000          ?        ?  8259.2773  61.2981          ?        ?      908.8        3.4       ?       ? 
1 1 1   22    1   24 o    702.0    2.8    0.0000   0.0000          ?        ?  4928.7485  38.9498          ?        ?      702.0        2.8       ?       ? 
1 1 1   22    1   25 o    963.2    3.5    0.0000   0.0000          ?        ?  9277.7188  68.3218          ?        ?      963.2        3.5       ?       ? 
1 1 1   22    1   26 o    892.9    3.3    0.0000   0.0000          ?        ?  7973.8584  59.3825          ?        ?      892.9        3.3       ?       ? 
1 1 1   22    1   27 o   1290.9    4.6    0.0000   0.0000          ?        ? 16665.4141 118.7650          ?        ?     1290.9        4.6       ?       ? 
1 1 1   22    1   28 o    275.9    2.8    0.0000   0.0000          ?        ?   761.1177  15.3245          ?        ?      275.9        2.8       ?       ? 
1 1 1   22    1   29 o    878.9    3.4    0.0000   0.0000          ?        ?  7724.8350  59.3825          ?        ?      878.9        3.4       ?       ? 
1 1 1   22    1   30 o    737.6    2.9    0.0000   0.0000          ?        ?  5440.2041  43.4195          ?        ?      737.6        2.9       ?       ? 
1 1 1   22    1   31 o    242.1    3.2    0.0000   0.0000          ?        ?   586.1629  15.3245          ?        ?      242.1        3.2       ?       ? 
1 1 1   22    1   32 o    302.9    2.8    0.0000   0.0000          ?        ?   917.5555  17.2401          ?        ?      302.9        2.8       ?       ? 
1 1 1   22    1   33 o    291.5    2.6    0.0000   0.0000          ?        ?   849.8723  15.3245          ?        ?      291.5        2.6       ?       ? 
1 1 1   22    1   34 o   1178.9    4.3    0.0000   0.0000          ?        ? 13899.9766 100.2479          ?        ?     1178.9        4.3       ?       ? 
1 1 1   22    1   35 o    921.5    3.6    0.0000   0.0000          ?        ?  8491.6992  65.7677          ?        ?      921.5        3.6       ?       ? 
1 1 1   22    1   36 o   1628.6    5.4    0.0000   0.0000          ?        ? 26528.6602 176.2320          ?        ?     1628.6        5.4       ?       ? 
1 1 1   22    1   37 o    688.6    3.0    0.0000   0.0000          ?        ?  4742.3003  41.5039          ?        ?      688.6        3.0       ?       ? 
1 1 1   22    1   38 o    826.2    3.1    0.0000   0.0000          ?        ?  6825.7964  51.7203          ?        ?      826.2        3.1       ?       ? 
1 1 1   22    1   39 o    741.8    3.1    0.0000   0.0000          ?        ?  5503.4180  46.6121          ?        ?      741.8        3.1       ?       ? 
1 1 1   22    1   40 o    366.5    2.8    0.0000   0.0000          ?        ?  1343.4495  20.4327          ?        ?      366.5        2.8       ?       ? 
1 1 1   22    1   41 o    278.4    3.3    0.0000   0.0000          ?        ?   775.1653  18.5171          ?        ?      278.4        3.3       ?       ? 
1 1 1   22    1   42 o    700.6    3.2    0.0000   0.0000          ?        ?  4908.3159  44.6965          ?        ?      700.6        3.2       ?       ? 
1 1 1   22    1   43 o    991.5    3.6    0.0000   0.0000          ?        ?  9832.5947  71.5144          ?        ?      991.5        3.6       ?       ? 
1 1 1   22    1   44 o    524.2    2.7    0.0000   0.0000          ?        ?  2748.1970  28.7335          ?        ?      524.2        2.7       ?       ? 
1 1 1   22    1   45 o    395.1    2.8    0.0000   0.0000          ?        ?  1561.1854  22.3483          ?        ?      395.1        2.8       ?       ? 
1 1 1   22    1   46 o    779.5    3.1    0.0000   0.0000          ?        ?  6076.8105  47.8891          ?        ?      779.5        3.1       ?       ? 
1 1 1   22    1   47 o    180.6    5.1    0.0000   0.0000          ?        ?   326.2845  18.5171          ?        ?      180.6        5.1       ?       ? 
1 1 1   22    1   48 o    544.0    2.7    0.0000   0.0000          ?        ?  2959.5479  29.3720          ?        ?      544.0        2.7       ?       ? 
1 1 1   22    1   49 o    543.6    2.6    0.0000   0.0000          ?        ?  2955.0781  28.7335          ?        ?      543.6        2.6       ?       ? 
1 1 1   22    1   50 o    497.6    2.6    0.0000   0.0000          ?        ?  2476.8254  26.1794          ?        ?      497.6        2.6       ?       ? 
1 1 1   22    1   51 o    676.7    2.8    0.0000   0.0000          ?        ?  4580.1157  38.3113          ?        ?      676.7        2.8       ?       ? 
1 1 1   22    1   52 o    285.5    3.2    0.0000   0.0000          ?        ?   815.3921  18.5171          ?        ?      285.5        3.2       ?       ? 
1 1 1   22    1   53 o    186.5    4.8    0.0000   0.0000          ?        ?   347.9943  17.8786          ?        ?      186.5        4.8       ?       ? 
1 1 1   22    1   54 f    281.0    3.5    0.0000   0.0000          ?        ?   789.8513  19.7942          ?        ?      281.0        3.5       ?       ? 
1 1 1   22    1   55 o    245.5    3.8    0.0000   0.0000          ?        ?   602.7644  18.5171          ?        ?      245.5        3.8       ?       ? 
1 1 1   22    1   56 o     26.0   12.4    0.0000   0.0000          ?        ?   -23.6253  17.8786          ?        ?       26.0       12.4       ?       ? 
1 1 1   22    1   57 o    240.6    3.7    0.0000   0.0000          ?        ?   579.1391  17.8786          ?        ?      240.6        3.7       ?       ? 
1 1 1   22    1   58 o    438.0    2.7    0.0000   0.0000          ?        ?  1919.3960  23.6253          ?        ?      438.0        2.7       ?       ? 
1 1 1   22    1   59 o     66.7   14.3    0.0000   0.0000          ?        ?    46.6121  18.5171          ?        ?       66.7       14.3       ?       ? 
1 1 1   22    1   60 o     21.6   10.7    0.0000   0.0000          ?        ?   -47.8891  18.5171          ?        ?       21.6       10.7       ?       ? 
1 1 1   22    1   61 o    169.6    5.5    0.0000   0.0000          ?        ?   287.9732  18.5171          ?        ?      169.6        5.5       ?       ? 
1 1 1   22    1   62 o     45.3   16.2    0.0000   0.0000          ?        ?    17.8786  18.5171          ?        ?       45.3       16.2       ?       ? 
1 1 1   22    1   63 o     30.4   14.0    0.0000   0.0000          ?        ?   -15.3245  19.7942          ?        ?       30.4       14.0       ?       ? 
1 1 1   22    1   64 o    346.8    3.3    0.0000   0.0000          ?        ?  1203.6133  22.9868          ?        ?      346.8        3.3       ?       ? 
1 1 1   22    1   65 f    256.9    4.1    0.0000   0.0000          ?        ?   660.8699  21.0712          ?        ?      256.9        4.1       ?       ? 
1 1 1   22    1   66 o    354.6    3.3    0.0000   0.0000          ?        ?  1258.5261  23.6253          ?        ?      354.6        3.3       ?       ? 
1 1 1   22    1   67 o     71.2   15.7    0.0000   0.0000          ?        ?    53.6358  21.7097          ?        ?       71.2       15.7       ?       ? 
1 1 1   22    1   68 f    194.2    5.4    0.0000   0.0000          ?        ?   378.0048  21.0712          ?        ?      194.2        5.4       ?       ? 
1 1 1   22    1   69 o     30.4   14.2    0.0000   0.0000          ?        ?   -19.1556  21.0712          ?        ?       30.4       14.2       ?       ? 
1 1 1   22    1   70 o    183.0    5.9    0.0000   0.0000          ?        ?   335.8624  21.7097          ?        ?      183.0        5.9       ?       ? 
1 1 1   22    1   71 o    138.9    7.6    0.0000   0.0000          ?        ?   194.1106  21.0712          ?        ?      138.9        7.6       ?       ? 
1 1 1   22    1   72 o     74.1   14.7    0.0000   0.0000          ?        ?    58.1055  21.0712          ?        ?       74.1       14.7       ?       ? 
1 1 1   22    1   73 o    167.6    6.3    0.0000   0.0000          ?        ?   282.2266  21.0712          ?        ?      167.6        6.3       ?       ? 
1 1 1   22    1   74 f    133.2    7.9    0.0000   0.0000          ?        ?   178.7861  21.0712          ?        ?      133.2        7.9       ?       ? 
1 1 1   22    1   75 o    167.3    6.1    0.0000   0.0000          ?        ?   281.5880  20.4327          ?        ?      167.3        6.1       ?       ? 
1 1 1   22    1   76 o    188.6    5.8    0.0000   0.0000          ?        ?   357.5721  21.7097          ?        ?      188.6        5.8       ?       ? 
1 1 1   22    1   77 o     41.0   16.6    0.0000   0.0000          ?        ?     8.9393  21.0712          ?        ?       41.0       16.6       ?       ? 
1 1 1   22    2    0 o    519.1    3.0 2694.5613  31.2876  2694.5613  31.2876  2694.5613  31.2876      519.1      3.0      519.1        3.0     0.0     0.0 
1 1 1   22    2    1 o    351.0    1.8    0.0000   0.0000          ?        ?  1232.3467  12.7704          ?        ?      351.0        1.8       ?       ? 
1 1 1   22    2    2 o    463.3    2.1    0.0000   0.0000          ?        ?  2146.7097  19.1556          ?        ?      463.3        2.1       ?       ? 
1 1 1   22    2    3 o   1034.6    3.6    0.0000   0.0000          ?        ? 10705.4531  75.3456          ?        ?     1034.6        3.6       ?       ? 
1 1 1   22    2    4 o    893.1    3.2    0.0000   0.0000          ?        ?  7976.4116  56.8284          ?        ?      893.1        3.2       ?       ? 
1 1 1   22    2    5 o    950.5    3.4    0.0000   0.0000          ?        ?  9035.0811  63.8522          ?        ?      950.5        3.4       ?       ? 
1 1 1   22    2    6 o    465.0    2.1    0.0000   0.0000          ?        ?  2162.6729  19.1556          ?        ?      465.0        2.1       ?       ? 
1 1 1   22    2    7 o   1912.4    6.3    0.0000   0.0000          ?        ? 36577.7109 240.0841          ?        ?     1912.4        6.3       ?       ? 
1 1 1   22    2    8 o    742.7    2.8    0.0000   0.0000          ?        ?  5516.1885  41.5039          ?        ?      742.7        2.8       ?       ? 
1 1 1   22    2    9 o    236.2    1.8    0.0000   0.0000          ?        ?   558.0679   8.3008          ?        ?      236.2        1.8       ?       ? 
1 1 1   22    2   10 o    353.5    1.9    0.0000   0.0000          ?        ?  1249.5868  13.4090          ?        ?      353.5        1.9       ?       ? 
1 1 1   22    2   11 o    946.9    3.3    0.0000   0.0000          ?        ?  8967.3975  63.2136          ?        ?      946.9        3.3       ?       ? 
1 1 1   22    2   12 o    995.9    3.5    0.0000   0.0000          ?        ?  9919.4336  68.9603          ?        ?      995.9        3.5       ?       ? 
1 1 1   22    2   13 o   1948.8    6.4    0.0000   0.0000          ?        ? 37983.0977 247.7464          ?        ?     1948.8        6.4       ?       ? 
1 1 1   22    2   14 o    337.6    2.1    0.0000   0.0000          ?        ?  1139.7611  14.0475          ?        ?      337.6        2.1       ?       ? 
1 1 1   22    2   15 f   1058.3    4.0    0.0000   0.0000          ?        ? 11200.3076  83.6463          ?        ?     1058.3        4.0       ?       ? 
1 1 1   22    2   16 o   1310.0    4.6    0.0000   0.0000          ?        ? 17162.8223 119.4035          ?        ?     1310.0        4.6       ?       ? 
1 1 1   22    2   17 o   1644.3    5.4    0.0000   0.0000          ?        ? 27040.1133 177.5090          ?        ?     1644.3        5.4       ?       ? 
1 1 1   22    2   18 o   1113.3    3.8    0.0000   0.0000          ?        ? 12394.3428  85.5619          ?        ?     1113.3        3.8       ?       ? 
1 1 1   22    2   19 o    465.3    2.3    0.0000   0.0000          ?        ?  2165.2268  21.0712          ?        ?      465.3        2.3       ?       ? 
1 1 1   22    2   20 o    916.3    3.4    0.0000   0.0000          ?        ?  8397.1973  62.5751          ?        ?      916.3        3.4       ?       ? 
1 1 1   22    2   21 o     29.2   11.9    0.0000   0.0000          ?        ?     3.1926  10.8549          ?        ?       29.2       11.9       ?       ? 
1 1 1   22    2   22 o    856.4    3.1    0.0000   0.0000          ?        ?  7334.0591  52.9973          ?        ?      856.4        3.1       ?       ? 
1 1 1   22    2   23 o    431.6    2.3    0.0000   0.0000          ?        ?  1862.5676  19.7942          ?        ?      431.6        2.3       ?       ? 
1 1 1   22    2   24 o   1127.3    4.0    0.0000   0.0000          ?        ? 12709.1348  90.6701          ?        ?     1127.3        4.0       ?       ? 
1 1 1   22    2   25 o   1418.0    4.8    0.0000   0.0000          ?        ? 20108.9609 136.6436          ?        ?     1418.0        4.8       ?       ? 
1 1 1   22    2   26 o    726.1    2.8    0.0000   0.0000          ?        ?  5272.2729  40.8654          ?        ?      726.1        2.8       ?       ? 
1 1 1   22    2   27 f   1367.5    4.6    0.0000   0.0000          ?        ? 18701.0215 127.0658          ?        ?     1367.5        4.6       ?       ? 
1 1 1   22    2   28 o   1489.0    5.3    0.0000   0.0000          ?        ? 22173.9395 158.3534          ?        ?     1489.0        5.3       ?       ? 
1 1 1   22    2   29 o    519.7    2.5    0.0000   0.0000          ?        ?  2700.9465  25.5409          ?        ?      519.7        2.5       ?       ? 
1 1 1   22    2   30 o    281.8    2.8    0.0000   0.0000          ?        ?   794.3209  15.9630          ?        ?      281.8        2.8       ?       ? 
1 1 1   22    2   31 o    166.3    4.4    0.0000   0.0000          ?        ?   276.4799  14.6860          ?        ?      166.3        4.4       ?       ? 
1 1 1   22    2   32 o    969.7    3.6    0.0000   0.0000          ?        ?  9403.5078  70.2374          ?        ?      969.7        3.6       ?       ? 
1 1 1   22    2   33 o    282.1    2.8    0.0000   0.0000          ?        ?   795.5980  15.9630          ?        ?      282.1        2.8       ?       ? 
1 1 1   22    2   34 o    122.5    6.3    0.0000   0.0000          ?        ?   150.0526  15.3245          ?        ?      122.5        6.3       ?       ? 
1 1 1   22    2   35 o    422.2    2.6    0.0000   0.0000          ?        ?  1782.7524  22.3483          ?        ?      422.2        2.6       ?       ? 
1 1 1   22    2   36 o    377.8    2.6    0.0000   0.0000          ?        ?  1427.0958  19.7942          ?        ?      377.8        2.6       ?       ? 
1 1 1   22    2   37 o    317.3    3.1    0.0000   0.0000          ?        ?  1006.9486  19.7942          ?        ?      317.3        3.1       ?       ? 
1 1 1   22    2   38 o    681.8    2.8    0.0000   0.0000          ?        ?  4648.4375  38.3113          ?        ?      681.8        2.8       ?       ? 
1 1 1   22    2   39 o   1233.0    4.2    0.0000   0.0000          ?        ? 15203.8389 104.7175          ?        ?     1233.0        4.2       ?       ? 
1 1 1   22    2   40 o    819.4    3.2    0.0000   0.0000          ?        ?  6714.6934  51.7203          ?        ?      819.4        3.2       ?       ? 
1 1 1   22    2   41 o   1382.5    4.9    0.0000   0.0000          ?        ? 19116.0605 136.0051          ?        ?     1382.5        4.9       ?       ? 
1 1 1   22    2   42 o    544.9    2.8    0.0000   0.0000          ?        ?  2969.7642  30.0105          ?        ?      544.9        2.8       ?       ? 
1 1 1   22    2   43 o    565.2    2.8    0.0000   0.0000          ?        ?  3195.1621  31.2876          ?        ?      565.2        2.8       ?       ? 
1 1 1   22    2   44 f    333.0    3.6    0.0000   0.0000          ?        ?  1109.1121  24.2638          ?        ?      333.0        3.6       ?       ? 
1 1 1   22    2   45 o    462.5    2.6    0.0000   0.0000          ?        ?  2139.0474  24.2638          ?        ?      462.5        2.6       ?       ? 
1 1 1   22    2   46 o    862.2    3.3    0.0000   0.0000          ?        ?  7434.3076  56.1899          ?        ?      862.2        3.3       ?       ? 
1 1 1   22    2   47 o    679.9    3.0    0.0000   0.0000          ?        ?  4622.8965  40.2269          ?        ?      679.9        3.0       ?       ? 
1 1 1   22    2   48 o    518.3    2.6    0.0000   0.0000          ?        ?  2686.2605  27.4564          ?        ?      518.3        2.6       ?       ? 
1 1 1   22    2   49 o    596.0    2.7    0.0000   0.0000          ?        ?  3552.7344  32.5646          ?        ?      596.0        2.7       ?       ? 
1 1 1   22    2   50 o    342.2    2.9    0.0000   0.0000          ?        ?  1171.0486  19.7942          ?        ?      342.2        2.9       ?       ? 
1 1 1   22    2   51 f    290.5    3.3    0.0000   0.0000          ?        ?   844.1255  19.1556          ?        ?      290.5        3.3       ?       ? 
1 1 1   22    2   52 o    230.2    3.7    0.0000   0.0000          ?        ?   529.9730  17.2401          ?        ?      230.2        3.7       ?       ? 
1 1 1   22    2   53 o    272.5    3.5    0.0000   0.0000          ?        ?   742.6006  19.1556          ?        ?      272.5        3.5       ?       ? 
1 1 1   22    2   54 f    120.6    7.1    0.0000   0.0000          ?        ?   145.5829  17.2401          ?        ?      120.6        7.1       ?       ? 
1 1 1   22    2   55 o    160.5    5.8    0.0000   0.0000          ?        ?   257.9627  18.5171          ?        ?      160.5        5.8       ?       ? 
1 1 1   22    2   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    2   57 f    422.2    2.8    0.0000   0.0000          ?        ?  1783.3909  23.6253          ?        ?      422.2        2.8       ?       ? 
1 1 1   22    2   58 o    586.8    2.7    0.0000   0.0000          ?        ?  3444.8242  31.9261          ?        ?      586.8        2.7       ?       ? 
1 1 1   22    2   59 o    188.1    5.1    0.0000   0.0000          ?        ?   354.3795  19.1556          ?        ?      188.1        5.1       ?       ? 
1 1 1   22    2   60 o     89.8   10.7    0.0000   0.0000          ?        ?    81.0922  19.1556          ?        ?       89.8       10.7       ?       ? 
1 1 1   22    2   61 o    253.9    3.8    0.0000   0.0000          ?        ?   644.9069  19.1556          ?        ?      253.9        3.8       ?       ? 
1 1 1   22    2   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    2   63 o    254.0    4.0    0.0000   0.0000          ?        ?   645.5453  20.4327          ?        ?      254.0        4.0       ?       ? 
1 1 1   22    2   64 o    289.3    3.4    0.0000   0.0000          ?        ?   837.7404  19.7942          ?        ?      289.3        3.4       ?       ? 
1 1 1   22    2   65 o    285.4    3.8    0.0000   0.0000          ?        ?   815.3921  21.7097          ?        ?      285.4        3.8       ?       ? 
1 1 1   22    2   66 o    132.9    7.9    0.0000   0.0000          ?        ?   177.5090  21.0712          ?        ?      132.9        7.9       ?       ? 
1 1 1   22    2   67 o    238.3    4.4    0.0000   0.0000          ?        ?   568.9227  21.0712          ?        ?      238.3        4.4       ?       ? 
1 1 1   22    2   68 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    2   69 o    171.1    6.2    0.0000   0.0000          ?        ?   293.7199  21.0712          ?        ?      171.1        6.2       ?       ? 
1 1 1   22    2   70 o    141.8    8.1    0.0000   0.0000          ?        ?   202.4114  22.9868          ?        ?      141.8        8.1       ?       ? 
1 1 1   22    2   71 o     29.4   13.8    0.0000   0.0000          ?        ?   -22.3483  21.0712          ?        ?       29.4       13.8       ?       ? 
1 1 1   22    2   72 f    176.3    6.3    0.0000   0.0000          ?        ?   312.2371  22.3483          ?        ?      176.3        6.3       ?       ? 
1 1 1   22    2   73 o     46.3   17.4    0.0000   0.0000          ?        ?    17.2401  21.7097          ?        ?       46.3       17.4       ?       ? 
1 1 1   22    2   74 o     91.3   11.5    0.0000   0.0000          ?        ?    84.9234  21.0712          ?        ?       91.3       11.5       ?       ? 
1 1 1   22    2   75 o     38.6   16.4    0.0000   0.0000          ?        ?     1.2770  22.3483          ?        ?       38.6       16.4       ?       ? 
1 1 1   22    2   76 o     95.2   11.1    0.0000   0.0000          ?        ?    92.5856  21.0712          ?        ?       95.2       11.1       ?       ? 
1 1 1   22    2   77 o    111.9    8.8    0.0000   0.0000          ?        ?   127.0658  19.7942          ?        ?      111.9        8.8       ?       ? 
1 1 1   22    3    0 o    135.5    2.8  183.8942   7.6623   183.8942   7.6623   183.8942   7.6623      135.5      2.8      135.5        2.8     0.0     0.0 
1 1 1   22    3    1 o   1033.6    3.6    0.0000   0.0000          ?        ? 10683.7432  74.0685          ?        ?     1033.6        3.6       ?       ? 
1 1 1   22    3    2 o    914.7    3.2    0.0000   0.0000          ?        ?  8367.8262  59.3825          ?        ?      914.7        3.2       ?       ? 
1 1 1   22    3    3 o   1000.7    3.5    0.0000   0.0000          ?        ? 10014.5732  70.2374          ?        ?     1000.7        3.5       ?       ? 
1 1 1   22    3    4 o    445.5    2.0    0.0000   0.0000          ?        ?  1985.1637  17.8786          ?        ?      445.5        2.0       ?       ? 
1 1 1   22    3    5 o    626.0    2.4    0.0000   0.0000          ?        ?  3919.2456  30.6490          ?        ?      626.0        2.4       ?       ? 
1 1 1   22    3    6 o   1157.0    4.0    0.0000   0.0000          ?        ? 13386.6055  91.9471          ?        ?     1157.0        4.0       ?       ? 
1 1 1   22    3    7 o   1329.8    4.5    0.0000   0.0000          ?        ? 17684.4961 119.4035          ?        ?     1329.8        4.5       ?       ? 
1 1 1   22    3    8 o   1187.5    4.1    0.0000   0.0000          ?        ? 14103.0264  96.4168          ?        ?     1187.5        4.1       ?       ? 
1 1 1   22    3    9 o   1379.6    4.6    0.0000   0.0000          ?        ? 19035.6055 127.7043          ?        ?     1379.6        4.6       ?       ? 
1 1 1   22    3   10 o    347.8    1.8    0.0000   0.0000          ?        ?  1209.9985  12.7704          ?        ?      347.8        1.8       ?       ? 
1 1 1   22    3   11 o   2141.7    6.9    0.0000   0.0000          ?        ? 45878.4180 297.5511          ?        ?     2141.7        6.9       ?       ? 
1 1 1   22    3   12 o     91.1    4.2    0.0000   0.0000          ?        ?    83.0078   7.6623          ?        ?       91.1        4.2       ?       ? 
1 1 1   22    3   13 o    818.8    3.1    0.0000   0.0000          ?        ?  6704.4771  51.0817          ?        ?      818.8        3.1       ?       ? 
1 1 1   22    3   14 o    744.2    3.0    0.0000   0.0000          ?        ?  5539.1753  44.0580          ?        ?      744.2        3.0       ?       ? 
1 1 1   22    3   15 o    970.6    3.5    0.0000   0.0000          ?        ?  9421.3867  67.6833          ?        ?      970.6        3.5       ?       ? 
1 1 1   22    3   16 o    696.8    2.7    0.0000   0.0000          ?        ?  4855.3188  37.6728          ?        ?      696.8        2.7       ?       ? 
1 1 1   22    3   17 o   1297.2    4.5    0.0000   0.0000          ?        ? 16829.5137 115.5724          ?        ?     1297.2        4.5       ?       ? 
1 1 1   22    3   18 o   1838.3    6.3    0.0000   0.0000          ?        ? 33796.9492 231.7833          ?        ?     1838.3        6.3       ?       ? 
1 1 1   22    3   19 o    909.8    3.3    0.0000   0.0000          ?        ?  8277.7949  60.0210          ?        ?      909.8        3.3       ?       ? 
1 1 1   22    3   20 o    874.7    3.2    0.0000   0.0000          ?        ?  7651.4048  56.1899          ?        ?      874.7        3.2       ?       ? 
1 1 1   22    3   21 o   1175.9    4.1    0.0000   0.0000          ?        ? 13827.8252  95.7782          ?        ?     1175.9        4.1       ?       ? 
1 1 1   22    3   22 o    787.2    3.0    0.0000   0.0000          ?        ?  6196.2139  46.6121          ?        ?      787.2        3.0       ?       ? 
1 1 1   22    3   23 o    723.2    2.8    0.0000   0.0000          ?        ?  5230.7690  40.8654          ?        ?      723.2        2.8       ?       ? 
1 1 1   22    3   24 o    219.4    3.2    0.0000   0.0000          ?        ?   481.4453  14.0475          ?        ?      219.4        3.2       ?       ? 
1 1 1   22    3   25 o     21.4   10.6    0.0000   0.0000          ?        ?   -37.6728  16.6016          ?        ?       21.4       10.6       ?       ? 
1 1 1   22    3   26 o   1769.2    5.8    0.0000   0.0000          ?        ? 31306.0762 205.6040          ?        ?     1769.2        5.8       ?       ? 
1 1 1   22    3   27 o    337.4    2.7    0.0000   0.0000          ?        ?  1138.4841  18.5171          ?        ?      337.4        2.7       ?       ? 
1 1 1   22    3   28 o    808.4    3.0    0.0000   0.0000          ?        ?  6535.2690  49.1662          ?        ?      808.4        3.0       ?       ? 
1 1 1   22    3   29 o    801.5    3.0    0.0000   0.0000          ?        ?  6423.5273  48.5276          ?        ?      801.5        3.0       ?       ? 
1 1 1   22    3   30 o    212.2    3.5    0.0000   0.0000          ?        ?   450.1577  14.6860          ?        ?      212.2        3.5       ?       ? 
1 1 1   22    3   31 o    711.7    2.9    0.0000   0.0000          ?        ?  5064.7534  41.5039          ?        ?      711.7        2.9       ?       ? 
1 1 1   22    3   32 o    970.4    3.8    0.0000   0.0000          ?        ?  9417.5557  73.4300          ?        ?      970.4        3.8       ?       ? 
1 1 1   22    3   33 o    715.5    3.1    0.0000   0.0000          ?        ?  5120.3052  44.0580          ?        ?      715.5        3.1       ?       ? 
1 1 1   22    3   34 o    182.7    4.5    0.0000   0.0000          ?        ?   333.9468  16.6016          ?        ?      182.7        4.5       ?       ? 
1 1 1   22    3   35 o    702.6    3.1    0.0000   0.0000          ?        ?  4936.4106  43.4195          ?        ?      702.6        3.1       ?       ? 
1 1 1   22    3   36 o    352.4    2.6    0.0000   0.0000          ?        ?  1241.9246  18.5171          ?        ?      352.4        2.6       ?       ? 
1 1 1   22    3   37 o     37.7   15.9    0.0000   0.0000          ?        ?     1.2770  20.4327          ?        ?       37.7       15.9       ?       ? 
1 1 1   22    3   38 o   1786.0    5.9    0.0000   0.0000          ?        ? 31906.9258 210.7121          ?        ?     1786.0        5.9       ?       ? 
1 1 1   22    3   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    3   40 o   1099.6    3.9    0.0000   0.0000          ?        ? 12092.9609  86.8389          ?        ?     1099.6        3.9       ?       ? 
1 1 1   22    3   41 o    278.4    3.4    0.0000   0.0000          ?        ?   775.1653  19.1556          ?        ?      278.4        3.4       ?       ? 
1 1 1   22    3   42 o    311.9    3.0    0.0000   0.0000          ?        ?   973.1069  18.5171          ?        ?      311.9        3.0       ?       ? 
1 1 1   22    3   43 f   1046.9    3.7    0.0000   0.0000          ?        ? 10960.8623  77.8996          ?        ?     1046.9        3.7       ?       ? 
1 1 1   22    3   44 o    592.5    3.0    0.0000   0.0000          ?        ?  3511.2305  35.1187          ?        ?      592.5        3.0       ?       ? 
1 1 1   22    3   45 o    466.3    2.7    0.0000   0.0000          ?        ?  2174.1663  24.9023          ?        ?      466.3        2.7       ?       ? 
1 1 1   22    3   46 o    496.0    2.7    0.0000   0.0000          ?        ?  2460.2236  26.8179          ?        ?      496.0        2.7       ?       ? 
1 1 1   22    3   47 o    365.7    2.8    0.0000   0.0000          ?        ?  1337.7028  20.4327          ?        ?      365.7        2.8       ?       ? 
1 1 1   22    3   48 o    267.5    3.5    0.0000   0.0000          ?        ?   715.7827  18.5171          ?        ?      267.5        3.5       ?       ? 
1 1 1   22    3   49 o    682.2    2.9    0.0000   0.0000          ?        ?  4654.1841  39.5883          ?        ?      682.2        2.9       ?       ? 
1 1 1   22    3   50 f    287.0    3.4    0.0000   0.0000          ?        ?   823.6929  19.7942          ?        ?      287.0        3.4       ?       ? 
1 1 1   22    3   51 o     20.4   10.3    0.0000   0.0000          ?        ?   -55.5514  18.5171          ?        ?       20.4       10.3       ?       ? 
1 1 1   22    3   52 o    151.5    5.7    0.0000   0.0000          ?        ?   229.8678  17.2401          ?        ?      151.5        5.7       ?       ? 
1 1 1   22    3   53 f    435.8    2.8    0.0000   0.0000          ?        ?  1899.6018  24.2638          ?        ?      435.8        2.8       ?       ? 
1 1 1   22    3   54 o     20.9   10.4    0.0000   0.0000          ?        ?   -52.3588  18.5171          ?        ?       20.9       10.4       ?       ? 
1 1 1   22    3   55 o    177.4    4.9    0.0000   0.0000          ?        ?   314.7912  17.2401          ?        ?      177.4        4.9       ?       ? 
1 1 1   22    3   56 o    254.9    3.8    0.0000   0.0000          ?        ?   650.0150  19.1556          ?        ?      254.9        3.8       ?       ? 
1 1 1   22    3   57 o    444.8    2.7    0.0000   0.0000          ?        ?  1978.7784  23.6253          ?        ?      444.8        2.7       ?       ? 
1 1 1   22    3   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    3   59 o    423.7    2.9    0.0000   0.0000          ?        ?  1795.5229  24.2638          ?        ?      423.7        2.9       ?       ? 
1 1 1   22    3   60 o    125.1    7.7    0.0000   0.0000          ?        ?   157.0763  19.1556          ?        ?      125.1        7.7       ?       ? 
1 1 1   22    3   61 o    347.0    3.1    0.0000   0.0000          ?        ?  1204.8903  21.7097          ?        ?      347.0        3.1       ?       ? 
1 1 1   22    3   62 o    193.3    5.1    0.0000   0.0000          ?        ?   374.1737  19.7942          ?        ?      193.3        5.1       ?       ? 
1 1 1   22    3   63 o    387.3    3.0    0.0000   0.0000          ?        ?  1501.1644  22.9868          ?        ?      387.3        3.0       ?       ? 
1 1 1   22    3   64 o    460.4    2.8    0.0000   0.0000          ?        ?  2120.5303  26.1794          ?        ?      460.4        2.8       ?       ? 
1 1 1   22    3   65 o     54.2   16.7    0.0000   0.0000          ?        ?    30.0105  19.7942          ?        ?       54.2       16.7       ?       ? 
1 1 1   22    3   66 o    182.9    5.9    0.0000   0.0000          ?        ?   335.2238  21.7097          ?        ?      182.9        5.9       ?       ? 
1 1 1   22    3   67 f    305.9    3.7    0.0000   0.0000          ?        ?   936.7112  22.3483          ?        ?      305.9        3.7       ?       ? 
1 1 1   22    3   68 o    115.4    9.1    0.0000   0.0000          ?        ?   134.0895  21.0712          ?        ?      115.4        9.1       ?       ? 
1 1 1   22    3   69 o    358.9    3.4    0.0000   0.0000          ?        ?  1289.1752  24.2638          ?        ?      358.9        3.4       ?       ? 
1 1 1   22    3   70 f    124.1    9.0    0.0000   0.0000          ?        ?   155.1608  22.3483          ?        ?      124.1        9.0       ?       ? 
1 1 1   22    3   71 o    144.7    7.9    0.0000   0.0000          ?        ?   210.7121  22.9868          ?        ?      144.7        7.9       ?       ? 
1 1 1   22    3   72 o     57.4   17.4    0.0000   0.0000          ?        ?    34.4802  21.7097          ?        ?       57.4       17.4       ?       ? 
1 1 1   22    3   73 o     87.5   11.7    0.0000   0.0000          ?        ?    77.8996  20.4327          ?        ?       87.5       11.7       ?       ? 
1 1 1   22    3   74 o     30.6   14.2    0.0000   0.0000          ?        ?   -17.8786  21.0712          ?        ?       30.6       14.2       ?       ? 
1 1 1   22    3   75 o     47.3   17.0    0.0000   0.0000          ?        ?    20.4327  20.4327          ?        ?       47.3       17.0       ?       ? 
1 1 1   22    3   76 o    161.8    6.5    0.0000   0.0000          ?        ?   263.7094  21.0712          ?        ?      161.8        6.5       ?       ? 
1 1 1   22    3   77 o    122.8    7.8    0.0000   0.0000          ?        ?   152.6067  19.1556          ?        ?      122.8        7.8       ?       ? 
1 1 1   22    4    0 o    742.7    4.0 5516.1885  58.7440  5516.1885  58.7440  5516.1885  58.7440      742.7      4.0      742.7        4.0     0.0     0.0 
1 1 1   22    4    1 o    919.1    3.3    0.0000   0.0000          ?        ?  8448.2793  61.2981          ?        ?      919.1        3.3       ?       ? 
1 1 1   22    4    2 o    505.6    2.1    0.0000   0.0000          ?        ?  2556.6406  21.7097          ?        ?      505.6        2.1       ?       ? 
1 1 1   22    4    3 o    464.9    2.1    0.0000   0.0000          ?        ?  2161.3958  19.1556          ?        ?      464.9        2.1       ?       ? 
1 1 1   22    4    4 o    833.5    3.0    0.0000   0.0000          ?        ?  6947.1152  50.4432          ?        ?      833.5        3.0       ?       ? 
1 1 1   22    4    5 o    762.4    2.8    0.0000   0.0000          ?        ?  5812.4624  42.7809          ?        ?      762.4        2.8       ?       ? 
1 1 1   22    4    6 o    463.9    2.1    0.0000   0.0000          ?        ?  2152.4565  19.1556          ?        ?      463.9        2.1       ?       ? 
1 1 1   22    4    7 o   2389.1    7.7    0.0000   0.0000          ?        ? 57091.4961 368.4270          ?        ?     2389.1        7.7       ?       ? 
1 1 1   22    4    8 o    205.3    1.9    0.0000   0.0000          ?        ?   421.4243   7.6623          ?        ?      205.3        1.9       ?       ? 
1 1 1   22    4    9 o   1601.6    5.3    0.0000   0.0000          ?        ? 25653.8828 169.8468          ?        ?     1601.6        5.3       ?       ? 
1 1 1   22    4   10 o    544.1    2.2    0.0000   0.0000          ?        ?  2960.1863  24.2638          ?        ?      544.1        2.2       ?       ? 
1 1 1   22    4   11 o    389.5    2.0    0.0000   0.0000          ?        ?  1517.1274  15.9630          ?        ?      389.5        2.0       ?       ? 
1 1 1   22    4   12 o   1305.3    4.6    0.0000   0.0000          ?        ? 17038.9492 120.6806          ?        ?     1305.3        4.6       ?       ? 
1 1 1   22    4   13 o    367.2    2.0    0.0000   0.0000          ?        ?  1348.5576  14.6860          ?        ?      367.2        2.0       ?       ? 
1 1 1   22    4   14 o    352.0    1.9    0.0000   0.0000          ?        ?  1238.7319  13.4090          ?        ?      352.0        1.9       ?       ? 
1 1 1   22    4   15 o    623.3    2.4    0.0000   0.0000          ?        ?  3884.7656  30.0105          ?        ?      623.3        2.4       ?       ? 
1 1 1   22    4   16 o   1270.0    4.3    0.0000   0.0000          ?        ? 16130.9717 109.8257          ?        ?     1270.0        4.3       ?       ? 
1 1 1   22    4   17 o    468.1    2.2    0.0000   0.0000          ?        ?  2190.7678  20.4327          ?        ?      468.1        2.2       ?       ? 
1 1 1   22    4   18 o   1437.4    4.9    0.0000   0.0000          ?        ? 20663.1992 141.7518          ?        ?     1437.4        4.9       ?       ? 
1 1 1   22    4   19 o   1363.8    4.7    0.0000   0.0000          ?        ? 18599.4961 127.7043          ?        ?     1363.8        4.7       ?       ? 
1 1 1   22    4   20 o    497.9    2.2    0.0000   0.0000          ?        ?  2478.7410  22.3483          ?        ?      497.9        2.2       ?       ? 
1 1 1   22    4   21 o   1003.4    3.6    0.0000   0.0000          ?        ? 10068.8477  72.7915          ?        ?     1003.4        3.6       ?       ? 
1 1 1   22    4   22 o    685.1    2.7    0.0000   0.0000          ?        ?  4694.4111  37.6728          ?        ?      685.1        2.7       ?       ? 
1 1 1   22    4   23 o    561.7    2.4    0.0000   0.0000          ?        ?  3155.5740  27.4564          ?        ?      561.7        2.4       ?       ? 
1 1 1   22    4   24 o    630.0    2.5    0.0000   0.0000          ?        ?  3969.6890  31.9261          ?        ?      630.0        2.5       ?       ? 
1 1 1   22    4   25 o   1790.2    5.9    0.0000   0.0000          ?        ? 32051.2324 210.0736          ?        ?     1790.2        5.9       ?       ? 
1 1 1   22    4   26 o   1271.6    4.4    0.0000   0.0000          ?        ? 16170.5605 112.3798          ?        ?     1271.6        4.4       ?       ? 
1 1 1   22    4   27 o    925.8    3.4    0.0000   0.0000          ?        ?  8570.8760  62.5751          ?        ?      925.8        3.4       ?       ? 
1 1 1   22    4   28 o    336.9    2.5    0.0000   0.0000          ?        ?  1135.2915  16.6016          ?        ?      336.9        2.5       ?       ? 
1 1 1   22    4   29 o    678.4    2.9    0.0000   0.0000          ?        ?  4601.8257  39.5883          ?        ?      678.4        2.9       ?       ? 
1 1 1   22    4   30 o     75.4   11.0    0.0000   0.0000          ?        ?    56.8284  16.6016          ?        ?       75.4       11.0       ?       ? 
1 1 1   22    4   31 o    841.2    3.2    0.0000   0.0000          ?        ?  7076.7354  53.6358          ?        ?      841.2        3.2       ?       ? 
1 1 1   22    4   32 o    827.8    3.5    0.0000   0.0000          ?        ?  6852.6138  58.7440          ?        ?      827.8        3.5       ?       ? 
1 1 1   22    4   33 o   1329.3    4.7    0.0000   0.0000          ?        ? 17671.7246 123.8732          ?        ?     1329.3        4.7       ?       ? 
1 1 1   22    4   34 o    885.3    3.3    0.0000   0.0000          ?        ?  7837.8530  58.1055          ?        ?      885.3        3.3       ?       ? 
1 1 1   22    4   35 f    739.6    3.0    0.0000   0.0000          ?        ?  5470.8530  44.0580          ?        ?      739.6        3.0       ?       ? 
1 1 1   22    4   36 o    880.3    3.7    0.0000   0.0000          ?        ?  7749.7368  64.4907          ?        ?      880.3        3.7       ?       ? 
1 1 1   22    4   37 o    470.6    3.0    0.0000   0.0000          ?        ?  2214.3928  28.0950          ?        ?      470.6        3.0       ?       ? 
1 1 1   22    4   38 o    749.8    3.2    0.0000   0.0000          ?        ?  5622.8213  47.8891          ?        ?      749.8        3.2       ?       ? 
1 1 1   22    4   39 o   1001.0    3.7    0.0000   0.0000          ?        ? 10021.5967  74.0685          ?        ?     1001.0        3.7       ?       ? 
1 1 1   22    4   40 o    255.9    3.9    0.0000   0.0000          ?        ?   655.1232  19.7942          ?        ?      255.9        3.9       ?       ? 
1 1 1   22    4   41 f    644.7    3.0    0.0000   0.0000          ?        ?  4156.7759  38.9498          ?        ?      644.7        3.0       ?       ? 
1 1 1   22    4   42 o    709.7    2.9    0.0000   0.0000          ?        ?  5037.2974  41.5039          ?        ?      709.7        2.9       ?       ? 
1 1 1   22    4   43 o    547.6    3.0    0.0000   0.0000          ?        ?  2999.1362  32.5646          ?        ?      547.6        3.0       ?       ? 
1 1 1   22    4   44 o    619.1    2.7    0.0000   0.0000          ?        ?  3833.6841  33.8416          ?        ?      619.1        2.7       ?       ? 
1 1 1   22    4   45 o    484.1    2.6    0.0000   0.0000          ?        ?  2344.0129  25.5409          ?        ?      484.1        2.6       ?       ? 
1 1 1   22    4   46 o     18.6    9.4    0.0000   0.0000          ?        ?   -50.4432  15.9630          ?        ?       18.6        9.4       ?       ? 
1 1 1   22    4   47 o    339.2    3.0    0.0000   0.0000          ?        ?  1150.6160  20.4327          ?        ?      339.2        3.0       ?       ? 
1 1 1   22    4   48 o    267.9    3.3    0.0000   0.0000          ?        ?   717.6983  17.8786          ?        ?      267.9        3.3       ?       ? 
1 1 1   22    4   49 o    369.3    2.9    0.0000   0.0000          ?        ?  1363.8822  21.7097          ?        ?      369.3        2.9       ?       ? 
1 1 1   22    4   50 o    664.9    2.7    0.0000   0.0000          ?        ?  4421.1240  36.3957          ?        ?      664.9        2.7       ?       ? 
1 1 1   22    4   51 o    522.7    2.6    0.0000   0.0000          ?        ?  2732.8726  27.4564          ?        ?      522.7        2.6       ?       ? 
1 1 1   22    4   52 o    329.8    3.0    0.0000   0.0000          ?        ?  1088.0408  19.7942          ?        ?      329.8        3.0       ?       ? 
1 1 1   22    4   53 o    888.1    3.4    0.0000   0.0000          ?        ?  7890.2114  60.0210          ?        ?      888.1        3.4       ?       ? 
1 1 1   22    4   54 o    283.7    3.5    0.0000   0.0000          ?        ?   805.1758  19.7942          ?        ?      283.7        3.5       ?       ? 
1 1 1   22    4   55 o    207.4    4.5    0.0000   0.0000          ?        ?   430.3636  18.5171          ?        ?      207.4        4.5       ?       ? 
1 1 1   22    4   56 o    206.9    4.6    0.0000   0.0000          ?        ?   428.4480  19.1556          ?        ?      206.9        4.6       ?       ? 
1 1 1   22    4   57 o    370.8    3.0    0.0000   0.0000          ?        ?  1375.3755  22.3483          ?        ?      370.8        3.0       ?       ? 
1 1 1   22    4   58 o    533.3    2.8    0.0000   0.0000          ?        ?  2845.2524  30.0105          ?        ?      533.3        2.8       ?       ? 
1 1 1   22    4   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    4   60 o    372.9    3.0    0.0000   0.0000          ?        ?  1391.3386  22.3483          ?        ?      372.9        3.0       ?       ? 
1 1 1   22    4   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    4   62 o    283.0    3.5    0.0000   0.0000          ?        ?   801.3447  19.7942          ?        ?      283.0        3.5       ?       ? 
1 1 1   22    4   63 o    179.2    5.3    0.0000   0.0000          ?        ?   321.8149  19.1556          ?        ?      179.2        5.3       ?       ? 
1 1 1   22    4   64 o     37.8   15.8    0.0000   0.0000          ?        ?     3.1926  19.7942          ?        ?       37.8       15.8       ?       ? 
1 1 1   22    4   65 o    196.7    5.2    0.0000   0.0000          ?        ?   387.5826  20.4327          ?        ?      196.7        5.2       ?       ? 
1 1 1   22    4   66 o     75.7   14.4    0.0000   0.0000          ?        ?    60.0210  21.0712          ?        ?       75.7       14.4       ?       ? 
1 1 1   22    4   67 o    133.4    7.7    0.0000   0.0000          ?        ?   178.7861  20.4327          ?        ?      133.4        7.7       ?       ? 
1 1 1   22    4   68 o     29.0   13.6    0.0000   0.0000          ?        ?   -21.7097  20.4327          ?        ?       29.0       13.6       ?       ? 
1 1 1   22    4   69 o     92.3   11.4    0.0000   0.0000          ?        ?    86.2004  21.0712          ?        ?       92.3       11.4       ?       ? 
1 1 1   22    4   70 o    118.0    8.9    0.0000   0.0000          ?        ?   140.4748  21.0712          ?        ?      118.0        8.9       ?       ? 
1 1 1   22    4   71 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    4   72 o    301.3    3.8    0.0000   0.0000          ?        ?   909.2548  22.9868          ?        ?      301.3        3.8       ?       ? 
1 1 1   22    4   73 o     71.5   14.3    0.0000   0.0000          ?        ?    54.2743  19.7942          ?        ?       71.5       14.3       ?       ? 
1 1 1   22    4   74 o     86.6   11.8    0.0000   0.0000          ?        ?    76.6226  20.4327          ?        ?       86.6       11.8       ?       ? 
1 1 1   22    4   75 o     24.5   12.0    0.0000   0.0000          ?        ?   -40.8654  20.4327          ?        ?       24.5       12.0       ?       ? 
1 1 1   22    4   76 o     30.4   14.2    0.0000   0.0000          ?        ?   -17.8786  21.0712          ?        ?       30.4       14.2       ?       ? 
1 1 1   22    4   77 o    108.0    9.2    0.0000   0.0000          ?        ?   118.7650  19.7942          ?        ?      108.0        9.2       ?       ? 
1 1 1   22    5    0 o    675.8    3.7 4567.9839  49.8047  4567.9839  49.8047  4567.9839  49.8047      675.8      3.7      675.8        3.7     0.0     0.0 
1 1 1   22    5    1 o    908.6    3.3    0.0000   0.0000          ?        ?  8255.4463  59.3825          ?        ?      908.6        3.3       ?       ? 
1 1 1   22    5    2 o    868.5    3.1    0.0000   0.0000          ?        ?  7543.4946  53.6358          ?        ?      868.5        3.1       ?       ? 
1 1 1   22    5    3 o   1105.8    3.8    0.0000   0.0000          ?        ? 12227.6895  84.2849          ?        ?     1105.8        3.8       ?       ? 
1 1 1   22    5    4 o   1303.3    4.4    0.0000   0.0000          ?        ? 16985.9512 114.9339          ?        ?     1303.3        4.4       ?       ? 
1 1 1   22    5    5 o    396.7    1.9    0.0000   0.0000          ?        ?  1573.9558  14.6860          ?        ?      396.7        1.9       ?       ? 
1 1 1   22    5    6 o    845.2    3.1    0.0000   0.0000          ?        ?  7143.1411  51.7203          ?        ?      845.2        3.1       ?       ? 
1 1 1   22    5    7 o    651.0    2.6    0.0000   0.0000          ?        ?  4237.8682  33.2031          ?        ?      651.0        2.6       ?       ? 
1 1 1   22    5    8 o    515.8    2.2    0.0000   0.0000          ?        ?  2660.7197  22.9868          ?        ?      515.8        2.2       ?       ? 
1 1 1   22    5    9 o   1616.7    5.6    0.0000   0.0000          ?        ? 26141.0762 180.7016          ?        ?     1616.7        5.6       ?       ? 
1 1 1   22    5   10 o   1048.2    3.8    0.0000   0.0000          ?        ? 10987.0410  80.4537          ?        ?     1048.2        3.8       ?       ? 
1 1 1   22    5   11 o   1554.7    5.1    0.0000   0.0000          ?        ? 24171.8750 159.6304          ?        ?     1554.7        5.1       ?       ? 
1 1 1   22    5   12 o    368.9    2.0    0.0000   0.0000          ?        ?  1360.6896  14.6860          ?        ?      368.9        2.0       ?       ? 
1 1 1   22    5   13 o   1354.0    4.6    0.0000   0.0000          ?        ? 18333.2324 125.7888          ?        ?     1354.0        4.6       ?       ? 
1 1 1   22    5   14 o   2137.1    6.9    0.0000   0.0000          ?        ? 45677.9219 296.2740          ?        ?     2137.1        6.9       ?       ? 
1 1 1   22    5   15 o    499.8    2.2    0.0000   0.0000          ?        ?  2498.5352  22.3483          ?        ?      499.8        2.2       ?       ? 
1 1 1   22    5   16 o    873.5    3.3    0.0000   0.0000          ?        ?  7630.3335  58.1055          ?        ?      873.5        3.3       ?       ? 
1 1 1   22    5   17 o   1312.8    4.5    0.0000   0.0000          ?        ? 17234.9746 118.7650          ?        ?     1312.8        4.5       ?       ? 
1 1 1   22    5   18 o   1712.4    5.8    0.0000   0.0000          ?        ? 29325.3848 197.3032          ?        ?     1712.4        5.8       ?       ? 
1 1 1   22    5   19 o   1061.8    3.7    0.0000   0.0000          ?        ? 11275.6533  79.1767          ?        ?     1061.8        3.7       ?       ? 
1 1 1   22    5   20 o   1565.8    5.3    0.0000   0.0000          ?        ? 24520.5078 166.6541          ?        ?     1565.8        5.3       ?       ? 
1 1 1   22    5   21 o   1683.0    5.6    0.0000   0.0000          ?        ? 28327.3730 187.0868          ?        ?     1683.0        5.6       ?       ? 
1 1 1   22    5   22 o   1305.3    4.5    0.0000   0.0000          ?        ? 17039.5879 117.4880          ?        ?     1305.3        4.5       ?       ? 
1 1 1   22    5   23 o    803.3    3.1    0.0000   0.0000          ?        ?  6452.8994  49.8047          ?        ?      803.3        3.1       ?       ? 
1 1 1   22    5   24 o    736.8    2.9    0.0000   0.0000          ?        ?  5428.7109  43.4195          ?        ?      736.8        2.9       ?       ? 
1 1 1   22    5   25 o    952.2    3.6    0.0000   0.0000          ?        ?  9067.0068  67.6833          ?        ?      952.2        3.6       ?       ? 
1 1 1   22    5   26 o    705.6    2.9    0.0000   0.0000          ?        ?  4978.5532  40.8654          ?        ?      705.6        2.9       ?       ? 
1 1 1   22    5   27 o   1443.3    5.0    0.0000   0.0000          ?        ? 20832.4062 145.5829          ?        ?     1443.3        5.0       ?       ? 
1 1 1   22    5   28 o   1023.0    4.0    0.0000   0.0000          ?        ? 10466.0078  81.7308          ?        ?     1023.0        4.0       ?       ? 
1 1 1   22    5   29 o    863.3    3.4    0.0000   0.0000          ?        ?  7453.4634  58.7440          ?        ?      863.3        3.4       ?       ? 
1 1 1   22    5   30 o    764.9    3.2    0.0000   0.0000          ?        ?  5851.4121  48.5276          ?        ?      764.9        3.2       ?       ? 
1 1 1   22    5   31 o    926.5    3.7    0.0000   0.0000          ?        ?  8584.2852  68.9603          ?        ?      926.5        3.7       ?       ? 
1 1 1   22    5   32 o   1109.2    4.1    0.0000   0.0000          ?        ? 12304.9502  90.0316          ?        ?     1109.2        4.1       ?       ? 
1 1 1   22    5   33 o   1470.2    5.3    0.0000   0.0000          ?        ? 21619.0664 157.0763          ?        ?     1470.2        5.3       ?       ? 
1 1 1   22    5   34 o    577.9    2.9    0.0000   0.0000          ?        ?  3339.4680  33.2031          ?        ?      577.9        2.9       ?       ? 
1 1 1   22    5   35 o   1146.5    4.3    0.0000   0.0000          ?        ? 13145.8838  97.6938          ?        ?     1146.5        4.3       ?       ? 
1 1 1   22    5   36 o   1349.5    4.9    0.0000   0.0000          ?        ? 18215.1055 132.8125          ?        ?     1349.5        4.9       ?       ? 
1 1 1   22    5   37 o    426.5    2.5    0.0000   0.0000          ?        ?  1819.1481  21.7097          ?        ?      426.5        2.5       ?       ? 
1 1 1   22    5   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    5   39 o    110.7    8.4    0.0000   0.0000          ?        ?   122.5962  18.5171          ?        ?      110.7        8.4       ?       ? 
1 1 1   22    5   40 o    934.9    3.4    0.0000   0.0000          ?        ?  8741.3613  64.4907          ?        ?      934.9        3.4       ?       ? 
1 1 1   22    5   41 o    635.3    2.8    0.0000   0.0000          ?        ?  4036.0950  35.7572          ?        ?      635.3        2.8       ?       ? 
1 1 1   22    5   42 o    244.8    3.8    0.0000   0.0000          ?        ?   599.5718  18.5171          ?        ?      244.8        3.8       ?       ? 
1 1 1   22    5   43 o    620.7    2.7    0.0000   0.0000          ?        ?  3852.8396  33.2031          ?        ?      620.7        2.7       ?       ? 
1 1 1   22    5   44 f     26.2   12.5    0.0000   0.0000          ?        ?   -22.9868  17.8786          ?        ?       26.2       12.5       ?       ? 
1 1 1   22    5   45 o    248.6    3.6    0.0000   0.0000          ?        ?   618.0889  17.8786          ?        ?      248.6        3.6       ?       ? 
1 1 1   22    5   46 o     87.1   10.3    0.0000   0.0000          ?        ?    75.9841  17.8786          ?        ?       87.1       10.3       ?       ? 
1 1 1   22    5   47 o    342.4    3.3    0.0000   0.0000          ?        ?  1172.9642  22.3483          ?        ?      342.4        3.3       ?       ? 
1 1 1   22    5   48 o     50.0   16.2    0.0000   0.0000          ?        ?    24.2638  18.5171          ?        ?       50.0       16.2       ?       ? 
1 1 1   22    5   49 o    388.1    3.0    0.0000   0.0000          ?        ?  1506.9110  22.9868          ?        ?      388.1        3.0       ?       ? 
1 1 1   22    5   50 o    212.3    4.4    0.0000   0.0000          ?        ?   450.7963  18.5171          ?        ?      212.3        4.4       ?       ? 
1 1 1   22    5   51 o    235.9    3.9    0.0000   0.0000          ?        ?   556.7908  18.5171          ?        ?      235.9        3.9       ?       ? 
1 1 1   22    5   52 o    148.1    6.3    0.0000   0.0000          ?        ?   219.6514  18.5171          ?        ?      148.1        6.3       ?       ? 
1 1 1   22    5   53 o    252.2    3.9    0.0000   0.0000          ?        ?   636.6060  19.7942          ?        ?      252.2        3.9       ?       ? 
1 1 1   22    5   54 o    334.7    3.1    0.0000   0.0000          ?        ?  1120.6055  21.0712          ?        ?      334.7        3.1       ?       ? 
1 1 1   22    5   55 o    673.6    2.9    0.0000   0.0000          ?        ?  4538.6118  39.5883          ?        ?      673.6        2.9       ?       ? 
1 1 1   22    5   56 o     20.3   10.2    0.0000   0.0000          ?        ?   -56.1899  18.5171          ?        ?       20.3       10.2       ?       ? 
1 1 1   22    5   57 o    173.9    5.3    0.0000   0.0000          ?        ?   302.6593  18.5171          ?        ?      173.9        5.3       ?       ? 
1 1 1   22    5   58 f     70.8   14.0    0.0000   0.0000          ?        ?    52.3588  19.1556          ?        ?       70.8       14.0       ?       ? 
1 1 1   22    5   59 o    144.3    6.6    0.0000   0.0000          ?        ?   208.7966  19.1556          ?        ?      144.3        6.6       ?       ? 
1 1 1   22    5   60 o    177.3    5.2    0.0000   0.0000          ?        ?   314.7912  18.5171          ?        ?      177.3        5.2       ?       ? 
1 1 1   22    5   61 o    310.8    3.3    0.0000   0.0000          ?        ?   966.7217  20.4327          ?        ?      310.8        3.3       ?       ? 
1 1 1   22    5   62 o    216.5    4.6    0.0000   0.0000          ?        ?   469.3134  19.7942          ?        ?      216.5        4.6       ?       ? 
1 1 1   22    5   63 o    196.7    5.0    0.0000   0.0000          ?        ?   387.5826  19.7942          ?        ?      196.7        5.0       ?       ? 
1 1 1   22    5   64 o     25.4   12.3    0.0000   0.0000          ?        ?   -31.2876  19.1556          ?        ?       25.4       12.3       ?       ? 
1 1 1   22    5   65 o    280.5    3.6    0.0000   0.0000          ?        ?   787.2972  20.4327          ?        ?      280.5        3.6       ?       ? 
1 1 1   22    5   66 o     29.6   13.8    0.0000   0.0000          ?        ?   -17.8786  19.7942          ?        ?       29.6       13.8       ?       ? 
1 1 1   22    5   67 o    226.8    4.6    0.0000   0.0000          ?        ?   515.2869  21.0712          ?        ?      226.8        4.6       ?       ? 
1 1 1   22    5   68 o    148.1    7.3    0.0000   0.0000          ?        ?   220.2900  21.7097          ?        ?      148.1        7.3       ?       ? 
1 1 1   22    5   69 o     76.4   14.3    0.0000   0.0000          ?        ?    61.2981  21.0712          ?        ?       76.4       14.3       ?       ? 
1 1 1   22    5   70 o     38.7   16.2    0.0000   0.0000          ?        ?     3.1926  21.0712          ?        ?       38.7       16.2       ?       ? 
1 1 1   22    5   71 o     26.2   12.7    0.0000   0.0000          ?        ?   -35.7572  21.0712          ?        ?       26.2       12.7       ?       ? 
1 1 1   22    5   72 o     47.8   17.7    0.0000   0.0000          ?        ?    19.1556  22.3483          ?        ?       47.8       17.7       ?       ? 
1 1 1   22    5   73 o    154.0    7.0    0.0000   0.0000          ?        ?   238.8071  21.7097          ?        ?      154.0        7.0       ?       ? 
1 1 1   22    5   74 f    105.8   10.3    0.0000   0.0000          ?        ?   113.6568  21.7097          ?        ?      105.8       10.3       ?       ? 
1 1 1   22    5   75 o    173.0    6.1    0.0000   0.0000          ?        ?   301.3822  21.0712          ?        ?      173.0        6.1       ?       ? 
1 1 1   22    5   76 o     54.0   17.3    0.0000   0.0000          ?        ?    30.6490  21.0712          ?        ?       54.0       17.3       ?       ? 
1 1 1   22    6    0 o   1620.2    7.7 26254.0957 249.6619 26254.0957 249.6619 26254.0957 249.6619     1620.2      7.7     1620.2        7.7     0.0     0.0 
1 1 1   22    6    1 o    263.6    1.8    0.0000   0.0000          ?        ?   694.7115   9.5778          ?        ?      263.6        1.8       ?       ? 
1 1 1   22    6    2 o   1284.3    4.4    0.0000   0.0000          ?        ? 16494.2910 113.6568          ?        ?     1284.3        4.4       ?       ? 
1 1 1   22    6    3 o    498.4    2.1    0.0000   0.0000          ?        ?  2484.4878  21.0712          ?        ?      498.4        2.1       ?       ? 
1 1 1   22    6    4 o    882.0    3.2    0.0000   0.0000          ?        ?  7780.3862  56.8284          ?        ?      882.0        3.2       ?       ? 
1 1 1   22    6    5 o   1068.4    3.7    0.0000   0.0000          ?        ? 11415.4902  79.8152          ?        ?     1068.4        3.7       ?       ? 
1 1 1   22    6    6 o   1088.2    3.9    0.0000   0.0000          ?        ? 11841.3838  85.5619          ?        ?     1088.2        3.9       ?       ? 
1 1 1   22    6    7 o   1960.2    6.7    0.0000   0.0000          ?        ? 38431.3398 263.7094          ?        ?     1960.2        6.7       ?       ? 
1 1 1   22    6    8 o   1610.4    5.6    0.0000   0.0000          ?        ? 25935.4727 180.0631          ?        ?     1610.4        5.6       ?       ? 
1 1 1   22    6    9 o    153.9    2.5    0.0000   0.0000          ?        ?   236.8915   7.6623          ?        ?      153.9        2.5       ?       ? 
1 1 1   22    6   10 o    981.7    3.6    0.0000   0.0000          ?        ?  9637.8457  70.8759          ?        ?      981.7        3.6       ?       ? 
1 1 1   22    6   11 o    709.3    3.0    0.0000   0.0000          ?        ?  5030.9121  42.1424          ?        ?      709.3        3.0       ?       ? 
1 1 1   22    6   12 f    815.9    3.1    0.0000   0.0000          ?        ?  6657.8647  51.0817          ?        ?      815.9        3.1       ?       ? 
1 1 1   22    6   13 o    519.1    2.4    0.0000   0.0000          ?        ?  2695.1997  24.9023          ?        ?      519.1        2.4       ?       ? 
1 1 1   22    6   14 o    626.3    2.7    0.0000   0.0000          ?        ?  3923.0771  33.2031          ?        ?      626.3        2.7       ?       ? 
1 1 1   22    6   15 o    506.7    2.4    0.0000   0.0000          ?        ?  2567.4956  24.2638          ?        ?      506.7        2.4       ?       ? 
1 1 1   22    6   16 o   1292.4    4.6    0.0000   0.0000          ?        ? 16705.0020 118.7650          ?        ?     1292.4        4.6       ?       ? 
1 1 1   22    6   17 o   1297.4    4.6    0.0000   0.0000          ?        ? 16832.7070 120.0421          ?        ?     1297.4        4.6       ?       ? 
1 1 1   22    6   18 o    489.8    2.3    0.0000   0.0000          ?        ?  2398.9258  22.3483          ?        ?      489.8        2.3       ?       ? 
1 1 1   22    6   19 o    228.0    3.1    0.0000   0.0000          ?        ?   519.7566  14.0475          ?        ?      228.0        3.1       ?       ? 
1 1 1   22    6   20 f    720.8    2.7    0.0000   0.0000          ?        ?  5196.2891  39.5883          ?        ?      720.8        2.7       ?       ? 
1 1 1   22    6   21 o   1462.9    5.0    0.0000   0.0000          ?        ? 21402.6055 145.5829          ?        ?     1462.9        5.0       ?       ? 
1 1 1   22    6   22 o   1791.9    5.9    0.0000   0.0000          ?        ? 32113.1660 210.7121          ?        ?     1791.9        5.9       ?       ? 
1 1 1   22    6   23 o   1391.9    4.8    0.0000   0.0000          ?        ? 19376.5781 134.0895          ?        ?     1391.9        4.8       ?       ? 
1 1 1   22    6   24 o    959.2    3.5    0.0000   0.0000          ?        ?  9201.7354  66.4062          ?        ?      959.2        3.5       ?       ? 
1 1 1   22    6   25 o    299.9    2.6    0.0000   0.0000          ?        ?   899.6769  15.3245          ?        ?      299.9        2.6       ?       ? 
1 1 1   22    6   26 f    803.8    3.1    0.0000   0.0000          ?        ?  6461.8389  49.8047          ?        ?      803.8        3.1       ?       ? 
1 1 1   22    6   27 o     86.4    7.4    0.0000   0.0000          ?        ?    74.7070  12.7704          ?        ?       86.4        7.4       ?       ? 
1 1 1   22    6   28 o   1128.1    4.1    0.0000   0.0000          ?        ? 12727.0127  91.9471          ?        ?     1128.1        4.1       ?       ? 
1 1 1   22    6   29 o    563.2    2.6    0.0000   0.0000          ?        ?  3171.5371  28.7335          ?        ?      563.2        2.6       ?       ? 
1 1 1   22    6   30 o    665.8    2.9    0.0000   0.0000          ?        ?  4433.2554  38.3113          ?        ?      665.8        2.9       ?       ? 
1 1 1   22    6   31 o    632.0    2.7    0.0000   0.0000          ?        ?  3993.9529  34.4802          ?        ?      632.0        2.7       ?       ? 
1 1 1   22    6   32 o    673.8    3.0    0.0000   0.0000          ?        ?  4539.8887  40.2269          ?        ?      673.8        3.0       ?       ? 
1 1 1   22    6   33 o    569.7    2.7    0.0000   0.0000          ?        ?  3246.2439  30.6490          ?        ?      569.7        2.7       ?       ? 
1 1 1   22    6   34 o    623.5    3.0    0.0000   0.0000          ?        ?  3887.9583  37.0343          ?        ?      623.5        3.0       ?       ? 
1 1 1   22    6   35 o   1065.0    4.2    0.0000   0.0000          ?        ? 11343.3369  90.0316          ?        ?     1065.0        4.2       ?       ? 
1 1 1   22    6   36 o    432.6    2.8    0.0000   0.0000          ?        ?  1871.5070  24.2638          ?        ?      432.6        2.8       ?       ? 
1 1 1   22    6   37 o    114.1    7.0    0.0000   0.0000          ?        ?   130.2584  15.9630          ?        ?      114.1        7.0       ?       ? 
1 1 1   22    6   38 o    311.0    3.3    0.0000   0.0000          ?        ?   967.3603  20.4327          ?        ?      311.0        3.3       ?       ? 
1 1 1   22    6   39 o    604.9    3.0    0.0000   0.0000          ?        ?  3659.3672  35.7572          ?        ?      604.9        3.0       ?       ? 
1 1 1   22    6   40 o   1370.7    4.9    0.0000   0.0000          ?        ? 18791.6914 135.3666          ?        ?     1370.7        4.9       ?       ? 
1 1 1   22    6   41 o    500.8    2.6    0.0000   0.0000          ?        ?  2508.1128  26.1794          ?        ?      500.8        2.6       ?       ? 
1 1 1   22    6   42 o    338.6    2.9    0.0000   0.0000          ?        ?  1146.7849  19.7942          ?        ?      338.6        2.9       ?       ? 
1 1 1   22    6   43 o    330.7    3.0    0.0000   0.0000          ?        ?  1093.7876  19.7942          ?        ?      330.7        3.0       ?       ? 
1 1 1   22    6   44 o    256.2    3.4    0.0000   0.0000          ?        ?   656.4003  17.2401          ?        ?      256.2        3.4       ?       ? 
1 1 1   22    6   45 o    204.6    4.1    0.0000   0.0000          ?        ?   418.8702  16.6016          ?        ?      204.6        4.1       ?       ? 
1 1 1   22    6   46 o    138.1    6.0    0.0000   0.0000          ?        ?   190.9180  16.6016          ?        ?      138.1        6.0       ?       ? 
1 1 1   22    6   47 o    256.5    3.6    0.0000   0.0000          ?        ?   658.3158  18.5171          ?        ?      256.5        3.6       ?       ? 
1 1 1   22    6   48 o    320.2    3.2    0.0000   0.0000          ?        ?  1025.4658  20.4327          ?        ?      320.2        3.2       ?       ? 
1 1 1   22    6   49 o    437.2    2.8    0.0000   0.0000          ?        ?  1911.7338  24.9023          ?        ?      437.2        2.8       ?       ? 
1 1 1   22    6   50 o    221.0    4.3    0.0000   0.0000          ?        ?   488.4691  19.1556          ?        ?      221.0        4.3       ?       ? 
1 1 1   22    6   51 o    581.2    2.8    0.0000   0.0000          ?        ?  3378.4177  32.5646          ?        ?      581.2        2.8       ?       ? 
1 1 1   22    6   52 o    347.5    3.2    0.0000   0.0000          ?        ?  1208.0829  22.3483          ?        ?      347.5        3.2       ?       ? 
1 1 1   22    6   53 o    430.2    2.7    0.0000   0.0000          ?        ?  1851.0741  22.9868          ?        ?      430.2        2.7       ?       ? 
1 1 1   22    6   54 f    331.3    3.0    0.0000   0.0000          ?        ?  1098.2572  19.7942          ?        ?      331.3        3.0       ?       ? 
1 1 1   22    6   55 o     24.1   11.7    0.0000   0.0000          ?        ?   -34.4802  18.5171          ?        ?       24.1       11.7       ?       ? 
1 1 1   22    6   56 f    383.6    2.9    0.0000   0.0000          ?        ?  1471.7924  22.3483          ?        ?      383.6        2.9       ?       ? 
1 1 1   22    6   57 o     22.7   11.2    0.0000   0.0000          ?        ?   -41.5039  18.5171          ?        ?       22.7       11.2       ?       ? 
1 1 1   22    6   58 o    369.2    2.9    0.0000   0.0000          ?        ?  1363.8822  21.7097          ?        ?      369.2        2.9       ?       ? 
1 1 1   22    6   59 o    325.9    3.1    0.0000   0.0000          ?        ?  1062.5000  20.4327          ?        ?      325.9        3.1       ?       ? 
1 1 1   22    6   60 o    211.0    4.4    0.0000   0.0000          ?        ?   445.6881  18.5171          ?        ?      211.0        4.4       ?       ? 
1 1 1   22    6   61 o     33.5   14.8    0.0000   0.0000          ?        ?    -5.1082  19.1556          ?        ?       33.5       14.8       ?       ? 
1 1 1   22    6   62 o    111.6    8.9    0.0000   0.0000          ?        ?   125.1502  19.7942          ?        ?      111.6        8.9       ?       ? 
1 1 1   22    6   63 o    276.1    3.8    0.0000   0.0000          ?        ?   763.0333  21.0712          ?        ?      276.1        3.8       ?       ? 
1 1 1   22    6   64 o    494.2    2.8    0.0000   0.0000          ?        ?  2443.6223  27.4564          ?        ?      494.2        2.8       ?       ? 
1 1 1   22    6   65 o     56.9   16.1    0.0000   0.0000          ?        ?    33.8416  19.1556          ?        ?       56.9       16.1       ?       ? 
1 1 1   22    6   66 o    140.6    7.7    0.0000   0.0000          ?        ?   198.5802  21.7097          ?        ?      140.6        7.7       ?       ? 
1 1 1   22    6   67 o    250.1    4.5    0.0000   0.0000          ?        ?   626.3897  22.3483          ?        ?      250.1        4.5       ?       ? 
1 1 1   22    6   68 o    218.7    5.0    0.0000   0.0000          ?        ?   479.5297  21.7097          ?        ?      218.7        5.0       ?       ? 
1 1 1   22    6   69 o     40.7   16.7    0.0000   0.0000          ?        ?     6.3852  21.7097          ?        ?       40.7       16.7       ?       ? 
1 1 1   22    6   70 o    103.0    9.9    0.0000   0.0000          ?        ?   107.2716  20.4327          ?        ?      103.0        9.9       ?       ? 
1 1 1   22    6   71 o    131.8    7.8    0.0000   0.0000          ?        ?   174.9549  20.4327          ?        ?      131.8        7.8       ?       ? 
1 1 1   22    6   72 o     28.5   13.6    0.0000   0.0000          ?        ?   -28.0950  21.7097          ?        ?       28.5       13.6       ?       ? 
1 1 1   22    6   73 o    205.2    5.3    0.0000   0.0000          ?        ?   422.7013  21.7097          ?        ?      205.2        5.3       ?       ? 
1 1 1   22    6   74 o    136.1    7.7    0.0000   0.0000          ?        ?   187.0868  21.0712          ?        ?      136.1        7.7       ?       ? 
1 1 1   22    6   75 o    149.5    6.6    0.0000   0.0000          ?        ?   225.3981  19.7942          ?        ?      149.5        6.6       ?       ? 
1 1 1   22    6   76 o     81.4   12.6    0.0000   0.0000          ?        ?    68.3218  20.4327          ?        ?       81.4       12.6       ?       ? 
1 1 1   22    7    0 o   1119.6    6.0 12536.0957 135.3666 12536.0957 135.3666 12536.0957 135.3666     1119.6      6.0     1119.6        6.0     0.0     0.0 
1 1 1   22    7    1 o   1614.2    5.8    0.0000   0.0000          ?        ? 26060.6211 185.8098          ?        ?     1614.2        5.8       ?       ? 
1 1 1   22    7    2 o   1093.7    4.1    0.0000   0.0000          ?        ? 11963.3408  88.7545          ?        ?     1093.7        4.1       ?       ? 
1 1 1   22    7    3 o    686.7    2.8    0.0000   0.0000          ?        ?  4716.1206  38.3113          ?        ?      686.7        2.8       ?       ? 
1 1 1   22    7    4 o    698.3    2.9    0.0000   0.0000          ?        ?  4877.0283  40.2269          ?        ?      698.3        2.9       ?       ? 
1 1 1   22    7    5 o    274.4    2.1    0.0000   0.0000          ?        ?   752.8170  11.4934          ?        ?      274.4        2.1       ?       ? 
1 1 1   22    7    6 o   1628.3    5.4    0.0000   0.0000          ?        ? 26514.6113 175.5934          ?        ?     1628.3        5.4       ?       ? 
1 1 1   22    7    7 o    820.9    3.0    0.0000   0.0000          ?        ?  6738.3188  49.1662          ?        ?      820.9        3.0       ?       ? 
1 1 1   22    7    8 o    275.0    2.4    0.0000   0.0000          ?        ?   756.0096  13.4090          ?        ?      275.0        2.4       ?       ? 
1 1 1   22    7    9 o    645.3    2.7    0.0000   0.0000          ?        ?  4164.4380  35.1187          ?        ?      645.3        2.7       ?       ? 
1 1 1   22    7   10 o    675.6    2.8    0.0000   0.0000          ?        ?  4564.1523  37.6728          ?        ?      675.6        2.8       ?       ? 
1 1 1   22    7   11 o    885.6    3.2    0.0000   0.0000          ?        ?  7842.9614  56.8284          ?        ?      885.6        3.2       ?       ? 
1 1 1   22    7   12 o    906.1    3.3    0.0000   0.0000          ?        ?  8210.7500  60.6596          ?        ?      906.1        3.3       ?       ? 
1 1 1   22    7   13 o   1073.6    3.9    0.0000   0.0000          ?        ? 11525.9541  83.6463          ?        ?     1073.6        3.9       ?       ? 
1 1 1   22    7   14 o   1297.5    4.5    0.0000   0.0000          ?        ? 16835.8984 116.2109          ?        ?     1297.5        4.5       ?       ? 
1 1 1   22    7   15 o    780.8    2.9    0.0000   0.0000          ?        ?  6095.9658  45.9736          ?        ?      780.8        2.9       ?       ? 
1 1 1   22    7   16 f    482.6    2.2    0.0000   0.0000          ?        ?  2328.6885  21.7097          ?        ?      482.6        2.2       ?       ? 
1 1 1   22    7   17 o    916.5    3.3    0.0000   0.0000          ?        ?  8399.7520  60.6596          ?        ?      916.5        3.3       ?       ? 
1 1 1   22    7   18 o    822.9    3.1    0.0000   0.0000          ?        ?  6771.5220  51.7203          ?        ?      822.9        3.1       ?       ? 
1 1 1   22    7   19 o   1271.2    4.5    0.0000   0.0000          ?        ? 16160.3428 114.9339          ?        ?     1271.2        4.5       ?       ? 
1 1 1   22    7   20 o    579.4    2.6    0.0000   0.0000          ?        ?  3356.7083  30.6490          ?        ?      579.4        2.6       ?       ? 
1 1 1   22    7   21 o     90.7    7.0    0.0000   0.0000          ?        ?    82.3693  12.7704          ?        ?       90.7        7.0       ?       ? 
1 1 1   22    7   22 o   1012.1    3.8    0.0000   0.0000          ?        ? 10243.1641  77.2611          ?        ?     1012.1        3.8       ?       ? 
1 1 1   22    7   23 o    707.2    3.0    0.0000   0.0000          ?        ?  5000.9014  42.7809          ?        ?      707.2        3.0       ?       ? 
1 1 1   22    7   24 o    700.1    3.1    0.0000   0.0000          ?        ?  4901.2920  42.7809          ?        ?      700.1        3.1       ?       ? 
1 1 1   22    7   25 o   1199.3    4.4    0.0000   0.0000          ?        ? 14383.3389 104.7175          ?        ?     1199.3        4.4       ?       ? 
1 1 1   22    7   26 o    425.6    2.6    0.0000   0.0000          ?        ?  1811.4860  21.7097          ?        ?      425.6        2.6       ?       ? 
1 1 1   22    7   27 o   1255.9    4.4    0.0000   0.0000          ?        ? 15774.6768 111.1028          ?        ?     1255.9        4.4       ?       ? 
1 1 1   22    7   28 o    799.5    3.3    0.0000   0.0000          ?        ?  6392.8784  52.3588          ?        ?      799.5        3.3       ?       ? 
1 1 1   22    7   29 o    809.1    3.1    0.0000   0.0000          ?        ?  6546.7627  50.4432          ?        ?      809.1        3.1       ?       ? 
1 1 1   22    7   30 o    185.7    4.0    0.0000   0.0000          ?        ?   344.8017  14.6860          ?        ?      185.7        4.0       ?       ? 
1 1 1   22    7   31 f    983.4    3.7    0.0000   0.0000          ?        ?  9671.0488  73.4300          ?        ?      983.4        3.7       ?       ? 
1 1 1   22    7   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    7   33 f    295.8    2.9    0.0000   0.0000          ?        ?   874.7747  17.2401          ?        ?      295.8        2.9       ?       ? 
1 1 1   22    7   34 o    923.8    3.6    0.0000   0.0000          ?        ?  8534.4795  65.7677          ?        ?      923.8        3.6       ?       ? 
1 1 1   22    7   35 o    225.9    4.1    0.0000   0.0000          ?        ?   510.1788  18.5171          ?        ?      225.9        4.1       ?       ? 
1 1 1   22    7   36 o   1703.8    5.7    0.0000   0.0000          ?        ? 29036.1309 195.3876          ?        ?     1703.8        5.7       ?       ? 
1 1 1   22    7   37 o    194.9    4.8    0.0000   0.0000          ?        ?   379.9204  18.5171          ?        ?      194.9        4.8       ?       ? 
1 1 1   22    7   38 o    114.9    6.9    0.0000   0.0000          ?        ?   132.1740  15.9630          ?        ?      114.9        6.9       ?       ? 
1 1 1   22    7   39 o    426.6    2.7    0.0000   0.0000          ?        ?  1820.4252  22.9868          ?        ?      426.6        2.7       ?       ? 
1 1 1   22    7   40 o    423.0    2.9    0.0000   0.0000          ?        ?  1789.7760  24.9023          ?        ?      423.0        2.9       ?       ? 
1 1 1   22    7   41 o    165.3    5.0    0.0000   0.0000          ?        ?   273.2873  16.6016          ?        ?      165.3        5.0       ?       ? 
1 1 1   22    7   42 o    319.0    3.0    0.0000   0.0000          ?        ?  1017.8034  19.1556          ?        ?      319.0        3.0       ?       ? 
1 1 1   22    7   43 o    322.9    3.0    0.0000   0.0000          ?        ?  1042.7058  19.1556          ?        ?      322.9        3.0       ?       ? 
1 1 1   22    7   44 o    335.2    2.9    0.0000   0.0000          ?        ?  1123.7981  19.1556          ?        ?      335.2        2.9       ?       ? 
1 1 1   22    7   45 o    149.4    6.0    0.0000   0.0000          ?        ?   223.4826  17.8786          ?        ?      149.4        6.0       ?       ? 
1 1 1   22    7   46 o    495.0    2.6    0.0000   0.0000          ?        ?  2450.6460  25.5409          ?        ?      495.0        2.6       ?       ? 
1 1 1   22    7   47 o    472.5    2.6    0.0000   0.0000          ?        ?  2232.9102  24.9023          ?        ?      472.5        2.6       ?       ? 
1 1 1   22    7   48 o    261.2    3.4    0.0000   0.0000          ?        ?   682.5797  17.8786          ?        ?      261.2        3.4       ?       ? 
1 1 1   22    7   49 o    444.1    2.7    0.0000   0.0000          ?        ?  1973.0319  23.6253          ?        ?      444.1        2.7       ?       ? 
1 1 1   22    7   50 o    588.7    2.7    0.0000   0.0000          ?        ?  3466.5342  31.2876          ?        ?      588.7        2.7       ?       ? 
1 1 1   22    7   51 o     43.8   16.1    0.0000   0.0000          ?        ?    15.3245  18.5171          ?        ?       43.8       16.1       ?       ? 
1 1 1   22    7   52 o    392.8    2.8    0.0000   0.0000          ?        ?  1543.3068  22.3483          ?        ?      392.8        2.8       ?       ? 
1 1 1   22    7   53 o    524.4    2.7    0.0000   0.0000          ?        ?  2750.7510  28.7335          ?        ?      524.4        2.7       ?       ? 
1 1 1   22    7   54 o     51.5   15.8    0.0000   0.0000          ?        ?    26.8179  17.8786          ?        ?       51.5       15.8       ?       ? 
1 1 1   22    7   55 o    307.3    3.3    0.0000   0.0000          ?        ?   945.0120  20.4327          ?        ?      307.3        3.3       ?       ? 
1 1 1   22    7   56 o    436.9    2.7    0.0000   0.0000          ?        ?  1909.1797  23.6253          ?        ?      436.9        2.7       ?       ? 
1 1 1   22    7   57 o    455.5    2.7    0.0000   0.0000          ?        ?  2075.1953  24.9023          ?        ?      455.5        2.7       ?       ? 
1 1 1   22    7   58 o     37.7   15.4    0.0000   0.0000          ?        ?     5.1082  18.5171          ?        ?       37.7       15.4       ?       ? 
1 1 1   22    7   59 o    395.3    2.8    0.0000   0.0000          ?        ?  1563.1010  22.3483          ?        ?      395.3        2.8       ?       ? 
1 1 1   22    7   60 o    222.8    4.3    0.0000   0.0000          ?        ?   496.7698  19.1556          ?        ?      222.8        4.3       ?       ? 
1 1 1   22    7   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    7   62 o    357.4    3.1    0.0000   0.0000          ?        ?  1278.3203  22.3483          ?        ?      357.4        3.1       ?       ? 
1 1 1   22    7   63 o     20.3   10.2    0.0000   0.0000          ?        ?   -65.7677  19.7942          ?        ?       20.3       10.2       ?       ? 
1 1 1   22    7   64 o    190.3    5.4    0.0000   0.0000          ?        ?   362.6803  20.4327          ?        ?      190.3        5.4       ?       ? 
1 1 1   22    7   65 o     20.3   10.3    0.0000   0.0000          ?        ?   -75.3456  21.0712          ?        ?       20.3       10.3       ?       ? 
1 1 1   22    7   66 o    229.6    4.7    0.0000   0.0000          ?        ?   528.0574  21.7097          ?        ?      229.6        4.7       ?       ? 
1 1 1   22    7   67 o    562.2    2.8    0.0000   0.0000          ?        ?  3162.5977  31.9261          ?        ?      562.2        2.8       ?       ? 
1 1 1   22    7   68 o     20.7   10.5    0.0000   0.0000          ?        ?   -71.5144  21.0712          ?        ?       20.7       10.5       ?       ? 
1 1 1   22    7   69 o    182.1    6.0    0.0000   0.0000          ?        ?   332.6698  21.7097          ?        ?      182.1        6.0       ?       ? 
1 1 1   22    7   70 o     93.2   11.7    0.0000   0.0000          ?        ?    88.1160  21.7097          ?        ?       93.2       11.7       ?       ? 
1 1 1   22    7   71 o     61.4   17.1    0.0000   0.0000          ?        ?    40.2269  21.7097          ?        ?       61.4       17.1       ?       ? 
1 1 1   22    7   72 o     61.3   16.7    0.0000   0.0000          ?        ?    40.2269  21.0712          ?        ?       61.3       16.7       ?       ? 
1 1 1   22    7   73 o    102.1   10.3    0.0000   0.0000          ?        ?   105.9946  21.0712          ?        ?      102.1       10.3       ?       ? 
1 1 1   22    7   74 o    267.5    4.1    0.0000   0.0000          ?        ?   717.6983  21.7097          ?        ?      267.5        4.1       ?       ? 
1 1 1   22    7   75 o     36.3   15.6    0.0000   0.0000          ?        ?     0.0000  20.4327          ?        ?       36.3       15.6       ?       ? 
1 1 1   22    7   76 o     55.6   17.2    0.0000   0.0000          ?        ?    33.2031  21.0712          ?        ?       55.6       17.2       ?       ? 
1 1 1   22    8    0 o    822.9    4.5 6772.7983  73.4300  6772.7983  73.4300  6772.7983  73.4300      822.9      4.5      822.9        4.5     0.0     0.0 
1 1 1   22    8    1 o    743.4    2.9    0.0000   0.0000          ?        ?  5527.0430  43.4195          ?        ?      743.4        2.9       ?       ? 
1 1 1   22    8    2 o    617.3    2.4    0.0000   0.0000          ?        ?  3810.6970  30.0105          ?        ?      617.3        2.4       ?       ? 
1 1 1   22    8    3 o    548.3    2.3    0.0000   0.0000          ?        ?  3006.7983  25.5409          ?        ?      548.3        2.3       ?       ? 
1 1 1   22    8    4 o    759.5    2.9    0.0000   0.0000          ?        ?  5769.0430  44.0580          ?        ?      759.5        2.9       ?       ? 
1 1 1   22    8    5 o    681.5    2.7    0.0000   0.0000          ?        ?  4644.6064  37.0343          ?        ?      681.5        2.7       ?       ? 
1 1 1   22    8    6 o    326.9    2.7    0.0000   0.0000          ?        ?  1068.8851  17.8786          ?        ?      326.9        2.7       ?       ? 
1 1 1   22    8    7 o    385.3    2.2    0.0000   0.0000          ?        ?  1484.5627  16.6016          ?        ?      385.3        2.2       ?       ? 
1 1 1   22    8    8 o   1488.5    5.2    0.0000   0.0000          ?        ? 22157.3398 155.1608          ?        ?     1488.5        5.2       ?       ? 
1 1 1   22    8    9 o   1096.9    4.1    0.0000   0.0000          ?        ? 12033.5781  89.3930          ?        ?     1096.9        4.1       ?       ? 
1 1 1   22    8   10 o    603.6    2.6    0.0000   0.0000          ?        ?  3643.4043  31.9261          ?        ?      603.6        2.6       ?       ? 
1 1 1   22    8   11 o   1178.0    4.3    0.0000   0.0000          ?        ? 13876.9912 100.2479          ?        ?     1178.0        4.3       ?       ? 
1 1 1   22    8   12 o   1109.9    3.8    0.0000   0.0000          ?        ? 12318.9980  84.9234          ?        ?     1109.9        3.8       ?       ? 
1 1 1   22    8   13 o   1581.8    5.3    0.0000   0.0000          ?        ? 25021.7461 166.6541          ?        ?     1581.8        5.3       ?       ? 
1 1 1   22    8   14 f   1354.7    4.7    0.0000   0.0000          ?        ? 18353.0273 126.4273          ?        ?     1354.7        4.7       ?       ? 
1 1 1   22    8   15 o   1736.6    5.8    0.0000   0.0000          ?        ? 30161.8477 203.0499          ?        ?     1736.6        5.8       ?       ? 
1 1 1   22    8   16 o   1121.1    3.9    0.0000   0.0000          ?        ? 12568.6602  87.4775          ?        ?     1121.1        3.9       ?       ? 
1 1 1   22    8   17 f   1230.6    4.3    0.0000   0.0000          ?        ? 15143.8174 105.9946          ?        ?     1230.6        4.3       ?       ? 
1 1 1   22    8   18 o   1038.0    3.8    0.0000   0.0000          ?        ? 10774.4141  77.8996          ?        ?     1038.0        3.8       ?       ? 
1 1 1   22    8   19 o    922.8    3.3    0.0000   0.0000          ?        ?  8516.6016  61.2981          ?        ?      922.8        3.3       ?       ? 
1 1 1   22    8   20 o   1330.0    4.6    0.0000   0.0000          ?        ? 17690.2422 122.5962          ?        ?     1330.0        4.6       ?       ? 
1 1 1   22    8   21 o   1106.3    3.9    0.0000   0.0000          ?        ? 12240.4600  86.8389          ?        ?     1106.3        3.9       ?       ? 
1 1 1   22    8   22 o    609.0    2.6    0.0000   0.0000          ?        ?  3709.1724  31.9261          ?        ?      609.0        2.6       ?       ? 
1 1 1   22    8   23 o    622.9    2.6    0.0000   0.0000          ?        ?  3880.2959  32.5646          ?        ?      622.9        2.6       ?       ? 
1 1 1   22    8   24 o   1000.0    3.5    0.0000   0.0000          ?        ? 10000.5254  70.8759          ?        ?     1000.0        3.5       ?       ? 
1 1 1   22    8   25 f   1158.7    4.3    0.0000   0.0000          ?        ? 13428.1094 100.2479          ?        ?     1158.7        4.3       ?       ? 
1 1 1   22    8   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    8   27 o    474.2    2.4    0.0000   0.0000          ?        ?  2248.8733  22.9868          ?        ?      474.2        2.4       ?       ? 
1 1 1   22    8   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    8   29 o    198.5    3.7    0.0000   0.0000          ?        ?   393.9678  14.6860          ?        ?      198.5        3.7       ?       ? 
1 1 1   22    8   30 o    433.3    2.9    0.0000   0.0000          ?        ?  1877.8921  25.5409          ?        ?      433.3        2.9       ?       ? 
1 1 1   22    8   31 f    510.1    2.8    0.0000   0.0000          ?        ?  2602.6143  28.7335          ?        ?      510.1        2.8       ?       ? 
1 1 1   22    8   32 o   1088.5    4.0    0.0000   0.0000          ?        ? 11849.6846  87.4775          ?        ?     1088.5        4.0       ?       ? 
1 1 1   22    8   33 o    372.1    2.7    0.0000   0.0000          ?        ?  1384.3149  20.4327          ?        ?      372.1        2.7       ?       ? 
1 1 1   22    8   34 o    835.2    3.4    0.0000   0.0000          ?        ?  6976.4873  56.8284          ?        ?      835.2        3.4       ?       ? 
1 1 1   22    8   35 o    500.5    2.7    0.0000   0.0000          ?        ?  2505.5588  26.8179          ?        ?      500.5        2.7       ?       ? 
1 1 1   22    8   36 o    736.3    2.9    0.0000   0.0000          ?        ?  5421.6870  43.4195          ?        ?      736.3        2.9       ?       ? 
1 1 1   22    8   37 o   1250.8    4.3    0.0000   0.0000          ?        ? 15647.6113 107.2716          ?        ?     1250.8        4.3       ?       ? 
1 1 1   22    8   38 o    532.3    2.6    0.0000   0.0000          ?        ?  2833.7588  27.4564          ?        ?      532.3        2.6       ?       ? 
1 1 1   22    8   39 o    353.7    2.9    0.0000   0.0000          ?        ?  1250.8638  20.4327          ?        ?      353.7        2.9       ?       ? 
1 1 1   22    8   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    8   41 o    281.8    3.2    0.0000   0.0000          ?        ?   794.3209  17.8786          ?        ?      281.8        3.2       ?       ? 
1 1 1   22    8   42 o    234.7    3.7    0.0000   0.0000          ?        ?   551.0442  17.2401          ?        ?      234.7        3.7       ?       ? 
1 1 1   22    8   43 o    472.8    2.6    0.0000   0.0000          ?        ?  2236.1028  24.9023          ?        ?      472.8        2.6       ?       ? 
1 1 1   22    8   44 o    211.4    4.1    0.0000   0.0000          ?        ?   446.9651  17.2401          ?        ?      211.4        4.1       ?       ? 
1 1 1   22    8   45 o    475.2    2.6    0.0000   0.0000          ?        ?  2258.4512  24.9023          ?        ?      475.2        2.6       ?       ? 
1 1 1   22    8   46 o    443.8    2.6    0.0000   0.0000          ?        ?  1969.8392  22.9868          ?        ?      443.8        2.6       ?       ? 
1 1 1   22    8   47 o    365.3    3.0    0.0000   0.0000          ?        ?  1334.5103  21.7097          ?        ?      365.3        3.0       ?       ? 
1 1 1   22    8   48 o    784.9    3.2    0.0000   0.0000          ?        ?  6162.3721  50.4432          ?        ?      784.9        3.2       ?       ? 
1 1 1   22    8   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    8   50 o    169.8    5.3    0.0000   0.0000          ?        ?   288.6118  17.8786          ?        ?      169.8        5.3       ?       ? 
1 1 1   22    8   51 o    155.5    5.7    0.0000   0.0000          ?        ?   241.9997  17.8786          ?        ?      155.5        5.7       ?       ? 
1 1 1   22    8   52 o    430.0    2.7    0.0000   0.0000          ?        ?  1849.1587  23.6253          ?        ?      430.0        2.7       ?       ? 
1 1 1   22    8   53 o    316.0    3.0    0.0000   0.0000          ?        ?   998.6478  19.1556          ?        ?      316.0        3.0       ?       ? 
1 1 1   22    8   54 o    194.8    4.6    0.0000   0.0000          ?        ?   379.9204  17.8786          ?        ?      194.8        4.6       ?       ? 
1 1 1   22    8   55 o     82.9   10.0    0.0000   0.0000          ?        ?    68.9603  16.6016          ?        ?       82.9       10.0       ?       ? 
1 1 1   22    8   56 o    341.6    3.1    0.0000   0.0000          ?        ?  1167.2175  21.0712          ?        ?      341.6        3.1       ?       ? 
1 1 1   22    8   57 o    275.8    3.5    0.0000   0.0000          ?        ?   761.1177  19.1556          ?        ?      275.8        3.5       ?       ? 
1 1 1   22    8   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    8   59 o    276.1    3.6    0.0000   0.0000          ?        ?   763.0333  19.7942          ?        ?      276.1        3.6       ?       ? 
1 1 1   22    8   60 o    211.4    4.7    0.0000   0.0000          ?        ?   447.6036  19.7942          ?        ?      211.4        4.7       ?       ? 
1 1 1   22    8   61 o     94.9   10.4    0.0000   0.0000          ?        ?    90.6701  19.7942          ?        ?       94.9       10.4       ?       ? 
1 1 1   22    8   62 o    276.8    3.8    0.0000   0.0000          ?        ?   766.8644  21.0712          ?        ?      276.8        3.8       ?       ? 
1 1 1   22    8   63 f    359.9    3.1    0.0000   0.0000          ?        ?  1296.1989  22.3483          ?        ?      359.9        3.1       ?       ? 
1 1 1   22    8   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    8   65 f    114.6    9.5    0.0000   0.0000          ?        ?   132.1740  21.7097          ?        ?      114.6        9.5       ?       ? 
1 1 1   22    8   66 o    436.9    2.9    0.0000   0.0000          ?        ?  1909.8182  25.5409          ?        ?      436.9        2.9       ?       ? 
1 1 1   22    8   67 o    407.4    3.0    0.0000   0.0000          ?        ?  1660.7948  24.2638          ?        ?      407.4        3.0       ?       ? 
1 1 1   22    8   68 o    103.7   10.2    0.0000   0.0000          ?        ?   108.5487  21.0712          ?        ?      103.7       10.2       ?       ? 
1 1 1   22    8   69 o    112.2    9.1    0.0000   0.0000          ?        ?   127.0658  20.4327          ?        ?      112.2        9.1       ?       ? 
1 1 1   22    8   70 o    345.0    3.4    0.0000   0.0000          ?        ?  1192.1199  23.6253          ?        ?      345.0        3.4       ?       ? 
1 1 1   22    8   71 o     44.1   16.9    0.0000   0.0000          ?        ?    14.0475  21.0712          ?        ?       44.1       16.9       ?       ? 
1 1 1   22    8   72 o     60.3   17.2    0.0000   0.0000          ?        ?    38.9498  21.7097          ?        ?       60.3       17.2       ?       ? 
1 1 1   22    8   73 o     88.0   12.0    0.0000   0.0000          ?        ?    79.1767  21.0712          ?        ?       88.0       12.0       ?       ? 
1 1 1   22    8   74 o    106.9    9.9    0.0000   0.0000          ?        ?   116.2109  21.0712          ?        ?      106.9        9.9       ?       ? 
1 1 1   22    8   75 o     57.5   16.7    0.0000   0.0000          ?        ?    35.7572  20.4327          ?        ?       57.5       16.7       ?       ? 
1 1 1   22    9    0 o    668.9    3.7 4474.1211  49.1662  4474.1211  49.1662  4474.1211  49.1662      668.9      3.7      668.9        3.7     0.0     0.0 
1 1 1   22    9    1 o    414.7    2.1    0.0000   0.0000          ?        ?  1720.1772  17.2401          ?        ?      414.7        2.1       ?       ? 
1 1 1   22    9    2 o    933.6    3.5    0.0000   0.0000          ?        ?  8716.4590  64.4907          ?        ?      933.6        3.5       ?       ? 
1 1 1   22    9    3 o   1484.7    5.2    0.0000   0.0000          ?        ? 22043.6816 153.8837          ?        ?     1484.7        5.2       ?       ? 
1 1 1   22    9    4 o    915.2    3.4    0.0000   0.0000          ?        ?  8375.4883  62.5751          ?        ?      915.2        3.4       ?       ? 
1 1 1   22    9    5 o    985.0    3.7    0.0000   0.0000          ?        ?  9701.6973  72.1529          ?        ?      985.0        3.7       ?       ? 
1 1 1   22    9    6 o   2600.3    8.7    0.0000   0.0000          ?        ? 67629.0156 454.6274          ?        ?     2600.3        8.7       ?       ? 
1 1 1   22    9    7 o    551.8    2.5    0.0000   0.0000          ?        ?  3045.1096  27.4564          ?        ?      551.8        2.5       ?       ? 
1 1 1   22    9    8 o   1309.5    4.6    0.0000   0.0000          ?        ? 17148.1367 121.3191          ?        ?     1309.5        4.6       ?       ? 
1 1 1   22    9    9 o   1186.5    4.1    0.0000   0.0000          ?        ? 14078.7627  98.3323          ?        ?     1186.5        4.1       ?       ? 
1 1 1   22    9   10 o   1140.8    4.0    0.0000   0.0000          ?        ? 13015.6250  91.3086          ?        ?     1140.8        4.0       ?       ? 
1 1 1   22    9   11 o   1573.0    5.4    0.0000   0.0000          ?        ? 24743.9902 168.5697          ?        ?     1573.0        5.4       ?       ? 
1 1 1   22    9   12 o   1599.8    5.5    0.0000   0.0000          ?        ? 25595.7793 176.8705          ?        ?     1599.8        5.5       ?       ? 
1 1 1   22    9   13 o   1098.9    4.0    0.0000   0.0000          ?        ? 12076.9980  88.1160          ?        ?     1098.9        4.0       ?       ? 
1 1 1   22    9   14 o   1133.1    4.1    0.0000   0.0000          ?        ? 12839.3936  92.5856          ?        ?     1133.1        4.1       ?       ? 
1 1 1   22    9   15 o   1176.7    4.3    0.0000   0.0000          ?        ? 13846.9805 100.8864          ?        ?     1176.7        4.3       ?       ? 
1 1 1   22    9   16 o   1278.5    4.6    0.0000   0.0000          ?        ? 16347.4307 116.8494          ?        ?     1278.5        4.6       ?       ? 
1 1 1   22    9   17 o    914.6    3.6    0.0000   0.0000          ?        ?  8365.9102  65.7677          ?        ?      914.6        3.6       ?       ? 
1 1 1   22    9   18 f    811.2    3.2    0.0000   0.0000          ?        ?  6580.6035  51.7203          ?        ?      811.2        3.2       ?       ? 
1 1 1   22    9   19 o    110.4    4.9    0.0000   0.0000          ?        ?   121.9576  10.8549          ?        ?      110.4        4.9       ?       ? 
1 1 1   22    9   20 o   1428.9    5.0    0.0000   0.0000          ?        ? 20419.9219 144.3059          ?        ?     1428.9        5.0       ?       ? 
1 1 1   22    9   21 o    508.0    2.6    0.0000   0.0000          ?        ?  2580.2659  26.1794          ?        ?      508.0        2.6       ?       ? 
1 1 1   22    9   22 o    903.2    3.4    0.0000   0.0000          ?        ?  8157.7520  61.9366          ?        ?      903.2        3.4       ?       ? 
1 1 1   22    9   23 o     53.9   17.0    0.0000   0.0000          ?        ?    28.7335  20.4327          ?        ?       53.9       17.0       ?       ? 
1 1 1   22    9   24 f   1019.8    3.9    0.0000   0.0000          ?        ? 10401.5176  79.8152          ?        ?     1019.8        3.9       ?       ? 
1 1 1   22    9   25 o   1186.2    4.3    0.0000   0.0000          ?        ? 14071.1006 102.8020          ?        ?     1186.2        4.3       ?       ? 
1 1 1   22    9   26 o     58.7   12.4    0.0000   0.0000          ?        ?    35.7572  14.0475          ?        ?       58.7       12.4       ?       ? 
1 1 1   22    9   27 o    892.4    3.4    0.0000   0.0000          ?        ?  7964.9189  61.2981          ?        ?      892.4        3.4       ?       ? 
1 1 1   22    9   28 o   1302.9    4.6    0.0000   0.0000          ?        ? 16977.0137 120.0421          ?        ?     1302.9        4.6       ?       ? 
1 1 1   22    9   29 o    247.3    3.4    0.0000   0.0000          ?        ?   611.7037  16.6016          ?        ?      247.3        3.4       ?       ? 
1 1 1   22    9   30 o    309.9    2.9    0.0000   0.0000          ?        ?   960.3365  17.8786          ?        ?      309.9        2.9       ?       ? 
1 1 1   22    9   31 o    928.1    3.8    0.0000   0.0000          ?        ?  8613.6572  70.8759          ?        ?      928.1        3.8       ?       ? 
1 1 1   22    9   32 f   1014.2    3.8    0.0000   0.0000          ?        ? 10287.2217  77.8996          ?        ?     1014.2        3.8       ?       ? 
1 1 1   22    9   33 o    851.9    3.3    0.0000   0.0000          ?        ?  7257.4365  56.8284          ?        ?      851.9        3.3       ?       ? 
1 1 1   22    9   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    9   35 o    254.4    3.3    0.0000   0.0000          ?        ?   647.4609  16.6016          ?        ?      254.4        3.3       ?       ? 
1 1 1   22    9   36 o    642.0    2.9    0.0000   0.0000          ?        ?  4121.6572  37.6728          ?        ?      642.0        2.9       ?       ? 
1 1 1   22    9   37 o    758.3    3.2    0.0000   0.0000          ?        ?  5751.1646  47.8891          ?        ?      758.3        3.2       ?       ? 
1 1 1   22    9   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    9   39 o    756.9    3.1    0.0000   0.0000          ?        ?  5729.4546  46.6121          ?        ?      756.9        3.1       ?       ? 
1 1 1   22    9   40 o    879.2    3.4    0.0000   0.0000          ?        ?  7730.5811  60.6596          ?        ?      879.2        3.4       ?       ? 
1 1 1   22    9   41 o    607.1    2.7    0.0000   0.0000          ?        ?  3685.5469  33.2031          ?        ?      607.1        2.7       ?       ? 
1 1 1   22    9   42 f    324.2    3.0    0.0000   0.0000          ?        ?  1051.0066  19.1556          ?        ?      324.2        3.0       ?       ? 
1 1 1   22    9   43 o    536.3    2.7    0.0000   0.0000          ?        ?  2876.5400  28.7335          ?        ?      536.3        2.7       ?       ? 
1 1 1   22    9   44 o    291.6    3.3    0.0000   0.0000          ?        ?   850.5108  19.1556          ?        ?      291.6        3.3       ?       ? 
1 1 1   22    9   45 o    355.7    2.9    0.0000   0.0000          ?        ?  1265.5498  20.4327          ?        ?      355.7        2.9       ?       ? 
1 1 1   22    9   46 o    212.9    4.2    0.0000   0.0000          ?        ?   453.3503  17.8786          ?        ?      212.9        4.2       ?       ? 
1 1 1   22    9   47 o    837.0    3.4    0.0000   0.0000          ?        ?  7007.1367  56.8284          ?        ?      837.0        3.4       ?       ? 
1 1 1   22    9   48 o    108.6    8.2    0.0000   0.0000          ?        ?   118.1265  17.8786          ?        ?      108.6        8.2       ?       ? 
1 1 1   22    9   49 o    558.6    2.8    0.0000   0.0000          ?        ?  3121.0938  31.2876          ?        ?      558.6        2.8       ?       ? 
1 1 1   22    9   50 o    194.5    4.6    0.0000   0.0000          ?        ?   378.6433  17.8786          ?        ?      194.5        4.6       ?       ? 
1 1 1   22    9   51 o    272.5    3.5    0.0000   0.0000          ?        ?   742.6006  19.1556          ?        ?      272.5        3.5       ?       ? 
1 1 1   22    9   52 f    234.8    3.8    0.0000   0.0000          ?        ?   551.6827  17.8786          ?        ?      234.8        3.8       ?       ? 
1 1 1   22    9   53 o    332.4    3.2    0.0000   0.0000          ?        ?  1105.2810  21.0712          ?        ?      332.4        3.2       ?       ? 
1 1 1   22    9   54 o     41.7   15.7    0.0000   0.0000          ?        ?    12.7704  17.8786          ?        ?       41.7       15.7       ?       ? 
1 1 1   22    9   55 o    426.2    2.8    0.0000   0.0000          ?        ?  1817.2325  23.6253          ?        ?      426.2        2.8       ?       ? 
1 1 1   22    9   56 o    121.3    7.9    0.0000   0.0000          ?        ?   147.4985  19.1556          ?        ?      121.3        7.9       ?       ? 
1 1 1   22    9   57 o    219.3    4.4    0.0000   0.0000          ?        ?   481.4453  19.1556          ?        ?      219.3        4.4       ?       ? 
1 1 1   22    9   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    9   59 o    309.3    3.2    0.0000   0.0000          ?        ?   957.1439  19.7942          ?        ?      309.3        3.2       ?       ? 
1 1 1   22    9   60 o    294.1    3.5    0.0000   0.0000          ?        ?   865.8354  20.4327          ?        ?      294.1        3.5       ?       ? 
1 1 1   22    9   61 o    582.3    3.0    0.0000   0.0000          ?        ?  3393.1040  34.4802          ?        ?      582.3        3.0       ?       ? 
1 1 1   22    9   62 f    230.1    4.6    0.0000   0.0000          ?        ?   529.9730  21.0712          ?        ?      230.1        4.6       ?       ? 
1 1 1   22    9   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22    9   64 o    209.4    5.2    0.0000   0.0000          ?        ?   439.3029  21.7097          ?        ?      209.4        5.2       ?       ? 
1 1 1   22    9   65 o    208.8    5.2    0.0000   0.0000          ?        ?   436.7488  21.7097          ?        ?      208.8        5.2       ?       ? 
1 1 1   22    9   66 o    271.3    4.1    0.0000   0.0000          ?        ?   736.8539  22.3483          ?        ?      271.3        4.1       ?       ? 
1 1 1   22    9   67 o    127.5    8.3    0.0000   0.0000          ?        ?   163.4615  21.0712          ?        ?      127.5        8.3       ?       ? 
1 1 1   22    9   68 o    129.9    8.4    0.0000   0.0000          ?        ?   169.8468  21.7097          ?        ?      129.9        8.4       ?       ? 
1 1 1   22    9   69 o    349.7    3.4    0.0000   0.0000          ?        ?  1224.6844  23.6253          ?        ?      349.7        3.4       ?       ? 
1 1 1   22    9   70 o     59.2   17.3    0.0000   0.0000          ?        ?    37.0343  21.7097          ?        ?       59.2       17.3       ?       ? 
1 1 1   22    9   71 o    106.0    9.6    0.0000   0.0000          ?        ?   113.6568  20.4327          ?        ?      106.0        9.6       ?       ? 
1 1 1   22    9   72 o     71.0   14.4    0.0000   0.0000          ?        ?    53.6358  19.7942          ?        ?       71.0       14.4       ?       ? 
1 1 1   22    9   73 o    241.3    4.4    0.0000   0.0000          ?        ?   584.2473  21.0712          ?        ?      241.3        4.4       ?       ? 
1 1 1   22    9   74 o    208.6    5.0    0.0000   0.0000          ?        ?   437.3873  21.0712          ?        ?      208.6        5.0       ?       ? 
1 1 1   22    9   75 o    185.2    5.7    0.0000   0.0000          ?        ?   345.4402  21.0712          ?        ?      185.2        5.7       ?       ? 
1 1 1   22   10    0 o     61.5   16.8   45.3350  17.8786    45.3350  17.8786    45.3350  17.8786       61.5     16.8       61.5       16.8     0.0     0.0 
1 1 1   22   10    1 o    821.6    3.8    0.0000   0.0000          ?        ?  6750.4502  62.5751          ?        ?      821.6        3.8       ?       ? 
1 1 1   22   10    2 o   1267.1    5.0    0.0000   0.0000          ?        ? 16056.9033 127.7043          ?        ?     1267.1        5.0       ?       ? 
1 1 1   22   10    3 o   1274.5    5.1    0.0000   0.0000          ?        ? 16245.2666 128.9814          ?        ?     1274.5        5.1       ?       ? 
1 1 1   22   10    4 o   1814.2    6.8    0.0000   0.0000          ?        ? 32918.9844 245.1923          ?        ?     1814.2        6.8       ?       ? 
1 1 1   22   10    5 o    977.5    3.9    0.0000   0.0000          ?        ?  9554.8379  76.6226          ?        ?      977.5        3.9       ?       ? 
1 1 1   22   10    6 o   1189.3    4.4    0.0000   0.0000          ?        ? 14145.8076 104.7175          ?        ?     1189.3        4.4       ?       ? 
1 1 1   22   10    7 o    678.8    2.8    0.0000   0.0000          ?        ?  4608.2104  38.3113          ?        ?      678.8        2.8       ?       ? 
1 1 1   22   10    8 o   1196.3    4.3    0.0000   0.0000          ?        ? 14312.4619 102.8020          ?        ?     1196.3        4.3       ?       ? 
1 1 1   22   10    9 o   1745.7    5.9    0.0000   0.0000          ?        ? 30477.9160 204.3269          ?        ?     1745.7        5.9       ?       ? 
1 1 1   22   10   10 o    526.7    2.5    0.0000   0.0000          ?        ?  2774.3765  26.1794          ?        ?      526.7        2.5       ?       ? 
1 1 1   22   10   11 o   1294.9    4.6    0.0000   0.0000          ?        ? 16768.8555 118.7650          ?        ?     1294.9        4.6       ?       ? 
1 1 1   22   10   12 o   1699.1    6.1    0.0000   0.0000          ?        ? 28871.3945 208.7966          ?        ?     1699.1        6.1       ?       ? 
1 1 1   22   10   13 o   1846.4    6.5    0.0000   0.0000          ?        ? 34095.1406 240.0841          ?        ?     1846.4        6.5       ?       ? 
1 1 1   22   10   14 o    618.1    2.6    0.0000   0.0000          ?        ?  3820.2749  32.5646          ?        ?      618.1        2.6       ?       ? 
1 1 1   22   10   15 o   1097.9    3.9    0.0000   0.0000          ?        ? 12053.3721  85.5619          ?        ?     1097.9        3.9       ?       ? 
1 1 1   22   10   16 o    250.7    2.5    0.0000   0.0000          ?        ?   628.3053  12.7704          ?        ?      250.7        2.5       ?       ? 
1 1 1   22   10   17 o    533.9    2.4    0.0000   0.0000          ?        ?  2850.9990  25.5409          ?        ?      533.9        2.4       ?       ? 
1 1 1   22   10   18 o    543.3    2.5    0.0000   0.0000          ?        ?  2951.8855  26.8179          ?        ?      543.3        2.5       ?       ? 
1 1 1   22   10   19 o    517.8    2.5    0.0000   0.0000          ?        ?  2681.1523  26.1794          ?        ?      517.8        2.5       ?       ? 
1 1 1   22   10   20 o   1227.9    4.3    0.0000   0.0000          ?        ? 15077.4111 105.3561          ?        ?     1227.9        4.3       ?       ? 
1 1 1   22   10   21 o    506.4    2.5    0.0000   0.0000          ?        ?  2564.9414  24.9023          ?        ?      506.4        2.5       ?       ? 
1 1 1   22   10   22 o    886.6    3.2    0.0000   0.0000          ?        ?  7861.4780  57.4669          ?        ?      886.6        3.2       ?       ? 
1 1 1   22   10   23 o    830.1    3.2    0.0000   0.0000          ?        ?  6890.2866  52.9973          ?        ?      830.1        3.2       ?       ? 
1 1 1   22   10   24 o    861.0    3.3    0.0000   0.0000          ?        ?  7413.8745  57.4669          ?        ?      861.0        3.3       ?       ? 
1 1 1   22   10   25 o   1648.0    5.8    0.0000   0.0000          ?        ? 27163.9883 189.6409          ?        ?     1648.0        5.8       ?       ? 
1 1 1   22   10   26 o    887.5    3.4    0.0000   0.0000          ?        ?  7877.4409  60.6596          ?        ?      887.5        3.4       ?       ? 
1 1 1   22   10   27 o    301.7    2.8    0.0000   0.0000          ?        ?   910.5319  16.6016          ?        ?      301.7        2.8       ?       ? 
1 1 1   22   10   28 o   1293.9    4.5    0.0000   0.0000          ?        ? 16743.9531 117.4880          ?        ?     1293.9        4.5       ?       ? 
1 1 1   22   10   29 o    993.3    3.6    0.0000   0.0000          ?        ?  9867.0752  71.5144          ?        ?      993.3        3.6       ?       ? 
1 1 1   22   10   30 o    865.7    3.3    0.0000   0.0000          ?        ?  7495.6055  57.4669          ?        ?      865.7        3.3       ?       ? 
1 1 1   22   10   31 o    816.8    3.2    0.0000   0.0000          ?        ?  6672.5508  52.3588          ?        ?      816.8        3.2       ?       ? 
1 1 1   22   10   32 o    489.0    2.7    0.0000   0.0000          ?        ?  2391.2634  26.1794          ?        ?      489.0        2.7       ?       ? 
1 1 1   22   10   33 o   1033.8    3.8    0.0000   0.0000          ?        ? 10687.5752  78.5382          ?        ?     1033.8        3.8       ?       ? 
1 1 1   22   10   34 o    329.4    2.8    0.0000   0.0000          ?        ?  1084.8481  18.5171          ?        ?      329.4        2.8       ?       ? 
1 1 1   22   10   35 o    217.9    4.1    0.0000   0.0000          ?        ?   475.0601  17.8786          ?        ?      217.9        4.1       ?       ? 
1 1 1   22   10   36 o   1150.9    4.1    0.0000   0.0000          ?        ? 13247.4082  95.1397          ?        ?     1150.9        4.1       ?       ? 
1 1 1   22   10   37 o    643.4    2.8    0.0000   0.0000          ?        ?  4140.1743  35.7572          ?        ?      643.4        2.8       ?       ? 
1 1 1   22   10   38 o    331.0    2.9    0.0000   0.0000          ?        ?  1095.7031  19.1556          ?        ?      331.0        2.9       ?       ? 
1 1 1   22   10   39 o    548.0    2.9    0.0000   0.0000          ?        ?  3003.6057  31.2876          ?        ?      548.0        2.9       ?       ? 
1 1 1   22   10   40 o    350.9    3.1    0.0000   0.0000          ?        ?  1231.7081  21.7097          ?        ?      350.9        3.1       ?       ? 
1 1 1   22   10   41 o    485.8    2.7    0.0000   0.0000          ?        ?  2360.6145  26.1794          ?        ?      485.8        2.7       ?       ? 
1 1 1   22   10   42 o    123.0    6.5    0.0000   0.0000          ?        ?   151.3296  15.9630          ?        ?      123.0        6.5       ?       ? 
1 1 1   22   10   43 o    182.0    4.4    0.0000   0.0000          ?        ?   331.3927  15.9630          ?        ?      182.0        4.4       ?       ? 
1 1 1   22   10   44 o    152.6    5.4    0.0000   0.0000          ?        ?   233.0604  16.6016          ?        ?      152.6        5.4       ?       ? 
1 1 1   22   10   45 f    671.0    2.9    0.0000   0.0000          ?        ?  4503.4932  38.3113          ?        ?      671.0        2.9       ?       ? 
1 1 1   22   10   46 o    490.3    2.7    0.0000   0.0000          ?        ?  2404.0339  26.8179          ?        ?      490.3        2.7       ?       ? 
1 1 1   22   10   47 o    462.3    2.5    0.0000   0.0000          ?        ?  2137.7703  22.9868          ?        ?      462.3        2.5       ?       ? 
1 1 1   22   10   48 o    355.1    2.9    0.0000   0.0000          ?        ?  1261.0802  20.4327          ?        ?      355.1        2.9       ?       ? 
1 1 1   22   10   49 o    529.6    2.7    0.0000   0.0000          ?        ?  2805.0254  28.0950          ?        ?      529.6        2.7       ?       ? 
1 1 1   22   10   50 f     88.9    9.3    0.0000   0.0000          ?        ?    79.1767  16.6016          ?        ?       88.9        9.3       ?       ? 
1 1 1   22   10   51 o    166.4    5.0    0.0000   0.0000          ?        ?   277.1184  16.6016          ?        ?      166.4        5.0       ?       ? 
1 1 1   22   10   52 o     85.2    9.7    0.0000   0.0000          ?        ?    72.7915  16.6016          ?        ?       85.2        9.7       ?       ? 
1 1 1   22   10   53 o    351.1    3.0    0.0000   0.0000          ?        ?  1232.9854  21.0712          ?        ?      351.1        3.0       ?       ? 
1 1 1   22   10   54 o    268.2    3.6    0.0000   0.0000          ?        ?   719.6138  19.1556          ?        ?      268.2        3.6       ?       ? 
1 1 1   22   10   55 o    381.9    2.8    0.0000   0.0000          ?        ?  1459.0220  21.0712          ?        ?      381.9        2.8       ?       ? 
1 1 1   22   10   56 o     67.6   14.1    0.0000   0.0000          ?        ?    47.8891  18.5171          ?        ?       67.6       14.1       ?       ? 
1 1 1   22   10   57 o    280.2    3.4    0.0000   0.0000          ?        ?   785.3816  19.1556          ?        ?      280.2        3.4       ?       ? 
1 1 1   22   10   58 o    223.8    4.3    0.0000   0.0000          ?        ?   501.2395  19.1556          ?        ?      223.8        4.3       ?       ? 
1 1 1   22   10   59 o    182.4    5.3    0.0000   0.0000          ?        ?   333.3083  19.1556          ?        ?      182.4        5.3       ?       ? 
1 1 1   22   10   60 o    507.8    2.8    0.0000   0.0000          ?        ?  2579.6274  28.7335          ?        ?      507.8        2.8       ?       ? 
1 1 1   22   10   61 o    261.0    4.0    0.0000   0.0000          ?        ?   681.9411  21.0712          ?        ?      261.0        4.0       ?       ? 
1 1 1   22   10   62 o    231.7    4.4    0.0000   0.0000          ?        ?   537.6352  20.4327          ?        ?      231.7        4.4       ?       ? 
1 1 1   22   10   63 o    371.3    3.2    0.0000   0.0000          ?        ?  1379.8452  23.6253          ?        ?      371.3        3.2       ?       ? 
1 1 1   22   10   64 o    199.1    5.3    0.0000   0.0000          ?        ?   397.1605  21.0712          ?        ?      199.1        5.3       ?       ? 
1 1 1   22   10   65 o    161.5    6.3    0.0000   0.0000          ?        ?   261.7939  20.4327          ?        ?      161.5        6.3       ?       ? 
1 1 1   22   10   66 o     46.3   16.7    0.0000   0.0000          ?        ?    18.5171  19.7942          ?        ?       46.3       16.7       ?       ? 
1 1 1   22   10   67 o    261.0    4.3    0.0000   0.0000          ?        ?   682.5797  22.3483          ?        ?      261.0        4.3       ?       ? 
1 1 1   22   10   68 o     22.9   11.4    0.0000   0.0000          ?        ?   -58.7440  21.7097          ?        ?       22.9       11.4       ?       ? 
1 1 1   22   10   69 o    270.6    4.2    0.0000   0.0000          ?        ?   733.6614  22.9868          ?        ?      270.6        4.2       ?       ? 
1 1 1   22   10   70 o    127.8    8.5    0.0000   0.0000          ?        ?   164.7386  21.7097          ?        ?      127.8        8.5       ?       ? 
1 1 1   22   10   71 o     31.7   14.4    0.0000   0.0000          ?        ?   -10.8549  19.7942          ?        ?       31.7       14.4       ?       ? 
1 1 1   22   10   72 o     23.1   11.5    0.0000   0.0000          ?        ?   -49.1662  20.4327          ?        ?       23.1       11.5       ?       ? 
1 1 1   22   10   73 o     25.9   12.6    0.0000   0.0000          ?        ?   -39.5883  21.7097          ?        ?       25.9       12.6       ?       ? 
1 1 1   22   10   74 o    170.6    6.2    0.0000   0.0000          ?        ?   293.0815  21.0712          ?        ?      170.6        6.2       ?       ? 
1 1 1   22   11    0 o    499.8    3.8 2498.5352  38.3113  2498.5352  38.3113  2498.5352  38.3113      499.8      3.8      499.8        3.8     0.0     0.0 
1 1 1   22   11    1 o   1399.5    5.6    0.0000   0.0000          ?        ? 19587.9277 155.7993          ?        ?     1399.5        5.6       ?       ? 
1 1 1   22   11    2 o   1354.6    5.2    0.0000   0.0000          ?        ? 18351.7500 141.1133          ?        ?     1354.6        5.2       ?       ? 
1 1 1   22   11    3 o   1275.3    4.9    0.0000   0.0000          ?        ? 16265.0615 125.1502          ?        ?     1275.3        4.9       ?       ? 
1 1 1   22   11    4 o    996.3    3.7    0.0000   0.0000          ?        ?  9926.4570  74.7070          ?        ?      996.3        3.7       ?       ? 
1 1 1   22   11    5 o    782.4    3.0    0.0000   0.0000          ?        ?  6122.1455  46.6121          ?        ?      782.4        3.0       ?       ? 
1 1 1   22   11    6 o   1219.6    4.3    0.0000   0.0000          ?        ? 14874.3613 104.0790          ?        ?     1219.6        4.3       ?       ? 
1 1 1   22   11    7 o   1392.7    4.8    0.0000   0.0000          ?        ? 19397.0098 133.4510          ?        ?     1392.7        4.8       ?       ? 
1 1 1   22   11    8 o   1160.1    4.3    0.0000   0.0000          ?        ? 13460.0361  98.9709          ?        ?     1160.1        4.3       ?       ? 
1 1 1   22   11    9 o   1140.5    4.0    0.0000   0.0000          ?        ? 13008.6016  91.9471          ?        ?     1140.5        4.0       ?       ? 
1 1 1   22   11   10 o    388.0    2.1    0.0000   0.0000          ?        ?  1505.6340  16.6016          ?        ?      388.0        2.1       ?       ? 
1 1 1   22   11   11 o   1616.8    5.5    0.0000   0.0000          ?        ? 26142.3516 176.2320          ?        ?     1616.8        5.5       ?       ? 
1 1 1   22   11   12 o    680.7    2.8    0.0000   0.0000          ?        ?  4633.1128  38.3113          ?        ?      680.7        2.8       ?       ? 
1 1 1   22   11   13 o   1815.7    6.4    0.0000   0.0000          ?        ? 32972.6172 231.1448          ?        ?     1815.7        6.4       ?       ? 
1 1 1   22   11   14 o   1418.9    5.1    0.0000   0.0000          ?        ? 20133.8633 144.9444          ?        ?     1418.9        5.1       ?       ? 
1 1 1   22   11   15 o   1614.3    5.5    0.0000   0.0000          ?        ? 26062.5371 176.2320          ?        ?     1614.3        5.5       ?       ? 
1 1 1   22   11   16 o    862.0    3.2    0.0000   0.0000          ?        ?  7430.4761  54.9129          ?        ?      862.0        3.2       ?       ? 
1 1 1   22   11   17 o   1297.7    4.6    0.0000   0.0000          ?        ? 16841.0078 118.7650          ?        ?     1297.7        4.6       ?       ? 
1 1 1   22   11   18 o    660.9    2.8    0.0000   0.0000          ?        ?  4368.1265  36.3957          ?        ?      660.9        2.8       ?       ? 
1 1 1   22   11   19 o   1319.2    4.6    0.0000   0.0000          ?        ? 17404.1836 121.3191          ?        ?     1319.2        4.6       ?       ? 
1 1 1   22   11   20 o    188.4    3.1    0.0000   0.0000          ?        ?   355.0180  11.4934          ?        ?      188.4        3.1       ?       ? 
1 1 1   22   11   21 o   1734.8    5.7    0.0000   0.0000          ?        ? 30099.2695 199.2188          ?        ?     1734.8        5.7       ?       ? 
1 1 1   22   11   22 o    896.6    3.3    0.0000   0.0000          ?        ?  8039.6255  60.0210          ?        ?      896.6        3.3       ?       ? 
1 1 1   22   11   23 o    282.5    2.5    0.0000   0.0000          ?        ?   798.1520  14.0475          ?        ?      282.5        2.5       ?       ? 
1 1 1   22   11   24 o   1220.2    4.3    0.0000   0.0000          ?        ? 14890.3242 105.3561          ?        ?     1220.2        4.3       ?       ? 
1 1 1   22   11   25 o   1201.7    4.4    0.0000   0.0000          ?        ? 14442.0820 104.7175          ?        ?     1201.7        4.4       ?       ? 
1 1 1   22   11   26 o    249.4    3.5    0.0000   0.0000          ?        ?   621.9200  17.2401          ?        ?      249.4        3.5       ?       ? 
1 1 1   22   11   27 o    766.0    3.1    0.0000   0.0000          ?        ?  5868.0137  47.2506          ?        ?      766.0        3.1       ?       ? 
1 1 1   22   11   28 o    506.4    2.7    0.0000   0.0000          ?        ?  2564.9414  27.4564          ?        ?      506.4        2.7       ?       ? 
1 1 1   22   11   29 o   1265.1    4.6    0.0000   0.0000          ?        ? 16007.7373 115.5724          ?        ?     1265.1        4.6       ?       ? 
1 1 1   22   11   30 o    617.1    2.8    0.0000   0.0000          ?        ?  3808.7815  35.1187          ?        ?      617.1        2.8       ?       ? 
1 1 1   22   11   31 o    961.5    3.6    0.0000   0.0000          ?        ?  9245.7930  69.5989          ?        ?      961.5        3.6       ?       ? 
1 1 1   22   11   32 o    171.6    4.7    0.0000   0.0000          ?        ?   294.3585  15.9630          ?        ?      171.6        4.7       ?       ? 
1 1 1   22   11   33 o    734.3    3.2    0.0000   0.0000          ?        ?  5391.6768  47.2506          ?        ?      734.3        3.2       ?       ? 
1 1 1   22   11   34 o    651.5    2.8    0.0000   0.0000          ?        ?  4244.2534  36.3957          ?        ?      651.5        2.8       ?       ? 
1 1 1   22   11   35 o    713.4    3.0    0.0000   0.0000          ?        ?  5090.2944  42.1424          ?        ?      713.4        3.0       ?       ? 
1 1 1   22   11   36 o    592.6    2.9    0.0000   0.0000          ?        ?  3511.8689  34.4802          ?        ?      592.6        2.9       ?       ? 
1 1 1   22   11   37 o    644.2    2.8    0.0000   0.0000          ?        ?  4150.3906  36.3957          ?        ?      644.2        2.8       ?       ? 
1 1 1   22   11   38 o    564.1    2.7    0.0000   0.0000          ?        ?  3182.3918  30.0105          ?        ?      564.1        2.7       ?       ? 
1 1 1   22   11   39 o    947.2    3.6    0.0000   0.0000          ?        ?  8973.7832  68.9603          ?        ?      947.2        3.6       ?       ? 
1 1 1   22   11   40 o    651.2    2.9    0.0000   0.0000          ?        ?  4241.0605  37.6728          ?        ?      651.2        2.9       ?       ? 
1 1 1   22   11   41 o    632.3    2.8    0.0000   0.0000          ?        ?  3998.4226  35.7572          ?        ?      632.3        2.8       ?       ? 
1 1 1   22   11   42 o    325.9    3.0    0.0000   0.0000          ?        ?  1062.5000  19.7942          ?        ?      325.9        3.0       ?       ? 
1 1 1   22   11   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   11   44 o    567.5    2.8    0.0000   0.0000          ?        ?  3221.3416  31.2876          ?        ?      567.5        2.8       ?       ? 
1 1 1   22   11   45 o    334.7    3.1    0.0000   0.0000          ?        ?  1120.6055  21.0712          ?        ?      334.7        3.1       ?       ? 
1 1 1   22   11   46 o    572.2    2.7    0.0000   0.0000          ?        ?  3274.9775  31.2876          ?        ?      572.2        2.7       ?       ? 
1 1 1   22   11   47 f    111.5    7.4    0.0000   0.0000          ?        ?   124.5117  16.6016          ?        ?      111.5        7.4       ?       ? 
1 1 1   22   11   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   11   49 o    118.2    7.0    0.0000   0.0000          ?        ?   139.8362  16.6016          ?        ?      118.2        7.0       ?       ? 
1 1 1   22   11   50 o    286.1    3.3    0.0000   0.0000          ?        ?   818.5847  19.1556          ?        ?      286.1        3.3       ?       ? 
1 1 1   22   11   51 o    126.2    6.8    0.0000   0.0000          ?        ?   159.6304  17.2401          ?        ?      126.2        6.8       ?       ? 
1 1 1   22   11   52 o    167.0    5.4    0.0000   0.0000          ?        ?   279.0340  17.8786          ?        ?      167.0        5.4       ?       ? 
1 1 1   22   11   53 o    325.4    3.0    0.0000   0.0000          ?        ?  1059.3074  19.7942          ?        ?      325.4        3.0       ?       ? 
1 1 1   22   11   54 f    104.0    8.3    0.0000   0.0000          ?        ?   108.5487  17.2401          ?        ?      104.0        8.3       ?       ? 
1 1 1   22   11   55 o     40.1   15.6    0.0000   0.0000          ?        ?    10.2163  17.8786          ?        ?       40.1       15.6       ?       ? 
1 1 1   22   11   56 o    365.7    3.0    0.0000   0.0000          ?        ?  1337.7028  21.7097          ?        ?      365.7        3.0       ?       ? 
1 1 1   22   11   57 o    180.2    5.1    0.0000   0.0000          ?        ?   325.0075  18.5171          ?        ?      180.2        5.1       ?       ? 
1 1 1   22   11   58 o     69.5   13.3    0.0000   0.0000          ?        ?    50.4432  17.8786          ?        ?       69.5       13.3       ?       ? 
1 1 1   22   11   59 o    470.9    2.7    0.0000   0.0000          ?        ?  2218.8625  25.5409          ?        ?      470.9        2.7       ?       ? 
1 1 1   22   11   60 o    111.6    8.6    0.0000   0.0000          ?        ?   125.1502  19.1556          ?        ?      111.6        8.6       ?       ? 
1 1 1   22   11   61 f     53.5   16.0    0.0000   0.0000          ?        ?    29.3720  18.5171          ?        ?       53.5       16.0       ?       ? 
1 1 1   22   11   62 o    198.6    5.3    0.0000   0.0000          ?        ?   395.2449  21.0712          ?        ?      198.6        5.3       ?       ? 
1 1 1   22   11   63 o    149.0    7.1    0.0000   0.0000          ?        ?   222.8441  21.0712          ?        ?      149.0        7.1       ?       ? 
1 1 1   22   11   64 o    324.7    3.6    0.0000   0.0000          ?        ?  1055.4763  23.6253          ?        ?      324.7        3.6       ?       ? 
1 1 1   22   11   65 o     61.6   16.3    0.0000   0.0000          ?        ?    40.2269  20.4327          ?        ?       61.6       16.3       ?       ? 
1 1 1   22   11   66 o    198.0    5.6    0.0000   0.0000          ?        ?   393.3293  22.3483          ?        ?      198.0        5.6       ?       ? 
1 1 1   22   11   67 f    252.2    4.4    0.0000   0.0000          ?        ?   637.2446  22.3483          ?        ?      252.2        4.4       ?       ? 
1 1 1   22   11   68 o     33.7   15.1    0.0000   0.0000          ?        ?    -8.9393  21.0712          ?        ?       33.7       15.1       ?       ? 
1 1 1   22   11   69 o    132.2    8.7    0.0000   0.0000          ?        ?   176.2320  22.9868          ?        ?      132.2        8.7       ?       ? 
1 1 1   22   11   70 f     59.9   16.9    0.0000   0.0000          ?        ?    38.3113  21.0712          ?        ?       59.9       16.9       ?       ? 
1 1 1   22   11   71 o    217.7    5.0    0.0000   0.0000          ?        ?   475.6986  21.7097          ?        ?      217.7        5.0       ?       ? 
1 1 1   22   11   72 o    175.6    6.4    0.0000   0.0000          ?        ?   310.3215  22.3483          ?        ?      175.6        6.4       ?       ? 
1 1 1   22   11   73 o     50.1   17.0    0.0000   0.0000          ?        ?    24.9023  20.4327          ?        ?       50.1       17.0       ?       ? 
1 1 1   22   11   74 o    162.1    6.5    0.0000   0.0000          ?        ?   264.9865  21.0712          ?        ?      162.1        6.5       ?       ? 
1 1 1   22   12    0 o   3331.0   37.0 111231.1016 2466.6089 111231.1016 2466.6089 111231.1016 2466.6089     3331.0     37.0     3331.0       37.0     0.0     0.0 
1 1 1   22   12    1 o   1495.7    5.8    0.0000   0.0000          ?        ? 22372.5215 174.9549          ?        ?     1495.7        5.8       ?       ? 
1 1 1   22   12    2 o    623.7    3.0    0.0000   0.0000          ?        ?  3889.8738  37.0343          ?        ?      623.7        3.0       ?       ? 
1 1 1   22   12    3 o   1795.7    6.3    0.0000   0.0000          ?        ? 32247.8965 226.6752          ?        ?     1795.7        6.3       ?       ? 
1 1 1   22   12    4 o    520.1    2.4    0.0000   0.0000          ?        ?  2704.7776  24.9023          ?        ?      520.1        2.4       ?       ? 
1 1 1   22   12    5 f   1307.1    4.6    0.0000   0.0000          ?        ? 17085.5625 121.3191          ?        ?     1307.1        4.6       ?       ? 
1 1 1   22   12    6 o   2000.7    6.7    0.0000   0.0000          ?        ? 40034.0273 266.9020          ?        ?     2000.7        6.7       ?       ? 
1 1 1   22   12    7 o    784.1    3.1    0.0000   0.0000          ?        ?  6148.9634  48.5276          ?        ?      784.1        3.1       ?       ? 
1 1 1   22   12    8 o     91.1    4.9    0.0000   0.0000          ?        ?    83.0078   8.9393          ?        ?       91.1        4.9       ?       ? 
1 1 1   22   12    9 o    575.1    2.5    0.0000   0.0000          ?        ?  3306.9036  28.7335          ?        ?      575.1        2.5       ?       ? 
1 1 1   22   12   10 o    991.9    3.6    0.0000   0.0000          ?        ?  9838.9795  72.1529          ?        ?      991.9        3.6       ?       ? 
1 1 1   22   12   11 o    231.2    3.2    0.0000   0.0000          ?        ?   534.4426  14.6860          ?        ?      231.2        3.2       ?       ? 
1 1 1   22   12   12 o    891.7    3.3    0.0000   0.0000          ?        ?  7952.1484  59.3825          ?        ?      891.7        3.3       ?       ? 
1 1 1   22   12   13 o    469.8    2.2    0.0000   0.0000          ?        ?  2206.7307  21.0712          ?        ?      469.8        2.2       ?       ? 
1 1 1   22   12   14 o    213.7    2.7    0.0000   0.0000          ?        ?   456.5430  11.4934          ?        ?      213.7        2.7       ?       ? 
1 1 1   22   12   15 o   1403.5    4.8    0.0000   0.0000          ?        ? 19699.0312 136.0051          ?        ?     1403.5        4.8       ?       ? 
1 1 1   22   12   16 o   1716.9    5.9    0.0000   0.0000          ?        ? 29483.0977 203.0499          ?        ?     1716.9        5.9       ?       ? 
1 1 1   22   12   17 o   1758.5    6.2    0.0000   0.0000          ?        ? 30929.9883 219.6514          ?        ?     1758.5        6.2       ?       ? 
1 1 1   22   12   18 o    737.1    2.9    0.0000   0.0000          ?        ?  5433.8188  42.7809          ?        ?      737.1        2.9       ?       ? 
1 1 1   22   12   19 f    800.9    3.1    0.0000   0.0000          ?        ?  6413.9497  49.8047          ?        ?      800.9        3.1       ?       ? 
1 1 1   22   12   20 o    826.9    3.6    0.0000   0.0000          ?        ?  6837.9282  58.7440          ?        ?      826.9        3.6       ?       ? 
1 1 1   22   12   21 o   1451.1    5.3    0.0000   0.0000          ?        ? 21059.0820 153.8837          ?        ?     1451.1        5.3       ?       ? 
1 1 1   22   12   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   12   23 o    121.2    5.3    0.0000   0.0000          ?        ?   146.8600  12.7704          ?        ?      121.2        5.3       ?       ? 
1 1 1   22   12   24 o    758.9    3.1    0.0000   0.0000          ?        ?  5758.8267  47.2506          ?        ?      758.9        3.1       ?       ? 
1 1 1   22   12   25 o    920.0    3.4    0.0000   0.0000          ?        ?  8464.8809  63.2136          ?        ?      920.0        3.4       ?       ? 
1 1 1   22   12   26 o    538.3    2.7    0.0000   0.0000          ?        ?  2898.2495  29.3720          ?        ?      538.3        2.7       ?       ? 
1 1 1   22   12   27 f    899.7    3.4    0.0000   0.0000          ?        ?  8094.5386  61.9366          ?        ?      899.7        3.4       ?       ? 
1 1 1   22   12   28 o   1068.3    3.9    0.0000   0.0000          ?        ? 11413.5742  83.0078          ?        ?     1068.3        3.9       ?       ? 
1 1 1   22   12   29 o    293.7    3.3    0.0000   0.0000          ?        ?   862.6428  19.1556          ?        ?      293.7        3.3       ?       ? 
1 1 1   22   12   30 o    836.6    3.4    0.0000   0.0000          ?        ?  7000.1128  57.4669          ?        ?      836.6        3.4       ?       ? 
1 1 1   22   12   31 o    316.7    2.7    0.0000   0.0000          ?        ?  1003.1175  17.2401          ?        ?      316.7        2.7       ?       ? 
1 1 1   22   12   32 o    518.5    2.8    0.0000   0.0000          ?        ?  2688.8147  28.7335          ?        ?      518.5        2.8       ?       ? 
1 1 1   22   12   33 o    242.5    3.4    0.0000   0.0000          ?        ?   588.0784  16.6016          ?        ?      242.5        3.4       ?       ? 
1 1 1   22   12   34 o    766.6    3.2    0.0000   0.0000          ?        ?  5876.9531  49.8047          ?        ?      766.6        3.2       ?       ? 
1 1 1   22   12   35 o    663.7    2.9    0.0000   0.0000          ?        ?  4405.1606  38.3113          ?        ?      663.7        2.9       ?       ? 
1 1 1   22   12   36 o    759.6    3.2    0.0000   0.0000          ?        ?  5770.3198  47.8891          ?        ?      759.6        3.2       ?       ? 
1 1 1   22   12   37 o    740.6    3.2    0.0000   0.0000          ?        ?  5485.5391  47.2506          ?        ?      740.6        3.2       ?       ? 
1 1 1   22   12   38 o    601.5    2.8    0.0000   0.0000          ?        ?  3617.8633  33.8416          ?        ?      601.5        2.8       ?       ? 
1 1 1   22   12   39 o    429.1    2.8    0.0000   0.0000          ?        ?  1841.4963  23.6253          ?        ?      429.1        2.8       ?       ? 
1 1 1   22   12   40 o    809.7    3.2    0.0000   0.0000          ?        ?  6556.9785  51.0817          ?        ?      809.7        3.2       ?       ? 
1 1 1   22   12   41 o    247.9    3.6    0.0000   0.0000          ?        ?   614.8964  17.8786          ?        ?      247.9        3.6       ?       ? 
1 1 1   22   12   42 o    550.3    2.8    0.0000   0.0000          ?        ?  3028.5081  31.2876          ?        ?      550.3        2.8       ?       ? 
1 1 1   22   12   43 o    778.8    3.2    0.0000   0.0000          ?        ?  6066.5938  49.1662          ?        ?      778.8        3.2       ?       ? 
1 1 1   22   12   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   12   45 o    879.0    3.4    0.0000   0.0000          ?        ?  7728.6660  59.3825          ?        ?      879.0        3.4       ?       ? 
1 1 1   22   12   46 o    280.7    3.3    0.0000   0.0000          ?        ?   787.9357  18.5171          ?        ?      280.7        3.3       ?       ? 
1 1 1   22   12   47 o    189.7    4.5    0.0000   0.0000          ?        ?   360.1262  17.2401          ?        ?      189.7        4.5       ?       ? 
1 1 1   22   12   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   12   49 o     74.8   11.1    0.0000   0.0000          ?        ?    56.1899  16.6016          ?        ?       74.8       11.1       ?       ? 
1 1 1   22   12   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   12   51 o     19.3    9.7    0.0000   0.0000          ?        ?   -54.2743  17.2401          ?        ?       19.3        9.7       ?       ? 
1 1 1   22   12   52 o    291.7    3.3    0.0000   0.0000          ?        ?   851.1494  19.1556          ?        ?      291.7        3.3       ?       ? 
1 1 1   22   12   53 o     32.8   14.2    0.0000   0.0000          ?        ?    -2.5541  17.2401          ?        ?       32.8       14.2       ?       ? 
1 1 1   22   12   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   12   55 o    270.9    3.5    0.0000   0.0000          ?        ?   734.2999  19.1556          ?        ?      270.9        3.5       ?       ? 
1 1 1   22   12   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   12   57 o    205.2    4.7    0.0000   0.0000          ?        ?   421.4243  19.1556          ?        ?      205.2        4.7       ?       ? 
1 1 1   22   12   58 o    374.0    3.0    0.0000   0.0000          ?        ?  1399.6394  22.3483          ?        ?      374.0        3.0       ?       ? 
1 1 1   22   12   59 o    214.1    4.8    0.0000   0.0000          ?        ?   459.0970  20.4327          ?        ?      214.1        4.8       ?       ? 
1 1 1   22   12   60 o     74.2   13.9    0.0000   0.0000          ?        ?    57.4669  19.7942          ?        ?       74.2       13.9       ?       ? 
1 1 1   22   12   61 o    196.9    5.2    0.0000   0.0000          ?        ?   388.2211  20.4327          ?        ?      196.9        5.2       ?       ? 
1 1 1   22   12   62 o    257.8    4.1    0.0000   0.0000          ?        ?   665.3395  21.0712          ?        ?      257.8        4.1       ?       ? 
1 1 1   22   12   63 o    136.0    7.3    0.0000   0.0000          ?        ?   185.8098  19.7942          ?        ?      136.0        7.3       ?       ? 
1 1 1   22   12   64 o    201.0    5.4    0.0000   0.0000          ?        ?   404.8227  21.7097          ?        ?      201.0        5.4       ?       ? 
1 1 1   22   12   65 o     73.5   14.4    0.0000   0.0000          ?        ?    56.8284  20.4327          ?        ?       73.5       14.4       ?       ? 
1 1 1   22   12   66 o     29.4   13.8    0.0000   0.0000          ?        ?   -20.4327  20.4327          ?        ?       29.4       13.8       ?       ? 
1 1 1   22   12   67 o    263.8    4.1    0.0000   0.0000          ?        ?   697.2656  21.7097          ?        ?      263.8        4.1       ?       ? 
1 1 1   22   12   68 o    236.1    4.6    0.0000   0.0000          ?        ?   558.7064  21.7097          ?        ?      236.1        4.6       ?       ? 
1 1 1   22   12   69 o    121.9    8.6    0.0000   0.0000          ?        ?   150.0526  21.0712          ?        ?      121.9        8.6       ?       ? 
1 1 1   22   12   70 o     24.4   12.0    0.0000   0.0000          ?        ?   -41.5039  20.4327          ?        ?       24.4       12.0       ?       ? 
1 1 1   22   12   71 o     61.1   16.7    0.0000   0.0000          ?        ?    40.2269  21.0712          ?        ?       61.1       16.7       ?       ? 
1 1 1   22   12   72 o     72.9   14.5    0.0000   0.0000          ?        ?    56.8284  20.4327          ?        ?       72.9       14.5       ?       ? 
1 1 1   22   12   73 o     89.6   11.8    0.0000   0.0000          ?        ?    82.3693  21.0712          ?        ?       89.6       11.8       ?       ? 
1 1 1   22   12   74 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   13    0 o    249.8    3.6  624.4742  17.8786   624.4742  17.8786   624.4742  17.8786      249.8      3.6      249.8        3.6     0.0     0.0 
1 1 1   22   13    1 o   1600.2    6.2    0.0000   0.0000          ?        ? 25610.4629 197.9417          ?        ?     1600.2        6.2       ?       ? 
1 1 1   22   13    2 o    924.0    3.9    0.0000   0.0000          ?        ?  8537.6729  71.5144          ?        ?      924.0        3.9       ?       ? 
1 1 1   22   13    3 o    216.6    2.4    0.0000   0.0000          ?        ?   469.3134  10.2163          ?        ?      216.6        2.4       ?       ? 
1 1 1   22   13    4 o   1334.6    5.4    0.0000   0.0000          ?        ? 17814.1133 143.0288          ?        ?     1334.6        5.4       ?       ? 
1 1 1   22   13    5 o   1313.9    5.1    0.0000   0.0000          ?        ? 17265.6250 134.7281          ?        ?     1313.9        5.1       ?       ? 
1 1 1   22   13    6 o   1391.0    5.1    0.0000   0.0000          ?        ? 19350.3984 141.1133          ?        ?     1391.0        5.1       ?       ? 
1 1 1   22   13    7 o   1462.2    5.3    0.0000   0.0000          ?        ? 21382.8125 155.7993          ?        ?     1462.2        5.3       ?       ? 
1 1 1   22   13    8 o    596.8    2.6    0.0000   0.0000          ?        ?  3562.3123  30.6490          ?        ?      596.8        2.6       ?       ? 
1 1 1   22   13    9 o    423.0    2.2    0.0000   0.0000          ?        ?  1789.1377  18.5171          ?        ?      423.0        2.2       ?       ? 
1 1 1   22   13   10 o   1073.9    3.8    0.0000   0.0000          ?        ? 11533.6162  82.3693          ?        ?     1073.9        3.8       ?       ? 
1 1 1   22   13   11 o    686.8    2.6    0.0000   0.0000          ?        ?  4717.3975  36.3957          ?        ?      686.8        2.6       ?       ? 
1 1 1   22   13   12 o    337.6    2.4    0.0000   0.0000          ?        ?  1139.7611  15.9630          ?        ?      337.6        2.4       ?       ? 
1 1 1   22   13   13 f    797.8    3.1    0.0000   0.0000          ?        ?  6365.4224  49.1662          ?        ?      797.8        3.1       ?       ? 
1 1 1   22   13   14 o   1058.2    3.9    0.0000   0.0000          ?        ? 11198.3926  81.7308          ?        ?     1058.2        3.9       ?       ? 
1 1 1   22   13   15 o    636.4    2.8    0.0000   0.0000          ?        ?  4050.7812  35.7572          ?        ?      636.4        2.8       ?       ? 
1 1 1   22   13   16 o   1391.8    4.6    0.0000   0.0000          ?        ? 19371.4688 128.3428          ?        ?     1391.8        4.6       ?       ? 
1 1 1   22   13   17 o   1591.6    5.8    0.0000   0.0000          ?        ? 25337.1777 185.8098          ?        ?     1591.6        5.8       ?       ? 
1 1 1   22   13   18 o   1230.8    4.3    0.0000   0.0000          ?        ? 15148.9258 106.6331          ?        ?     1230.8        4.3       ?       ? 
1 1 1   22   13   19 o    547.4    2.5    0.0000   0.0000          ?        ?  2996.5820  27.4564          ?        ?      547.4        2.5       ?       ? 
1 1 1   22   13   20 o   1294.8    4.6    0.0000   0.0000          ?        ? 16766.3008 119.4035          ?        ?     1294.8        4.6       ?       ? 
1 1 1   22   13   21 o   1279.7    4.5    0.0000   0.0000          ?        ? 16378.7188 114.9339          ?        ?     1279.7        4.5       ?       ? 
1 1 1   22   13   22 o    391.2    2.7    0.0000   0.0000          ?        ?  1530.5364  21.0712          ?        ?      391.2        2.7       ?       ? 
1 1 1   22   13   23 o   1176.8    4.1    0.0000   0.0000          ?        ? 13850.1729  95.7782          ?        ?     1176.8        4.1       ?       ? 
1 1 1   22   13   24 o    437.9    2.6    0.0000   0.0000          ?        ?  1917.4803  22.3483          ?        ?      437.9        2.6       ?       ? 
1 1 1   22   13   25 o    575.4    2.6    0.0000   0.0000          ?        ?  3311.3730  30.0105          ?        ?      575.4        2.6       ?       ? 
1 1 1   22   13   26 o   1159.5    4.0    0.0000   0.0000          ?        ? 13445.3496  93.8627          ?        ?     1159.5        4.0       ?       ? 
1 1 1   22   13   27 o    930.8    3.5    0.0000   0.0000          ?        ?  8665.3770  64.4907          ?        ?      930.8        3.5       ?       ? 
1 1 1   22   13   28 o    394.5    2.4    0.0000   0.0000          ?        ?  1556.7157  19.1556          ?        ?      394.5        2.4       ?       ? 
1 1 1   22   13   29 o    987.3    3.7    0.0000   0.0000          ?        ?  9747.6709  72.7915          ?        ?      987.3        3.7       ?       ? 
1 1 1   22   13   30 o    533.2    2.6    0.0000   0.0000          ?        ?  2842.6982  27.4564          ?        ?      533.2        2.6       ?       ? 
1 1 1   22   13   31 o    470.4    2.7    0.0000   0.0000          ?        ?  2213.1160  25.5409          ?        ?      470.4        2.7       ?       ? 
1 1 1   22   13   32 o    980.9    3.7    0.0000   0.0000          ?        ?  9621.8828  72.1529          ?        ?      980.9        3.7       ?       ? 
1 1 1   22   13   33 o    748.3    3.0    0.0000   0.0000          ?        ?  5599.8345  44.6965          ?        ?      748.3        3.0       ?       ? 
1 1 1   22   13   34 f    875.2    3.5    0.0000   0.0000          ?        ?  7660.3438  61.2981          ?        ?      875.2        3.5       ?       ? 
1 1 1   22   13   35 o    750.6    3.1    0.0000   0.0000          ?        ?  5634.3149  45.9736          ?        ?      750.6        3.1       ?       ? 
1 1 1   22   13   36 o    448.4    2.6    0.0000   0.0000          ?        ?  2010.7046  22.9868          ?        ?      448.4        2.6       ?       ? 
1 1 1   22   13   37 o    178.1    4.8    0.0000   0.0000          ?        ?   317.3452  17.2401          ?        ?      178.1        4.8       ?       ? 
1 1 1   22   13   38 o     23.1   11.3    0.0000   0.0000          ?        ?   -32.5646  17.2401          ?        ?       23.1       11.3       ?       ? 
1 1 1   22   13   39 o    869.1    3.3    0.0000   0.0000          ?        ?  7554.9878  57.4669          ?        ?      869.1        3.3       ?       ? 
1 1 1   22   13   40 o    702.8    2.9    0.0000   0.0000          ?        ?  4940.2417  40.8654          ?        ?      702.8        2.9       ?       ? 
1 1 1   22   13   41 o     30.7   13.5    0.0000   0.0000          ?        ?    -4.4697  15.9630          ?        ?       30.7       13.5       ?       ? 
1 1 1   22   13   42 o    422.7    2.6    0.0000   0.0000          ?        ?  1787.2220  21.7097          ?        ?      422.7        2.6       ?       ? 
1 1 1   22   13   43 o    385.7    2.6    0.0000   0.0000          ?        ?  1487.7554  19.7942          ?        ?      385.7        2.6       ?       ? 
1 1 1   22   13   44 o    143.6    5.6    0.0000   0.0000          ?        ?   206.2425  15.9630          ?        ?      143.6        5.6       ?       ? 
1 1 1   22   13   45 o    494.2    2.6    0.0000   0.0000          ?        ?  2442.3452  26.1794          ?        ?      494.2        2.6       ?       ? 
1 1 1   22   13   46 o    542.6    2.7    0.0000   0.0000          ?        ?  2944.8618  29.3720          ?        ?      542.6        2.7       ?       ? 
1 1 1   22   13   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   13   48 o    444.1    2.5    0.0000   0.0000          ?        ?  1972.3933  22.3483          ?        ?      444.1        2.5       ?       ? 
1 1 1   22   13   49 o    315.1    3.0    0.0000   0.0000          ?        ?   992.9011  19.1556          ?        ?      315.1        3.0       ?       ? 
1 1 1   22   13   50 o     57.5   15.3    0.0000   0.0000          ?        ?    34.4802  17.8786          ?        ?       57.5       15.3       ?       ? 
1 1 1   22   13   51 o    465.6    2.7    0.0000   0.0000          ?        ?  2168.4194  25.5409          ?        ?      465.6        2.7       ?       ? 
1 1 1   22   13   52 o    294.8    3.2    0.0000   0.0000          ?        ?   869.6664  19.1556          ?        ?      294.8        3.2       ?       ? 
1 1 1   22   13   53 o    263.3    3.5    0.0000   0.0000          ?        ?   693.4344  18.5171          ?        ?      263.3        3.5       ?       ? 
1 1 1   22   13   54 o    357.5    2.9    0.0000   0.0000          ?        ?  1278.3203  21.0712          ?        ?      357.5        2.9       ?       ? 
1 1 1   22   13   55 o    142.3    6.5    0.0000   0.0000          ?        ?   203.0499  18.5171          ?        ?      142.3        6.5       ?       ? 
1 1 1   22   13   56 f    253.5    3.9    0.0000   0.0000          ?        ?   642.9913  19.7942          ?        ?      253.5        3.9       ?       ? 
1 1 1   22   13   57 o    289.3    3.6    0.0000   0.0000          ?        ?   837.7404  21.0712          ?        ?      289.3        3.6       ?       ? 
1 1 1   22   13   58 o     98.9    9.7    0.0000   0.0000          ?        ?    98.3323  19.1556          ?        ?       98.9        9.7       ?       ? 
1 1 1   22   13   59 o    115.2    8.9    0.0000   0.0000          ?        ?   133.4510  20.4327          ?        ?      115.2        8.9       ?       ? 
1 1 1   22   13   60 o     85.3   11.6    0.0000   0.0000          ?        ?    73.4300  19.7942          ?        ?       85.3       11.6       ?       ? 
1 1 1   22   13   61 o    123.5    8.3    0.0000   0.0000          ?        ?   153.2452  20.4327          ?        ?      123.5        8.3       ?       ? 
1 1 1   22   13   62 o     24.1   11.9    0.0000   0.0000          ?        ?   -40.2269  19.7942          ?        ?       24.1       11.9       ?       ? 
1 1 1   22   13   63 o    141.5    7.0    0.0000   0.0000          ?        ?   201.1343  19.7942          ?        ?      141.5        7.0       ?       ? 
1 1 1   22   13   64 f     72.2   14.7    0.0000   0.0000          ?        ?    54.9129  20.4327          ?        ?       72.2       14.7       ?       ? 
1 1 1   22   13   65 o    286.0    3.8    0.0000   0.0000          ?        ?   819.2233  21.7097          ?        ?      286.0        3.8       ?       ? 
1 1 1   22   13   66 o     23.7   11.8    0.0000   0.0000          ?        ?   -49.1662  21.0712          ?        ?       23.7       11.8       ?       ? 
1 1 1   22   13   67 o     26.7   12.9    0.0000   0.0000          ?        ?   -33.2031  21.0712          ?        ?       26.7       12.9       ?       ? 
1 1 1   22   13   68 o     81.5   12.9    0.0000   0.0000          ?        ?    67.6833  21.0712          ?        ?       81.5       12.9       ?       ? 
1 1 1   22   13   69 o    216.9    5.0    0.0000   0.0000          ?        ?   471.8675  21.7097          ?        ?      216.9        5.0       ?       ? 
1 1 1   22   13   70 o    121.8    8.9    0.0000   0.0000          ?        ?   150.0526  21.7097          ?        ?      121.8        8.9       ?       ? 
1 1 1   22   13   71 o     60.1   16.9    0.0000   0.0000          ?        ?    38.9498  21.0712          ?        ?       60.1       16.9       ?       ? 
1 1 1   22   13   72 o     29.2   13.8    0.0000   0.0000          ?        ?   -22.3483  21.0712          ?        ?       29.2       13.8       ?       ? 
1 1 1   22   13   73 o    149.2    7.1    0.0000   0.0000          ?        ?   224.7596  21.0712          ?        ?      149.2        7.1       ?       ? 
1 1 1   22   14    0 o    935.1    6.0 8746.4697 112.3798  8746.4697 112.3798  8746.4697 112.3798      935.1      6.0      935.1        6.0     0.0     0.0 
1 1 1   22   14    1 o    705.8    3.3    0.0000   0.0000          ?        ?  4981.7456  46.6121          ?        ?      705.8        3.3       ?       ? 
1 1 1   22   14    2 o   1311.4    5.2    0.0000   0.0000          ?        ? 17200.4961 137.2822          ?        ?     1311.4        5.2       ?       ? 
1 1 1   22   14    3 o   1260.9    5.5    0.0000   0.0000          ?        ? 15900.4648 137.9207          ?        ?     1260.9        5.5       ?       ? 
1 1 1   22   14    4 o    962.6    3.7    0.0000   0.0000          ?        ?  9266.2256  72.1529          ?        ?      962.6        3.7       ?       ? 
1 1 1   22   14    5 o   1618.6    5.7    0.0000   0.0000          ?        ? 26201.0957 184.5327          ?        ?     1618.6        5.7       ?       ? 
1 1 1   22   14    6 o    745.9    3.0    0.0000   0.0000          ?        ?  5564.0776  44.6965          ?        ?      745.9        3.0       ?       ? 
1 1 1   22   14    7 o    362.7    2.3    0.0000   0.0000          ?        ?  1315.3545  16.6016          ?        ?      362.7        2.3       ?       ? 
1 1 1   22   14    8 o   1065.7    4.0    0.0000   0.0000          ?        ? 11358.0234  84.9234          ?        ?     1065.7        4.0       ?       ? 
1 1 1   22   14    9 f   1190.0    4.2    0.0000   0.0000          ?        ? 14161.7705 100.8864          ?        ?     1190.0        4.2       ?       ? 
1 1 1   22   14   10 o   1466.0    5.0    0.0000   0.0000          ?        ? 21492.6387 146.2215          ?        ?     1466.0        5.0       ?       ? 
1 1 1   22   14   11 o    527.3    2.5    0.0000   0.0000          ?        ?  2780.7617  26.8179          ?        ?      527.3        2.5       ?       ? 
1 1 1   22   14   12 o    473.9    2.2    0.0000   0.0000          ?        ?  2245.6807  21.0712          ?        ?      473.9        2.2       ?       ? 
1 1 1   22   14   13 o   1020.8    3.8    0.0000   0.0000          ?        ? 10421.3115  77.8996          ?        ?     1020.8        3.8       ?       ? 
1 1 1   22   14   14 o    197.0    3.2    0.0000   0.0000          ?        ?   388.2211  12.7704          ?        ?      197.0        3.2       ?       ? 
1 1 1   22   14   15 o     83.0    5.8    0.0000   0.0000          ?        ?    68.9603   9.5778          ?        ?       83.0        5.8       ?       ? 
1 1 1   22   14   16 o   1340.8    4.7    0.0000   0.0000          ?        ? 17979.4922 127.0658          ?        ?     1340.8        4.7       ?       ? 
1 1 1   22   14   17 o   1480.8    5.3    0.0000   0.0000          ?        ? 21929.3867 157.0763          ?        ?     1480.8        5.3       ?       ? 
1 1 1   22   14   18 o   1447.0    5.1    0.0000   0.0000          ?        ? 20940.9551 148.1370          ?        ?     1447.0        5.1       ?       ? 
1 1 1   22   14   19 o    384.8    2.4    0.0000   0.0000          ?        ?  1480.7316  18.5171          ?        ?      384.8        2.4       ?       ? 
1 1 1   22   14   20 o     58.7   11.8    0.0000   0.0000          ?        ?    35.7572  13.4090          ?        ?       58.7       11.8       ?       ? 
1 1 1   22   14   21 o    216.6    4.0    0.0000   0.0000          ?        ?   469.3134  17.2401          ?        ?      216.6        4.0       ?       ? 
1 1 1   22   14   22 o    172.5    3.9    0.0000   0.0000          ?        ?   297.5511  13.4090          ?        ?      172.5        3.9       ?       ? 
1 1 1   22   14   23 o    756.9    3.0    0.0000   0.0000          ?        ?  5729.4546  45.9736          ?        ?      756.9        3.0       ?       ? 
1 1 1   22   14   24 o    180.4    4.2    0.0000   0.0000          ?        ?   325.6460  15.3245          ?        ?      180.4        4.2       ?       ? 
1 1 1   22   14   25 o    733.3    2.9    0.0000   0.0000          ?        ?  5378.2676  42.7809          ?        ?      733.3        2.9       ?       ? 
1 1 1   22   14   26 o   1264.7    4.4    0.0000   0.0000          ?        ? 15995.6055 110.4642          ?        ?     1264.7        4.4       ?       ? 
1 1 1   22   14   27 o    518.7    2.6    0.0000   0.0000          ?        ?  2690.7300  26.8179          ?        ?      518.7        2.6       ?       ? 
1 1 1   22   14   28 o    311.4    2.7    0.0000   0.0000          ?        ?   969.9143  16.6016          ?        ?      311.4        2.7       ?       ? 
1 1 1   22   14   29 o    428.7    2.5    0.0000   0.0000          ?        ?  1838.3037  21.7097          ?        ?      428.7        2.5       ?       ? 
1 1 1   22   14   30 o   1036.1    3.9    0.0000   0.0000          ?        ? 10736.7412  79.8152          ?        ?     1036.1        3.9       ?       ? 
1 1 1   22   14   31 f   1221.5    4.3    0.0000   0.0000          ?        ? 14924.1660 104.0790          ?        ?     1221.5        4.3       ?       ? 
1 1 1   22   14   32 o    257.8    3.1    0.0000   0.0000          ?        ?   664.7010  15.9630          ?        ?      257.8        3.1       ?       ? 
1 1 1   22   14   33 o    538.8    3.0    0.0000   0.0000          ?        ?  2903.3579  31.9261          ?        ?      538.8        3.0       ?       ? 
1 1 1   22   14   34 o    483.5    2.8    0.0000   0.0000          ?        ?  2337.6277  26.8179          ?        ?      483.5        2.8       ?       ? 
1 1 1   22   14   35 o   1187.9    4.1    0.0000   0.0000          ?        ? 14113.2441  97.6938          ?        ?     1187.9        4.1       ?       ? 
1 1 1   22   14   36 o    463.0    2.6    0.0000   0.0000          ?        ?  2143.5171  24.2638          ?        ?      463.0        2.6       ?       ? 
1 1 1   22   14   37 o    439.1    2.7    0.0000   0.0000          ?        ?  1928.3353  23.6253          ?        ?      439.1        2.7       ?       ? 
1 1 1   22   14   38 o    408.2    2.7    0.0000   0.0000          ?        ?  1666.5415  21.7097          ?        ?      408.2        2.7       ?       ? 
1 1 1   22   14   39 o    368.1    2.7    0.0000   0.0000          ?        ?  1354.9429  19.7942          ?        ?      368.1        2.7       ?       ? 
1 1 1   22   14   40 o    446.7    2.5    0.0000   0.0000          ?        ?  1995.3801  22.3483          ?        ?      446.7        2.5       ?       ? 
1 1 1   22   14   41 o    207.9    3.8    0.0000   0.0000          ?        ?   432.2791  15.9630          ?        ?      207.9        3.8       ?       ? 
1 1 1   22   14   42 o    719.3    3.0    0.0000   0.0000          ?        ?  5175.2178  43.4195          ?        ?      719.3        3.0       ?       ? 
1 1 1   22   14   43 o    171.5    4.7    0.0000   0.0000          ?        ?   294.3585  15.9630          ?        ?      171.5        4.7       ?       ? 
1 1 1   22   14   44 o    172.1    4.8    0.0000   0.0000          ?        ?   296.2740  16.6016          ?        ?      172.1        4.8       ?       ? 
1 1 1   22   14   45 o    511.1    2.6    0.0000   0.0000          ?        ?  2612.8306  26.1794          ?        ?      511.1        2.6       ?       ? 
1 1 1   22   14   46 o     85.9    9.7    0.0000   0.0000          ?        ?    74.0685  16.6016          ?        ?       85.9        9.7       ?       ? 
1 1 1   22   14   47 o    398.6    2.9    0.0000   0.0000          ?        ?  1589.2803  22.9868          ?        ?      398.6        2.9       ?       ? 
1 1 1   22   14   48 o    150.3    5.5    0.0000   0.0000          ?        ?   226.0367  16.6016          ?        ?      150.3        5.5       ?       ? 
1 1 1   22   14   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   14   50 o     26.4   12.4    0.0000   0.0000          ?        ?   -17.2401  16.6016          ?        ?       26.4       12.4       ?       ? 
1 1 1   22   14   51 o    116.8    7.4    0.0000   0.0000          ?        ?   136.6436  17.2401          ?        ?      116.8        7.4       ?       ? 
1 1 1   22   14   52 o    377.6    3.0    0.0000   0.0000          ?        ?  1426.4573  22.3483          ?        ?      377.6        3.0       ?       ? 
1 1 1   22   14   53 o     26.7   12.6    0.0000   0.0000          ?        ?   -21.0712  17.8786          ?        ?       26.7       12.6       ?       ? 
1 1 1   22   14   54 o    369.8    2.8    0.0000   0.0000          ?        ?  1368.3518  21.0712          ?        ?      369.8        2.8       ?       ? 
1 1 1   22   14   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   14   56 o    236.9    4.2    0.0000   0.0000          ?        ?   561.8990  19.7942          ?        ?      236.9        4.2       ?       ? 
1 1 1   22   14   57 o     21.8   10.8    0.0000   0.0000          ?        ?   -46.6121  18.5171          ?        ?       21.8       10.8       ?       ? 
1 1 1   22   14   58 o     28.8   13.5    0.0000   0.0000          ?        ?   -22.9868  20.4327          ?        ?       28.8       13.5       ?       ? 
1 1 1   22   14   59 f    353.0    3.3    0.0000   0.0000          ?        ?  1247.0327  23.6253          ?        ?      353.0        3.3       ?       ? 
1 1 1   22   14   60 o     74.0   14.8    0.0000   0.0000          ?        ?    57.4669  21.0712          ?        ?       74.0       14.8       ?       ? 
1 1 1   22   14   61 o    324.9    3.3    0.0000   0.0000          ?        ?  1056.7533  21.7097          ?        ?      324.9        3.3       ?       ? 
1 1 1   22   14   62 o    602.4    2.9    0.0000   0.0000          ?        ?  3631.2725  35.1187          ?        ?      602.4        2.9       ?       ? 
1 1 1   22   14   63 o    146.4    7.0    0.0000   0.0000          ?        ?   215.1818  20.4327          ?        ?      146.4        7.0       ?       ? 
1 1 1   22   14   64 o    128.5    8.2    0.0000   0.0000          ?        ?   166.0156  21.0712          ?        ?      128.5        8.2       ?       ? 
1 1 1   22   14   65 f    124.9    8.4    0.0000   0.0000          ?        ?   157.0763  21.0712          ?        ?      124.9        8.4       ?       ? 
1 1 1   22   14   66 o     37.5   15.8    0.0000   0.0000          ?        ?     1.9156  20.4327          ?        ?       37.5       15.8       ?       ? 
1 1 1   22   14   67 o    126.8    8.3    0.0000   0.0000          ?        ?   162.1845  21.0712          ?        ?      126.8        8.3       ?       ? 
1 1 1   22   14   68 o    116.3    8.8    0.0000   0.0000          ?        ?   136.6436  20.4327          ?        ?      116.3        8.8       ?       ? 
1 1 1   22   14   69 f    164.3    6.4    0.0000   0.0000          ?        ?   271.3717  21.0712          ?        ?      164.3        6.4       ?       ? 
1 1 1   22   14   70 o    134.2    8.1    0.0000   0.0000          ?        ?   181.9787  21.7097          ?        ?      134.2        8.1       ?       ? 
1 1 1   22   14   71 o    231.6    4.5    0.0000   0.0000          ?        ?   538.2737  21.0712          ?        ?      231.6        4.5       ?       ? 
1 1 1   22   14   72 o    104.1    9.8    0.0000   0.0000          ?        ?   110.4642  20.4327          ?        ?      104.1        9.8       ?       ? 
1 1 1   22   15    0 f   1435.3    8.0 20605.0938 229.8678 20605.0938 229.8678 20605.0938 229.8678     1435.3      8.0     1435.3        8.0     0.0     0.0 
1 1 1   22   15    1 o    424.7    2.5    0.0000   0.0000          ?        ?  1803.8236  21.0712          ?        ?      424.7        2.5       ?       ? 
1 1 1   22   15    2 o    984.1    4.3    0.0000   0.0000          ?        ?  9685.7344  84.2849          ?        ?      984.1        4.3       ?       ? 
1 1 1   22   15    3 o    115.0    6.4    0.0000   0.0000          ?        ?   132.1740  14.6860          ?        ?      115.0        6.4       ?       ? 
1 1 1   22   15    4 o   1662.8    6.2    0.0000   0.0000          ?        ? 27654.3711 205.6040          ?        ?     1662.8        6.2       ?       ? 
1 1 1   22   15    5 o    918.8    3.5    0.0000   0.0000          ?        ?  8443.1719  64.4907          ?        ?      918.8        3.5       ?       ? 
1 1 1   22   15    6 o   1186.5    4.4    0.0000   0.0000          ?        ? 14079.4023 104.0790          ?        ?     1186.5        4.4       ?       ? 
1 1 1   22   15    7 o   1385.5    4.9    0.0000   0.0000          ?        ? 19199.0684 135.3666          ?        ?     1385.5        4.9       ?       ? 
1 1 1   22   15    8 o   1251.4    4.2    0.0000   0.0000          ?        ? 15660.3818 105.9946          ?        ?     1251.4        4.2       ?       ? 
1 1 1   22   15    9 o    567.7    2.5    0.0000   0.0000          ?        ?  3223.2571  28.0950          ?        ?      567.7        2.5       ?       ? 
1 1 1   22   15   10 o   1134.4    4.1    0.0000   0.0000          ?        ? 12870.6797  91.9471          ?        ?     1134.4        4.1       ?       ? 
1 1 1   22   15   11 o    448.0    2.4    0.0000   0.0000          ?        ?  2007.5120  21.0712          ?        ?      448.0        2.4       ?       ? 
1 1 1   22   15   12 o    742.1    3.0    0.0000   0.0000          ?        ?  5507.8872  44.6965          ?        ?      742.1        3.0       ?       ? 
1 1 1   22   15   13 o    324.9    2.3    0.0000   0.0000          ?        ?  1055.4763  14.6860          ?        ?      324.9        2.3       ?       ? 
1 1 1   22   15   14 o     91.8    5.2    0.0000   0.0000          ?        ?    84.2849   9.5778          ?        ?       91.8        5.2       ?       ? 
1 1 1   22   15   15 o   1394.1    4.9    0.0000   0.0000          ?        ? 19437.8750 137.9207          ?        ?     1394.1        4.9       ?       ? 
1 1 1   22   15   16 o   1304.1    4.7    0.0000   0.0000          ?        ? 17008.3008 123.8732          ?        ?     1304.1        4.7       ?       ? 
1 1 1   22   15   17 o    527.8    3.0    0.0000   0.0000          ?        ?  2785.8699  31.2876          ?        ?      527.8        3.0       ?       ? 
1 1 1   22   15   18 o   2061.9    6.9    0.0000   0.0000          ?        ? 42524.2617 283.5036          ?        ?     2061.9        6.9       ?       ? 
1 1 1   22   15   19 o    615.3    2.8    0.0000   0.0000          ?        ?  3785.7949  34.4802          ?        ?      615.3        2.8       ?       ? 
1 1 1   22   15   20 o    653.5    2.8    0.0000   0.0000          ?        ?  4270.4326  37.0343          ?        ?      653.5        2.8       ?       ? 
1 1 1   22   15   21 o   1686.9    5.7    0.0000   0.0000          ?        ? 28460.8223 193.4720          ?        ?     1686.9        5.7       ?       ? 
1 1 1   22   15   22 o    603.2    2.6    0.0000   0.0000          ?        ?  3638.9348  31.2876          ?        ?      603.2        2.6       ?       ? 
1 1 1   22   15   23 o    790.3    3.0    0.0000   0.0000          ?        ?  6245.3799  47.8891          ?        ?      790.3        3.0       ?       ? 
1 1 1   22   15   24 o    701.8    2.9    0.0000   0.0000          ?        ?  4924.9170  40.2269          ?        ?      701.8        2.9       ?       ? 
1 1 1   22   15   25 o    475.4    2.4    0.0000   0.0000          ?        ?  2259.7280  22.9868          ?        ?      475.4        2.4       ?       ? 
1 1 1   22   15   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   15   27 o    876.1    3.3    0.0000   0.0000          ?        ?  7675.6685  58.1055          ?        ?      876.1        3.3       ?       ? 
1 1 1   22   15   28 o    738.1    3.0    0.0000   0.0000          ?        ?  5448.5049  44.6965          ?        ?      738.1        3.0       ?       ? 
1 1 1   22   15   29 o    864.6    3.3    0.0000   0.0000          ?        ?  7475.8115  57.4669          ?        ?      864.6        3.3       ?       ? 
1 1 1   22   15   30 o    313.3    3.1    0.0000   0.0000          ?        ?   981.4077  19.1556          ?        ?      313.3        3.1       ?       ? 
1 1 1   22   15   31 o   1041.0    3.8    0.0000   0.0000          ?        ? 10838.9043  79.1767          ?        ?     1041.0        3.8       ?       ? 
1 1 1   22   15   32 o    434.4    2.6    0.0000   0.0000          ?        ?  1886.8314  22.3483          ?        ?      434.4        2.6       ?       ? 
1 1 1   22   15   33 o    426.0    2.7    0.0000   0.0000          ?        ?  1815.3169  22.9868          ?        ?      426.0        2.7       ?       ? 
1 1 1   22   15   34 o    582.5    2.6    0.0000   0.0000          ?        ?  3393.7424  30.0105          ?        ?      582.5        2.6       ?       ? 
1 1 1   22   15   35 o    255.1    3.3    0.0000   0.0000          ?        ?   650.6536  16.6016          ?        ?      255.1        3.3       ?       ? 
1 1 1   22   15   36 o    123.8    6.4    0.0000   0.0000          ?        ?   153.2452  15.9630          ?        ?      123.8        6.4       ?       ? 
1 1 1   22   15   37 o    205.1    3.7    0.0000   0.0000          ?        ?   420.7858  15.3245          ?        ?      205.1        3.7       ?       ? 
1 1 1   22   15   38 o    604.7    2.7    0.0000   0.0000          ?        ?  3657.4519  32.5646          ?        ?      604.7        2.7       ?       ? 
1 1 1   22   15   39 o    766.3    3.0    0.0000   0.0000          ?        ?  5872.4834  45.3350          ?        ?      766.3        3.0       ?       ? 
1 1 1   22   15   40 o    519.2    2.6    0.0000   0.0000          ?        ?  2695.8384  26.8179          ?        ?      519.2        2.6       ?       ? 
1 1 1   22   15   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   15   42 f    117.4    6.8    0.0000   0.0000          ?        ?   137.9207  15.9630          ?        ?      117.4        6.8       ?       ? 
1 1 1   22   15   43 o    147.5    5.4    0.0000   0.0000          ?        ?   217.7359  15.9630          ?        ?      147.5        5.4       ?       ? 
1 1 1   22   15   44 o    441.0    2.5    0.0000   0.0000          ?        ?  1944.9369  22.3483          ?        ?      441.0        2.5       ?       ? 
1 1 1   22   15   45 o    321.8    2.8    0.0000   0.0000          ?        ?  1035.6820  17.8786          ?        ?      321.8        2.8       ?       ? 
1 1 1   22   15   46 o    104.7    7.6    0.0000   0.0000          ?        ?   109.8257  15.9630          ?        ?      104.7        7.6       ?       ? 
1 1 1   22   15   47 o    574.4    2.7    0.0000   0.0000          ?        ?  3300.5186  31.2876          ?        ?      574.4        2.7       ?       ? 
1 1 1   22   15   48 o    378.3    2.9    0.0000   0.0000          ?        ?  1431.5654  21.7097          ?        ?      378.3        2.9       ?       ? 
1 1 1   22   15   49 o    441.5    2.6    0.0000   0.0000          ?        ?  1950.0450  22.9868          ?        ?      441.5        2.6       ?       ? 
1 1 1   22   15   50 o     20.6   10.3    0.0000   0.0000          ?        ?   -45.9736  17.2401          ?        ?       20.6       10.3       ?       ? 
1 1 1   22   15   51 o    149.8    5.8    0.0000   0.0000          ?        ?   224.7596  17.2401          ?        ?      149.8        5.8       ?       ? 
1 1 1   22   15   52 o     57.4   14.9    0.0000   0.0000          ?        ?    34.4802  17.2401          ?        ?       57.4       14.9       ?       ? 
1 1 1   22   15   53 o    206.9    4.3    0.0000   0.0000          ?        ?   428.4480  17.8786          ?        ?      206.9        4.3       ?       ? 
1 1 1   22   15   54 o    255.6    3.7    0.0000   0.0000          ?        ?   653.8461  19.1556          ?        ?      255.6        3.7       ?       ? 
1 1 1   22   15   55 o    400.6    2.9    0.0000   0.0000          ?        ?  1605.2433  22.9868          ?        ?      400.6        2.9       ?       ? 
1 1 1   22   15   56 o    292.4    3.6    0.0000   0.0000          ?        ?   855.6190  21.0712          ?        ?      292.4        3.6       ?       ? 
1 1 1   22   15   57 o    360.8    3.2    0.0000   0.0000          ?        ?  1302.5841  22.9868          ?        ?      360.8        3.2       ?       ? 
1 1 1   22   15   58 o    552.4    2.9    0.0000   0.0000          ?        ?  3052.7720  31.9261          ?        ?      552.4        2.9       ?       ? 
1 1 1   22   15   59 o    305.1    3.8    0.0000   0.0000          ?        ?   931.6030  22.9868          ?        ?      305.1        3.8       ?       ? 
1 1 1   22   15   60 o     77.8   12.7    0.0000   0.0000          ?        ?    61.2981  19.7942          ?        ?       77.8       12.7       ?       ? 
1 1 1   22   15   61 f    287.8    3.6    0.0000   0.0000          ?        ?   828.8011  20.4327          ?        ?      287.8        3.6       ?       ? 
1 1 1   22   15   62 o    196.0    5.4    0.0000   0.0000          ?        ?   385.0285  21.0712          ?        ?      196.0        5.4       ?       ? 
1 1 1   22   15   63 o    279.5    3.9    0.0000   0.0000          ?        ?   782.1890  21.7097          ?        ?      279.5        3.9       ?       ? 
1 1 1   22   15   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   15   65 o    220.6    4.9    0.0000   0.0000          ?        ?   487.8305  21.7097          ?        ?      220.6        4.9       ?       ? 
1 1 1   22   15   66 o    157.8    7.1    0.0000   0.0000          ?        ?   250.3005  22.3483          ?        ?      157.8        7.1       ?       ? 
1 1 1   22   15   67 o    201.2    5.2    0.0000   0.0000          ?        ?   406.0997  21.0712          ?        ?      201.2        5.2       ?       ? 
1 1 1   22   15   68 o    185.5    5.7    0.0000   0.0000          ?        ?   345.4402  21.0712          ?        ?      185.5        5.7       ?       ? 
1 1 1   22   15   69 o     27.9   13.3    0.0000   0.0000          ?        ?   -25.5409  20.4327          ?        ?       27.9       13.3       ?       ? 
1 1 1   22   15   70 o    358.4    3.3    0.0000   0.0000          ?        ?  1286.6211  23.6253          ?        ?      358.4        3.3       ?       ? 
1 1 1   22   15   71 o    290.2    4.0    0.0000   0.0000          ?        ?   844.7642  22.9868          ?        ?      290.2        4.0       ?       ? 
1 1 1   22   15   72 o     49.1   17.0    0.0000   0.0000          ?        ?    23.6253  20.4327          ?        ?       49.1       17.0       ?       ? 
1 1 1   22   16    0 o   1322.5    7.0 17493.5762 186.4483 17493.5762 186.4483 17493.5762 186.4483     1322.5      7.0     1322.5        7.0     0.0     0.0 
1 1 1   22   16    1 o   1483.4    5.5    0.0000   0.0000          ?        ? 22007.9238 162.8230          ?        ?     1483.4        5.5       ?       ? 
1 1 1   22   16    2 o   1064.7    4.1    0.0000   0.0000          ?        ? 11335.6748  87.4775          ?        ?     1064.7        4.1       ?       ? 
1 1 1   22   16    3 o   1632.1    6.3    0.0000   0.0000          ?        ? 26641.0371 205.6040          ?        ?     1632.1        6.3       ?       ? 
1 1 1   22   16    4 f    282.3    2.6    0.0000   0.0000          ?        ?   796.8750  14.6860          ?        ?      282.3        2.6       ?       ? 
1 1 1   22   16    5 o    533.2    2.8    0.0000   0.0000          ?        ?  2842.6982  30.0105          ?        ?      533.2        2.8       ?       ? 
1 1 1   22   16    6 o   1314.2    4.9    0.0000   0.0000          ?        ? 17272.6484 128.3428          ?        ?     1314.2        4.9       ?       ? 
1 1 1   22   16    7 o    811.7    3.3    0.0000   0.0000          ?        ?  6588.2666  52.9973          ?        ?      811.7        3.3       ?       ? 
1 1 1   22   16    8 o    290.2    2.1    0.0000   0.0000          ?        ?   842.2100  12.1319          ?        ?      290.2        2.1       ?       ? 
1 1 1   22   16    9 o   2012.2    6.8    0.0000   0.0000          ?        ? 40499.5117 274.5643          ?        ?     2012.2        6.8       ?       ? 
1 1 1   22   16   10 o    202.5    2.5    0.0000   0.0000          ?        ?   409.9309  10.2163          ?        ?      202.5        2.5       ?       ? 
1 1 1   22   16   11 f     43.9   12.5    0.0000   0.0000          ?        ?    19.7942  11.4934          ?        ?       43.9       12.5       ?       ? 
1 1 1   22   16   12 o    170.6    3.4    0.0000   0.0000          ?        ?   291.1659  11.4934          ?        ?      170.6        3.4       ?       ? 
1 1 1   22   16   13 o    560.0    2.7    0.0000   0.0000          ?        ?  3136.4182  30.0105          ?        ?      560.0        2.7       ?       ? 
1 1 1   22   16   14 o    492.2    2.3    0.0000   0.0000          ?        ?  2422.5510  22.3483          ?        ?      492.2        2.3       ?       ? 
1 1 1   22   16   15 o    155.4    3.9    0.0000   0.0000          ?        ?   241.3612  12.1319          ?        ?      155.4        3.9       ?       ? 
1 1 1   22   16   16 o   1423.7    5.1    0.0000   0.0000          ?        ? 20270.5078 144.9444          ?        ?     1423.7        5.1       ?       ? 
1 1 1   22   16   17 o   1410.1    4.9    0.0000   0.0000          ?        ? 19884.8398 137.9207          ?        ?     1410.1        4.9       ?       ? 
1 1 1   22   16   18 o   1050.4    3.8    0.0000   0.0000          ?        ? 11034.2920  80.4537          ?        ?     1050.4        3.8       ?       ? 
1 1 1   22   16   19 o    651.0    2.6    0.0000   0.0000          ?        ?  4238.5063  34.4802          ?        ?      651.0        2.6       ?       ? 
1 1 1   22   16   20 o    680.7    2.9    0.0000   0.0000          ?        ?  4633.7515  38.9498          ?        ?      680.7        2.9       ?       ? 
1 1 1   22   16   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   16   22 o     68.7   10.2    0.0000   0.0000          ?        ?    47.2506  14.0475          ?        ?       68.7       10.2       ?       ? 
1 1 1   22   16   23 o    384.1    2.5    0.0000   0.0000          ?        ?  1475.6235  19.1556          ?        ?      384.1        2.5       ?       ? 
1 1 1   22   16   24 o    480.5    2.4    0.0000   0.0000          ?        ?  2308.8943  22.9868          ?        ?      480.5        2.4       ?       ? 
1 1 1   22   16   25 o    477.1    2.5    0.0000   0.0000          ?        ?  2276.3296  23.6253          ?        ?      477.1        2.5       ?       ? 
1 1 1   22   16   26 o    176.9    4.0    0.0000   0.0000          ?        ?   312.8756  14.0475          ?        ?      176.9        4.0       ?       ? 
1 1 1   22   16   27 o     57.6   12.6    0.0000   0.0000          ?        ?    34.4802  14.0475          ?        ?       57.6       12.6       ?       ? 
1 1 1   22   16   28 o    500.0    2.4    0.0000   0.0000          ?        ?  2499.8123  24.2638          ?        ?      500.0        2.4       ?       ? 
1 1 1   22   16   29 o    542.8    2.6    0.0000   0.0000          ?        ?  2946.1387  28.0950          ?        ?      542.8        2.6       ?       ? 
1 1 1   22   16   30 o    427.8    2.5    0.0000   0.0000          ?        ?  1830.0031  21.7097          ?        ?      427.8        2.5       ?       ? 
1 1 1   22   16   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   16   32 o    929.2    3.5    0.0000   0.0000          ?        ?  8635.3662  64.4907          ?        ?      929.2        3.5       ?       ? 
1 1 1   22   16   33 f    463.2    2.5    0.0000   0.0000          ?        ?  2145.4326  22.9868          ?        ?      463.2        2.5       ?       ? 
1 1 1   22   16   34 o    390.0    2.6    0.0000   0.0000          ?        ?  1520.9585  20.4327          ?        ?      390.0        2.6       ?       ? 
1 1 1   22   16   35 o    389.5    2.6    0.0000   0.0000          ?        ?  1517.1274  20.4327          ?        ?      389.5        2.6       ?       ? 
1 1 1   22   16   36 o    908.8    3.4    0.0000   0.0000          ?        ?  8261.1934  61.9366          ?        ?      908.8        3.4       ?       ? 
1 1 1   22   16   37 o    630.9    2.7    0.0000   0.0000          ?        ?  3980.5439  34.4802          ?        ?      630.9        2.7       ?       ? 
1 1 1   22   16   38 o    696.1    2.8    0.0000   0.0000          ?        ?  4846.3789  39.5883          ?        ?      696.1        2.8       ?       ? 
1 1 1   22   16   39 o    235.9    3.4    0.0000   0.0000          ?        ?   556.7908  15.9630          ?        ?      235.9        3.4       ?       ? 
1 1 1   22   16   40 o    207.0    3.9    0.0000   0.0000          ?        ?   428.4480  15.9630          ?        ?      207.0        3.9       ?       ? 
1 1 1   22   16   41 o    543.6    2.6    0.0000   0.0000          ?        ?  2955.7166  28.7335          ?        ?      543.6        2.6       ?       ? 
1 1 1   22   16   42 o    141.3    5.9    0.0000   0.0000          ?        ?   199.8573  16.6016          ?        ?      141.3        5.9       ?       ? 
1 1 1   22   16   43 o    492.6    2.6    0.0000   0.0000          ?        ?  2427.0208  25.5409          ?        ?      492.6        2.6       ?       ? 
1 1 1   22   16   44 o    523.9    2.7    0.0000   0.0000          ?        ?  2745.0044  28.0950          ?        ?      523.9        2.7       ?       ? 
1 1 1   22   16   45 o    444.0    2.7    0.0000   0.0000          ?        ?  1971.7548  23.6253          ?        ?      444.0        2.7       ?       ? 
1 1 1   22   16   46 o    198.6    4.2    0.0000   0.0000          ?        ?   394.6064  16.6016          ?        ?      198.6        4.2       ?       ? 
1 1 1   22   16   47 o    197.1    4.4    0.0000   0.0000          ?        ?   388.8597  17.2401          ?        ?      197.1        4.4       ?       ? 
1 1 1   22   16   48 o    170.2    5.3    0.0000   0.0000          ?        ?   289.8888  17.8786          ?        ?      170.2        5.3       ?       ? 
1 1 1   22   16   49 o    282.1    3.4    0.0000   0.0000          ?        ?   796.2365  19.1556          ?        ?      282.1        3.4       ?       ? 
1 1 1   22   16   50 o    439.4    2.6    0.0000   0.0000          ?        ?  1931.5280  22.9868          ?        ?      439.4        2.6       ?       ? 
1 1 1   22   16   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   16   52 o    118.1    7.6    0.0000   0.0000          ?        ?   139.8362  17.8786          ?        ?      118.1        7.6       ?       ? 
1 1 1   22   16   53 o    118.3    7.6    0.0000   0.0000          ?        ?   140.4748  17.8786          ?        ?      118.3        7.6       ?       ? 
1 1 1   22   16   54 o    138.0    6.7    0.0000   0.0000          ?        ?   190.9180  18.5171          ?        ?      138.0        6.7       ?       ? 
1 1 1   22   16   55 o    277.4    3.6    0.0000   0.0000          ?        ?   770.0571  19.7942          ?        ?      277.4        3.6       ?       ? 
1 1 1   22   16   56 o    460.6    2.8    0.0000   0.0000          ?        ?  2122.4458  26.1794          ?        ?      460.6        2.8       ?       ? 
1 1 1   22   16   57 o    353.4    3.2    0.0000   0.0000          ?        ?  1249.5868  22.3483          ?        ?      353.4        3.2       ?       ? 
1 1 1   22   16   58 o    148.4    6.7    0.0000   0.0000          ?        ?   220.9285  19.7942          ?        ?      148.4        6.7       ?       ? 
1 1 1   22   16   59 o    169.5    5.8    0.0000   0.0000          ?        ?   287.9732  19.7942          ?        ?      169.5        5.8       ?       ? 
1 1 1   22   16   60 o     22.1   11.0    0.0000   0.0000          ?        ?   -48.5276  19.1556          ?        ?       22.1       11.0       ?       ? 
1 1 1   22   16   61 o    208.0    4.9    0.0000   0.0000          ?        ?   433.5562  20.4327          ?        ?      208.0        4.9       ?       ? 
1 1 1   22   16   62 o    358.5    3.1    0.0000   0.0000          ?        ?  1286.6211  22.3483          ?        ?      358.5        3.1       ?       ? 
1 1 1   22   16   63 o     60.1   16.1    0.0000   0.0000          ?        ?    38.3113  19.7942          ?        ?       60.1       16.1       ?       ? 
1 1 1   22   16   64 o    361.3    3.3    0.0000   0.0000          ?        ?  1307.0537  23.6253          ?        ?      361.3        3.3       ?       ? 
1 1 1   22   16   65 o    154.1    6.8    0.0000   0.0000          ?        ?   238.8071  21.0712          ?        ?      154.1        6.8       ?       ? 
1 1 1   22   16   66 o    143.7    6.9    0.0000   0.0000          ?        ?   207.5195  19.7942          ?        ?      143.7        6.9       ?       ? 
1 1 1   22   16   67 o     63.2   16.1    0.0000   0.0000          ?        ?    42.7809  20.4327          ?        ?       63.2       16.1       ?       ? 
1 1 1   22   16   68 o    131.0    8.0    0.0000   0.0000          ?        ?   173.0394  21.0712          ?        ?      131.0        8.0       ?       ? 
1 1 1   22   16   69 o    232.7    4.5    0.0000   0.0000          ?        ?   543.3819  21.0712          ?        ?      232.7        4.5       ?       ? 
1 1 1   22   16   70 f    204.9    5.3    0.0000   0.0000          ?        ?   422.0628  21.7097          ?        ?      204.9        5.3       ?       ? 
1 1 1   22   16   71 o    108.7    9.1    0.0000   0.0000          ?        ?   120.0421  19.7942          ?        ?      108.7        9.1       ?       ? 
1 1 1   22   17    0 o    633.9    4.6 4018.8552  58.7440  4018.8552  58.7440  4018.8552  58.7440      633.9      4.6      633.9        4.6     0.0     0.0 
1 1 1   22   17    1 o    798.1    3.4    0.0000   0.0000          ?        ?  6369.8916  54.9129          ?        ?      798.1        3.4       ?       ? 
1 1 1   22   17    2 o    335.8    2.9    0.0000   0.0000          ?        ?  1127.6293  19.7942          ?        ?      335.8        2.9       ?       ? 
1 1 1   22   17    3 o   1284.5    5.0    0.0000   0.0000          ?        ? 16500.0371 127.7043          ?        ?     1284.5        5.0       ?       ? 
1 1 1   22   17    4 o    753.2    3.7    0.0000   0.0000          ?        ?  5673.2646  56.1899          ?        ?      753.2        3.7       ?       ? 
1 1 1   22   17    5 o   1735.5    6.1    0.0000   0.0000          ?        ? 30124.1719 213.2662          ?        ?     1735.5        6.1       ?       ? 
1 1 1   22   17    6 o   1280.3    5.0    0.0000   0.0000          ?        ? 16392.7656 128.3428          ?        ?     1280.3        5.0       ?       ? 
1 1 1   22   17    7 o   1381.6    5.0    0.0000   0.0000          ?        ? 19089.8809 137.2822          ?        ?     1381.6        5.0       ?       ? 
1 1 1   22   17    8 o   1432.2    4.9    0.0000   0.0000          ?        ? 20513.1465 141.7518          ?        ?     1432.2        4.9       ?       ? 
1 1 1   22   17    9 o    159.2    2.6    0.0000   0.0000          ?        ?   253.4931   8.3008          ?        ?      159.2        2.6       ?       ? 
1 1 1   22   17   10 o    720.4    2.8    0.0000   0.0000          ?        ?  5189.2651  40.8654          ?        ?      720.4        2.8       ?       ? 
1 1 1   22   17   11 o    538.4    2.4    0.0000   0.0000          ?        ?  2898.8882  26.1794          ?        ?      538.4        2.4       ?       ? 
1 1 1   22   17   12 o    791.9    3.2    0.0000   0.0000          ?        ?  6271.5596  50.4432          ?        ?      791.9        3.2       ?       ? 
1 1 1   22   17   13 o   1062.5    3.9    0.0000   0.0000          ?        ? 11289.7012  82.3693          ?        ?     1062.5        3.9       ?       ? 
1 1 1   22   17   14 f    268.2    3.9    0.0000   0.0000          ?        ?   719.6138  21.0712          ?        ?      268.2        3.9       ?       ? 
1 1 1   22   17   15 o    421.5    2.8    0.0000   0.0000          ?        ?  1777.0056  23.6253          ?        ?      421.5        2.8       ?       ? 
1 1 1   22   17   16 o   1392.6    4.9    0.0000   0.0000          ?        ? 19394.4551 137.2822          ?        ?     1392.6        4.9       ?       ? 
1 1 1   22   17   17 o     18.9    9.3    0.0000   0.0000          ?        ?   -28.7335  12.7704          ?        ?       18.9        9.3       ?       ? 
1 1 1   22   17   18 o    347.7    2.5    0.0000   0.0000          ?        ?  1208.7214  17.2401          ?        ?      347.7        2.5       ?       ? 
1 1 1   22   17   19 o    129.6    5.7    0.0000   0.0000          ?        ?   167.9312  14.6860          ?        ?      129.6        5.7       ?       ? 
1 1 1   22   17   20 o    765.6    3.0    0.0000   0.0000          ?        ?  5860.9902  46.6121          ?        ?      765.6        3.0       ?       ? 
1 1 1   22   17   21 o    959.2    3.5    0.0000   0.0000          ?        ?  9201.0967  67.6833          ?        ?      959.2        3.5       ?       ? 
1 1 1   22   17   22 o   1115.8    4.0    0.0000   0.0000          ?        ? 12450.5332  88.7545          ?        ?     1115.8        4.0       ?       ? 
1 1 1   22   17   23 f    948.5    3.5    0.0000   0.0000          ?        ?  8996.7695  67.0448          ?        ?      948.5        3.5       ?       ? 
1 1 1   22   17   24 o    282.8    2.6    0.0000   0.0000          ?        ?   800.0676  14.6860          ?        ?      282.8        2.6       ?       ? 
1 1 1   22   17   25 o    994.2    3.6    0.0000   0.0000          ?        ?  9886.2305  70.8759          ?        ?      994.2        3.6       ?       ? 
1 1 1   22   17   26 o     22.2   10.8    0.0000   0.0000          ?        ?   -24.2638  14.6860          ?        ?       22.2       10.8       ?       ? 
1 1 1   22   17   27 o   1082.5    3.8    0.0000   0.0000          ?        ? 11718.7881  83.0078          ?        ?     1082.5        3.8       ?       ? 
1 1 1   22   17   28 o    838.9    3.2    0.0000   0.0000          ?        ?  7037.7852  54.2743          ?        ?      838.9        3.2       ?       ? 
1 1 1   22   17   29 o    190.4    3.9    0.0000   0.0000          ?        ?   362.6803  14.6860          ?        ?      190.4        3.9       ?       ? 
1 1 1   22   17   30 o    547.9    2.6    0.0000   0.0000          ?        ?  3001.6902  28.0950          ?        ?      547.9        2.6       ?       ? 
1 1 1   22   17   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   17   32 o    495.8    2.6    0.0000   0.0000          ?        ?  2458.3083  26.1794          ?        ?      495.8        2.6       ?       ? 
1 1 1   22   17   33 o    461.1    2.5    0.0000   0.0000          ?        ?  2126.2771  22.9868          ?        ?      461.1        2.5       ?       ? 
1 1 1   22   17   34 o    387.6    2.6    0.0000   0.0000          ?        ?  1502.4414  19.7942          ?        ?      387.6        2.6       ?       ? 
1 1 1   22   17   35 o     94.5    8.1    0.0000   0.0000          ?        ?    89.3930  15.3245          ?        ?       94.5        8.1       ?       ? 
1 1 1   22   17   36 o    291.9    2.8    0.0000   0.0000          ?        ?   852.4264  16.6016          ?        ?      291.9        2.8       ?       ? 
1 1 1   22   17   37 o    337.1    2.7    0.0000   0.0000          ?        ?  1136.5685  18.5171          ?        ?      337.1        2.7       ?       ? 
1 1 1   22   17   38 o    442.3    2.5    0.0000   0.0000          ?        ?  1956.4302  22.3483          ?        ?      442.3        2.5       ?       ? 
1 1 1   22   17   39 o    327.0    2.7    0.0000   0.0000          ?        ?  1069.5237  17.8786          ?        ?      327.0        2.7       ?       ? 
1 1 1   22   17   40 o    565.3    2.6    0.0000   0.0000          ?        ?  3195.8008  29.3720          ?        ?      565.3        2.6       ?       ? 
1 1 1   22   17   41 o    371.4    2.7    0.0000   0.0000          ?        ?  1379.8452  19.7942          ?        ?      371.4        2.7       ?       ? 
1 1 1   22   17   42 o    830.9    3.1    0.0000   0.0000          ?        ?  6906.2500  51.7203          ?        ?      830.9        3.1       ?       ? 
1 1 1   22   17   43 o    117.9    7.0    0.0000   0.0000          ?        ?   139.1977  16.6016          ?        ?      117.9        7.0       ?       ? 
1 1 1   22   17   44 o    563.9    2.7    0.0000   0.0000          ?        ?  3180.4763  30.0105          ?        ?      563.9        2.7       ?       ? 
1 1 1   22   17   45 o    219.2    4.1    0.0000   0.0000          ?        ?   480.8068  17.8786          ?        ?      219.2        4.1       ?       ? 
1 1 1   22   17   46 o    156.7    5.5    0.0000   0.0000          ?        ?   245.8308  17.2401          ?        ?      156.7        5.5       ?       ? 
1 1 1   22   17   47 o     58.4   14.3    0.0000   0.0000          ?        ?    35.7572  16.6016          ?        ?       58.4       14.3       ?       ? 
1 1 1   22   17   48 o    206.1    4.3    0.0000   0.0000          ?        ?   425.2554  17.8786          ?        ?      206.1        4.3       ?       ? 
1 1 1   22   17   49 o    324.5    3.0    0.0000   0.0000          ?        ?  1053.5607  19.7942          ?        ?      324.5        3.0       ?       ? 
1 1 1   22   17   50 o    268.9    3.4    0.0000   0.0000          ?        ?   723.4450  18.5171          ?        ?      268.9        3.4       ?       ? 
1 1 1   22   17   51 o    179.6    5.0    0.0000   0.0000          ?        ?   323.0919  17.8786          ?        ?      179.6        5.0       ?       ? 
1 1 1   22   17   52 o    121.0    7.7    0.0000   0.0000          ?        ?   146.8600  18.5171          ?        ?      121.0        7.7       ?       ? 
1 1 1   22   17   53 o    479.7    2.8    0.0000   0.0000          ?        ?  2301.8704  26.8179          ?        ?      479.7        2.8       ?       ? 
1 1 1   22   17   54 o     50.2   16.8    0.0000   0.0000          ?        ?    24.2638  19.7942          ?        ?       50.2       16.8       ?       ? 
1 1 1   22   17   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   17   56 o    565.4    2.9    0.0000   0.0000          ?        ?  3198.3547  32.5646          ?        ?      565.4        2.9       ?       ? 
1 1 1   22   17   57 o    449.7    2.8    0.0000   0.0000          ?        ?  2022.8364  24.9023          ?        ?      449.7        2.8       ?       ? 
1 1 1   22   17   58 o    242.9    4.2    0.0000   0.0000          ?        ?   590.6325  20.4327          ?        ?      242.9        4.2       ?       ? 
1 1 1   22   17   59 o     32.0   14.3    0.0000   0.0000          ?        ?    -7.0237  18.5171          ?        ?       32.0       14.3       ?       ? 
1 1 1   22   17   60 o    284.4    3.6    0.0000   0.0000          ?        ?   809.6454  20.4327          ?        ?      284.4        3.6       ?       ? 
1 1 1   22   17   61 o    123.7    8.0    0.0000   0.0000          ?        ?   153.8837  19.7942          ?        ?      123.7        8.0       ?       ? 
1 1 1   22   17   62 o    278.5    3.8    0.0000   0.0000          ?        ?   776.4423  21.0712          ?        ?      278.5        3.8       ?       ? 
1 1 1   22   17   63 o    187.3    5.6    0.0000   0.0000          ?        ?   351.8254  21.0712          ?        ?      187.3        5.6       ?       ? 
1 1 1   22   17   64 o     88.0   11.2    0.0000   0.0000          ?        ?    78.5382  19.7942          ?        ?       88.0       11.2       ?       ? 
1 1 1   22   17   65 o    185.2    5.5    0.0000   0.0000          ?        ?   344.1632  20.4327          ?        ?      185.2        5.5       ?       ? 
1 1 1   22   17   66 o    158.7    6.0    0.0000   0.0000          ?        ?   252.8546  19.1556          ?        ?      158.7        6.0       ?       ? 
1 1 1   22   17   67 o    220.7    4.6    0.0000   0.0000          ?        ?   488.4691  20.4327          ?        ?      220.7        4.6       ?       ? 
1 1 1   22   17   68 o    162.3    6.1    0.0000   0.0000          ?        ?   264.9865  19.7942          ?        ?      162.3        6.1       ?       ? 
1 1 1   22   17   69 o    136.4    7.3    0.0000   0.0000          ?        ?   187.7254  19.7942          ?        ?      136.4        7.3       ?       ? 
1 1 1   22   17   70 o    118.2    8.6    0.0000   0.0000          ?        ?   141.7518  20.4327          ?        ?      118.2        8.6       ?       ? 
1 1 1   22   17   71 o    155.3    6.4    0.0000   0.0000          ?        ?   243.2767  19.7942          ?        ?      155.3        6.4       ?       ? 
1 1 1   22   18    0 o    464.5    4.7 2158.8416  44.0580  2158.8416  44.0580  2158.8416  44.0580      464.5      4.7      464.5        4.7     0.0     0.0 
1 1 1   22   18    1 f     44.2   14.1    0.0000   0.0000          ?        ?    19.1556  14.0475          ?        ?       44.2       14.1       ?       ? 
1 1 1   22   18    2 o    892.2    4.2    0.0000   0.0000          ?        ?  7961.0879  74.0685          ?        ?      892.2        4.2       ?       ? 
1 1 1   22   18    3 o    256.4    2.6    0.0000   0.0000          ?        ?   657.6772  13.4090          ?        ?      256.4        2.6       ?       ? 
1 1 1   22   18    4 o    462.4    3.0    0.0000   0.0000          ?        ?  2137.7703  28.0950          ?        ?      462.4        3.0       ?       ? 
1 1 1   22   18    5 o    474.4    2.7    0.0000   0.0000          ?        ?  2250.7888  25.5409          ?        ?      474.4        2.7       ?       ? 
1 1 1   22   18    6 o    981.4    3.9    0.0000   0.0000          ?        ?  9632.0986  75.9841          ?        ?      981.4        3.9       ?       ? 
1 1 1   22   18    7 o    688.8    3.1    0.0000   0.0000          ?        ?  4744.2158  42.1424          ?        ?      688.8        3.1       ?       ? 
1 1 1   22   18    8 o   1372.3    4.9    0.0000   0.0000          ?        ? 18834.4727 134.7281          ?        ?     1372.3        4.9       ?       ? 
1 1 1   22   18    9 o    389.7    2.1    0.0000   0.0000          ?        ?  1518.4044  16.6016          ?        ?      389.7        2.1       ?       ? 
1 1 1   22   18   10 o    212.9    2.2    0.0000   0.0000          ?        ?   453.3503   9.5778          ?        ?      212.9        2.2       ?       ? 
1 1 1   22   18   11 o    982.0    3.7    0.0000   0.0000          ?        ?  9644.8691  73.4300          ?        ?      982.0        3.7       ?       ? 
1 1 1   22   18   12 o    259.2    2.5    0.0000   0.0000          ?        ?   671.7247  12.7704          ?        ?      259.2        2.5       ?       ? 
1 1 1   22   18   13 o    128.3    4.0    0.0000   0.0000          ?        ?   164.7386  10.2163          ?        ?      128.3        4.0       ?       ? 
1 1 1   22   18   14 o   1371.8    4.7    0.0000   0.0000          ?        ? 18820.4258 127.7043          ?        ?     1371.8        4.7       ?       ? 
1 1 1   22   18   15 o   1875.4    6.2    0.0000   0.0000          ?        ? 35179.3477 231.7833          ?        ?     1875.4        6.2       ?       ? 
1 1 1   22   18   16 o    496.9    2.5    0.0000   0.0000          ?        ?  2469.1631  24.9023          ?        ?      496.9        2.5       ?       ? 
1 1 1   22   18   17 o   1293.5    4.4    0.0000   0.0000          ?        ? 16733.7363 114.2954          ?        ?     1293.5        4.4       ?       ? 
1 1 1   22   18   18 o    799.3    3.2    0.0000   0.0000          ?        ?  6388.4087  50.4432          ?        ?      799.3        3.2       ?       ? 
1 1 1   22   18   19 o    424.5    2.3    0.0000   0.0000          ?        ?  1801.9081  19.7942          ?        ?      424.5        2.3       ?       ? 
1 1 1   22   18   20 o    492.1    2.3    0.0000   0.0000          ?        ?  2421.9124  22.9868          ?        ?      492.1        2.3       ?       ? 
1 1 1   22   18   21 o   1010.7    3.6    0.0000   0.0000          ?        ? 10216.9844  73.4300          ?        ?     1010.7        3.6       ?       ? 
1 1 1   22   18   22 o    400.0    2.5    0.0000   0.0000          ?        ?  1600.1353  19.7942          ?        ?      400.0        2.5       ?       ? 
1 1 1   22   18   23 o    815.3    3.2    0.0000   0.0000          ?        ?  6647.0103  52.3588          ?        ?      815.3        3.2       ?       ? 
1 1 1   22   18   24 o     87.5    8.4    0.0000   0.0000          ?        ?    76.6226  14.6860          ?        ?       87.5        8.4       ?       ? 
1 1 1   22   18   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   18   26 o    548.2    2.5    0.0000   0.0000          ?        ?  3005.5215  27.4564          ?        ?      548.2        2.5       ?       ? 
1 1 1   22   18   27 o    287.8    2.8    0.0000   0.0000          ?        ?   828.1625  15.9630          ?        ?      287.8        2.8       ?       ? 
1 1 1   22   18   28 o    635.5    2.8    0.0000   0.0000          ?        ?  4039.2876  35.1187          ?        ?      635.5        2.8       ?       ? 
1 1 1   22   18   29 o    486.6    2.5    0.0000   0.0000          ?        ?  2367.6382  24.2638          ?        ?      486.6        2.5       ?       ? 
1 1 1   22   18   30 o    448.6    2.6    0.0000   0.0000          ?        ?  2012.6202  22.9868          ?        ?      448.6        2.6       ?       ? 
1 1 1   22   18   31 o    323.3    2.6    0.0000   0.0000          ?        ?  1045.2599  16.6016          ?        ?      323.3        2.6       ?       ? 
1 1 1   22   18   32 o    720.0    3.0    0.0000   0.0000          ?        ?  5184.7954  42.7809          ?        ?      720.0        3.0       ?       ? 
1 1 1   22   18   33 o    411.8    2.6    0.0000   0.0000          ?        ?  1695.9135  21.0712          ?        ?      411.8        2.6       ?       ? 
1 1 1   22   18   34 o    250.6    3.2    0.0000   0.0000          ?        ?   628.3053  15.9630          ?        ?      250.6        3.2       ?       ? 
1 1 1   22   18   35 o    416.9    2.7    0.0000   0.0000          ?        ?  1738.0559  22.3483          ?        ?      416.9        2.7       ?       ? 
1 1 1   22   18   36 o    292.0    3.0    0.0000   0.0000          ?        ?   853.0649  17.2401          ?        ?      292.0        3.0       ?       ? 
1 1 1   22   18   37 o    330.3    2.6    0.0000   0.0000          ?        ?  1091.2334  17.2401          ?        ?      330.3        2.6       ?       ? 
1 1 1   22   18   38 o    355.8    2.5    0.0000   0.0000          ?        ?  1266.1884  17.8786          ?        ?      355.8        2.5       ?       ? 
1 1 1   22   18   39 o    388.8    2.5    0.0000   0.0000          ?        ?  1512.0193  19.7942          ?        ?      388.8        2.5       ?       ? 
1 1 1   22   18   40 o     18.0    9.0    0.0000   0.0000          ?        ?   -45.3350  14.6860          ?        ?       18.0        9.0       ?       ? 
1 1 1   22   18   41 o     26.1   12.1    0.0000   0.0000          ?        ?   -14.0475  15.3245          ?        ?       26.1       12.1       ?       ? 
1 1 1   22   18   42 o    336.5    2.7    0.0000   0.0000          ?        ?  1132.7373  17.8786          ?        ?      336.5        2.7       ?       ? 
1 1 1   22   18   43 o    525.3    2.6    0.0000   0.0000          ?        ?  2760.3289  26.8179          ?        ?      525.3        2.6       ?       ? 
1 1 1   22   18   44 o    699.1    2.9    0.0000   0.0000          ?        ?  4889.1602  40.8654          ?        ?      699.1        2.9       ?       ? 
1 1 1   22   18   45 o    220.7    3.9    0.0000   0.0000          ?        ?   487.1920  17.2401          ?        ?      220.7        3.9       ?       ? 
1 1 1   22   18   46 o     20.1   10.1    0.0000   0.0000          ?        ?   -44.6965  16.6016          ?        ?       20.1       10.1       ?       ? 
1 1 1   22   18   47 o    396.9    2.7    0.0000   0.0000          ?        ?  1575.8713  21.7097          ?        ?      396.9        2.7       ?       ? 
1 1 1   22   18   48 o    437.5    2.7    0.0000   0.0000          ?        ?  1914.9263  23.6253          ?        ?      437.5        2.7       ?       ? 
1 1 1   22   18   49 o    121.6    7.1    0.0000   0.0000          ?        ?   148.1370  17.2401          ?        ?      121.6        7.1       ?       ? 
1 1 1   22   18   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   18   51 f    249.5    3.8    0.0000   0.0000          ?        ?   623.1971  19.1556          ?        ?      249.5        3.8       ?       ? 
1 1 1   22   18   52 o    117.0    7.6    0.0000   0.0000          ?        ?   137.2822  17.8786          ?        ?      117.0        7.6       ?       ? 
1 1 1   22   18   53 o    106.1    8.4    0.0000   0.0000          ?        ?   113.0183  17.8786          ?        ?      106.1        8.4       ?       ? 
1 1 1   22   18   54 o    261.0    3.8    0.0000   0.0000          ?        ?   681.9411  19.7942          ?        ?      261.0        3.8       ?       ? 
1 1 1   22   18   55 o    236.0    4.2    0.0000   0.0000          ?        ?   557.4294  19.7942          ?        ?      236.0        4.2       ?       ? 
1 1 1   22   18   56 o    286.6    3.6    0.0000   0.0000          ?        ?   821.7773  20.4327          ?        ?      286.6        3.6       ?       ? 
1 1 1   22   18   57 o    466.0    2.8    0.0000   0.0000          ?        ?  2172.2507  26.1794          ?        ?      466.0        2.8       ?       ? 
1 1 1   22   18   58 o     84.9   11.3    0.0000   0.0000          ?        ?    72.7915  19.1556          ?        ?       84.9       11.3       ?       ? 
1 1 1   22   18   59 o    102.9    9.0    0.0000   0.0000          ?        ?   106.6331  18.5171          ?        ?      102.9        9.0       ?       ? 
1 1 1   22   18   60 o    160.2    5.8    0.0000   0.0000          ?        ?   257.3242  18.5171          ?        ?      160.2        5.8       ?       ? 
1 1 1   22   18   61 o    153.4    6.5    0.0000   0.0000          ?        ?   236.2530  19.7942          ?        ?      153.4        6.5       ?       ? 
1 1 1   22   18   62 o     81.7   12.1    0.0000   0.0000          ?        ?    67.6833  19.7942          ?        ?       81.7       12.1       ?       ? 
1 1 1   22   18   63 o    298.0    3.6    0.0000   0.0000          ?        ?   889.4606  21.7097          ?        ?      298.0        3.6       ?       ? 
1 1 1   22   18   64 o    155.0    6.4    0.0000   0.0000          ?        ?   241.3612  19.7942          ?        ?      155.0        6.4       ?       ? 
1 1 1   22   18   65 o    187.6    5.3    0.0000   0.0000          ?        ?   353.1024  19.7942          ?        ?      187.6        5.3       ?       ? 
1 1 1   22   18   66 o    150.1    6.6    0.0000   0.0000          ?        ?   226.6752  19.7942          ?        ?      150.1        6.6       ?       ? 
1 1 1   22   18   67 o     20.0   10.1    0.0000   0.0000          ?        ?   -71.5144  20.4327          ?        ?       20.0       10.1       ?       ? 
1 1 1   22   18   68 o    190.0    5.4    0.0000   0.0000          ?        ?   362.6803  20.4327          ?        ?      190.0        5.4       ?       ? 
1 1 1   22   18   69 o    101.2    9.8    0.0000   0.0000          ?        ?   104.0790  19.7942          ?        ?      101.2        9.8       ?       ? 
1 1 1   22   18   70 o     92.1   10.7    0.0000   0.0000          ?        ?    86.8389  19.7942          ?        ?       92.1       10.7       ?       ? 
1 1 1   22   19    0 o   2578.2   14.6 66513.5234 750.9014 66513.5234 750.9014 66513.5234 750.9014     2578.2     14.6     2578.2       14.6     0.0     0.0 
1 1 1   22   19    1 o    380.9    5.2    0.0000   0.0000          ?        ?  1451.3596  39.5883          ?        ?      380.9        5.2       ?       ? 
1 1 1   22   19    2 o   1381.6    5.8    0.0000   0.0000          ?        ? 19091.1582 160.9075          ?        ?     1381.6        5.8       ?       ? 
1 1 1   22   19    3 o    435.4    3.0    0.0000   0.0000          ?        ?  1895.7706  26.1794          ?        ?      435.4        3.0       ?       ? 
1 1 1   22   19    4 o   1452.6    5.5    0.0000   0.0000          ?        ? 21103.7793 159.6304          ?        ?     1452.6        5.5       ?       ? 
1 1 1   22   19    5 o    681.9    3.0    0.0000   0.0000          ?        ?  4650.3530  41.5039          ?        ?      681.9        3.0       ?       ? 
1 1 1   22   19    6 o    644.4    2.7    0.0000   0.0000          ?        ?  4152.3062  35.1187          ?        ?      644.4        2.7       ?       ? 
1 1 1   22   19    7 o    725.0    3.0    0.0000   0.0000          ?        ?  5256.9482  43.4195          ?        ?      725.0        3.0       ?       ? 
1 1 1   22   19    8 o    329.9    3.1    0.0000   0.0000          ?        ?  1088.6793  20.4327          ?        ?      329.9        3.1       ?       ? 
1 1 1   22   19    9 o    268.6    2.0    0.0000   0.0000          ?        ?   721.5294  10.8549          ?        ?      268.6        2.0       ?       ? 
1 1 1   22   19   10 o    934.6    3.5    0.0000   0.0000          ?        ?  8734.9756  65.1292          ?        ?      934.6        3.5       ?       ? 
1 1 1   22   19   11 o    992.1    3.5    0.0000   0.0000          ?        ?  9842.8105  69.5989          ?        ?      992.1        3.5       ?       ? 
1 1 1   22   19   12 f    449.1    2.3    0.0000   0.0000          ?        ?  2017.0897  20.4327          ?        ?      449.1        2.3       ?       ? 
1 1 1   22   19   13 f    383.5    2.3    0.0000   0.0000          ?        ?  1470.5154  17.8786          ?        ?      383.5        2.3       ?       ? 
1 1 1   22   19   14 o    349.9    2.5    0.0000   0.0000          ?        ?  1224.6844  17.2401          ?        ?      349.9        2.5       ?       ? 
1 1 1   22   19   15 o    476.7    2.4    0.0000   0.0000          ?        ?  2272.4985  22.9868          ?        ?      476.7        2.4       ?       ? 
1 1 1   22   19   16 o    441.7    2.9    0.0000   0.0000          ?        ?  1951.3221  25.5409          ?        ?      441.7        2.9       ?       ? 
1 1 1   22   19   17 o    334.6    2.5    0.0000   0.0000          ?        ?  1119.3285  16.6016          ?        ?      334.6        2.5       ?       ? 
1 1 1   22   19   18 o    857.8    3.3    0.0000   0.0000          ?        ?  7358.9619  56.1899          ?        ?      857.8        3.3       ?       ? 
1 1 1   22   19   19 o    242.2    2.9    0.0000   0.0000          ?        ?   586.8014  14.0475          ?        ?      242.2        2.9       ?       ? 
1 1 1   22   19   20 o   1391.7    4.7    0.0000   0.0000          ?        ? 19371.4688 130.8969          ?        ?     1391.7        4.7       ?       ? 
1 1 1   22   19   21 o    179.2    3.4    0.0000   0.0000          ?        ?   321.1764  12.1319          ?        ?      179.2        3.4       ?       ? 
1 1 1   22   19   22 o    492.2    2.4    0.0000   0.0000          ?        ?  2422.5510  23.6253          ?        ?      492.2        2.4       ?       ? 
1 1 1   22   19   23 o    373.0    2.6    0.0000   0.0000          ?        ?  1391.3386  19.1556          ?        ?      373.0        2.6       ?       ? 
1 1 1   22   19   24 o    680.4    2.8    0.0000   0.0000          ?        ?  4629.2817  37.6728          ?        ?      680.4        2.8       ?       ? 
1 1 1   22   19   25 o    862.1    3.2    0.0000   0.0000          ?        ?  7433.0303  55.5514          ?        ?      862.1        3.2       ?       ? 
1 1 1   22   19   26 o    134.2    5.2    0.0000   0.0000          ?        ?   180.0631  14.0475          ?        ?      134.2        5.2       ?       ? 
1 1 1   22   19   27 o   1204.3    4.3    0.0000   0.0000          ?        ? 14505.2959 103.4405          ?        ?     1204.3        4.3       ?       ? 
1 1 1   22   19   28 o    227.7    3.4    0.0000   0.0000          ?        ?   518.4796  15.3245          ?        ?      227.7        3.4       ?       ? 
1 1 1   22   19   29 o    704.3    2.9    0.0000   0.0000          ?        ?  4960.6748  40.8654          ?        ?      704.3        2.9       ?       ? 
1 1 1   22   19   30 o    165.5    4.4    0.0000   0.0000          ?        ?   273.9258  14.6860          ?        ?      165.5        4.4       ?       ? 
1 1 1   22   19   31 o    194.6    3.6    0.0000   0.0000          ?        ?   378.6433  14.0475          ?        ?      194.6        3.6       ?       ? 
1 1 1   22   19   32 o    132.5    5.5    0.0000   0.0000          ?        ?   175.5934  14.6860          ?        ?      132.5        5.5       ?       ? 
1 1 1   22   19   33 o    219.1    3.4    0.0000   0.0000          ?        ?   480.1682  14.6860          ?        ?      219.1        3.4       ?       ? 
1 1 1   22   19   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   19   35 o    506.9    2.5    0.0000   0.0000          ?        ?  2569.4109  25.5409          ?        ?      506.9        2.5       ?       ? 
1 1 1   22   19   36 o    333.0    2.8    0.0000   0.0000          ?        ?  1109.1121  18.5171          ?        ?      333.0        2.8       ?       ? 
1 1 1   22   19   37 f    605.4    2.6    0.0000   0.0000          ?        ?  3665.7524  31.9261          ?        ?      605.4        2.6       ?       ? 
1 1 1   22   19   38 o    277.6    3.1    0.0000   0.0000          ?        ?   770.6956  17.2401          ?        ?      277.6        3.1       ?       ? 
1 1 1   22   19   39 o    182.9    4.2    0.0000   0.0000          ?        ?   334.5853  15.3245          ?        ?      182.9        4.2       ?       ? 
1 1 1   22   19   40 o    288.3    2.9    0.0000   0.0000          ?        ?   831.3552  16.6016          ?        ?      288.3        2.9       ?       ? 
1 1 1   22   19   41 o    324.5    2.8    0.0000   0.0000          ?        ?  1052.9221  17.8786          ?        ?      324.5        2.8       ?       ? 
1 1 1   22   19   42 o    163.9    4.9    0.0000   0.0000          ?        ?   268.8176  15.9630          ?        ?      163.9        4.9       ?       ? 
1 1 1   22   19   43 o    153.0    5.4    0.0000   0.0000          ?        ?   234.3374  16.6016          ?        ?      153.0        5.4       ?       ? 
1 1 1   22   19   44 o    607.3    2.7    0.0000   0.0000          ?        ?  3688.7395  33.2031          ?        ?      607.3        2.7       ?       ? 
1 1 1   22   19   45 o     67.9   13.2    0.0000   0.0000          ?        ?    47.8891  17.2401          ?        ?       67.9       13.2       ?       ? 
1 1 1   22   19   46 o     97.7    9.5    0.0000   0.0000          ?        ?    95.7782  18.5171          ?        ?       97.7        9.5       ?       ? 
1 1 1   22   19   47 o    694.7    3.0    0.0000   0.0000          ?        ?  4828.5005  42.1424          ?        ?      694.7        3.0       ?       ? 
1 1 1   22   19   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   19   49 o    420.9    2.7    0.0000   0.0000          ?        ?  1772.5361  22.9868          ?        ?      420.9        2.7       ?       ? 
1 1 1   22   19   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   19   51 o    158.3    5.9    0.0000   0.0000          ?        ?   250.9390  18.5171          ?        ?      158.3        5.9       ?       ? 
1 1 1   22   19   52 o    153.1    5.6    0.0000   0.0000          ?        ?   234.9760  17.2401          ?        ?      153.1        5.6       ?       ? 
1 1 1   22   19   53 f     75.0   12.3    0.0000   0.0000          ?        ?    56.8284  18.5171          ?        ?       75.0       12.3       ?       ? 
1 1 1   22   19   54 o    163.8    5.3    0.0000   0.0000          ?        ?   268.8176  17.2401          ?        ?      163.8        5.3       ?       ? 
1 1 1   22   19   55 o    555.6    2.8    0.0000   0.0000          ?        ?  3087.8906  30.6490          ?        ?      555.6        2.8       ?       ? 
1 1 1   22   19   56 o    191.4    5.2    0.0000   0.0000          ?        ?   367.1499  19.7942          ?        ?      191.4        5.2       ?       ? 
1 1 1   22   19   57 f    194.3    4.9    0.0000   0.0000          ?        ?   378.0048  19.1556          ?        ?      194.3        4.9       ?       ? 
1 1 1   22   19   58 o     24.5   12.0    0.0000   0.0000          ?        ?   -35.1187  19.1556          ?        ?       24.5       12.0       ?       ? 
1 1 1   22   19   59 o     87.9   10.5    0.0000   0.0000          ?        ?    77.8996  18.5171          ?        ?       87.9       10.5       ?       ? 
1 1 1   22   19   60 o     55.1   16.9    0.0000   0.0000          ?        ?    31.2876  20.4327          ?        ?       55.1       16.9       ?       ? 
1 1 1   22   19   61 o    395.9    3.0    0.0000   0.0000          ?        ?  1568.8477  23.6253          ?        ?      395.9        3.0       ?       ? 
1 1 1   22   19   62 o    206.9    4.9    0.0000   0.0000          ?        ?   429.0865  20.4327          ?        ?      206.9        4.9       ?       ? 
1 1 1   22   19   63 o    182.4    5.6    0.0000   0.0000          ?        ?   333.9468  20.4327          ?        ?      182.4        5.6       ?       ? 
1 1 1   22   19   64 o    210.1    4.9    0.0000   0.0000          ?        ?   442.4955  20.4327          ?        ?      210.1        4.9       ?       ? 
1 1 1   22   19   65 o     52.2   17.0    0.0000   0.0000          ?        ?    27.4564  20.4327          ?        ?       52.2       17.0       ?       ? 
1 1 1   22   19   66 o    170.0    5.8    0.0000   0.0000          ?        ?   290.5273  19.7942          ?        ?      170.0        5.8       ?       ? 
1 1 1   22   19   67 o    192.7    5.1    0.0000   0.0000          ?        ?   372.8966  19.7942          ?        ?      192.7        5.1       ?       ? 
1 1 1   22   19   68 o     29.3   13.7    0.0000   0.0000          ?        ?   -19.7942  20.4327          ?        ?       29.3       13.7       ?       ? 
1 1 1   22   19   69 o     57.5   16.1    0.0000   0.0000          ?        ?    35.7572  19.1556          ?        ?       57.5       16.1       ?       ? 
1 1 1   22   19   70 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   20    0 o    442.9    5.3 1962.1769  47.2506  1962.1769  47.2506  1962.1769  47.2506      442.9      5.3      442.9        5.3     0.0     0.0 
1 1 1   22   20    1 o    293.6    3.7    0.0000   0.0000          ?        ?   862.0042  21.7097          ?        ?      293.6        3.7       ?       ? 
1 1 1   22   20    2 o    397.0    3.5    0.0000   0.0000          ?        ?  1575.8713  27.4564          ?        ?      397.0        3.5       ?       ? 
1 1 1   22   20    3 o   1548.8    6.2    0.0000   0.0000          ?        ? 23992.4492 191.5565          ?        ?     1548.8        6.2       ?       ? 
1 1 1   22   20    4 o    490.9    2.9    0.0000   0.0000          ?        ?  2409.7805  28.0950          ?        ?      490.9        2.9       ?       ? 
1 1 1   22   20    5 o    697.1    3.1    0.0000   0.0000          ?        ?  4859.7881  43.4195          ?        ?      697.1        3.1       ?       ? 
1 1 1   22   20    6 o   1075.9    3.9    0.0000   0.0000          ?        ? 11575.7588  84.2849          ?        ?     1075.9        3.9       ?       ? 
1 1 1   22   20    7 o    361.0    2.3    0.0000   0.0000          ?        ?  1303.2227  16.6016          ?        ?      361.0        2.3       ?       ? 
1 1 1   22   20    8 o   1347.3    4.8    0.0000   0.0000          ?        ? 18153.8086 128.3428          ?        ?     1347.3        4.8       ?       ? 
1 1 1   22   20    9 o   1256.9    4.3    0.0000   0.0000          ?        ? 15800.2178 107.2716          ?        ?     1256.9        4.3       ?       ? 
1 1 1   22   20   10 f   1106.9    3.8    0.0000   0.0000          ?        ? 12252.5918  84.9234          ?        ?     1106.9        3.8       ?       ? 
1 1 1   22   20   11 o    329.6    2.2    0.0000   0.0000          ?        ?  1086.1254  14.6860          ?        ?      329.6        2.2       ?       ? 
1 1 1   22   20   12 o    727.1    2.8    0.0000   0.0000          ?        ?  5286.3208  40.8654          ?        ?      727.1        2.8       ?       ? 
1 1 1   22   20   13 o    386.5    2.5    0.0000   0.0000          ?        ?  1493.5021  19.1556          ?        ?      386.5        2.5       ?       ? 
1 1 1   22   20   14 o    715.5    2.8    0.0000   0.0000          ?        ?  5119.6665  40.2269          ?        ?      715.5        2.8       ?       ? 
1 1 1   22   20   15 o    246.2    2.6    0.0000   0.0000          ?        ?   605.9570  12.7704          ?        ?      246.2        2.6       ?       ? 
1 1 1   22   20   16 o   1389.1    4.8    0.0000   0.0000          ?        ? 19299.3164 133.4510          ?        ?     1389.1        4.8       ?       ? 
1 1 1   22   20   17 o    491.4    2.4    0.0000   0.0000          ?        ?  2414.8889  23.6253          ?        ?      491.4        2.4       ?       ? 
1 1 1   22   20   18 o    656.9    2.8    0.0000   0.0000          ?        ?  4315.7681  37.0343          ?        ?      656.9        2.8       ?       ? 
1 1 1   22   20   19 o     17.9    9.0    0.0000   0.0000          ?        ?   -45.9736  14.6860          ?        ?       17.9        9.0       ?       ? 
1 1 1   22   20   20 o    606.9    2.7    0.0000   0.0000          ?        ?  3682.9927  32.5646          ?        ?      606.9        2.7       ?       ? 
1 1 1   22   20   21 o    708.5    2.8    0.0000   0.0000          ?        ?  5020.6953  40.2269          ?        ?      708.5        2.8       ?       ? 
1 1 1   22   20   22 o    417.7    2.4    0.0000   0.0000          ?        ?  1745.0795  19.7942          ?        ?      417.7        2.4       ?       ? 
1 1 1   22   20   23 o    688.2    2.8    0.0000   0.0000          ?        ?  4737.1919  38.3113          ?        ?      688.2        2.8       ?       ? 
1 1 1   22   20   24 f    668.0    2.7    0.0000   0.0000          ?        ?  4461.9893  36.3957          ?        ?      668.0        2.7       ?       ? 
1 1 1   22   20   25 o    156.2    4.3    0.0000   0.0000          ?        ?   243.9153  13.4090          ?        ?      156.2        4.3       ?       ? 
1 1 1   22   20   26 o    400.6    2.5    0.0000   0.0000          ?        ?  1604.6049  19.7942          ?        ?      400.6        2.5       ?       ? 
1 1 1   22   20   27 o    644.6    2.8    0.0000   0.0000          ?        ?  4156.1372  35.7572          ?        ?      644.6        2.8       ?       ? 
1 1 1   22   20   28 o    600.6    2.7    0.0000   0.0000          ?        ?  3607.0088  31.9261          ?        ?      600.6        2.7       ?       ? 
1 1 1   22   20   29 o    325.6    2.6    0.0000   0.0000          ?        ?  1059.9459  17.2401          ?        ?      325.6        2.6       ?       ? 
1 1 1   22   20   30 o    372.2    2.7    0.0000   0.0000          ?        ?  1385.5919  19.7942          ?        ?      372.2        2.7       ?       ? 
1 1 1   22   20   31 o    126.1    5.8    0.0000   0.0000          ?        ?   158.9919  14.6860          ?        ?      126.1        5.8       ?       ? 
1 1 1   22   20   32 o     90.4    8.1    0.0000   0.0000          ?        ?    81.7308  14.6860          ?        ?       90.4        8.1       ?       ? 
1 1 1   22   20   33 o    262.9    3.2    0.0000   0.0000          ?        ?   691.5189  16.6016          ?        ?      262.9        3.2       ?       ? 
1 1 1   22   20   34 o    178.6    4.3    0.0000   0.0000          ?        ?   319.2608  15.3245          ?        ?      178.6        4.3       ?       ? 
1 1 1   22   20   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   20   36 o    291.7    2.7    0.0000   0.0000          ?        ?   851.1494  15.9630          ?        ?      291.7        2.7       ?       ? 
1 1 1   22   20   37 o    194.2    3.8    0.0000   0.0000          ?        ?   377.3663  14.6860          ?        ?      194.2        3.8       ?       ? 
1 1 1   22   20   38 o    156.1    4.9    0.0000   0.0000          ?        ?   243.9153  15.3245          ?        ?      156.1        4.9       ?       ? 
1 1 1   22   20   39 o    258.6    3.2    0.0000   0.0000          ?        ?   669.1707  16.6016          ?        ?      258.6        3.2       ?       ? 
1 1 1   22   20   40 o    508.2    2.5    0.0000   0.0000          ?        ?  2583.4585  25.5409          ?        ?      508.2        2.5       ?       ? 
1 1 1   22   20   41 o    264.3    3.3    0.0000   0.0000          ?        ?   698.5427  17.2401          ?        ?      264.3        3.3       ?       ? 
1 1 1   22   20   42 o    252.4    3.4    0.0000   0.0000          ?        ?   637.2446  17.2401          ?        ?      252.4        3.4       ?       ? 
1 1 1   22   20   43 o    276.9    3.2    0.0000   0.0000          ?        ?   766.8644  17.8786          ?        ?      276.9        3.2       ?       ? 
1 1 1   22   20   44 o    237.7    3.6    0.0000   0.0000          ?        ?   565.0916  17.2401          ?        ?      237.7        3.6       ?       ? 
1 1 1   22   20   45 o    587.5    2.7    0.0000   0.0000          ?        ?  3452.4866  31.9261          ?        ?      587.5        2.7       ?       ? 
1 1 1   22   20   46 o    586.6    2.8    0.0000   0.0000          ?        ?  3442.2700  33.2031          ?        ?      586.6        2.8       ?       ? 
1 1 1   22   20   47 o    404.2    3.0    0.0000   0.0000          ?        ?  1634.6154  24.2638          ?        ?      404.2        3.0       ?       ? 
1 1 1   22   20   48 o    279.0    3.4    0.0000   0.0000          ?        ?   778.9964  19.1556          ?        ?      279.0        3.4       ?       ? 
1 1 1   22   20   49 o     96.7    8.9    0.0000   0.0000          ?        ?    93.8627  17.2401          ?        ?       96.7        8.9       ?       ? 
1 1 1   22   20   50 o    215.9    4.1    0.0000   0.0000          ?        ?   466.7593  17.8786          ?        ?      215.9        4.1       ?       ? 
1 1 1   22   20   51 o    316.8    3.1    0.0000   0.0000          ?        ?  1004.3945  19.7942          ?        ?      316.8        3.1       ?       ? 
1 1 1   22   20   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   20   53 o    350.0    3.0    0.0000   0.0000          ?        ?  1225.3230  21.0712          ?        ?      350.0        3.0       ?       ? 
1 1 1   22   20   54 o     91.5   10.1    0.0000   0.0000          ?        ?    84.2849  18.5171          ?        ?       91.5       10.1       ?       ? 
1 1 1   22   20   55 o    516.3    2.7    0.0000   0.0000          ?        ?  2666.4663  28.0950          ?        ?      516.3        2.7       ?       ? 
1 1 1   22   20   56 o    105.4    9.1    0.0000   0.0000          ?        ?   111.7413  19.1556          ?        ?      105.4        9.1       ?       ? 
1 1 1   22   20   57 o     95.2   10.1    0.0000   0.0000          ?        ?    91.3086  19.1556          ?        ?       95.2       10.1       ?       ? 
1 1 1   22   20   58 o    254.9    3.8    0.0000   0.0000          ?        ?   650.6536  19.1556          ?        ?      254.9        3.8       ?       ? 
1 1 1   22   20   59 o    310.1    3.3    0.0000   0.0000          ?        ?   962.2521  20.4327          ?        ?      310.1        3.3       ?       ? 
1 1 1   22   20   60 o    169.8    5.8    0.0000   0.0000          ?        ?   289.2503  19.7942          ?        ?      169.8        5.8       ?       ? 
1 1 1   22   20   61 o     93.7   10.6    0.0000   0.0000          ?        ?    88.7545  19.7942          ?        ?       93.7       10.6       ?       ? 
1 1 1   22   20   62 o     94.7   10.5    0.0000   0.0000          ?        ?    90.6701  19.7942          ?        ?       94.7       10.5       ?       ? 
1 1 1   22   20   63 f    114.2    8.9    0.0000   0.0000          ?        ?   131.5355  20.4327          ?        ?      114.2        8.9       ?       ? 
1 1 1   22   20   64 o    157.6    6.3    0.0000   0.0000          ?        ?   249.6619  19.7942          ?        ?      157.6        6.3       ?       ? 
1 1 1   22   20   65 o    171.7    5.9    0.0000   0.0000          ?        ?   296.2740  20.4327          ?        ?      171.7        5.9       ?       ? 
1 1 1   22   20   66 o    152.1    6.7    0.0000   0.0000          ?        ?   233.0604  20.4327          ?        ?      152.1        6.7       ?       ? 
1 1 1   22   20   67 o     49.1   16.8    0.0000   0.0000          ?        ?    23.6253  19.7942          ?        ?       49.1       16.8       ?       ? 
1 1 1   22   20   68 o    122.0    8.4    0.0000   0.0000          ?        ?   150.6911  20.4327          ?        ?      122.0        8.4       ?       ? 
1 1 1   22   20   69 o    236.2    4.3    0.0000   0.0000          ?        ?   559.9835  20.4327          ?        ?      236.2        4.3       ?       ? 
1 1 1   22   21    0 o   2388.3   17.1 57093.4102 817.9462 57093.4102 817.9462 57093.4102 817.9462     2388.3     17.1     2388.3       17.1     0.0     0.0 
1 1 1   22   21    1 o    624.2    4.4    0.0000   0.0000          ?        ?  3896.2590  54.9129          ?        ?      624.2        4.4       ?       ? 
1 1 1   22   21    2 o   1055.9    4.6    0.0000   0.0000          ?        ? 11150.5039  97.0553          ?        ?     1055.9        4.6       ?       ? 
1 1 1   22   21    3 o    342.1    3.4    0.0000   0.0000          ?        ?  1170.4102  22.9868          ?        ?      342.1        3.4       ?       ? 
1 1 1   22   21    4 o    861.7    4.2    0.0000   0.0000          ?        ?  7426.0063  72.1529          ?        ?      861.7        4.2       ?       ? 
1 1 1   22   21    5 o    964.0    4.0    0.0000   0.0000          ?        ?  9293.0439  77.8996          ?        ?      964.0        4.0       ?       ? 
1 1 1   22   21    6 o    648.3    3.0    0.0000   0.0000          ?        ?  4203.3877  38.9498          ?        ?      648.3        3.0       ?       ? 
1 1 1   22   21    7 o    560.3    2.8    0.0000   0.0000          ?        ?  3139.6108  31.9261          ?        ?      560.3        2.8       ?       ? 
1 1 1   22   21    8 o    231.6    2.2    0.0000   0.0000          ?        ?   536.3582  10.2163          ?        ?      231.6        2.2       ?       ? 
1 1 1   22   21    9 o    631.6    2.9    0.0000   0.0000          ?        ?  3989.4832  36.3957          ?        ?      631.6        2.9       ?       ? 
1 1 1   22   21   10 o    985.5    3.7    0.0000   0.0000          ?        ?  9713.1904  72.1529          ?        ?      985.5        3.7       ?       ? 
1 1 1   22   21   11 o    712.1    2.7    0.0000   0.0000          ?        ?  5071.1387  38.9498          ?        ?      712.1        2.7       ?       ? 
1 1 1   22   21   12 o    974.4    3.8    0.0000   0.0000          ?        ?  9494.8164  74.7070          ?        ?      974.4        3.8       ?       ? 
1 1 1   22   21   13 o    924.0    3.3    0.0000   0.0000          ?        ?  8537.6729  61.2981          ?        ?      924.0        3.3       ?       ? 
1 1 1   22   21   14 o    444.7    2.3    0.0000   0.0000          ?        ?  1977.5016  20.4327          ?        ?      444.7        2.3       ?       ? 
1 1 1   22   21   15 o    562.1    2.5    0.0000   0.0000          ?        ?  3160.0435  28.0950          ?        ?      562.1        2.5       ?       ? 
1 1 1   22   21   16 o    610.0    2.6    0.0000   0.0000          ?        ?  3720.6655  31.9261          ?        ?      610.0        2.6       ?       ? 
1 1 1   22   21   17 o    821.9    3.2    0.0000   0.0000          ?        ?  6755.5586  52.3588          ?        ?      821.9        3.2       ?       ? 
1 1 1   22   21   18 o    474.5    2.5    0.0000   0.0000          ?        ?  2251.4272  23.6253          ?        ?      474.5        2.5       ?       ? 
1 1 1   22   21   19 o    429.7    2.5    0.0000   0.0000          ?        ?  1846.6046  21.7097          ?        ?      429.7        2.5       ?       ? 
1 1 1   22   21   20 o   1867.1    6.1    0.0000   0.0000          ?        ? 34874.1367 229.2293          ?        ?     1867.1        6.1       ?       ? 
1 1 1   22   21   21 o    551.8    2.5    0.0000   0.0000          ?        ?  3045.1096  28.0950          ?        ?      551.8        2.5       ?       ? 
1 1 1   22   21   22 o    716.3    2.9    0.0000   0.0000          ?        ?  5131.7983  40.8654          ?        ?      716.3        2.9       ?       ? 
1 1 1   22   21   23 o    421.2    2.3    0.0000   0.0000          ?        ?  1774.4515  19.7942          ?        ?      421.2        2.3       ?       ? 
1 1 1   22   21   24 o    537.9    2.5    0.0000   0.0000          ?        ?  2893.1416  26.8179          ?        ?      537.9        2.5       ?       ? 
1 1 1   22   21   25 o     34.7   13.2    0.0000   0.0000          ?        ?     8.3008  12.7704          ?        ?       34.7       13.2       ?       ? 
1 1 1   22   21   26 o    823.5    3.2    0.0000   0.0000          ?        ?  6781.7383  52.3588          ?        ?      823.5        3.2       ?       ? 
1 1 1   22   21   27 o    380.1    2.5    0.0000   0.0000          ?        ?  1444.9745  19.1556          ?        ?      380.1        2.5       ?       ? 
1 1 1   22   21   28 o    500.5    2.6    0.0000   0.0000          ?        ?  2505.5588  25.5409          ?        ?      500.5        2.6       ?       ? 
1 1 1   22   21   29 o    367.5    2.4    0.0000   0.0000          ?        ?  1350.4733  17.8786          ?        ?      367.5        2.4       ?       ? 
1 1 1   22   21   30 o    124.0    5.9    0.0000   0.0000          ?        ?   153.8837  14.6860          ?        ?      124.0        5.9       ?       ? 
1 1 1   22   21   31 o     38.2   13.4    0.0000   0.0000          ?        ?    12.7704  12.7704          ?        ?       38.2       13.4       ?       ? 
1 1 1   22   21   32 o    432.2    2.5    0.0000   0.0000          ?        ?  1868.3143  21.7097          ?        ?      432.2        2.5       ?       ? 
1 1 1   22   21   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   21   34 o     16.9    8.6    0.0000   0.0000          ?        ?   -52.9973  14.6860          ?        ?       16.9        8.6       ?       ? 
1 1 1   22   21   35 o    243.5    3.3    0.0000   0.0000          ?        ?   593.1866  15.9630          ?        ?      243.5        3.3       ?       ? 
1 1 1   22   21   36 o    538.9    2.7    0.0000   0.0000          ?        ?  2904.6348  28.7335          ?        ?      538.9        2.7       ?       ? 
1 1 1   22   21   37 f    192.4    4.1    0.0000   0.0000          ?        ?   370.3425  15.9630          ?        ?      192.4        4.1       ?       ? 
1 1 1   22   21   38 o    265.4    3.0    0.0000   0.0000          ?        ?   704.2894  15.9630          ?        ?      265.4        3.0       ?       ? 
1 1 1   22   21   39 o    168.9    4.5    0.0000   0.0000          ?        ?   285.4192  15.3245          ?        ?      168.9        4.5       ?       ? 
1 1 1   22   21   40 o    335.3    2.7    0.0000   0.0000          ?        ?  1124.4366  17.8786          ?        ?      335.3        2.7       ?       ? 
1 1 1   22   21   41 f    208.0    3.8    0.0000   0.0000          ?        ?   432.9177  15.9630          ?        ?      208.0        3.8       ?       ? 
1 1 1   22   21   42 o    339.2    2.8    0.0000   0.0000          ?        ?  1150.6160  19.1556          ?        ?      339.2        2.8       ?       ? 
1 1 1   22   21   43 o     25.4   11.9    0.0000   0.0000          ?        ?   -15.9630  15.3245          ?        ?       25.4       11.9       ?       ? 
1 1 1   22   21   44 o    537.8    2.6    0.0000   0.0000          ?        ?  2893.1416  28.0950          ?        ?      537.8        2.6       ?       ? 
1 1 1   22   21   45 o    229.4    4.2    0.0000   0.0000          ?        ?   526.7803  19.1556          ?        ?      229.4        4.2       ?       ? 
1 1 1   22   21   46 o    352.2    3.1    0.0000   0.0000          ?        ?  1240.6476  21.7097          ?        ?      352.2        3.1       ?       ? 
1 1 1   22   21   47 o    172.2    5.6    0.0000   0.0000          ?        ?   296.9126  19.1556          ?        ?      172.2        5.6       ?       ? 
1 1 1   22   21   48 o    562.2    2.9    0.0000   0.0000          ?        ?  3161.9592  32.5646          ?        ?      562.2        2.9       ?       ? 
1 1 1   22   21   49 o    341.6    3.2    0.0000   0.0000          ?        ?  1167.8560  21.7097          ?        ?      341.6        3.2       ?       ? 
1 1 1   22   21   50 o    519.3    2.8    0.0000   0.0000          ?        ?  2697.7539  29.3720          ?        ?      519.3        2.8       ?       ? 
1 1 1   22   21   51 o    266.4    3.4    0.0000   0.0000          ?        ?   710.0360  17.8786          ?        ?      266.4        3.4       ?       ? 
1 1 1   22   21   52 o    288.9    3.4    0.0000   0.0000          ?        ?   835.1863  19.7942          ?        ?      288.9        3.4       ?       ? 
1 1 1   22   21   53 o     22.4   11.0    0.0000   0.0000          ?        ?   -39.5883  17.8786          ?        ?       22.4       11.0       ?       ? 
1 1 1   22   21   54 o    150.0    6.0    0.0000   0.0000          ?        ?   225.3981  17.8786          ?        ?      150.0        6.0       ?       ? 
1 1 1   22   21   55 o    194.7    5.1    0.0000   0.0000          ?        ?   379.9204  19.7942          ?        ?      194.7        5.1       ?       ? 
1 1 1   22   21   56 o    287.4    3.8    0.0000   0.0000          ?        ?   826.8855  21.7097          ?        ?      287.4        3.8       ?       ? 
1 1 1   22   21   57 o     75.4   12.3    0.0000   0.0000          ?        ?    57.4669  18.5171          ?        ?       75.4       12.3       ?       ? 
1 1 1   22   21   58 o    211.2    4.8    0.0000   0.0000          ?        ?   446.9651  20.4327          ?        ?      211.2        4.8       ?       ? 
1 1 1   22   21   59 o    231.4    4.4    0.0000   0.0000          ?        ?   536.3582  20.4327          ?        ?      231.4        4.4       ?       ? 
1 1 1   22   21   60 o    279.8    3.9    0.0000   0.0000          ?        ?   784.1046  21.7097          ?        ?      279.8        3.9       ?       ? 
1 1 1   22   21   61 o     74.0   13.4    0.0000   0.0000          ?        ?    57.4669  19.1556          ?        ?       74.0       13.4       ?       ? 
1 1 1   22   21   62 o     34.3   15.1    0.0000   0.0000          ?        ?    -5.7467  20.4327          ?        ?       34.3       15.1       ?       ? 
1 1 1   22   21   63 o    136.5    7.5    0.0000   0.0000          ?        ?   187.7254  20.4327          ?        ?      136.5        7.5       ?       ? 
1 1 1   22   21   64 o    129.5    7.9    0.0000   0.0000          ?        ?   169.2082  20.4327          ?        ?      129.5        7.9       ?       ? 
1 1 1   22   21   65 o    239.9    4.4    0.0000   0.0000          ?        ?   577.2236  21.0712          ?        ?      239.9        4.4       ?       ? 
1 1 1   22   21   66 o     30.3   14.2    0.0000   0.0000          ?        ?   -18.5171  21.0712          ?        ?       30.3       14.2       ?       ? 
1 1 1   22   21   67 o     84.0   11.4    0.0000   0.0000          ?        ?    72.1529  19.1556          ?        ?       84.0       11.4       ?       ? 
1 1 1   22   21   68 o     60.3   16.1    0.0000   0.0000          ?        ?    39.5883  19.7942          ?        ?       60.3       16.1       ?       ? 
1 1 1   22   22    0 o    768.3    8.5 5905.6865 130.8969  5905.6865 130.8969  5905.6865 130.8969      768.3      8.5      768.3        8.5     0.0     0.0 
1 1 1   22   22    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   22    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   22    3 o     21.7   15.1  -17.8786  22.3483   -17.8786  22.3483   -17.8786  22.3483       21.7     15.1       21.7       15.1     0.0     0.0 
1 1 1   22   22    4 o    266.9    3.6  712.5901  19.1556   712.5901  19.1556   712.5901  19.1556      266.9      3.6      266.9        3.6     0.0     0.0 
1 1 1   22   22    5 o    805.8    5.1 6495.0420  81.7308  6495.0420  81.7308  6495.0420  81.7308      805.8      5.1      805.8        5.1     0.0     0.0 
1 1 1   22   22    6 o    338.9    4.0 1149.3389  26.8179  1149.3389  26.8179  1149.3389  26.8179      338.9      4.0      338.9        4.0     0.0     0.0 
1 1 1   22   22    7 o   1154.4    6.2 13330.4160 143.6674 13330.4160 143.6674 13330.4160 143.6674     1154.4      6.2     1154.4        6.2     0.0     0.0 
1 1 1   22   22    8 o    878.4    4.4 7716.5337  77.8996  7716.5337  77.8996  7716.5337  77.8996      878.4      4.4      878.4        4.4     0.0     0.0 
1 1 1   22   22    9 o    261.6    2.9  684.4952  15.3245   684.4952  15.3245   684.4952  15.3245      261.6      2.9      261.6        2.9     0.0     0.0 
1 1 1   22   22   10 o   1164.7    5.9 13567.3076 137.2822 13567.3076 137.2822 13567.3076 137.2822     1164.7      5.9     1164.7        5.9     0.0     0.0 
1 1 1   22   22   11 o   1015.2    5.1 10308.9316 103.4405 10308.9316 103.4405 10308.9316 103.4405     1015.2      5.1     1015.2        5.1     0.0     0.0 
1 1 1   22   22   12 o    260.9    5.8  681.9411  30.0105   681.9411  30.0105   681.9411  30.0105      260.9      5.8      260.9        5.8     0.0     0.0 
1 1 1   22   22   13 o    172.7    4.8  298.8281  16.6016   298.8281  16.6016   298.8281  16.6016      172.7      4.8      172.7        4.8     0.0     0.0 
1 1 1   22   22   14 o    635.2    3.7 4035.4568  46.6121  4035.4568  46.6121  4035.4568  46.6121      635.2      3.7      635.2        3.7     0.0     0.0 
1 1 1   22   22   15 o    150.7    5.1  227.9522  15.3245   227.9522  15.3245   227.9522  15.3245      150.7      5.1      150.7        5.1     0.0     0.0 
1 1 1   22   22   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   22   17 o    450.7    4.0 2031.7759  36.3957  2031.7759  36.3957  2031.7759  36.3957      450.7      4.0      450.7        4.0     0.0     0.0 
1 1 1   22   22   18 o    872.0    4.7 7604.7925  82.3693  7604.7925  82.3693  7604.7925  82.3693      872.0      4.7      872.0        4.7     0.0     0.0 
1 1 1   22   22   19 o    236.8    4.6  561.2605  21.7097   561.2605  21.7097   561.2605  21.7097      236.8      4.6      236.8        4.6     0.0     0.0 
1 1 1   22   22   20 o    900.1    4.8 8104.1162  85.5619  8104.1162  85.5619  8104.1162  85.5619      900.1      4.8      900.1        4.8     0.0     0.0 
1 1 1   22   22   21 o    485.0    3.7 2352.9521  35.7572  2352.9521  35.7572  2352.9521  35.7572      485.0      3.7      485.0        3.7     0.0     0.0 
1 1 1   22   22   22 f   1139.8    5.6 12995.8311 127.0658 12995.8311 127.0658 12995.8311 127.0658     1139.8      5.6     1139.8        5.6     0.0     0.0 
1 1 1   22   22   23 o    324.6    3.3 1054.1992  21.7097  1054.1992  21.7097  1054.1992  21.7097      324.6      3.3      324.6        3.3     0.0     0.0 
1 1 1   22   22   24 o    249.8    4.1  624.4742  20.4327   624.4742  20.4327   624.4742  20.4327      249.8      4.1      249.8        4.1     0.0     0.0 
1 1 1   22   22   25 o   1049.1    5.3 11008.7510 111.7413 11008.7510 111.7413 11008.7510 111.7413     1049.1      5.3     1049.1        5.3     0.0     0.0 
1 1 1   22   22   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   22   27 o    316.3    3.7 1001.2019  23.6253  1001.2019  23.6253  1001.2019  23.6253      316.3      3.7      316.3        3.7     0.0     0.0 
1 1 1   22   22   28 o     94.0   10.8   91.9471  19.7942    91.9471  19.7942    91.9471  19.7942       94.0     10.8       94.0       10.8     0.0     0.0 
1 1 1   22   22   29 o   1321.4    6.4 17468.0352 168.5697 17468.0352 168.5697 17468.0352 168.5697     1321.4      6.4     1321.4        6.4     0.0     0.0 
1 1 1   22   22   30 o    441.3    3.7 1948.1295  32.5646  1948.1295  32.5646  1948.1295  32.5646      441.3      3.7      441.3        3.7     0.0     0.0 
1 1 1   22   22   31 o    268.6    4.2  722.1680  22.3483   722.1680  22.3483   722.1680  22.3483      268.6      4.2      268.6        4.2     0.0     0.0 
1 1 1   22   22   32 o    527.5    4.2 2783.9543  44.6965  2783.9543  44.6965  2783.9543  44.6965      527.5      4.2      527.5        4.2     0.0     0.0 
1 1 1   22   22   33 o    290.9    4.3  846.6797  24.9023   846.6797  24.9023   846.6797  24.9023      290.9      4.3      290.9        4.3     0.0     0.0 
1 1 1   22   22   34 o    527.5    3.6 2783.3157  38.3113  2783.3157  38.3113  2783.3157  38.3113      527.5      3.6      527.5        3.6     0.0     0.0 
1 1 1   22   22   35 o    707.2    3.9 5003.4551  55.5514  5003.4551  55.5514  5003.4551  55.5514      707.2      3.9      707.2        3.9     0.0     0.0 
1 1 1   22   22   36 o    181.2    5.8  329.4771  21.0712   329.4771  21.0712   329.4771  21.0712      181.2      5.8      181.2        5.8     0.0     0.0 
1 1 1   22   22   37 o     25.7   17.0   -3.1926  21.7097    -3.1926  21.7097    -3.1926  21.7097       25.7     17.0       25.7       17.0     0.0     0.0 
1 1 1   22   22   38 o    351.4    4.2 1235.5393  29.3720  1235.5393  29.3720  1235.5393  29.3720      351.4      4.2      351.4        4.2     0.0     0.0 
1 1 1   22   22   39 o    103.4    9.7  109.8257  19.7942   109.8257  19.7942   109.8257  19.7942      103.4      9.7      103.4        9.7     0.0     0.0 
1 1 1   22   22   40 o    456.3    3.9 2082.8577  35.7572  2082.8577  35.7572  2082.8577  35.7572      456.3      3.9      456.3        3.9     0.0     0.0 
1 1 1   22   22   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   22   42 o     14.1   10.5  -70.8759  22.3483   -70.8759  22.3483   -70.8759  22.3483       14.1     10.5       14.1       10.5     0.0     0.0 
1 1 1   22   22   43 o    428.2    4.2 1835.1111  35.7572  1835.1111  35.7572  1835.1111  35.7572      428.2      4.2      428.2        4.2     0.0     0.0 
1 1 1   22   22   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   22   45 o    888.8    5.2 7905.5361  91.9471  7905.5361  91.9471  7905.5361  91.9471      888.8      5.2      888.8        5.2     0.0     0.0 
1 1 1   22   22   46 o    359.1    4.4 1290.4523  31.9261  1290.4523  31.9261  1290.4523  31.9261      359.1      4.4      359.1        4.4     0.0     0.0 
1 1 1   22   22   47 o    495.2    4.8 2453.8386  47.2506  2453.8386  47.2506  2453.8386  47.2506      495.2      4.8      495.2        4.8     0.0     0.0 
1 1 1   22   22   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   22   49 o    196.6    6.5  388.2211  25.5409   388.2211  25.5409   388.2211  25.5409      196.6      6.5      196.6        6.5     0.0     0.0 
1 1 1   22   22   50 o    604.0    3.8 3649.7896  45.9736  3649.7896  45.9736  3649.7896  45.9736      604.0      3.8      604.0        3.8     0.0     0.0 
1 1 1   22   22   51 o    212.5    6.3  453.3503  26.8179   453.3503  26.8179   453.3503  26.8179      212.5      6.3      212.5        6.3     0.0     0.0 
1 1 1   22   22   52 o    193.2    6.5  374.8122  24.9023   374.8122  24.9023   374.8122  24.9023      193.2      6.5      193.2        6.5     0.0     0.0 
1 1 1   22   22   53 o     28.3   18.2    1.9156  22.9868     1.9156  22.9868     1.9156  22.9868       28.3     18.2       28.3       18.2     0.0     0.0 
1 1 1   22   22   54 o    409.4    3.8 1677.3964  31.2876  1677.3964  31.2876  1677.3964  31.2876      409.4      3.8      409.4        3.8     0.0     0.0 
1 1 1   22   22   55 o    340.8    4.4 1162.7479  30.0105  1162.7479  30.0105  1162.7479  30.0105      340.8      4.4      340.8        4.4     0.0     0.0 
1 1 1   22   22   56 o     46.9   23.5   33.2031  26.8179    33.2031  26.8179    33.2031  26.8179       46.9     23.5       46.9       23.5     0.0     0.0 
1 1 1   22   22   57 o     68.5   21.3   59.3825  25.5409    59.3825  25.5409    59.3825  25.5409       68.5     21.3       68.5       21.3     0.0     0.0 
1 1 1   22   22   58 o    219.7    6.3  484.6379  27.4564   484.6379  27.4564   484.6379  27.4564      219.7      6.3      219.7        6.3     0.0     0.0 
1 1 1   22   22   59 o    114.4   12.8  136.6436  28.7335   136.6436  28.7335   136.6436  28.7335      114.4     12.8      114.4       12.8     0.0     0.0 
1 1 1   22   22   60 o    418.2    4.3 1750.8264  35.7572  1750.8264  35.7572  1750.8264  35.7572      418.2      4.3      418.2        4.3     0.0     0.0 
1 1 1   22   22   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   22   22   62 o    144.7   10.5  213.9047  30.0105   213.9047  30.0105   213.9047  30.0105      144.7     10.5      144.7       10.5     0.0     0.0 
1 1 1   22   22   63 o     19.1   14.0  -52.9973  28.0950   -52.9973  28.0950   -52.9973  28.0950       19.1     14.0       19.1       14.0     0.0     0.0 
1 1 1   22   22   64 o    344.0    4.7 1185.7346  32.5646  1185.7346  32.5646  1185.7346  32.5646      344.0      4.7      344.0        4.7     0.0     0.0 
1 1 1   22   22   65 o    118.6   11.8  146.2215  27.4564   146.2215  27.4564   146.2215  27.4564      118.6     11.8      118.6       11.8     0.0     0.0 
1 1 1   22   22   66 o     26.4   18.0  -12.1319  28.0950   -12.1319  28.0950   -12.1319  28.0950       26.4     18.0       26.4       18.0     0.0     0.0 
1 1 1   22   22   67 o     43.6   23.3   29.3720  27.4564    29.3720  27.4564    29.3720  27.4564       43.6     23.3       43.6       23.3     0.0     0.0 
1 1 1   23    0    0 o    785.9    5.8 6177.0586  91.3086  6177.0586  91.3086  6177.0586  91.3086      785.9      5.8      785.9        5.8     0.0     0.0 
1 1 1   23    0    1 o    213.0    2.4  453.9889  10.2163   453.9889  10.2163   453.9889  10.2163      213.0      2.4      213.0        2.4     0.0     0.0 
1 1 1   23    0    2 o   1016.6    5.1 10337.0264 102.8020 10337.0264 102.8020 10337.0264 102.8020     1016.6      5.1     1016.6        5.1     0.0     0.0 
1 1 1   23    0    3 o    827.2    4.2 6843.0361  69.5989  6843.0361  69.5989  6843.0361  69.5989      827.2      4.2      827.2        4.2     0.0     0.0 
1 1 1   23    0    4 o    240.6    2.3  579.1391  10.8549   579.1391  10.8549   579.1391  10.8549      240.6      2.3      240.6        2.3     0.0     0.0 
1 1 1   23    0    5 o    446.7    2.7 1996.0187  24.2638  1996.0187  24.2638  1996.0187  24.2638      446.7      2.7      446.7        2.7     0.0     0.0 
1 1 1   23    0    6 o    364.0    2.5 1324.9324  17.8786  1324.9324  17.8786  1324.9324  17.8786      364.0      2.5      364.0        2.5     0.0     0.0 
1 1 1   23    0    7 o    238.0    2.3  566.3687  10.8549   566.3687  10.8549   566.3687  10.8549      238.0      2.3      238.0        2.3     0.0     0.0 
1 1 1   23    0    8 o    313.0    2.3  980.1307  14.6860   980.1307  14.6860   980.1307  14.6860      313.0      2.3      313.0        2.3     0.0     0.0 
1 1 1   23    0    9 o   1455.9    6.9 21198.9180 199.8573 21198.9180 199.8573 21198.9180 199.8573     1455.9      6.9     1455.9        6.9     0.0     0.0 
1 1 1   23    0   10 o    886.3    4.5 7856.3701  79.8152  7856.3701  79.8152  7856.3701  79.8152      886.3      4.5      886.3        4.5     0.0     0.0 
1 1 1   23    0   11 o    574.0    3.2 3294.7715  37.0343  3294.7715  37.0343  3294.7715  37.0343      574.0      3.2      574.0        3.2     0.0     0.0 
1 1 1   23    0   12 o   1173.0    5.7 13761.4180 133.4510 13761.4180 133.4510 13761.4180 133.4510     1173.0      5.7     1173.0        5.7     0.0     0.0 
1 1 1   23    0   13 o    539.1    3.3 2907.1890  35.1187  2907.1890  35.1187  2907.1890  35.1187      539.1      3.3      539.1        3.3     0.0     0.0 
1 1 1   23    0   14 o   1388.1    6.6 19271.8594 184.5327 19271.8594 184.5327 19271.8594 184.5327     1388.1      6.6     1388.1        6.6     0.0     0.0 
1 1 1   23    0   15 o   1420.3    7.3 20175.3672 208.1580 20175.3672 208.1580 20175.3672 208.1580     1420.3      7.3     1420.3        7.3     0.0     0.0 
1 1 1   23    0   16 o    487.6    3.1 2377.8545  30.6490  2377.8545  30.6490  2377.8545  30.6490      487.6      3.1      487.6        3.1     0.0     0.0 
1 1 1   23    0   17 f   2763.9   15.2 76428.4844 841.5715 76428.4844 841.5715 76428.4844 841.5715     2763.9     15.2     2763.9       15.2     0.0     0.0 
1 1 1   23    0   18 o   2807.5   13.3 78849.7578 744.5162 78849.7578 744.5162 78849.7578 744.5162     2807.5     13.3     2807.5       13.3     0.0     0.0 
1 1 1   23    0   19 o    562.4    3.6 3163.8748  40.2269  3163.8748  40.2269  3163.8748  40.2269      562.4      3.6      562.4        3.6     0.0     0.0 
1 1 1   23    0   20 o    582.2    3.6 3390.5498  42.1424  3390.5498  42.1424  3390.5498  42.1424      582.2      3.6      582.2        3.6     0.0     0.0 
1 1 1   23    0   21 o     11.6    8.6  -37.0343  13.4090   -37.0343  13.4090   -37.0343  13.4090       11.6      8.6       11.6        8.6     0.0     0.0 
1 1 1   23    0   22 o   1529.9    7.2 23410.1191 220.2900 23410.1191 220.2900 23410.1191 220.2900     1529.9      7.2     1529.9        7.2     0.0     0.0 
1 1 1   23    0   23 o   2622.5   20.7 68830.7188 1085.4868 68830.7188 1085.4868 68830.7188 1085.4868     2622.5     20.7     2622.5       20.7     0.0     0.0 
1 1 1   23    0   24 o   2539.0   13.3 64485.5781 675.5559 64485.5781 675.5559 64485.5781 675.5559     2539.0     13.3     2539.0       13.3     0.0     0.0 
1 1 1   23    0   25 o    629.9    3.8 3968.4119  47.2506  3968.4119  47.2506  3968.4119  47.2506      629.9      3.8      629.9        3.8     0.0     0.0 
1 1 1   23    0   26 o    351.7    3.5 1237.4550  24.9023  1237.4550  24.9023  1237.4550  24.9023      351.7      3.5      351.7        3.5     0.0     0.0 
1 1 1   23    0   27 o   1435.8    6.9 20617.8633 197.9417 20617.8633 197.9417 20617.8633 197.9417     1435.8      6.9     1435.8        6.9     0.0     0.0 
1 1 1   23    0   28 f    683.1    4.0 4666.3159  54.9129  4666.3159  54.9129  4666.3159  54.9129      683.1      4.0      683.1        4.0     0.0     0.0 
1 1 1   23    0   29 o   1014.5    6.5 10293.6074 132.8125 10293.6074 132.8125 10293.6074 132.8125     1014.5      6.5     1014.5        6.5     0.0     0.0 
1 1 1   23    0   30 o    467.9    4.6 2190.1292  43.4195  2190.1292  43.4195  2190.1292  43.4195      467.9      4.6      467.9        4.6     0.0     0.0 
1 1 1   23    0   31 o     80.6   14.9   70.8759  21.7097    70.8759  21.7097    70.8759  21.7097       80.6     14.9       80.6       14.9     0.0     0.0 
1 1 1   23    0   32 o    452.9    3.6 2051.5698  32.5646  2051.5698  32.5646  2051.5698  32.5646      452.9      3.6      452.9        3.6     0.0     0.0 
1 1 1   23    0   33 o   1166.4    6.1 13607.5352 143.0288 13607.5352 143.0288 13607.5352 143.0288     1166.4      6.1     1166.4        6.1     0.0     0.0 
1 1 1   23    0   34 o    382.7    3.8 1465.4071  29.3720  1465.4071  29.3720  1465.4071  29.3720      382.7      3.8      382.7        3.8     0.0     0.0 
1 1 1   23    0   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    0   36 o     79.2   20.6   74.0685  28.0950    74.0685  28.0950    74.0685  28.0950       79.2     20.6       79.2       20.6     0.0     0.0 
1 1 1   23    0   37 o   1071.1    5.4 11473.5957 114.9339 11473.5957 114.9339 11473.5957 114.9339     1071.1      5.4     1071.1        5.4     0.0     0.0 
1 1 1   23    0   38 o     28.6   21.4 -363.3188 102.1635  -363.3188 102.1635  -363.3188 102.1635       28.6     21.4       28.6       21.4     0.0     0.0 
1 1 1   23    0   39 o    573.1    4.0 3285.1938  45.3350  3285.1938  45.3350  3285.1938  45.3350      573.1      4.0      573.1        4.0     0.0     0.0 
1 1 1   23    0   40 o    423.9    4.2 1797.4384  35.7572  1797.4384  35.7572  1797.4384  35.7572      423.9      4.2      423.9        4.2     0.0     0.0 
1 1 1   23    0   41 o     14.5   10.8  -88.7545  25.5409   -88.7545  25.5409   -88.7545  25.5409       14.5     10.8       14.5       10.8     0.0     0.0 
1 1 1   23    0   42 o    375.7    4.0 1411.7714  30.0105  1411.7714  30.0105  1411.7714  30.0105      375.7      4.0      375.7        4.0     0.0     0.0 
1 1 1   23    0   43 o    721.4    4.5 5205.8667  65.1292  5205.8667  65.1292  5205.8667  65.1292      721.4      4.5      721.4        4.5     0.0     0.0 
1 1 1   23    0   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    0   45 o    826.6    4.4 6834.0972  72.7915  6834.0972  72.7915  6834.0972  72.7915      826.6      4.4      826.6        4.4     0.0     0.0 
1 1 1   23    0   46 o     43.5   22.0   28.0950  23.6253    28.0950  23.6253    28.0950  23.6253       43.5     22.0       43.5       22.0     0.0     0.0 
1 1 1   23    0   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    0   48 o    753.2    4.5 5675.1802  68.3218  5675.1802  68.3218  5675.1802  68.3218      753.2      4.5      753.2        4.5     0.0     0.0 
1 1 1   23    0   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    0   50 o    553.7    3.7 3066.1809  40.8654  3066.1809  40.8654  3066.1809  40.8654      553.7      3.7      553.7        3.7     0.0     0.0 
1 1 1   23    0   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    0   52 o    124.3   10.2  157.7148  24.9023   157.7148  24.9023   157.7148  24.9023      124.3     10.2      124.3       10.2     0.0     0.0 
1 1 1   23    0   53 o    251.0    5.9  631.4979  29.3720   631.4979  29.3720   631.4979  29.3720      251.0      5.9      251.0        5.9     0.0     0.0 
1 1 1   23    0   54 f    325.6    4.3 1061.2229  28.0950  1061.2229  28.0950  1061.2229  28.0950      325.6      4.3      325.6        4.3     0.0     0.0 
1 1 1   23    0   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    0   56 o    193.1    7.0  374.8122  26.8179   374.8122  26.8179   374.8122  26.8179      193.1      7.0      193.1        7.0     0.0     0.0 
1 1 1   23    0   57 o    685.8    4.2 4704.6274  57.4669  4704.6274  57.4669  4704.6274  57.4669      685.8      4.2      685.8        4.2     0.0     0.0 
1 1 1   23    0   58 o    108.4   13.3  123.2347  28.0950   123.2347  28.0950   123.2347  28.0950      108.4     13.3      108.4       13.3     0.0     0.0 
1 1 1   23    0   59 o    211.8    6.2  450.1577  26.1794   450.1577  26.1794   450.1577  26.1794      211.8      6.2      211.8        6.2     0.0     0.0 
1 1 1   23    0   60 o     15.3   11.4  -86.2004  26.8179   -86.2004  26.8179   -86.2004  26.8179       15.3     11.4       15.3       11.4     0.0     0.0 
1 1 1   23    0   61 o    170.8    8.3  294.3585  28.0950   294.3585  28.0950   294.3585  28.0950      170.8      8.3      170.8        8.3     0.0     0.0 
1 1 1   23    0   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    0   63 o    592.5    4.4 3513.7844  52.3588  3513.7844  52.3588  3513.7844  52.3588      592.5      4.4      592.5        4.4     0.0     0.0 
1 1 1   23    0   64 o    174.6    8.5  307.7674  29.3720   307.7674  29.3720   307.7674  29.3720      174.6      8.5      174.6        8.5     0.0     0.0 
1 1 1   23    0   65 o    386.0    4.5 1491.5865  34.4802  1491.5865  34.4802  1491.5865  34.4802      386.0      4.5      386.0        4.5     0.0     0.0 
1 1 1   23    0   66 o    205.9    7.8  426.5325  31.9261   426.5325  31.9261   426.5325  31.9261      205.9      7.8      205.9        7.8     0.0     0.0 
1 1 1   23    0   67 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    0   68 o    302.7    5.1  918.1941  30.6490   918.1941  30.6490   918.1941  30.6490      302.7      5.1      302.7        5.1     0.0     0.0 
1 1 1   23    0   69 o     15.2   11.4 -100.8864  28.7335  -100.8864  28.7335  -100.8864  28.7335       15.2     11.4       15.2       11.4     0.0     0.0 
1 1 1   23    0   70 o     23.9   16.7  -23.6253  28.0950   -23.6253  28.0950   -23.6253  28.0950       23.9     16.7       23.9       16.7     0.0     0.0 
1 1 1   23    0   71 o    220.8    7.1  490.3846  31.2876   490.3846  31.2876   490.3846  31.2876      220.8      7.1      220.8        7.1     0.0     0.0 
1 1 1   23    0   72 o     23.6   16.6  -26.8179  28.7335   -26.8179  28.7335   -26.8179  28.7335       23.6     16.6       23.6       16.6     0.0     0.0 
1 1 1   23    0   73 o     26.9   18.3  -12.1319  28.7335   -12.1319  28.7335   -12.1319  28.7335       26.9     18.3       26.9       18.3     0.0     0.0 
1 1 1   23    0   74 o     67.7   24.7   62.5751  30.6490    62.5751  30.6490    62.5751  30.6490       67.7     24.7       67.7       24.7     0.0     0.0 
1 1 1   23    0   75 o     83.1   22.3   84.2849  31.9261    84.2849  31.9261    84.2849  31.9261       83.1     22.3       83.1       22.3     0.0     0.0 
1 1 1   23    0   76 o     57.0   24.9   48.5276  29.3720    48.5276  29.3720    48.5276  29.3720       57.0     24.9       57.0       24.9     0.0     0.0 
1 1 1   23    0   77 o    161.9   10.5  268.1791  33.8416   268.1791  33.8416   268.1791  33.8416      161.9     10.5      161.9       10.5     0.0     0.0 
1 1 1   23    1    0 o    694.6    3.8 4824.6694  52.3588  4824.6694  52.3588  4824.6694  52.3588      694.6      3.8      694.6        3.8     0.0     0.0 
1 1 1   23    1    1 o    475.7    2.0    0.0000   0.0000          ?        ?  2262.9207  19.1556          ?        ?      475.7        2.0       ?       ? 
1 1 1   23    1    2 o    713.4    2.7    0.0000   0.0000          ?        ?  5089.0176  38.3113          ?        ?      713.4        2.7       ?       ? 
1 1 1   23    1    3 o   1139.0    4.0    0.0000   0.0000          ?        ? 12973.4824  90.0316          ?        ?     1139.0        4.0       ?       ? 
1 1 1   23    1    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    1    5 o    580.9    2.3    0.0000   0.0000          ?        ?  3373.9485  26.8179          ?        ?      580.9        2.3       ?       ? 
1 1 1   23    1    6 o    613.9    2.4    0.0000   0.0000          ?        ?  3769.1931  29.3720          ?        ?      613.9        2.4       ?       ? 
1 1 1   23    1    7 o    216.8    1.9    0.0000   0.0000          ?        ?   469.9519   8.3008          ?        ?      216.8        1.9       ?       ? 
1 1 1   23    1    8 o   1154.4    4.0    0.0000   0.0000          ?        ? 13327.2227  91.9471          ?        ?     1154.4        4.0       ?       ? 
1 1 1   23    1    9 o   1194.5    4.1    0.0000   0.0000          ?        ? 14268.4053  97.0553          ?        ?     1194.5        4.1       ?       ? 
1 1 1   23    1   10 o   2079.7    6.8    0.0000   0.0000          ?        ? 43258.5625 280.9495          ?        ?     2079.7        6.8       ?       ? 
1 1 1   23    1   11 o    736.7    2.7    0.0000   0.0000          ?        ?  5427.4336  39.5883          ?        ?      736.7        2.7       ?       ? 
1 1 1   23    1   12 o   1247.3    4.2    0.0000   0.0000          ?        ? 15558.8564 105.3561          ?        ?     1247.3        4.2       ?       ? 
1 1 1   23    1   13 o    669.9    2.5    0.0000   0.0000          ?        ?  4487.5298  33.8416          ?        ?      669.9        2.5       ?       ? 
1 1 1   23    1   14 o   2409.4    8.5    0.0000   0.0000          ?        ? 58065.8789 408.6538          ?        ?     2409.4        8.5       ?       ? 
1 1 1   23    1   15 o    723.6    2.8    0.0000   0.0000          ?        ?  5236.5156  40.2269          ?        ?      723.6        2.8       ?       ? 
1 1 1   23    1   16 o   1704.0    5.6    0.0000   0.0000          ?        ? 29039.3242 190.2794          ?        ?     1704.0        5.6       ?       ? 
1 1 1   23    1   17 o    491.9    2.3    0.0000   0.0000          ?        ?  2419.3584  22.3483          ?        ?      491.9        2.3       ?       ? 
1 1 1   23    1   18 o   1446.4    4.8    0.0000   0.0000          ?        ? 20921.8008 139.8362          ?        ?     1446.4        4.8       ?       ? 
1 1 1   23    1   19 o    613.9    2.7    0.0000   0.0000          ?        ?  3769.1931  33.2031          ?        ?      613.9        2.7       ?       ? 
1 1 1   23    1   20 f   1475.6    5.0    0.0000   0.0000          ?        ? 21774.8633 147.4985          ?        ?     1475.6        5.0       ?       ? 
1 1 1   23    1   21 o    393.3    1.9    0.0000   0.0000          ?        ?  1546.4994  15.3245          ?        ?      393.3        1.9       ?       ? 
1 1 1   23    1   22 o   1701.2    5.6    0.0000   0.0000          ?        ? 28944.1855 189.0024          ?        ?     1701.2        5.6       ?       ? 
1 1 1   23    1   23 o    584.1    2.7    0.0000   0.0000          ?        ?  3412.2598  31.2876          ?        ?      584.1        2.7       ?       ? 
1 1 1   23    1   24 o   1899.3    6.2    0.0000   0.0000          ?        ? 36078.3867 235.6145          ?        ?     1899.3        6.2       ?       ? 
1 1 1   23    1   25 o    537.0    2.6    0.0000   0.0000          ?        ?  2884.2021  27.4564          ?        ?      537.0        2.6       ?       ? 
1 1 1   23    1   26 o    792.4    3.1    0.0000   0.0000          ?        ?  6278.5830  49.8047          ?        ?      792.4        3.1       ?       ? 
1 1 1   23    1   27 o    978.9    3.7    0.0000   0.0000          ?        ?  9582.2939  71.5144          ?        ?      978.9        3.7       ?       ? 
1 1 1   23    1   28 o    986.0    3.9    0.0000   0.0000          ?        ?  9722.1299  75.9841          ?        ?      986.0        3.9       ?       ? 
1 1 1   23    1   29 o    347.3    2.8    0.0000   0.0000          ?        ?  1206.1674  19.1556          ?        ?      347.3        2.8       ?       ? 
1 1 1   23    1   30 o    379.5    2.3    0.0000   0.0000          ?        ?  1440.5049  17.2401          ?        ?      379.5        2.3       ?       ? 
1 1 1   23    1   31 f    737.0    3.2    0.0000   0.0000          ?        ?  5431.9033  47.2506          ?        ?      737.0        3.2       ?       ? 
1 1 1   23    1   32 o    492.5    2.5    0.0000   0.0000          ?        ?  2425.7437  24.9023          ?        ?      492.5        2.5       ?       ? 
1 1 1   23    1   33 o   1424.1    5.3    0.0000   0.0000          ?        ? 20282.6387 150.0526          ?        ?     1424.1        5.3       ?       ? 
1 1 1   23    1   34 o    481.9    2.7    0.0000   0.0000          ?        ?  2322.3032  26.1794          ?        ?      481.9        2.7       ?       ? 
1 1 1   23    1   35 o    240.0    3.7    0.0000   0.0000          ?        ?   575.9465  17.8786          ?        ?      240.0        3.7       ?       ? 
1 1 1   23    1   36 o   1140.3    4.0    0.0000   0.0000          ?        ? 13004.7695  91.3086          ?        ?     1140.3        4.0       ?       ? 
1 1 1   23    1   37 o    615.9    2.9    0.0000   0.0000          ?        ?  3793.4568  35.1187          ?        ?      615.9        2.9       ?       ? 
1 1 1   23    1   38 o   1153.9    4.1    0.0000   0.0000          ?        ? 13315.7295  93.8627          ?        ?     1153.9        4.1       ?       ? 
1 1 1   23    1   39 o    688.0    2.9    0.0000   0.0000          ?        ?  4733.3608  40.2269          ?        ?      688.0        2.9       ?       ? 
1 1 1   23    1   40 o   1302.9    4.5    0.0000   0.0000          ?        ? 16978.9297 116.2109          ?        ?     1302.9        4.5       ?       ? 
1 1 1   23    1   41 o    838.0    3.2    0.0000   0.0000          ?        ?  7023.0996  53.6358          ?        ?      838.0        3.2       ?       ? 
1 1 1   23    1   42 o    407.7    2.8    0.0000   0.0000          ?        ?  1662.0717  22.9868          ?        ?      407.7        2.8       ?       ? 
1 1 1   23    1   43 o    358.1    2.9    0.0000   0.0000          ?        ?  1282.1515  20.4327          ?        ?      358.1        2.9       ?       ? 
1 1 1   23    1   44 o    589.8    2.7    0.0000   0.0000          ?        ?  3478.6658  31.9261          ?        ?      589.8        2.7       ?       ? 
1 1 1   23    1   45 o    491.5    2.6    0.0000   0.0000          ?        ?  2416.1658  25.5409          ?        ?      491.5        2.6       ?       ? 
1 1 1   23    1   46 o    308.3    3.0    0.0000   0.0000          ?        ?   950.7587  18.5171          ?        ?      308.3        3.0       ?       ? 
1 1 1   23    1   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    1   48 o    453.8    2.5    0.0000   0.0000          ?        ?  2059.8708  22.9868          ?        ?      453.8        2.5       ?       ? 
1 1 1   23    1   49 o    218.8    4.1    0.0000   0.0000          ?        ?   478.8912  17.8786          ?        ?      218.8        4.1       ?       ? 
1 1 1   23    1   50 o    361.9    2.8    0.0000   0.0000          ?        ?  1310.2463  20.4327          ?        ?      361.9        2.8       ?       ? 
1 1 1   23    1   51 o    361.8    2.8    0.0000   0.0000          ?        ?  1308.9694  20.4327          ?        ?      361.8        2.8       ?       ? 
1 1 1   23    1   52 o     21.7   10.7    0.0000   0.0000          ?        ?   -39.5883  17.2401          ?        ?       21.7       10.7       ?       ? 
1 1 1   23    1   53 o     81.3   11.0    0.0000   0.0000          ?        ?    66.4062  17.8786          ?        ?       81.3       11.0       ?       ? 
1 1 1   23    1   54 o     39.4   15.5    0.0000   0.0000          ?        ?     8.9393  17.8786          ?        ?       39.4       15.5       ?       ? 
1 1 1   23    1   55 o    101.9    9.1    0.0000   0.0000          ?        ?   104.0790  18.5171          ?        ?      101.9        9.1       ?       ? 
1 1 1   23    1   56 o    281.3    3.6    0.0000   0.0000          ?        ?   791.7668  20.4327          ?        ?      281.3        3.6       ?       ? 
1 1 1   23    1   57 o    518.4    2.8    0.0000   0.0000          ?        ?  2688.1760  28.7335          ?        ?      518.4        2.8       ?       ? 
1 1 1   23    1   58 o    152.7    6.3    0.0000   0.0000          ?        ?   233.6989  19.1556          ?        ?      152.7        6.3       ?       ? 
1 1 1   23    1   59 o    256.6    3.6    0.0000   0.0000          ?        ?   658.9543  18.5171          ?        ?      256.6        3.6       ?       ? 
1 1 1   23    1   60 o    249.3    3.8    0.0000   0.0000          ?        ?   621.9200  19.1556          ?        ?      249.3        3.8       ?       ? 
1 1 1   23    1   61 o    270.6    3.7    0.0000   0.0000          ?        ?   733.0228  19.7942          ?        ?      270.6        3.7       ?       ? 
1 1 1   23    1   62 o    189.6    5.1    0.0000   0.0000          ?        ?   360.1262  19.1556          ?        ?      189.6        5.1       ?       ? 
1 1 1   23    1   63 o    288.9    3.6    0.0000   0.0000          ?        ?   835.1863  21.0712          ?        ?      288.9        3.6       ?       ? 
1 1 1   23    1   64 o    219.3    4.8    0.0000   0.0000          ?        ?   481.4453  21.0712          ?        ?      219.3        4.8       ?       ? 
1 1 1   23    1   65 o    256.8    4.4    0.0000   0.0000          ?        ?   660.2314  22.3483          ?        ?      256.8        4.4       ?       ? 
1 1 1   23    1   66 o    330.8    3.4    0.0000   0.0000          ?        ?  1095.0646  22.3483          ?        ?      330.8        3.4       ?       ? 
1 1 1   23    1   67 o    114.6    8.6    0.0000   0.0000          ?        ?   132.1740  19.7942          ?        ?      114.6        8.6       ?       ? 
1 1 1   23    1   68 o     69.9   15.5    0.0000   0.0000          ?        ?    51.7203  21.0712          ?        ?       69.9       15.5       ?       ? 
1 1 1   23    1   69 o    331.3    3.5    0.0000   0.0000          ?        ?  1098.8958  22.9868          ?        ?      331.3        3.5       ?       ? 
1 1 1   23    1   70 o    195.0    5.4    0.0000   0.0000          ?        ?   381.1974  21.0712          ?        ?      195.0        5.4       ?       ? 
1 1 1   23    1   71 o     66.5   16.0    0.0000   0.0000          ?        ?    47.2506  21.0712          ?        ?       66.5       16.0       ?       ? 
1 1 1   23    1   72 o    102.4   10.0    0.0000   0.0000          ?        ?   105.9946  20.4327          ?        ?      102.4       10.0       ?       ? 
1 1 1   23    1   73 o     33.1   15.0    0.0000   0.0000          ?        ?   -12.1319  21.7097          ?        ?       33.1       15.0       ?       ? 
1 1 1   23    1   74 o     60.3   16.5    0.0000   0.0000          ?        ?    38.9498  20.4327          ?        ?       60.3       16.5       ?       ? 
1 1 1   23    1   75 f     92.3   11.1    0.0000   0.0000          ?        ?    86.8389  20.4327          ?        ?       92.3       11.1       ?       ? 
1 1 1   23    1   76 f     30.7   14.4    0.0000   0.0000          ?        ?   -21.0712  22.3483          ?        ?       30.7       14.4       ?       ? 
1 1 1   23    1   77 o    126.4    8.6    0.0000   0.0000          ?        ?   162.1845  21.7097          ?        ?      126.4        8.6       ?       ? 
1 1 1   23    2    0 o    189.9    2.5  360.7647   9.5778   360.7647   9.5778   360.7647   9.5778      189.9      2.5      189.9        2.5     0.0     0.0 
1 1 1   23    2    1 o   1066.5    3.7    0.0000   0.0000          ?        ? 11375.9014  79.8152          ?        ?     1066.5        3.7       ?       ? 
1 1 1   23    2    2 o    928.6    3.3    0.0000   0.0000          ?        ?  8623.8730  61.9366          ?        ?      928.6        3.3       ?       ? 
1 1 1   23    2    3 o   1665.6    5.5    0.0000   0.0000          ?        ? 27745.0430 183.2557          ?        ?     1665.6        5.5       ?       ? 
1 1 1   23    2    4 o    931.9    3.3    0.0000   0.0000          ?        ?  8683.8945  61.2981          ?        ?      931.9        3.3       ?       ? 
1 1 1   23    2    5 o   1068.6    3.7    0.0000   0.0000          ?        ? 11419.3213  79.1767          ?        ?     1068.6        3.7       ?       ? 
1 1 1   23    2    6 o   1052.1    3.7    0.0000   0.0000          ?        ? 11069.4111  77.2611          ?        ?     1052.1        3.7       ?       ? 
1 1 1   23    2    7 o   1328.2    4.5    0.0000   0.0000          ?        ? 17641.7129 119.4035          ?        ?     1328.2        4.5       ?       ? 
1 1 1   23    2    8 o   2217.6    7.2    0.0000   0.0000          ?        ? 49189.1523 317.9838          ?        ?     2217.6        7.2       ?       ? 
1 1 1   23    2    9 o    915.3    3.2    0.0000   0.0000          ?        ?  8377.4033  59.3825          ?        ?      915.3        3.2       ?       ? 
1 1 1   23    2   10 o    585.0    2.3    0.0000   0.0000          ?        ?  3422.4758  26.8179          ?        ?      585.0        2.3       ?       ? 
1 1 1   23    2   11 o   1143.7    3.9    0.0000   0.0000          ?        ? 13080.1152  89.3930          ?        ?     1143.7        3.9       ?       ? 
1 1 1   23    2   12 o    977.9    3.6    0.0000   0.0000          ?        ?  9563.1377  70.2374          ?        ?      977.9        3.6       ?       ? 
1 1 1   23    2   13 o    413.1    2.1    0.0000   0.0000          ?        ?  1706.1299  17.2401          ?        ?      413.1        2.1       ?       ? 
1 1 1   23    2   14 o   1738.3    5.7    0.0000   0.0000          ?        ? 30219.3145 198.5802          ?        ?     1738.3        5.7       ?       ? 
1 1 1   23    2   15 o   1530.1    5.1    0.0000   0.0000          ?        ? 23414.5879 155.7993          ?        ?     1530.1        5.1       ?       ? 
1 1 1   23    2   16 o    579.8    2.4    0.0000   0.0000          ?        ?  3361.8164  27.4564          ?        ?      579.8        2.4       ?       ? 
1 1 1   23    2   17 o   1461.3    5.1    0.0000   0.0000          ?        ? 21354.7168 148.7755          ?        ?     1461.3        5.1       ?       ? 
1 1 1   23    2   18 o    607.1    2.7    0.0000   0.0000          ?        ?  3686.1853  32.5646          ?        ?      607.1        2.7       ?       ? 
1 1 1   23    2   19 o    155.4    3.3    0.0000   0.0000          ?        ?   241.3612  10.2163          ?        ?      155.4        3.3       ?       ? 
1 1 1   23    2   20 o    825.1    3.0    0.0000   0.0000          ?        ?  6807.2788  49.8047          ?        ?      825.1        3.0       ?       ? 
1 1 1   23    2   21 o   1141.4    4.0    0.0000   0.0000          ?        ? 13028.3955  90.6701          ?        ?     1141.4        4.0       ?       ? 
1 1 1   23    2   22 o    636.9    2.7    0.0000   0.0000          ?        ?  4055.8894  34.4802          ?        ?      636.9        2.7       ?       ? 
1 1 1   23    2   23 o   2362.7    7.7    0.0000   0.0000          ?        ? 55836.1602 362.0418          ?        ?     2362.7        7.7       ?       ? 
1 1 1   23    2   24 o    813.0    3.2    0.0000   0.0000          ?        ?  6609.3374  51.7203          ?        ?      813.0        3.2       ?       ? 
1 1 1   23    2   25 o   1650.9    5.6    0.0000   0.0000          ?        ? 27257.2090 185.1713          ?        ?     1650.9        5.6       ?       ? 
1 1 1   23    2   26 o   1139.6    4.0    0.0000   0.0000          ?        ? 12986.8916  90.0316          ?        ?     1139.6        4.0       ?       ? 
1 1 1   23    2   27 f    830.9    3.3    0.0000   0.0000          ?        ?  6903.6953  54.9129          ?        ?      830.9        3.3       ?       ? 
1 1 1   23    2   28 o    665.6    2.8    0.0000   0.0000          ?        ?  4430.0630  37.6728          ?        ?      665.6        2.8       ?       ? 
1 1 1   23    2   29 f   1372.3    4.8    0.0000   0.0000          ?        ? 18833.8340 131.5355          ?        ?     1372.3        4.8       ?       ? 
1 1 1   23    2   30 f    623.9    2.9    0.0000   0.0000          ?        ?  3892.4277  36.3957          ?        ?      623.9        2.9       ?       ? 
1 1 1   23    2   31 o    659.4    2.8    0.0000   0.0000          ?        ?  4348.3325  37.0343          ?        ?      659.4        2.8       ?       ? 
1 1 1   23    2   32 o    206.8    3.7    0.0000   0.0000          ?        ?   427.8095  15.3245          ?        ?      206.8        3.7       ?       ? 
1 1 1   23    2   33 o     64.8   12.3    0.0000   0.0000          ?        ?    43.4195  15.3245          ?        ?       64.8       12.3       ?       ? 
1 1 1   23    2   34 o    451.1    2.5    0.0000   0.0000          ?        ?  2034.9685  22.3483          ?        ?      451.1        2.5       ?       ? 
1 1 1   23    2   35 o    242.4    3.2    0.0000   0.0000          ?        ?   587.4399  15.3245          ?        ?      242.4        3.2       ?       ? 
1 1 1   23    2   36 o    966.5    3.6    0.0000   0.0000          ?        ?  9342.8477  69.5989          ?        ?      966.5        3.6       ?       ? 
1 1 1   23    2   37 o    647.1    2.9    0.0000   0.0000          ?        ?  4188.0635  37.6728          ?        ?      647.1        2.9       ?       ? 
1 1 1   23    2   38 o    291.4    3.5    0.0000   0.0000          ?        ?   849.2338  20.4327          ?        ?      291.4        3.5       ?       ? 
1 1 1   23    2   39 f    451.2    2.7    0.0000   0.0000          ?        ?  2035.6068  24.2638          ?        ?      451.2        2.7       ?       ? 
1 1 1   23    2   40 f    630.5    2.8    0.0000   0.0000          ?        ?  3975.4355  35.7572          ?        ?      630.5        2.8       ?       ? 
1 1 1   23    2   41 o    196.4    5.7    0.0000   0.0000          ?        ?   385.6671  22.3483          ?        ?      196.4        5.7       ?       ? 
1 1 1   23    2   42 o    336.0    2.9    0.0000   0.0000          ?        ?  1128.9062  19.7942          ?        ?      336.0        2.9       ?       ? 
1 1 1   23    2   43 o    933.4    3.5    0.0000   0.0000          ?        ?  8713.9043  64.4907          ?        ?      933.4        3.5       ?       ? 
1 1 1   23    2   44 o    446.6    2.8    0.0000   0.0000          ?        ?  1994.7416  24.9023          ?        ?      446.6        2.8       ?       ? 
1 1 1   23    2   45 f    646.6    2.9    0.0000   0.0000          ?        ?  4181.0396  37.6728          ?        ?      646.6        2.9       ?       ? 
1 1 1   23    2   46 o    485.5    2.8    0.0000   0.0000          ?        ?  2357.4219  26.8179          ?        ?      485.5        2.8       ?       ? 
1 1 1   23    2   47 o     71.9   14.3    0.0000   0.0000          ?        ?    53.6358  19.7942          ?        ?       71.9       14.3       ?       ? 
1 1 1   23    2   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    2   49 o    284.2    3.7    0.0000   0.0000          ?        ?   807.7299  21.0712          ?        ?      284.2        3.7       ?       ? 
1 1 1   23    2   50 o    147.7    6.1    0.0000   0.0000          ?        ?   218.3744  17.8786          ?        ?      147.7        6.1       ?       ? 
1 1 1   23    2   51 o    119.0    7.0    0.0000   0.0000          ?        ?   141.7518  16.6016          ?        ?      119.0        7.0       ?       ? 
1 1 1   23    2   52 o    270.8    3.5    0.0000   0.0000          ?        ?   733.6614  19.1556          ?        ?      270.8        3.5       ?       ? 
1 1 1   23    2   53 o    318.9    3.1    0.0000   0.0000          ?        ?  1017.1650  19.7942          ?        ?      318.9        3.1       ?       ? 
1 1 1   23    2   54 o    301.6    3.3    0.0000   0.0000          ?        ?   909.8933  19.7942          ?        ?      301.6        3.3       ?       ? 
1 1 1   23    2   55 o    534.5    2.7    0.0000   0.0000          ?        ?  2857.3843  28.7335          ?        ?      534.5        2.7       ?       ? 
1 1 1   23    2   56 o    306.8    3.5    0.0000   0.0000          ?        ?   941.8194  21.7097          ?        ?      306.8        3.5       ?       ? 
1 1 1   23    2   57 o    257.1    3.6    0.0000   0.0000          ?        ?   661.5084  18.5171          ?        ?      257.1        3.6       ?       ? 
1 1 1   23    2   58 o    179.1    5.3    0.0000   0.0000          ?        ?   321.1764  19.1556          ?        ?      179.1        5.3       ?       ? 
1 1 1   23    2   59 o    329.0    3.1    0.0000   0.0000          ?        ?  1082.9327  20.4327          ?        ?      329.0        3.1       ?       ? 
1 1 1   23    2   60 o    103.7    8.6    0.0000   0.0000          ?        ?   107.9102  17.8786          ?        ?      103.7        8.6       ?       ? 
1 1 1   23    2   61 o    187.4    5.3    0.0000   0.0000          ?        ?   351.8254  19.7942          ?        ?      187.4        5.3       ?       ? 
1 1 1   23    2   62 o    384.9    3.1    0.0000   0.0000          ?        ?  1482.6472  23.6253          ?        ?      384.9        3.1       ?       ? 
1 1 1   23    2   63 o    164.5    6.4    0.0000   0.0000          ?        ?   271.3717  21.0712          ?        ?      164.5        6.4       ?       ? 
1 1 1   23    2   64 o     67.0   15.1    0.0000   0.0000          ?        ?    47.2506  19.7942          ?        ?       67.0       15.1       ?       ? 
1 1 1   23    2   65 o     27.1   13.0    0.0000   0.0000          ?        ?   -29.3720  20.4327          ?        ?       27.1       13.0       ?       ? 
1 1 1   23    2   66 o    264.9    4.1    0.0000   0.0000          ?        ?   702.3738  21.7097          ?        ?      264.9        4.1       ?       ? 
1 1 1   23    2   67 o     35.3   15.6    0.0000   0.0000          ?        ?    -6.3852  21.7097          ?        ?       35.3       15.6       ?       ? 
1 1 1   23    2   68 o     62.1   16.6    0.0000   0.0000          ?        ?    40.8654  21.0712          ?        ?       62.1       16.6       ?       ? 
1 1 1   23    2   69 f     96.3   11.3    0.0000   0.0000          ?        ?    93.8627  21.7097          ?        ?       96.3       11.3       ?       ? 
1 1 1   23    2   70 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    2   71 o    255.8    4.4    0.0000   0.0000          ?        ?   655.7617  22.3483          ?        ?      255.8        4.4       ?       ? 
1 1 1   23    2   72 o     99.4   10.9    0.0000   0.0000          ?        ?   100.2479  21.7097          ?        ?       99.4       10.9       ?       ? 
1 1 1   23    2   73 o     89.7   11.0    0.0000   0.0000          ?        ?    81.7308  19.7942          ?        ?       89.7       11.0       ?       ? 
1 1 1   23    2   74 o     32.3   14.5    0.0000   0.0000          ?        ?    -8.9393  19.7942          ?        ?       32.3       14.5       ?       ? 
1 1 1   23    2   75 o    180.5    5.8    0.0000   0.0000          ?        ?   327.5616  21.0712          ?        ?      180.5        5.8       ?       ? 
1 1 1   23    2   76 o    123.5    8.5    0.0000   0.0000          ?        ?   154.5222  21.0712          ?        ?      123.5        8.5       ?       ? 
1 1 1   23    2   77 o     23.4   11.6    0.0000   0.0000          ?        ?   -49.8047  21.0712          ?        ?       23.4       11.6       ?       ? 
1 1 1   23    3    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    3    1 o    495.2    2.1    0.0000   0.0000          ?        ?  2451.9231  20.4327          ?        ?      495.2        2.1       ?       ? 
1 1 1   23    3    2 o    959.6    3.4    0.0000   0.0000          ?        ?  9208.1201  65.7677          ?        ?      959.6        3.4       ?       ? 
1 1 1   23    3    3 o    253.1    1.8    0.0000   0.0000          ?        ?   640.4372   8.9393          ?        ?      253.1        1.8       ?       ? 
1 1 1   23    3    4 o   1835.7    6.0    0.0000   0.0000          ?        ? 33703.7266 221.5670          ?        ?     1835.7        6.0       ?       ? 
1 1 1   23    3    5 o    536.5    2.2    0.0000   0.0000          ?        ?  2878.4553  23.6253          ?        ?      536.5        2.2       ?       ? 
1 1 1   23    3    6 o   1937.1    6.3    0.0000   0.0000          ?        ? 37529.1094 245.8308          ?        ?     1937.1        6.3       ?       ? 
1 1 1   23    3    7 o   1746.3    5.8    0.0000   0.0000          ?        ? 30500.9004 202.4114          ?        ?     1746.3        5.8       ?       ? 
1 1 1   23    3    8 o   1277.5    4.4    0.0000   0.0000          ?        ? 16321.8896 111.7413          ?        ?     1277.5        4.4       ?       ? 
1 1 1   23    3    9 f    143.2    2.7    0.0000   0.0000          ?        ?   204.9654   7.6623          ?        ?      143.2        2.7       ?       ? 
1 1 1   23    3   10 o   1002.8    3.7    0.0000   0.0000          ?        ? 10056.7158  74.0685          ?        ?     1002.8        3.7       ?       ? 
1 1 1   23    3   11 o   1387.7    5.0    0.0000   0.0000          ?        ? 19259.0898 139.1977          ?        ?     1387.7        5.0       ?       ? 
1 1 1   23    3   12 o   1330.1    4.7    0.0000   0.0000          ?        ? 17692.7949 124.5117          ?        ?     1330.1        4.7       ?       ? 
1 1 1   23    3   13 o   1100.7    3.8    0.0000   0.0000          ?        ? 12115.3096  83.6463          ?        ?     1100.7        3.8       ?       ? 
1 1 1   23    3   14 o   1156.2    4.0    0.0000   0.0000          ?        ? 13368.7266  91.9471          ?        ?     1156.2        4.0       ?       ? 
1 1 1   23    3   15 o    879.1    3.1    0.0000   0.0000          ?        ?  7728.6660  54.9129          ?        ?      879.1        3.1       ?       ? 
1 1 1   23    3   16 o   1526.9    5.3    0.0000   0.0000          ?        ? 23315.6172 162.1845          ?        ?     1526.9        5.3       ?       ? 
1 1 1   23    3   17 o   1910.1    6.5    0.0000   0.0000          ?        ? 36488.3164 247.7464          ?        ?     1910.1        6.5       ?       ? 
1 1 1   23    3   18 o    307.0    2.3    0.0000   0.0000          ?        ?   942.4579  14.0475          ?        ?      307.0        2.3       ?       ? 
1 1 1   23    3   19 o    914.0    3.3    0.0000   0.0000          ?        ?  8353.7783  60.0210          ?        ?      914.0        3.3       ?       ? 
1 1 1   23    3   20 o   1345.2    4.5    0.0000   0.0000          ?        ? 18096.9805 121.9576          ?        ?     1345.2        4.5       ?       ? 
1 1 1   23    3   21 o    928.3    3.4    0.0000   0.0000          ?        ?  8618.1260  62.5751          ?        ?      928.3        3.4       ?       ? 
1 1 1   23    3   22 o    665.5    2.7    0.0000   0.0000          ?        ?  4429.4248  35.7572          ?        ?      665.5        2.7       ?       ? 
1 1 1   23    3   23 o    247.2    3.0    0.0000   0.0000          ?        ?   611.0652  14.6860          ?        ?      247.2        3.0       ?       ? 
1 1 1   23    3   24 o   1258.1    4.5    0.0000   0.0000          ?        ? 15829.5898 113.0183          ?        ?     1258.1        4.5       ?       ? 
1 1 1   23    3   25 o   1766.9    5.8    0.0000   0.0000          ?        ? 31224.9863 204.9654          ?        ?     1766.9        5.8       ?       ? 
1 1 1   23    3   26 o   1625.8    5.5    0.0000   0.0000          ?        ? 26434.1562 178.7861          ?        ?     1625.8        5.5       ?       ? 
1 1 1   23    3   27 o    516.1    2.6    0.0000   0.0000          ?        ?  2663.9124  26.8179          ?        ?      516.1        2.6       ?       ? 
1 1 1   23    3   28 o   1154.9    4.1    0.0000   0.0000          ?        ? 13338.7168  94.5012          ?        ?     1154.9        4.1       ?       ? 
1 1 1   23    3   29 o    417.7    2.7    0.0000   0.0000          ?        ?  1744.4412  22.3483          ?        ?      417.7        2.7       ?       ? 
1 1 1   23    3   30 o    259.3    3.1    0.0000   0.0000          ?        ?   672.3633  15.9630          ?        ?      259.3        3.1       ?       ? 
1 1 1   23    3   31 o     32.5   13.7    0.0000   0.0000          ?        ?     0.6385  15.3245          ?        ?       32.5       13.7       ?       ? 
1 1 1   23    3   32 o   1262.4    4.7    0.0000   0.0000          ?        ? 15939.4160 117.4880          ?        ?     1262.4        4.7       ?       ? 
1 1 1   23    3   33 o    788.2    3.0    0.0000   0.0000          ?        ?  6212.1772  47.2506          ?        ?      788.2        3.0       ?       ? 
1 1 1   23    3   34 o   1044.1    3.8    0.0000   0.0000          ?        ? 10902.1182  79.8152          ?        ?     1044.1        3.8       ?       ? 
1 1 1   23    3   35 o    451.9    2.5    0.0000   0.0000          ?        ?  2042.6306  22.9868          ?        ?      451.9        2.5       ?       ? 
1 1 1   23    3   36 o    599.3    2.9    0.0000   0.0000          ?        ?  3591.6841  35.1187          ?        ?      599.3        2.9       ?       ? 
1 1 1   23    3   37 o    318.1    3.1    0.0000   0.0000          ?        ?  1012.0568  19.7942          ?        ?      318.1        3.1       ?       ? 
1 1 1   23    3   38 o    615.9    2.8    0.0000   0.0000          ?        ?  3793.4568  34.4802          ?        ?      615.9        2.8       ?       ? 
1 1 1   23    3   39 o    711.6    3.1    0.0000   0.0000          ?        ?  5064.1147  44.0580          ?        ?      711.6        3.1       ?       ? 
1 1 1   23    3   40 o    131.0    8.5    0.0000   0.0000          ?        ?   171.7623  22.3483          ?        ?      131.0        8.5       ?       ? 
1 1 1   23    3   41 o    425.7    2.8    0.0000   0.0000          ?        ?  1812.1243  23.6253          ?        ?      425.7        2.8       ?       ? 
1 1 1   23    3   42 o    718.3    2.9    0.0000   0.0000          ?        ?  5159.8931  41.5039          ?        ?      718.3        2.9       ?       ? 
1 1 1   23    3   43 o     64.5   14.2    0.0000   0.0000          ?        ?    43.4195  17.8786          ?        ?       64.5       14.2       ?       ? 
1 1 1   23    3   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    3   45 o    749.6    2.9    0.0000   0.0000          ?        ?  5620.2676  44.0580          ?        ?      749.6        2.9       ?       ? 
1 1 1   23    3   46 o    307.7    3.1    0.0000   0.0000          ?        ?   946.9276  19.1556          ?        ?      307.7        3.1       ?       ? 
1 1 1   23    3   47 o    280.8    3.3    0.0000   0.0000          ?        ?   788.5742  18.5171          ?        ?      280.8        3.3       ?       ? 
1 1 1   23    3   48 o    553.7    2.6    0.0000   0.0000          ?        ?  3066.8193  28.7335          ?        ?      553.7        2.6       ?       ? 
1 1 1   23    3   49 o    476.2    2.6    0.0000   0.0000          ?        ?  2268.0288  24.9023          ?        ?      476.2        2.6       ?       ? 
1 1 1   23    3   50 o    272.3    3.4    0.0000   0.0000          ?        ?   741.9621  18.5171          ?        ?      272.3        3.4       ?       ? 
1 1 1   23    3   51 o    555.5    2.6    0.0000   0.0000          ?        ?  3086.6135  29.3720          ?        ?      555.5        2.6       ?       ? 
1 1 1   23    3   52 o    192.2    4.7    0.0000   0.0000          ?        ?   369.7040  17.8786          ?        ?      192.2        4.7       ?       ? 
1 1 1   23    3   53 o    566.8    2.8    0.0000   0.0000          ?        ?  3213.0410  31.9261          ?        ?      566.8        2.8       ?       ? 
1 1 1   23    3   54 o    250.6    3.8    0.0000   0.0000          ?        ?   628.3053  19.1556          ?        ?      250.6        3.8       ?       ? 
1 1 1   23    3   55 o    218.8    4.2    0.0000   0.0000          ?        ?   478.8912  18.5171          ?        ?      218.8        4.2       ?       ? 
1 1 1   23    3   56 o    286.6    3.5    0.0000   0.0000          ?        ?   821.7773  19.7942          ?        ?      286.6        3.5       ?       ? 
1 1 1   23    3   57 o    404.6    2.8    0.0000   0.0000          ?        ?  1637.8080  22.9868          ?        ?      404.6        2.8       ?       ? 
1 1 1   23    3   58 o    109.7    8.7    0.0000   0.0000          ?        ?   120.6806  19.1556          ?        ?      109.7        8.7       ?       ? 
1 1 1   23    3   59 o    148.3    6.5    0.0000   0.0000          ?        ?   220.2900  19.1556          ?        ?      148.3        6.5       ?       ? 
1 1 1   23    3   60 o    183.8    5.6    0.0000   0.0000          ?        ?   338.4165  20.4327          ?        ?      183.8        5.6       ?       ? 
1 1 1   23    3   61 o    231.2    4.6    0.0000   0.0000          ?        ?   535.0811  21.0712          ?        ?      231.2        4.6       ?       ? 
1 1 1   23    3   62 o    361.2    3.3    0.0000   0.0000          ?        ?  1305.1382  23.6253          ?        ?      361.2        3.3       ?       ? 
1 1 1   23    3   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    3   64 f    377.8    3.1    0.0000   0.0000          ?        ?  1428.3728  23.6253          ?        ?      377.8        3.1       ?       ? 
1 1 1   23    3   65 o    304.8    3.5    0.0000   0.0000          ?        ?   929.6875  21.0712          ?        ?      304.8        3.5       ?       ? 
1 1 1   23    3   66 o     79.8   12.8    0.0000   0.0000          ?        ?    64.4907  20.4327          ?        ?       79.8       12.8       ?       ? 
1 1 1   23    3   67 o    130.5    7.6    0.0000   0.0000          ?        ?   171.1238  19.7942          ?        ?      130.5        7.6       ?       ? 
1 1 1   23    3   68 o    103.8    9.8    0.0000   0.0000          ?        ?   108.5487  20.4327          ?        ?      103.8        9.8       ?       ? 
1 1 1   23    3   69 o    283.1    3.9    0.0000   0.0000          ?        ?   802.6216  22.3483          ?        ?      283.1        3.9       ?       ? 
1 1 1   23    3   70 o     36.4   15.8    0.0000   0.0000          ?        ?    -1.9156  21.0712          ?        ?       36.4       15.8       ?       ? 
1 1 1   23    3   71 o     77.9   14.0    0.0000   0.0000          ?        ?    63.8522  21.0712          ?        ?       77.9       14.0       ?       ? 
1 1 1   23    3   72 o    260.4    4.2    0.0000   0.0000          ?        ?   679.3870  21.7097          ?        ?      260.4        4.2       ?       ? 
1 1 1   23    3   73 f     32.3   14.6    0.0000   0.0000          ?        ?   -10.8549  20.4327          ?        ?       32.3       14.6       ?       ? 
1 1 1   23    3   74 o    147.3    6.7    0.0000   0.0000          ?        ?   218.3744  19.7942          ?        ?      147.3        6.7       ?       ? 
1 1 1   23    3   75 o    121.5    8.1    0.0000   0.0000          ?        ?   149.4141  19.7942          ?        ?      121.5        8.1       ?       ? 
1 1 1   23    3   76 f     96.5   10.6    0.0000   0.0000          ?        ?    95.1397  20.4327          ?        ?       96.5       10.6       ?       ? 
1 1 1   23    4    0 o     86.4    4.8   75.3456   8.3008    75.3456   8.3008    75.3456   8.3008       86.4      4.8       86.4        4.8     0.0     0.0 
1 1 1   23    4    1 o   1054.3    3.7    0.0000   0.0000          ?        ? 11116.0234  77.8996          ?        ?     1054.3        3.7       ?       ? 
1 1 1   23    4    2 o    672.5    2.6    0.0000   0.0000          ?        ?  4522.6484  34.4802          ?        ?      672.5        2.6       ?       ? 
1 1 1   23    4    3 o   1261.7    4.3    0.0000   0.0000          ?        ? 15918.9834 108.5487          ?        ?     1261.7        4.3       ?       ? 
1 1 1   23    4    4 o    550.2    2.3    0.0000   0.0000          ?        ?  3027.2310  24.9023          ?        ?      550.2        2.3       ?       ? 
1 1 1   23    4    5 o   2350.1    7.6    0.0000   0.0000          ?        ? 55241.0625 356.2951          ?        ?     2350.1        7.6       ?       ? 
1 1 1   23    4    6 o    677.5    2.6    0.0000   0.0000          ?        ?  4589.6934  35.1187          ?        ?      677.5        2.6       ?       ? 
1 1 1   23    4    7 o   1194.1    4.3    0.0000   0.0000          ?        ? 14260.7412 101.5249          ?        ?     1194.1        4.3       ?       ? 
1 1 1   23    4    8 o    826.1    3.1    0.0000   0.0000          ?        ?  6825.1577  51.7203          ?        ?      826.1        3.1       ?       ? 
1 1 1   23    4    9 o    851.9    3.1    0.0000   0.0000          ?        ?  7256.7983  53.6358          ?        ?      851.9        3.1       ?       ? 
1 1 1   23    4   10 o    414.7    2.1    0.0000   0.0000          ?        ?  1720.1772  17.2401          ?        ?      414.7        2.1       ?       ? 
1 1 1   23    4   11 o    616.5    2.5    0.0000   0.0000          ?        ?  3800.4807  30.6490          ?        ?      616.5        2.5       ?       ? 
1 1 1   23    4   12 o    261.4    2.1    0.0000   0.0000          ?        ?   683.2181  10.8549          ?        ?      261.4        2.1       ?       ? 
1 1 1   23    4   13 o   1611.2    5.4    0.0000   0.0000          ?        ? 25961.0117 172.4008          ?        ?     1611.2        5.4       ?       ? 
1 1 1   23    4   14 o   1289.8    4.5    0.0000   0.0000          ?        ? 16636.6816 114.9339          ?        ?     1289.8        4.5       ?       ? 
1 1 1   23    4   15 o    359.1    2.0    0.0000   0.0000          ?        ?  1289.8137  14.6860          ?        ?      359.1        2.0       ?       ? 
1 1 1   23    4   16 o   1131.4    4.0    0.0000   0.0000          ?        ? 12800.4424  90.0316          ?        ?     1131.4        4.0       ?       ? 
1 1 1   23    4   17 f    913.5    3.4    0.0000   0.0000          ?        ?  8344.8389  61.2981          ?        ?      913.5        3.4       ?       ? 
1 1 1   23    4   18 o   1000.9    3.5    0.0000   0.0000          ?        ? 10017.7656  70.8759          ?        ?     1000.9        3.5       ?       ? 
1 1 1   23    4   19 o   1467.9    4.9    0.0000   0.0000          ?        ? 21547.5508 144.3059          ?        ?     1467.9        4.9       ?       ? 
1 1 1   23    4   20 o    707.3    2.7    0.0000   0.0000          ?        ?  5003.4551  38.3113          ?        ?      707.3        2.7       ?       ? 
1 1 1   23    4   21 o   1559.3    5.2    0.0000   0.0000          ?        ? 24316.8203 162.1845          ?        ?     1559.3        5.2       ?       ? 
1 1 1   23    4   22 o    442.8    2.3    0.0000   0.0000          ?        ?  1960.8999  20.4327          ?        ?      442.8        2.3       ?       ? 
1 1 1   23    4   23 o    614.6    2.6    0.0000   0.0000          ?        ?  3777.4939  31.9261          ?        ?      614.6        2.6       ?       ? 
1 1 1   23    4   24 o    841.8    3.2    0.0000   0.0000          ?        ?  7086.9517  53.6358          ?        ?      841.8        3.2       ?       ? 
1 1 1   23    4   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    4   26 o    408.1    2.6    0.0000   0.0000          ?        ?  1665.9028  21.0712          ?        ?      408.1        2.6       ?       ? 
1 1 1   23    4   27 o    714.7    2.8    0.0000   0.0000          ?        ?  5108.8115  40.2269          ?        ?      714.7        2.8       ?       ? 
1 1 1   23    4   28 o   1159.5    4.2    0.0000   0.0000          ?        ? 13446.6260  97.6938          ?        ?     1159.5        4.2       ?       ? 
1 1 1   23    4   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    4   30 o    371.1    2.8    0.0000   0.0000          ?        ?  1377.2911  21.0712          ?        ?      371.1        2.8       ?       ? 
1 1 1   23    4   31 o   1090.0    3.8    0.0000   0.0000          ?        ? 11880.9717  83.6463          ?        ?     1090.0        3.8       ?       ? 
1 1 1   23    4   32 o    549.5    2.7    0.0000   0.0000          ?        ?  3019.5688  29.3720          ?        ?      549.5        2.7       ?       ? 
1 1 1   23    4   33 o    467.5    2.7    0.0000   0.0000          ?        ?  2185.6594  24.9023          ?        ?      467.5        2.7       ?       ? 
1 1 1   23    4   34 o    725.6    2.9    0.0000   0.0000          ?        ?  5264.6108  42.1424          ?        ?      725.6        2.9       ?       ? 
1 1 1   23    4   35 o    822.1    3.1    0.0000   0.0000          ?        ?  6759.3896  51.7203          ?        ?      822.1        3.1       ?       ? 
1 1 1   23    4   36 o   1211.6    4.2    0.0000   0.0000          ?        ? 14680.2510 101.5249          ?        ?     1211.6        4.2       ?       ? 
1 1 1   23    4   37 o    220.7    4.2    0.0000   0.0000          ?        ?   487.1920  18.5171          ?        ?      220.7        4.2       ?       ? 
1 1 1   23    4   38 o    559.1    2.6    0.0000   0.0000          ?        ?  3125.5635  28.7335          ?        ?      559.1        2.6       ?       ? 
1 1 1   23    4   39 o    560.8    2.6    0.0000   0.0000          ?        ?  3145.3577  29.3720          ?        ?      560.8        2.6       ?       ? 
1 1 1   23    4   40 o    640.1    2.7    0.0000   0.0000          ?        ?  4097.3936  35.1187          ?        ?      640.1        2.7       ?       ? 
1 1 1   23    4   41 o    773.3    3.0    0.0000   0.0000          ?        ?  5981.0322  46.6121          ?        ?      773.3        3.0       ?       ? 
1 1 1   23    4   42 o    294.6    3.3    0.0000   0.0000          ?        ?   867.7509  19.1556          ?        ?      294.6        3.3       ?       ? 
1 1 1   23    4   43 o    526.3    2.6    0.0000   0.0000          ?        ?  2770.5454  27.4564          ?        ?      526.3        2.6       ?       ? 
1 1 1   23    4   44 o    500.1    2.6    0.0000   0.0000          ?        ?  2501.0894  26.1794          ?        ?      500.1        2.6       ?       ? 
1 1 1   23    4   45 o    576.1    2.7    0.0000   0.0000          ?        ?  3319.6741  31.2876          ?        ?      576.1        2.7       ?       ? 
1 1 1   23    4   46 o    414.3    2.7    0.0000   0.0000          ?        ?  1716.3461  22.3483          ?        ?      414.3        2.7       ?       ? 
1 1 1   23    4   47 o    157.1    5.7    0.0000   0.0000          ?        ?   247.1079  17.8786          ?        ?      157.1        5.7       ?       ? 
1 1 1   23    4   48 o     25.2   12.1    0.0000   0.0000          ?        ?   -26.8179  17.8786          ?        ?       25.2       12.1       ?       ? 
1 1 1   23    4   49 o    580.8    2.9    0.0000   0.0000          ?        ?  3373.9485  33.2031          ?        ?      580.8        2.9       ?       ? 
1 1 1   23    4   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    4   51 o    214.8    4.3    0.0000   0.0000          ?        ?   461.6512  18.5171          ?        ?      214.8        4.3       ?       ? 
1 1 1   23    4   52 o    378.1    2.9    0.0000   0.0000          ?        ?  1429.6499  21.7097          ?        ?      378.1        2.9       ?       ? 
1 1 1   23    4   53 o    567.3    2.8    0.0000   0.0000          ?        ?  3219.4260  31.2876          ?        ?      567.3        2.8       ?       ? 
1 1 1   23    4   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    4   55 o    455.3    2.8    0.0000   0.0000          ?        ?  2073.9182  25.5409          ?        ?      455.3        2.8       ?       ? 
1 1 1   23    4   56 o    240.7    4.0    0.0000   0.0000          ?        ?   579.7776  19.1556          ?        ?      240.7        4.0       ?       ? 
1 1 1   23    4   57 o    173.1    5.3    0.0000   0.0000          ?        ?   300.1052  18.5171          ?        ?      173.1        5.3       ?       ? 
1 1 1   23    4   58 f    171.4    5.8    0.0000   0.0000          ?        ?   294.3585  19.7942          ?        ?      171.4        5.8       ?       ? 
1 1 1   23    4   59 o    336.8    3.2    0.0000   0.0000          ?        ?  1134.6530  21.7097          ?        ?      336.8        3.2       ?       ? 
1 1 1   23    4   60 o     36.3   15.6    0.0000   0.0000          ?        ?    -1.2770  20.4327          ?        ?       36.3       15.6       ?       ? 
1 1 1   23    4   61 o    285.2    3.7    0.0000   0.0000          ?        ?   814.1151  21.0712          ?        ?      285.2        3.7       ?       ? 
1 1 1   23    4   62 o    304.8    3.6    0.0000   0.0000          ?        ?   929.6875  21.7097          ?        ?      304.8        3.6       ?       ? 
1 1 1   23    4   63 o    280.9    3.9    0.0000   0.0000          ?        ?   789.8513  21.7097          ?        ?      280.9        3.9       ?       ? 
1 1 1   23    4   64 o    342.6    3.3    0.0000   0.0000          ?        ?  1174.2412  22.3483          ?        ?      342.6        3.3       ?       ? 
1 1 1   23    4   65 o     22.5   11.2    0.0000   0.0000          ?        ?   -57.4669  21.0712          ?        ?       22.5       11.2       ?       ? 
1 1 1   23    4   66 o    210.6    4.9    0.0000   0.0000          ?        ?   444.4110  20.4327          ?        ?      210.6        4.9       ?       ? 
1 1 1   23    4   67 o    252.5    4.0    0.0000   0.0000          ?        ?   638.5216  20.4327          ?        ?      252.5        4.0       ?       ? 
1 1 1   23    4   68 o     33.1   14.9    0.0000   0.0000          ?        ?    -8.9393  20.4327          ?        ?       33.1       14.9       ?       ? 
1 1 1   23    4   69 o    226.9    4.5    0.0000   0.0000          ?        ?   515.9255  20.4327          ?        ?      226.9        4.5       ?       ? 
1 1 1   23    4   70 o     21.6   10.8    0.0000   0.0000          ?        ?   -51.0817  19.1556          ?        ?       21.6       10.8       ?       ? 
1 1 1   23    4   71 o     32.8   14.8    0.0000   0.0000          ?        ?    -9.5778  20.4327          ?        ?       32.8       14.8       ?       ? 
1 1 1   23    4   72 o    311.6    3.7    0.0000   0.0000          ?        ?   972.4684  22.9868          ?        ?      311.6        3.7       ?       ? 
1 1 1   23    4   73 o    172.7    5.7    0.0000   0.0000          ?        ?   299.4666  19.7942          ?        ?      172.7        5.7       ?       ? 
1 1 1   23    4   74 o     57.8   16.7    0.0000   0.0000          ?        ?    35.7572  20.4327          ?        ?       57.8       16.7       ?       ? 
1 1 1   23    4   75 o    111.9    9.1    0.0000   0.0000          ?        ?   127.0658  20.4327          ?        ?      111.9        9.1       ?       ? 
1 1 1   23    4   76 o    198.6    5.1    0.0000   0.0000          ?        ?   396.5219  20.4327          ?        ?      198.6        5.1       ?       ? 
1 1 1   23    5    0 o    680.0    4.0 4624.1738  54.2743  4624.1738  54.2743  4624.1738  54.2743      680.0      4.0      680.0        4.0     0.0     0.0 
1 1 1   23    5    1 o   2029.5    6.9    0.0000   0.0000          ?        ? 41196.7773 280.3110          ?        ?     2029.5        6.9       ?       ? 
1 1 1   23    5    2 o    916.3    3.4    0.0000   0.0000          ?        ?  8395.9209  62.5751          ?        ?      916.3        3.4       ?       ? 
1 1 1   23    5    3 o    674.2    2.7    0.0000   0.0000          ?        ?  4545.6357  36.3957          ?        ?      674.2        2.7       ?       ? 
1 1 1   23    5    4 o    986.5    3.6    0.0000   0.0000          ?        ?  9732.3467  71.5144          ?        ?      986.5        3.6       ?       ? 
1 1 1   23    5    5 o    290.2    2.0    0.0000   0.0000          ?        ?   842.2100  11.4934          ?        ?      290.2        2.0       ?       ? 
1 1 1   23    5    6 o    696.0    2.7    0.0000   0.0000          ?        ?  4844.4639  37.6728          ?        ?      696.0        2.7       ?       ? 
1 1 1   23    5    7 o   1135.4    4.0    0.0000   0.0000          ?        ? 12891.1133  90.0316          ?        ?     1135.4        4.0       ?       ? 
1 1 1   23    5    8 o    775.3    3.0    0.0000   0.0000          ?        ?  6011.0430  47.2506          ?        ?      775.3        3.0       ?       ? 
1 1 1   23    5    9 o    512.4    2.2    0.0000   0.0000          ?        ?  2625.6011  22.9868          ?        ?      512.4        2.2       ?       ? 
1 1 1   23    5   10 o   1100.6    4.0    0.0000   0.0000          ?        ? 12113.3936  87.4775          ?        ?     1100.6        4.0       ?       ? 
1 1 1   23    5   11 o   1032.1    3.7    0.0000   0.0000          ?        ? 10651.8174  76.6226          ?        ?     1032.1        3.7       ?       ? 
1 1 1   23    5   12 o    481.4    2.2    0.0000   0.0000          ?        ?  2317.1948  21.0712          ?        ?      481.4        2.2       ?       ? 
1 1 1   23    5   13 o   2228.5    7.7    0.0000   0.0000          ?        ? 49669.9570 344.1632          ?        ?     2228.5        7.7       ?       ? 
1 1 1   23    5   14 o    561.7    2.4    0.0000   0.0000          ?        ?  3154.9353  26.8179          ?        ?      561.7        2.4       ?       ? 
1 1 1   23    5   15 o    960.1    3.6    0.0000   0.0000          ?        ?  9218.3359  68.9603          ?        ?      960.1        3.6       ?       ? 
1 1 1   23    5   16 o   1170.3    4.1    0.0000   0.0000          ?        ? 13695.6494  95.7782          ?        ?     1170.3        4.1       ?       ? 
1 1 1   23    5   17 o   1433.9    4.8    0.0000   0.0000          ?        ? 20561.6738 136.6436          ?        ?     1433.9        4.8       ?       ? 
1 1 1   23    5   18 o   2289.3    7.4    0.0000   0.0000          ?        ? 52419.4336 338.4165          ?        ?     2289.3        7.4       ?       ? 
1 1 1   23    5   19 o    791.4    2.9    0.0000   0.0000          ?        ?  6262.6201  46.6121          ?        ?      791.4        2.9       ?       ? 
1 1 1   23    5   20 o   2213.2    7.2    0.0000   0.0000          ?        ? 48989.2930 318.6223          ?        ?     2213.2        7.2       ?       ? 
1 1 1   23    5   21 o   1410.1    4.9    0.0000   0.0000          ?        ? 19886.7559 137.2822          ?        ?     1410.1        4.9       ?       ? 
1 1 1   23    5   22 o    296.6    2.5    0.0000   0.0000          ?        ?   879.8828  14.6860          ?        ?      296.6        2.5       ?       ? 
1 1 1   23    5   23 o   1443.7    4.8    0.0000   0.0000          ?        ? 20845.8145 139.8362          ?        ?     1443.7        4.8       ?       ? 
1 1 1   23    5   24 o    567.3    2.5    0.0000   0.0000          ?        ?  3218.7876  28.0950          ?        ?      567.3        2.5       ?       ? 
1 1 1   23    5   25 o    404.4    2.4    0.0000   0.0000          ?        ?  1635.2539  19.7942          ?        ?      404.4        2.4       ?       ? 
1 1 1   23    5   26 o    609.2    2.6    0.0000   0.0000          ?        ?  3711.0879  31.9261          ?        ?      609.2        2.6       ?       ? 
1 1 1   23    5   27 o   1525.2    5.2    0.0000   0.0000          ?        ? 23266.4512 159.6304          ?        ?     1525.2        5.2       ?       ? 
1 1 1   23    5   28 o    112.4    8.5    0.0000   0.0000          ?        ?   126.4273  19.1556          ?        ?      112.4        8.5       ?       ? 
1 1 1   23    5   29 o   1184.1    4.2    0.0000   0.0000          ?        ? 14021.9346  98.9709          ?        ?     1184.1        4.2       ?       ? 
1 1 1   23    5   30 o    240.1    3.7    0.0000   0.0000          ?        ?   576.5850  17.8786          ?        ?      240.1        3.7       ?       ? 
1 1 1   23    5   31 o    928.3    3.6    0.0000   0.0000          ?        ?  8618.7656  66.4062          ?        ?      928.3        3.6       ?       ? 
1 1 1   23    5   32 o    608.7    2.9    0.0000   0.0000          ?        ?  3705.3408  35.1187          ?        ?      608.7        2.9       ?       ? 
1 1 1   23    5   33 o   1305.0    4.5    0.0000   0.0000          ?        ? 17033.2031 118.1265          ?        ?     1305.0        4.5       ?       ? 
1 1 1   23    5   34 o    904.9    3.6    0.0000   0.0000          ?        ?  8189.0400  65.1292          ?        ?      904.9        3.6       ?       ? 
1 1 1   23    5   35 o    901.4    3.8    0.0000   0.0000          ?        ?  8126.4644  68.9603          ?        ?      901.4        3.8       ?       ? 
1 1 1   23    5   36 o    561.0    2.8    0.0000   0.0000          ?        ?  3147.2729  31.9261          ?        ?      561.0        2.8       ?       ? 
1 1 1   23    5   37 o    290.9    3.4    0.0000   0.0000          ?        ?   846.0411  19.7942          ?        ?      290.9        3.4       ?       ? 
1 1 1   23    5   38 o    739.8    3.2    0.0000   0.0000          ?        ?  5474.0459  46.6121          ?        ?      739.8        3.2       ?       ? 
1 1 1   23    5   39 o   1008.2    3.7    0.0000   0.0000          ?        ? 10165.2646  75.3456          ?        ?     1008.2        3.7       ?       ? 
1 1 1   23    5   40 o    416.0    3.0    0.0000   0.0000          ?        ?  1730.3936  24.9023          ?        ?      416.0        3.0       ?       ? 
1 1 1   23    5   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    5   42 o    658.8    3.0    0.0000   0.0000          ?        ?  4341.3086  38.9498          ?        ?      658.8        3.0       ?       ? 
1 1 1   23    5   43 o    475.7    2.5    0.0000   0.0000          ?        ?  2263.5591  23.6253          ?        ?      475.7        2.5       ?       ? 
1 1 1   23    5   44 o    111.5    7.2    0.0000   0.0000          ?        ?   124.5117  15.9630          ?        ?      111.5        7.2       ?       ? 
1 1 1   23    5   45 o    294.2    3.3    0.0000   0.0000          ?        ?   865.8354  19.1556          ?        ?      294.2        3.3       ?       ? 
1 1 1   23    5   46 o    927.6    3.4    0.0000   0.0000          ?        ?  8605.9951  63.8522          ?        ?      927.6        3.4       ?       ? 
1 1 1   23    5   47 o     38.5   15.2    0.0000   0.0000          ?        ?     8.3008  17.2401          ?        ?       38.5       15.2       ?       ? 
1 1 1   23    5   48 o    511.4    2.7    0.0000   0.0000          ?        ?  2616.0232  27.4564          ?        ?      511.4        2.7       ?       ? 
1 1 1   23    5   49 o    177.9    5.2    0.0000   0.0000          ?        ?   316.7067  18.5171          ?        ?      177.9        5.2       ?       ? 
1 1 1   23    5   50 o     85.9   10.8    0.0000   0.0000          ?        ?    74.0685  18.5171          ?        ?       85.9       10.8       ?       ? 
1 1 1   23    5   51 o    741.6    2.9    0.0000   0.0000          ?        ?  5500.8638  43.4195          ?        ?      741.6        2.9       ?       ? 
1 1 1   23    5   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    5   53 o    333.7    3.1    0.0000   0.0000          ?        ?  1113.5817  20.4327          ?        ?      333.7        3.1       ?       ? 
1 1 1   23    5   54 o    179.8    5.1    0.0000   0.0000          ?        ?   323.7305  18.5171          ?        ?      179.8        5.1       ?       ? 
1 1 1   23    5   55 o    196.5    4.7    0.0000   0.0000          ?        ?   386.3056  18.5171          ?        ?      196.5        4.7       ?       ? 
1 1 1   23    5   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    5   57 o    338.4    3.1    0.0000   0.0000          ?        ?  1145.5078  21.0712          ?        ?      338.4        3.1       ?       ? 
1 1 1   23    5   58 o    171.1    5.6    0.0000   0.0000          ?        ?   293.0815  19.1556          ?        ?      171.1        5.6       ?       ? 
1 1 1   23    5   59 o    323.5    3.3    0.0000   0.0000          ?        ?  1047.1754  21.0712          ?        ?      323.5        3.3       ?       ? 
1 1 1   23    5   60 o    215.3    4.7    0.0000   0.0000          ?        ?   464.2052  20.4327          ?        ?      215.3        4.7       ?       ? 
1 1 1   23    5   61 o    264.5    4.1    0.0000   0.0000          ?        ?   700.4582  21.7097          ?        ?      264.5        4.1       ?       ? 
1 1 1   23    5   62 o    239.7    4.3    0.0000   0.0000          ?        ?   575.3080  20.4327          ?        ?      239.7        4.3       ?       ? 
1 1 1   23    5   63 o    255.2    3.9    0.0000   0.0000          ?        ?   651.9305  19.7942          ?        ?      255.2        3.9       ?       ? 
1 1 1   23    5   64 o    315.1    3.3    0.0000   0.0000          ?        ?   993.5397  21.0712          ?        ?      315.1        3.3       ?       ? 
1 1 1   23    5   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    5   66 o    310.6    3.4    0.0000   0.0000          ?        ?   965.4447  21.0712          ?        ?      310.6        3.4       ?       ? 
1 1 1   23    5   67 o    157.5    6.7    0.0000   0.0000          ?        ?   249.0234  21.0712          ?        ?      157.5        6.7       ?       ? 
1 1 1   23    5   68 o    197.3    5.3    0.0000   0.0000          ?        ?   390.1367  21.0712          ?        ?      197.3        5.3       ?       ? 
1 1 1   23    5   69 o     75.2   14.1    0.0000   0.0000          ?        ?    59.3825  20.4327          ?        ?       75.2       14.1       ?       ? 
1 1 1   23    5   70 o    131.6    7.5    0.0000   0.0000          ?        ?   174.3164  19.7942          ?        ?      131.6        7.5       ?       ? 
1 1 1   23    5   71 f    126.6    8.1    0.0000   0.0000          ?        ?   161.5460  20.4327          ?        ?      126.6        8.1       ?       ? 
1 1 1   23    5   72 o    146.6    7.2    0.0000   0.0000          ?        ?   216.4588  21.0712          ?        ?      146.6        7.2       ?       ? 
1 1 1   23    5   73 o    291.3    3.9    0.0000   0.0000          ?        ?   850.5108  22.9868          ?        ?      291.3        3.9       ?       ? 
1 1 1   23    5   74 o    116.1    9.1    0.0000   0.0000          ?        ?   136.6436  21.0712          ?        ?      116.1        9.1       ?       ? 
1 1 1   23    5   75 o    118.1    9.2    0.0000   0.0000          ?        ?   141.7518  21.7097          ?        ?      118.1        9.2       ?       ? 
1 1 1   23    5   76 o    106.9    9.0    0.0000   0.0000          ?        ?   116.2109  19.1556          ?        ?      106.9        9.0       ?       ? 
1 1 1   23    6    0 o    431.4    3.0 1861.2905  25.5409  1861.2905  25.5409  1861.2905  25.5409      431.4      3.0      431.4        3.0     0.0     0.0 
1 1 1   23    6    1 o   1365.7    4.7    0.0000   0.0000          ?        ? 18653.7695 127.7043          ?        ?     1365.7        4.7       ?       ? 
1 1 1   23    6    2 o    590.9    2.4    0.0000   0.0000          ?        ?  3492.0750  28.0950          ?        ?      590.9        2.4       ?       ? 
1 1 1   23    6    3 o    870.2    3.2    0.0000   0.0000          ?        ?  7572.2280  56.1899          ?        ?      870.2        3.2       ?       ? 
1 1 1   23    6    4 o    843.6    3.1    0.0000   0.0000          ?        ?  7116.9619  52.9973          ?        ?      843.6        3.1       ?       ? 
1 1 1   23    6    5 o    817.3    3.2    0.0000   0.0000          ?        ?  6679.5747  51.7203          ?        ?      817.3        3.2       ?       ? 
1 1 1   23    6    6 o    584.0    2.6    0.0000   0.0000          ?        ?  3410.3438  30.0105          ?        ?      584.0        2.6       ?       ? 
1 1 1   23    6    7 o    499.6    2.3    0.0000   0.0000          ?        ?  2495.9810  22.9868          ?        ?      499.6        2.3       ?       ? 
1 1 1   23    6    8 o   1156.1    4.1    0.0000   0.0000          ?        ? 13367.4502  93.8627          ?        ?     1156.1        4.1       ?       ? 
1 1 1   23    6    9 o    635.6    2.5    0.0000   0.0000          ?        ?  4040.5647  31.9261          ?        ?      635.6        2.5       ?       ? 
1 1 1   23    6   10 o    987.8    3.5    0.0000   0.0000          ?        ?  9757.2490  68.9603          ?        ?      987.8        3.5       ?       ? 
1 1 1   23    6   11 o   1787.2    6.1    0.0000   0.0000          ?        ? 31943.3223 219.6514          ?        ?     1787.2        6.1       ?       ? 
1 1 1   23    6   12 o     80.3    4.8    0.0000   0.0000          ?        ?    64.4907   7.6623          ?        ?       80.3        4.8       ?       ? 
1 1 1   23    6   13 o   1311.5    4.6    0.0000   0.0000          ?        ? 17201.1328 121.9576          ?        ?     1311.5        4.6       ?       ? 
1 1 1   23    6   14 o    962.1    3.6    0.0000   0.0000          ?        ?  9257.2871  68.3218          ?        ?      962.1        3.6       ?       ? 
1 1 1   23    6   15 o    589.7    2.5    0.0000   0.0000          ?        ?  3478.0273  29.3720          ?        ?      589.7        2.5       ?       ? 
1 1 1   23    6   16 o   1034.9    3.6    0.0000   0.0000          ?        ? 10710.5615  75.3456          ?        ?     1034.9        3.6       ?       ? 
1 1 1   23    6   17 o    634.0    2.6    0.0000   0.0000          ?        ?  4019.4937  32.5646          ?        ?      634.0        2.6       ?       ? 
1 1 1   23    6   18 f    149.9    3.6    0.0000   0.0000          ?        ?   224.7596  10.8549          ?        ?      149.9        3.6       ?       ? 
1 1 1   23    6   19 o   1396.8    4.7    0.0000   0.0000          ?        ? 19513.2207 130.8969          ?        ?     1396.8        4.7       ?       ? 
1 1 1   23    6   20 o    928.9    3.6    0.0000   0.0000          ?        ?  8628.3428  67.6833          ?        ?      928.9        3.6       ?       ? 
1 1 1   23    6   21 o    983.3    3.7    0.0000   0.0000          ?        ?  9669.1338  72.7915          ?        ?      983.3        3.7       ?       ? 
1 1 1   23    6   22 o    119.0    7.0    0.0000   0.0000          ?        ?   141.7518  16.6016          ?        ?      119.0        7.0       ?       ? 
1 1 1   23    6   23 o   1052.0    3.9    0.0000   0.0000          ?        ? 11068.1338  83.0078          ?        ?     1052.0        3.9       ?       ? 
1 1 1   23    6   24 o    297.9    2.8    0.0000   0.0000          ?        ?   887.5450  16.6016          ?        ?      297.9        2.8       ?       ? 
1 1 1   23    6   25 o    633.3    2.7    0.0000   0.0000          ?        ?  4011.1929  34.4802          ?        ?      633.3        2.7       ?       ? 
1 1 1   23    6   26 o     24.6   11.8    0.0000   0.0000          ?        ?   -21.0712  15.9630          ?        ?       24.6       11.8       ?       ? 
1 1 1   23    6   27 o    838.7    3.5    0.0000   0.0000          ?        ?  7033.9541  58.7440          ?        ?      838.7        3.5       ?       ? 
1 1 1   23    6   28 o    651.8    2.8    0.0000   0.0000          ?        ?  4248.7231  36.3957          ?        ?      651.8        2.8       ?       ? 
1 1 1   23    6   29 o   1344.0    4.6    0.0000   0.0000          ?        ? 18066.3301 123.2347          ?        ?     1344.0        4.6       ?       ? 
1 1 1   23    6   30 o   1055.8    3.9    0.0000   0.0000          ?        ? 11147.9492  83.0078          ?        ?     1055.8        3.9       ?       ? 
1 1 1   23    6   31 o    692.7    3.0    0.0000   0.0000          ?        ?  4799.1284  41.5039          ?        ?      692.7        3.0       ?       ? 
1 1 1   23    6   32 o   1256.8    4.8    0.0000   0.0000          ?        ? 15797.0254 120.6806          ?        ?     1256.8        4.8       ?       ? 
1 1 1   23    6   33 o    413.4    2.7    0.0000   0.0000          ?        ?  1708.6840  22.3483          ?        ?      413.4        2.7       ?       ? 
1 1 1   23    6   34 o    894.3    3.4    0.0000   0.0000          ?        ?  7998.7603  60.6596          ?        ?      894.3        3.4       ?       ? 
1 1 1   23    6   35 o    576.6    2.8    0.0000   0.0000          ?        ?  3325.4207  32.5646          ?        ?      576.6        2.8       ?       ? 
1 1 1   23    6   36 o    660.0    3.0    0.0000   0.0000          ?        ?  4356.6328  40.2269          ?        ?      660.0        3.0       ?       ? 
1 1 1   23    6   37 o    671.1    3.0    0.0000   0.0000          ?        ?  4503.4932  40.2269          ?        ?      671.1        3.0       ?       ? 
1 1 1   23    6   38 o   1370.8    4.8    0.0000   0.0000          ?        ? 18794.2441 130.2584          ?        ?     1370.8        4.8       ?       ? 
1 1 1   23    6   39 o    162.9    6.5    0.0000   0.0000          ?        ?   265.6250  21.0712          ?        ?      162.9        6.5       ?       ? 
1 1 1   23    6   40 o    554.0    2.8    0.0000   0.0000          ?        ?  3069.3735  30.6490          ?        ?      554.0        2.8       ?       ? 
1 1 1   23    6   41 o    339.3    2.9    0.0000   0.0000          ?        ?  1151.2545  19.7942          ?        ?      339.3        2.9       ?       ? 
1 1 1   23    6   42 o    400.5    3.0    0.0000   0.0000          ?        ?  1604.6049  24.2638          ?        ?      400.5        3.0       ?       ? 
1 1 1   23    6   43 o    118.5    6.7    0.0000   0.0000          ?        ?   140.4748  15.9630          ?        ?      118.5        6.7       ?       ? 
1 1 1   23    6   44 o    139.7    5.9    0.0000   0.0000          ?        ?   195.3876  16.6016          ?        ?      139.7        5.9       ?       ? 
1 1 1   23    6   45 o    414.0    2.6    0.0000   0.0000          ?        ?  1714.4305  21.7097          ?        ?      414.0        2.6       ?       ? 
1 1 1   23    6   46 f    287.4    3.4    0.0000   0.0000          ?        ?   826.2469  19.7942          ?        ?      287.4        3.4       ?       ? 
1 1 1   23    6   47 o    246.0    3.8    0.0000   0.0000          ?        ?   605.3185  18.5171          ?        ?      246.0        3.8       ?       ? 
1 1 1   23    6   48 o    125.5    6.9    0.0000   0.0000          ?        ?   157.7148  17.2401          ?        ?      125.5        6.9       ?       ? 
1 1 1   23    6   49 o    191.6    4.5    0.0000   0.0000          ?        ?   367.1499  17.2401          ?        ?      191.6        4.5       ?       ? 
1 1 1   23    6   50 o    683.3    2.9    0.0000   0.0000          ?        ?  4670.1475  39.5883          ?        ?      683.3        2.9       ?       ? 
1 1 1   23    6   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    6   52 o    368.7    2.8    0.0000   0.0000          ?        ?  1360.0510  20.4327          ?        ?      368.7        2.8       ?       ? 
1 1 1   23    6   53 o    762.6    3.0    0.0000   0.0000          ?        ?  5816.9321  45.9736          ?        ?      762.6        3.0       ?       ? 
1 1 1   23    6   54 o    328.8    3.2    0.0000   0.0000          ?        ?  1081.6556  21.0712          ?        ?      328.8        3.2       ?       ? 
1 1 1   23    6   55 o    372.2    3.0    0.0000   0.0000          ?        ?  1385.5919  22.3483          ?        ?      372.2        3.0       ?       ? 
1 1 1   23    6   56 o    505.7    2.8    0.0000   0.0000          ?        ?  2558.5562  28.0950          ?        ?      505.7        2.8       ?       ? 
1 1 1   23    6   57 f    420.6    2.9    0.0000   0.0000          ?        ?  1769.3435  24.2638          ?        ?      420.6        2.9       ?       ? 
1 1 1   23    6   58 o    363.0    3.1    0.0000   0.0000          ?        ?  1318.5471  22.3483          ?        ?      363.0        3.1       ?       ? 
1 1 1   23    6   59 o    133.8    7.2    0.0000   0.0000          ?        ?   179.4246  19.1556          ?        ?      133.8        7.2       ?       ? 
1 1 1   23    6   60 o    243.0    4.1    0.0000   0.0000          ?        ?   591.2710  19.7942          ?        ?      243.0        4.1       ?       ? 
1 1 1   23    6   61 o     63.7   15.2    0.0000   0.0000          ?        ?    42.7809  19.1556          ?        ?       63.7       15.2       ?       ? 
1 1 1   23    6   62 o    193.6    4.9    0.0000   0.0000          ?        ?   375.4507  19.1556          ?        ?      193.6        4.9       ?       ? 
1 1 1   23    6   63 o    241.6    4.2    0.0000   0.0000          ?        ?   584.2473  20.4327          ?        ?      241.6        4.2       ?       ? 
1 1 1   23    6   64 o    212.4    4.8    0.0000   0.0000          ?        ?   452.0733  20.4327          ?        ?      212.4        4.8       ?       ? 
1 1 1   23    6   65 o    140.2    7.5    0.0000   0.0000          ?        ?   197.3032  21.0712          ?        ?      140.2        7.5       ?       ? 
1 1 1   23    6   66 o    236.0    4.6    0.0000   0.0000          ?        ?   558.0679  21.7097          ?        ?      236.0        4.6       ?       ? 
1 1 1   23    6   67 o    155.5    6.8    0.0000   0.0000          ?        ?   242.6382  21.0712          ?        ?      155.5        6.8       ?       ? 
1 1 1   23    6   68 o     33.6   15.0    0.0000   0.0000          ?        ?    -7.6623  20.4327          ?        ?       33.6       15.0       ?       ? 
1 1 1   23    6   69 o    251.0    4.5    0.0000   0.0000          ?        ?   631.4979  22.3483          ?        ?      251.0        4.5       ?       ? 
1 1 1   23    6   70 o     57.3   17.1    0.0000   0.0000          ?        ?    34.4802  21.0712          ?        ?       57.3       17.1       ?       ? 
1 1 1   23    6   71 o    226.3    4.8    0.0000   0.0000          ?        ?   513.3714  21.7097          ?        ?      226.3        4.8       ?       ? 
1 1 1   23    6   72 o    182.7    5.8    0.0000   0.0000          ?        ?   335.2238  21.0712          ?        ?      182.7        5.8       ?       ? 
1 1 1   23    6   73 o     92.4   10.7    0.0000   0.0000          ?        ?    86.8389  19.7942          ?        ?       92.4       10.7       ?       ? 
1 1 1   23    6   74 o     64.8   15.5    0.0000   0.0000          ?        ?    45.3350  19.7942          ?        ?       64.8       15.5       ?       ? 
1 1 1   23    6   75 o    157.8    6.5    0.0000   0.0000          ?        ?   250.9390  20.4327          ?        ?      157.8        6.5       ?       ? 
1 1 1   23    7    0 o   1258.2    6.7 15832.1436 169.2082 15832.1436 169.2082 15832.1436 169.2082     1258.2      6.7     1258.2        6.7     0.0     0.0 
1 1 1   23    7    1 o   1482.3    5.3    0.0000   0.0000          ?        ? 21975.3613 158.3534          ?        ?     1482.3        5.3       ?       ? 
1 1 1   23    7    2 o    988.6    3.7    0.0000   0.0000          ?        ?  9773.8506  74.0685          ?        ?      988.6        3.7       ?       ? 
1 1 1   23    7    3 o    504.2    2.3    0.0000   0.0000          ?        ?  2541.9546  22.9868          ?        ?      504.2        2.3       ?       ? 
1 1 1   23    7    4 o   1378.3    5.0    0.0000   0.0000          ?        ? 18999.8496 137.2822          ?        ?     1378.3        5.0       ?       ? 
1 1 1   23    7    5 o   1277.3    4.4    0.0000   0.0000          ?        ? 16315.5039 113.6568          ?        ?     1277.3        4.4       ?       ? 
1 1 1   23    7    6 o   1950.8    6.7    0.0000   0.0000          ?        ? 38062.2734 260.5168          ?        ?     1950.8        6.7       ?       ? 
1 1 1   23    7    7 f   1151.5    4.2    0.0000   0.0000          ?        ? 13260.1787  95.7782          ?        ?     1151.5        4.2       ?       ? 
1 1 1   23    7    8 f   1582.7    5.6    0.0000   0.0000          ?        ? 25051.1191 178.7861          ?        ?     1582.7        5.6       ?       ? 
1 1 1   23    7    9 o    841.1    3.2    0.0000   0.0000          ?        ?  7075.4580  54.2743          ?        ?      841.1        3.2       ?       ? 
1 1 1   23    7   10 o   1227.6    4.4    0.0000   0.0000          ?        ? 15069.7500 107.2716          ?        ?     1227.6        4.4       ?       ? 
1 1 1   23    7   11 o   2032.6    6.9    0.0000   0.0000          ?        ? 41321.9258 281.5880          ?        ?     2032.6        6.9       ?       ? 
1 1 1   23    7   12 o    414.8    2.2    0.0000   0.0000          ?        ?  1720.8158  17.8786          ?        ?      414.8        2.2       ?       ? 
1 1 1   23    7   13 o   2270.1    7.9    0.0000   0.0000          ?        ? 51541.4648 356.9336          ?        ?     2270.1        7.9       ?       ? 
1 1 1   23    7   14 o    913.3    3.4    0.0000   0.0000          ?        ?  8342.2852  61.9366          ?        ?      913.3        3.4       ?       ? 
1 1 1   23    7   15 o    933.0    3.4    0.0000   0.0000          ?        ?  8705.6045  62.5751          ?        ?      933.0        3.4       ?       ? 
1 1 1   23    7   16 o    496.3    2.3    0.0000   0.0000          ?        ?  2463.4163  22.3483          ?        ?      496.3        2.3       ?       ? 
1 1 1   23    7   17 o   1067.8    3.7    0.0000   0.0000          ?        ? 11401.4424  79.8152          ?        ?     1067.8        3.7       ?       ? 
1 1 1   23    7   18 f   1063.9    3.8    0.0000   0.0000          ?        ? 11319.7119  79.8152          ?        ?     1063.9        3.8       ?       ? 
1 1 1   23    7   19 o    939.8    3.5    0.0000   0.0000          ?        ?  8833.3086  66.4062          ?        ?      939.8        3.5       ?       ? 
1 1 1   23    7   20 o    171.8    3.0    0.0000   0.0000          ?        ?   294.9970  10.2163          ?        ?      171.8        3.0       ?       ? 
1 1 1   23    7   21 o    907.9    3.3    0.0000   0.0000          ?        ?  8243.3145  60.6596          ?        ?      907.9        3.3       ?       ? 
1 1 1   23    7   22 o    698.4    2.8    0.0000   0.0000          ?        ?  4878.3052  39.5883          ?        ?      698.4        2.8       ?       ? 
1 1 1   23    7   23 o    405.2    2.4    0.0000   0.0000          ?        ?  1641.6392  19.7942          ?        ?      405.2        2.4       ?       ? 
1 1 1   23    7   24 o    265.1    2.8    0.0000   0.0000          ?        ?   703.0123  14.6860          ?        ?      265.1        2.8       ?       ? 
1 1 1   23    7   25 o    831.0    3.3    0.0000   0.0000          ?        ?  6906.2500  55.5514          ?        ?      831.0        3.3       ?       ? 
1 1 1   23    7   26 o    600.0    2.8    0.0000   0.0000          ?        ?  3600.6235  33.2031          ?        ?      600.0        2.8       ?       ? 
1 1 1   23    7   27 o   1443.3    5.4    0.0000   0.0000          ?        ? 20834.3223 155.1608          ?        ?     1443.3        5.4       ?       ? 
1 1 1   23    7   28 o    671.5    2.9    0.0000   0.0000          ?        ?  4509.8779  39.5883          ?        ?      671.5        2.9       ?       ? 
1 1 1   23    7   29 o    376.2    2.6    0.0000   0.0000          ?        ?  1415.6024  19.7942          ?        ?      376.2        2.6       ?       ? 
1 1 1   23    7   30 o    883.2    3.4    0.0000   0.0000          ?        ?  7801.4575  60.6596          ?        ?      883.2        3.4       ?       ? 
1 1 1   23    7   31 o    549.7    2.8    0.0000   0.0000          ?        ?  3021.4844  31.2876          ?        ?      549.7        2.8       ?       ? 
1 1 1   23    7   32 o    469.1    2.8    0.0000   0.0000          ?        ?  2200.9841  26.1794          ?        ?      469.1        2.8       ?       ? 
1 1 1   23    7   33 o    560.9    2.8    0.0000   0.0000          ?        ?  3145.9961  31.2876          ?        ?      560.9        2.8       ?       ? 
1 1 1   23    7   34 f    185.5    4.6    0.0000   0.0000          ?        ?   344.1632  17.2401          ?        ?      185.5        4.6       ?       ? 
1 1 1   23    7   35 o   1535.2    5.1    0.0000   0.0000          ?        ? 23572.3027 157.7148          ?        ?     1535.2        5.1       ?       ? 
1 1 1   23    7   36 o    903.3    3.5    0.0000   0.0000          ?        ?  8160.3062  62.5751          ?        ?      903.3        3.5       ?       ? 
1 1 1   23    7   37 o    277.7    3.6    0.0000   0.0000          ?        ?   771.3342  19.7942          ?        ?      277.7        3.6       ?       ? 
1 1 1   23    7   38 o   1041.3    3.8    0.0000   0.0000          ?        ? 10844.0127  79.8152          ?        ?     1041.3        3.8       ?       ? 
1 1 1   23    7   39 o    743.8    3.0    0.0000   0.0000          ?        ?  5532.7900  44.0580          ?        ?      743.8        3.0       ?       ? 
1 1 1   23    7   40 o    224.7    4.0    0.0000   0.0000          ?        ?   505.0706  17.8786          ?        ?      224.7        4.0       ?       ? 
1 1 1   23    7   41 o    493.5    2.6    0.0000   0.0000          ?        ?  2435.9600  25.5409          ?        ?      493.5        2.6       ?       ? 
1 1 1   23    7   42 o    263.3    3.3    0.0000   0.0000          ?        ?   693.4344  17.2401          ?        ?      263.3        3.3       ?       ? 
1 1 1   23    7   43 o    182.9    4.5    0.0000   0.0000          ?        ?   334.5853  16.6016          ?        ?      182.9        4.5       ?       ? 
1 1 1   23    7   44 o    128.3    6.5    0.0000   0.0000          ?        ?   164.7386  16.6016          ?        ?      128.3        6.5       ?       ? 
1 1 1   23    7   45 o    531.8    2.5    0.0000   0.0000          ?        ?  2828.0122  26.8179          ?        ?      531.8        2.5       ?       ? 
1 1 1   23    7   46 o    473.2    2.7    0.0000   0.0000          ?        ?  2239.2954  25.5409          ?        ?      473.2        2.7       ?       ? 
1 1 1   23    7   47 f    552.2    2.8    0.0000   0.0000          ?        ?  3049.5793  30.6490          ?        ?      552.2        2.8       ?       ? 
1 1 1   23    7   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    7   49 o     27.6   12.9    0.0000   0.0000          ?        ?   -15.9630  17.2401          ?        ?       27.6       12.9       ?       ? 
1 1 1   23    7   50 o    469.6    2.7    0.0000   0.0000          ?        ?  2205.4536  24.9023          ?        ?      469.6        2.7       ?       ? 
1 1 1   23    7   51 o    262.9    3.5    0.0000   0.0000          ?        ?   691.5189  18.5171          ?        ?      262.9        3.5       ?       ? 
1 1 1   23    7   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    7   53 o    348.9    3.0    0.0000   0.0000          ?        ?  1217.6608  21.0712          ?        ?      348.9        3.0       ?       ? 
1 1 1   23    7   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    7   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    7   56 o    109.7    8.4    0.0000   0.0000          ?        ?   120.6806  18.5171          ?        ?      109.7        8.4       ?       ? 
1 1 1   23    7   57 o     49.3   16.2    0.0000   0.0000          ?        ?    23.6253  18.5171          ?        ?       49.3       16.2       ?       ? 
1 1 1   23    7   58 o    147.2    6.3    0.0000   0.0000          ?        ?   217.0974  18.5171          ?        ?      147.2        6.3       ?       ? 
1 1 1   23    7   59 o    125.1    7.7    0.0000   0.0000          ?        ?   157.0763  19.1556          ?        ?      125.1        7.7       ?       ? 
1 1 1   23    7   60 o    140.5    6.8    0.0000   0.0000          ?        ?   197.9417  19.1556          ?        ?      140.5        6.8       ?       ? 
1 1 1   23    7   61 o    275.4    3.7    0.0000   0.0000          ?        ?   759.2022  20.4327          ?        ?      275.4        3.7       ?       ? 
1 1 1   23    7   62 o    211.3    4.7    0.0000   0.0000          ?        ?   446.9651  19.7942          ?        ?      211.3        4.7       ?       ? 
1 1 1   23    7   63 o    349.6    3.1    0.0000   0.0000          ?        ?  1222.7689  21.7097          ?        ?      349.6        3.1       ?       ? 
1 1 1   23    7   64 o     29.4   13.7    0.0000   0.0000          ?        ?   -18.5171  19.7942          ?        ?       29.4       13.7       ?       ? 
1 1 1   23    7   65 o    129.8    7.9    0.0000   0.0000          ?        ?   169.2082  20.4327          ?        ?      129.8        7.9       ?       ? 
1 1 1   23    7   66 o    244.1    4.4    0.0000   0.0000          ?        ?   597.0177  21.7097          ?        ?      244.1        4.4       ?       ? 
1 1 1   23    7   67 o    101.9   10.0    0.0000   0.0000          ?        ?   104.7175  20.4327          ?        ?      101.9       10.0       ?       ? 
1 1 1   23    7   68 o     20.9   10.5    0.0000   0.0000          ?        ?   -65.1292  20.4327          ?        ?       20.9       10.5       ?       ? 
1 1 1   23    7   69 o     47.7   17.0    0.0000   0.0000          ?        ?    20.4327  20.4327          ?        ?       47.7       17.0       ?       ? 
1 1 1   23    7   70 o     34.8   15.3    0.0000   0.0000          ?        ?    -4.4697  20.4327          ?        ?       34.8       15.3       ?       ? 
1 1 1   23    7   71 o     30.2   14.0    0.0000   0.0000          ?        ?   -17.2401  20.4327          ?        ?       30.2       14.0       ?       ? 
1 1 1   23    7   72 o    334.0    3.5    0.0000   0.0000          ?        ?  1117.4128  23.6253          ?        ?      334.0        3.5       ?       ? 
1 1 1   23    7   73 o     63.4   16.1    0.0000   0.0000          ?        ?    43.4195  20.4327          ?        ?       63.4       16.1       ?       ? 
1 1 1   23    7   74 o    257.4    4.2    0.0000   0.0000          ?        ?   664.7010  21.7097          ?        ?      257.4        4.2       ?       ? 
1 1 1   23    7   75 o    246.8    4.0    0.0000   0.0000          ?        ?   611.0652  19.7942          ?        ?      246.8        4.0       ?       ? 
1 1 1   23    8    0 o   1216.6    6.0 14802.8477 144.9444 14802.8477 144.9444 14802.8477 144.9444     1216.6      6.0     1216.6        6.0     0.0     0.0 
1 1 1   23    8    1 o   1415.6    4.8    0.0000   0.0000          ?        ? 20040.0020 135.3666          ?        ?     1415.6        4.8       ?       ? 
1 1 1   23    8    2 o    225.6    2.1    0.0000   0.0000          ?        ?   508.9017   9.5778          ?        ?      225.6        2.1       ?       ? 
1 1 1   23    8    3 o    257.4    1.9    0.0000   0.0000          ?        ?   662.7855   9.5778          ?        ?      257.4        1.9       ?       ? 
1 1 1   23    8    4 o   1211.4    4.4    0.0000   0.0000          ?        ? 14676.4199 107.2716          ?        ?     1211.4        4.4       ?       ? 
1 1 1   23    8    5 o   1619.4    5.6    0.0000   0.0000          ?        ? 26227.2754 181.9787          ?        ?     1619.4        5.6       ?       ? 
1 1 1   23    8    6 o    808.4    3.1    0.0000   0.0000          ?        ?  6535.9072  49.8047          ?        ?      808.4        3.1       ?       ? 
1 1 1   23    8    7 o   1164.0    4.1    0.0000   0.0000          ?        ? 13550.0684  95.1397          ?        ?     1164.0        4.1       ?       ? 
1 1 1   23    8    8 o    734.1    2.8    0.0000   0.0000          ?        ?  5389.1226  41.5039          ?        ?      734.1        2.8       ?       ? 
1 1 1   23    8    9 o    892.5    3.2    0.0000   0.0000          ?        ?  7965.5571  57.4669          ?        ?      892.5        3.2       ?       ? 
1 1 1   23    8   10 o   1528.5    5.3    0.0000   0.0000          ?        ? 23365.4219 163.4615          ?        ?     1528.5        5.3       ?       ? 
1 1 1   23    8   11 o   2659.2    9.1    0.0000   0.0000          ?        ? 70730.9531 485.2764          ?        ?     2659.2        9.1       ?       ? 
1 1 1   23    8   12 o    664.5    2.8    0.0000   0.0000          ?        ?  4415.3770  37.0343          ?        ?      664.5        2.8       ?       ? 
1 1 1   23    8   13 o    449.5    2.5    0.0000   0.0000          ?        ?  2020.2823  22.3483          ?        ?      449.5        2.5       ?       ? 
1 1 1   23    8   14 o    700.9    2.8    0.0000   0.0000          ?        ?  4912.1470  38.9498          ?        ?      700.9        2.8       ?       ? 
1 1 1   23    8   15 f   1821.7    6.3    0.0000   0.0000          ?        ? 33189.7148 227.9522          ?        ?     1821.7        6.3       ?       ? 
1 1 1   23    8   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    8   17 o     20.7   10.5    0.0000   0.0000          ?        ?   -72.1529  21.0712          ?        ?       20.7       10.5       ?       ? 
1 1 1   23    8   18 o    422.5    2.3    0.0000   0.0000          ?        ?  1785.3065  19.7942          ?        ?      422.5        2.3       ?       ? 
1 1 1   23    8   19 o   1019.8    3.9    0.0000   0.0000          ?        ? 10400.2402  79.1767          ?        ?     1019.8        3.9       ?       ? 
1 1 1   23    8   20 o    779.6    3.0    0.0000   0.0000          ?        ?  6078.0874  46.6121          ?        ?      779.6        3.0       ?       ? 
1 1 1   23    8   21 o    786.8    3.1    0.0000   0.0000          ?        ?  6191.1055  48.5276          ?        ?      786.8        3.1       ?       ? 
1 1 1   23    8   22 o    624.7    2.7    0.0000   0.0000          ?        ?  3902.0056  33.2031          ?        ?      624.7        2.7       ?       ? 
1 1 1   23    8   23 o   1484.6    5.2    0.0000   0.0000          ?        ? 22043.0430 154.5222          ?        ?     1484.6        5.2       ?       ? 
1 1 1   23    8   24 o    763.8    3.1    0.0000   0.0000          ?        ?  5834.8105  46.6121          ?        ?      763.8        3.1       ?       ? 
1 1 1   23    8   25 o   1560.0    5.5    0.0000   0.0000          ?        ? 24340.4453 170.4853          ?        ?     1560.0        5.5       ?       ? 
1 1 1   23    8   26 o    807.5    3.1    0.0000   0.0000          ?        ?  6520.5830  50.4432          ?        ?      807.5        3.1       ?       ? 
1 1 1   23    8   27 o    646.3    2.7    0.0000   0.0000          ?        ?  4177.2085  35.1187          ?        ?      646.3        2.7       ?       ? 
1 1 1   23    8   28 o    437.5    2.6    0.0000   0.0000          ?        ?  1914.2877  22.3483          ?        ?      437.5        2.6       ?       ? 
1 1 1   23    8   29 o    301.4    3.2    0.0000   0.0000          ?        ?   908.6163  19.1556          ?        ?      301.4        3.2       ?       ? 
1 1 1   23    8   30 o    860.9    3.4    0.0000   0.0000          ?        ?  7411.3203  58.1055          ?        ?      860.9        3.4       ?       ? 
1 1 1   23    8   31 o    635.3    3.0    0.0000   0.0000          ?        ?  4036.0950  38.3113          ?        ?      635.3        3.0       ?       ? 
1 1 1   23    8   32 o    728.9    3.2    0.0000   0.0000          ?        ?  5313.7769  47.2506          ?        ?      728.9        3.2       ?       ? 
1 1 1   23    8   33 o    873.6    3.4    0.0000   0.0000          ?        ?  7632.8877  59.3825          ?        ?      873.6        3.4       ?       ? 
1 1 1   23    8   34 o   1062.4    4.1    0.0000   0.0000          ?        ? 11288.4238  86.8389          ?        ?     1062.4        4.1       ?       ? 
1 1 1   23    8   35 o   1051.8    4.0    0.0000   0.0000          ?        ? 11064.9414  83.6463          ?        ?     1051.8        4.0       ?       ? 
1 1 1   23    8   36 o    286.4    3.3    0.0000   0.0000          ?        ?   820.5003  19.1556          ?        ?      286.4        3.3       ?       ? 
1 1 1   23    8   37 o    238.8    3.9    0.0000   0.0000          ?        ?   570.1998  18.5171          ?        ?      238.8        3.9       ?       ? 
1 1 1   23    8   38 f    641.4    2.8    0.0000   0.0000          ?        ?  4114.6333  36.3957          ?        ?      641.4        2.8       ?       ? 
1 1 1   23    8   39 o    758.3    3.1    0.0000   0.0000          ?        ?  5751.1646  47.2506          ?        ?      758.3        3.1       ?       ? 
1 1 1   23    8   40 o    859.8    3.3    0.0000   0.0000          ?        ?  7394.0806  56.8284          ?        ?      859.8        3.3       ?       ? 
1 1 1   23    8   41 o   1093.4    4.0    0.0000   0.0000          ?        ? 11957.5938  87.4775          ?        ?     1093.4        4.0       ?       ? 
1 1 1   23    8   42 o    228.7    4.0    0.0000   0.0000          ?        ?   522.9492  18.5171          ?        ?      228.7        4.0       ?       ? 
1 1 1   23    8   43 o     25.9   12.3    0.0000   0.0000          ?        ?   -21.7097  17.2401          ?        ?       25.9       12.3       ?       ? 
1 1 1   23    8   44 o    601.9    2.9    0.0000   0.0000          ?        ?  3622.9719  34.4802          ?        ?      601.9        2.9       ?       ? 
1 1 1   23    8   45 o    110.9    7.5    0.0000   0.0000          ?        ?   123.2347  16.6016          ?        ?      110.9        7.5       ?       ? 
1 1 1   23    8   46 o    340.4    3.0    0.0000   0.0000          ?        ?  1158.9167  20.4327          ?        ?      340.4        3.0       ?       ? 
1 1 1   23    8   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    8   48 o    575.2    2.7    0.0000   0.0000          ?        ?  3308.8191  31.2876          ?        ?      575.2        2.7       ?       ? 
1 1 1   23    8   49 o    836.3    3.3    0.0000   0.0000          ?        ?  6996.9204  55.5514          ?        ?      836.3        3.3       ?       ? 
1 1 1   23    8   50 o    617.5    2.8    0.0000   0.0000          ?        ?  3814.5283  34.4802          ?        ?      617.5        2.8       ?       ? 
1 1 1   23    8   51 o     79.3   11.3    0.0000   0.0000          ?        ?    63.2136  17.8786          ?        ?       79.3       11.3       ?       ? 
1 1 1   23    8   52 f    372.2    2.7    0.0000   0.0000          ?        ?  1385.5919  20.4327          ?        ?      372.2        2.7       ?       ? 
1 1 1   23    8   53 o    175.9    5.1    0.0000   0.0000          ?        ?   309.6830  17.8786          ?        ?      175.9        5.1       ?       ? 
1 1 1   23    8   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    8   55 o    277.5    3.7    0.0000   0.0000          ?        ?   770.6956  20.4327          ?        ?      277.5        3.7       ?       ? 
1 1 1   23    8   56 o    330.0    3.1    0.0000   0.0000          ?        ?  1089.3180  20.4327          ?        ?      330.0        3.1       ?       ? 
1 1 1   23    8   57 o     30.9   14.0    0.0000   0.0000          ?        ?   -10.2163  18.5171          ?        ?       30.9       14.0       ?       ? 
1 1 1   23    8   58 o    103.3    9.6    0.0000   0.0000          ?        ?   107.2716  19.7942          ?        ?      103.3        9.6       ?       ? 
1 1 1   23    8   59 o     34.0   14.7    0.0000   0.0000          ?        ?    -2.5541  18.5171          ?        ?       34.0       14.7       ?       ? 
1 1 1   23    8   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    8   61 o    233.1    4.4    0.0000   0.0000          ?        ?   544.0204  20.4327          ?        ?      233.1        4.4       ?       ? 
1 1 1   23    8   62 o    321.9    3.5    0.0000   0.0000          ?        ?  1036.9591  22.3483          ?        ?      321.9        3.5       ?       ? 
1 1 1   23    8   63 o    232.1    4.3    0.0000   0.0000          ?        ?   539.5508  19.7942          ?        ?      232.1        4.3       ?       ? 
1 1 1   23    8   64 o    219.8    4.8    0.0000   0.0000          ?        ?   483.9994  21.0712          ?        ?      219.8        4.8       ?       ? 
1 1 1   23    8   65 o    351.4    3.4    0.0000   0.0000          ?        ?  1236.1779  23.6253          ?        ?      351.4        3.4       ?       ? 
1 1 1   23    8   66 o     22.0   11.0    0.0000   0.0000          ?        ?   -52.9973  19.7942          ?        ?       22.0       11.0       ?       ? 
1 1 1   23    8   67 o     29.9   14.1    0.0000   0.0000          ?        ?   -25.5409  22.3483          ?        ?       29.9       14.1       ?       ? 
1 1 1   23    8   68 o    178.7    6.3    0.0000   0.0000          ?        ?   320.5379  22.3483          ?        ?      178.7        6.3       ?       ? 
1 1 1   23    8   69 o    170.1    6.2    0.0000   0.0000          ?        ?   290.5273  21.0712          ?        ?      170.1        6.2       ?       ? 
1 1 1   23    8   70 f    183.7    5.9    0.0000   0.0000          ?        ?   339.0550  21.7097          ?        ?      183.7        5.9       ?       ? 
1 1 1   23    8   71 o     82.6   12.4    0.0000   0.0000          ?        ?    69.5989  20.4327          ?        ?       82.6       12.4       ?       ? 
1 1 1   23    8   72 o     54.2   17.0    0.0000   0.0000          ?        ?    30.6490  20.4327          ?        ?       54.2       17.0       ?       ? 
1 1 1   23    8   73 o    148.7    6.9    0.0000   0.0000          ?        ?   222.8441  20.4327          ?        ?      148.7        6.9       ?       ? 
1 1 1   23    8   74 o    107.8    9.2    0.0000   0.0000          ?        ?   118.1265  19.7942          ?        ?      107.8        9.2       ?       ? 
1 1 1   23    8   75 o    190.5    5.4    0.0000   0.0000          ?        ?   365.2344  20.4327          ?        ?      190.5        5.4       ?       ? 
1 1 1   23    9    0 o   2070.1   10.6 42865.2344 438.0258 42865.2344 438.0258 42865.2344 438.0258     2070.1     10.6     2070.1       10.6     0.0     0.0 
1 1 1   23    9    1 o   1130.9    4.1    0.0000   0.0000          ?        ? 12788.9502  93.2242          ?        ?     1130.9        4.1       ?       ? 
1 1 1   23    9    2 f   1552.2    5.6    0.0000   0.0000          ?        ? 24095.2520 172.4008          ?        ?     1552.2        5.6       ?       ? 
1 1 1   23    9    3 o    781.0    3.1    0.0000   0.0000          ?        ?  6099.1587  48.5276          ?        ?      781.0        3.1       ?       ? 
1 1 1   23    9    4 o    795.5    3.1    0.0000   0.0000          ?        ?  6328.3877  49.8047          ?        ?      795.5        3.1       ?       ? 
1 1 1   23    9    5 o   1500.2    5.4    0.0000   0.0000          ?        ? 22507.8867 162.1845          ?        ?     1500.2        5.4       ?       ? 
1 1 1   23    9    6 o   1974.6    6.7    0.0000   0.0000          ?        ? 38993.8750 266.2635          ?        ?     1974.6        6.7       ?       ? 
1 1 1   23    9    7 o   1009.2    3.7    0.0000   0.0000          ?        ? 10184.4199  74.7070          ?        ?     1009.2        3.7       ?       ? 
1 1 1   23    9    8 o   1437.1    5.1    0.0000   0.0000          ?        ? 20655.5352 145.5829          ?        ?     1437.1        5.1       ?       ? 
1 1 1   23    9    9 o    421.4    2.3    0.0000   0.0000          ?        ?  1775.7286  19.1556          ?        ?      421.4        2.3       ?       ? 
1 1 1   23    9   10 o    804.7    3.2    0.0000   0.0000          ?        ?  6475.2476  51.7203          ?        ?      804.7        3.2       ?       ? 
1 1 1   23    9   11 o    930.5    3.6    0.0000   0.0000          ?        ?  8658.3535  67.0448          ?        ?      930.5        3.6       ?       ? 
1 1 1   23    9   12 o   2791.6   12.2    0.0000   0.0000          ?        ? 77966.6797 679.3870          ?        ?     2791.6       12.2       ?       ? 
1 1 1   23    9   13 f    750.2    2.9    0.0000   0.0000          ?        ?  5628.5684  44.0580          ?        ?      750.2        2.9       ?       ? 
1 1 1   23    9   14 o    699.0    2.7    0.0000   0.0000          ?        ?  4885.9678  38.3113          ?        ?      699.0        2.7       ?       ? 
1 1 1   23    9   15 o    744.4    3.0    0.0000   0.0000          ?        ?  5541.7295  44.0580          ?        ?      744.4        3.0       ?       ? 
1 1 1   23    9   16 f   1623.2    5.5    0.0000   0.0000          ?        ? 26349.2344 179.4246          ?        ?     1623.2        5.5       ?       ? 
1 1 1   23    9   17 o   1186.8    4.3    0.0000   0.0000          ?        ? 14085.1475 101.5249          ?        ?     1186.8        4.3       ?       ? 
1 1 1   23    9   18 o   1376.5    4.8    0.0000   0.0000          ?        ? 18949.4062 130.8969          ?        ?     1376.5        4.8       ?       ? 
1 1 1   23    9   19 o    214.3    2.8    0.0000   0.0000          ?        ?   459.0970  12.1319          ?        ?      214.3        2.8       ?       ? 
1 1 1   23    9   20 o    228.7    2.8    0.0000   0.0000          ?        ?   522.9492  12.7704          ?        ?      228.7        2.8       ?       ? 
1 1 1   23    9   21 o    187.9    3.4    0.0000   0.0000          ?        ?   353.1024  12.7704          ?        ?      187.9        3.4       ?       ? 
1 1 1   23    9   22 o    131.0    5.8    0.0000   0.0000          ?        ?   171.7623  15.3245          ?        ?      131.0        5.8       ?       ? 
1 1 1   23    9   23 o    835.9    3.1    0.0000   0.0000          ?        ?  6987.9810  52.3588          ?        ?      835.9        3.1       ?       ? 
1 1 1   23    9   24 o    834.9    3.3    0.0000   0.0000          ?        ?  6970.1021  54.2743          ?        ?      834.9        3.3       ?       ? 
1 1 1   23    9   25 o    209.4    3.5    0.0000   0.0000          ?        ?   438.6643  14.6860          ?        ?      209.4        3.5       ?       ? 
1 1 1   23    9   26 o    219.1    3.2    0.0000   0.0000          ?        ?   480.1682  14.0475          ?        ?      219.1        3.2       ?       ? 
1 1 1   23    9   27 o   1414.8    4.9    0.0000   0.0000          ?        ? 20019.5684 139.8362          ?        ?     1414.8        4.9       ?       ? 
1 1 1   23    9   28 o    936.0    3.7    0.0000   0.0000          ?        ?  8762.4326  68.9603          ?        ?      936.0        3.7       ?       ? 
1 1 1   23    9   29 o    814.3    3.1    0.0000   0.0000          ?        ?  6631.6855  49.8047          ?        ?      814.3        3.1       ?       ? 
1 1 1   23    9   30 o    808.1    3.2    0.0000   0.0000          ?        ?  6530.7993  51.7203          ?        ?      808.1        3.2       ?       ? 
1 1 1   23    9   31 o   1432.4    5.1    0.0000   0.0000          ?        ? 20520.1699 146.2215          ?        ?     1432.4        5.1       ?       ? 
1 1 1   23    9   32 o    558.5    2.8    0.0000   0.0000          ?        ?  3119.8167  31.2876          ?        ?      558.5        2.8       ?       ? 
1 1 1   23    9   33 o   1226.9    4.4    0.0000   0.0000          ?        ? 15055.0635 107.9102          ?        ?     1226.9        4.4       ?       ? 
1 1 1   23    9   34 o    418.5    2.7    0.0000   0.0000          ?        ?  1751.4647  22.3483          ?        ?      418.5        2.7       ?       ? 
1 1 1   23    9   35 o    345.8    2.7    0.0000   0.0000          ?        ?  1195.9510  18.5171          ?        ?      345.8        2.7       ?       ? 
1 1 1   23    9   36 o     77.0   11.2    0.0000   0.0000          ?        ?    59.3825  17.2401          ?        ?       77.0       11.2       ?       ? 
1 1 1   23    9   37 o    884.3    3.3    0.0000   0.0000          ?        ?  7821.2515  58.7440          ?        ?      884.3        3.3       ?       ? 
1 1 1   23    9   38 o    392.9    2.6    0.0000   0.0000          ?        ?  1543.9453  20.4327          ?        ?      392.9        2.6       ?       ? 
1 1 1   23    9   39 o    475.7    2.5    0.0000   0.0000          ?        ?  2262.9207  23.6253          ?        ?      475.7        2.5       ?       ? 
1 1 1   23    9   40 o    471.6    2.7    0.0000   0.0000          ?        ?  2224.6094  25.5409          ?        ?      471.6        2.7       ?       ? 
1 1 1   23    9   41 o    346.5    2.9    0.0000   0.0000          ?        ?  1201.0592  19.7942          ?        ?      346.5        2.9       ?       ? 
1 1 1   23    9   42 o    466.9    2.5    0.0000   0.0000          ?        ?  2179.9128  22.9868          ?        ?      466.9        2.5       ?       ? 
1 1 1   23    9   43 o    333.0    2.9    0.0000   0.0000          ?        ?  1109.1121  19.1556          ?        ?      333.0        2.9       ?       ? 
1 1 1   23    9   44 o    238.2    3.6    0.0000   0.0000          ?        ?   567.6458  17.2401          ?        ?      238.2        3.6       ?       ? 
1 1 1   23    9   45 o     62.5   14.1    0.0000   0.0000          ?        ?    40.8654  17.2401          ?        ?       62.5       14.1       ?       ? 
1 1 1   23    9   46 o    680.7    2.9    0.0000   0.0000          ?        ?  4635.0288  38.9498          ?        ?      680.7        2.9       ?       ? 
1 1 1   23    9   47 o    118.2    7.0    0.0000   0.0000          ?        ?   139.8362  16.6016          ?        ?      118.2        7.0       ?       ? 
1 1 1   23    9   48 o    325.3    2.7    0.0000   0.0000          ?        ?  1058.6688  17.8786          ?        ?      325.3        2.7       ?       ? 
1 1 1   23    9   49 o    122.9    7.0    0.0000   0.0000          ?        ?   151.3296  17.2401          ?        ?      122.9        7.0       ?       ? 
1 1 1   23    9   50 o    144.8    6.4    0.0000   0.0000          ?        ?   210.0736  18.5171          ?        ?      144.8        6.4       ?       ? 
1 1 1   23    9   51 o    191.9    4.7    0.0000   0.0000          ?        ?   368.4270  17.8786          ?        ?      191.9        4.7       ?       ? 
1 1 1   23    9   52 o    545.3    2.7    0.0000   0.0000          ?        ?  2974.2336  29.3720          ?        ?      545.3        2.7       ?       ? 
1 1 1   23    9   53 o    374.0    2.9    0.0000   0.0000          ?        ?  1399.0010  21.7097          ?        ?      374.0        2.9       ?       ? 
1 1 1   23    9   54 o    278.9    3.7    0.0000   0.0000          ?        ?   778.3578  20.4327          ?        ?      278.9        3.7       ?       ? 
1 1 1   23    9   55 o    243.6    3.9    0.0000   0.0000          ?        ?   593.8251  19.1556          ?        ?      243.6        3.9       ?       ? 
1 1 1   23    9   56 o    275.1    3.6    0.0000   0.0000          ?        ?   757.2866  19.7942          ?        ?      275.1        3.6       ?       ? 
1 1 1   23    9   57 o     50.5   16.5    0.0000   0.0000          ?        ?    24.9023  19.1556          ?        ?       50.5       16.5       ?       ? 
1 1 1   23    9   58 o    332.8    3.1    0.0000   0.0000          ?        ?  1108.4736  20.4327          ?        ?      332.8        3.1       ?       ? 
1 1 1   23    9   59 o    149.1    6.4    0.0000   0.0000          ?        ?   222.8441  19.1556          ?        ?      149.1        6.4       ?       ? 
1 1 1   23    9   60 o    166.1    6.0    0.0000   0.0000          ?        ?   276.4799  19.7942          ?        ?      166.1        6.0       ?       ? 
1 1 1   23    9   61 o    136.3    7.3    0.0000   0.0000          ?        ?   186.4483  19.7942          ?        ?      136.3        7.3       ?       ? 
1 1 1   23    9   62 o    211.9    4.8    0.0000   0.0000          ?        ?   449.5192  20.4327          ?        ?      211.9        4.8       ?       ? 
1 1 1   23    9   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23    9   64 o    297.9    3.8    0.0000   0.0000          ?        ?   888.1836  22.3483          ?        ?      297.9        3.8       ?       ? 
1 1 1   23    9   65 o    334.7    3.4    0.0000   0.0000          ?        ?  1121.2440  22.9868          ?        ?      334.7        3.4       ?       ? 
1 1 1   23    9   66 o     94.7   10.8    0.0000   0.0000          ?        ?    90.6701  20.4327          ?        ?       94.7       10.8       ?       ? 
1 1 1   23    9   67 o     28.0   13.4    0.0000   0.0000          ?        ?   -28.0950  21.0712          ?        ?       28.0       13.4       ?       ? 
1 1 1   23    9   68 o    278.5    4.1    0.0000   0.0000          ?        ?   777.0808  22.9868          ?        ?      278.5        4.1       ?       ? 
1 1 1   23    9   69 o    344.9    3.5    0.0000   0.0000          ?        ?  1191.4814  24.2638          ?        ?      344.9        3.5       ?       ? 
1 1 1   23    9   70 o    267.8    4.3    0.0000   0.0000          ?        ?   718.9753  22.9868          ?        ?      267.8        4.3       ?       ? 
1 1 1   23    9   71 o     32.0   14.6    0.0000   0.0000          ?        ?   -13.4090  21.0712          ?        ?       32.0       14.6       ?       ? 
1 1 1   23    9   72 o     25.7   12.5    0.0000   0.0000          ?        ?   -37.6728  21.0712          ?        ?       25.7       12.5       ?       ? 
1 1 1   23    9   73 o     47.9   17.2    0.0000   0.0000          ?        ?    21.0712  21.0712          ?        ?       47.9       17.2       ?       ? 
1 1 1   23    9   74 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   10    0 o    727.1    4.4 5286.9590  63.8522  5286.9590  63.8522  5286.9590  63.8522      727.1      4.4      727.1        4.4     0.0     0.0 
1 1 1   23   10    1 f    178.1    2.7    0.0000   0.0000          ?        ?   317.3452   9.5778          ?        ?      178.1        2.7       ?       ? 
1 1 1   23   10    2 o   1064.5    4.1    0.0000   0.0000          ?        ? 11333.1201  87.4775          ?        ?     1064.5        4.1       ?       ? 
1 1 1   23   10    3 o    767.9    3.1    0.0000   0.0000          ?        ?  5897.3857  47.8891          ?        ?      767.9        3.1       ?       ? 
1 1 1   23   10    4 o   1143.2    4.0    0.0000   0.0000          ?        ? 13069.8994  92.5856          ?        ?     1143.2        4.0       ?       ? 
1 1 1   23   10    5 o   2168.0    7.5    0.0000   0.0000          ?        ? 47011.7930 326.9231          ?        ?     2168.0        7.5       ?       ? 
1 1 1   23   10    6 o    569.8    2.5    0.0000   0.0000          ?        ?  3246.2439  28.0950          ?        ?      569.8        2.5       ?       ? 
1 1 1   23   10    7 o    836.9    3.2    0.0000   0.0000          ?        ?  7003.9438  54.2743          ?        ?      836.9        3.2       ?       ? 
1 1 1   23   10    8 o    447.1    2.3    0.0000   0.0000          ?        ?  1999.2113  20.4327          ?        ?      447.1        2.3       ?       ? 
1 1 1   23   10    9 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   10   10 o   1231.9    4.3    0.0000   0.0000          ?        ? 15177.0195 106.6331          ?        ?     1231.9        4.3       ?       ? 
1 1 1   23   10   11 o    883.4    3.2    0.0000   0.0000          ?        ?  7804.6504  56.8284          ?        ?      883.4        3.2       ?       ? 
1 1 1   23   10   12 o   1199.4    4.2    0.0000   0.0000          ?        ? 14387.1689  99.6094          ?        ?     1199.4        4.2       ?       ? 
1 1 1   23   10   13 o    407.8    2.2    0.0000   0.0000          ?        ?  1662.7103  17.8786          ?        ?      407.8        2.2       ?       ? 
1 1 1   23   10   14 o   1478.6    5.1    0.0000   0.0000          ?        ? 21864.8965 149.4141          ?        ?     1478.6        5.1       ?       ? 
1 1 1   23   10   15 o    871.7    3.4    0.0000   0.0000          ?        ?  7599.6841  59.3825          ?        ?      871.7        3.4       ?       ? 
1 1 1   23   10   16 o    725.1    2.8    0.0000   0.0000          ?        ?  5257.5874  40.2269          ?        ?      725.1        2.8       ?       ? 
1 1 1   23   10   17 o   1131.6    3.9    0.0000   0.0000          ?        ? 12805.5508  89.3930          ?        ?     1131.6        3.9       ?       ? 
1 1 1   23   10   18 o    955.5    3.5    0.0000   0.0000          ?        ?  9129.5830  67.0448          ?        ?      955.5        3.5       ?       ? 
1 1 1   23   10   19 o    221.3    2.6    0.0000   0.0000          ?        ?   489.7461  11.4934          ?        ?      221.3        2.6       ?       ? 
1 1 1   23   10   20 o   1017.4    3.8    0.0000   0.0000          ?        ? 10351.7119  77.2611          ?        ?     1017.4        3.8       ?       ? 
1 1 1   23   10   21 o    369.4    2.3    0.0000   0.0000          ?        ?  1364.5208  17.2401          ?        ?      369.4        2.3       ?       ? 
1 1 1   23   10   22 o    851.3    3.3    0.0000   0.0000          ?        ?  7247.2207  56.8284          ?        ?      851.3        3.3       ?       ? 
1 1 1   23   10   23 o   1269.0    4.4    0.0000   0.0000          ?        ? 16105.4316 110.4642          ?        ?     1269.0        4.4       ?       ? 
1 1 1   23   10   24 o    633.1    2.7    0.0000   0.0000          ?        ?  4008.0002  34.4802          ?        ?      633.1        2.7       ?       ? 
1 1 1   23   10   25 o   1019.8    3.7    0.0000   0.0000          ?        ? 10401.5176  75.3456          ?        ?     1019.8        3.7       ?       ? 
1 1 1   23   10   26 o    555.0    2.9    0.0000   0.0000          ?        ?  3080.8669  31.9261          ?        ?      555.0        2.9       ?       ? 
1 1 1   23   10   27 o    415.1    2.4    0.0000   0.0000          ?        ?  1723.3699  19.7942          ?        ?      415.1        2.4       ?       ? 
1 1 1   23   10   28 o    341.5    2.7    0.0000   0.0000          ?        ?  1166.5790  18.5171          ?        ?      341.5        2.7       ?       ? 
1 1 1   23   10   29 o   1150.2    4.2    0.0000   0.0000          ?        ? 13230.8076  97.6938          ?        ?     1150.2        4.2       ?       ? 
1 1 1   23   10   30 o    434.9    2.6    0.0000   0.0000          ?        ?  1891.3011  22.3483          ?        ?      434.9        2.6       ?       ? 
1 1 1   23   10   31 o    713.4    3.1    0.0000   0.0000          ?        ?  5090.2944  44.6965          ?        ?      713.4        3.1       ?       ? 
1 1 1   23   10   32 o    798.0    3.4    0.0000   0.0000          ?        ?  6369.2534  53.6358          ?        ?      798.0        3.4       ?       ? 
1 1 1   23   10   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   10   34 o    361.2    2.8    0.0000   0.0000          ?        ?  1304.4998  20.4327          ?        ?      361.2        2.8       ?       ? 
1 1 1   23   10   35 f    757.9    3.2    0.0000   0.0000          ?        ?  5744.1406  47.8891          ?        ?      757.9        3.2       ?       ? 
1 1 1   23   10   36 o    610.5    2.8    0.0000   0.0000          ?        ?  3727.0508  33.8416          ?        ?      610.5        2.8       ?       ? 
1 1 1   23   10   37 o    489.9    2.7    0.0000   0.0000          ?        ?  2400.2026  26.1794          ?        ?      489.9        2.7       ?       ? 
1 1 1   23   10   38 o    419.1    2.5    0.0000   0.0000          ?        ?  1756.5730  21.0712          ?        ?      419.1        2.5       ?       ? 
1 1 1   23   10   39 o    274.7    3.1    0.0000   0.0000          ?        ?   754.7325  17.2401          ?        ?      274.7        3.1       ?       ? 
1 1 1   23   10   40 o    414.5    2.6    0.0000   0.0000          ?        ?  1718.2617  21.7097          ?        ?      414.5        2.6       ?       ? 
1 1 1   23   10   41 o    718.4    2.9    0.0000   0.0000          ?        ?  5161.1704  42.1424          ?        ?      718.4        2.9       ?       ? 
1 1 1   23   10   42 o    641.4    2.8    0.0000   0.0000          ?        ?  4114.6333  36.3957          ?        ?      641.4        2.8       ?       ? 
1 1 1   23   10   43 o    479.6    2.6    0.0000   0.0000          ?        ?  2300.5933  24.9023          ?        ?      479.6        2.6       ?       ? 
1 1 1   23   10   44 o    160.2    5.0    0.0000   0.0000          ?        ?   256.6857  15.9630          ?        ?      160.2        5.0       ?       ? 
1 1 1   23   10   45 o    480.6    2.6    0.0000   0.0000          ?        ?  2310.1711  24.9023          ?        ?      480.6        2.6       ?       ? 
1 1 1   23   10   46 o    261.7    3.4    0.0000   0.0000          ?        ?   685.1337  17.8786          ?        ?      261.7        3.4       ?       ? 
1 1 1   23   10   47 o    457.6    2.7    0.0000   0.0000          ?        ?  2094.3508  24.9023          ?        ?      457.6        2.7       ?       ? 
1 1 1   23   10   48 o     33.4   14.1    0.0000   0.0000          ?        ?     1.2770  15.9630          ?        ?       33.4       14.1       ?       ? 
1 1 1   23   10   49 o    228.9    3.8    0.0000   0.0000          ?        ?   524.2263  17.2401          ?        ?      228.9        3.8       ?       ? 
1 1 1   23   10   50 o    456.1    2.7    0.0000   0.0000          ?        ?  2080.9419  24.2638          ?        ?      456.1        2.7       ?       ? 
1 1 1   23   10   51 o    251.7    3.6    0.0000   0.0000          ?        ?   634.0520  17.8786          ?        ?      251.7        3.6       ?       ? 
1 1 1   23   10   52 o     99.0    8.7    0.0000   0.0000          ?        ?    98.3323  17.2401          ?        ?       99.0        8.7       ?       ? 
1 1 1   23   10   53 o    283.9    3.6    0.0000   0.0000          ?        ?   806.4528  20.4327          ?        ?      283.9        3.6       ?       ? 
1 1 1   23   10   54 f    209.5    4.4    0.0000   0.0000          ?        ?   439.3029  18.5171          ?        ?      209.5        4.4       ?       ? 
1 1 1   23   10   55 o    276.0    3.6    0.0000   0.0000          ?        ?   762.3948  19.7942          ?        ?      276.0        3.6       ?       ? 
1 1 1   23   10   56 o    153.6    6.0    0.0000   0.0000          ?        ?   236.2530  18.5171          ?        ?      153.6        6.0       ?       ? 
1 1 1   23   10   57 o    272.1    3.5    0.0000   0.0000          ?        ?   740.6851  19.1556          ?        ?      272.1        3.5       ?       ? 
1 1 1   23   10   58 o    395.9    2.9    0.0000   0.0000          ?        ?  1568.2091  22.9868          ?        ?      395.9        2.9       ?       ? 
1 1 1   23   10   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   10   60 o    118.6    7.8    0.0000   0.0000          ?        ?   141.1133  18.5171          ?        ?      118.6        7.8       ?       ? 
1 1 1   23   10   61 o    216.6    4.6    0.0000   0.0000          ?        ?   469.9519  19.7942          ?        ?      216.6        4.6       ?       ? 
1 1 1   23   10   62 o    189.6    5.2    0.0000   0.0000          ?        ?   360.1262  19.7942          ?        ?      189.6        5.2       ?       ? 
1 1 1   23   10   63 o     52.1   17.0    0.0000   0.0000          ?        ?    26.8179  20.4327          ?        ?       52.1       17.0       ?       ? 
1 1 1   23   10   64 o    272.5    4.0    0.0000   0.0000          ?        ?   743.2392  21.7097          ?        ?      272.5        4.0       ?       ? 
1 1 1   23   10   65 o    163.3    6.3    0.0000   0.0000          ?        ?   267.5406  20.4327          ?        ?      163.3        6.3       ?       ? 
1 1 1   23   10   66 o    255.1    4.1    0.0000   0.0000          ?        ?   651.9305  21.0712          ?        ?      255.1        4.1       ?       ? 
1 1 1   23   10   67 f     62.4   16.2    0.0000   0.0000          ?        ?    41.5039  20.4327          ?        ?       62.4       16.2       ?       ? 
1 1 1   23   10   68 o    286.4    3.8    0.0000   0.0000          ?        ?   821.7773  21.7097          ?        ?      286.4        3.8       ?       ? 
1 1 1   23   10   69 o    143.4    7.3    0.0000   0.0000          ?        ?   206.8810  21.0712          ?        ?      143.4        7.3       ?       ? 
1 1 1   23   10   70 o     39.1   16.3    0.0000   0.0000          ?        ?     4.4697  21.0712          ?        ?       39.1       16.3       ?       ? 
1 1 1   23   10   71 o    210.1    5.0    0.0000   0.0000          ?        ?   443.1340  21.0712          ?        ?      210.1        5.0       ?       ? 
1 1 1   23   10   72 o    111.6    9.7    0.0000   0.0000          ?        ?   126.4273  21.7097          ?        ?      111.6        9.7       ?       ? 
1 1 1   23   10   73 o    188.7    5.8    0.0000   0.0000          ?        ?   358.2106  21.7097          ?        ?      188.7        5.8       ?       ? 
1 1 1   23   10   74 o    170.7    6.2    0.0000   0.0000          ?        ?   293.7199  21.0712          ?        ?      170.7        6.2       ?       ? 
1 1 1   23   11    0 o    832.2    4.9 6926.0439  81.7308  6926.0439  81.7308  6926.0439  81.7308      832.2      4.9      832.2        4.9     0.0     0.0 
1 1 1   23   11    1 o    746.8    3.2    0.0000   0.0000          ?        ?  5577.4863  48.5276          ?        ?      746.8        3.2       ?       ? 
1 1 1   23   11    2 o   1542.4    5.7    0.0000   0.0000          ?        ? 23791.3164 175.5934          ?        ?     1542.4        5.7       ?       ? 
1 1 1   23   11    3 o    848.6    3.6    0.0000   0.0000          ?        ?  7201.8857  61.2981          ?        ?      848.6        3.6       ?       ? 
1 1 1   23   11    4 o    528.8    2.5    0.0000   0.0000          ?        ?  2796.7246  26.1794          ?        ?      528.8        2.5       ?       ? 
1 1 1   23   11    5 o    752.9    2.9    0.0000   0.0000          ?        ?  5668.1567  44.0580          ?        ?      752.9        2.9       ?       ? 
1 1 1   23   11    6 o    744.6    3.1    0.0000   0.0000          ?        ?  5544.9219  46.6121          ?        ?      744.6        3.1       ?       ? 
1 1 1   23   11    7 o    283.0    2.1    0.0000   0.0000          ?        ?   800.7061  12.1319          ?        ?      283.0        2.1       ?       ? 
1 1 1   23   11    8 o    901.7    3.4    0.0000   0.0000          ?        ?  8130.9346  60.6596          ?        ?      901.7        3.4       ?       ? 
1 1 1   23   11    9 o   1600.4    5.3    0.0000   0.0000          ?        ? 25614.2949 169.8468          ?        ?     1600.4        5.3       ?       ? 
1 1 1   23   11   10 o   1101.9    3.9    0.0000   0.0000          ?        ? 12142.1270  86.2004          ?        ?     1101.9        3.9       ?       ? 
1 1 1   23   11   11 o   1486.2    5.0    0.0000   0.0000          ?        ? 22088.3789 148.7755          ?        ?     1486.2        5.0       ?       ? 
1 1 1   23   11   12 f   1378.7    5.0    0.0000   0.0000          ?        ? 19008.7891 137.2822          ?        ?     1378.7        5.0       ?       ? 
1 1 1   23   11   13 o   1879.0    6.6    0.0000   0.0000          ?        ? 35312.8008 247.7464          ?        ?     1879.0        6.6       ?       ? 
1 1 1   23   11   14 o    919.0    3.5    0.0000   0.0000          ?        ?  8445.0869  63.8522          ?        ?      919.0        3.5       ?       ? 
1 1 1   23   11   15 o    354.8    2.7    0.0000   0.0000          ?        ?  1259.1647  19.1556          ?        ?      354.8        2.7       ?       ? 
1 1 1   23   11   16 o    222.4    3.0    0.0000   0.0000          ?        ?   494.8542  13.4090          ?        ?      222.4        3.0       ?       ? 
1 1 1   23   11   17 o    672.4    2.8    0.0000   0.0000          ?        ?  4520.7329  37.0343          ?        ?      672.4        2.8       ?       ? 
1 1 1   23   11   18 o    832.1    3.4    0.0000   0.0000          ?        ?  6924.1289  56.8284          ?        ?      832.1        3.4       ?       ? 
1 1 1   23   11   19 o    278.2    2.8    0.0000   0.0000          ?        ?   773.8882  15.3245          ?        ?      278.2        2.8       ?       ? 
1 1 1   23   11   20 o    155.1    4.3    0.0000   0.0000          ?        ?   240.7227  13.4090          ?        ?      155.1        4.3       ?       ? 
1 1 1   23   11   21 o   1311.0    4.8    0.0000   0.0000          ?        ? 17188.3633 127.0658          ?        ?     1311.0        4.8       ?       ? 
1 1 1   23   11   22 o    201.7    3.6    0.0000   0.0000          ?        ?   406.7383  14.6860          ?        ?      201.7        3.6       ?       ? 
1 1 1   23   11   23 o   1371.8    5.1    0.0000   0.0000          ?        ? 18821.0645 139.1977          ?        ?     1371.8        5.1       ?       ? 
1 1 1   23   11   24 o    453.6    2.7    0.0000   0.0000          ?        ?  2057.9551  24.9023          ?        ?      453.6        2.7       ?       ? 
1 1 1   23   11   25 o    845.4    3.3    0.0000   0.0000          ?        ?  7147.6113  55.5514          ?        ?      845.4        3.3       ?       ? 
1 1 1   23   11   26 o   1097.9    4.2    0.0000   0.0000          ?        ? 12054.6504  91.3086          ?        ?     1097.9        4.2       ?       ? 
1 1 1   23   11   27 o    214.7    3.3    0.0000   0.0000          ?        ?   461.0126  14.0475          ?        ?      214.7        3.3       ?       ? 
1 1 1   23   11   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   11   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   11   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   11   31 o   1253.4    4.6    0.0000   0.0000          ?        ? 15711.4639 116.2109          ?        ?     1253.4        4.6       ?       ? 
1 1 1   23   11   32 o    487.8    2.9    0.0000   0.0000          ?        ?  2379.7703  28.0950          ?        ?      487.8        2.9       ?       ? 
1 1 1   23   11   33 o    595.1    2.8    0.0000   0.0000          ?        ?  3541.2407  33.8416          ?        ?      595.1        2.8       ?       ? 
1 1 1   23   11   34 o    309.2    3.0    0.0000   0.0000          ?        ?   955.8669  18.5171          ?        ?      309.2        3.0       ?       ? 
1 1 1   23   11   35 o    311.2    3.0    0.0000   0.0000          ?        ?   968.6373  18.5171          ?        ?      311.2        3.0       ?       ? 
1 1 1   23   11   36 o    313.6    3.0    0.0000   0.0000          ?        ?   983.3233  18.5171          ?        ?      313.6        3.0       ?       ? 
1 1 1   23   11   37 o    236.9    3.8    0.0000   0.0000          ?        ?   561.2605  17.8786          ?        ?      236.9        3.8       ?       ? 
1 1 1   23   11   38 o    682.5    2.9    0.0000   0.0000          ?        ?  4658.6538  39.5883          ?        ?      682.5        2.9       ?       ? 
1 1 1   23   11   39 o    551.4    2.6    0.0000   0.0000          ?        ?  3041.2783  28.7335          ?        ?      551.4        2.6       ?       ? 
1 1 1   23   11   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   11   41 o    559.3    2.7    0.0000   0.0000          ?        ?  3128.7559  30.6490          ?        ?      559.3        2.7       ?       ? 
1 1 1   23   11   42 o    864.5    3.3    0.0000   0.0000          ?        ?  7475.1724  57.4669          ?        ?      864.5        3.3       ?       ? 
1 1 1   23   11   43 o     96.5    9.3    0.0000   0.0000          ?        ?    93.2242  17.8786          ?        ?       96.5        9.3       ?       ? 
1 1 1   23   11   44 o    468.2    2.7    0.0000   0.0000          ?        ?  2192.6831  24.9023          ?        ?      468.2        2.7       ?       ? 
1 1 1   23   11   45 o    448.3    2.6    0.0000   0.0000          ?        ?  2010.0660  22.9868          ?        ?      448.3        2.6       ?       ? 
1 1 1   23   11   46 o    329.2    3.1    0.0000   0.0000          ?        ?  1084.2097  20.4327          ?        ?      329.2        3.1       ?       ? 
1 1 1   23   11   47 o     65.5   13.6    0.0000   0.0000          ?        ?    44.6965  17.2401          ?        ?       65.5       13.6       ?       ? 
1 1 1   23   11   48 o    294.6    3.3    0.0000   0.0000          ?        ?   868.3894  19.1556          ?        ?      294.6        3.3       ?       ? 
1 1 1   23   11   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   11   50 o     21.7   10.8    0.0000   0.0000          ?        ?   -43.4195  17.8786          ?        ?       21.7       10.8       ?       ? 
1 1 1   23   11   51 o    385.1    2.9    0.0000   0.0000          ?        ?  1483.2858  22.3483          ?        ?      385.1        2.9       ?       ? 
1 1 1   23   11   52 o    358.5    2.9    0.0000   0.0000          ?        ?  1285.3440  21.0712          ?        ?      358.5        2.9       ?       ? 
1 1 1   23   11   53 f    314.3    3.3    0.0000   0.0000          ?        ?   988.4315  20.4327          ?        ?      314.3        3.3       ?       ? 
1 1 1   23   11   54 f    375.2    3.0    0.0000   0.0000          ?        ?  1408.5787  22.3483          ?        ?      375.2        3.0       ?       ? 
1 1 1   23   11   55 o    403.3    2.8    0.0000   0.0000          ?        ?  1626.9531  22.3483          ?        ?      403.3        2.8       ?       ? 
1 1 1   23   11   56 o     78.0   11.9    0.0000   0.0000          ?        ?    61.2981  18.5171          ?        ?       78.0       11.9       ?       ? 
1 1 1   23   11   57 o    193.3    4.8    0.0000   0.0000          ?        ?   374.1737  18.5171          ?        ?      193.3        4.8       ?       ? 
1 1 1   23   11   58 o    313.3    3.3    0.0000   0.0000          ?        ?   982.0463  20.4327          ?        ?      313.3        3.3       ?       ? 
1 1 1   23   11   59 o    130.1    7.4    0.0000   0.0000          ?        ?   169.8468  19.1556          ?        ?      130.1        7.4       ?       ? 
1 1 1   23   11   60 f    225.9    4.4    0.0000   0.0000          ?        ?   510.8173  19.7942          ?        ?      225.9        4.4       ?       ? 
1 1 1   23   11   61 o    159.8    6.0    0.0000   0.0000          ?        ?   256.0471  19.1556          ?        ?      159.8        6.0       ?       ? 
1 1 1   23   11   62 o     63.6   15.6    0.0000   0.0000          ?        ?    42.7809  19.7942          ?        ?       63.6       15.6       ?       ? 
1 1 1   23   11   63 o    124.5    8.2    0.0000   0.0000          ?        ?   155.7993  20.4327          ?        ?      124.5        8.2       ?       ? 
1 1 1   23   11   64 o    227.1    4.5    0.0000   0.0000          ?        ?   516.5640  20.4327          ?        ?      227.1        4.5       ?       ? 
1 1 1   23   11   65 o     97.1    9.9    0.0000   0.0000          ?        ?    95.1397  19.1556          ?        ?       97.1        9.9       ?       ? 
1 1 1   23   11   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   11   67 o    234.3    4.6    0.0000   0.0000          ?        ?   550.4056  21.7097          ?        ?      234.3        4.6       ?       ? 
1 1 1   23   11   68 o    335.7    3.4    0.0000   0.0000          ?        ?  1128.2677  22.9868          ?        ?      335.7        3.4       ?       ? 
1 1 1   23   11   69 o     27.8   13.3    0.0000   0.0000          ?        ?   -26.1794  20.4327          ?        ?       27.8       13.3       ?       ? 
1 1 1   23   11   70 o    183.2    5.8    0.0000   0.0000          ?        ?   337.1394  21.0712          ?        ?      183.2        5.8       ?       ? 
1 1 1   23   11   71 o     84.7   12.1    0.0000   0.0000          ?        ?    73.4300  20.4327          ?        ?       84.7       12.1       ?       ? 
1 1 1   23   11   72 o    114.5    8.9    0.0000   0.0000          ?        ?   132.8125  20.4327          ?        ?      114.5        8.9       ?       ? 
1 1 1   23   11   73 o    181.1    5.8    0.0000   0.0000          ?        ?   330.1157  21.0712          ?        ?      181.1        5.8       ?       ? 
1 1 1   23   12    0 o    245.7    4.3  604.0414  21.0712   604.0414  21.0712   604.0414  21.0712      245.7      4.3      245.7        4.3     0.0     0.0 
1 1 1   23   12    1 o    455.3    2.8    0.0000   0.0000          ?        ?  2073.2798  25.5409          ?        ?      455.3        2.8       ?       ? 
1 1 1   23   12    2 o   1403.3    5.4    0.0000   0.0000          ?        ? 19693.2832 150.6911          ?        ?     1403.3        5.4       ?       ? 
1 1 1   23   12    3 o    798.4    3.3    0.0000   0.0000          ?        ?  6374.3613  52.3588          ?        ?      798.4        3.3       ?       ? 
1 1 1   23   12    4 o    975.5    3.6    0.0000   0.0000          ?        ?  9517.1650  70.8759          ?        ?      975.5        3.6       ?       ? 
1 1 1   23   12    5 o   1600.5    5.5    0.0000   0.0000          ?        ? 25618.1270 177.5090          ?        ?     1600.5        5.5       ?       ? 
1 1 1   23   12    6 o   1285.4    4.6    0.0000   0.0000          ?        ? 16524.3008 118.1265          ?        ?     1285.4        4.6       ?       ? 
1 1 1   23   12    7 o    246.7    2.5    0.0000   0.0000          ?        ?   608.5111  12.1319          ?        ?      246.7        2.5       ?       ? 
1 1 1   23   12    8 o    800.8    3.0    0.0000   0.0000          ?        ?  6412.6729  48.5276          ?        ?      800.8        3.0       ?       ? 
1 1 1   23   12    9 o    770.3    2.9    0.0000   0.0000          ?        ?  5933.1431  45.3350          ?        ?      770.3        2.9       ?       ? 
1 1 1   23   12   10 o   1416.4    4.8    0.0000   0.0000          ?        ? 20062.9883 135.3666          ?        ?     1416.4        4.8       ?       ? 
1 1 1   23   12   11 o    142.5    2.9    0.0000   0.0000          ?        ?   203.0499   8.3008          ?        ?      142.5        2.9       ?       ? 
1 1 1   23   12   12 o   1102.8    4.0    0.0000   0.0000          ?        ? 12163.1982  87.4775          ?        ?     1102.8        4.0       ?       ? 
1 1 1   23   12   13 o     91.4   12.6    0.0000   0.0000          ?        ?    83.6463  22.9868          ?        ?       91.4       12.6       ?       ? 
1 1 1   23   12   14 o    697.6    2.8    0.0000   0.0000          ?        ?  4866.8120  39.5883          ?        ?      697.6        2.8       ?       ? 
1 1 1   23   12   15 o   1485.1    5.2    0.0000   0.0000          ?        ? 22059.0059 154.5222          ?        ?     1485.1        5.2       ?       ? 
1 1 1   23   12   16 o    818.4    3.3    0.0000   0.0000          ?        ?  6697.4536  53.6358          ?        ?      818.4        3.3       ?       ? 
1 1 1   23   12   17 o    373.0    2.6    0.0000   0.0000          ?        ?  1391.3386  19.1556          ?        ?      373.0        2.6       ?       ? 
1 1 1   23   12   18 o    616.6    2.6    0.0000   0.0000          ?        ?  3801.7578  32.5646          ?        ?      616.6        2.6       ?       ? 
1 1 1   23   12   19 o    196.5    3.2    0.0000   0.0000          ?        ?   386.3056  12.7704          ?        ?      196.5        3.2       ?       ? 
1 1 1   23   12   20 o    206.8    3.1    0.0000   0.0000          ?        ?   427.8095  12.7704          ?        ?      206.8        3.1       ?       ? 
1 1 1   23   12   21 o    831.1    3.3    0.0000   0.0000          ?        ?  6906.8882  54.9129          ?        ?      831.1        3.3       ?       ? 
1 1 1   23   12   22 o   1433.6    5.0    0.0000   0.0000          ?        ? 20554.0117 142.3903          ?        ?     1433.6        5.0       ?       ? 
1 1 1   23   12   23 o    328.0    2.4    0.0000   0.0000          ?        ?  1075.9089  15.9630          ?        ?      328.0        2.4       ?       ? 
1 1 1   23   12   24 o    139.8    4.8    0.0000   0.0000          ?        ?   195.3876  13.4090          ?        ?      139.8        4.8       ?       ? 
1 1 1   23   12   25 o    591.8    2.6    0.0000   0.0000          ?        ?  3502.2910  31.2876          ?        ?      591.8        2.6       ?       ? 
1 1 1   23   12   26 o   1147.6    4.0    0.0000   0.0000          ?        ? 13170.7852  91.9471          ?        ?     1147.6        4.0       ?       ? 
1 1 1   23   12   27 o    645.7    2.7    0.0000   0.0000          ?        ?  4169.5464  35.1187          ?        ?      645.7        2.7       ?       ? 
1 1 1   23   12   28 o     19.9   10.1    0.0000   0.0000          ?        ?   -68.9603  19.7942          ?        ?       19.9       10.1       ?       ? 
1 1 1   23   12   29 o    168.2    4.6    0.0000   0.0000          ?        ?   282.8651  15.3245          ?        ?      168.2        4.6       ?       ? 
1 1 1   23   12   30 o   1407.0    5.3    0.0000   0.0000          ?        ? 19800.5547 148.1370          ?        ?     1407.0        5.3       ?       ? 
1 1 1   23   12   31 o     24.0   11.6    0.0000   0.0000          ?        ?   -26.1794  16.6016          ?        ?       24.0       11.6       ?       ? 
1 1 1   23   12   32 o    560.0    2.6    0.0000   0.0000          ?        ?  3136.4182  29.3720          ?        ?      560.0        2.6       ?       ? 
1 1 1   23   12   33 o    482.4    2.6    0.0000   0.0000          ?        ?  2327.4114  24.9023          ?        ?      482.4        2.6       ?       ? 
1 1 1   23   12   34 o    891.9    3.5    0.0000   0.0000          ?        ?  7955.3413  63.2136          ?        ?      891.9        3.5       ?       ? 
1 1 1   23   12   35 o    543.4    2.6    0.0000   0.0000          ?        ?  2953.1626  28.7335          ?        ?      543.4        2.6       ?       ? 
1 1 1   23   12   36 o    230.9    3.5    0.0000   0.0000          ?        ?   533.1656  15.9630          ?        ?      230.9        3.5       ?       ? 
1 1 1   23   12   37 o    301.1    2.9    0.0000   0.0000          ?        ?   906.7007  17.2401          ?        ?      301.1        2.9       ?       ? 
1 1 1   23   12   38 o    198.3    3.9    0.0000   0.0000          ?        ?   393.3293  15.3245          ?        ?      198.3        3.9       ?       ? 
1 1 1   23   12   39 o    246.1    3.5    0.0000   0.0000          ?        ?   605.9570  17.2401          ?        ?      246.1        3.5       ?       ? 
1 1 1   23   12   40 o    416.6    2.5    0.0000   0.0000          ?        ?  1736.1403  21.0712          ?        ?      416.6        2.5       ?       ? 
1 1 1   23   12   41 o    132.5    6.0    0.0000   0.0000          ?        ?   175.5934  15.9630          ?        ?      132.5        6.0       ?       ? 
1 1 1   23   12   42 o    204.5    3.9    0.0000   0.0000          ?        ?   418.2317  15.9630          ?        ?      204.5        3.9       ?       ? 
1 1 1   23   12   43 o    321.3    3.0    0.0000   0.0000          ?        ?  1032.4895  19.1556          ?        ?      321.3        3.0       ?       ? 
1 1 1   23   12   44 o    367.2    2.7    0.0000   0.0000          ?        ?  1348.5576  19.7942          ?        ?      367.2        2.7       ?       ? 
1 1 1   23   12   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   12   46 o    544.4    2.6    0.0000   0.0000          ?        ?  2964.0176  28.7335          ?        ?      544.4        2.6       ?       ? 
1 1 1   23   12   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   12   48 o    325.3    3.0    0.0000   0.0000          ?        ?  1058.6688  19.7942          ?        ?      325.3        3.0       ?       ? 
1 1 1   23   12   49 o    202.9    4.4    0.0000   0.0000          ?        ?   411.8464  17.8786          ?        ?      202.9        4.4       ?       ? 
1 1 1   23   12   50 o    447.6    2.7    0.0000   0.0000          ?        ?  2004.3193  24.2638          ?        ?      447.6        2.7       ?       ? 
1 1 1   23   12   51 o    269.4    3.4    0.0000   0.0000          ?        ?   725.9991  18.5171          ?        ?      269.4        3.4       ?       ? 
1 1 1   23   12   52 o     61.4   14.7    0.0000   0.0000          ?        ?    39.5883  17.8786          ?        ?       61.4       14.7       ?       ? 
1 1 1   23   12   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   12   54 o    223.2    4.0    0.0000   0.0000          ?        ?   498.6854  17.8786          ?        ?      223.2        4.0       ?       ? 
1 1 1   23   12   55 o    401.9    2.8    0.0000   0.0000          ?        ?  1616.0983  22.3483          ?        ?      401.9        2.8       ?       ? 
1 1 1   23   12   56 o    481.7    2.7    0.0000   0.0000          ?        ?  2321.0261  26.1794          ?        ?      481.7        2.7       ?       ? 
1 1 1   23   12   57 o    183.5    5.0    0.0000   0.0000          ?        ?   337.1394  18.5171          ?        ?      183.5        5.0       ?       ? 
1 1 1   23   12   58 o    150.4    6.4    0.0000   0.0000          ?        ?   226.6752  19.1556          ?        ?      150.4        6.4       ?       ? 
1 1 1   23   12   59 o    623.1    2.8    0.0000   0.0000          ?        ?  3884.1270  35.1187          ?        ?      623.1        2.8       ?       ? 
1 1 1   23   12   60 o    258.7    3.7    0.0000   0.0000          ?        ?   669.8092  19.1556          ?        ?      258.7        3.7       ?       ? 
1 1 1   23   12   61 o    201.2    5.1    0.0000   0.0000          ?        ?   405.4612  20.4327          ?        ?      201.2        5.1       ?       ? 
1 1 1   23   12   62 f    158.6    6.4    0.0000   0.0000          ?        ?   252.2160  20.4327          ?        ?      158.6        6.4       ?       ? 
1 1 1   23   12   63 f    299.2    3.4    0.0000   0.0000          ?        ?   895.8459  20.4327          ?        ?      299.2        3.4       ?       ? 
1 1 1   23   12   64 o     38.1   15.7    0.0000   0.0000          ?        ?     5.1082  19.1556          ?        ?       38.1       15.7       ?       ? 
1 1 1   23   12   65 o    156.3    6.5    0.0000   0.0000          ?        ?   245.1923  20.4327          ?        ?      156.3        6.5       ?       ? 
1 1 1   23   12   66 o     26.2   12.7    0.0000   0.0000          ?        ?   -30.0105  19.7942          ?        ?       26.2       12.7       ?       ? 
1 1 1   23   12   67 o     62.8   15.8    0.0000   0.0000          ?        ?    42.1424  19.7942          ?        ?       62.8       15.8       ?       ? 
1 1 1   23   12   68 o     71.5   14.8    0.0000   0.0000          ?        ?    54.2743  20.4327          ?        ?       71.5       14.8       ?       ? 
1 1 1   23   12   69 o    179.7    5.9    0.0000   0.0000          ?        ?   324.3690  21.0712          ?        ?      179.7        5.9       ?       ? 
1 1 1   23   12   70 o     29.4   13.8    0.0000   0.0000          ?        ?   -19.7942  20.4327          ?        ?       29.4       13.8       ?       ? 
1 1 1   23   12   71 f    147.8    7.1    0.0000   0.0000          ?        ?   220.2900  21.0712          ?        ?      147.8        7.1       ?       ? 
1 1 1   23   12   72 o    198.1    5.3    0.0000   0.0000          ?        ?   394.6064  21.0712          ?        ?      198.1        5.3       ?       ? 
1 1 1   23   12   73 o    134.8    7.6    0.0000   0.0000          ?        ?   183.8942  20.4327          ?        ?      134.8        7.6       ?       ? 
1 1 1   23   13    0 o    487.5    3.9 2377.2158  37.6728  2377.2158  37.6728  2377.2158  37.6728      487.5      3.9      487.5        3.9     0.0     0.0 
1 1 1   23   13    1 o    409.7    2.7    0.0000   0.0000          ?        ?  1678.6733  22.3483          ?        ?      409.7        2.7       ?       ? 
1 1 1   23   13    2 o    171.9    3.9    0.0000   0.0000          ?        ?   295.6355  13.4090          ?        ?      171.9        3.9       ?       ? 
1 1 1   23   13    3 f   1207.5    4.5    0.0000   0.0000          ?        ? 14581.9180 109.8257          ?        ?     1207.5        4.5       ?       ? 
1 1 1   23   13    4 o    319.1    2.4    0.0000   0.0000          ?        ?  1018.4420  15.3245          ?        ?      319.1        2.4       ?       ? 
1 1 1   23   13    5 o   1538.6    5.4    0.0000   0.0000          ?        ? 23674.4668 165.3771          ?        ?     1538.6        5.4       ?       ? 
1 1 1   23   13    6 o   1294.2    4.6    0.0000   0.0000          ?        ? 16749.6992 119.4035          ?        ?     1294.2        4.6       ?       ? 
1 1 1   23   13    7 o   2497.0    8.2    0.0000   0.0000          ?        ? 62363.7695 408.6538          ?        ?     2497.0        8.2       ?       ? 
1 1 1   23   13    8 o    841.6    3.1    0.0000   0.0000          ?        ?  7082.4814  52.9973          ?        ?      841.6        3.1       ?       ? 
1 1 1   23   13    9 o    357.4    2.1    0.0000   0.0000          ?        ?  1277.6818  14.6860          ?        ?      357.4        2.1       ?       ? 
1 1 1   23   13   10 o    791.8    3.0    0.0000   0.0000          ?        ?  6269.0054  47.8891          ?        ?      791.8        3.0       ?       ? 
1 1 1   23   13   11 o    610.7    2.6    0.0000   0.0000          ?        ?  3729.6047  31.2876          ?        ?      610.7        2.6       ?       ? 
1 1 1   23   13   12 o    492.3    2.3    0.0000   0.0000          ?        ?  2423.1895  22.9868          ?        ?      492.3        2.3       ?       ? 
1 1 1   23   13   13 o   1984.9    6.8    0.0000   0.0000          ?        ? 39405.0820 269.4561          ?        ?     1984.9        6.8       ?       ? 
1 1 1   23   13   14 o   1082.4    4.2    0.0000   0.0000          ?        ? 11717.5098  90.0316          ?        ?     1082.4        4.2       ?       ? 
1 1 1   23   13   15 o   1014.5    3.7    0.0000   0.0000          ?        ? 10293.6074  75.3456          ?        ?     1014.5        3.7       ?       ? 
1 1 1   23   13   16 o    808.4    3.1    0.0000   0.0000          ?        ?  6534.6304  50.4432          ?        ?      808.4        3.1       ?       ? 
1 1 1   23   13   17 o   1532.9    5.3    0.0000   0.0000          ?        ? 23500.7891 163.4615          ?        ?     1532.9        5.3       ?       ? 
1 1 1   23   13   18 o    536.9    2.6    0.0000   0.0000          ?        ?  2882.9250  27.4564          ?        ?      536.9        2.6       ?       ? 
1 1 1   23   13   19 o    596.1    2.7    0.0000   0.0000          ?        ?  3554.0112  32.5646          ?        ?      596.1        2.7       ?       ? 
1 1 1   23   13   20 o   1224.0    4.5    0.0000   0.0000          ?        ? 14983.5488 109.1872          ?        ?     1224.0        4.5       ?       ? 
1 1 1   23   13   21 o   1300.5    4.6    0.0000   0.0000          ?        ? 16915.7148 118.7650          ?        ?     1300.5        4.6       ?       ? 
1 1 1   23   13   22 o    783.2    3.1    0.0000   0.0000          ?        ?  6134.2773  48.5276          ?        ?      783.2        3.1       ?       ? 
1 1 1   23   13   23 o   1349.1    4.8    0.0000   0.0000          ?        ? 18203.6133 130.2584          ?        ?     1349.1        4.8       ?       ? 
1 1 1   23   13   24 o   1086.9    3.9    0.0000   0.0000          ?        ? 11813.9268  84.9234          ?        ?     1086.9        3.9       ?       ? 
1 1 1   23   13   25 o    630.7    2.7    0.0000   0.0000          ?        ?  3977.9897  33.8416          ?        ?      630.7        2.7       ?       ? 
1 1 1   23   13   26 o    159.4    5.2    0.0000   0.0000          ?        ?   254.1316  16.6016          ?        ?      159.4        5.2       ?       ? 
1 1 1   23   13   27 o    190.4    4.0    0.0000   0.0000          ?        ?   362.6803  15.3245          ?        ?      190.4        4.0       ?       ? 
1 1 1   23   13   28 o    560.2    2.5    0.0000   0.0000          ?        ?  3138.3337  28.0950          ?        ?      560.2        2.5       ?       ? 
1 1 1   23   13   29 o    593.3    2.7    0.0000   0.0000          ?        ?  3520.8083  31.9261          ?        ?      593.3        2.7       ?       ? 
1 1 1   23   13   30 f    723.4    3.0    0.0000   0.0000          ?        ?  5233.9619  42.7809          ?        ?      723.4        3.0       ?       ? 
1 1 1   23   13   31 o    564.3    2.7    0.0000   0.0000          ?        ?  3184.3074  30.6490          ?        ?      564.3        2.7       ?       ? 
1 1 1   23   13   32 o    589.0    2.7    0.0000   0.0000          ?        ?  3469.7266  31.2876          ?        ?      589.0        2.7       ?       ? 
1 1 1   23   13   33 o    364.9    2.7    0.0000   0.0000          ?        ?  1331.9562  19.7942          ?        ?      364.9        2.7       ?       ? 
1 1 1   23   13   34 o    431.7    2.7    0.0000   0.0000          ?        ?  1863.8446  23.6253          ?        ?      431.7        2.7       ?       ? 
1 1 1   23   13   35 o    468.0    2.6    0.0000   0.0000          ?        ?  2190.7678  24.2638          ?        ?      468.0        2.6       ?       ? 
1 1 1   23   13   36 o    496.3    2.5    0.0000   0.0000          ?        ?  2463.4163  24.9023          ?        ?      496.3        2.5       ?       ? 
1 1 1   23   13   37 o    606.9    2.7    0.0000   0.0000          ?        ?  3684.2698  32.5646          ?        ?      606.9        2.7       ?       ? 
1 1 1   23   13   38 o    358.2    2.6    0.0000   0.0000          ?        ?  1283.4285  18.5171          ?        ?      358.2        2.6       ?       ? 
1 1 1   23   13   39 o    406.2    2.7    0.0000   0.0000          ?        ?  1650.5784  21.7097          ?        ?      406.2        2.7       ?       ? 
1 1 1   23   13   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   13   41 o    306.8    2.8    0.0000   0.0000          ?        ?   941.1808  17.2401          ?        ?      306.8        2.8       ?       ? 
1 1 1   23   13   42 o    156.7    5.1    0.0000   0.0000          ?        ?   245.8308  15.9630          ?        ?      156.7        5.1       ?       ? 
1 1 1   23   13   43 o    410.9    2.6    0.0000   0.0000          ?        ?  1688.8896  21.0712          ?        ?      410.9        2.6       ?       ? 
1 1 1   23   13   44 o    212.4    3.9    0.0000   0.0000          ?        ?   451.4348  16.6016          ?        ?      212.4        3.9       ?       ? 
1 1 1   23   13   45 o    280.5    3.2    0.0000   0.0000          ?        ?   787.2972  17.8786          ?        ?      280.5        3.2       ?       ? 
1 1 1   23   13   46 o     22.7   11.1    0.0000   0.0000          ?        ?   -31.2876  16.6016          ?        ?       22.7       11.1       ?       ? 
1 1 1   23   13   47 o     57.4   14.9    0.0000   0.0000          ?        ?    34.4802  17.2401          ?        ?       57.4       14.9       ?       ? 
1 1 1   23   13   48 o    659.2    2.8    0.0000   0.0000          ?        ?  4346.4170  36.3957          ?        ?      659.2        2.8       ?       ? 
1 1 1   23   13   49 o    376.7    2.8    0.0000   0.0000          ?        ?  1419.4336  21.0712          ?        ?      376.7        2.8       ?       ? 
1 1 1   23   13   50 o     46.5   15.7    0.0000   0.0000          ?        ?    20.4327  17.2401          ?        ?       46.5       15.7       ?       ? 
1 1 1   23   13   51 o    174.2    5.1    0.0000   0.0000          ?        ?   303.9363  17.8786          ?        ?      174.2        5.1       ?       ? 
1 1 1   23   13   52 f    162.9    5.1    0.0000   0.0000          ?        ?   265.6250  16.6016          ?        ?      162.9        5.1       ?       ? 
1 1 1   23   13   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   13   54 o    215.4    4.2    0.0000   0.0000          ?        ?   464.2052  17.8786          ?        ?      215.4        4.2       ?       ? 
1 1 1   23   13   55 o    102.7    9.0    0.0000   0.0000          ?        ?   105.9946  18.5171          ?        ?      102.7        9.0       ?       ? 
1 1 1   23   13   56 o    230.8    4.0    0.0000   0.0000          ?        ?   533.1656  18.5171          ?        ?      230.8        4.0       ?       ? 
1 1 1   23   13   57 f    197.2    4.7    0.0000   0.0000          ?        ?   389.4982  18.5171          ?        ?      197.2        4.7       ?       ? 
1 1 1   23   13   58 o    232.7    4.3    0.0000   0.0000          ?        ?   542.1049  19.7942          ?        ?      232.7        4.3       ?       ? 
1 1 1   23   13   59 o    204.7    5.0    0.0000   0.0000          ?        ?   419.5087  20.4327          ?        ?      204.7        5.0       ?       ? 
1 1 1   23   13   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   13   61 f     81.0   12.2    0.0000   0.0000          ?        ?    66.4062  19.7942          ?        ?       81.0       12.2       ?       ? 
1 1 1   23   13   62 o    234.0    4.2    0.0000   0.0000          ?        ?   548.4901  19.7942          ?        ?      234.0        4.2       ?       ? 
1 1 1   23   13   63 o    224.8    4.5    0.0000   0.0000          ?        ?   506.3477  20.4327          ?        ?      224.8        4.5       ?       ? 
1 1 1   23   13   64 o    165.2    6.4    0.0000   0.0000          ?        ?   273.9258  21.0712          ?        ?      165.2        6.4       ?       ? 
1 1 1   23   13   65 o     24.8   12.1    0.0000   0.0000          ?        ?   -36.3957  19.7942          ?        ?       24.8       12.1       ?       ? 
1 1 1   23   13   66 o    215.5    4.9    0.0000   0.0000          ?        ?   465.4823  21.0712          ?        ?      215.5        4.9       ?       ? 
1 1 1   23   13   67 o    111.6    9.2    0.0000   0.0000          ?        ?   125.7888  20.4327          ?        ?      111.6        9.2       ?       ? 
1 1 1   23   13   68 o    401.6    3.0    0.0000   0.0000          ?        ?  1614.8212  24.2638          ?        ?      401.6        3.0       ?       ? 
1 1 1   23   13   69 o    122.4    8.3    0.0000   0.0000          ?        ?   151.3296  20.4327          ?        ?      122.4        8.3       ?       ? 
1 1 1   23   13   70 o     83.2   12.7    0.0000   0.0000          ?        ?    70.8759  21.0712          ?        ?       83.2       12.7       ?       ? 
1 1 1   23   13   71 f     62.4   15.4    0.0000   0.0000          ?        ?    42.1424  19.1556          ?        ?       62.4       15.4       ?       ? 
1 1 1   23   13   72 o    154.7    6.6    0.0000   0.0000          ?        ?   241.3612  20.4327          ?        ?      154.7        6.6       ?       ? 
1 1 1   23   14    0 o   1499.1    7.9 22478.5156 237.5300 22478.5156 237.5300 22478.5156 237.5300     1499.1      7.9     1499.1        7.9     0.0     0.0 
1 1 1   23   14    1 o   2270.8    8.1    0.0000   0.0000          ?        ? 51580.4180 368.4270          ?        ?     2270.8        8.1       ?       ? 
1 1 1   23   14    2 o    733.9    3.2    0.0000   0.0000          ?        ?  5385.9297  47.2506          ?        ?      733.9        3.2       ?       ? 
1 1 1   23   14    3 o   1341.3    5.0    0.0000   0.0000          ?        ? 17991.6230 134.7281          ?        ?     1341.3        5.0       ?       ? 
1 1 1   23   14    4 o    764.1    3.1    0.0000   0.0000          ?        ?  5839.2803  47.2506          ?        ?      764.1        3.1       ?       ? 
1 1 1   23   14    5 o    219.1    2.6    0.0000   0.0000          ?        ?   480.1682  11.4934          ?        ?      219.1        2.6       ?       ? 
1 1 1   23   14    6 o   1927.8    6.8    0.0000   0.0000          ?        ? 37171.5352 260.5168          ?        ?     1927.8        6.8       ?       ? 
1 1 1   23   14    7 o    888.8    3.4    0.0000   0.0000          ?        ?  7899.7891  60.6596          ?        ?      888.8        3.4       ?       ? 
1 1 1   23   14    8 o    574.5    2.6    0.0000   0.0000          ?        ?  3301.1567  29.3720          ?        ?      574.5        2.6       ?       ? 
1 1 1   23   14    9 o   1951.5    6.6    0.0000   0.0000          ?        ? 38092.2852 259.2398          ?        ?     1951.5        6.6       ?       ? 
1 1 1   23   14   10 o    768.7    3.0    0.0000   0.0000          ?        ?  5909.5176  46.6121          ?        ?      768.7        3.0       ?       ? 
1 1 1   23   14   11 o   1174.3    4.2    0.0000   0.0000          ?        ? 13791.4277  98.9709          ?        ?     1174.3        4.2       ?       ? 
1 1 1   23   14   12 o    890.0    3.4    0.0000   0.0000          ?        ?  7922.1377  60.6596          ?        ?      890.0        3.4       ?       ? 
1 1 1   23   14   13 o    715.9    2.8    0.0000   0.0000          ?        ?  5125.4131  40.2269          ?        ?      715.9        2.8       ?       ? 
1 1 1   23   14   14 o    870.9    3.3    0.0000   0.0000          ?        ?  7584.3604  56.8284          ?        ?      870.9        3.3       ?       ? 
1 1 1   23   14   15 o    472.1    2.8    0.0000   0.0000          ?        ?  2228.4404  26.1794          ?        ?      472.1        2.8       ?       ? 
1 1 1   23   14   16 o    815.7    3.2    0.0000   0.0000          ?        ?  6654.0337  51.7203          ?        ?      815.7        3.2       ?       ? 
1 1 1   23   14   17 o    357.1    2.6    0.0000   0.0000          ?        ?  1275.1277  18.5171          ?        ?      357.1        2.6       ?       ? 
1 1 1   23   14   18 o    893.6    3.8    0.0000   0.0000          ?        ?  7986.6289  67.0448          ?        ?      893.6        3.8       ?       ? 
1 1 1   23   14   19 o    706.5    2.9    0.0000   0.0000          ?        ?  4991.3237  41.5039          ?        ?      706.5        2.9       ?       ? 
1 1 1   23   14   20 f    110.7    6.1    0.0000   0.0000          ?        ?   122.5962  13.4090          ?        ?      110.7        6.1       ?       ? 
1 1 1   23   14   21 o    501.8    2.7    0.0000   0.0000          ?        ?  2517.6907  27.4564          ?        ?      501.8        2.7       ?       ? 
1 1 1   23   14   22 o    389.6    2.4    0.0000   0.0000          ?        ?  1517.7659  18.5171          ?        ?      389.6        2.4       ?       ? 
1 1 1   23   14   23 o    733.4    3.2    0.0000   0.0000          ?        ?  5378.9062  46.6121          ?        ?      733.4        3.2       ?       ? 
1 1 1   23   14   24 o    665.6    2.7    0.0000   0.0000          ?        ?  4430.0630  36.3957          ?        ?      665.6        2.7       ?       ? 
1 1 1   23   14   25 o    346.1    2.6    0.0000   0.0000          ?        ?  1197.8666  17.8786          ?        ?      346.1        2.6       ?       ? 
1 1 1   23   14   26 f    475.5    2.6    0.0000   0.0000          ?        ?  2261.0051  24.2638          ?        ?      475.5        2.6       ?       ? 
1 1 1   23   14   27 o    391.0    2.4    0.0000   0.0000          ?        ?  1528.6207  19.1556          ?        ?      391.0        2.4       ?       ? 
1 1 1   23   14   28 o    594.0    2.6    0.0000   0.0000          ?        ?  3529.1091  31.2876          ?        ?      594.0        2.6       ?       ? 
1 1 1   23   14   29 o    620.0    2.7    0.0000   0.0000          ?        ?  3844.5386  33.2031          ?        ?      620.0        2.7       ?       ? 
1 1 1   23   14   30 o    268.2    3.2    0.0000   0.0000          ?        ?   719.6138  17.2401          ?        ?      268.2        3.2       ?       ? 
1 1 1   23   14   31 o    167.6    4.6    0.0000   0.0000          ?        ?   280.9495  15.3245          ?        ?      167.6        4.6       ?       ? 
1 1 1   23   14   32 o    538.5    2.7    0.0000   0.0000          ?        ?  2899.5269  29.3720          ?        ?      538.5        2.7       ?       ? 
1 1 1   23   14   33 o   1218.4    4.3    0.0000   0.0000          ?        ? 14848.8203 104.0790          ?        ?     1218.4        4.3       ?       ? 
1 1 1   23   14   34 o    645.4    2.9    0.0000   0.0000          ?        ?  4165.7153  37.6728          ?        ?      645.4        2.9       ?       ? 
1 1 1   23   14   35 o    516.3    2.9    0.0000   0.0000          ?        ?  2666.4663  30.0105          ?        ?      516.3        2.9       ?       ? 
1 1 1   23   14   36 o    402.3    2.7    0.0000   0.0000          ?        ?  1618.6523  21.7097          ?        ?      402.3        2.7       ?       ? 
1 1 1   23   14   37 o    387.9    2.7    0.0000   0.0000          ?        ?  1504.9955  21.0712          ?        ?      387.9        2.7       ?       ? 
1 1 1   23   14   38 o    163.5    4.7    0.0000   0.0000          ?        ?   267.5406  15.3245          ?        ?      163.5        4.7       ?       ? 
1 1 1   23   14   39 o    116.6    6.6    0.0000   0.0000          ?        ?   136.0051  15.3245          ?        ?      116.6        6.6       ?       ? 
1 1 1   23   14   40 o    392.2    2.7    0.0000   0.0000          ?        ?  1538.1986  21.0712          ?        ?      392.2        2.7       ?       ? 
1 1 1   23   14   41 o    450.6    2.6    0.0000   0.0000          ?        ?  2031.1373  22.9868          ?        ?      450.6        2.6       ?       ? 
1 1 1   23   14   42 o    218.5    3.8    0.0000   0.0000          ?        ?   477.6142  16.6016          ?        ?      218.5        3.8       ?       ? 
1 1 1   23   14   43 o    198.6    4.0    0.0000   0.0000          ?        ?   394.6064  15.9630          ?        ?      198.6        4.0       ?       ? 
1 1 1   23   14   44 o    515.4    2.6    0.0000   0.0000          ?        ?  2656.8884  26.8179          ?        ?      515.4        2.6       ?       ? 
1 1 1   23   14   45 o     61.5   13.8    0.0000   0.0000          ?        ?    39.5883  16.6016          ?        ?       61.5       13.8       ?       ? 
1 1 1   23   14   46 o    439.0    2.6    0.0000   0.0000          ?        ?  1927.6968  22.9868          ?        ?      439.0        2.6       ?       ? 
1 1 1   23   14   47 o    345.5    2.9    0.0000   0.0000          ?        ?  1194.0354  19.7942          ?        ?      345.5        2.9       ?       ? 
1 1 1   23   14   48 o    445.5    2.8    0.0000   0.0000          ?        ?  1985.1637  24.9023          ?        ?      445.5        2.8       ?       ? 
1 1 1   23   14   49 o    367.3    2.8    0.0000   0.0000          ?        ?  1349.1962  20.4327          ?        ?      367.3        2.8       ?       ? 
1 1 1   23   14   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   14   51 o    160.3    5.6    0.0000   0.0000          ?        ?   257.3242  17.8786          ?        ?      160.3        5.6       ?       ? 
1 1 1   23   14   52 o     19.3    9.7    0.0000   0.0000          ?        ?   -49.8047  16.6016          ?        ?       19.3        9.7       ?       ? 
1 1 1   23   14   53 o    295.7    3.2    0.0000   0.0000          ?        ?   874.7747  19.1556          ?        ?      295.7        3.2       ?       ? 
1 1 1   23   14   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   14   55 o    214.6    4.3    0.0000   0.0000          ?        ?   461.0126  18.5171          ?        ?      214.6        4.3       ?       ? 
1 1 1   23   14   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   14   57 f    147.8    6.3    0.0000   0.0000          ?        ?   219.0129  18.5171          ?        ?      147.8        6.3       ?       ? 
1 1 1   23   14   58 o    436.0    2.9    0.0000   0.0000          ?        ?  1901.5173  24.9023          ?        ?      436.0        2.9       ?       ? 
1 1 1   23   14   59 o     23.1   11.4    0.0000   0.0000          ?        ?   -45.9736  19.7942          ?        ?       23.1       11.4       ?       ? 
1 1 1   23   14   60 o    263.7    3.8    0.0000   0.0000          ?        ?   695.9886  19.7942          ?        ?      263.7        3.8       ?       ? 
1 1 1   23   14   61 o    381.2    3.1    0.0000   0.0000          ?        ?  1453.9137  23.6253          ?        ?      381.2        3.1       ?       ? 
1 1 1   23   14   62 o     68.7   14.8    0.0000   0.0000          ?        ?    49.8047  19.7942          ?        ?       68.7       14.8       ?       ? 
1 1 1   23   14   63 o    302.3    3.6    0.0000   0.0000          ?        ?   915.0015  21.7097          ?        ?      302.3        3.6       ?       ? 
1 1 1   23   14   64 o    329.5    3.5    0.0000   0.0000          ?        ?  1086.7638  22.9868          ?        ?      329.5        3.5       ?       ? 
1 1 1   23   14   65 o    115.9    8.8    0.0000   0.0000          ?        ?   135.3666  20.4327          ?        ?      115.9        8.8       ?       ? 
1 1 1   23   14   66 o    190.0    5.4    0.0000   0.0000          ?        ?   362.0418  20.4327          ?        ?      190.0        5.4       ?       ? 
1 1 1   23   14   67 f    116.6    9.0    0.0000   0.0000          ?        ?   137.2822  21.0712          ?        ?      116.6        9.0       ?       ? 
1 1 1   23   14   68 o    130.0    7.9    0.0000   0.0000          ?        ?   170.4853  20.4327          ?        ?      130.0        7.9       ?       ? 
1 1 1   23   14   69 o     30.0   14.0    0.0000   0.0000          ?        ?   -17.8786  20.4327          ?        ?       30.0       14.0       ?       ? 
1 1 1   23   14   70 o     64.6   16.7    0.0000   0.0000          ?        ?    45.3350  21.7097          ?        ?       64.6       16.7       ?       ? 
1 1 1   23   14   71 o    193.5    5.1    0.0000   0.0000          ?        ?   376.0892  19.7942          ?        ?      193.5        5.1       ?       ? 
1 1 1   23   14   72 o     20.6   10.4    0.0000   0.0000          ?        ?   -61.2981  19.7942          ?        ?       20.6       10.4       ?       ? 
1 1 1   23   15    0 o    723.7    4.9 5239.0698  70.2374  5239.0698  70.2374  5239.0698  70.2374      723.7      4.9      723.7        4.9     0.0     0.0 
1 1 1   23   15    1 o    691.8    3.3    0.0000   0.0000          ?        ?  4786.3579  45.3350          ?        ?      691.8        3.3       ?       ? 
1 1 1   23   15    2 o    185.7    3.8    0.0000   0.0000          ?        ?   344.8017  14.0475          ?        ?      185.7        3.8       ?       ? 
1 1 1   23   15    3 o    591.1    2.8    0.0000   0.0000          ?        ?  3493.9905  33.2031          ?        ?      591.1        2.8       ?       ? 
1 1 1   23   15    4 o   1102.0    4.2    0.0000   0.0000          ?        ? 12144.0430  92.5856          ?        ?     1102.0        4.2       ?       ? 
1 1 1   23   15    5 o   1824.8    6.7    0.0000   0.0000          ?        ? 33305.2891 245.8308          ?        ?     1824.8        6.7       ?       ? 
1 1 1   23   15    6 o   1025.1    3.8    0.0000   0.0000          ?        ? 10508.1504  77.8996          ?        ?     1025.1        3.8       ?       ? 
1 1 1   23   15    7 o   1377.0    5.1    0.0000   0.0000          ?        ? 18962.8164 139.8362          ?        ?     1377.0        5.1       ?       ? 
1 1 1   23   15    8 o    894.2    3.5    0.0000   0.0000          ?        ?  7996.2065  63.2136          ?        ?      894.2        3.5       ?       ? 
1 1 1   23   15    9 o    863.3    3.4    0.0000   0.0000          ?        ?  7454.1016  58.7440          ?        ?      863.3        3.4       ?       ? 
1 1 1   23   15   10 o    125.6    5.8    0.0000   0.0000          ?        ?   157.7148  14.6860          ?        ?      125.6        5.8       ?       ? 
1 1 1   23   15   11 o    584.6    2.8    0.0000   0.0000          ?        ?  3418.0061  33.2031          ?        ?      584.6        2.8       ?       ? 
1 1 1   23   15   12 o   1003.6    3.8    0.0000   0.0000          ?        ? 10072.6787  77.2611          ?        ?     1003.6        3.8       ?       ? 
1 1 1   23   15   13 o    450.7    2.3    0.0000   0.0000          ?        ?  2031.1373  20.4327          ?        ?      450.7        2.3       ?       ? 
1 1 1   23   15   14 o    872.2    3.5    0.0000   0.0000          ?        ?  7608.6235  61.2981          ?        ?      872.2        3.5       ?       ? 
1 1 1   23   15   15 o     61.9    8.8    0.0000   0.0000          ?        ?    38.3113  10.8549          ?        ?       61.9        8.8       ?       ? 
1 1 1   23   15   16 o    839.6    3.2    0.0000   0.0000          ?        ?  7049.2788  54.2743          ?        ?      839.6        3.2       ?       ? 
1 1 1   23   15   17 o   1673.5    6.0    0.0000   0.0000          ?        ? 28011.3047 199.2188          ?        ?     1673.5        6.0       ?       ? 
1 1 1   23   15   18 o   1411.0    5.0    0.0000   0.0000          ?        ? 19911.0195 141.1133          ?        ?     1411.0        5.0       ?       ? 
1 1 1   23   15   19 o    266.3    3.7    0.0000   0.0000          ?        ?   709.3975  19.7942          ?        ?      266.3        3.7       ?       ? 
1 1 1   23   15   20 o    566.2    2.5    0.0000   0.0000          ?        ?  3206.0171  28.0950          ?        ?      566.2        2.5       ?       ? 
1 1 1   23   15   21 o    984.0    3.6    0.0000   0.0000          ?        ?  9683.1807  70.2374          ?        ?      984.0        3.6       ?       ? 
1 1 1   23   15   22 o    562.5    2.6    0.0000   0.0000          ?        ?  3163.8748  28.7335          ?        ?      562.5        2.6       ?       ? 
1 1 1   23   15   23 o    504.5    2.5    0.0000   0.0000          ?        ?  2545.7859  24.9023          ?        ?      504.5        2.5       ?       ? 
1 1 1   23   15   24 o    746.2    3.0    0.0000   0.0000          ?        ?  5568.5469  44.0580          ?        ?      746.2        3.0       ?       ? 
1 1 1   23   15   25 o    246.8    3.2    0.0000   0.0000          ?        ?   609.1497  15.9630          ?        ?      246.8        3.2       ?       ? 
1 1 1   23   15   26 o    236.0    3.1    0.0000   0.0000          ?        ?   556.7908  14.6860          ?        ?      236.0        3.1       ?       ? 
1 1 1   23   15   27 o    742.7    2.9    0.0000   0.0000          ?        ?  5516.1885  43.4195          ?        ?      742.7        2.9       ?       ? 
1 1 1   23   15   28 o    501.2    2.4    0.0000   0.0000          ?        ?  2511.9441  24.2638          ?        ?      501.2        2.4       ?       ? 
1 1 1   23   15   29 o    443.8    2.6    0.0000   0.0000          ?        ?  1969.8392  22.9868          ?        ?      443.8        2.6       ?       ? 
1 1 1   23   15   30 o    606.7    2.8    0.0000   0.0000          ?        ?  3681.0771  33.8416          ?        ?      606.7        2.8       ?       ? 
1 1 1   23   15   31 o    169.9    5.3    0.0000   0.0000          ?        ?   288.6118  17.8786          ?        ?      169.9        5.3       ?       ? 
1 1 1   23   15   32 o   1047.9    3.7    0.0000   0.0000          ?        ? 10983.2100  78.5382          ?        ?     1047.9        3.7       ?       ? 
1 1 1   23   15   33 o    219.7    4.4    0.0000   0.0000          ?        ?   482.7224  19.1556          ?        ?      219.7        4.4       ?       ? 
1 1 1   23   15   34 o    853.2    3.2    0.0000   0.0000          ?        ?  7281.0625  54.2743          ?        ?      853.2        3.2       ?       ? 
1 1 1   23   15   35 o    262.8    3.0    0.0000   0.0000          ?        ?   690.8804  15.9630          ?        ?      262.8        3.0       ?       ? 
1 1 1   23   15   36 o    314.9    2.7    0.0000   0.0000          ?        ?   991.6241  17.2401          ?        ?      314.9        2.7       ?       ? 
1 1 1   23   15   37 o    311.1    2.7    0.0000   0.0000          ?        ?   967.9988  16.6016          ?        ?      311.1        2.7       ?       ? 
1 1 1   23   15   38 o    438.8    2.6    0.0000   0.0000          ?        ?  1925.7812  22.9868          ?        ?      438.8        2.6       ?       ? 
1 1 1   23   15   39 o     26.2   12.2    0.0000   0.0000          ?        ?   -15.9630  15.9630          ?        ?       26.2       12.2       ?       ? 
1 1 1   23   15   40 f    457.8    2.6    0.0000   0.0000          ?        ?  2096.2664  23.6253          ?        ?      457.8        2.6       ?       ? 
1 1 1   23   15   41 o    534.7    2.6    0.0000   0.0000          ?        ?  2859.2998  28.0950          ?        ?      534.7        2.6       ?       ? 
1 1 1   23   15   42 o    170.0    4.9    0.0000   0.0000          ?        ?   289.2503  16.6016          ?        ?      170.0        4.9       ?       ? 
1 1 1   23   15   43 o    307.6    2.9    0.0000   0.0000          ?        ?   946.2890  17.8786          ?        ?      307.6        2.9       ?       ? 
1 1 1   23   15   44 o    240.3    3.6    0.0000   0.0000          ?        ?   577.8621  17.2401          ?        ?      240.3        3.6       ?       ? 
1 1 1   23   15   45 o    183.6    4.3    0.0000   0.0000          ?        ?   337.1394  15.9630          ?        ?      183.6        4.3       ?       ? 
1 1 1   23   15   46 f     43.9   15.3    0.0000   0.0000          ?        ?    17.2401  16.6016          ?        ?       43.9       15.3       ?       ? 
1 1 1   23   15   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   15   48 o    689.4    2.9    0.0000   0.0000          ?        ?  4754.4316  39.5883          ?        ?      689.4        2.9       ?       ? 
1 1 1   23   15   49 o    179.3    5.2    0.0000   0.0000          ?        ?   321.8149  18.5171          ?        ?      179.3        5.2       ?       ? 
1 1 1   23   15   50 o    136.7    6.1    0.0000   0.0000          ?        ?   187.0868  16.6016          ?        ?      136.7        6.1       ?       ? 
1 1 1   23   15   51 o    390.5    2.8    0.0000   0.0000          ?        ?  1525.4281  21.7097          ?        ?      390.5        2.8       ?       ? 
1 1 1   23   15   52 f     22.4   11.0    0.0000   0.0000          ?        ?   -39.5883  17.8786          ?        ?       22.4       11.0       ?       ? 
1 1 1   23   15   53 o    384.6    2.7    0.0000   0.0000          ?        ?  1479.4546  21.0712          ?        ?      384.6        2.7       ?       ? 
1 1 1   23   15   54 o    241.3    3.8    0.0000   0.0000          ?        ?   582.9703  18.5171          ?        ?      241.3        3.8       ?       ? 
1 1 1   23   15   55 o    344.8    3.0    0.0000   0.0000          ?        ?  1189.5658  20.4327          ?        ?      344.8        3.0       ?       ? 
1 1 1   23   15   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   15   57 o    150.4    6.4    0.0000   0.0000          ?        ?   226.6752  19.1556          ?        ?      150.4        6.4       ?       ? 
1 1 1   23   15   58 o    439.7    2.8    0.0000   0.0000          ?        ?  1934.0819  24.9023          ?        ?      439.7        2.8       ?       ? 
1 1 1   23   15   59 o    458.4    2.8    0.0000   0.0000          ?        ?  2102.0132  25.5409          ?        ?      458.4        2.8       ?       ? 
1 1 1   23   15   60 f     95.2   10.1    0.0000   0.0000          ?        ?    91.3086  19.1556          ?        ?       95.2       10.1       ?       ? 
1 1 1   23   15   61 o     34.2   14.9    0.0000   0.0000          ?        ?    -3.1926  19.1556          ?        ?       34.2       14.9       ?       ? 
1 1 1   23   15   62 o    235.4    4.5    0.0000   0.0000          ?        ?   554.8753  21.0712          ?        ?      235.4        4.5       ?       ? 
1 1 1   23   15   63 o     86.6   11.8    0.0000   0.0000          ?        ?    75.9841  20.4327          ?        ?       86.6       11.8       ?       ? 
1 1 1   23   15   64 o     82.4   12.4    0.0000   0.0000          ?        ?    68.9603  20.4327          ?        ?       82.4       12.4       ?       ? 
1 1 1   23   15   65 o     88.3   11.6    0.0000   0.0000          ?        ?    79.1767  20.4327          ?        ?       88.3       11.6       ?       ? 
1 1 1   23   15   66 o    144.7    7.5    0.0000   0.0000          ?        ?   210.7121  21.7097          ?        ?      144.7        7.5       ?       ? 
1 1 1   23   15   67 o    125.0    8.7    0.0000   0.0000          ?        ?   157.7148  21.7097          ?        ?      125.0        8.7       ?       ? 
1 1 1   23   15   68 o     41.4   16.8    0.0000   0.0000          ?        ?     8.3008  21.7097          ?        ?       41.4       16.8       ?       ? 
1 1 1   23   15   69 o     56.5   17.1    0.0000   0.0000          ?        ?    33.8416  21.0712          ?        ?       56.5       17.1       ?       ? 
1 1 1   23   15   70 o    123.3    8.5    0.0000   0.0000          ?        ?   153.8837  21.0712          ?        ?      123.3        8.5       ?       ? 
1 1 1   23   15   71 o     68.5   16.1    0.0000   0.0000          ?        ?    51.0817  21.7097          ?        ?       68.5       16.1       ?       ? 
1 1 1   23   16    0 o    133.8    5.5  180.0631  14.6860   180.0631  14.6860   180.0631  14.6860      133.8      5.5      133.8        5.5     0.0     0.0 
1 1 1   23   16    1 o    491.8    2.9    0.0000   0.0000          ?        ?  2418.7197  28.7335          ?        ?      491.8        2.9       ?       ? 
1 1 1   23   16    2 o   1702.7    6.5    0.0000   0.0000          ?        ? 28996.5449 222.2055          ?        ?     1702.7        6.5       ?       ? 
1 1 1   23   16    3 o    177.8    3.4    0.0000   0.0000          ?        ?   316.0682  12.1319          ?        ?      177.8        3.4       ?       ? 
1 1 1   23   16    4 o    577.0    3.0    0.0000   0.0000          ?        ?  3329.2520  34.4802          ?        ?      577.0        3.0       ?       ? 
1 1 1   23   16    5 o   1375.8    5.5    0.0000   0.0000          ?        ? 18929.6133 150.6911          ?        ?     1375.8        5.5       ?       ? 
1 1 1   23   16    6 f    493.7    2.5    0.0000   0.0000          ?        ?  2437.8755  24.9023          ?        ?      493.7        2.5       ?       ? 
1 1 1   23   16    7 o    936.7    3.9    0.0000   0.0000          ?        ?  8774.5635  73.4300          ?        ?      936.7        3.9       ?       ? 
1 1 1   23   16    8 o    834.5    3.2    0.0000   0.0000          ?        ?  6964.9941  53.6358          ?        ?      834.5        3.2       ?       ? 
1 1 1   23   16    9 o   1067.1    3.9    0.0000   0.0000          ?        ? 11387.3945  82.3693          ?        ?     1067.1        3.9       ?       ? 
1 1 1   23   16   10 o    723.1    3.0    0.0000   0.0000          ?        ?  5229.4922  43.4195          ?        ?      723.1        3.0       ?       ? 
1 1 1   23   16   11 o    975.7    3.7    0.0000   0.0000          ?        ?  9519.7188  71.5144          ?        ?      975.7        3.7       ?       ? 
1 1 1   23   16   12 o    561.5    2.6    0.0000   0.0000          ?        ?  3153.0198  28.7335          ?        ?      561.5        2.6       ?       ? 
1 1 1   23   16   13 o    240.9    2.5    0.0000   0.0000          ?        ?   580.4161  12.1319          ?        ?      240.9        2.5       ?       ? 
1 1 1   23   16   14 o    420.2    2.2    0.0000   0.0000          ?        ?  1765.5123  18.5171          ?        ?      420.2        2.2       ?       ? 
1 1 1   23   16   15 o   1518.2    5.3    0.0000   0.0000          ?        ? 23053.8242 162.1845          ?        ?     1518.2        5.3       ?       ? 
1 1 1   23   16   16 o    837.9    3.2    0.0000   0.0000          ?        ?  7020.5454  53.6358          ?        ?      837.9        3.2       ?       ? 
1 1 1   23   16   17 o    489.7    2.5    0.0000   0.0000          ?        ?  2398.2874  24.2638          ?        ?      489.7        2.5       ?       ? 
1 1 1   23   16   18 f   1306.2    4.5    0.0000   0.0000          ?        ? 17062.5742 118.1265          ?        ?     1306.2        4.5       ?       ? 
1 1 1   23   16   19 o    729.0    3.0    0.0000   0.0000          ?        ?  5314.4155  43.4195          ?        ?      729.0        3.0       ?       ? 
1 1 1   23   16   20 o    970.7    3.6    0.0000   0.0000          ?        ?  9423.3027  69.5989          ?        ?      970.7        3.6       ?       ? 
1 1 1   23   16   21 o   1515.8    5.1    0.0000   0.0000          ?        ? 22981.6699 155.1608          ?        ?     1515.8        5.1       ?       ? 
1 1 1   23   16   22 o   1684.5    5.7    0.0000   0.0000          ?        ? 28382.9258 192.8335          ?        ?     1684.5        5.7       ?       ? 
1 1 1   23   16   23 o   1095.3    3.9    0.0000   0.0000          ?        ? 11998.4600  84.9234          ?        ?     1095.3        3.9       ?       ? 
1 1 1   23   16   24 o    699.6    2.8    0.0000   0.0000          ?        ?  4894.2681  39.5883          ?        ?      699.6        2.8       ?       ? 
1 1 1   23   16   25 o    272.5    2.8    0.0000   0.0000          ?        ?   742.6006  15.3245          ?        ?      272.5        2.8       ?       ? 
1 1 1   23   16   26 o    452.7    2.5    0.0000   0.0000          ?        ?  2049.6545  22.3483          ?        ?      452.7        2.5       ?       ? 
1 1 1   23   16   27 o     16.9    8.5    0.0000   0.0000          ?        ?   -43.4195  13.4090          ?        ?       16.9        8.5       ?       ? 
1 1 1   23   16   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   16   29 o    324.7    2.7    0.0000   0.0000          ?        ?  1054.1992  17.2401          ?        ?      324.7        2.7       ?       ? 
1 1 1   23   16   30 o    521.9    2.5    0.0000   0.0000          ?        ?  2723.9333  26.1794          ?        ?      521.9        2.5       ?       ? 
1 1 1   23   16   31 o    385.9    2.6    0.0000   0.0000          ?        ?  1489.0325  19.7942          ?        ?      385.9        2.6       ?       ? 
1 1 1   23   16   32 o    623.0    2.7    0.0000   0.0000          ?        ?  3882.2114  33.8416          ?        ?      623.0        2.7       ?       ? 
1 1 1   23   16   33 f    664.4    2.9    0.0000   0.0000          ?        ?  4415.3770  38.3113          ?        ?      664.4        2.9       ?       ? 
1 1 1   23   16   34 o    483.4    2.4    0.0000   0.0000          ?        ?  2336.9893  23.6253          ?        ?      483.4        2.4       ?       ? 
1 1 1   23   16   35 o    360.5    2.7    0.0000   0.0000          ?        ?  1300.0300  19.1556          ?        ?      360.5        2.7       ?       ? 
1 1 1   23   16   36 o    545.1    2.6    0.0000   0.0000          ?        ?  2971.6797  28.0950          ?        ?      545.1        2.6       ?       ? 
1 1 1   23   16   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   16   38 o    428.0    2.6    0.0000   0.0000          ?        ?  1831.9185  22.3483          ?        ?      428.0        2.6       ?       ? 
1 1 1   23   16   39 o     77.0    9.5    0.0000   0.0000          ?        ?    59.3825  14.6860          ?        ?       77.0        9.5       ?       ? 
1 1 1   23   16   40 o    279.5    3.1    0.0000   0.0000          ?        ?   781.5505  17.2401          ?        ?      279.5        3.1       ?       ? 
1 1 1   23   16   41 o    207.7    3.7    0.0000   0.0000          ?        ?   431.6406  15.3245          ?        ?      207.7        3.7       ?       ? 
1 1 1   23   16   42 o     93.1    8.6    0.0000   0.0000          ?        ?    86.8389  15.9630          ?        ?       93.1        8.6       ?       ? 
1 1 1   23   16   43 o    179.7    5.0    0.0000   0.0000          ?        ?   323.0919  17.8786          ?        ?      179.7        5.0       ?       ? 
1 1 1   23   16   44 o    457.7    2.6    0.0000   0.0000          ?        ?  2095.6282  23.6253          ?        ?      457.7        2.6       ?       ? 
1 1 1   23   16   45 o    486.9    2.6    0.0000   0.0000          ?        ?  2371.4692  25.5409          ?        ?      486.9        2.6       ?       ? 
1 1 1   23   16   46 o     27.6   12.8    0.0000   0.0000          ?        ?   -15.9630  17.2401          ?        ?       27.6       12.8       ?       ? 
1 1 1   23   16   47 o    327.5    3.0    0.0000   0.0000          ?        ?  1072.7163  19.7942          ?        ?      327.5        3.0       ?       ? 
1 1 1   23   16   48 o    474.8    2.6    0.0000   0.0000          ?        ?  2254.6199  24.9023          ?        ?      474.8        2.6       ?       ? 
1 1 1   23   16   49 o    373.2    2.7    0.0000   0.0000          ?        ?  1393.2542  20.4327          ?        ?      373.2        2.7       ?       ? 
1 1 1   23   16   50 o    270.9    3.3    0.0000   0.0000          ?        ?   734.2999  17.8786          ?        ?      270.9        3.3       ?       ? 
1 1 1   23   16   51 o    174.6    4.8    0.0000   0.0000          ?        ?   305.2133  16.6016          ?        ?      174.6        4.8       ?       ? 
1 1 1   23   16   52 o    103.7    8.6    0.0000   0.0000          ?        ?   107.9102  17.8786          ?        ?      103.7        8.6       ?       ? 
1 1 1   23   16   53 o    293.7    3.3    0.0000   0.0000          ?        ?   863.2812  19.1556          ?        ?      293.7        3.3       ?       ? 
1 1 1   23   16   54 o    251.7    3.9    0.0000   0.0000          ?        ?   634.0520  19.7942          ?        ?      251.7        3.9       ?       ? 
1 1 1   23   16   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   16   56 f    327.7    3.1    0.0000   0.0000          ?        ?  1074.6320  20.4327          ?        ?      327.7        3.1       ?       ? 
1 1 1   23   16   57 o    584.4    2.8    0.0000   0.0000          ?        ?  3416.7290  32.5646          ?        ?      584.4        2.8       ?       ? 
1 1 1   23   16   58 o    196.7    5.2    0.0000   0.0000          ?        ?   387.5826  20.4327          ?        ?      196.7        5.2       ?       ? 
1 1 1   23   16   59 o    248.9    4.0    0.0000   0.0000          ?        ?   620.0045  19.7942          ?        ?      248.9        4.0       ?       ? 
1 1 1   23   16   60 o     35.6   15.2    0.0000   0.0000          ?        ?     0.0000  19.1556          ?        ?       35.6       15.2       ?       ? 
1 1 1   23   16   61 o    152.2    6.5    0.0000   0.0000          ?        ?   232.4219  19.7942          ?        ?      152.2        6.5       ?       ? 
1 1 1   23   16   62 o    331.6    3.5    0.0000   0.0000          ?        ?  1100.8113  22.9868          ?        ?      331.6        3.5       ?       ? 
1 1 1   23   16   63 f    169.2    6.0    0.0000   0.0000          ?        ?   287.3347  20.4327          ?        ?      169.2        6.0       ?       ? 
1 1 1   23   16   64 o    220.9    4.8    0.0000   0.0000          ?        ?   489.1075  21.0712          ?        ?      220.9        4.8       ?       ? 
1 1 1   23   16   65 o    138.2    7.6    0.0000   0.0000          ?        ?   192.1950  21.0712          ?        ?      138.2        7.6       ?       ? 
1 1 1   23   16   66 o     84.9   12.4    0.0000   0.0000          ?        ?    73.4300  21.0712          ?        ?       84.9       12.4       ?       ? 
1 1 1   23   16   67 o    120.1    8.5    0.0000   0.0000          ?        ?   145.5829  20.4327          ?        ?      120.1        8.5       ?       ? 
1 1 1   23   16   68 o     24.6   12.1    0.0000   0.0000          ?        ?   -43.4195  21.0712          ?        ?       24.6       12.1       ?       ? 
1 1 1   23   16   69 o     75.1   14.1    0.0000   0.0000          ?        ?    60.0210  20.4327          ?        ?       75.1       14.1       ?       ? 
1 1 1   23   16   70 o     29.2   13.8    0.0000   0.0000          ?        ?   -22.3483  21.0712          ?        ?       29.2       13.8       ?       ? 
1 1 1   23   16   71 o     30.0   14.0    0.0000   0.0000          ?        ?   -17.2401  20.4327          ?        ?       30.0       14.0       ?       ? 
1 1 1   23   17    0 o    542.9    4.0 2948.0544  43.4195  2948.0544  43.4195  2948.0544  43.4195      542.9      4.0      542.9        4.0     0.0     0.0 
1 1 1   23   17    1 o    342.0    2.6    0.0000   0.0000          ?        ?  1169.7716  17.8786          ?        ?      342.0        2.6       ?       ? 
1 1 1   23   17    2 f    280.7    2.6    0.0000   0.0000          ?        ?   787.9357  14.6860          ?        ?      280.7        2.6       ?       ? 
1 1 1   23   17    3 o   1621.2    6.3    0.0000   0.0000          ?        ? 26286.6562 203.0499          ?        ?     1621.2        6.3       ?       ? 
1 1 1   23   17    4 o    584.7    3.2    0.0000   0.0000          ?        ?  3419.2832  37.0343          ?        ?      584.7        3.2       ?       ? 
1 1 1   23   17    5 o    356.3    2.7    0.0000   0.0000          ?        ?  1269.3810  19.1556          ?        ?      356.3        2.7       ?       ? 
1 1 1   23   17    6 o    215.7    2.5    0.0000   0.0000          ?        ?   465.4823  10.8549          ?        ?      215.7        2.5       ?       ? 
1 1 1   23   17    7 o   1569.1    5.8    0.0000   0.0000          ?        ? 24625.2266 183.2557          ?        ?     1569.1        5.8       ?       ? 
1 1 1   23   17    8 o    590.5    3.1    0.0000   0.0000          ?        ?  3486.9666  36.3957          ?        ?      590.5        3.1       ?       ? 
1 1 1   23   17    9 o     73.7    4.8    0.0000   0.0000          ?        ?    54.2743   7.0237          ?        ?       73.7        4.8       ?       ? 
1 1 1   23   17   10 o   1271.3    4.6    0.0000   0.0000          ?        ? 16163.5361 116.8494          ?        ?     1271.3        4.6       ?       ? 
1 1 1   23   17   11 o    214.0    2.5    0.0000   0.0000          ?        ?   457.8200  10.8549          ?        ?      214.0        2.5       ?       ? 
1 1 1   23   17   12 o    488.0    2.4    0.0000   0.0000          ?        ?  2381.0471  23.6253          ?        ?      488.0        2.4       ?       ? 
1 1 1   23   17   13 o    643.1    2.5    0.0000   0.0000          ?        ?  4135.7046  32.5646          ?        ?      643.1        2.5       ?       ? 
1 1 1   23   17   14 o    267.7    2.6    0.0000   0.0000          ?        ?   716.4213  14.0475          ?        ?      267.7        2.6       ?       ? 
1 1 1   23   17   15 o   1356.8    4.8    0.0000   0.0000          ?        ? 18412.4102 130.8969          ?        ?     1356.8        4.8       ?       ? 
1 1 1   23   17   16 o    673.8    2.8    0.0000   0.0000          ?        ?  4539.8887  37.6728          ?        ?      673.8        2.8       ?       ? 
1 1 1   23   17   17 o   1061.6    3.8    0.0000   0.0000          ?        ? 11270.5449  81.0922          ?        ?     1061.6        3.8       ?       ? 
1 1 1   23   17   18 o    714.8    2.9    0.0000   0.0000          ?        ?  5110.0884  41.5039          ?        ?      714.8        2.9       ?       ? 
1 1 1   23   17   19 o   1474.8    5.1    0.0000   0.0000          ?        ? 21753.1543 150.6911          ?        ?     1474.8        5.1       ?       ? 
1 1 1   23   17   20 o    426.4    2.5    0.0000   0.0000          ?        ?  1818.5095  21.7097          ?        ?      426.4        2.5       ?       ? 
1 1 1   23   17   21 o    863.0    3.3    0.0000   0.0000          ?        ?  7448.3550  57.4669          ?        ?      863.0        3.3       ?       ? 
1 1 1   23   17   22 o    405.6    3.1    0.0000   0.0000          ?        ?  1645.4703  25.5409          ?        ?      405.6        3.1       ?       ? 
1 1 1   23   17   23 f    160.4    6.2    0.0000   0.0000          ?        ?   257.3242  19.7942          ?        ?      160.4        6.2       ?       ? 
1 1 1   23   17   24 o    768.9    2.9    0.0000   0.0000          ?        ?  5912.0718  45.3350          ?        ?      768.9        2.9       ?       ? 
1 1 1   23   17   25 o    759.3    3.0    0.0000   0.0000          ?        ?  5766.4888  45.3350          ?        ?      759.3        3.0       ?       ? 
1 1 1   23   17   26 o   1220.7    4.2    0.0000   0.0000          ?        ? 14903.7344 103.4405          ?        ?     1220.7        4.2       ?       ? 
1 1 1   23   17   27 o     18.7    9.3    0.0000   0.0000          ?        ?   -33.2031  13.4090          ?        ?       18.7        9.3       ?       ? 
1 1 1   23   17   28 o    730.7    3.0    0.0000   0.0000          ?        ?  5339.9561  43.4195          ?        ?      730.7        3.0       ?       ? 
1 1 1   23   17   29 o    503.2    2.5    0.0000   0.0000          ?        ?  2532.3767  25.5409          ?        ?      503.2        2.5       ?       ? 
1 1 1   23   17   30 o    138.4    5.3    0.0000   0.0000          ?        ?   191.5565  14.6860          ?        ?      138.4        5.3       ?       ? 
1 1 1   23   17   31 o    210.5    3.2    0.0000   0.0000          ?        ?   443.1340  13.4090          ?        ?      210.5        3.2       ?       ? 
1 1 1   23   17   32 o    328.1    2.6    0.0000   0.0000          ?        ?  1076.5475  17.2401          ?        ?      328.1        2.6       ?       ? 
1 1 1   23   17   33 o    184.8    4.0    0.0000   0.0000          ?        ?   341.6091  14.6860          ?        ?      184.8        4.0       ?       ? 
1 1 1   23   17   34 o    242.5    3.4    0.0000   0.0000          ?        ?   588.0784  16.6016          ?        ?      242.5        3.4       ?       ? 
1 1 1   23   17   35 o    335.3    2.6    0.0000   0.0000          ?        ?  1124.4366  17.2401          ?        ?      335.3        2.6       ?       ? 
1 1 1   23   17   36 o    380.8    2.7    0.0000   0.0000          ?        ?  1450.0826  20.4327          ?        ?      380.8        2.7       ?       ? 
1 1 1   23   17   37 o    434.6    2.4    0.0000   0.0000          ?        ?  1888.7469  21.0712          ?        ?      434.6        2.4       ?       ? 
1 1 1   23   17   38 o     17.6    8.8    0.0000   0.0000          ?        ?   -43.4195  14.0475          ?        ?       17.6        8.8       ?       ? 
1 1 1   23   17   39 o    405.8    2.7    0.0000   0.0000          ?        ?  1647.3857  21.7097          ?        ?      405.8        2.7       ?       ? 
1 1 1   23   17   40 o    370.7    2.7    0.0000   0.0000          ?        ?  1374.7371  19.7942          ?        ?      370.7        2.7       ?       ? 
1 1 1   23   17   41 o    151.8    5.5    0.0000   0.0000          ?        ?   230.5063  16.6016          ?        ?      151.8        5.5       ?       ? 
1 1 1   23   17   42 o    609.1    2.8    0.0000   0.0000          ?        ?  3711.0879  33.8416          ?        ?      609.1        2.8       ?       ? 
1 1 1   23   17   43 o    275.7    3.1    0.0000   0.0000          ?        ?   760.4792  17.2401          ?        ?      275.7        3.1       ?       ? 
1 1 1   23   17   44 o    401.6    2.7    0.0000   0.0000          ?        ?  1613.5442  21.7097          ?        ?      401.6        2.7       ?       ? 
1 1 1   23   17   45 o    358.8    2.8    0.0000   0.0000          ?        ?  1287.8981  20.4327          ?        ?      358.8        2.8       ?       ? 
1 1 1   23   17   46 o    353.7    3.1    0.0000   0.0000          ?        ?  1251.5024  21.7097          ?        ?      353.7        3.1       ?       ? 
1 1 1   23   17   47 f     64.5   13.3    0.0000   0.0000          ?        ?    43.4195  16.6016          ?        ?       64.5       13.3       ?       ? 
1 1 1   23   17   48 o    738.3    3.0    0.0000   0.0000          ?        ?  5452.3364  44.0580          ?        ?      738.3        3.0       ?       ? 
1 1 1   23   17   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   17   50 o    265.4    3.5    0.0000   0.0000          ?        ?   704.9279  18.5171          ?        ?      265.4        3.5       ?       ? 
1 1 1   23   17   51 o     90.9    9.8    0.0000   0.0000          ?        ?    83.0078  17.8786          ?        ?       90.9        9.8       ?       ? 
1 1 1   23   17   52 o    524.3    2.7    0.0000   0.0000          ?        ?  2749.4741  28.0950          ?        ?      524.3        2.7       ?       ? 
1 1 1   23   17   53 o     97.6    9.2    0.0000   0.0000          ?        ?    95.7782  17.8786          ?        ?       97.6        9.2       ?       ? 
1 1 1   23   17   54 o    378.8    2.9    0.0000   0.0000          ?        ?  1435.3966  21.7097          ?        ?      378.8        2.9       ?       ? 
1 1 1   23   17   55 o    658.9    3.1    0.0000   0.0000          ?        ?  4344.5015  40.8654          ?        ?      658.9        3.1       ?       ? 
1 1 1   23   17   56 o    149.1    6.6    0.0000   0.0000          ?        ?   222.8441  19.7942          ?        ?      149.1        6.6       ?       ? 
1 1 1   23   17   57 o    537.4    2.9    0.0000   0.0000          ?        ?  2889.9490  31.2876          ?        ?      537.4        2.9       ?       ? 
1 1 1   23   17   58 o    138.8    7.1    0.0000   0.0000          ?        ?   193.4720  19.7942          ?        ?      138.8        7.1       ?       ? 
1 1 1   23   17   59 o     64.0   15.6    0.0000   0.0000          ?        ?    43.4195  19.7942          ?        ?       64.0       15.6       ?       ? 
1 1 1   23   17   60 o    143.7    7.3    0.0000   0.0000          ?        ?   207.5195  21.0712          ?        ?      143.7        7.3       ?       ? 
1 1 1   23   17   61 o    196.0    5.0    0.0000   0.0000          ?        ?   385.0285  19.7942          ?        ?      196.0        5.0       ?       ? 
1 1 1   23   17   62 o    306.7    3.4    0.0000   0.0000          ?        ?   941.8194  21.0712          ?        ?      306.7        3.4       ?       ? 
1 1 1   23   17   63 o     26.7   12.8    0.0000   0.0000          ?        ?   -28.0950  19.7942          ?        ?       26.7       12.8       ?       ? 
1 1 1   23   17   64 o     25.3   12.4    0.0000   0.0000          ?        ?   -37.0343  20.4327          ?        ?       25.3       12.4       ?       ? 
1 1 1   23   17   65 o    134.9    7.8    0.0000   0.0000          ?        ?   183.2557  21.0712          ?        ?      134.9        7.8       ?       ? 
1 1 1   23   17   66 f    214.7    4.9    0.0000   0.0000          ?        ?   462.2897  21.0712          ?        ?      214.7        4.9       ?       ? 
1 1 1   23   17   67 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   17   68 o    173.8    6.1    0.0000   0.0000          ?        ?   303.9363  21.0712          ?        ?      173.8        6.1       ?       ? 
1 1 1   23   17   69 o    212.3    5.0    0.0000   0.0000          ?        ?   452.7119  21.0712          ?        ?      212.3        5.0       ?       ? 
1 1 1   23   17   70 o     56.5   16.5    0.0000   0.0000          ?        ?    34.4802  19.7942          ?        ?       56.5       16.5       ?       ? 
1 1 1   23   18    0 o    486.3    4.2 2365.0840  40.8654  2365.0840  40.8654  2365.0840  40.8654      486.3      4.2      486.3        4.2     0.0     0.0 
1 1 1   23   18    1 o   1054.9    4.7    0.0000   0.0000          ?        ? 11130.0703  98.9709          ?        ?     1054.9        4.7       ?       ? 
1 1 1   23   18    2 o    959.7    4.1    0.0000   0.0000          ?        ?  9210.6748  77.8996          ?        ?      959.7        4.1       ?       ? 
1 1 1   23   18    3 o    988.3    4.4    0.0000   0.0000          ?        ?  9768.1045  87.4775          ?        ?      988.3        4.4       ?       ? 
1 1 1   23   18    4 o    915.7    3.9    0.0000   0.0000          ?        ?  8385.7051  72.1529          ?        ?      915.7        3.9       ?       ? 
1 1 1   23   18    5 o    478.5    2.5    0.0000   0.0000          ?        ?  2289.7385  24.2638          ?        ?      478.5        2.5       ?       ? 
1 1 1   23   18    6 o   1474.0    5.7    0.0000   0.0000          ?        ? 21731.4453 169.2082          ?        ?     1474.0        5.7       ?       ? 
1 1 1   23   18    7 o    455.1    2.5    0.0000   0.0000          ?        ?  2071.3640  22.3483          ?        ?      455.1        2.5       ?       ? 
1 1 1   23   18    8 o   1028.8    3.8    0.0000   0.0000          ?        ? 10585.4121  77.8996          ?        ?     1028.8        3.8       ?       ? 
1 1 1   23   18    9 o    495.0    2.3    0.0000   0.0000          ?        ?  2450.6460  22.9868          ?        ?      495.0        2.3       ?       ? 
1 1 1   23   18   10 o    651.4    2.7    0.0000   0.0000          ?        ?  4243.6147  35.1187          ?        ?      651.4        2.7       ?       ? 
1 1 1   23   18   11 o    348.2    2.2    0.0000   0.0000          ?        ?  1212.5525  15.3245          ?        ?      348.2        2.2       ?       ? 
1 1 1   23   18   12 o   1021.9    3.5    0.0000   0.0000          ?        ? 10443.0215  72.1529          ?        ?     1021.9        3.5       ?       ? 
1 1 1   23   18   13 o    758.5    2.9    0.0000   0.0000          ?        ?  5753.7183  44.6965          ?        ?      758.5        2.9       ?       ? 
1 1 1   23   18   14 o   1026.3    3.6    0.0000   0.0000          ?        ? 10533.6914  74.7070          ?        ?     1026.3        3.6       ?       ? 
1 1 1   23   18   15 o     80.7    8.7    0.0000   0.0000          ?        ?    65.1292  14.0475          ?        ?       80.7        8.7       ?       ? 
1 1 1   23   18   16 o     93.2    7.2    0.0000   0.0000          ?        ?    86.8389  13.4090          ?        ?       93.2        7.2       ?       ? 
1 1 1   23   18   17 o    364.5    2.4    0.0000   0.0000          ?        ?  1328.7635  17.2401          ?        ?      364.5        2.4       ?       ? 
1 1 1   23   18   18 o    962.5    3.5    0.0000   0.0000          ?        ?  9264.9492  67.0448          ?        ?      962.5        3.5       ?       ? 
1 1 1   23   18   19 o    293.3    2.6    0.0000   0.0000          ?        ?   860.0886  15.3245          ?        ?      293.3        2.6       ?       ? 
1 1 1   23   18   20 o    366.4    2.8    0.0000   0.0000          ?        ?  1342.8110  20.4327          ?        ?      366.4        2.8       ?       ? 
1 1 1   23   18   21 o    595.8    2.7    0.0000   0.0000          ?        ?  3549.5420  31.9261          ?        ?      595.8        2.7       ?       ? 
1 1 1   23   18   22 o    839.9    3.3    0.0000   0.0000          ?        ?  7054.3872  54.9129          ?        ?      839.9        3.3       ?       ? 
1 1 1   23   18   23 o    889.5    3.3    0.0000   0.0000          ?        ?  7913.1987  59.3825          ?        ?      889.5        3.3       ?       ? 
1 1 1   23   18   24 o     23.4   11.0    0.0000   0.0000          ?        ?   -12.7704  12.7704          ?        ?       23.4       11.0       ?       ? 
1 1 1   23   18   25 o    727.5    2.9    0.0000   0.0000          ?        ?  5293.3442  42.1424          ?        ?      727.5        2.9       ?       ? 
1 1 1   23   18   26 o    365.6    2.5    0.0000   0.0000          ?        ?  1336.4258  18.5171          ?        ?      365.6        2.5       ?       ? 
1 1 1   23   18   27 o     16.3    8.3    0.0000   0.0000          ?        ?   -47.2506  13.4090          ?        ?       16.3        8.3       ?       ? 
1 1 1   23   18   28 o    726.0    2.9    0.0000   0.0000          ?        ?  5270.9961  42.1424          ?        ?      726.0        2.9       ?       ? 
1 1 1   23   18   29 o    471.9    2.6    0.0000   0.0000          ?        ?  2227.1633  24.9023          ?        ?      471.9        2.6       ?       ? 
1 1 1   23   18   30 o    287.9    2.9    0.0000   0.0000          ?        ?   828.8011  16.6016          ?        ?      287.9        2.9       ?       ? 
1 1 1   23   18   31 o    102.9    7.4    0.0000   0.0000          ?        ?   105.9946  15.3245          ?        ?      102.9        7.4       ?       ? 
1 1 1   23   18   32 o    481.5    2.6    0.0000   0.0000          ?        ?  2318.4722  24.9023          ?        ?      481.5        2.6       ?       ? 
1 1 1   23   18   33 o    454.5    2.5    0.0000   0.0000          ?        ?  2066.2561  22.3483          ?        ?      454.5        2.5       ?       ? 
1 1 1   23   18   34 o    566.4    2.6    0.0000   0.0000          ?        ?  3207.9326  29.3720          ?        ?      566.4        2.6       ?       ? 
1 1 1   23   18   35 o    134.4    5.5    0.0000   0.0000          ?        ?   180.7016  14.6860          ?        ?      134.4        5.5       ?       ? 
1 1 1   23   18   36 o     60.1   13.1    0.0000   0.0000          ?        ?    37.6728  15.3245          ?        ?       60.1       13.1       ?       ? 
1 1 1   23   18   37 f    336.5    2.7    0.0000   0.0000          ?        ?  1132.7373  17.8786          ?        ?      336.5        2.7       ?       ? 
1 1 1   23   18   38 o    251.5    3.2    0.0000   0.0000          ?        ?   632.7749  15.9630          ?        ?      251.5        3.2       ?       ? 
1 1 1   23   18   39 o    467.5    2.7    0.0000   0.0000          ?        ?  2186.2981  24.9023          ?        ?      467.5        2.7       ?       ? 
1 1 1   23   18   40 o    339.5    2.7    0.0000   0.0000          ?        ?  1153.1700  18.5171          ?        ?      339.5        2.7       ?       ? 
1 1 1   23   18   41 o    360.0    2.7    0.0000   0.0000          ?        ?  1296.1989  19.1556          ?        ?      360.0        2.7       ?       ? 
1 1 1   23   18   42 o     17.8    9.0    0.0000   0.0000          ?        ?   -56.1899  15.9630          ?        ?       17.8        9.0       ?       ? 
1 1 1   23   18   43 o    231.3    3.7    0.0000   0.0000          ?        ?   535.0811  17.2401          ?        ?      231.3        3.7       ?       ? 
1 1 1   23   18   44 o     29.4   13.3    0.0000   0.0000          ?        ?    -8.9393  16.6016          ?        ?       29.4       13.3       ?       ? 
1 1 1   23   18   45 o     85.9    9.7    0.0000   0.0000          ?        ?    74.0685  16.6016          ?        ?       85.9        9.7       ?       ? 
1 1 1   23   18   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   18   47 o     24.1   11.6    0.0000   0.0000          ?        ?   -25.5409  16.6016          ?        ?       24.1       11.6       ?       ? 
1 1 1   23   18   48 o    440.6    2.6    0.0000   0.0000          ?        ?  1941.7443  22.9868          ?        ?      440.6        2.6       ?       ? 
1 1 1   23   18   49 o    378.6    2.7    0.0000   0.0000          ?        ?  1434.1196  20.4327          ?        ?      378.6        2.7       ?       ? 
1 1 1   23   18   50 o    146.3    5.9    0.0000   0.0000          ?        ?   214.5433  17.2401          ?        ?      146.3        5.9       ?       ? 
1 1 1   23   18   51 o    368.1    2.8    0.0000   0.0000          ?        ?  1355.5814  20.4327          ?        ?      368.1        2.8       ?       ? 
1 1 1   23   18   52 o     64.3   14.3    0.0000   0.0000          ?        ?    43.4195  17.8786          ?        ?       64.3       14.3       ?       ? 
1 1 1   23   18   53 o     25.5   12.2    0.0000   0.0000          ?        ?   -25.5409  17.8786          ?        ?       25.5       12.2       ?       ? 
1 1 1   23   18   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   18   55 o    486.5    2.8    0.0000   0.0000          ?        ?  2367.6382  27.4564          ?        ?      486.5        2.8       ?       ? 
1 1 1   23   18   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   18   57 o    218.5    4.7    0.0000   0.0000          ?        ?   478.2527  20.4327          ?        ?      218.5        4.7       ?       ? 
1 1 1   23   18   58 o    129.8    7.9    0.0000   0.0000          ?        ?   169.2082  20.4327          ?        ?      129.8        7.9       ?       ? 
1 1 1   23   18   59 f    218.5    4.5    0.0000   0.0000          ?        ?   478.2527  19.7942          ?        ?      218.5        4.5       ?       ? 
1 1 1   23   18   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   18   61 o    124.7    8.2    0.0000   0.0000          ?        ?   156.4378  20.4327          ?        ?      124.7        8.2       ?       ? 
1 1 1   23   18   62 o    287.4    3.8    0.0000   0.0000          ?        ?   826.8855  21.7097          ?        ?      287.4        3.8       ?       ? 
1 1 1   23   18   63 o    199.9    5.3    0.0000   0.0000          ?        ?   400.9916  21.0712          ?        ?      199.9        5.3       ?       ? 
1 1 1   23   18   64 o    101.1    9.8    0.0000   0.0000          ?        ?   103.4405  19.7942          ?        ?      101.1        9.8       ?       ? 
1 1 1   23   18   65 o     37.7   16.0    0.0000   0.0000          ?        ?     1.2770  21.0712          ?        ?       37.7       16.0       ?       ? 
1 1 1   23   18   66 o    204.7    5.1    0.0000   0.0000          ?        ?   420.7858  21.0712          ?        ?      204.7        5.1       ?       ? 
1 1 1   23   18   67 o    158.1    6.7    0.0000   0.0000          ?        ?   251.5775  21.0712          ?        ?      158.1        6.7       ?       ? 
1 1 1   23   18   68 o     78.3   14.0    0.0000   0.0000          ?        ?    65.1292  21.0712          ?        ?       78.3       14.0       ?       ? 
1 1 1   23   18   69 o     78.7   12.6    0.0000   0.0000          ?        ?    63.8522  19.7942          ?        ?       78.7       12.6       ?       ? 
1 1 1   23   19    0 o    428.2    4.2 1833.8342  35.7572  1833.8342  35.7572  1833.8342  35.7572      428.2      4.2      428.2        4.2     0.0     0.0 
1 1 1   23   19    1 o    954.9    4.1    0.0000   0.0000          ?        ?  9118.7275  79.1767          ?        ?      954.9        4.1       ?       ? 
1 1 1   23   19    2 o   1905.9    8.0    0.0000   0.0000          ?        ? 36336.9883 303.9363          ?        ?     1905.9        8.0       ?       ? 
1 1 1   23   19    3 o   1314.7    5.2    0.0000   0.0000          ?        ? 17287.3340 137.2822          ?        ?     1314.7        5.2       ?       ? 
1 1 1   23   19    4 o    762.4    3.2    0.0000   0.0000          ?        ?  5813.1011  48.5276          ?        ?      762.4        3.2       ?       ? 
1 1 1   23   19    5 o    587.5    2.7    0.0000   0.0000          ?        ?  3451.2095  31.9261          ?        ?      587.5        2.7       ?       ? 
1 1 1   23   19    6 o   1128.7    4.4    0.0000   0.0000          ?        ? 12741.6992  98.9709          ?        ?     1128.7        4.4       ?       ? 
1 1 1   23   19    7 o    132.0    3.4    0.0000   0.0000          ?        ?   174.3164   8.9393          ?        ?      132.0        3.4       ?       ? 
1 1 1   23   19    8 o    894.8    3.5    0.0000   0.0000          ?        ?  8007.0610  63.2136          ?        ?      894.8        3.5       ?       ? 
1 1 1   23   19    9 o    237.2    2.0    0.0000   0.0000          ?        ?   562.5375   9.5778          ?        ?      237.2        2.0       ?       ? 
1 1 1   23   19   10 o    598.4    2.6    0.0000   0.0000          ?        ?  3580.8291  30.6490          ?        ?      598.4        2.6       ?       ? 
1 1 1   23   19   11 o   1519.3    5.1    0.0000   0.0000          ?        ? 23087.6660 154.5222          ?        ?     1519.3        5.1       ?       ? 
1 1 1   23   19   12 o    605.6    2.6    0.0000   0.0000          ?        ?  3667.6685  31.2876          ?        ?      605.6        2.6       ?       ? 
1 1 1   23   19   13 o    675.4    2.6    0.0000   0.0000          ?        ?  4562.2368  35.7572          ?        ?      675.4        2.6       ?       ? 
1 1 1   23   19   14 o    794.4    3.0    0.0000   0.0000          ?        ?  6311.7861  47.8891          ?        ?      794.4        3.0       ?       ? 
1 1 1   23   19   15 o    630.2    2.6    0.0000   0.0000          ?        ?  3972.2429  33.2031          ?        ?      630.2        2.6       ?       ? 
1 1 1   23   19   16 o   1232.2    4.9    0.0000   0.0000          ?        ? 15185.9600 121.3191          ?        ?     1232.2        4.9       ?       ? 
1 1 1   23   19   17 o    148.0    3.9    0.0000   0.0000          ?        ?   219.0129  11.4934          ?        ?      148.0        3.9       ?       ? 
1 1 1   23   19   18 o    828.7    3.1    0.0000   0.0000          ?        ?  6867.3003  51.7203          ?        ?      828.7        3.1       ?       ? 
1 1 1   23   19   19 o   1138.2    4.0    0.0000   0.0000          ?        ? 12957.5195  91.3086          ?        ?     1138.2        4.0       ?       ? 
1 1 1   23   19   20 o    279.1    2.7    0.0000   0.0000          ?        ?   778.9964  15.3245          ?        ?      279.1        2.7       ?       ? 
1 1 1   23   19   21 o    402.6    2.4    0.0000   0.0000          ?        ?  1620.5679  19.1556          ?        ?      402.6        2.4       ?       ? 
1 1 1   23   19   22 o    345.2    2.3    0.0000   0.0000          ?        ?  1191.4814  15.9630          ?        ?      345.2        2.3       ?       ? 
1 1 1   23   19   23 o    721.2    3.0    0.0000   0.0000          ?        ?  5202.0356  42.7809          ?        ?      721.2        3.0       ?       ? 
1 1 1   23   19   24 o    443.0    2.5    0.0000   0.0000          ?        ?  1962.8154  21.7097          ?        ?      443.0        2.5       ?       ? 
1 1 1   23   19   25 o    375.1    2.6    0.0000   0.0000          ?        ?  1407.3016  19.1556          ?        ?      375.1        2.6       ?       ? 
1 1 1   23   19   26 o    254.6    3.0    0.0000   0.0000          ?        ?   648.0994  15.3245          ?        ?      254.6        3.0       ?       ? 
1 1 1   23   19   27 o    694.5    2.9    0.0000   0.0000          ?        ?  4824.0308  40.8654          ?        ?      694.5        2.9       ?       ? 
1 1 1   23   19   28 o    329.6    2.6    0.0000   0.0000          ?        ?  1086.7638  17.2401          ?        ?      329.6        2.6       ?       ? 
1 1 1   23   19   29 o    387.1    2.6    0.0000   0.0000          ?        ?  1498.6102  19.7942          ?        ?      387.1        2.6       ?       ? 
1 1 1   23   19   30 o    541.6    2.6    0.0000   0.0000          ?        ?  2933.3684  28.0950          ?        ?      541.6        2.6       ?       ? 
1 1 1   23   19   31 o    475.7    2.5    0.0000   0.0000          ?        ?  2263.5591  23.6253          ?        ?      475.7        2.5       ?       ? 
1 1 1   23   19   32 o    158.2    4.6    0.0000   0.0000          ?        ?   250.3005  14.6860          ?        ?      158.2        4.6       ?       ? 
1 1 1   23   19   33 o    609.3    2.6    0.0000   0.0000          ?        ?  3713.0032  31.9261          ?        ?      609.3        2.6       ?       ? 
1 1 1   23   19   34 o    288.5    2.9    0.0000   0.0000          ?        ?   832.6321  16.6016          ?        ?      288.5        2.9       ?       ? 
1 1 1   23   19   35 o    424.7    2.5    0.0000   0.0000          ?        ?  1803.8236  21.0712          ?        ?      424.7        2.5       ?       ? 
1 1 1   23   19   36 o    238.4    3.3    0.0000   0.0000          ?        ?   568.2842  15.9630          ?        ?      238.4        3.3       ?       ? 
1 1 1   23   19   37 o    259.0    3.2    0.0000   0.0000          ?        ?   671.0862  16.6016          ?        ?      259.0        3.2       ?       ? 
1 1 1   23   19   38 o     18.1    9.1    0.0000   0.0000          ?        ?   -49.1662  15.3245          ?        ?       18.1        9.1       ?       ? 
1 1 1   23   19   39 o    198.1    4.2    0.0000   0.0000          ?        ?   392.6908  16.6016          ?        ?      198.1        4.2       ?       ? 
1 1 1   23   19   40 o    718.7    2.9    0.0000   0.0000          ?        ?  5166.2783  42.1424          ?        ?      718.7        2.9       ?       ? 
1 1 1   23   19   41 o    253.1    3.4    0.0000   0.0000          ?        ?   641.0757  17.2401          ?        ?      253.1        3.4       ?       ? 
1 1 1   23   19   42 o    353.4    2.8    0.0000   0.0000          ?        ?  1248.9484  19.7942          ?        ?      353.4        2.8       ?       ? 
1 1 1   23   19   43 o    191.7    4.2    0.0000   0.0000          ?        ?   367.7885  15.9630          ?        ?      191.7        4.2       ?       ? 
1 1 1   23   19   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   19   45 o     31.0   13.7    0.0000   0.0000          ?        ?    -5.1082  16.6016          ?        ?       31.0       13.7       ?       ? 
1 1 1   23   19   46 o    177.0    4.9    0.0000   0.0000          ?        ?   313.5141  17.2401          ?        ?      177.0        4.9       ?       ? 
1 1 1   23   19   47 f    394.3    2.7    0.0000   0.0000          ?        ?  1555.4387  21.0712          ?        ?      394.3        2.7       ?       ? 
1 1 1   23   19   48 o    170.4    4.9    0.0000   0.0000          ?        ?   290.5273  16.6016          ?        ?      170.4        4.9       ?       ? 
1 1 1   23   19   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   19   50 o    274.1    3.3    0.0000   0.0000          ?        ?   751.5399  17.8786          ?        ?      274.1        3.3       ?       ? 
1 1 1   23   19   51 o    148.7    6.0    0.0000   0.0000          ?        ?   221.5670  17.8786          ?        ?      148.7        6.0       ?       ? 
1 1 1   23   19   52 o    147.4    5.8    0.0000   0.0000          ?        ?   217.7359  17.2401          ?        ?      147.4        5.8       ?       ? 
1 1 1   23   19   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   19   54 o    715.9    3.0    0.0000   0.0000          ?        ?  5128.6060  43.4195          ?        ?      715.9        3.0       ?       ? 
1 1 1   23   19   55 f    162.2    5.9    0.0000   0.0000          ?        ?   263.7094  19.1556          ?        ?      162.2        5.9       ?       ? 
1 1 1   23   19   56 o     24.1   11.8    0.0000   0.0000          ?        ?   -37.0343  19.1556          ?        ?       24.1       11.8       ?       ? 
1 1 1   23   19   57 f     20.6   10.3    0.0000   0.0000          ?        ?   -53.6358  18.5171          ?        ?       20.6       10.3       ?       ? 
1 1 1   23   19   58 o    139.7    7.3    0.0000   0.0000          ?        ?   196.0261  20.4327          ?        ?      139.7        7.3       ?       ? 
1 1 1   23   19   59 o    195.7    5.1    0.0000   0.0000          ?        ?   383.7515  19.7942          ?        ?      195.7        5.1       ?       ? 
1 1 1   23   19   60 o    255.5    4.1    0.0000   0.0000          ?        ?   653.8461  21.0712          ?        ?      255.5        4.1       ?       ? 
1 1 1   23   19   61 o    193.8    5.3    0.0000   0.0000          ?        ?   376.7278  20.4327          ?        ?      193.8        5.3       ?       ? 
1 1 1   23   19   62 o    141.2    7.2    0.0000   0.0000          ?        ?   200.4958  20.4327          ?        ?      141.2        7.2       ?       ? 
1 1 1   23   19   63 o    127.6    8.0    0.0000   0.0000          ?        ?   164.1001  20.4327          ?        ?      127.6        8.0       ?       ? 
1 1 1   23   19   64 o    108.1    9.5    0.0000   0.0000          ?        ?   118.1265  20.4327          ?        ?      108.1        9.5       ?       ? 
1 1 1   23   19   65 o     37.3   15.9    0.0000   0.0000          ?        ?     0.6385  21.0712          ?        ?       37.3       15.9       ?       ? 
1 1 1   23   19   66 o    113.2    9.0    0.0000   0.0000          ?        ?   129.6199  20.4327          ?        ?      113.2        9.0       ?       ? 
1 1 1   23   19   67 o     33.6   15.1    0.0000   0.0000          ?        ?    -8.3008  21.0712          ?        ?       33.6       15.1       ?       ? 
1 1 1   23   19   68 o     65.5   15.8    0.0000   0.0000          ?        ?    46.6121  20.4327          ?        ?       65.5       15.8       ?       ? 
1 1 1   23   19   69 o     94.0   11.2    0.0000   0.0000          ?        ?    90.6701  21.0712          ?        ?       94.0       11.2       ?       ? 
1 1 1   23   20    0 o   1515.3    9.7 22970.8164 294.9970 22970.8164 294.9970 22970.8164 294.9970     1515.3      9.7     1515.3        9.7     0.0     0.0 
1 1 1   23   20    1 o    883.0    4.3    0.0000   0.0000          ?        ?  7798.2651  75.3456          ?        ?      883.0        4.3       ?       ? 
1 1 1   23   20    2 o   1098.5    4.7    0.0000   0.0000          ?        ? 12068.6973 102.1635          ?        ?     1098.5        4.7       ?       ? 
1 1 1   23   20    3 o   1066.4    4.9    0.0000   0.0000          ?        ? 11373.3467 105.3561          ?        ?     1066.4        4.9       ?       ? 
1 1 1   23   20    4 f    405.6    2.8    0.0000   0.0000          ?        ?  1645.4703  22.3483          ?        ?      405.6        2.8       ?       ? 
1 1 1   23   20    5 o    968.0    4.0    0.0000   0.0000          ?        ?  9370.9434  77.8996          ?        ?      968.0        4.0       ?       ? 
1 1 1   23   20    6 f    967.2    3.9    0.0000   0.0000          ?        ?  9354.9805  75.9841          ?        ?      967.2        3.9       ?       ? 
1 1 1   23   20    7 o    328.9    2.2    0.0000   0.0000          ?        ?  1081.6556  14.6860          ?        ?      328.9        2.2       ?       ? 
1 1 1   23   20    8 o    673.2    2.9    0.0000   0.0000          ?        ?  4532.2266  39.5883          ?        ?      673.2        2.9       ?       ? 
1 1 1   23   20    9 o    484.5    2.3    0.0000   0.0000          ?        ?  2347.2056  22.3483          ?        ?      484.5        2.3       ?       ? 
1 1 1   23   20   10 o    601.2    2.5    0.0000   0.0000          ?        ?  3614.6707  30.0105          ?        ?      601.2        2.5       ?       ? 
1 1 1   23   20   11 f    683.3    2.7    0.0000   0.0000          ?        ?  4669.5088  36.3957          ?        ?      683.3        2.7       ?       ? 
1 1 1   23   20   12 o    825.8    3.1    0.0000   0.0000          ?        ?  6820.6875  51.0817          ?        ?      825.8        3.1       ?       ? 
1 1 1   23   20   13 o    966.1    3.5    0.0000   0.0000          ?        ?  9335.1865  67.0448          ?        ?      966.1        3.5       ?       ? 
1 1 1   23   20   14 o   1056.8    3.7    0.0000   0.0000          ?        ? 11168.3818  77.8996          ?        ?     1056.8        3.7       ?       ? 
1 1 1   23   20   15 o    576.4    2.5    0.0000   0.0000          ?        ?  3322.2280  29.3720          ?        ?      576.4        2.5       ?       ? 
1 1 1   23   20   16 o    241.4    3.3    0.0000   0.0000          ?        ?   582.9703  15.9630          ?        ?      241.4        3.3       ?       ? 
1 1 1   23   20   17 f    321.0    2.7    0.0000   0.0000          ?        ?  1030.5739  17.2401          ?        ?      321.0        2.7       ?       ? 
1 1 1   23   20   18 o    715.2    2.8    0.0000   0.0000          ?        ?  5115.8354  40.2269          ?        ?      715.2        2.8       ?       ? 
1 1 1   23   20   19 o   1159.6    4.0    0.0000   0.0000          ?        ? 13448.5420  93.8627          ?        ?     1159.6        4.0       ?       ? 
1 1 1   23   20   20 f    284.2    2.7    0.0000   0.0000          ?        ?   807.7299  15.3245          ?        ?      284.2        2.7       ?       ? 
1 1 1   23   20   21 f    918.4    3.4    0.0000   0.0000          ?        ?  8434.8711  62.5751          ?        ?      918.4        3.4       ?       ? 
1 1 1   23   20   22 o    193.6    3.1    0.0000   0.0000          ?        ?   374.8122  12.1319          ?        ?      193.6        3.1       ?       ? 
1 1 1   23   20   23 o    345.4    2.4    0.0000   0.0000          ?        ?  1192.7584  16.6016          ?        ?      345.4        2.4       ?       ? 
1 1 1   23   20   24 o    424.0    2.5    0.0000   0.0000          ?        ?  1798.0769  21.0712          ?        ?      424.0        2.5       ?       ? 
1 1 1   23   20   25 o    263.4    2.9    0.0000   0.0000          ?        ?   694.0730  15.3245          ?        ?      263.4        2.9       ?       ? 
1 1 1   23   20   26 o    877.9    3.3    0.0000   0.0000          ?        ?  7708.8721  58.1055          ?        ?      877.9        3.3       ?       ? 
1 1 1   23   20   27 o    497.4    2.4    0.0000   0.0000          ?        ?  2474.2712  24.2638          ?        ?      497.4        2.4       ?       ? 
1 1 1   23   20   28 o   1227.4    4.2    0.0000   0.0000          ?        ? 15068.4717 104.0790          ?        ?     1227.4        4.2       ?       ? 
1 1 1   23   20   29 o    379.0    2.6    0.0000   0.0000          ?        ?  1436.6737  19.7942          ?        ?      379.0        2.6       ?       ? 
1 1 1   23   20   30 o    740.2    3.1    0.0000   0.0000          ?        ?  5479.7925  46.6121          ?        ?      740.2        3.1       ?       ? 
1 1 1   23   20   31 o    102.0    6.9    0.0000   0.0000          ?        ?   104.0790  14.0475          ?        ?      102.0        6.9       ?       ? 
1 1 1   23   20   32 f    421.4    2.7    0.0000   0.0000          ?        ?  1776.3672  22.9868          ?        ?      421.4        2.7       ?       ? 
1 1 1   23   20   33 o    429.7    2.6    0.0000   0.0000          ?        ?  1846.6046  22.3483          ?        ?      429.7        2.6       ?       ? 
1 1 1   23   20   34 o    669.3    2.8    0.0000   0.0000          ?        ?  4479.8677  37.6728          ?        ?      669.3        2.8       ?       ? 
1 1 1   23   20   35 o    405.4    2.6    0.0000   0.0000          ?        ?  1643.5547  21.0712          ?        ?      405.4        2.6       ?       ? 
1 1 1   23   20   36 o    364.4    2.7    0.0000   0.0000          ?        ?  1328.1250  19.7942          ?        ?      364.4        2.7       ?       ? 
1 1 1   23   20   37 o    427.1    2.6    0.0000   0.0000          ?        ?  1824.2563  22.3483          ?        ?      427.1        2.6       ?       ? 
1 1 1   23   20   38 o    269.6    3.2    0.0000   0.0000          ?        ?   727.2761  17.2401          ?        ?      269.6        3.2       ?       ? 
1 1 1   23   20   39 o     52.5   13.8    0.0000   0.0000          ?        ?    28.7335  14.6860          ?        ?       52.5       13.8       ?       ? 
1 1 1   23   20   40 o    439.9    2.6    0.0000   0.0000          ?        ?  1935.3591  22.9868          ?        ?      439.9        2.6       ?       ? 
1 1 1   23   20   41 o    834.5    3.2    0.0000   0.0000          ?        ?  6965.6328  52.9973          ?        ?      834.5        3.2       ?       ? 
1 1 1   23   20   42 o    150.7    5.1    0.0000   0.0000          ?        ?   227.3137  15.3245          ?        ?      150.7        5.1       ?       ? 
1 1 1   23   20   43 o    112.3    7.1    0.0000   0.0000          ?        ?   126.4273  15.9630          ?        ?      112.3        7.1       ?       ? 
1 1 1   23   20   44 o    239.7    3.6    0.0000   0.0000          ?        ?   574.6694  17.2401          ?        ?      239.7        3.6       ?       ? 
1 1 1   23   20   45 o    429.8    2.7    0.0000   0.0000          ?        ?  1847.8816  22.9868          ?        ?      429.8        2.7       ?       ? 
1 1 1   23   20   46 o    391.7    2.9    0.0000   0.0000          ?        ?  1535.0060  22.3483          ?        ?      391.7        2.9       ?       ? 
1 1 1   23   20   47 o    128.5    7.0    0.0000   0.0000          ?        ?   165.3771  17.8786          ?        ?      128.5        7.0       ?       ? 
1 1 1   23   20   48 o    372.9    2.8    0.0000   0.0000          ?        ?  1391.3386  21.0712          ?        ?      372.9        2.8       ?       ? 
1 1 1   23   20   49 o    378.0    3.0    0.0000   0.0000          ?        ?  1429.6499  22.3483          ?        ?      378.0        3.0       ?       ? 
1 1 1   23   20   50 o     85.1   10.1    0.0000   0.0000          ?        ?    72.7915  17.2401          ?        ?       85.1       10.1       ?       ? 
1 1 1   23   20   51 o    333.7    3.1    0.0000   0.0000          ?        ?  1114.2202  20.4327          ?        ?      333.7        3.1       ?       ? 
1 1 1   23   20   52 o     40.9   15.8    0.0000   0.0000          ?        ?    10.8549  18.5171          ?        ?       40.9       15.8       ?       ? 
1 1 1   23   20   53 o    228.4    4.2    0.0000   0.0000          ?        ?   522.3107  19.1556          ?        ?      228.4        4.2       ?       ? 
1 1 1   23   20   54 o    386.0    3.1    0.0000   0.0000          ?        ?  1490.9480  23.6253          ?        ?      386.0        3.1       ?       ? 
1 1 1   23   20   55 o    253.8    3.9    0.0000   0.0000          ?        ?   644.9069  19.7942          ?        ?      253.8        3.9       ?       ? 
1 1 1   23   20   56 o    206.2    4.6    0.0000   0.0000          ?        ?   425.8939  19.1556          ?        ?      206.2        4.6       ?       ? 
1 1 1   23   20   57 o    198.5    5.0    0.0000   0.0000          ?        ?   394.6064  19.7942          ?        ?      198.5        5.0       ?       ? 
1 1 1   23   20   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   20   59 o    127.0    7.5    0.0000   0.0000          ?        ?   162.1845  19.1556          ?        ?      127.0        7.5       ?       ? 
1 1 1   23   20   60 o    131.9    7.5    0.0000   0.0000          ?        ?   174.9549  19.7942          ?        ?      131.9        7.5       ?       ? 
1 1 1   23   20   61 o     25.4   12.3    0.0000   0.0000          ?        ?   -33.8416  19.7942          ?        ?       25.4       12.3       ?       ? 
1 1 1   23   20   62 o     99.5   10.6    0.0000   0.0000          ?        ?   100.2479  21.0712          ?        ?       99.5       10.6       ?       ? 
1 1 1   23   20   63 o    149.3    7.1    0.0000   0.0000          ?        ?   224.1211  21.0712          ?        ?      149.3        7.1       ?       ? 
1 1 1   23   20   64 o    236.7    4.5    0.0000   0.0000          ?        ?   561.8990  21.0712          ?        ?      236.7        4.5       ?       ? 
1 1 1   23   20   65 o    144.4    7.3    0.0000   0.0000          ?        ?   210.0736  21.0712          ?        ?      144.4        7.3       ?       ? 
1 1 1   23   20   66 o     91.5   11.5    0.0000   0.0000          ?        ?    85.5619  21.0712          ?        ?       91.5       11.5       ?       ? 
1 1 1   23   20   67 o    242.3    4.5    0.0000   0.0000          ?        ?   589.3555  21.7097          ?        ?      242.3        4.5       ?       ? 
1 1 1   23   20   68 o     31.9   14.4    0.0000   0.0000          ?        ?    -9.5778  19.7942          ?        ?       31.9       14.4       ?       ? 
1 1 1   23   21    0 o    929.7    6.4 8645.5830 118.7650  8645.5830 118.7650  8645.5830 118.7650      929.7      6.4      929.7        6.4     0.0     0.0 
1 1 1   23   21    1 o   1098.5    5.1    0.0000   0.0000          ?        ? 12069.9746 111.7413          ?        ?     1098.5        5.1       ?       ? 
1 1 1   23   21    2 o    432.4    3.6    0.0000   0.0000          ?        ?  1870.2299  31.2876          ?        ?      432.4        3.6       ?       ? 
1 1 1   23   21    3 o    700.8    3.6    0.0000   0.0000          ?        ?  4911.5083  49.8047          ?        ?      700.8        3.6       ?       ? 
1 1 1   23   21    4 f    219.4    3.5    0.0000   0.0000          ?        ?   481.4453  15.3245          ?        ?      219.4        3.5       ?       ? 
1 1 1   23   21    5 o    807.6    3.5    0.0000   0.0000          ?        ?  6522.4985  56.8284          ?        ?      807.6        3.5       ?       ? 
1 1 1   23   21    6 o     18.1    8.8    0.0000   0.0000          ?        ?   -15.3245   9.5778          ?        ?       18.1        8.8       ?       ? 
1 1 1   23   21    7 o    478.1    2.3    0.0000   0.0000          ?        ?  2285.9075  22.3483          ?        ?      478.1        2.3       ?       ? 
1 1 1   23   21    8 o    553.7    2.7    0.0000   0.0000          ?        ?  3065.5425  29.3720          ?        ?      553.7        2.7       ?       ? 
1 1 1   23   21    9 o    190.4    2.2    0.0000   0.0000          ?        ?   362.6803   8.3008          ?        ?      190.4        2.2       ?       ? 
1 1 1   23   21   10 o    984.1    3.7    0.0000   0.0000          ?        ?  9685.0967  73.4300          ?        ?      984.1        3.7       ?       ? 
1 1 1   23   21   11 o    481.1    2.3    0.0000   0.0000          ?        ?  2314.6409  22.3483          ?        ?      481.1        2.3       ?       ? 
1 1 1   23   21   12 o    845.3    3.2    0.0000   0.0000          ?        ?  7145.6953  53.6358          ?        ?      845.3        3.2       ?       ? 
1 1 1   23   21   13 o    388.3    2.1    0.0000   0.0000          ?        ?  1507.5496  16.6016          ?        ?      388.3        2.1       ?       ? 
1 1 1   23   21   14 o    493.4    2.3    0.0000   0.0000          ?        ?  2434.6829  22.9868          ?        ?      493.4        2.3       ?       ? 
1 1 1   23   21   15 o    649.7    2.7    0.0000   0.0000          ?        ?  4221.2661  34.4802          ?        ?      649.7        2.7       ?       ? 
1 1 1   23   21   16 o    490.6    2.4    0.0000   0.0000          ?        ?  2406.5879  23.6253          ?        ?      490.6        2.4       ?       ? 
1 1 1   23   21   17 o   1240.9    4.3    0.0000   0.0000          ?        ? 15399.8652 107.9102          ?        ?     1240.9        4.3       ?       ? 
1 1 1   23   21   18 o    416.0    2.4    0.0000   0.0000          ?        ?  1731.0322  19.7942          ?        ?      416.0        2.4       ?       ? 
1 1 1   23   21   19 o   1308.5    4.8    0.0000   0.0000          ?        ? 17125.7891 125.1502          ?        ?     1308.5        4.8       ?       ? 
1 1 1   23   21   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   21   21 o   1257.4    4.3    0.0000   0.0000          ?        ? 15814.9043 109.1872          ?        ?     1257.4        4.3       ?       ? 
1 1 1   23   21   22 o    615.6    2.7    0.0000   0.0000          ?        ?  3789.6257  33.2031          ?        ?      615.6        2.7       ?       ? 
1 1 1   23   21   23 o    456.0    2.5    0.0000   0.0000          ?        ?  2079.6650  22.9868          ?        ?      456.0        2.5       ?       ? 
1 1 1   23   21   24 o    395.0    2.3    0.0000   0.0000          ?        ?  1560.5469  18.5171          ?        ?      395.0        2.3       ?       ? 
1 1 1   23   21   25 o    477.8    2.5    0.0000   0.0000          ?        ?  2282.7148  23.6253          ?        ?      477.8        2.5       ?       ? 
1 1 1   23   21   26 o    247.6    3.1    0.0000   0.0000          ?        ?   612.9808  15.3245          ?        ?      247.6        3.1       ?       ? 
1 1 1   23   21   27 o    334.7    2.5    0.0000   0.0000          ?        ?  1120.6055  16.6016          ?        ?      334.7        2.5       ?       ? 
1 1 1   23   21   28 o    251.4    3.0    0.0000   0.0000          ?        ?   632.1364  15.3245          ?        ?      251.4        3.0       ?       ? 
1 1 1   23   21   29 o    482.1    2.6    0.0000   0.0000          ?        ?  2324.8572  24.9023          ?        ?      482.1        2.6       ?       ? 
1 1 1   23   21   30 o    943.8    3.6    0.0000   0.0000          ?        ?  8910.5693  67.0448          ?        ?      943.8        3.6       ?       ? 
1 1 1   23   21   31 o    371.2    2.5    0.0000   0.0000          ?        ?  1377.9297  18.5171          ?        ?      371.2        2.5       ?       ? 
1 1 1   23   21   32 o    553.2    2.8    0.0000   0.0000          ?        ?  3061.0728  30.6490          ?        ?      553.2        2.8       ?       ? 
1 1 1   23   21   33 o    566.3    2.6    0.0000   0.0000          ?        ?  3207.2939  30.0105          ?        ?      566.3        2.6       ?       ? 
1 1 1   23   21   34 o     83.7    9.2    0.0000   0.0000          ?        ?    70.2374  15.3245          ?        ?       83.7        9.2       ?       ? 
1 1 1   23   21   35 o    160.2    4.8    0.0000   0.0000          ?        ?   256.6857  15.3245          ?        ?      160.2        4.8       ?       ? 
1 1 1   23   21   36 o    515.0    2.6    0.0000   0.0000          ?        ?  2653.0574  26.8179          ?        ?      515.0        2.6       ?       ? 
1 1 1   23   21   37 o    248.7    3.3    0.0000   0.0000          ?        ?   618.7275  16.6016          ?        ?      248.7        3.3       ?       ? 
1 1 1   23   21   38 o    127.5    6.0    0.0000   0.0000          ?        ?   162.8230  15.3245          ?        ?      127.5        6.0       ?       ? 
1 1 1   23   21   39 o    277.2    3.2    0.0000   0.0000          ?        ?   768.7800  17.8786          ?        ?      277.2        3.2       ?       ? 
1 1 1   23   21   40 o    206.2    3.9    0.0000   0.0000          ?        ?   425.2554  15.9630          ?        ?      206.2        3.9       ?       ? 
1 1 1   23   21   41 o    224.3    3.8    0.0000   0.0000          ?        ?   503.1551  17.2401          ?        ?      224.3        3.8       ?       ? 
1 1 1   23   21   42 o    604.9    2.6    0.0000   0.0000          ?        ?  3660.0061  31.9261          ?        ?      604.9        2.6       ?       ? 
1 1 1   23   21   43 o    247.7    3.4    0.0000   0.0000          ?        ?   613.6193  16.6016          ?        ?      247.7        3.4       ?       ? 
1 1 1   23   21   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   21   45 o    635.2    2.8    0.0000   0.0000          ?        ?  4036.7339  35.7572          ?        ?      635.2        2.8       ?       ? 
1 1 1   23   21   46 f    142.4    6.1    0.0000   0.0000          ?        ?   203.0499  17.2401          ?        ?      142.4        6.1       ?       ? 
1 1 1   23   21   47 o    104.0    8.6    0.0000   0.0000          ?        ?   108.5487  17.8786          ?        ?      104.0        8.6       ?       ? 
1 1 1   23   21   48 o     72.5   11.9    0.0000   0.0000          ?        ?    52.9973  17.2401          ?        ?       72.5       11.9       ?       ? 
1 1 1   23   21   49 o    408.5    2.8    0.0000   0.0000          ?        ?  1669.0955  22.9868          ?        ?      408.5        2.8       ?       ? 
1 1 1   23   21   50 o    296.4    3.6    0.0000   0.0000          ?        ?   879.2443  21.0712          ?        ?      296.4        3.6       ?       ? 
1 1 1   23   21   51 o    418.5    2.8    0.0000   0.0000          ?        ?  1752.1033  23.6253          ?        ?      418.5        2.8       ?       ? 
1 1 1   23   21   52 o    323.6    3.2    0.0000   0.0000          ?        ?  1047.8141  20.4327          ?        ?      323.6        3.2       ?       ? 
1 1 1   23   21   53 o    180.8    5.3    0.0000   0.0000          ?        ?   327.5616  19.1556          ?        ?      180.8        5.3       ?       ? 
1 1 1   23   21   54 o    157.2    6.1    0.0000   0.0000          ?        ?   247.7464  19.1556          ?        ?      157.2        6.1       ?       ? 
1 1 1   23   21   55 o     20.3   10.2    0.0000   0.0000          ?        ?   -70.2374  20.4327          ?        ?       20.3       10.2       ?       ? 
1 1 1   23   21   56 o    113.2    8.7    0.0000   0.0000          ?        ?   128.9814  19.7942          ?        ?      113.2        8.7       ?       ? 
1 1 1   23   21   57 o     84.5   11.3    0.0000   0.0000          ?        ?    72.1529  19.1556          ?        ?       84.5       11.3       ?       ? 
1 1 1   23   21   58 o    160.7    6.2    0.0000   0.0000          ?        ?   259.2398  19.7942          ?        ?      160.7        6.2       ?       ? 
1 1 1   23   21   59 o    197.1    5.2    0.0000   0.0000          ?        ?   389.4982  20.4327          ?        ?      197.1        5.2       ?       ? 
1 1 1   23   21   60 o     23.1   11.4    0.0000   0.0000          ?        ?   -45.9736  19.7942          ?        ?       23.1       11.4       ?       ? 
1 1 1   23   21   61 o     19.7   10.0    0.0000   0.0000          ?        ?   -75.3456  20.4327          ?        ?       19.7       10.0       ?       ? 
1 1 1   23   21   62 o    231.0    4.7    0.0000   0.0000          ?        ?   535.0811  21.7097          ?        ?      231.0        4.7       ?       ? 
1 1 1   23   21   63 o     85.7   11.6    0.0000   0.0000          ?        ?    74.7070  19.7942          ?        ?       85.7       11.6       ?       ? 
1 1 1   23   21   64 o    299.3    3.8    0.0000   0.0000          ?        ?   897.7615  22.9868          ?        ?      299.3        3.8       ?       ? 
1 1 1   23   21   65 f    162.7    6.3    0.0000   0.0000          ?        ?   266.2635  20.4327          ?        ?      162.7        6.3       ?       ? 
1 1 1   23   21   66 o    209.3    4.7    0.0000   0.0000          ?        ?   439.9414  19.7942          ?        ?      209.3        4.7       ?       ? 
1 1 1   23   21   67 o     39.5   16.2    0.0000   0.0000          ?        ?     7.0237  20.4327          ?        ?       39.5       16.2       ?       ? 
1 1 1   23   22    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   22    1 o    378.4    3.5    0.0000   0.0000          ?        ?  1432.2040  26.1794          ?        ?      378.4        3.5       ?       ? 
1 1 1   23   22    2 o    395.8    3.1    0.0000   0.0000          ?        ?  1566.9320  24.2638          ?        ?      395.8        3.1       ?       ? 
1 1 1   23   22    3 o    708.0    3.7    0.0000   0.0000          ?        ?  5013.6719  51.7203          ?        ?      708.0        3.7       ?       ? 
1 1 1   23   22    4 o    599.2    3.0    0.0000   0.0000          ?        ?  3591.0459  36.3957          ?        ?      599.2        3.0       ?       ? 
1 1 1   23   22    5 o    217.8    2.9    0.0000   0.0000          ?        ?   474.4216  12.7704          ?        ?      217.8        2.9       ?       ? 
1 1 1   23   22    6 o    633.1    3.0    0.0000   0.0000          ?        ?  4008.6387  37.6728          ?        ?      633.1        3.0       ?       ? 
1 1 1   23   22    7 o   1266.9    4.7    0.0000   0.0000          ?        ? 16053.7100 120.0421          ?        ?     1266.9        4.7       ?       ? 
1 1 1   23   22    8 o    547.7    2.6    0.0000   0.0000          ?        ?  3000.4131  28.0950          ?        ?      547.7        2.6       ?       ? 
1 1 1   23   22    9 o    530.9    2.3    0.0000   0.0000          ?        ?  2818.4343  24.2638          ?        ?      530.9        2.3       ?       ? 
1 1 1   23   22   10 o    249.4    2.2    0.0000   0.0000          ?        ?   621.9200  10.8549          ?        ?      249.4        2.2       ?       ? 
1 1 1   23   22   11 o    439.2    2.3    0.0000   0.0000          ?        ?  1928.9739  19.7942          ?        ?      439.2        2.3       ?       ? 
1 1 1   23   22   12 o   1136.3    3.9    0.0000   0.0000          ?        ? 12912.8232  89.3930          ?        ?     1136.3        3.9       ?       ? 
1 1 1   23   22   13 o    581.6    2.5    0.0000   0.0000          ?        ?  3382.2490  28.7335          ?        ?      581.6        2.5       ?       ? 
1 1 1   23   22   14 o    591.6    2.5    0.0000   0.0000          ?        ?  3499.7368  30.0105          ?        ?      591.6        2.5       ?       ? 
1 1 1   23   22   15 o    577.0    2.5    0.0000   0.0000          ?        ?  3329.8904  28.7335          ?        ?      577.0        2.5       ?       ? 
1 1 1   23   22   16 f    461.4    2.3    0.0000   0.0000          ?        ?  2129.4697  21.0712          ?        ?      461.4        2.3       ?       ? 
1 1 1   23   22   17 o    455.6    2.3    0.0000   0.0000          ?        ?  2075.8337  21.0712          ?        ?      455.6        2.3       ?       ? 
1 1 1   23   22   18 o    545.5    2.6    0.0000   0.0000          ?        ?  2976.1494  28.7335          ?        ?      545.5        2.6       ?       ? 
1 1 1   23   22   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   22   20 o    296.3    2.7    0.0000   0.0000          ?        ?   877.9672  15.9630          ?        ?      296.3        2.7       ?       ? 
1 1 1   23   22   21 o   1233.2    4.3    0.0000   0.0000          ?        ? 15210.2246 105.9946          ?        ?     1233.2        4.3       ?       ? 
1 1 1   23   22   22 o    345.8    2.6    0.0000   0.0000          ?        ?  1195.9510  17.8786          ?        ?      345.8        2.6       ?       ? 
1 1 1   23   22   23 o    670.4    2.8    0.0000   0.0000          ?        ?  4494.5537  37.0343          ?        ?      670.4        2.8       ?       ? 
1 1 1   23   22   24 o    195.4    3.3    0.0000   0.0000          ?        ?   381.8359  12.7704          ?        ?      195.4        3.3       ?       ? 
1 1 1   23   22   25 o    191.6    3.5    0.0000   0.0000          ?        ?   367.1499  13.4090          ?        ?      191.6        3.5       ?       ? 
1 1 1   23   22   26 o    299.9    2.7    0.0000   0.0000          ?        ?   899.6769  15.9630          ?        ?      299.9        2.7       ?       ? 
1 1 1   23   22   27 o    385.3    2.5    0.0000   0.0000          ?        ?  1484.5627  19.1556          ?        ?      385.3        2.5       ?       ? 
1 1 1   23   22   28 o    545.5    2.5    0.0000   0.0000          ?        ?  2976.1494  27.4564          ?        ?      545.5        2.5       ?       ? 
1 1 1   23   22   29 o    102.3    6.6    0.0000   0.0000          ?        ?   104.7175  13.4090          ?        ?      102.3        6.6       ?       ? 
1 1 1   23   22   30 o    383.9    2.5    0.0000   0.0000          ?        ?  1473.7079  19.1556          ?        ?      383.9        2.5       ?       ? 
1 1 1   23   22   31 o    385.9    2.5    0.0000   0.0000          ?        ?  1489.0325  19.1556          ?        ?      385.9        2.5       ?       ? 
1 1 1   23   22   32 f    378.9    2.7    0.0000   0.0000          ?        ?  1436.0352  20.4327          ?        ?      378.9        2.7       ?       ? 
1 1 1   23   22   33 o    272.1    3.1    0.0000   0.0000          ?        ?   740.6851  16.6016          ?        ?      272.1        3.1       ?       ? 
1 1 1   23   22   34 o    625.1    2.7    0.0000   0.0000          ?        ?  3908.3906  33.8416          ?        ?      625.1        2.7       ?       ? 
1 1 1   23   22   35 o    317.2    2.7    0.0000   0.0000          ?        ?  1006.3101  17.2401          ?        ?      317.2        2.7       ?       ? 
1 1 1   23   22   36 o    665.3    2.9    0.0000   0.0000          ?        ?  4427.5093  38.3113          ?        ?      665.3        2.9       ?       ? 
1 1 1   23   22   37 o    315.8    3.0    0.0000   0.0000          ?        ?   997.3708  19.1556          ?        ?      315.8        3.0       ?       ? 
1 1 1   23   22   38 o    394.5    2.8    0.0000   0.0000          ?        ?  1556.7157  22.3483          ?        ?      394.5        2.8       ?       ? 
1 1 1   23   22   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   22   40 o    244.6    3.3    0.0000   0.0000          ?        ?   598.2947  15.9630          ?        ?      244.6        3.3       ?       ? 
1 1 1   23   22   41 o    175.7    4.5    0.0000   0.0000          ?        ?   309.0445  15.9630          ?        ?      175.7        4.5       ?       ? 
1 1 1   23   22   42 o    259.1    3.6    0.0000   0.0000          ?        ?   671.7247  18.5171          ?        ?      259.1        3.6       ?       ? 
1 1 1   23   22   43 o    154.8    5.6    0.0000   0.0000          ?        ?   240.0841  17.2401          ?        ?      154.8        5.6       ?       ? 
1 1 1   23   22   44 o    484.9    2.8    0.0000   0.0000          ?        ?  2351.6750  26.8179          ?        ?      484.9        2.8       ?       ? 
1 1 1   23   22   45 o    359.1    2.8    0.0000   0.0000          ?        ?  1289.8137  20.4327          ?        ?      359.1        2.8       ?       ? 
1 1 1   23   22   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   22   47 o    408.5    2.8    0.0000   0.0000          ?        ?  1669.7340  22.9868          ?        ?      408.5        2.8       ?       ? 
1 1 1   23   22   48 o     33.0   14.1    0.0000   0.0000          ?        ?    -0.6385  16.6016          ?        ?       33.0       14.1       ?       ? 
1 1 1   23   22   49 o    183.5    4.7    0.0000   0.0000          ?        ?   337.1394  17.2401          ?        ?      183.5        4.7       ?       ? 
1 1 1   23   22   50 o    152.1    6.1    0.0000   0.0000          ?        ?   231.7833  18.5171          ?        ?      152.1        6.1       ?       ? 
1 1 1   23   22   51 o    212.5    4.5    0.0000   0.0000          ?        ?   452.0733  19.1556          ?        ?      212.5        4.5       ?       ? 
1 1 1   23   22   52 o     23.8   11.5    0.0000   0.0000          ?        ?   -29.3720  17.2401          ?        ?       23.8       11.5       ?       ? 
1 1 1   23   22   53 o    268.0    3.5    0.0000   0.0000          ?        ?   718.9753  18.5171          ?        ?      268.0        3.5       ?       ? 
1 1 1   23   22   54 o     56.9   16.1    0.0000   0.0000          ?        ?    33.8416  19.1556          ?        ?       56.9       16.1       ?       ? 
1 1 1   23   22   55 o    450.4    2.8    0.0000   0.0000          ?        ?  2029.8602  25.5409          ?        ?      450.4        2.8       ?       ? 
1 1 1   23   22   56 o    205.5    5.0    0.0000   0.0000          ?        ?   423.3398  20.4327          ?        ?      205.5        5.0       ?       ? 
1 1 1   23   22   57 o    130.7    7.6    0.0000   0.0000          ?        ?   171.7623  19.7942          ?        ?      130.7        7.6       ?       ? 
1 1 1   23   22   58 o     91.3   10.8    0.0000   0.0000          ?        ?    84.2849  19.7942          ?        ?       91.3       10.8       ?       ? 
1 1 1   23   22   59 o     82.1   11.3    0.0000   0.0000          ?        ?    68.3218  18.5171          ?        ?       82.1       11.3       ?       ? 
1 1 1   23   22   60 o    152.3    6.7    0.0000   0.0000          ?        ?   233.0604  20.4327          ?        ?      152.3        6.7       ?       ? 
1 1 1   23   22   61 o    127.6    8.0    0.0000   0.0000          ?        ?   164.1001  20.4327          ?        ?      127.6        8.0       ?       ? 
1 1 1   23   22   62 o    325.4    3.3    0.0000   0.0000          ?        ?  1060.5845  21.7097          ?        ?      325.4        3.3       ?       ? 
1 1 1   23   22   63 o    167.4    5.9    0.0000   0.0000          ?        ?   281.5880  19.7942          ?        ?      167.4        5.9       ?       ? 
1 1 1   23   22   64 o    249.2    4.2    0.0000   0.0000          ?        ?   622.5586  21.0712          ?        ?      249.2        4.2       ?       ? 
1 1 1   23   22   65 o    269.7    3.9    0.0000   0.0000          ?        ?   729.1917  21.0712          ?        ?      269.7        3.9       ?       ? 
1 1 1   23   22   66 o     23.8   11.6    0.0000   0.0000          ?        ?   -34.4802  18.5171          ?        ?       23.8       11.6       ?       ? 
1 1 1   23   22   67 o     31.7   14.3    0.0000   0.0000          ?        ?    -8.3008  19.1556          ?        ?       31.7       14.3       ?       ? 
1 1 1   23   23    0 o    938.1    8.7 8803.2969 163.4615  8803.2969 163.4615  8803.2969 163.4615      938.1      8.7      938.1        8.7     0.0     0.0 
1 1 1   23   23    1 o   1239.9    7.6 15380.0703 189.0024 15380.0703 189.0024 15380.0703 189.0024     1239.9      7.6     1239.9        7.6     0.0     0.0 
1 1 1   23   23    2 f    238.5    6.0  570.1998  28.7335   570.1998  28.7335   570.1998  28.7335      238.5      6.0      238.5        6.0     0.0     0.0 
1 1 1   23   23    3 o    775.2    5.2 6011.0430  81.0922  6011.0430  81.0922  6011.0430  81.0922      775.2      5.2      775.2        5.2     0.0     0.0 
1 1 1   23   23    4 o   1220.3    7.4 14896.0703 179.4246 14896.0703 179.4246 14896.0703 179.4246     1220.3      7.4     1220.3        7.4     0.0     0.0 
1 1 1   23   23    5 o    266.2    4.1  709.3975  21.7097   709.3975  21.7097   709.3975  21.7097      266.2      4.1      266.2        4.1     0.0     0.0 
1 1 1   23   23    6 o    172.4    5.4  298.1896  18.5171   298.1896  18.5171   298.1896  18.5171      172.4      5.4      172.4        5.4     0.0     0.0 
1 1 1   23   23    7 o   1384.6    7.3 19176.0820 203.0499 19176.0820 203.0499 19176.0820 203.0499     1384.6      7.3     1384.6        7.3     0.0     0.0 
1 1 1   23   23    8 o    164.5    5.4  271.3717  17.8786   271.3717  17.8786   271.3717  17.8786      164.5      5.4      164.5        5.4     0.0     0.0 
1 1 1   23   23    9 o     97.3    4.3   95.1397   8.3008    95.1397   8.3008    95.1397   8.3008       97.3      4.3       97.3        4.3     0.0     0.0 
1 1 1   23   23   10 o    382.5    2.8 1463.4916  21.7097  1463.4916  21.7097  1463.4916  21.7097      382.5      2.8      382.5        2.8     0.0     0.0 
1 1 1   23   23   11 o    414.9    3.0 1722.0929  24.9023  1722.0929  24.9023  1722.0929  24.9023      414.9      3.0      414.9        3.0     0.0     0.0 
1 1 1   23   23   12 o     14.3   10.2  -13.4090  11.4934   -13.4090  11.4934   -13.4090  11.4934       14.3     10.2       14.3       10.2     0.0     0.0 
1 1 1   23   23   13 o    658.6    4.1 4338.1162  53.6358  4338.1162  53.6358  4338.1162  53.6358      658.6      4.1      658.6        4.1     0.0     0.0 
1 1 1   23   23   14 o    722.1    3.9 5214.8062  56.8284  5214.8062  56.8284  5214.8062  56.8284      722.1      3.9      722.1        3.9     0.0     0.0 
1 1 1   23   23   15 o    747.3    4.1 5585.1489  60.6596  5585.1489  60.6596  5585.1489  60.6596      747.3      4.1      747.3        4.1     0.0     0.0 
1 1 1   23   23   16 o    188.4    4.4  355.6566  16.6016   355.6566  16.6016   355.6566  16.6016      188.4      4.4      188.4        4.4     0.0     0.0 
1 1 1   23   23   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   23   18 o     20.4   13.6   -3.8311  14.6860    -3.8311  14.6860    -3.8311  14.6860       20.4     13.6       20.4       13.6     0.0     0.0 
1 1 1   23   23   19 o    396.6    3.2 1573.3173  25.5409  1573.3173  25.5409  1573.3173  25.5409      396.6      3.2      396.6        3.2     0.0     0.0 
1 1 1   23   23   20 o    951.9    4.9 9063.8145  93.8627  9063.8145  93.8627  9063.8145  93.8627      951.9      4.9      951.9        4.9     0.0     0.0 
1 1 1   23   23   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   23   22 o    637.6    3.9 4066.7444  49.1662  4066.7444  49.1662  4066.7444  49.1662      637.6      3.9      637.6        3.9     0.0     0.0 
1 1 1   23   23   23 o    423.1    3.4 1791.0532  28.7335  1791.0532  28.7335  1791.0532  28.7335      423.1      3.4      423.1        3.4     0.0     0.0 
1 1 1   23   23   24 o    225.3    4.4  508.2632  19.7942   508.2632  19.7942   508.2632  19.7942      225.3      4.4      225.3        4.4     0.0     0.0 
1 1 1   23   23   25 f    378.8    3.3 1435.3966  24.9023  1435.3966  24.9023  1435.3966  24.9023      378.8      3.3      378.8        3.3     0.0     0.0 
1 1 1   23   23   26 o    664.9    3.9 4422.4004  52.3588  4422.4004  52.3588  4422.4004  52.3588      664.9      3.9      664.9        3.9     0.0     0.0 
1 1 1   23   23   27 o    476.5    3.4 2271.2214  31.9261  2271.2214  31.9261  2271.2214  31.9261      476.5      3.4      476.5        3.4     0.0     0.0 
1 1 1   23   23   28 o    212.0    4.7  450.1577  19.7942   450.1577  19.7942   450.1577  19.7942      212.0      4.7      212.0        4.7     0.0     0.0 
1 1 1   23   23   29 o    354.5    3.6 1257.2490  25.5409  1257.2490  25.5409  1257.2490  25.5409      354.5      3.6      354.5        3.6     0.0     0.0 
1 1 1   23   23   30 o    184.7    5.9  342.2476  21.7097   342.2476  21.7097   342.2476  21.7097      184.7      5.9      184.7        5.9     0.0     0.0 
1 1 1   23   23   31 o    368.2    3.5 1356.2198  25.5409  1356.2198  25.5409  1356.2198  25.5409      368.2      3.5      368.2        3.5     0.0     0.0 
1 1 1   23   23   32 o     71.9   18.0   60.6596  22.3483    60.6596  22.3483    60.6596  22.3483       71.9     18.0       71.9       18.0     0.0     0.0 
1 1 1   23   23   33 o    587.7    3.9 3455.0403  45.9736  3455.0403  45.9736  3455.0403  45.9736      587.7      3.9      587.7        3.9     0.0     0.0 
1 1 1   23   23   34 o    114.0    9.4  132.8125  21.0712   132.8125  21.0712   132.8125  21.0712      114.0      9.4      114.0        9.4     0.0     0.0 
1 1 1   23   23   35 o    222.0    4.9  493.5772  21.7097   493.5772  21.7097   493.5772  21.7097      222.0      4.9      222.0        4.9     0.0     0.0 
1 1 1   23   23   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   23   37 o    340.5    3.9 1160.1937  26.8179  1160.1937  26.8179  1160.1937  26.8179      340.5      3.9      340.5        3.9     0.0     0.0 
1 1 1   23   23   38 o     14.1   10.6  -74.7070  22.9868   -74.7070  22.9868   -74.7070  22.9868       14.1     10.6       14.1       10.6     0.0     0.0 
1 1 1   23   23   39 o    129.5    7.9  169.8468  20.4327   169.8468  20.4327   169.8468  20.4327      129.5      7.9      129.5        7.9     0.0     0.0 
1 1 1   23   23   40 o    296.3    4.0  878.6058  23.6253   878.6058  23.6253   878.6058  23.6253      296.3      4.0      296.3        4.0     0.0     0.0 
1 1 1   23   23   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   23   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   23   43 o     40.2   22.2   22.9868  25.5409    22.9868  25.5409    22.9868  25.5409       40.2     22.2       40.2       22.2     0.0     0.0 
1 1 1   23   23   44 o    780.7    4.3 6098.5200  67.0448  6098.5200  67.0448  6098.5200  67.0448      780.7      4.3      780.7        4.3     0.0     0.0 
1 1 1   23   23   45 o    210.9    6.1  446.3266  25.5409   446.3266  25.5409   446.3266  25.5409      210.9      6.1      210.9        6.1     0.0     0.0 
1 1 1   23   23   46 f    224.1    5.8  503.7936  26.1794   503.7936  26.1794   503.7936  26.1794      224.1      5.8      224.1        5.8     0.0     0.0 
1 1 1   23   23   47 o     23.7   16.3  -14.6860  24.2638   -14.6860  24.2638   -14.6860  24.2638       23.7     16.3       23.7       16.3     0.0     0.0 
1 1 1   23   23   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   23   23   49 o    288.0    4.8  830.7167  27.4564   830.7167  27.4564   830.7167  27.4564      288.0      4.8      288.0        4.8     0.0     0.0 
1 1 1   23   23   50 o     20.7   14.7  -28.0950  24.2638   -28.0950  24.2638   -28.0950  24.2638       20.7     14.7       20.7       14.7     0.0     0.0 
1 1 1   23   23   51 f     20.7   14.8  -32.5646  25.5409   -32.5646  25.5409   -32.5646  25.5409       20.7     14.8       20.7       14.8     0.0     0.0 
1 1 1   23   23   52 o     17.5   12.8  -51.7203  24.9023   -51.7203  24.9023   -51.7203  24.9023       17.5     12.8       17.5       12.8     0.0     0.0 
1 1 1   23   23   53 o     20.0   14.4  -38.9498  26.1794   -38.9498  26.1794   -38.9498  26.1794       20.0     14.4       20.0       14.4     0.0     0.0 
1 1 1   23   23   54 f    120.6   10.8  149.4141  25.5409   149.4141  25.5409   149.4141  25.5409      120.6     10.8      120.6       10.8     0.0     0.0 
1 1 1   23   23   55 o     19.4   14.2  -56.8284  29.3720   -56.8284  29.3720   -56.8284  29.3720       19.4     14.2       19.4       14.2     0.0     0.0 
1 1 1   23   23   56 o     24.7   17.0  -15.3245  26.1794   -15.3245  26.1794   -15.3245  26.1794       24.7     17.0       24.7       17.0     0.0     0.0 
1 1 1   23   23   57 o     26.0   17.9  -15.9630  28.7335   -15.9630  28.7335   -15.9630  28.7335       26.0     17.9       26.0       17.9     0.0     0.0 
1 1 1   23   23   58 o     24.5   17.2  -28.0950  30.6490   -28.0950  30.6490   -28.0950  30.6490       24.5     17.2       24.5       17.2     0.0     0.0 
1 1 1   23   23   59 o     28.6   19.0   -5.1082  28.0950    -5.1082  28.0950    -5.1082  28.0950       28.6     19.0       28.6       19.0     0.0     0.0 
1 1 1   23   23   60 o     33.6   20.8   10.2163  26.8179    10.2163  26.8179    10.2163  26.8179       33.6     20.8       33.6       20.8     0.0     0.0 
1 1 1   23   23   61 o    164.9    8.4  275.2028  27.4564   275.2028  27.4564   275.2028  27.4564      164.9      8.4      164.9        8.4     0.0     0.0 
1 1 1   23   23   62 o     23.0   16.3  -31.9261  29.3720   -31.9261  29.3720   -31.9261  29.3720       23.0     16.3       23.0       16.3     0.0     0.0 
1 1 1   23   23   63 o     21.6   15.5  -33.2031  27.4564   -33.2031  27.4564   -33.2031  27.4564       21.6     15.5       21.6       15.5     0.0     0.0 
1 1 1   23   23   64 o     49.3   24.2   37.6728  28.0950    37.6728  28.0950    37.6728  28.0950       49.3     24.2       49.3       24.2     0.0     0.0 
1 1 1   23   23   65 o    254.0    5.7  648.0994  28.7335   648.0994  28.7335   648.0994  28.7335      254.0      5.7      254.0        5.7     0.0     0.0 
1 1 1   23   23   66 o     96.4   13.6   97.6938  25.5409    97.6938  25.5409    97.6938  25.5409       96.4     13.6       96.4       13.6     0.0     0.0 
1 1 1   24    0    0 o    338.1    3.5 1143.5923  23.6253  1143.5923  23.6253  1143.5923  23.6253      338.1      3.5      338.1        3.5     0.0     0.0 
1 1 1   24    0    1 o    402.3    2.5 1618.6523  20.4327  1618.6523  20.4327  1618.6523  20.4327      402.3      2.5      402.3        2.5     0.0     0.0 
1 1 1   24    0    2 o    672.1    3.8 4518.1787  50.4432  4518.1787  50.4432  4518.1787  50.4432      672.1      3.8      672.1        3.8     0.0     0.0 
1 1 1   24    0    3 o    354.5    2.6 1256.6106  18.5171  1256.6106  18.5171  1256.6106  18.5171      354.5      2.6      354.5        2.6     0.0     0.0 
1 1 1   24    0    4 o    211.7    2.4  448.2422  10.2163   448.2422  10.2163   448.2422  10.2163      211.7      2.4      211.7        2.4     0.0     0.0 
1 1 1   24    0    5 o    416.0    2.7 1730.3936  22.3483  1730.3936  22.3483  1730.3936  22.3483      416.0      2.7      416.0        2.7     0.0     0.0 
1 1 1   24    0    6 o    561.3    3.2 3151.1042  36.3957  3151.1042  36.3957  3151.1042  36.3957      561.3      3.2      561.3        3.2     0.0     0.0 
1 1 1   24    0    7 o    413.7    2.7 1711.8765  22.3483  1711.8765  22.3483  1711.8765  22.3483      413.7      2.7      413.7        2.7     0.0     0.0 
1 1 1   24    0    8 o     53.5    8.2   30.0105   8.3008    30.0105   8.3008    30.0105   8.3008       53.5      8.2       53.5        8.2     0.0     0.0 
1 1 1   24    0    9 o    167.5    3.6  280.9495  12.1319   280.9495  12.1319   280.9495  12.1319      167.5      3.6      167.5        3.6     0.0     0.0 
1 1 1   24    0   10 o   1199.8    5.9 14396.1094 141.7518 14396.1094 141.7518 14396.1094 141.7518     1199.8      5.9     1199.8        5.9     0.0     0.0 
1 1 1   24    0   11 f    689.3    3.7 4751.8779  51.0817  4751.8779  51.0817  4751.8779  51.0817      689.3      3.7      689.3        3.7     0.0     0.0 
1 1 1   24    0   12 f    553.7    3.5 3066.1809  38.9498  3066.1809  38.9498  3066.1809  38.9498      553.7      3.5      553.7        3.5     0.0     0.0 
1 1 1   24    0   13 o   1176.0    6.2 13832.2939 146.8600 13832.2939 146.8600 13832.2939 146.8600     1176.0      6.2     1176.0        6.2     0.0     0.0 
1 1 1   24    0   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    0   15 o   1459.9    6.9 21317.0449 200.4958 21317.0449 200.4958 21317.0449 200.4958     1459.9      6.9     1459.9        6.9     0.0     0.0 
1 1 1   24    0   16 o    178.6    3.8  319.2608  13.4090   319.2608  13.4090   319.2608  13.4090      178.6      3.8      178.6        3.8     0.0     0.0 
1 1 1   24    0   17 o   1866.0    9.0 34826.8828 336.5009 34826.8828 336.5009 34826.8828 336.5009     1866.0      9.0     1866.0        9.0     0.0     0.0 
1 1 1   24    0   18 o   1117.8    6.0 12495.8682 134.0895 12495.8682 134.0895 12495.8682 134.0895     1117.8      6.0     1117.8        6.0     0.0     0.0 
1 1 1   24    0   19 o    957.0    5.0 9158.9541  95.7782  9158.9541  95.7782  9158.9541  95.7782      957.0      5.0      957.0        5.0     0.0     0.0 
1 1 1   24    0   20 o     88.5    6.9   79.8152  12.1319    79.8152  12.1319    79.8152  12.1319       88.5      6.9       88.5        6.9     0.0     0.0 
1 1 1   24    0   21 f   2084.8    9.5 43471.1914 397.7990 43471.1914 397.7990 43471.1914 397.7990     2084.8      9.5     2084.8        9.5     0.0     0.0 
1 1 1   24    0   22 o    374.7    3.1 1404.1090  22.9868  1404.1090  22.9868  1404.1090  22.9868      374.7      3.1      374.7        3.1     0.0     0.0 
1 1 1   24    0   23 o    605.3    3.7 3663.8369  45.3350  3663.8369  45.3350  3663.8369  45.3350      605.3      3.7      605.3        3.7     0.0     0.0 
1 1 1   24    0   24 o    366.4    3.5 1342.8110  25.5409  1342.8110  25.5409  1342.8110  25.5409      366.4      3.5      366.4        3.5     0.0     0.0 
1 1 1   24    0   25 o    600.8    3.6 3610.2014  43.4195  3610.2014  43.4195  3610.2014  43.4195      600.8      3.6      600.8        3.6     0.0     0.0 
1 1 1   24    0   26 o    875.6    4.8 7668.0063  84.2849  7668.0063  84.2849  7668.0063  84.2849      875.6      4.8      875.6        4.8     0.0     0.0 
1 1 1   24    0   27 o   1103.1    5.7 12169.5840 125.1502 12169.5840 125.1502 12169.5840 125.1502     1103.1      5.7     1103.1        5.7     0.0     0.0 
1 1 1   24    0   28 o   1585.8    7.8 25152.6445 248.3849 25152.6445 248.3849 25152.6445 248.3849     1585.8      7.8     1585.8        7.8     0.0     0.0 
1 1 1   24    0   29 o    549.5    4.1 3020.2073  45.3350  3020.2073  45.3350  3020.2073  45.3350      549.5      4.1      549.5        4.1     0.0     0.0 
1 1 1   24    0   30 o    639.3    3.9 4087.1768  50.4432  4087.1768  50.4432  4087.1768  50.4432      639.3      3.9      639.3        3.9     0.0     0.0 
1 1 1   24    0   31 f    915.2    5.4 8376.7656  99.6094  8376.7656  99.6094  8376.7656  99.6094      915.2      5.4      915.2        5.4     0.0     0.0 
1 1 1   24    0   32 o    596.6    3.7 3559.7581  44.6965  3559.7581  44.6965  3559.7581  44.6965      596.6      3.7      596.6        3.7     0.0     0.0 
1 1 1   24    0   33 o    255.1    4.1  651.2921  21.0712   651.2921  21.0712   651.2921  21.0712      255.1      4.1      255.1        4.1     0.0     0.0 
1 1 1   24    0   34 o    624.2    5.6 3897.5361  70.2374  3897.5361  70.2374  3897.5361  70.2374      624.2      5.6      624.2        5.6     0.0     0.0 
1 1 1   24    0   35 o    211.3    5.6  447.6036  23.6253   447.6036  23.6253   447.6036  23.6253      211.3      5.6      211.3        5.6     0.0     0.0 
1 1 1   24    0   36 o   1277.3    6.4 16319.3359 164.7386 16319.3359 164.7386 16319.3359 164.7386     1277.3      6.4     1277.3        6.4     0.0     0.0 
1 1 1   24    0   37 o     20.1   15.0 -148.1370  45.9736  -148.1370  45.9736  -148.1370  45.9736       20.1     15.0       20.1       15.0     0.0     0.0 
1 1 1   24    0   38 o   1030.3    5.4 10617.9766 111.1028 10617.9766 111.1028 10617.9766 111.1028     1030.3      5.4     1030.3        5.4     0.0     0.0 
1 1 1   24    0   39 o    421.3    4.3 1775.7286  36.3957  1775.7286  36.3957  1775.7286  36.3957      421.3      4.3      421.3        4.3     0.0     0.0 
1 1 1   24    0   40 o    547.3    3.8 2995.9436  41.5039  2995.9436  41.5039  2995.9436  41.5039      547.3      3.8      547.3        3.8     0.0     0.0 
1 1 1   24    0   41 o    344.5    4.1 1187.6503  28.0950  1187.6503  28.0950  1187.6503  28.0950      344.5      4.1      344.5        4.1     0.0     0.0 
1 1 1   24    0   42 o    383.2    3.9 1469.2383  30.0105  1469.2383  30.0105  1469.2383  30.0105      383.2      3.9      383.2        3.9     0.0     0.0 
1 1 1   24    0   43 o    604.9    3.9 3660.0061  47.2506  3660.0061  47.2506  3660.0061  47.2506      604.9      3.9      604.9        3.9     0.0     0.0 
1 1 1   24    0   44 o    237.4    5.4  564.4531  25.5409   564.4531  25.5409   564.4531  25.5409      237.4      5.4      237.4        5.4     0.0     0.0 
1 1 1   24    0   45 o    148.9   10.0  224.7596  29.3720   224.7596  29.3720   224.7596  29.3720      148.9     10.0      148.9       10.0     0.0     0.0 
1 1 1   24    0   46 o   1167.9    5.9 13645.2070 136.6436 13645.2070 136.6436 13645.2070 136.6436     1167.9      5.9     1167.9        5.9     0.0     0.0 
1 1 1   24    0   47 o    396.5    3.8 1572.6788  30.0105  1572.6788  30.0105  1572.6788  30.0105      396.5      3.8      396.5        3.8     0.0     0.0 
1 1 1   24    0   48 o    638.0    3.9 4071.8525  49.8047  4071.8525  49.8047  4071.8525  49.8047      638.0      3.9      638.0        3.9     0.0     0.0 
1 1 1   24    0   49 o     31.6   20.7   -1.9156  31.2876    -1.9156  31.2876    -1.9156  31.2876       31.6     20.7       31.6       20.7     0.0     0.0 
1 1 1   24    0   50 o    869.5    4.6 7563.2886  79.8152  7563.2886  79.8152  7563.2886  79.8152      869.5      4.6      869.5        4.6     0.0     0.0 
1 1 1   24    0   51 o    210.3    6.1  443.7725  25.5409   443.7725  25.5409   443.7725  25.5409      210.3      6.1      210.3        6.1     0.0     0.0 
1 1 1   24    0   52 f    554.8    3.8 3079.5898  42.1424  3079.5898  42.1424  3079.5898  42.1424      554.8      3.8      554.8        3.8     0.0     0.0 
1 1 1   24    0   53 o    111.5   11.4  128.3428  24.9023   128.3428  24.9023   128.3428  24.9023      111.5     11.4      111.5       11.4     0.0     0.0 
1 1 1   24    0   54 o     17.9   13.1  -51.7203  25.5409   -51.7203  25.5409   -51.7203  25.5409       17.9     13.1       17.9       13.1     0.0     0.0 
1 1 1   24    0   55 o    156.4    8.6  247.1079  26.8179   247.1079  26.8179   247.1079  26.8179      156.4      8.6      156.4        8.6     0.0     0.0 
1 1 1   24    0   56 f    170.6    8.5  293.7199  28.7335   293.7199  28.7335   293.7199  28.7335      170.6      8.5      170.6        8.5     0.0     0.0 
1 1 1   24    0   57 o    268.5    5.4  722.1680  28.7335   722.1680  28.7335   722.1680  28.7335      268.5      5.4      268.5        5.4     0.0     0.0 
1 1 1   24    0   58 o    233.3    6.3  545.9360  29.3720   545.9360  29.3720   545.9360  29.3720      233.3      6.3      233.3        6.3     0.0     0.0 
1 1 1   24    0   59 o    316.1    4.3  999.9249  27.4564   999.9249  27.4564   999.9249  27.4564      316.1      4.3      316.1        4.3     0.0     0.0 
1 1 1   24    0   60 o     17.3   12.8  -63.2136  26.8179   -63.2136  26.8179   -63.2136  26.8179       17.3     12.8       17.3       12.8     0.0     0.0 
1 1 1   24    0   61 o    111.9   12.2  130.2584  26.8179   130.2584  26.8179   130.2584  26.8179      111.9     12.2      111.9       12.2     0.0     0.0 
1 1 1   24    0   62 o     74.5   20.4   67.0448  26.1794    67.0448  26.1794    67.0448  26.1794       74.5     20.4       74.5       20.4     0.0     0.0 
1 1 1   24    0   63 o    252.2    5.7  637.8831  28.7335   637.8831  28.7335   637.8831  28.7335      252.2      5.7      252.2        5.7     0.0     0.0 
1 1 1   24    0   64 o     18.1   13.3  -62.5751  28.0950   -62.5751  28.0950   -62.5751  28.0950       18.1     13.3       18.1       13.3     0.0     0.0 
1 1 1   24    0   65 o     17.6   13.0  -63.8522  27.4564   -63.8522  27.4564   -63.8522  27.4564       17.6     13.0       17.6       13.0     0.0     0.0 
1 1 1   24    0   66 o     69.0   22.5   61.2981  27.4564    61.2981  27.4564    61.2981  27.4564       69.0     22.5       69.0       22.5     0.0     0.0 
1 1 1   24    0   67 o     16.7   12.4  -68.9603  26.8179   -68.9603  26.8179   -68.9603  26.8179       16.7     12.4       16.7       12.4     0.0     0.0 
1 1 1   24    0   68 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    0   69 o    337.5    4.4 1140.3997  30.0105  1140.3997  30.0105  1140.3997  30.0105      337.5      4.4      337.5        4.4     0.0     0.0 
1 1 1   24    0   70 f    241.0    6.6  583.6088  31.9261   583.6088  31.9261   583.6088  31.9261      241.0      6.6      241.0        6.6     0.0     0.0 
1 1 1   24    0   71 o     28.9   19.4   -8.9393  30.6490    -8.9393  30.6490    -8.9393  30.6490       28.9     19.4       28.9       19.4     0.0     0.0 
1 1 1   24    0   72 o     76.7   23.0   74.0685  30.6490    74.0685  30.6490    74.0685  30.6490       76.7     23.0       76.7       23.0     0.0     0.0 
1 1 1   24    0   73 o     36.2   22.4   12.1319  31.2876    12.1319  31.2876    12.1319  31.2876       36.2     22.4       36.2       22.4     0.0     0.0 
1 1 1   24    0   74 o     70.0   22.3   63.2136  27.4564    63.2136  27.4564    63.2136  27.4564       70.0     22.3       70.0       22.3     0.0     0.0 
1 1 1   24    0   75 o    150.7    9.8  231.7833  29.3720   231.7833  29.3720   231.7833  29.3720      150.7      9.8      150.7        9.8     0.0     0.0 
1 1 1   24    0   76 o     37.6   22.7   16.6016  30.6490    16.6016  30.6490    16.6016  30.6490       37.6     22.7       37.6       22.7     0.0     0.0 
1 1 1   24    0   77 o    213.5    7.6  460.3741  32.5646   460.3741  32.5646   460.3741  32.5646      213.5      7.6      213.5        7.6     0.0     0.0 
1 1 1   24    1    0 o    622.4    3.5 3874.5491  43.4195  3874.5491  43.4195  3874.5491  43.4195      622.4      3.5      622.4        3.5     0.0     0.0 
1 1 1   24    1    1 o    443.1    2.0    0.0000   0.0000          ?        ?  1963.4540  17.8786          ?        ?      443.1        2.0       ?       ? 
1 1 1   24    1    2 o   1271.6    4.3    0.0000   0.0000          ?        ? 16169.9209 110.4642          ?        ?     1271.6        4.3       ?       ? 
1 1 1   24    1    3 o    667.1    2.6    0.0000   0.0000          ?        ?  4449.8574  34.4802          ?        ?      667.1        2.6       ?       ? 
1 1 1   24    1    4 o    497.3    2.1    0.0000   0.0000          ?        ?  2472.9941  20.4327          ?        ?      497.3        2.1       ?       ? 
1 1 1   24    1    5 o    813.8    2.9    0.0000   0.0000          ?        ?  6623.3853  47.8891          ?        ?      813.8        2.9       ?       ? 
1 1 1   24    1    6 o    448.8    2.1    0.0000   0.0000          ?        ?  2014.5358  18.5171          ?        ?      448.8        2.1       ?       ? 
1 1 1   24    1    7 o   1988.2    6.5    0.0000   0.0000          ?        ? 39535.3438 259.8783          ?        ?     1988.2        6.5       ?       ? 
1 1 1   24    1    8 o    357.9    1.9    0.0000   0.0000          ?        ?  1280.8744  13.4090          ?        ?      357.9        1.9       ?       ? 
1 1 1   24    1    9 o   1029.9    3.6    0.0000   0.0000          ?        ? 10606.4824  74.7070          ?        ?     1029.9        3.6       ?       ? 
1 1 1   24    1   10 o     29.0   10.8    0.0000   0.0000          ?        ?     6.3852   8.3008          ?        ?       29.0       10.8       ?       ? 
1 1 1   24    1   11 o    751.8    3.1    0.0000   0.0000          ?        ?  5652.1934  45.9736          ?        ?      751.8        3.1       ?       ? 
1 1 1   24    1   12 o    528.2    2.3    0.0000   0.0000          ?        ?  2790.3396  24.2638          ?        ?      528.2        2.3       ?       ? 
1 1 1   24    1   13 o    382.1    2.1    0.0000   0.0000          ?        ?  1459.6605  15.9630          ?        ?      382.1        2.1       ?       ? 
1 1 1   24    1   14 o   1200.4    4.1    0.0000   0.0000          ?        ? 14410.7939  98.9709          ?        ?     1200.4        4.1       ?       ? 
1 1 1   24    1   15 o    358.2    2.1    0.0000   0.0000          ?        ?  1282.7899  14.6860          ?        ?      358.2        2.1       ?       ? 
1 1 1   24    1   16 o    893.0    3.2    0.0000   0.0000          ?        ?  7974.4966  57.4669          ?        ?      893.0        3.2       ?       ? 
1 1 1   24    1   17 o   1385.9    5.1    0.0000   0.0000          ?        ? 19208.0078 142.3903          ?        ?     1385.9        5.1       ?       ? 
1 1 1   24    1   18 o   1597.0    5.3    0.0000   0.0000          ?        ? 25507.6621 169.8468          ?        ?     1597.0        5.3       ?       ? 
1 1 1   24    1   19 o   1002.6    3.6    0.0000   0.0000          ?        ? 10052.8848  71.5144          ?        ?     1002.6        3.6       ?       ? 
1 1 1   24    1   20 o    829.7    3.0    0.0000   0.0000          ?        ?  6883.9014  49.8047          ?        ?      829.7        3.0       ?       ? 
1 1 1   24    1   21 o    607.1    2.4    0.0000   0.0000          ?        ?  3686.1853  29.3720          ?        ?      607.1        2.4       ?       ? 
1 1 1   24    1   22 o    958.6    3.4    0.0000   0.0000          ?        ?  9188.9648  65.7677          ?        ?      958.6        3.4       ?       ? 
1 1 1   24    1   23 o   1521.7    5.1    0.0000   0.0000          ?        ? 23158.5410 154.5222          ?        ?     1521.7        5.1       ?       ? 
1 1 1   24    1   24 o   1527.0    5.1    0.0000   0.0000          ?        ? 23318.8105 156.4378          ?        ?     1527.0        5.1       ?       ? 
1 1 1   24    1   25 o    911.9    3.4    0.0000   0.0000          ?        ?  8315.4678  62.5751          ?        ?      911.9        3.4       ?       ? 
1 1 1   24    1   26 o    706.2    2.9    0.0000   0.0000          ?        ?  4987.4922  41.5039          ?        ?      706.2        2.9       ?       ? 
1 1 1   24    1   27 o   2203.0    7.2    0.0000   0.0000          ?        ? 48541.6914 316.0682          ?        ?     2203.0        7.2       ?       ? 
1 1 1   24    1   28 o    888.1    3.5    0.0000   0.0000          ?        ?  7888.2964  61.2981          ?        ?      888.1        3.5       ?       ? 
1 1 1   24    1   29 o    688.9    3.7    0.0000   0.0000          ?        ?  4745.4927  50.4432          ?        ?      688.9        3.7       ?       ? 
1 1 1   24    1   30 o    213.5    3.7    0.0000   0.0000          ?        ?   455.9044  15.9630          ?        ?      213.5        3.7       ?       ? 
1 1 1   24    1   31 o   1276.1    4.6    0.0000   0.0000          ?        ? 16284.8545 116.8494          ?        ?     1276.1        4.6       ?       ? 
1 1 1   24    1   32 o    679.4    2.9    0.0000   0.0000          ?        ?  4615.8730  39.5883          ?        ?      679.4        2.9       ?       ? 
1 1 1   24    1   33 f    244.2    3.7    0.0000   0.0000          ?        ?   596.3792  17.8786          ?        ?      244.2        3.7       ?       ? 
1 1 1   24    1   34 o    875.9    3.4    0.0000   0.0000          ?        ?  7671.8374  58.7440          ?        ?      875.9        3.4       ?       ? 
1 1 1   24    1   35 o    171.7    4.8    0.0000   0.0000          ?        ?   294.9970  16.6016          ?        ?      171.7        4.8       ?       ? 
1 1 1   24    1   36 o    174.9    4.7    0.0000   0.0000          ?        ?   305.8519  16.6016          ?        ?      174.9        4.7       ?       ? 
1 1 1   24    1   37 o   1790.9    6.0    0.0000   0.0000          ?        ? 32082.5195 216.4588          ?        ?     1790.9        6.0       ?       ? 
1 1 1   24    1   38 o   1394.4    4.7    0.0000   0.0000          ?        ? 19446.1758 132.1740          ?        ?     1394.4        4.7       ?       ? 
1 1 1   24    1   39 o    652.7    3.0    0.0000   0.0000          ?        ?  4260.8545  39.5883          ?        ?      652.7        3.0       ?       ? 
1 1 1   24    1   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    1   41 o    953.2    3.5    0.0000   0.0000          ?        ?  9086.8008  66.4062          ?        ?      953.2        3.5       ?       ? 
1 1 1   24    1   42 o    867.2    3.3    0.0000   0.0000          ?        ?  7521.7847  56.8284          ?        ?      867.2        3.3       ?       ? 
1 1 1   24    1   43 o     23.6   11.5    0.0000   0.0000          ?        ?   -33.8416  17.8786          ?        ?       23.6       11.5       ?       ? 
1 1 1   24    1   44 o    473.5    2.8    0.0000   0.0000          ?        ?  2241.8494  26.1794          ?        ?      473.5        2.8       ?       ? 
1 1 1   24    1   45 o    358.7    2.9    0.0000   0.0000          ?        ?  1286.6211  21.0712          ?        ?      358.7        2.9       ?       ? 
1 1 1   24    1   46 o    509.3    2.8    0.0000   0.0000          ?        ?  2594.3132  28.0950          ?        ?      509.3        2.8       ?       ? 
1 1 1   24    1   47 o    466.0    2.7    0.0000   0.0000          ?        ?  2172.2507  24.9023          ?        ?      466.0        2.7       ?       ? 
1 1 1   24    1   48 o    697.3    2.9    0.0000   0.0000          ?        ?  4862.9805  40.8654          ?        ?      697.3        2.9       ?       ? 
1 1 1   24    1   49 o    346.2    3.2    0.0000   0.0000          ?        ?  1198.5051  22.3483          ?        ?      346.2        3.2       ?       ? 
1 1 1   24    1   50 f    297.0    3.2    0.0000   0.0000          ?        ?   882.4369  19.1556          ?        ?      297.0        3.2       ?       ? 
1 1 1   24    1   51 o     26.8   12.6    0.0000   0.0000          ?        ?   -18.5171  17.2401          ?        ?       26.8       12.6       ?       ? 
1 1 1   24    1   52 o    263.8    3.5    0.0000   0.0000          ?        ?   695.9886  18.5171          ?        ?      263.8        3.5       ?       ? 
1 1 1   24    1   53 o    343.8    3.0    0.0000   0.0000          ?        ?  1182.5420  20.4327          ?        ?      343.8        3.0       ?       ? 
1 1 1   24    1   54 o    387.6    2.8    0.0000   0.0000          ?        ?  1502.4414  21.7097          ?        ?      387.6        2.8       ?       ? 
1 1 1   24    1   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    1   56 o    605.1    2.9    0.0000   0.0000          ?        ?  3663.1987  35.1187          ?        ?      605.1        2.9       ?       ? 
1 1 1   24    1   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    1   58 o     37.1   15.3    0.0000   0.0000          ?        ?     3.8311  18.5171          ?        ?       37.1       15.3       ?       ? 
1 1 1   24    1   59 o    116.4    8.2    0.0000   0.0000          ?        ?   136.0051  19.1556          ?        ?      116.4        8.2       ?       ? 
1 1 1   24    1   60 o    149.1    6.2    0.0000   0.0000          ?        ?   222.8441  18.5171          ?        ?      149.1        6.2       ?       ? 
1 1 1   24    1   61 o    391.0    2.9    0.0000   0.0000          ?        ?  1529.2593  22.3483          ?        ?      391.0        2.9       ?       ? 
1 1 1   24    1   62 o    178.3    5.5    0.0000   0.0000          ?        ?   318.6223  19.7942          ?        ?      178.3        5.5       ?       ? 
1 1 1   24    1   63 o    196.9    5.0    0.0000   0.0000          ?        ?   388.2211  19.7942          ?        ?      196.9        5.0       ?       ? 
1 1 1   24    1   64 o    391.5    2.9    0.0000   0.0000          ?        ?  1533.7289  22.3483          ?        ?      391.5        2.9       ?       ? 
1 1 1   24    1   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    1   66 o    159.4    6.4    0.0000   0.0000          ?        ?   254.7701  20.4327          ?        ?      159.4        6.4       ?       ? 
1 1 1   24    1   67 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    1   68 o    152.7    7.3    0.0000   0.0000          ?        ?   234.3374  22.3483          ?        ?      152.7        7.3       ?       ? 
1 1 1   24    1   69 o    242.8    4.7    0.0000   0.0000          ?        ?   590.6325  22.9868          ?        ?      242.8        4.7       ?       ? 
1 1 1   24    1   70 o     63.9   17.5    0.0000   0.0000          ?        ?    43.4195  22.9868          ?        ?       63.9       17.5       ?       ? 
1 1 1   24    1   71 o    283.7    3.9    0.0000   0.0000          ?        ?   806.4528  22.3483          ?        ?      283.7        3.9       ?       ? 
1 1 1   24    1   72 o     32.1   14.6    0.0000   0.0000          ?        ?   -13.4090  21.0712          ?        ?       32.1       14.6       ?       ? 
1 1 1   24    1   73 o    107.7    9.5    0.0000   0.0000          ?        ?   117.4880  20.4327          ?        ?      107.7        9.5       ?       ? 
1 1 1   24    1   74 o     73.2   14.0    0.0000   0.0000          ?        ?    56.8284  19.7942          ?        ?       73.2       14.0       ?       ? 
1 1 1   24    1   75 o     29.2   13.8    0.0000   0.0000          ?        ?   -22.3483  21.0712          ?        ?       29.2       13.8       ?       ? 
1 1 1   24    1   76 o     25.5   12.6    0.0000   0.0000          ?        ?   -47.8891  22.9868          ?        ?       25.5       12.6       ?       ? 
1 1 1   24    2    0 o   1014.9    5.0 10300.6309 102.1635 10300.6309 102.1635 10300.6309 102.1635     1014.9      5.0     1014.9        5.0     0.0     0.0 
1 1 1   24    2    1 o    247.6    1.8    0.0000   0.0000          ?        ?   612.9808   8.9393          ?        ?      247.6        1.8       ?       ? 
1 1 1   24    2    2 o   1124.9    3.9    0.0000   0.0000          ?        ? 12654.2217  87.4775          ?        ?     1124.9        3.9       ?       ? 
1 1 1   24    2    3 o     88.3    3.6    0.0000   0.0000          ?        ?    77.8996   6.3852          ?        ?       88.3        3.6       ?       ? 
1 1 1   24    2    4 o   1324.1    4.5    0.0000   0.0000          ?        ? 17532.5273 120.0421          ?        ?     1324.1        4.5       ?       ? 
1 1 1   24    2    5 o    596.4    2.4    0.0000   0.0000          ?        ?  3557.2039  28.7335          ?        ?      596.4        2.4       ?       ? 
1 1 1   24    2    6 o    849.9    3.1    0.0000   0.0000          ?        ?  7223.5957  52.3588          ?        ?      849.9        3.1       ?       ? 
1 1 1   24    2    7 o   1044.7    3.7    0.0000   0.0000          ?        ? 10915.5273  76.6226          ?        ?     1044.7        3.7       ?       ? 
1 1 1   24    2    8 o   1851.7    6.3    0.0000   0.0000          ?        ? 34294.3555 234.9760          ?        ?     1851.7        6.3       ?       ? 
1 1 1   24    2    9 o    828.1    3.2    0.0000   0.0000          ?        ?  6857.7222  53.6358          ?        ?      828.1        3.2       ?       ? 
1 1 1   24    2   10 o    896.2    3.3    0.0000   0.0000          ?        ?  8031.3252  60.0210          ?        ?      896.2        3.3       ?       ? 
1 1 1   24    2   11 o    623.9    2.5    0.0000   0.0000          ?        ?  3892.4277  31.2876          ?        ?      623.9        2.5       ?       ? 
1 1 1   24    2   12 o    676.8    2.6    0.0000   0.0000          ?        ?  4580.7544  35.1187          ?        ?      676.8        2.6       ?       ? 
1 1 1   24    2   13 o   1187.4    4.1    0.0000   0.0000          ?        ? 14100.4736  97.0553          ?        ?     1187.4        4.1       ?       ? 
1 1 1   24    2   14 o   1581.3    5.2    0.0000   0.0000          ?        ? 25007.6992 165.3771          ?        ?     1581.3        5.2       ?       ? 
1 1 1   24    2   15 o    897.0    3.4    0.0000   0.0000          ?        ?  8046.6494  60.6596          ?        ?      897.0        3.4       ?       ? 
1 1 1   24    2   16 o   1358.1    4.8    0.0000   0.0000          ?        ? 18446.2500 130.2584          ?        ?     1358.1        4.8       ?       ? 
1 1 1   24    2   17 o    809.2    3.0    0.0000   0.0000          ?        ?  6548.0391  48.5276          ?        ?      809.2        3.0       ?       ? 
1 1 1   24    2   18 o    641.9    2.5    0.0000   0.0000          ?        ?  4121.0186  32.5646          ?        ?      641.9        2.5       ?       ? 
1 1 1   24    2   19 o    647.3    2.6    0.0000   0.0000          ?        ?  4189.9790  33.2031          ?        ?      647.3        2.6       ?       ? 
1 1 1   24    2   20 o   1817.7    6.0    0.0000   0.0000          ?        ? 33045.4102 217.0974          ?        ?     1817.7        6.0       ?       ? 
1 1 1   24    2   21 o    819.6    3.1    0.0000   0.0000          ?        ?  6717.2476  50.4432          ?        ?      819.6        3.1       ?       ? 
1 1 1   24    2   22 o   1114.1    3.8    0.0000   0.0000          ?        ? 12412.8604  85.5619          ?        ?     1114.1        3.8       ?       ? 
1 1 1   24    2   23 o   1124.3    3.9    0.0000   0.0000          ?        ? 12641.4512  86.8389          ?        ?     1124.3        3.9       ?       ? 
1 1 1   24    2   24 o   1622.0    5.5    0.0000   0.0000          ?        ? 26312.1973 177.5090          ?        ?     1622.0        5.5       ?       ? 
1 1 1   24    2   25 o    603.7    2.6    0.0000   0.0000          ?        ?  3644.6814  31.9261          ?        ?      603.7        2.6       ?       ? 
1 1 1   24    2   26 o    914.9    3.3    0.0000   0.0000          ?        ?  8371.6572  60.6596          ?        ?      914.9        3.3       ?       ? 
1 1 1   24    2   27 o    451.8    2.6    0.0000   0.0000          ?        ?  2041.3538  23.6253          ?        ?      451.8        2.6       ?       ? 
1 1 1   24    2   28 o   2032.0    6.6    0.0000   0.0000          ?        ? 41300.2188 268.1791          ?        ?     2032.0        6.6       ?       ? 
1 1 1   24    2   29 o    319.2    2.8    0.0000   0.0000          ?        ?  1019.0806  17.8786          ?        ?      319.2        2.8       ?       ? 
1 1 1   24    2   30 o    430.3    2.4    0.0000   0.0000          ?        ?  1851.7128  21.0712          ?        ?      430.3        2.4       ?       ? 
1 1 1   24    2   31 o    876.2    3.4    0.0000   0.0000          ?        ?  7678.2227  60.0210          ?        ?      876.2        3.4       ?       ? 
1 1 1   24    2   32 o    622.9    2.9    0.0000   0.0000          ?        ?  3879.6572  35.7572          ?        ?      622.9        2.9       ?       ? 
1 1 1   24    2   33 o   1427.3    5.0    0.0000   0.0000          ?        ? 20373.3086 142.3903          ?        ?     1427.3        5.0       ?       ? 
1 1 1   24    2   34 o    309.2    3.1    0.0000   0.0000          ?        ?   955.8669  19.1556          ?        ?      309.2        3.1       ?       ? 
1 1 1   24    2   35 o    694.7    3.0    0.0000   0.0000          ?        ?  4826.5850  41.5039          ?        ?      694.7        3.0       ?       ? 
1 1 1   24    2   36 o    289.2    3.4    0.0000   0.0000          ?        ?   836.4633  19.7942          ?        ?      289.2        3.4       ?       ? 
1 1 1   24    2   37 o    502.9    2.5    0.0000   0.0000          ?        ?  2529.1841  25.5409          ?        ?      502.9        2.5       ?       ? 
1 1 1   24    2   38 o    484.1    2.8    0.0000   0.0000          ?        ?  2343.3743  27.4564          ?        ?      484.1        2.8       ?       ? 
1 1 1   24    2   39 o    993.2    3.7    0.0000   0.0000          ?        ?  9866.4355  72.7915          ?        ?      993.2        3.7       ?       ? 
1 1 1   24    2   40 o    275.3    3.1    0.0000   0.0000          ?        ?   757.9252  17.2401          ?        ?      275.3        3.1       ?       ? 
1 1 1   24    2   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    2   42 o    781.6    3.1    0.0000   0.0000          ?        ?  6110.0137  47.8891          ?        ?      781.6        3.1       ?       ? 
1 1 1   24    2   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    2   44 o    688.3    3.0    0.0000   0.0000          ?        ?  4737.8306  40.8654          ?        ?      688.3        3.0       ?       ? 
1 1 1   24    2   45 o    479.2    2.5    0.0000   0.0000          ?        ?  2296.1238  24.2638          ?        ?      479.2        2.5       ?       ? 
1 1 1   24    2   46 o    435.1    2.6    0.0000   0.0000          ?        ?  1893.2167  22.9868          ?        ?      435.1        2.6       ?       ? 
1 1 1   24    2   47 o    528.3    2.6    0.0000   0.0000          ?        ?  2791.6167  27.4564          ?        ?      528.3        2.6       ?       ? 
1 1 1   24    2   48 o    291.9    3.4    0.0000   0.0000          ?        ?   852.4264  19.7942          ?        ?      291.9        3.4       ?       ? 
1 1 1   24    2   49 o     31.7   14.0    0.0000   0.0000          ?        ?    -5.1082  17.2401          ?        ?       31.7       14.0       ?       ? 
1 1 1   24    2   50 o    327.6    2.9    0.0000   0.0000          ?        ?  1073.3549  19.1556          ?        ?      327.6        2.9       ?       ? 
1 1 1   24    2   51 o    388.8    2.8    0.0000   0.0000          ?        ?  1512.0193  21.7097          ?        ?      388.8        2.8       ?       ? 
1 1 1   24    2   52 o    199.5    4.6    0.0000   0.0000          ?        ?   398.4375  18.5171          ?        ?      199.5        4.6       ?       ? 
1 1 1   24    2   53 o    263.2    3.6    0.0000   0.0000          ?        ?   692.7960  19.1556          ?        ?      263.2        3.6       ?       ? 
1 1 1   24    2   54 o     26.6   12.5    0.0000   0.0000          ?        ?   -19.1556  17.2401          ?        ?       26.6       12.5       ?       ? 
1 1 1   24    2   55 o    462.2    2.8    0.0000   0.0000          ?        ?  2137.1321  25.5409          ?        ?      462.2        2.8       ?       ? 
1 1 1   24    2   56 o    273.2    3.9    0.0000   0.0000          ?        ?   747.0703  21.0712          ?        ?      273.2        3.9       ?       ? 
1 1 1   24    2   57 o     19.1    9.7    0.0000   0.0000          ?        ?   -65.7677  18.5171          ?        ?       19.1        9.7       ?       ? 
1 1 1   24    2   58 o    225.1    4.3    0.0000   0.0000          ?        ?   506.9862  19.1556          ?        ?      225.1        4.3       ?       ? 
1 1 1   24    2   59 o    363.7    3.2    0.0000   0.0000          ?        ?  1323.6554  22.9868          ?        ?      363.7        3.2       ?       ? 
1 1 1   24    2   60 o    271.1    3.8    0.0000   0.0000          ?        ?   735.5769  20.4327          ?        ?      271.1        3.8       ?       ? 
1 1 1   24    2   61 o    221.7    4.6    0.0000   0.0000          ?        ?   492.3002  20.4327          ?        ?      221.7        4.6       ?       ? 
1 1 1   24    2   62 o    190.6    5.9    0.0000   0.0000          ?        ?   363.9573  22.3483          ?        ?      190.6        5.9       ?       ? 
1 1 1   24    2   63 o    269.0    4.0    0.0000   0.0000          ?        ?   724.0836  21.7097          ?        ?      269.0        4.0       ?       ? 
1 1 1   24    2   64 o    284.8    3.7    0.0000   0.0000          ?        ?   811.5610  21.0712          ?        ?      284.8        3.7       ?       ? 
1 1 1   24    2   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    2   66 o    317.1    3.4    0.0000   0.0000          ?        ?  1006.3101  21.7097          ?        ?      317.1        3.4       ?       ? 
1 1 1   24    2   67 o    223.7    4.6    0.0000   0.0000          ?        ?   501.2395  20.4327          ?        ?      223.7        4.6       ?       ? 
1 1 1   24    2   68 o    211.2    4.8    0.0000   0.0000          ?        ?   446.9651  20.4327          ?        ?      211.2        4.8       ?       ? 
1 1 1   24    2   69 o     32.0   14.5    0.0000   0.0000          ?        ?   -10.2163  19.7942          ?        ?       32.0       14.5       ?       ? 
1 1 1   24    2   70 o    147.0    7.0    0.0000   0.0000          ?        ?   217.0974  20.4327          ?        ?      147.0        7.0       ?       ? 
1 1 1   24    2   71 o    182.9    5.8    0.0000   0.0000          ?        ?   335.8624  21.0712          ?        ?      182.9        5.8       ?       ? 
1 1 1   24    2   72 o    306.6    3.6    0.0000   0.0000          ?        ?   941.8194  22.3483          ?        ?      306.6        3.6       ?       ? 
1 1 1   24    2   73 o     22.3   11.1    0.0000   0.0000          ?        ?   -54.2743  20.4327          ?        ?       22.3       11.1       ?       ? 
1 1 1   24    2   74 o    193.5    5.4    0.0000   0.0000          ?        ?   376.0892  21.0712          ?        ?      193.5        5.4       ?       ? 
1 1 1   24    2   75 o     22.4   11.2    0.0000   0.0000          ?        ?   -52.9973  20.4327          ?        ?       22.4       11.2       ?       ? 
1 1 1   24    2   76 o     91.0   11.6    0.0000   0.0000          ?        ?    84.9234  21.0712          ?        ?       91.0       11.6       ?       ? 
1 1 1   24    3    0 o    511.1    3.1 2612.1919  31.2876  2612.1919  31.2876  2612.1919  31.2876      511.1      3.1      511.1        3.1     0.0     0.0 
1 1 1   24    3    1 o    218.5    1.9    0.0000   0.0000          ?        ?   477.6142   8.3008          ?        ?      218.5        1.9       ?       ? 
1 1 1   24    3    2 o    637.6    2.7    0.0000   0.0000          ?        ?  4064.8286  33.8416          ?        ?      637.6        2.7       ?       ? 
1 1 1   24    3    3 o   1525.6    5.3    0.0000   0.0000          ?        ? 23277.9453 162.8230          ?        ?     1525.6        5.3       ?       ? 
1 1 1   24    3    4 o    143.8    2.9    0.0000   0.0000          ?        ?   206.8810   8.3008          ?        ?      143.8        2.9       ?       ? 
1 1 1   24    3    5 o    456.1    2.2    0.0000   0.0000          ?        ?  2080.3035  19.7942          ?        ?      456.1        2.2       ?       ? 
1 1 1   24    3    6 o    406.9    2.0    0.0000   0.0000          ?        ?  1655.6865  16.6016          ?        ?      406.9        2.0       ?       ? 
1 1 1   24    3    7 o    491.1    2.3    0.0000   0.0000          ?        ?  2411.6963  22.3483          ?        ?      491.1        2.3       ?       ? 
1 1 1   24    3    8 o   1649.2    5.7    0.0000   0.0000          ?        ? 27200.3828 188.3639          ?        ?     1649.2        5.7       ?       ? 
1 1 1   24    3    9 o    659.4    2.6    0.0000   0.0000          ?        ?  4348.3325  34.4802          ?        ?      659.4        2.6       ?       ? 
1 1 1   24    3   10 o    591.4    2.4    0.0000   0.0000          ?        ?  3497.8213  28.0950          ?        ?      591.4        2.4       ?       ? 
1 1 1   24    3   11 o    510.4    2.2    0.0000   0.0000          ?        ?  2605.1682  22.3483          ?        ?      510.4        2.2       ?       ? 
1 1 1   24    3   12 o   1615.4    5.4    0.0000   0.0000          ?        ? 26097.0176 173.0394          ?        ?     1615.4        5.4       ?       ? 
1 1 1   24    3   13 o    909.6    3.4    0.0000   0.0000          ?        ?  8273.3242  61.2981          ?        ?      909.6        3.4       ?       ? 
1 1 1   24    3   14 o    598.5    2.6    0.0000   0.0000          ?        ?  3582.1064  31.2876          ?        ?      598.5        2.6       ?       ? 
1 1 1   24    3   15 f    562.6    2.5    0.0000   0.0000          ?        ?  3165.1519  28.0950          ?        ?      562.6        2.5       ?       ? 
1 1 1   24    3   16 o   1780.4    5.9    0.0000   0.0000          ?        ? 31703.2383 209.4351          ?        ?     1780.4        5.9       ?       ? 
1 1 1   24    3   17 o    865.5    3.1    0.0000   0.0000          ?        ?  7491.1353  54.2743          ?        ?      865.5        3.1       ?       ? 
1 1 1   24    3   18 o   1300.6    4.4    0.0000   0.0000          ?        ? 16916.9922 114.9339          ?        ?     1300.6        4.4       ?       ? 
1 1 1   24    3   19 o    855.9    3.1    0.0000   0.0000          ?        ?  7326.3975  52.9973          ?        ?      855.9        3.1       ?       ? 
1 1 1   24    3   20 o    485.6    2.4    0.0000   0.0000          ?        ?  2358.0603  22.9868          ?        ?      485.6        2.4       ?       ? 
1 1 1   24    3   21 o    482.9    2.3    0.0000   0.0000          ?        ?  2331.8811  22.3483          ?        ?      482.9        2.3       ?       ? 
1 1 1   24    3   22 o   1837.2    6.2    0.0000   0.0000          ?        ? 33758.6367 226.6752          ?        ?     1837.2        6.2       ?       ? 
1 1 1   24    3   23 o    460.8    2.4    0.0000   0.0000          ?        ?  2123.0845  21.7097          ?        ?      460.8        2.4       ?       ? 
1 1 1   24    3   24 o   1349.2    4.8    0.0000   0.0000          ?        ? 18206.1680 129.6199          ?        ?     1349.2        4.8       ?       ? 
1 1 1   24    3   25 o    924.0    3.4    0.0000   0.0000          ?        ?  8537.6729  62.5751          ?        ?      924.0        3.4       ?       ? 
1 1 1   24    3   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    3   27 f    986.9    3.8    0.0000   0.0000          ?        ?  9741.2861  74.7070          ?        ?      986.9        3.8       ?       ? 
1 1 1   24    3   28 o    799.4    3.0    0.0000   0.0000          ?        ?  6390.9629  48.5276          ?        ?      799.4        3.0       ?       ? 
1 1 1   24    3   29 o   1006.9    4.1    0.0000   0.0000          ?        ? 10139.0850  81.7308          ?        ?     1006.9        4.1       ?       ? 
1 1 1   24    3   30 o   1184.6    4.1    0.0000   0.0000          ?        ? 14034.0664  97.0553          ?        ?     1184.6        4.1       ?       ? 
1 1 1   24    3   31 o   1345.5    4.8    0.0000   0.0000          ?        ? 18105.2812 130.2584          ?        ?     1345.5        4.8       ?       ? 
1 1 1   24    3   32 o   1015.5    4.0    0.0000   0.0000          ?        ? 10314.0400  81.0922          ?        ?     1015.5        4.0       ?       ? 
1 1 1   24    3   33 o   1111.1    4.1    0.0000   0.0000          ?        ? 12346.4541  90.0316          ?        ?     1111.1        4.1       ?       ? 
1 1 1   24    3   34 o    400.0    2.5    0.0000   0.0000          ?        ?  1600.1353  19.7942          ?        ?      400.0        2.5       ?       ? 
1 1 1   24    3   35 o    306.3    2.8    0.0000   0.0000          ?        ?   937.9882  17.2401          ?        ?      306.3        2.8       ?       ? 
1 1 1   24    3   36 o     67.0   13.8    0.0000   0.0000          ?        ?    46.6121  17.8786          ?        ?       67.0       13.8       ?       ? 
1 1 1   24    3   37 o   1420.1    4.9    0.0000   0.0000          ?        ? 20171.5371 139.1977          ?        ?     1420.1        4.9       ?       ? 
1 1 1   24    3   38 o    845.9    3.4    0.0000   0.0000          ?        ?  7156.5508  56.8284          ?        ?      845.9        3.4       ?       ? 
1 1 1   24    3   39 o    686.8    2.8    0.0000   0.0000          ?        ?  4717.3975  38.3113          ?        ?      686.8        2.8       ?       ? 
1 1 1   24    3   40 o   1230.4    4.3    0.0000   0.0000          ?        ? 15141.2637 105.3561          ?        ?     1230.4        4.3       ?       ? 
1 1 1   24    3   41 o    610.2    2.8    0.0000   0.0000          ?        ?  3723.8582  33.8416          ?        ?      610.2        2.8       ?       ? 
1 1 1   24    3   42 o    659.5    2.8    0.0000   0.0000          ?        ?  4349.6094  37.0343          ?        ?      659.5        2.8       ?       ? 
1 1 1   24    3   43 o    494.2    2.6    0.0000   0.0000          ?        ?  2442.3452  25.5409          ?        ?      494.2        2.6       ?       ? 
1 1 1   24    3   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    3   45 o    244.2    3.7    0.0000   0.0000          ?        ?   596.3792  17.8786          ?        ?      244.2        3.7       ?       ? 
1 1 1   24    3   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    3   47 o    702.6    3.0    0.0000   0.0000          ?        ?  4937.6875  42.7809          ?        ?      702.6        3.0       ?       ? 
1 1 1   24    3   48 o    603.8    2.8    0.0000   0.0000          ?        ?  3646.5969  33.8416          ?        ?      603.8        2.8       ?       ? 
1 1 1   24    3   49 o     27.3   12.8    0.0000   0.0000          ?        ?   -19.1556  17.8786          ?        ?       27.3       12.8       ?       ? 
1 1 1   24    3   50 o    257.0    3.9    0.0000   0.0000          ?        ?   660.8699  19.7942          ?        ?      257.0        3.9       ?       ? 
1 1 1   24    3   51 o    293.4    3.4    0.0000   0.0000          ?        ?   861.3657  19.7942          ?        ?      293.4        3.4       ?       ? 
1 1 1   24    3   52 o    295.8    3.5    0.0000   0.0000          ?        ?   875.4132  20.4327          ?        ?      295.8        3.5       ?       ? 
1 1 1   24    3   53 o    429.7    2.7    0.0000   0.0000          ?        ?  1847.2430  23.6253          ?        ?      429.7        2.7       ?       ? 
1 1 1   24    3   54 o    522.9    2.7    0.0000   0.0000          ?        ?  2734.7881  28.7335          ?        ?      522.9        2.7       ?       ? 
1 1 1   24    3   55 o    306.2    3.5    0.0000   0.0000          ?        ?   937.9882  21.7097          ?        ?      306.2        3.5       ?       ? 
1 1 1   24    3   56 o    210.1    4.4    0.0000   0.0000          ?        ?   441.8569  18.5171          ?        ?      210.1        4.4       ?       ? 
1 1 1   24    3   57 o    388.0    2.9    0.0000   0.0000          ?        ?  1506.2725  22.3483          ?        ?      388.0        2.9       ?       ? 
1 1 1   24    3   58 o     93.0   10.0    0.0000   0.0000          ?        ?    86.8389  18.5171          ?        ?       93.0       10.0       ?       ? 
1 1 1   24    3   59 f    146.3    6.5    0.0000   0.0000          ?        ?   214.5433  19.1556          ?        ?      146.3        6.5       ?       ? 
1 1 1   24    3   60 o    332.3    3.2    0.0000   0.0000          ?        ?  1104.6425  21.0712          ?        ?      332.3        3.2       ?       ? 
1 1 1   24    3   61 o    423.0    2.8    0.0000   0.0000          ?        ?  1790.4146  23.6253          ?        ?      423.0        2.8       ?       ? 
1 1 1   24    3   62 o    342.5    3.2    0.0000   0.0000          ?        ?  1173.6028  21.7097          ?        ?      342.5        3.2       ?       ? 
1 1 1   24    3   63 o    186.9    5.3    0.0000   0.0000          ?        ?   349.9099  19.7942          ?        ?      186.9        5.3       ?       ? 
1 1 1   24    3   64 o     20.1   10.2    0.0000   0.0000          ?        ?   -76.6226  21.0712          ?        ?       20.1       10.2       ?       ? 
1 1 1   24    3   65 o    176.5    5.6    0.0000   0.0000          ?        ?   312.2371  19.7942          ?        ?      176.5        5.6       ?       ? 
1 1 1   24    3   66 o    130.5    7.8    0.0000   0.0000          ?        ?   171.1238  20.4327          ?        ?      130.5        7.8       ?       ? 
1 1 1   24    3   67 o    375.0    3.1    0.0000   0.0000          ?        ?  1407.3016  22.9868          ?        ?      375.0        3.1       ?       ? 
1 1 1   24    3   68 o    149.6    6.6    0.0000   0.0000          ?        ?   224.7596  19.7942          ?        ?      149.6        6.6       ?       ? 
1 1 1   24    3   69 o    192.7    5.5    0.0000   0.0000          ?        ?   372.2581  21.0712          ?        ?      192.7        5.5       ?       ? 
1 1 1   24    3   70 o    222.0    4.7    0.0000   0.0000          ?        ?   494.2158  21.0712          ?        ?      222.0        4.7       ?       ? 
1 1 1   24    3   71 o    107.2   10.1    0.0000   0.0000          ?        ?   116.2109  21.7097          ?        ?      107.2       10.1       ?       ? 
1 1 1   24    3   72 o     36.6   15.5    0.0000   0.0000          ?        ?     1.2770  19.7942          ?        ?       36.6       15.5       ?       ? 
1 1 1   24    3   73 o    155.3    6.6    0.0000   0.0000          ?        ?   242.6382  20.4327          ?        ?      155.3        6.6       ?       ? 
1 1 1   24    3   74 o     26.6   12.8    0.0000   0.0000          ?        ?   -28.0950  19.7942          ?        ?       26.6       12.8       ?       ? 
1 1 1   24    3   75 o     34.9   15.1    0.0000   0.0000          ?        ?    -0.6385  19.1556          ?        ?       34.9       15.1       ?       ? 
1 1 1   24    3   76 o    105.5    8.8    0.0000   0.0000          ?        ?   113.0183  18.5171          ?        ?      105.5        8.8       ?       ? 
1 1 1   24    4    0 o    786.5    4.2 6185.9976  66.4062  6185.9976  66.4062  6185.9976  66.4062      786.5      4.2      786.5        4.2     0.0     0.0 
1 1 1   24    4    1 o    675.7    2.6    0.0000   0.0000          ?        ?  4565.4297  35.7572          ?        ?      675.7        2.6       ?       ? 
1 1 1   24    4    2 o   1328.5    4.5    0.0000   0.0000          ?        ? 17651.2910 120.6806          ?        ?     1328.5        4.5       ?       ? 
1 1 1   24    4    3 o    826.6    3.1    0.0000   0.0000          ?        ?  6832.1816  51.7203          ?        ?      826.6        3.1       ?       ? 
1 1 1   24    4    4 o    546.5    2.5    0.0000   0.0000          ?        ?  2987.0042  26.8179          ?        ?      546.5        2.5       ?       ? 
1 1 1   24    4    5 o    269.1    2.0    0.0000   0.0000          ?        ?   724.0836  10.8549          ?        ?      269.1        2.0       ?       ? 
1 1 1   24    4    6 o    169.9    2.3    0.0000   0.0000          ?        ?   288.6118   7.6623          ?        ?      169.9        2.3       ?       ? 
1 1 1   24    4    7 o    521.9    2.3    0.0000   0.0000          ?        ?  2723.9333  24.2638          ?        ?      521.9        2.3       ?       ? 
1 1 1   24    4    8 o    266.0    2.0    0.0000   0.0000          ?        ?   707.4820  10.8549          ?        ?      266.0        2.0       ?       ? 
1 1 1   24    4    9 o   1531.3    5.2    0.0000   0.0000          ?        ? 23451.6230 159.6304          ?        ?     1531.3        5.2       ?       ? 
1 1 1   24    4   10 o    860.1    3.2    0.0000   0.0000          ?        ?  7397.9116  54.9129          ?        ?      860.1        3.2       ?       ? 
1 1 1   24    4   11 o   1027.1    3.7    0.0000   0.0000          ?        ? 10550.2930  76.6226          ?        ?     1027.1        3.7       ?       ? 
1 1 1   24    4   12 o    833.1    3.3    0.0000   0.0000          ?        ?  6940.0918  54.2743          ?        ?      833.1        3.3       ?       ? 
1 1 1   24    4   13 o   1319.0    4.6    0.0000   0.0000          ?        ? 17398.4375 122.5962          ?        ?     1319.0        4.6       ?       ? 
1 1 1   24    4   14 o   1717.5    5.9    0.0000   0.0000          ?        ? 29499.6992 203.6884          ?        ?     1717.5        5.9       ?       ? 
1 1 1   24    4   15 o    213.4    2.2    0.0000   0.0000          ?        ?   455.2659   9.5778          ?        ?      213.4        2.2       ?       ? 
1 1 1   24    4   16 o    584.6    2.5    0.0000   0.0000          ?        ?  3417.3679  28.7335          ?        ?      584.6        2.5       ?       ? 
1 1 1   24    4   17 o   1298.3    4.4    0.0000   0.0000          ?        ? 16857.6094 114.9339          ?        ?     1298.3        4.4       ?       ? 
1 1 1   24    4   18 o    552.7    2.4    0.0000   0.0000          ?        ?  3054.6875  26.1794          ?        ?      552.7        2.4       ?       ? 
1 1 1   24    4   19 o    782.3    2.9    0.0000   0.0000          ?        ?  6120.8682  45.9736          ?        ?      782.3        2.9       ?       ? 
1 1 1   24    4   20 o    846.4    3.1    0.0000   0.0000          ?        ?  7164.8511  52.9973          ?        ?      846.4        3.1       ?       ? 
1 1 1   24    4   21 o   1873.6    6.3    0.0000   0.0000          ?        ? 35107.1992 234.3374          ?        ?     1873.6        6.3       ?       ? 
1 1 1   24    4   22 o    495.9    2.4    0.0000   0.0000          ?        ?  2459.5854  23.6253          ?        ?      495.9        2.4       ?       ? 
1 1 1   24    4   23 o    381.0    2.5    0.0000   0.0000          ?        ?  1451.9982  19.1556          ?        ?      381.0        2.5       ?       ? 
1 1 1   24    4   24 o    293.1    2.5    0.0000   0.0000          ?        ?   858.8116  14.6860          ?        ?      293.1        2.5       ?       ? 
1 1 1   24    4   25 o   1708.3    6.1    0.0000   0.0000          ?        ? 29187.4629 206.8810          ?        ?     1708.3        6.1       ?       ? 
1 1 1   24    4   26 o   1122.5    4.0    0.0000   0.0000          ?        ? 12600.5859  89.3930          ?        ?     1122.5        4.0       ?       ? 
1 1 1   24    4   27 o    621.0    2.8    0.0000   0.0000          ?        ?  3856.0322  34.4802          ?        ?      621.0        2.8       ?       ? 
1 1 1   24    4   28 o   1147.5    4.2    0.0000   0.0000          ?        ? 13169.5088  96.4168          ?        ?     1147.5        4.2       ?       ? 
1 1 1   24    4   29 o    679.7    3.1    0.0000   0.0000          ?        ?  4620.3423  42.1424          ?        ?      679.7        3.1       ?       ? 
1 1 1   24    4   30 o   1313.6    4.7    0.0000   0.0000          ?        ? 17256.0469 122.5962          ?        ?     1313.6        4.7       ?       ? 
1 1 1   24    4   31 o     83.8   10.3    0.0000   0.0000          ?        ?    70.2374  17.2401          ?        ?       83.8       10.3       ?       ? 
1 1 1   24    4   32 o    676.8    2.7    0.0000   0.0000          ?        ?  4581.3926  37.0343          ?        ?      676.8        2.7       ?       ? 
1 1 1   24    4   33 o    760.2    3.0    0.0000   0.0000          ?        ?  5779.2593  45.3350          ?        ?      760.2        3.0       ?       ? 
1 1 1   24    4   34 o    862.8    3.5    0.0000   0.0000          ?        ?  7445.1621  60.6596          ?        ?      862.8        3.5       ?       ? 
1 1 1   24    4   35 o    242.5    3.8    0.0000   0.0000          ?        ?   588.0784  18.5171          ?        ?      242.5        3.8       ?       ? 
1 1 1   24    4   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    4   37 o    733.8    3.0    0.0000   0.0000          ?        ?  5385.2915  44.0580          ?        ?      733.8        3.0       ?       ? 
1 1 1   24    4   38 o    186.7    4.6    0.0000   0.0000          ?        ?   348.6328  17.2401          ?        ?      186.7        4.6       ?       ? 
1 1 1   24    4   39 o    724.3    3.1    0.0000   0.0000          ?        ?  5246.0938  44.6965          ?        ?      724.3        3.1       ?       ? 
1 1 1   24    4   40 o    304.8    3.2    0.0000   0.0000          ?        ?   929.0490  19.7942          ?        ?      304.8        3.2       ?       ? 
1 1 1   24    4   41 f    439.0    2.7    0.0000   0.0000          ?        ?  1927.0582  23.6253          ?        ?      439.0        2.7       ?       ? 
1 1 1   24    4   42 o    605.4    2.7    0.0000   0.0000          ?        ?  3665.7524  33.2031          ?        ?      605.4        2.7       ?       ? 
1 1 1   24    4   43 o    238.1    3.8    0.0000   0.0000          ?        ?   567.0072  17.8786          ?        ?      238.1        3.8       ?       ? 
1 1 1   24    4   44 o    508.2    2.5    0.0000   0.0000          ?        ?  2582.8201  25.5409          ?        ?      508.2        2.5       ?       ? 
1 1 1   24    4   45 o    655.0    2.8    0.0000   0.0000          ?        ?  4290.8652  36.3957          ?        ?      655.0        2.8       ?       ? 
1 1 1   24    4   46 o    264.9    3.5    0.0000   0.0000          ?        ?   701.7353  18.5171          ?        ?      264.9        3.5       ?       ? 
1 1 1   24    4   47 o    214.7    4.2    0.0000   0.0000          ?        ?   461.0126  17.8786          ?        ?      214.7        4.2       ?       ? 
1 1 1   24    4   48 o    540.9    2.7    0.0000   0.0000          ?        ?  2925.7061  28.7335          ?        ?      540.9        2.7       ?       ? 
1 1 1   24    4   49 o    224.8    4.0    0.0000   0.0000          ?        ?   505.7091  17.8786          ?        ?      224.8        4.0       ?       ? 
1 1 1   24    4   50 o    403.0    2.9    0.0000   0.0000          ?        ?  1624.3989  22.9868          ?        ?      403.0        2.9       ?       ? 
1 1 1   24    4   51 o    406.8    2.7    0.0000   0.0000          ?        ?  1655.0481  22.3483          ?        ?      406.8        2.7       ?       ? 
1 1 1   24    4   52 o    100.3    9.2    0.0000   0.0000          ?        ?   100.8864  18.5171          ?        ?      100.3        9.2       ?       ? 
1 1 1   24    4   53 o    501.4    2.7    0.0000   0.0000          ?        ?  2514.4980  27.4564          ?        ?      501.4        2.7       ?       ? 
1 1 1   24    4   54 o    359.4    3.0    0.0000   0.0000          ?        ?  1292.3677  21.7097          ?        ?      359.4        3.0       ?       ? 
1 1 1   24    4   55 o    398.0    2.8    0.0000   0.0000          ?        ?  1584.1722  22.3483          ?        ?      398.0        2.8       ?       ? 
1 1 1   24    4   56 o    116.2    8.0    0.0000   0.0000          ?        ?   135.3666  18.5171          ?        ?      116.2        8.0       ?       ? 
1 1 1   24    4   57 o    182.1    5.3    0.0000   0.0000          ?        ?   332.0312  19.1556          ?        ?      182.1        5.3       ?       ? 
1 1 1   24    4   58 o    517.1    2.7    0.0000   0.0000          ?        ?  2674.7671  28.0950          ?        ?      517.1        2.7       ?       ? 
1 1 1   24    4   59 o    103.3    9.3    0.0000   0.0000          ?        ?   107.2716  19.1556          ?        ?      103.3        9.3       ?       ? 
1 1 1   24    4   60 o    228.4    4.2    0.0000   0.0000          ?        ?   522.3107  19.1556          ?        ?      228.4        4.2       ?       ? 
1 1 1   24    4   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    4   62 o    281.8    3.7    0.0000   0.0000          ?        ?   794.9594  21.0712          ?        ?      281.8        3.7       ?       ? 
1 1 1   24    4   63 o    221.3    4.6    0.0000   0.0000          ?        ?   490.3846  20.4327          ?        ?      221.3        4.6       ?       ? 
1 1 1   24    4   64 o    242.0    4.1    0.0000   0.0000          ?        ?   586.1629  19.7942          ?        ?      242.0        4.1       ?       ? 
1 1 1   24    4   65 o    272.5    3.9    0.0000   0.0000          ?        ?   743.2392  21.0712          ?        ?      272.5        3.9       ?       ? 
1 1 1   24    4   66 o    269.8    3.9    0.0000   0.0000          ?        ?   728.5532  21.0712          ?        ?      269.8        3.9       ?       ? 
1 1 1   24    4   67 o     64.4   15.5    0.0000   0.0000          ?        ?    44.0580  19.7942          ?        ?       64.4       15.5       ?       ? 
1 1 1   24    4   68 o     40.7   16.4    0.0000   0.0000          ?        ?     8.3008  20.4327          ?        ?       40.7       16.4       ?       ? 
1 1 1   24    4   69 o     34.1   15.1    0.0000   0.0000          ?        ?    -6.3852  20.4327          ?        ?       34.1       15.1       ?       ? 
1 1 1   24    4   70 o    103.3   10.2    0.0000   0.0000          ?        ?   107.9102  21.0712          ?        ?      103.3       10.2       ?       ? 
1 1 1   24    4   71 f    296.8    3.9    0.0000   0.0000          ?        ?   882.4369  22.9868          ?        ?      296.8        3.9       ?       ? 
1 1 1   24    4   72 o    131.9    8.2    0.0000   0.0000          ?        ?   175.5934  21.7097          ?        ?      131.9        8.2       ?       ? 
1 1 1   24    4   73 o    209.6    5.3    0.0000   0.0000          ?        ?   441.2184  22.3483          ?        ?      209.6        5.3       ?       ? 
1 1 1   24    4   74 o    146.3    7.0    0.0000   0.0000          ?        ?   215.8203  20.4327          ?        ?      146.3        7.0       ?       ? 
1 1 1   24    4   75 o    240.1    4.5    0.0000   0.0000          ?        ?   578.5006  21.7097          ?        ?      240.1        4.5       ?       ? 
1 1 1   24    4   76 o    149.0    6.9    0.0000   0.0000          ?        ?   224.1211  20.4327          ?        ?      149.0        6.9       ?       ? 
1 1 1   24    5    0 o      9.4    7.0  -21.0712   8.3008   -21.0712   8.3008   -21.0712   8.3008        9.4      7.0        9.4        7.0     0.0     0.0 
1 1 1   24    5    1 o   1273.9    4.6    0.0000   0.0000          ?        ? 16228.0273 116.2109          ?        ?     1273.9        4.6       ?       ? 
1 1 1   24    5    2 o   2149.3    7.3    0.0000   0.0000          ?        ? 46203.4258 314.7912          ?        ?     2149.3        7.3       ?       ? 
1 1 1   24    5    3 o    682.1    2.8    0.0000   0.0000          ?        ?  4652.2686  38.3113          ?        ?      682.1        2.8       ?       ? 
1 1 1   24    5    4 o   1197.0    4.2    0.0000   0.0000          ?        ? 14329.7021 100.8864          ?        ?     1197.0        4.2       ?       ? 
1 1 1   24    5    5 o   1041.9    3.6    0.0000   0.0000          ?        ? 10855.5059  75.3456          ?        ?     1041.9        3.6       ?       ? 
1 1 1   24    5    6 o    382.0    2.0    0.0000   0.0000          ?        ?  1459.0220  15.3245          ?        ?      382.0        2.0       ?       ? 
1 1 1   24    5    7 o    981.0    3.6    0.0000   0.0000          ?        ?  9623.1592  70.2374          ?        ?      981.0        3.6       ?       ? 
1 1 1   24    5    8 o   1418.7    4.9    0.0000   0.0000          ?        ? 20127.4785 137.9207          ?        ?     1418.7        4.9       ?       ? 
1 1 1   24    5    9 o    406.4    2.1    0.0000   0.0000          ?        ?  1651.8555  17.2401          ?        ?      406.4        2.1       ?       ? 
1 1 1   24    5   10 o   1047.4    3.8    0.0000   0.0000          ?        ? 10971.7178  80.4537          ?        ?     1047.4        3.8       ?       ? 
1 1 1   24    5   11 o   1311.1    4.4    0.0000   0.0000          ?        ? 17191.5547 116.2109          ?        ?     1311.1        4.4       ?       ? 
1 1 1   24    5   12 o   1662.9    5.8    0.0000   0.0000          ?        ? 27655.6504 191.5565          ?        ?     1662.9        5.8       ?       ? 
1 1 1   24    5   13 o    821.0    3.2    0.0000   0.0000          ?        ?  6740.2344  52.3588          ?        ?      821.0        3.2       ?       ? 
1 1 1   24    5   14 o    578.4    2.4    0.0000   0.0000          ?        ?  3345.8533  28.0950          ?        ?      578.4        2.4       ?       ? 
1 1 1   24    5   15 o    839.7    3.1    0.0000   0.0000          ?        ?  7050.5557  51.7203          ?        ?      839.7        3.1       ?       ? 
1 1 1   24    5   16 o    415.2    2.2    0.0000   0.0000          ?        ?  1724.0084  17.8786          ?        ?      415.2        2.2       ?       ? 
1 1 1   24    5   17 o    956.9    3.4    0.0000   0.0000          ?        ?  9157.6768  65.7677          ?        ?      956.9        3.4       ?       ? 
1 1 1   24    5   18 o    938.8    3.4    0.0000   0.0000          ?        ?  8814.1523  64.4907          ?        ?      938.8        3.4       ?       ? 
1 1 1   24    5   19 o    354.8    2.2    0.0000   0.0000          ?        ?  1259.1647  15.9630          ?        ?      354.8        2.2       ?       ? 
1 1 1   24    5   20 o   1445.8    5.0    0.0000   0.0000          ?        ? 20906.4746 143.6674          ?        ?     1445.8        5.0       ?       ? 
1 1 1   24    5   21 o    968.0    3.6    0.0000   0.0000          ?        ?  9370.3047  68.9603          ?        ?      968.0        3.6       ?       ? 
1 1 1   24    5   22 f    859.1    3.3    0.0000   0.0000          ?        ?  7380.0332  56.1899          ?        ?      859.1        3.3       ?       ? 
1 1 1   24    5   23 o   1152.6    4.5    0.0000   0.0000          ?        ? 13286.9961 104.0790          ?        ?     1152.6        4.5       ?       ? 
1 1 1   24    5   24 o    246.9    3.0    0.0000   0.0000          ?        ?   609.7881  14.6860          ?        ?      246.9        3.0       ?       ? 
1 1 1   24    5   25 o    653.9    2.9    0.0000   0.0000          ?        ?  4275.5405  37.6728          ?        ?      653.9        2.9       ?       ? 
1 1 1   24    5   26 f   1475.1    5.2    0.0000   0.0000          ?        ? 21761.4570 151.9681          ?        ?     1475.1        5.2       ?       ? 
1 1 1   24    5   27 o    562.9    2.8    0.0000   0.0000          ?        ?  3168.3445  31.2876          ?        ?      562.9        2.8       ?       ? 
1 1 1   24    5   28 o    943.1    3.5    0.0000   0.0000          ?        ?  8895.2441  65.7677          ?        ?      943.1        3.5       ?       ? 
1 1 1   24    5   29 o    888.7    3.4    0.0000   0.0000          ?        ?  7898.5127  60.6596          ?        ?      888.7        3.4       ?       ? 
1 1 1   24    5   30 o     58.1   13.0    0.0000   0.0000          ?        ?    35.1187  14.6860          ?        ?       58.1       13.0       ?       ? 
1 1 1   24    5   31 o   1020.2    3.8    0.0000   0.0000          ?        ? 10407.9023  76.6226          ?        ?     1020.2        3.8       ?       ? 
1 1 1   24    5   32 o    438.3    2.7    0.0000   0.0000          ?        ?  1921.3115  23.6253          ?        ?      438.3        2.7       ?       ? 
1 1 1   24    5   33 o    546.1    2.9    0.0000   0.0000          ?        ?  2982.5347  31.2876          ?        ?      546.1        2.9       ?       ? 
1 1 1   24    5   34 o    609.8    2.7    0.0000   0.0000          ?        ?  3718.7500  33.2031          ?        ?      609.8        2.7       ?       ? 
1 1 1   24    5   35 o    443.2    2.7    0.0000   0.0000          ?        ?  1964.0925  24.2638          ?        ?      443.2        2.7       ?       ? 
1 1 1   24    5   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    5   37 o    353.6    2.7    0.0000   0.0000          ?        ?  1250.2253  19.1556          ?        ?      353.6        2.7       ?       ? 
1 1 1   24    5   38 o    257.7    3.3    0.0000   0.0000          ?        ?   664.0625  17.2401          ?        ?      257.7        3.3       ?       ? 
1 1 1   24    5   39 o    899.9    3.4    0.0000   0.0000          ?        ?  8099.6470  61.9366          ?        ?      899.9        3.4       ?       ? 
1 1 1   24    5   40 o    482.0    2.7    0.0000   0.0000          ?        ?  2323.5801  26.1794          ?        ?      482.0        2.7       ?       ? 
1 1 1   24    5   41 o    714.0    3.0    0.0000   0.0000          ?        ?  5099.2334  42.1424          ?        ?      714.0        3.0       ?       ? 
1 1 1   24    5   42 o    880.2    3.4    0.0000   0.0000          ?        ?  7748.4600  59.3825          ?        ?      880.2        3.4       ?       ? 
1 1 1   24    5   43 o    388.1    2.7    0.0000   0.0000          ?        ?  1506.2725  21.0712          ?        ?      388.1        2.7       ?       ? 
1 1 1   24    5   44 o    350.1    3.0    0.0000   0.0000          ?        ?  1225.9615  21.0712          ?        ?      350.1        3.0       ?       ? 
1 1 1   24    5   45 o    524.3    2.8    0.0000   0.0000          ?        ?  2748.8357  29.3720          ?        ?      524.3        2.8       ?       ? 
1 1 1   24    5   46 o    330.5    3.2    0.0000   0.0000          ?        ?  1092.5105  21.0712          ?        ?      330.5        3.2       ?       ? 
1 1 1   24    5   47 o    599.4    2.8    0.0000   0.0000          ?        ?  3593.5996  33.8416          ?        ?      599.4        2.8       ?       ? 
1 1 1   24    5   48 o    452.3    2.6    0.0000   0.0000          ?        ?  2046.4618  23.6253          ?        ?      452.3        2.6       ?       ? 
1 1 1   24    5   49 o     66.0   13.0    0.0000   0.0000          ?        ?    45.3350  16.6016          ?        ?       66.0       13.0       ?       ? 
1 1 1   24    5   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    5   51 o     25.1   12.1    0.0000   0.0000          ?        ?   -30.0105  18.5171          ?        ?       25.1       12.1       ?       ? 
1 1 1   24    5   52 o    435.6    2.6    0.0000   0.0000          ?        ?  1898.3247  22.9868          ?        ?      435.6        2.6       ?       ? 
1 1 1   24    5   53 o    422.6    2.7    0.0000   0.0000          ?        ?  1785.9451  22.9868          ?        ?      422.6        2.7       ?       ? 
1 1 1   24    5   54 o     86.3   10.0    0.0000   0.0000          ?        ?    74.7070  17.2401          ?        ?       86.3       10.0       ?       ? 
1 1 1   24    5   55 o    383.5    2.8    0.0000   0.0000          ?        ?  1471.1538  21.7097          ?        ?      383.5        2.8       ?       ? 
1 1 1   24    5   56 o    299.7    3.2    0.0000   0.0000          ?        ?   898.3999  19.1556          ?        ?      299.7        3.2       ?       ? 
1 1 1   24    5   57 o    265.3    3.9    0.0000   0.0000          ?        ?   704.2894  20.4327          ?        ?      265.3        3.9       ?       ? 
1 1 1   24    5   58 o     39.5   15.7    0.0000   0.0000          ?        ?     8.3008  18.5171          ?        ?       39.5       15.7       ?       ? 
1 1 1   24    5   59 o    456.9    2.7    0.0000   0.0000          ?        ?  2088.6042  24.9023          ?        ?      456.9        2.7       ?       ? 
1 1 1   24    5   60 o    166.7    5.9    0.0000   0.0000          ?        ?   278.3954  19.7942          ?        ?      166.7        5.9       ?       ? 
1 1 1   24    5   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    5   62 o    554.5    2.9    0.0000   0.0000          ?        ?  3076.3972  31.9261          ?        ?      554.5        2.9       ?       ? 
1 1 1   24    5   63 o    242.1    4.2    0.0000   0.0000          ?        ?   586.8014  20.4327          ?        ?      242.1        4.2       ?       ? 
1 1 1   24    5   64 o    263.8    4.1    0.0000   0.0000          ?        ?   696.6271  21.7097          ?        ?      263.8        4.1       ?       ? 
1 1 1   24    5   65 o    163.7    6.2    0.0000   0.0000          ?        ?   268.8176  20.4327          ?        ?      163.7        6.2       ?       ? 
1 1 1   24    5   66 o     87.7   12.0    0.0000   0.0000          ?        ?    77.8996  21.0712          ?        ?       87.7       12.0       ?       ? 
1 1 1   24    5   67 o    151.9    6.9    0.0000   0.0000          ?        ?   231.7833  21.0712          ?        ?      151.9        6.9       ?       ? 
1 1 1   24    5   68 o     64.8   15.9    0.0000   0.0000          ?        ?    44.6965  20.4327          ?        ?       64.8       15.9       ?       ? 
1 1 1   24    5   69 f     32.1   14.7    0.0000   0.0000          ?        ?   -13.4090  21.0712          ?        ?       32.1       14.7       ?       ? 
1 1 1   24    5   70 o    184.3    5.9    0.0000   0.0000          ?        ?   340.9706  21.7097          ?        ?      184.3        5.9       ?       ? 
1 1 1   24    5   71 o     32.5   14.8    0.0000   0.0000          ?        ?   -14.0475  21.7097          ?        ?       32.5       14.8       ?       ? 
1 1 1   24    5   72 o     25.4   12.4    0.0000   0.0000          ?        ?   -36.3957  20.4327          ?        ?       25.4       12.4       ?       ? 
1 1 1   24    5   73 o    187.7    6.1    0.0000   0.0000          ?        ?   354.3795  22.9868          ?        ?      187.7        6.1       ?       ? 
1 1 1   24    5   74 o    101.3   10.7    0.0000   0.0000          ?        ?   104.7175  21.7097          ?        ?      101.3       10.7       ?       ? 
1 1 1   24    5   75 o    138.1    7.6    0.0000   0.0000          ?        ?   192.8335  21.0712          ?        ?      138.1        7.6       ?       ? 
1 1 1   24    6    0 o   2172.0   10.1 47188.0273 437.3873 47188.0273 437.3873 47188.0273 437.3873     2172.0     10.1     2172.0       10.1     0.0     0.0 
1 1 1   24    6    1 o    457.2    2.3    0.0000   0.0000          ?        ?  2090.5198  21.0712          ?        ?      457.2        2.3       ?       ? 
1 1 1   24    6    2 o     73.6   14.8    0.0000   0.0000          ?        ?    56.1899  21.0712          ?        ?       73.6       14.8       ?       ? 
1 1 1   24    6    3 o   1250.8    4.4    0.0000   0.0000          ?        ? 15645.6953 110.4642          ?        ?     1250.8        4.4       ?       ? 
1 1 1   24    6    4 o   1755.1    6.0    0.0000   0.0000          ?        ? 30806.1152 210.0736          ?        ?     1755.1        6.0       ?       ? 
1 1 1   24    6    5 o   1027.8    3.9    0.0000   0.0000          ?        ? 10564.9785  80.4537          ?        ?     1027.8        3.9       ?       ? 
1 1 1   24    6    6 o   2604.1    9.2    0.0000   0.0000          ?        ? 67830.1562 476.9756          ?        ?     2604.1        9.2       ?       ? 
1 1 1   24    6    7 o   1379.5    5.0    0.0000   0.0000          ?        ? 19030.4980 136.6436          ?        ?     1379.5        5.0       ?       ? 
1 1 1   24    6    8 o   1078.8    3.9    0.0000   0.0000          ?        ? 11637.6953  84.9234          ?        ?     1078.8        3.9       ?       ? 
1 1 1   24    6    9 o    867.6    3.2    0.0000   0.0000          ?        ?  7527.5317  55.5514          ?        ?      867.6        3.2       ?       ? 
1 1 1   24    6   10 o    753.8    3.0    0.0000   0.0000          ?        ?  5681.5654  44.6965          ?        ?      753.8        3.0       ?       ? 
1 1 1   24    6   11 o   1474.4    5.3    0.0000   0.0000          ?        ? 21741.0215 156.4378          ?        ?     1474.4        5.3       ?       ? 
1 1 1   24    6   12 o   1238.5    4.4    0.0000   0.0000          ?        ? 15338.5664 109.1872          ?        ?     1238.5        4.4       ?       ? 
1 1 1   24    6   13 o   1113.0    4.0    0.0000   0.0000          ?        ? 12388.5967  88.1160          ?        ?     1113.0        4.0       ?       ? 
1 1 1   24    6   14 o   1391.7    4.7    0.0000   0.0000          ?        ? 19370.1934 130.2584          ?        ?     1391.7        4.7       ?       ? 
1 1 1   24    6   15 o    710.3    2.7    0.0000   0.0000          ?        ?  5044.9590  38.9498          ?        ?      710.3        2.7       ?       ? 
1 1 1   24    6   16 o    572.3    2.5    0.0000   0.0000          ?        ?  3274.9775  28.0950          ?        ?      572.3        2.5       ?       ? 
1 1 1   24    6   17 f    621.9    2.5    0.0000   0.0000          ?        ?  3868.1638  31.2876          ?        ?      621.9        2.5       ?       ? 
1 1 1   24    6   18 f   1024.5    3.7    0.0000   0.0000          ?        ? 10496.6572  75.9841          ?        ?     1024.5        3.7       ?       ? 
1 1 1   24    6   19 o   1929.7    6.3    0.0000   0.0000          ?        ? 37241.1328 243.9153          ?        ?     1929.7        6.3       ?       ? 
1 1 1   24    6   20 o    713.5    2.7    0.0000   0.0000          ?        ?  5090.2944  38.9498          ?        ?      713.5        2.7       ?       ? 
1 1 1   24    6   21 o    547.3    2.4    0.0000   0.0000          ?        ?  2995.9436  26.8179          ?        ?      547.3        2.4       ?       ? 
1 1 1   24    6   22 o    507.1    2.4    0.0000   0.0000          ?        ?  2571.9651  24.2638          ?        ?      507.1        2.4       ?       ? 
1 1 1   24    6   23 o    526.0    2.5    0.0000   0.0000          ?        ?  2766.7141  26.8179          ?        ?      526.0        2.5       ?       ? 
1 1 1   24    6   24 o   1455.4    5.1    0.0000   0.0000          ?        ? 21185.5078 148.7755          ?        ?     1455.4        5.1       ?       ? 
1 1 1   24    6   25 o    225.6    3.0    0.0000   0.0000          ?        ?   508.9017  13.4090          ?        ?      225.6        3.0       ?       ? 
1 1 1   24    6   26 o    358.5    2.3    0.0000   0.0000          ?        ?  1285.3440  16.6016          ?        ?      358.5        2.3       ?       ? 
1 1 1   24    6   27 o    780.3    3.2    0.0000   0.0000          ?        ?  6088.3037  49.1662          ?        ?      780.3        3.2       ?       ? 
1 1 1   24    6   28 o    409.1    2.5    0.0000   0.0000          ?        ?  1673.5652  20.4327          ?        ?      409.1        2.5       ?       ? 
1 1 1   24    6   29 o    716.6    2.9    0.0000   0.0000          ?        ?  5135.6294  42.1424          ?        ?      716.6        2.9       ?       ? 
1 1 1   24    6   30 f    118.8    6.7    0.0000   0.0000          ?        ?   141.1133  15.9630          ?        ?      118.8        6.7       ?       ? 
1 1 1   24    6   31 o     49.7   14.9    0.0000   0.0000          ?        ?    24.9023  15.9630          ?        ?       49.7       14.9       ?       ? 
1 1 1   24    6   32 o    758.5    3.1    0.0000   0.0000          ?        ?  5753.7183  47.2506          ?        ?      758.5        3.1       ?       ? 
1 1 1   24    6   33 o    946.8    3.9    0.0000   0.0000          ?        ?  8964.8438  73.4300          ?        ?      946.8        3.9       ?       ? 
1 1 1   24    6   34 o    785.8    3.1    0.0000   0.0000          ?        ?  6175.7812  48.5276          ?        ?      785.8        3.1       ?       ? 
1 1 1   24    6   35 o    993.9    3.6    0.0000   0.0000          ?        ?  9878.5684  72.1529          ?        ?      993.9        3.6       ?       ? 
1 1 1   24    6   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    6   37 o    945.0    3.5    0.0000   0.0000          ?        ?  8931.0020  66.4062          ?        ?      945.0        3.5       ?       ? 
1 1 1   24    6   38 o    371.3    2.9    0.0000   0.0000          ?        ?  1378.5681  21.7097          ?        ?      371.3        2.9       ?       ? 
1 1 1   24    6   39 o    716.5    3.0    0.0000   0.0000          ?        ?  5133.7139  43.4195          ?        ?      716.5        3.0       ?       ? 
1 1 1   24    6   40 f    893.3    3.4    0.0000   0.0000          ?        ?  7980.2437  60.6596          ?        ?      893.3        3.4       ?       ? 
1 1 1   24    6   41 o    159.8    5.2    0.0000   0.0000          ?        ?   255.4086  16.6016          ?        ?      159.8        5.2       ?       ? 
1 1 1   24    6   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    6   43 o    389.6    2.7    0.0000   0.0000          ?        ?  1517.7659  21.0712          ?        ?      389.6        2.7       ?       ? 
1 1 1   24    6   44 o    509.4    2.8    0.0000   0.0000          ?        ?  2594.9519  28.0950          ?        ?      509.4        2.8       ?       ? 
1 1 1   24    6   45 o    139.3    6.2    0.0000   0.0000          ?        ?   194.1106  17.2401          ?        ?      139.3        6.2       ?       ? 
1 1 1   24    6   46 o    237.1    3.8    0.0000   0.0000          ?        ?   562.5375  17.8786          ?        ?      237.1        3.8       ?       ? 
1 1 1   24    6   47 o    649.4    2.9    0.0000   0.0000          ?        ?  4217.4355  37.6728          ?        ?      649.4        2.9       ?       ? 
1 1 1   24    6   48 o    243.6    3.8    0.0000   0.0000          ?        ?   593.8251  18.5171          ?        ?      243.6        3.8       ?       ? 
1 1 1   24    6   49 o    553.2    2.8    0.0000   0.0000          ?        ?  3061.0728  30.6490          ?        ?      553.2        2.8       ?       ? 
1 1 1   24    6   50 o    144.6    6.2    0.0000   0.0000          ?        ?   209.4351  17.8786          ?        ?      144.6        6.2       ?       ? 
1 1 1   24    6   51 o     23.3   11.3    0.0000   0.0000          ?        ?   -28.7335  16.6016          ?        ?       23.3       11.3       ?       ? 
1 1 1   24    6   52 o    358.1    2.8    0.0000   0.0000          ?        ?  1282.7899  19.7942          ?        ?      358.1        2.8       ?       ? 
1 1 1   24    6   53 o    319.7    3.1    0.0000   0.0000          ?        ?  1022.2732  19.7942          ?        ?      319.7        3.1       ?       ? 
1 1 1   24    6   54 o    314.3    3.1    0.0000   0.0000          ?        ?   988.4315  19.7942          ?        ?      314.3        3.1       ?       ? 
1 1 1   24    6   55 o    103.7    8.9    0.0000   0.0000          ?        ?   107.9102  18.5171          ?        ?      103.7        8.9       ?       ? 
1 1 1   24    6   56 o    568.2    2.6    0.0000   0.0000          ?        ?  3229.0039  30.0105          ?        ?      568.2        2.6       ?       ? 
1 1 1   24    6   57 o    292.0    3.3    0.0000   0.0000          ?        ?   853.0649  19.1556          ?        ?      292.0        3.3       ?       ? 
1 1 1   24    6   58 o    226.1    4.1    0.0000   0.0000          ?        ?   511.4558  18.5171          ?        ?      226.1        4.1       ?       ? 
1 1 1   24    6   59 o    340.7    3.1    0.0000   0.0000          ?        ?  1161.4708  21.0712          ?        ?      340.7        3.1       ?       ? 
1 1 1   24    6   60 o    210.4    4.7    0.0000   0.0000          ?        ?   443.1340  19.7942          ?        ?      210.4        4.7       ?       ? 
1 1 1   24    6   61 o     23.2   11.5    0.0000   0.0000          ?        ?   -45.3350  19.7942          ?        ?       23.2       11.5       ?       ? 
1 1 1   24    6   62 o     65.2   14.6    0.0000   0.0000          ?        ?    44.6965  18.5171          ?        ?       65.2       14.6       ?       ? 
1 1 1   24    6   63 o    120.1    8.2    0.0000   0.0000          ?        ?   144.9444  19.7942          ?        ?      120.1        8.2       ?       ? 
1 1 1   24    6   64 o    288.2    3.7    0.0000   0.0000          ?        ?   831.3552  21.0712          ?        ?      288.2        3.7       ?       ? 
1 1 1   24    6   65 o    175.9    5.8    0.0000   0.0000          ?        ?   310.3215  20.4327          ?        ?      175.9        5.8       ?       ? 
1 1 1   24    6   66 o    216.4    4.9    0.0000   0.0000          ?        ?   469.3134  21.0712          ?        ?      216.4        4.9       ?       ? 
1 1 1   24    6   67 o     94.8   10.4    0.0000   0.0000          ?        ?    90.6701  19.7942          ?        ?       94.8       10.4       ?       ? 
1 1 1   24    6   68 o    118.1    8.4    0.0000   0.0000          ?        ?   140.4748  19.7942          ?        ?      118.1        8.4       ?       ? 
1 1 1   24    6   69 o    113.9    9.0    0.0000   0.0000          ?        ?   130.8969  20.4327          ?        ?      113.9        9.0       ?       ? 
1 1 1   24    6   70 o     31.3   14.5    0.0000   0.0000          ?        ?   -17.8786  21.7097          ?        ?       31.3       14.5       ?       ? 
1 1 1   24    6   71 o     24.1   11.9    0.0000   0.0000          ?        ?   -50.4432  21.7097          ?        ?       24.1       11.9       ?       ? 
1 1 1   24    6   72 o    161.1    6.7    0.0000   0.0000          ?        ?   261.1554  21.7097          ?        ?      161.1        6.7       ?       ? 
1 1 1   24    6   73 o     31.7   14.5    0.0000   0.0000          ?        ?   -14.0475  21.0712          ?        ?       31.7       14.5       ?       ? 
1 1 1   24    6   74 o     92.4   11.4    0.0000   0.0000          ?        ?    87.4775  21.0712          ?        ?       92.4       11.4       ?       ? 
1 1 1   24    6   75 o    114.7    8.4    0.0000   0.0000          ?        ?   133.4510  19.1556          ?        ?      114.7        8.4       ?       ? 
1 1 1   24    7    0 o   1403.5    7.0 19700.9453 197.3032 19700.9453 197.3032 19700.9453 197.3032     1403.5      7.0     1403.5        7.0     0.0     0.0 
1 1 1   24    7    1 o   1999.2    6.8    0.0000   0.0000          ?        ? 39975.2852 273.2873          ?        ?     1999.2        6.8       ?       ? 
1 1 1   24    7    2 o   1894.6    6.5    0.0000   0.0000          ?        ? 35899.6016 246.4693          ?        ?     1894.6        6.5       ?       ? 
1 1 1   24    7    3 o    439.6    2.2    0.0000   0.0000          ?        ?  1932.1665  19.1556          ?        ?      439.6        2.2       ?       ? 
1 1 1   24    7    4 o   1193.9    4.1    0.0000   0.0000          ?        ? 14255.6348  97.6938          ?        ?     1193.9        4.1       ?       ? 
1 1 1   24    7    5 o    191.1    2.2    0.0000   0.0000          ?        ?   365.2344   8.3008          ?        ?      191.1        2.2       ?       ? 
1 1 1   24    7    6 o   2118.4    6.9    0.0000   0.0000          ?        ? 44884.2383 294.3585          ?        ?     2118.4        6.9       ?       ? 
1 1 1   24    7    7 o    840.3    3.2    0.0000   0.0000          ?        ?  7062.0493  52.9973          ?        ?      840.3        3.2       ?       ? 
1 1 1   24    7    8 o   1314.3    4.7    0.0000   0.0000          ?        ? 17273.9258 122.5962          ?        ?     1314.3        4.7       ?       ? 
1 1 1   24    7    9 o    412.5    2.2    0.0000   0.0000          ?        ?  1701.6602  18.5171          ?        ?      412.5        2.2       ?       ? 
1 1 1   24    7   10 o   1451.6    5.1    0.0000   0.0000          ?        ? 21074.4062 146.8600          ?        ?     1451.6        5.1       ?       ? 
1 1 1   24    7   11 o    364.9    2.3    0.0000   0.0000          ?        ?  1331.3176  16.6016          ?        ?      364.9        2.3       ?       ? 
1 1 1   24    7   12 o    398.0    2.2    0.0000   0.0000          ?        ?  1584.1722  17.2401          ?        ?      398.0        2.2       ?       ? 
1 1 1   24    7   13 o   1550.2    5.4    0.0000   0.0000          ?        ? 24033.9531 167.2927          ?        ?     1550.2        5.4       ?       ? 
1 1 1   24    7   14 o    150.1    3.4    0.0000   0.0000          ?        ?   225.3981  10.2163          ?        ?      150.1        3.4       ?       ? 
1 1 1   24    7   15 o    646.0    2.8    0.0000   0.0000          ?        ?  4172.7388  35.7572          ?        ?      646.0        2.8       ?       ? 
1 1 1   24    7   16 o    686.0    2.8    0.0000   0.0000          ?        ?  4706.5430  38.3113          ?        ?      686.0        2.8       ?       ? 
1 1 1   24    7   17 o   1340.4    4.8    0.0000   0.0000          ?        ? 17968.6387 128.3428          ?        ?     1340.4        4.8       ?       ? 
1 1 1   24    7   18 o   2110.4    7.3    0.0000   0.0000          ?        ? 44544.5469 309.6830          ?        ?     2110.4        7.3       ?       ? 
1 1 1   24    7   19 o   1256.0    4.5    0.0000   0.0000          ?        ? 15775.9531 113.0183          ?        ?     1256.0        4.5       ?       ? 
1 1 1   24    7   20 o    181.9    3.2    0.0000   0.0000          ?        ?   330.7542  11.4934          ?        ?      181.9        3.2       ?       ? 
1 1 1   24    7   21 o    849.0    3.3    0.0000   0.0000          ?        ?  7208.2710  55.5514          ?        ?      849.0        3.3       ?       ? 
1 1 1   24    7   22 o   1608.1    5.6    0.0000   0.0000          ?        ? 25863.3184 179.4246          ?        ?     1608.1        5.6       ?       ? 
1 1 1   24    7   23 o    892.1    3.4    0.0000   0.0000          ?        ?  7958.5337  61.2981          ?        ?      892.1        3.4       ?       ? 
1 1 1   24    7   24 o   1195.8    4.5    0.0000   0.0000          ?        ? 14300.9688 106.6331          ?        ?     1195.8        4.5       ?       ? 
1 1 1   24    7   25 o   1292.1    4.7    0.0000   0.0000          ?        ? 16696.0645 120.6806          ?        ?     1292.1        4.7       ?       ? 
1 1 1   24    7   26 o    334.5    2.8    0.0000   0.0000          ?        ?  1118.6898  18.5171          ?        ?      334.5        2.8       ?       ? 
1 1 1   24    7   27 o    522.8    2.9    0.0000   0.0000          ?        ?  2733.5112  30.0105          ?        ?      522.8        2.9       ?       ? 
1 1 1   24    7   28 o    735.7    3.0    0.0000   0.0000          ?        ?  5412.7480  43.4195          ?        ?      735.7        3.0       ?       ? 
1 1 1   24    7   29 o    767.8    3.0    0.0000   0.0000          ?        ?  5896.1089  46.6121          ?        ?      767.8        3.0       ?       ? 
1 1 1   24    7   30 o   1058.2    4.2    0.0000   0.0000          ?        ? 11199.0312  88.1160          ?        ?     1058.2        4.2       ?       ? 
1 1 1   24    7   31 o    867.5    3.6    0.0000   0.0000          ?        ?  7526.8931  63.2136          ?        ?      867.5        3.6       ?       ? 
1 1 1   24    7   32 o    601.2    2.9    0.0000   0.0000          ?        ?  3614.6707  34.4802          ?        ?      601.2        2.9       ?       ? 
1 1 1   24    7   33 o    689.2    3.1    0.0000   0.0000          ?        ?  4749.9624  42.1424          ?        ?      689.2        3.1       ?       ? 
1 1 1   24    7   34 o    691.7    3.1    0.0000   0.0000          ?        ?  4785.0811  43.4195          ?        ?      691.7        3.1       ?       ? 
1 1 1   24    7   35 o    197.2    4.4    0.0000   0.0000          ?        ?   388.8597  17.2401          ?        ?      197.2        4.4       ?       ? 
1 1 1   24    7   36 o    305.1    3.1    0.0000   0.0000          ?        ?   930.9645  19.1556          ?        ?      305.1        3.1       ?       ? 
1 1 1   24    7   37 o    944.1    3.8    0.0000   0.0000          ?        ?  8913.7617  71.5144          ?        ?      944.1        3.8       ?       ? 
1 1 1   24    7   38 o    204.8    4.5    0.0000   0.0000          ?        ?   419.5087  18.5171          ?        ?      204.8        4.5       ?       ? 
1 1 1   24    7   39 o    384.4    2.9    0.0000   0.0000          ?        ?  1477.5391  22.3483          ?        ?      384.4        2.9       ?       ? 
1 1 1   24    7   40 o    397.0    2.7    0.0000   0.0000          ?        ?  1575.8713  21.7097          ?        ?      397.0        2.7       ?       ? 
1 1 1   24    7   41 o    276.3    3.4    0.0000   0.0000          ?        ?   763.6719  18.5171          ?        ?      276.3        3.4       ?       ? 
1 1 1   24    7   42 o    498.5    2.7    0.0000   0.0000          ?        ?  2485.1262  26.8179          ?        ?      498.5        2.7       ?       ? 
1 1 1   24    7   43 o   1177.1    4.2    0.0000   0.0000          ?        ? 13861.0273  99.6094          ?        ?     1177.1        4.2       ?       ? 
1 1 1   24    7   44 o    514.8    2.8    0.0000   0.0000          ?        ?  2650.5034  28.7335          ?        ?      514.8        2.8       ?       ? 
1 1 1   24    7   45 o    674.2    2.9    0.0000   0.0000          ?        ?  4545.6357  39.5883          ?        ?      674.2        2.9       ?       ? 
1 1 1   24    7   46 o     85.2   10.5    0.0000   0.0000          ?        ?    72.7915  17.8786          ?        ?       85.2       10.5       ?       ? 
1 1 1   24    7   47 f    544.4    2.9    0.0000   0.0000          ?        ?  2964.6558  31.9261          ?        ?      544.4        2.9       ?       ? 
1 1 1   24    7   48 o    336.1    3.1    0.0000   0.0000          ?        ?  1130.1832  21.0712          ?        ?      336.1        3.1       ?       ? 
1 1 1   24    7   49 o    422.2    2.8    0.0000   0.0000          ?        ?  1782.7524  23.6253          ?        ?      422.2        2.8       ?       ? 
1 1 1   24    7   50 o    196.6    4.7    0.0000   0.0000          ?        ?   386.9441  18.5171          ?        ?      196.6        4.7       ?       ? 
1 1 1   24    7   51 o    167.2    5.3    0.0000   0.0000          ?        ?   279.6725  17.8786          ?        ?      167.2        5.3       ?       ? 
1 1 1   24    7   52 o    464.8    2.7    0.0000   0.0000          ?        ?  2161.3958  25.5409          ?        ?      464.8        2.7       ?       ? 
1 1 1   24    7   53 o    129.5    6.7    0.0000   0.0000          ?        ?   167.9312  17.2401          ?        ?      129.5        6.7       ?       ? 
1 1 1   24    7   54 o    182.7    4.7    0.0000   0.0000          ?        ?   333.9468  17.2401          ?        ?      182.7        4.7       ?       ? 
1 1 1   24    7   55 o    376.1    2.7    0.0000   0.0000          ?        ?  1414.9640  20.4327          ?        ?      376.1        2.7       ?       ? 
1 1 1   24    7   56 o    531.3    2.8    0.0000   0.0000          ?        ?  2823.5427  29.3720          ?        ?      531.3        2.8       ?       ? 
1 1 1   24    7   57 o     28.6   13.4    0.0000   0.0000          ?        ?   -19.1556  19.1556          ?        ?       28.6       13.4       ?       ? 
1 1 1   24    7   58 o    366.4    3.0    0.0000   0.0000          ?        ?  1343.4495  21.7097          ?        ?      366.4        3.0       ?       ? 
1 1 1   24    7   59 o    282.9    3.7    0.0000   0.0000          ?        ?   800.7061  21.0712          ?        ?      282.9        3.7       ?       ? 
1 1 1   24    7   60 o    293.2    3.5    0.0000   0.0000          ?        ?   860.0886  20.4327          ?        ?      293.2        3.5       ?       ? 
1 1 1   24    7   61 o    198.0    5.3    0.0000   0.0000          ?        ?   392.6908  21.0712          ?        ?      198.0        5.3       ?       ? 
1 1 1   24    7   62 o    130.8    7.3    0.0000   0.0000          ?        ?   171.7623  19.1556          ?        ?      130.8        7.3       ?       ? 
1 1 1   24    7   63 o    295.3    3.7    0.0000   0.0000          ?        ?   872.8591  21.7097          ?        ?      295.3        3.7       ?       ? 
1 1 1   24    7   64 o    100.7    9.8    0.0000   0.0000          ?        ?   102.1635  19.7942          ?        ?      100.7        9.8       ?       ? 
1 1 1   24    7   65 o    141.3    7.7    0.0000   0.0000          ?        ?   200.4958  21.7097          ?        ?      141.3        7.7       ?       ? 
1 1 1   24    7   66 o    269.7    4.1    0.0000   0.0000          ?        ?   728.5532  22.3483          ?        ?      269.7        4.1       ?       ? 
1 1 1   24    7   67 o    282.2    4.0    0.0000   0.0000          ?        ?   797.5135  22.3483          ?        ?      282.2        4.0       ?       ? 
1 1 1   24    7   68 o     20.7   10.4    0.0000   0.0000          ?        ?   -71.5144  21.0712          ?        ?       20.7       10.4       ?       ? 
1 1 1   24    7   69 o    144.5    7.5    0.0000   0.0000          ?        ?   210.0736  21.7097          ?        ?      144.5        7.5       ?       ? 
1 1 1   24    7   70 o     25.3   12.4    0.0000   0.0000          ?        ?   -40.2269  21.0712          ?        ?       25.3       12.4       ?       ? 
1 1 1   24    7   71 o    115.1    9.4    0.0000   0.0000          ?        ?   134.0895  21.7097          ?        ?      115.1        9.4       ?       ? 
1 1 1   24    7   72 o    166.1    6.5    0.0000   0.0000          ?        ?   277.7569  21.7097          ?        ?      166.1        6.5       ?       ? 
1 1 1   24    7   73 o    153.9    6.8    0.0000   0.0000          ?        ?   238.8071  21.0712          ?        ?      153.9        6.8       ?       ? 
1 1 1   24    7   74 o    118.5    8.3    0.0000   0.0000          ?        ?   142.3903  19.7942          ?        ?      118.5        8.3       ?       ? 
1 1 1   24    7   75 o     25.7   12.5    0.0000   0.0000          ?        ?   -37.0343  21.0712          ?        ?       25.7       12.5       ?       ? 
1 1 1   24    8    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    8    1 o   1112.4    4.0    0.0000   0.0000          ?        ? 12374.5488  88.7545          ?        ?     1112.4        4.0       ?       ? 
1 1 1   24    8    2 o   1204.6    4.2    0.0000   0.0000          ?        ? 14511.0430 102.1635          ?        ?     1204.6        4.2       ?       ? 
1 1 1   24    8    3 o   1192.5    4.2    0.0000   0.0000          ?        ? 14220.5156 100.2479          ?        ?     1192.5        4.2       ?       ? 
1 1 1   24    8    4 o   1442.6    5.1    0.0000   0.0000          ?        ? 20811.9727 147.4985          ?        ?     1442.6        5.1       ?       ? 
1 1 1   24    8    5 o    182.4    3.2    0.0000   0.0000          ?        ?   332.6698  11.4934          ?        ?      182.4        3.2       ?       ? 
1 1 1   24    8    6 o    212.9    3.3    0.0000   0.0000          ?        ?   453.3503  14.0475          ?        ?      212.9        3.3       ?       ? 
1 1 1   24    8    7 o   1024.6    3.9    0.0000   0.0000          ?        ? 10497.9336  80.4537          ?        ?     1024.6        3.9       ?       ? 
1 1 1   24    8    8 o    672.3    2.8    0.0000   0.0000          ?        ?  4519.4561  37.6728          ?        ?      672.3        2.8       ?       ? 
1 1 1   24    8    9 o    992.9    3.7    0.0000   0.0000          ?        ?  9858.1357  72.7915          ?        ?      992.9        3.7       ?       ? 
1 1 1   24    8   10 o   1306.5    4.6    0.0000   0.0000          ?        ? 17070.8750 121.3191          ?        ?     1306.5        4.6       ?       ? 
1 1 1   24    8   11 o    752.5    3.0    0.0000   0.0000          ?        ?  5662.4097  45.3350          ?        ?      752.5        3.0       ?       ? 
1 1 1   24    8   12 o   1758.1    6.1    0.0000   0.0000          ?        ? 30912.7461 213.2662          ?        ?     1758.1        6.1       ?       ? 
1 1 1   24    8   13 o    267.3    2.5    0.0000   0.0000          ?        ?   714.5057  13.4090          ?        ?      267.3        2.5       ?       ? 
1 1 1   24    8   14 o    578.4    2.5    0.0000   0.0000          ?        ?  3345.8533  29.3720          ?        ?      578.4        2.5       ?       ? 
1 1 1   24    8   15 f    981.0    3.7    0.0000   0.0000          ?        ?  9624.4365  72.1529          ?        ?      981.0        3.7       ?       ? 
1 1 1   24    8   16 o   1087.6    3.9    0.0000   0.0000          ?        ? 11829.2520  84.2849          ?        ?     1087.6        3.9       ?       ? 
1 1 1   24    8   17 f   1395.2    4.7    0.0000   0.0000          ?        ? 19467.2480 131.5355          ?        ?     1395.2        4.7       ?       ? 
1 1 1   24    8   18 o    265.4    2.6    0.0000   0.0000          ?        ?   704.2894  14.0475          ?        ?      265.4        2.6       ?       ? 
1 1 1   24    8   19 o    406.7    2.3    0.0000   0.0000          ?        ?  1654.4095  18.5171          ?        ?      406.7        2.3       ?       ? 
1 1 1   24    8   20 o   1279.9    4.5    0.0000   0.0000          ?        ? 16381.9111 114.2954          ?        ?     1279.9        4.5       ?       ? 
1 1 1   24    8   21 o    996.1    3.6    0.0000   0.0000          ?        ?  9921.9873  71.5144          ?        ?      996.1        3.6       ?       ? 
1 1 1   24    8   22 o    653.0    2.7    0.0000   0.0000          ?        ?  4264.6860  35.1187          ?        ?      653.0        2.7       ?       ? 
1 1 1   24    8   23 o   1657.5    5.7    0.0000   0.0000          ?        ? 27478.7773 190.2794          ?        ?     1657.5        5.7       ?       ? 
1 1 1   24    8   24 o   1210.3    4.2    0.0000   0.0000          ?        ? 14648.3252 100.8864          ?        ?     1210.3        4.2       ?       ? 
1 1 1   24    8   25 o    731.1    3.1    0.0000   0.0000          ?        ?  5345.0645  45.9736          ?        ?      731.1        3.1       ?       ? 
1 1 1   24    8   26 o    785.7    3.1    0.0000   0.0000          ?        ?  6173.2271  48.5276          ?        ?      785.7        3.1       ?       ? 
1 1 1   24    8   27 o   1612.3    5.5    0.0000   0.0000          ?        ? 25999.3242 176.2320          ?        ?     1612.3        5.5       ?       ? 
1 1 1   24    8   28 o    926.6    3.7    0.0000   0.0000          ?        ?  8586.2002  67.6833          ?        ?      926.6        3.7       ?       ? 
1 1 1   24    8   29 o    552.5    2.5    0.0000   0.0000          ?        ?  3052.7720  27.4564          ?        ?      552.5        2.5       ?       ? 
1 1 1   24    8   30 o    199.3    3.8    0.0000   0.0000          ?        ?   397.1605  15.3245          ?        ?      199.3        3.8       ?       ? 
1 1 1   24    8   31 o    706.1    3.0    0.0000   0.0000          ?        ?  4985.5767  42.1424          ?        ?      706.1        3.0       ?       ? 
1 1 1   24    8   32 o    788.6    3.2    0.0000   0.0000          ?        ?  6219.8389  51.0817          ?        ?      788.6        3.2       ?       ? 
1 1 1   24    8   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    8   34 o    509.1    2.6    0.0000   0.0000          ?        ?  2592.3977  26.1794          ?        ?      509.1        2.6       ?       ? 
1 1 1   24    8   35 o   1214.0    4.4    0.0000   0.0000          ?        ? 14741.5488 107.9102          ?        ?     1214.0        4.4       ?       ? 
1 1 1   24    8   36 o    879.0    3.3    0.0000   0.0000          ?        ?  7727.3882  57.4669          ?        ?      879.0        3.3       ?       ? 
1 1 1   24    8   37 o    135.6    5.7    0.0000   0.0000          ?        ?   183.8942  15.3245          ?        ?      135.6        5.7       ?       ? 
1 1 1   24    8   38 o    432.7    2.7    0.0000   0.0000          ?        ?  1872.7838  22.9868          ?        ?      432.7        2.7       ?       ? 
1 1 1   24    8   39 o    538.4    2.7    0.0000   0.0000          ?        ?  2899.5269  29.3720          ?        ?      538.4        2.7       ?       ? 
1 1 1   24    8   40 o    343.4    2.8    0.0000   0.0000          ?        ?  1179.3494  19.1556          ?        ?      343.4        2.8       ?       ? 
1 1 1   24    8   41 o     29.2   13.4    0.0000   0.0000          ?        ?   -13.4090  17.8786          ?        ?       29.2       13.4       ?       ? 
1 1 1   24    8   42 o    412.7    2.7    0.0000   0.0000          ?        ?  1703.5756  22.3483          ?        ?      412.7        2.7       ?       ? 
1 1 1   24    8   43 o    235.5    4.3    0.0000   0.0000          ?        ?   554.8753  20.4327          ?        ?      235.5        4.3       ?       ? 
1 1 1   24    8   44 o    299.8    3.2    0.0000   0.0000          ?        ?   899.0385  19.1556          ?        ?      299.8        3.2       ?       ? 
1 1 1   24    8   45 o    229.1    3.9    0.0000   0.0000          ?        ?   524.8647  17.8786          ?        ?      229.1        3.9       ?       ? 
1 1 1   24    8   46 o    498.7    2.7    0.0000   0.0000          ?        ?  2487.0417  26.8179          ?        ?      498.7        2.7       ?       ? 
1 1 1   24    8   47 o    287.1    3.2    0.0000   0.0000          ?        ?   824.3315  18.5171          ?        ?      287.1        3.2       ?       ? 
1 1 1   24    8   48 o    331.3    3.0    0.0000   0.0000          ?        ?  1097.6187  19.7942          ?        ?      331.3        3.0       ?       ? 
1 1 1   24    8   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    8   50 o    330.6    2.9    0.0000   0.0000          ?        ?  1093.1490  19.1556          ?        ?      330.6        2.9       ?       ? 
1 1 1   24    8   51 o    471.4    2.6    0.0000   0.0000          ?        ?  2222.6938  24.9023          ?        ?      471.4        2.6       ?       ? 
1 1 1   24    8   52 o    218.2    4.1    0.0000   0.0000          ?        ?   476.3371  17.8786          ?        ?      218.2        4.1       ?       ? 
1 1 1   24    8   53 o    211.2    4.1    0.0000   0.0000          ?        ?   446.3266  17.2401          ?        ?      211.2        4.1       ?       ? 
1 1 1   24    8   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    8   55 o     39.3   15.5    0.0000   0.0000          ?        ?     8.9393  17.8786          ?        ?       39.3       15.5       ?       ? 
1 1 1   24    8   56 o    176.2    5.3    0.0000   0.0000          ?        ?   310.9600  18.5171          ?        ?      176.2        5.3       ?       ? 
1 1 1   24    8   57 o     23.9   11.7    0.0000   0.0000          ?        ?   -35.1187  18.5171          ?        ?       23.9       11.7       ?       ? 
1 1 1   24    8   58 o    336.7    3.1    0.0000   0.0000          ?        ?  1134.0144  21.0712          ?        ?      336.7        3.1       ?       ? 
1 1 1   24    8   59 o    236.2    4.2    0.0000   0.0000          ?        ?   558.7064  19.7942          ?        ?      236.2        4.2       ?       ? 
1 1 1   24    8   60 o    358.9    3.1    0.0000   0.0000          ?        ?  1288.5366  22.3483          ?        ?      358.9        3.1       ?       ? 
1 1 1   24    8   61 o     78.8   11.8    0.0000   0.0000          ?        ?    62.5751  18.5171          ?        ?       78.8       11.8       ?       ? 
1 1 1   24    8   62 o    253.6    3.9    0.0000   0.0000          ?        ?   643.6298  19.7942          ?        ?      253.6        3.9       ?       ? 
1 1 1   24    8   63 o    222.0    4.6    0.0000   0.0000          ?        ?   493.5772  20.4327          ?        ?      222.0        4.6       ?       ? 
1 1 1   24    8   64 o    107.1    9.8    0.0000   0.0000          ?        ?   115.5724  21.0712          ?        ?      107.1        9.8       ?       ? 
1 1 1   24    8   65 o     83.7   12.2    0.0000   0.0000          ?        ?    70.8759  20.4327          ?        ?       83.7       12.2       ?       ? 
1 1 1   24    8   66 o    309.4    3.6    0.0000   0.0000          ?        ?   958.4210  22.3483          ?        ?      309.4        3.6       ?       ? 
1 1 1   24    8   67 o    325.1    3.7    0.0000   0.0000          ?        ?  1058.6688  24.2638          ?        ?      325.1        3.7       ?       ? 
1 1 1   24    8   68 o    130.3    8.3    0.0000   0.0000          ?        ?   171.1238  21.7097          ?        ?      130.3        8.3       ?       ? 
1 1 1   24    8   69 o    179.9    6.0    0.0000   0.0000          ?        ?   325.0075  21.7097          ?        ?      179.9        6.0       ?       ? 
1 1 1   24    8   70 o    149.6    7.5    0.0000   0.0000          ?        ?   225.3981  22.3483          ?        ?      149.6        7.5       ?       ? 
1 1 1   24    8   71 o    282.5    4.1    0.0000   0.0000          ?        ?   800.0676  22.9868          ?        ?      282.5        4.1       ?       ? 
1 1 1   24    8   72 o    180.5    5.7    0.0000   0.0000          ?        ?   327.5616  20.4327          ?        ?      180.5        5.7       ?       ? 
1 1 1   24    8   73 o    221.9    4.5    0.0000   0.0000          ?        ?   494.2158  19.7942          ?        ?      221.9        4.5       ?       ? 
1 1 1   24    8   74 o     22.4   11.2    0.0000   0.0000          ?        ?   -52.9973  20.4327          ?        ?       22.4       11.2       ?       ? 
1 1 1   24    9    0 f   1684.4   10.5 28380.3711 353.7410 28380.3711 353.7410 28380.3711 353.7410     1684.4     10.5     1684.4       10.5     0.0     0.0 
1 1 1   24    9    1 o    868.9    3.5    0.0000   0.0000          ?        ?  7549.8799  61.2981          ?        ?      868.9        3.5       ?       ? 
1 1 1   24    9    2 o   1296.8    4.7    0.0000   0.0000          ?        ? 16819.2988 122.5962          ?        ?     1296.8        4.7       ?       ? 
1 1 1   24    9    3 f    862.0    3.3    0.0000   0.0000          ?        ?  7430.4761  57.4669          ?        ?      862.0        3.3       ?       ? 
1 1 1   24    9    4 o   1574.2    5.6    0.0000   0.0000          ?        ? 24784.8555 176.2320          ?        ?     1574.2        5.6       ?       ? 
1 1 1   24    9    5 o   1357.3    4.9    0.0000   0.0000          ?        ? 18425.1816 132.8125          ?        ?     1357.3        4.9       ?       ? 
1 1 1   24    9    6 o   1771.7    6.1    0.0000   0.0000          ?        ? 31394.1934 216.4588          ?        ?     1771.7        6.1       ?       ? 
1 1 1   24    9    7 o   1026.9    3.7    0.0000   0.0000          ?        ? 10545.8232  75.9841          ?        ?     1026.9        3.7       ?       ? 
1 1 1   24    9    8 o    903.0    3.4    0.0000   0.0000          ?        ?  8153.9214  60.6596          ?        ?      903.0        3.4       ?       ? 
1 1 1   24    9    9 o   1017.1    3.7    0.0000   0.0000          ?        ? 10344.6885  74.7070          ?        ?     1017.1        3.7       ?       ? 
1 1 1   24    9   10 o    804.6    3.1    0.0000   0.0000          ?        ?  6474.6094  49.8047          ?        ?      804.6        3.1       ?       ? 
1 1 1   24    9   11 o    475.6    2.2    0.0000   0.0000          ?        ?  2261.6438  21.0712          ?        ?      475.6        2.2       ?       ? 
1 1 1   24    9   12 o   1146.6    4.0    0.0000   0.0000          ?        ? 13147.1602  91.3086          ?        ?     1146.6        4.0       ?       ? 
1 1 1   24    9   13 o   1964.1    6.7    0.0000   0.0000          ?        ? 38583.9492 263.0709          ?        ?     1964.1        6.7       ?       ? 
1 1 1   24    9   14 o   1489.6    5.1    0.0000   0.0000          ?        ? 22190.5430 151.9681          ?        ?     1489.6        5.1       ?       ? 
1 1 1   24    9   15 o   1035.0    3.7    0.0000   0.0000          ?        ? 10711.8389  75.9841          ?        ?     1035.0        3.7       ?       ? 
1 1 1   24    9   16 f   1590.7    5.4    0.0000   0.0000          ?        ? 25306.5273 172.4008          ?        ?     1590.7        5.4       ?       ? 
1 1 1   24    9   17 o   1299.1    4.6    0.0000   0.0000          ?        ? 16878.0430 120.0421          ?        ?     1299.1        4.6       ?       ? 
1 1 1   24    9   18 o   1475.4    5.0    0.0000   0.0000          ?        ? 21771.6719 146.2215          ?        ?     1475.4        5.0       ?       ? 
1 1 1   24    9   19 o    857.0    3.2    0.0000   0.0000          ?        ?  7344.9146  54.9129          ?        ?      857.0        3.2       ?       ? 
1 1 1   24    9   20 o   1493.0    5.4    0.0000   0.0000          ?        ? 22293.9824 160.2689          ?        ?     1493.0        5.4       ?       ? 
1 1 1   24    9   21 o    564.1    2.5    0.0000   0.0000          ?        ?  3181.7532  28.0950          ?        ?      564.1        2.5       ?       ? 
1 1 1   24    9   22 o   1218.6    4.3    0.0000   0.0000          ?        ? 14851.3740 104.7175          ?        ?     1218.6        4.3       ?       ? 
1 1 1   24    9   23 o    870.2    3.3    0.0000   0.0000          ?        ?  7572.2280  58.1055          ?        ?      870.2        3.3       ?       ? 
1 1 1   24    9   24 o   1340.4    4.7    0.0000   0.0000          ?        ? 17967.9980 125.1502          ?        ?     1340.4        4.7       ?       ? 
1 1 1   24    9   25 o    125.6    5.8    0.0000   0.0000          ?        ?   157.7148  14.6860          ?        ?      125.6        5.8       ?       ? 
1 1 1   24    9   26 o    726.3    3.0    0.0000   0.0000          ?        ?  5275.4658  43.4195          ?        ?      726.3        3.0       ?       ? 
1 1 1   24    9   27 o    984.8    3.7    0.0000   0.0000          ?        ?  9699.1436  72.1529          ?        ?      984.8        3.7       ?       ? 
1 1 1   24    9   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    9   29 o    803.4    3.1    0.0000   0.0000          ?        ?  6454.1768  49.1662          ?        ?      803.4        3.1       ?       ? 
1 1 1   24    9   30 o    975.0    3.7    0.0000   0.0000          ?        ?  9506.9482  71.5144          ?        ?      975.0        3.7       ?       ? 
1 1 1   24    9   31 o   1227.7    4.5    0.0000   0.0000          ?        ? 15075.4951 109.8257          ?        ?     1227.7        4.5       ?       ? 
1 1 1   24    9   32 o    288.7    3.2    0.0000   0.0000          ?        ?   833.2708  18.5171          ?        ?      288.7        3.2       ?       ? 
1 1 1   24    9   33 f     17.6    8.9    0.0000   0.0000          ?        ?   -58.1055  15.9630          ?        ?       17.6        8.9       ?       ? 
1 1 1   24    9   34 o    635.0    2.8    0.0000   0.0000          ?        ?  4032.9023  35.1187          ?        ?      635.0        2.8       ?       ? 
1 1 1   24    9   35 o    226.6    3.9    0.0000   0.0000          ?        ?   513.3714  17.8786          ?        ?      226.6        3.9       ?       ? 
1 1 1   24    9   36 o    304.6    3.1    0.0000   0.0000          ?        ?   927.7720  19.1556          ?        ?      304.6        3.1       ?       ? 
1 1 1   24    9   37 o    718.5    3.0    0.0000   0.0000          ?        ?  5163.0859  42.7809          ?        ?      718.5        3.0       ?       ? 
1 1 1   24    9   38 o    457.3    2.6    0.0000   0.0000          ?        ?  2091.7969  23.6253          ?        ?      457.3        2.6       ?       ? 
1 1 1   24    9   39 o    308.8    2.9    0.0000   0.0000          ?        ?   953.9513  17.8786          ?        ?      308.8        2.9       ?       ? 
1 1 1   24    9   40 o    197.8    4.2    0.0000   0.0000          ?        ?   391.4138  16.6016          ?        ?      197.8        4.2       ?       ? 
1 1 1   24    9   41 o    644.2    2.9    0.0000   0.0000          ?        ?  4150.3906  37.0343          ?        ?      644.2        2.9       ?       ? 
1 1 1   24    9   42 o    415.5    2.7    0.0000   0.0000          ?        ?  1726.5625  22.3483          ?        ?      415.5        2.7       ?       ? 
1 1 1   24    9   43 o    347.9    2.8    0.0000   0.0000          ?        ?  1210.6371  19.1556          ?        ?      347.9        2.8       ?       ? 
1 1 1   24    9   44 o    351.1    2.8    0.0000   0.0000          ?        ?  1232.9854  19.7942          ?        ?      351.1        2.8       ?       ? 
1 1 1   24    9   45 o    221.8    3.9    0.0000   0.0000          ?        ?   492.3002  17.2401          ?        ?      221.8        3.9       ?       ? 
1 1 1   24    9   46 o    462.5    2.6    0.0000   0.0000          ?        ?  2139.6860  24.2638          ?        ?      462.5        2.6       ?       ? 
1 1 1   24    9   47 o    178.8    4.6    0.0000   0.0000          ?        ?   319.8993  16.6016          ?        ?      178.8        4.6       ?       ? 
1 1 1   24    9   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    9   49 o    436.4    2.6    0.0000   0.0000          ?        ?  1904.7100  22.9868          ?        ?      436.4        2.6       ?       ? 
1 1 1   24    9   50 o    255.6    3.6    0.0000   0.0000          ?        ?   653.8461  18.5171          ?        ?      255.6        3.6       ?       ? 
1 1 1   24    9   51 o    328.1    3.1    0.0000   0.0000          ?        ?  1077.1859  20.4327          ?        ?      328.1        3.1       ?       ? 
1 1 1   24    9   52 o    301.6    3.1    0.0000   0.0000          ?        ?   909.8933  18.5171          ?        ?      301.6        3.1       ?       ? 
1 1 1   24    9   53 o    262.9    3.4    0.0000   0.0000          ?        ?   691.5189  17.8786          ?        ?      262.9        3.4       ?       ? 
1 1 1   24    9   54 o    161.7    5.3    0.0000   0.0000          ?        ?   261.7939  17.2401          ?        ?      161.7        5.3       ?       ? 
1 1 1   24    9   55 o    481.8    2.7    0.0000   0.0000          ?        ?  2322.3032  25.5409          ?        ?      481.8        2.7       ?       ? 
1 1 1   24    9   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24    9   57 o    241.9    3.8    0.0000   0.0000          ?        ?   585.5243  18.5171          ?        ?      241.9        3.8       ?       ? 
1 1 1   24    9   58 o    398.4    2.9    0.0000   0.0000          ?        ?  1588.0033  22.9868          ?        ?      398.4        2.9       ?       ? 
1 1 1   24    9   59 o    258.1    4.0    0.0000   0.0000          ?        ?   666.6166  20.4327          ?        ?      258.1        4.0       ?       ? 
1 1 1   24    9   60 o    247.3    4.0    0.0000   0.0000          ?        ?   612.3422  19.7942          ?        ?      247.3        4.0       ?       ? 
1 1 1   24    9   61 o    107.2    8.6    0.0000   0.0000          ?        ?   115.5724  18.5171          ?        ?      107.2        8.6       ?       ? 
1 1 1   24    9   62 o    144.3    6.9    0.0000   0.0000          ?        ?   208.7966  19.7942          ?        ?      144.3        6.9       ?       ? 
1 1 1   24    9   63 o    235.4    4.3    0.0000   0.0000          ?        ?   554.8753  20.4327          ?        ?      235.4        4.3       ?       ? 
1 1 1   24    9   64 o    123.7    8.3    0.0000   0.0000          ?        ?   153.8837  20.4327          ?        ?      123.7        8.3       ?       ? 
1 1 1   24    9   65 o     62.1   16.6    0.0000   0.0000          ?        ?    40.8654  21.0712          ?        ?       62.1       16.6       ?       ? 
1 1 1   24    9   66 o    198.2    5.2    0.0000   0.0000          ?        ?   393.9678  20.4327          ?        ?      198.2        5.2       ?       ? 
1 1 1   24    9   67 o    136.1    7.7    0.0000   0.0000          ?        ?   186.4483  21.0712          ?        ?      136.1        7.7       ?       ? 
1 1 1   24    9   68 o     32.7   14.9    0.0000   0.0000          ?        ?   -11.4934  21.0712          ?        ?       32.7       14.9       ?       ? 
1 1 1   24    9   69 o     49.5   17.3    0.0000   0.0000          ?        ?    22.9868  21.0712          ?        ?       49.5       17.3       ?       ? 
1 1 1   24    9   70 o     48.2   17.2    0.0000   0.0000          ?        ?    21.0712  21.0712          ?        ?       48.2       17.2       ?       ? 
1 1 1   24    9   71 o    286.0    3.7    0.0000   0.0000          ?        ?   819.8618  21.0712          ?        ?      286.0        3.7       ?       ? 
1 1 1   24    9   72 o    109.3    9.3    0.0000   0.0000          ?        ?   121.3191  20.4327          ?        ?      109.3        9.3       ?       ? 
1 1 1   24    9   73 o    195.7    5.5    0.0000   0.0000          ?        ?   385.0285  21.7097          ?        ?      195.7        5.5       ?       ? 
1 1 1   24    9   74 o    190.3    5.5    0.0000   0.0000          ?        ?   364.5958  21.0712          ?        ?      190.3        5.5       ?       ? 
1 1 1   24   10    0 o    559.7    3.6 3132.5872  40.2269  3132.5872  40.2269  3132.5872  40.2269      559.7      3.6      559.7        3.6     0.0     0.0 
1 1 1   24   10    1 o    932.2    3.5    0.0000   0.0000          ?        ?  8690.9180  64.4907          ?        ?      932.2        3.5       ?       ? 
1 1 1   24   10    2 o   1291.7    4.5    0.0000   0.0000          ?        ? 16687.1230 115.5724          ?        ?     1291.7        4.5       ?       ? 
1 1 1   24   10    3 o   1124.5    3.9    0.0000   0.0000          ?        ? 12646.5596  87.4775          ?        ?     1124.5        3.9       ?       ? 
1 1 1   24   10    4 o   1720.8    5.7    0.0000   0.0000          ?        ? 29614.6328 195.3876          ?        ?     1720.8        5.7       ?       ? 
1 1 1   24   10    5 o   1373.5    4.6    0.0000   0.0000          ?        ? 18865.1211 127.7043          ?        ?     1373.5        4.6       ?       ? 
1 1 1   24   10    6 f    352.0    2.1    0.0000   0.0000          ?        ?  1238.7319  14.6860          ?        ?      352.0        2.1       ?       ? 
1 1 1   24   10    7 o   1228.5    4.2    0.0000   0.0000          ?        ? 15094.0117 104.0790          ?        ?     1228.5        4.2       ?       ? 
1 1 1   24   10    8 o    367.4    2.1    0.0000   0.0000          ?        ?  1349.8347  15.3245          ?        ?      367.4        2.1       ?       ? 
1 1 1   24   10    9 o    845.3    3.2    0.0000   0.0000          ?        ?  7145.0571  53.6358          ?        ?      845.3        3.2       ?       ? 
1 1 1   24   10   10 o    541.8    2.4    0.0000   0.0000          ?        ?  2935.2839  26.1794          ?        ?      541.8        2.4       ?       ? 
1 1 1   24   10   11 o    885.6    3.4    0.0000   0.0000          ?        ?  7842.9614  59.3825          ?        ?      885.6        3.4       ?       ? 
1 1 1   24   10   12 o    975.9    3.6    0.0000   0.0000          ?        ?  9524.1885  69.5989          ?        ?      975.9        3.6       ?       ? 
1 1 1   24   10   13 o    633.2    2.7    0.0000   0.0000          ?        ?  4009.9158  34.4802          ?        ?      633.2        2.7       ?       ? 
1 1 1   24   10   14 o    680.3    3.0    0.0000   0.0000          ?        ?  4628.0049  40.2269          ?        ?      680.3        3.0       ?       ? 
1 1 1   24   10   15 o   1240.6    4.5    0.0000   0.0000          ?        ? 15391.5635 110.4642          ?        ?     1240.6        4.5       ?       ? 
1 1 1   24   10   16 o    903.9    3.5    0.0000   0.0000          ?        ?  8170.5225  63.2136          ?        ?      903.9        3.5       ?       ? 
1 1 1   24   10   17 o    797.9    3.3    0.0000   0.0000          ?        ?  6366.0605  52.9973          ?        ?      797.9        3.3       ?       ? 
1 1 1   24   10   18 o    736.3    3.1    0.0000   0.0000          ?        ?  5422.3257  45.9736          ?        ?      736.3        3.1       ?       ? 
1 1 1   24   10   19 o    488.5    2.5    0.0000   0.0000          ?        ?  2386.1555  24.2638          ?        ?      488.5        2.5       ?       ? 
1 1 1   24   10   20 o    824.2    3.2    0.0000   0.0000          ?        ?  6792.5933  52.3588          ?        ?      824.2        3.2       ?       ? 
1 1 1   24   10   21 o    326.9    2.5    0.0000   0.0000          ?        ?  1068.8851  16.6016          ?        ?      326.9        2.5       ?       ? 
1 1 1   24   10   22 o   1457.0    5.3    0.0000   0.0000          ?        ? 21231.4824 153.2452          ?        ?     1457.0        5.3       ?       ? 
1 1 1   24   10   23 o   1105.3    4.1    0.0000   0.0000          ?        ? 12218.7500  91.3086          ?        ?     1105.3        4.1       ?       ? 
1 1 1   24   10   24 o    819.5    3.4    0.0000   0.0000          ?        ?  6716.6094  55.5514          ?        ?      819.5        3.4       ?       ? 
1 1 1   24   10   25 o    465.0    2.7    0.0000   0.0000          ?        ?  2162.6729  24.9023          ?        ?      465.0        2.7       ?       ? 
1 1 1   24   10   26 o     90.4    8.1    0.0000   0.0000          ?        ?    81.7308  14.6860          ?        ?       90.4        8.1       ?       ? 
1 1 1   24   10   27 o    965.5    3.7    0.0000   0.0000          ?        ?  9323.0537  70.8759          ?        ?      965.5        3.7       ?       ? 
1 1 1   24   10   28 o    626.2    2.8    0.0000   0.0000          ?        ?  3921.7998  35.1187          ?        ?      626.2        2.8       ?       ? 
1 1 1   24   10   29 o    730.2    3.0    0.0000   0.0000          ?        ?  5332.9326  43.4195          ?        ?      730.2        3.0       ?       ? 
1 1 1   24   10   30 o   1514.7    5.3    0.0000   0.0000          ?        ? 22946.5508 161.5460          ?        ?     1514.7        5.3       ?       ? 
1 1 1   24   10   31 o    482.6    2.6    0.0000   0.0000          ?        ?  2329.3269  24.9023          ?        ?      482.6        2.6       ?       ? 
1 1 1   24   10   32 o    692.0    3.1    0.0000   0.0000          ?        ?  4789.5508  43.4195          ?        ?      692.0        3.1       ?       ? 
1 1 1   24   10   33 o    131.8    5.6    0.0000   0.0000          ?        ?   173.6779  14.6860          ?        ?      131.8        5.6       ?       ? 
1 1 1   24   10   34 o    627.2    2.9    0.0000   0.0000          ?        ?  3933.9316  36.3957          ?        ?      627.2        2.9       ?       ? 
1 1 1   24   10   35 f    515.0    2.6    0.0000   0.0000          ?        ?  2652.4187  26.8179          ?        ?      515.0        2.6       ?       ? 
1 1 1   24   10   36 o     23.0   11.1    0.0000   0.0000          ?        ?   -24.2638  15.3245          ?        ?       23.0       11.1       ?       ? 
1 1 1   24   10   37 o    761.2    3.1    0.0000   0.0000          ?        ?  5795.2222  47.2506          ?        ?      761.2        3.1       ?       ? 
1 1 1   24   10   38 o    466.5    2.7    0.0000   0.0000          ?        ?  2176.0815  24.9023          ?        ?      466.5        2.7       ?       ? 
1 1 1   24   10   39 o    271.1    3.2    0.0000   0.0000          ?        ?   734.9384  17.2401          ?        ?      271.1        3.2       ?       ? 
1 1 1   24   10   40 o    713.9    3.0    0.0000   0.0000          ?        ?  5096.6797  42.7809          ?        ?      713.9        3.0       ?       ? 
1 1 1   24   10   41 o    406.6    2.7    0.0000   0.0000          ?        ?  1653.1324  22.3483          ?        ?      406.6        2.7       ?       ? 
1 1 1   24   10   42 o     74.9   11.1    0.0000   0.0000          ?        ?    56.1899  16.6016          ?        ?       74.9       11.1       ?       ? 
1 1 1   24   10   43 o    223.7    4.0    0.0000   0.0000          ?        ?   500.6010  17.8786          ?        ?      223.7        4.0       ?       ? 
1 1 1   24   10   44 o    324.6    3.0    0.0000   0.0000          ?        ?  1054.1992  19.7942          ?        ?      324.6        3.0       ?       ? 
1 1 1   24   10   45 o    551.1    2.8    0.0000   0.0000          ?        ?  3038.0859  30.6490          ?        ?      551.1        2.8       ?       ? 
1 1 1   24   10   46 o    214.8    3.9    0.0000   0.0000          ?        ?   461.6512  16.6016          ?        ?      214.8        3.9       ?       ? 
1 1 1   24   10   47 o    278.4    3.3    0.0000   0.0000          ?        ?   775.1653  18.5171          ?        ?      278.4        3.3       ?       ? 
1 1 1   24   10   48 o    216.4    4.3    0.0000   0.0000          ?        ?   468.6749  18.5171          ?        ?      216.4        4.3       ?       ? 
1 1 1   24   10   49 o    624.8    2.8    0.0000   0.0000          ?        ?  3905.1980  35.1187          ?        ?      624.8        2.8       ?       ? 
1 1 1   24   10   50 o    449.4    2.6    0.0000   0.0000          ?        ?  2020.2823  23.6253          ?        ?      449.4        2.6       ?       ? 
1 1 1   24   10   51 o     44.4   15.3    0.0000   0.0000          ?        ?    17.8786  16.6016          ?        ?       44.4       15.3       ?       ? 
1 1 1   24   10   52 o    300.5    3.4    0.0000   0.0000          ?        ?   903.5081  20.4327          ?        ?      300.5        3.4       ?       ? 
1 1 1   24   10   53 o    158.7    5.6    0.0000   0.0000          ?        ?   252.2160  17.8786          ?        ?      158.7        5.6       ?       ? 
1 1 1   24   10   54 o    384.7    2.8    0.0000   0.0000          ?        ?  1480.7316  21.7097          ?        ?      384.7        2.8       ?       ? 
1 1 1   24   10   55 o     23.4   11.4    0.0000   0.0000          ?        ?   -34.4802  17.8786          ?        ?       23.4       11.4       ?       ? 
1 1 1   24   10   56 o    142.6    6.5    0.0000   0.0000          ?        ?   203.6884  18.5171          ?        ?      142.6        6.5       ?       ? 
1 1 1   24   10   57 o    280.0    3.6    0.0000   0.0000          ?        ?   784.7431  20.4327          ?        ?      280.0        3.6       ?       ? 
1 1 1   24   10   58 o    276.0    3.6    0.0000   0.0000          ?        ?   762.3948  19.7942          ?        ?      276.0        3.6       ?       ? 
1 1 1   24   10   59 o     82.3   11.2    0.0000   0.0000          ?        ?    68.3218  18.5171          ?        ?       82.3       11.2       ?       ? 
1 1 1   24   10   60 o    237.3    4.2    0.0000   0.0000          ?        ?   563.8146  19.7942          ?        ?      237.3        4.2       ?       ? 
1 1 1   24   10   61 o    236.6    4.2    0.0000   0.0000          ?        ?   560.6220  19.7942          ?        ?      236.6        4.2       ?       ? 
1 1 1   24   10   62 f    316.0    3.4    0.0000   0.0000          ?        ?   999.2863  21.7097          ?        ?      316.0        3.4       ?       ? 
1 1 1   24   10   63 o    210.3    5.0    0.0000   0.0000          ?        ?   443.1340  21.0712          ?        ?      210.3        5.0       ?       ? 
1 1 1   24   10   64 o     50.7   16.5    0.0000   0.0000          ?        ?    25.5409  19.1556          ?        ?       50.7       16.5       ?       ? 
1 1 1   24   10   65 o    220.1    4.6    0.0000   0.0000          ?        ?   485.2764  20.4327          ?        ?      220.1        4.6       ?       ? 
1 1 1   24   10   66 o    151.5    6.7    0.0000   0.0000          ?        ?   230.5063  20.4327          ?        ?      151.5        6.7       ?       ? 
1 1 1   24   10   67 o     20.3   10.3    0.0000   0.0000          ?        ?   -69.5989  20.4327          ?        ?       20.3       10.3       ?       ? 
1 1 1   24   10   68 o    230.7    4.7    0.0000   0.0000          ?        ?   533.8041  21.7097          ?        ?      230.7        4.7       ?       ? 
1 1 1   24   10   69 o    214.1    5.1    0.0000   0.0000          ?        ?   459.7356  21.7097          ?        ?      214.1        5.1       ?       ? 
1 1 1   24   10   70 o    182.7    5.6    0.0000   0.0000          ?        ?   335.2238  20.4327          ?        ?      182.7        5.6       ?       ? 
1 1 1   24   10   71 o    111.4    9.5    0.0000   0.0000          ?        ?   125.7888  21.0712          ?        ?      111.4        9.5       ?       ? 
1 1 1   24   10   72 o     74.6   14.2    0.0000   0.0000          ?        ?    59.3825  20.4327          ?        ?       74.6       14.2       ?       ? 
1 1 1   24   10   73 o     52.1   17.0    0.0000   0.0000          ?        ?    28.0950  20.4327          ?        ?       52.1       17.0       ?       ? 
1 1 1   24   11    0 o   1373.9    7.5 18879.8086 204.9654 18879.8086 204.9654 18879.8086 204.9654     1373.9      7.5     1373.9        7.5     0.0     0.0 
1 1 1   24   11    1 o   1118.1    4.2    0.0000   0.0000          ?        ? 12502.2539  94.5012          ?        ?     1118.1        4.2       ?       ? 
1 1 1   24   11    2 o   1708.4    6.1    0.0000   0.0000          ?        ? 29191.2949 208.7966          ?        ?     1708.4        6.1       ?       ? 
1 1 1   24   11    3 o    831.3    3.3    0.0000   0.0000          ?        ?  6910.7197  54.9129          ?        ?      831.3        3.3       ?       ? 
1 1 1   24   11    4 o   1896.6    6.5    0.0000   0.0000          ?        ? 35974.3086 247.7464          ?        ?     1896.6        6.5       ?       ? 
1 1 1   24   11    5 o   1196.0    4.1    0.0000   0.0000          ?        ? 14305.4375  98.9709          ?        ?     1196.0        4.1       ?       ? 
1 1 1   24   11    6 o    790.3    3.0    0.0000   0.0000          ?        ?  6246.6572  47.8891          ?        ?      790.3        3.0       ?       ? 
1 1 1   24   11    7 o    437.6    2.3    0.0000   0.0000          ?        ?  1914.9263  19.7942          ?        ?      437.6        2.3       ?       ? 
1 1 1   24   11    8 o   1164.4    4.1    0.0000   0.0000          ?        ? 13559.6455  96.4168          ?        ?     1164.4        4.1       ?       ? 
1 1 1   24   11    9 o   1201.9    4.2    0.0000   0.0000          ?        ? 14447.1914 101.5249          ?        ?     1201.9        4.2       ?       ? 
1 1 1   24   11   10 o    854.7    3.2    0.0000   0.0000          ?        ?  7305.3257  54.2743          ?        ?      854.7        3.2       ?       ? 
1 1 1   24   11   11 o    695.8    2.8    0.0000   0.0000          ?        ?  4841.2710  38.3113          ?        ?      695.8        2.8       ?       ? 
1 1 1   24   11   12 o   1063.6    3.7    0.0000   0.0000          ?        ? 11312.6875  79.1767          ?        ?     1063.6        3.7       ?       ? 
1 1 1   24   11   13 o   1160.4    4.0    0.0000   0.0000          ?        ? 13465.7822  93.8627          ?        ?     1160.4        4.0       ?       ? 
1 1 1   24   11   14 f   1073.6    4.1    0.0000   0.0000          ?        ? 11527.2314  88.7545          ?        ?     1073.6        4.1       ?       ? 
1 1 1   24   11   15 o   1486.1    5.5    0.0000   0.0000          ?        ? 22088.3789 162.1845          ?        ?     1486.1        5.5       ?       ? 
1 1 1   24   11   16 o    137.5    4.2    0.0000   0.0000          ?        ?   189.0024  11.4934          ?        ?      137.5        4.2       ?       ? 
1 1 1   24   11   17 f   1489.7    5.4    0.0000   0.0000          ?        ? 22196.2891 159.6304          ?        ?     1489.7        5.4       ?       ? 
1 1 1   24   11   18 o    246.2    2.5    0.0000   0.0000          ?        ?   605.9570  12.1319          ?        ?      246.2        2.5       ?       ? 
1 1 1   24   11   19 o   1720.4    5.9    0.0000   0.0000          ?        ? 29601.8633 204.3269          ?        ?     1720.4        5.9       ?       ? 
1 1 1   24   11   20 o   1184.5    4.3    0.0000   0.0000          ?        ? 14031.5127 101.5249          ?        ?     1184.5        4.3       ?       ? 
1 1 1   24   11   21 o   1562.0    5.6    0.0000   0.0000          ?        ? 24402.3809 174.9549          ?        ?     1562.0        5.6       ?       ? 
1 1 1   24   11   22 o    379.8    2.8    0.0000   0.0000          ?        ?  1442.4203  21.0712          ?        ?      379.8        2.8       ?       ? 
1 1 1   24   11   23 o   1237.0    4.5    0.0000   0.0000          ?        ? 15302.8096 110.4642          ?        ?     1237.0        4.5       ?       ? 
1 1 1   24   11   24 o   1659.1    5.5    0.0000   0.0000          ?        ? 27529.2207 183.8942          ?        ?     1659.1        5.5       ?       ? 
1 1 1   24   11   25 o    520.7    2.8    0.0000   0.0000          ?        ?  2711.1628  28.7335          ?        ?      520.7        2.8       ?       ? 
1 1 1   24   11   26 o   1427.1    4.9    0.0000   0.0000          ?        ? 20367.5625 138.5592          ?        ?     1427.1        4.9       ?       ? 
1 1 1   24   11   27 f    747.2    3.0    0.0000   0.0000          ?        ?  5583.8716  45.3350          ?        ?      747.2        3.0       ?       ? 
1 1 1   24   11   28 o    876.4    3.4    0.0000   0.0000          ?        ?  7680.7769  59.3825          ?        ?      876.4        3.4       ?       ? 
1 1 1   24   11   29 f   1416.5    5.0    0.0000   0.0000          ?        ? 20068.0957 140.4748          ?        ?     1416.5        5.0       ?       ? 
1 1 1   24   11   30 o    524.6    2.7    0.0000   0.0000          ?        ?  2752.0283  28.0950          ?        ?      524.6        2.7       ?       ? 
1 1 1   24   11   31 o   1223.9    4.3    0.0000   0.0000          ?        ? 14982.2705 105.9946          ?        ?     1223.9        4.3       ?       ? 
1 1 1   24   11   32 o    115.5    6.9    0.0000   0.0000          ?        ?   133.4510  15.9630          ?        ?      115.5        6.9       ?       ? 
1 1 1   24   11   33 o    518.2    2.6    0.0000   0.0000          ?        ?  2685.6221  26.8179          ?        ?      518.2        2.6       ?       ? 
1 1 1   24   11   34 o    639.2    2.8    0.0000   0.0000          ?        ?  4085.9001  35.7572          ?        ?      639.2        2.8       ?       ? 
1 1 1   24   11   35 o    424.8    2.5    0.0000   0.0000          ?        ?  1804.4622  21.0712          ?        ?      424.8        2.5       ?       ? 
1 1 1   24   11   36 o    325.7    2.6    0.0000   0.0000          ?        ?  1061.2229  17.2401          ?        ?      325.7        2.6       ?       ? 
1 1 1   24   11   37 o    468.7    2.5    0.0000   0.0000          ?        ?  2197.1531  23.6253          ?        ?      468.7        2.5       ?       ? 
1 1 1   24   11   38 o    504.0    2.7    0.0000   0.0000          ?        ?  2540.0391  27.4564          ?        ?      504.0        2.7       ?       ? 
1 1 1   24   11   39 o    323.0    2.8    0.0000   0.0000          ?        ?  1043.3442  17.8786          ?        ?      323.0        2.8       ?       ? 
1 1 1   24   11   40 o    257.4    3.3    0.0000   0.0000          ?        ?   662.7855  17.2401          ?        ?      257.4        3.3       ?       ? 
1 1 1   24   11   41 o    264.8    3.4    0.0000   0.0000          ?        ?   701.0967  17.8786          ?        ?      264.8        3.4       ?       ? 
1 1 1   24   11   42 o    510.3    2.6    0.0000   0.0000          ?        ?  2604.5298  26.1794          ?        ?      510.3        2.6       ?       ? 
1 1 1   24   11   43 o    221.8    3.9    0.0000   0.0000          ?        ?   492.3002  17.2401          ?        ?      221.8        3.9       ?       ? 
1 1 1   24   11   44 o    282.0    3.1    0.0000   0.0000          ?        ?   795.5980  17.2401          ?        ?      282.0        3.1       ?       ? 
1 1 1   24   11   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   11   46 o    114.0    7.3    0.0000   0.0000          ?        ?   130.2584  16.6016          ?        ?      114.0        7.3       ?       ? 
1 1 1   24   11   47 o    589.6    2.7    0.0000   0.0000          ?        ?  3476.7502  31.9261          ?        ?      589.6        2.7       ?       ? 
1 1 1   24   11   48 o    299.5    3.1    0.0000   0.0000          ?        ?   897.1229  18.5171          ?        ?      299.5        3.1       ?       ? 
1 1 1   24   11   49 o    396.4    2.7    0.0000   0.0000          ?        ?  1571.4017  21.0712          ?        ?      396.4        2.7       ?       ? 
1 1 1   24   11   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   11   51 o     22.0   10.8    0.0000   0.0000          ?        ?   -38.3113  17.2401          ?        ?       22.0       10.8       ?       ? 
1 1 1   24   11   52 o    137.8    6.3    0.0000   0.0000          ?        ?   190.2794  17.2401          ?        ?      137.8        6.3       ?       ? 
1 1 1   24   11   53 o     80.1   10.8    0.0000   0.0000          ?        ?    64.4907  17.2401          ?        ?       80.1       10.8       ?       ? 
1 1 1   24   11   54 o    216.5    4.1    0.0000   0.0000          ?        ?   469.3134  17.8786          ?        ?      216.5        4.1       ?       ? 
1 1 1   24   11   55 o     66.2   13.9    0.0000   0.0000          ?        ?    45.9736  17.8786          ?        ?       66.2       13.9       ?       ? 
1 1 1   24   11   56 o    261.4    3.5    0.0000   0.0000          ?        ?   683.8566  18.5171          ?        ?      261.4        3.5       ?       ? 
1 1 1   24   11   57 o    175.8    5.1    0.0000   0.0000          ?        ?   309.6830  17.8786          ?        ?      175.8        5.1       ?       ? 
1 1 1   24   11   58 o    291.4    3.4    0.0000   0.0000          ?        ?   849.8723  19.7942          ?        ?      291.4        3.4       ?       ? 
1 1 1   24   11   59 o     32.6   14.4    0.0000   0.0000          ?        ?    -5.7467  18.5171          ?        ?       32.6       14.4       ?       ? 
1 1 1   24   11   60 o     19.4    9.8    0.0000   0.0000          ?        ?   -67.6833  19.1556          ?        ?       19.4        9.8       ?       ? 
1 1 1   24   11   61 o    377.9    3.0    0.0000   0.0000          ?        ?  1429.0115  22.9868          ?        ?      377.9        3.0       ?       ? 
1 1 1   24   11   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   11   63 o    322.3    3.5    0.0000   0.0000          ?        ?  1039.5132  22.3483          ?        ?      322.3        3.5       ?       ? 
1 1 1   24   11   64 o     61.6   15.9    0.0000   0.0000          ?        ?    40.2269  19.7942          ?        ?       61.6       15.9       ?       ? 
1 1 1   24   11   65 o     76.5   13.9    0.0000   0.0000          ?        ?    61.2981  20.4327          ?        ?       76.5       13.9       ?       ? 
1 1 1   24   11   66 o     73.0   14.5    0.0000   0.0000          ?        ?    56.1899  20.4327          ?        ?       73.0       14.5       ?       ? 
1 1 1   24   11   67 o    362.3    3.3    0.0000   0.0000          ?        ?  1314.0775  24.2638          ?        ?      362.3        3.3       ?       ? 
1 1 1   24   11   68 o    121.5    8.4    0.0000   0.0000          ?        ?   148.7755  20.4327          ?        ?      121.5        8.4       ?       ? 
1 1 1   24   11   69 o    159.1    6.6    0.0000   0.0000          ?        ?   254.7701  21.0712          ?        ?      159.1        6.6       ?       ? 
1 1 1   24   11   70 o     26.6   12.8    0.0000   0.0000          ?        ?   -28.0950  19.7942          ?        ?       26.6       12.8       ?       ? 
1 1 1   24   11   71 o     87.0   11.4    0.0000   0.0000          ?        ?    77.2611  19.7942          ?        ?       87.0       11.4       ?       ? 
1 1 1   24   11   72 o    205.6    5.0    0.0000   0.0000          ?        ?   424.6169  20.4327          ?        ?      205.6        5.0       ?       ? 
1 1 1   24   11   73 o    123.2    8.3    0.0000   0.0000          ?        ?   153.8837  20.4327          ?        ?      123.2        8.3       ?       ? 
1 1 1   24   12    0 o   1396.3    7.8 19500.4512 217.7359 19500.4512 217.7359 19500.4512 217.7359     1396.3      7.8     1396.3        7.8     0.0     0.0 
1 1 1   24   12    1 o   1454.3    5.7    0.0000   0.0000          ?        ? 21151.6680 166.0156          ?        ?     1454.3        5.7       ?       ? 
1 1 1   24   12    2 o    994.1    4.0    0.0000   0.0000          ?        ?  9882.3984  79.1767          ?        ?      994.1        4.0       ?       ? 
1 1 1   24   12    3 o   1113.9    4.4    0.0000   0.0000          ?        ? 12409.0293  97.6938          ?        ?     1113.9        4.4       ?       ? 
1 1 1   24   12    4 o   1281.7    4.7    0.0000   0.0000          ?        ? 16428.5215 120.0421          ?        ?     1281.7        4.7       ?       ? 
1 1 1   24   12    5 o    538.4    2.5    0.0000   0.0000          ?        ?  2898.8882  27.4564          ?        ?      538.4        2.5       ?       ? 
1 1 1   24   12    6 o   1401.0    4.9    0.0000   0.0000          ?        ? 19630.0703 138.5592          ?        ?     1401.0        4.9       ?       ? 
1 1 1   24   12    7 o    820.0    3.0    0.0000   0.0000          ?        ?  6723.6328  49.1662          ?        ?      820.0        3.0       ?       ? 
1 1 1   24   12    8 o    896.9    3.2    0.0000   0.0000          ?        ?  8045.3726  58.1055          ?        ?      896.9        3.2       ?       ? 
1 1 1   24   12    9 o   1015.1    3.6    0.0000   0.0000          ?        ? 10304.4619  72.7915          ?        ?     1015.1        3.6       ?       ? 
1 1 1   24   12   10 o   1790.4    6.0    0.0000   0.0000          ?        ? 32060.8105 216.4588          ?        ?     1790.4        6.0       ?       ? 
1 1 1   24   12   11 o    523.9    2.5    0.0000   0.0000          ?        ?  2745.0044  26.1794          ?        ?      523.9        2.5       ?       ? 
1 1 1   24   12   12 o    700.6    2.8    0.0000   0.0000          ?        ?  4908.3159  39.5883          ?        ?      700.6        2.8       ?       ? 
1 1 1   24   12   13 o   1365.5    4.9    0.0000   0.0000          ?        ? 18648.0234 134.7281          ?        ?     1365.5        4.9       ?       ? 
1 1 1   24   12   14 o   1876.1    6.7    0.0000   0.0000          ?        ? 35202.9766 252.2160          ?        ?     1876.1        6.7       ?       ? 
1 1 1   24   12   15 o   1737.6    6.4    0.0000   0.0000          ?        ? 30197.6016 224.1211          ?        ?     1737.6        6.4       ?       ? 
1 1 1   24   12   16 o   1163.1    4.3    0.0000   0.0000          ?        ? 13530.2734  98.9709          ?        ?     1163.1        4.3       ?       ? 
1 1 1   24   12   17 o   1494.8    5.1    0.0000   0.0000          ?        ? 22345.7031 153.2452          ?        ?     1494.8        5.1       ?       ? 
1 1 1   24   12   18 o    159.0    3.6    0.0000   0.0000          ?        ?   252.8546  11.4934          ?        ?      159.0        3.6       ?       ? 
1 1 1   24   12   19 o   1551.9    5.2    0.0000   0.0000          ?        ? 24087.5898 161.5460          ?        ?     1551.9        5.2       ?       ? 
1 1 1   24   12   20 o   1015.4    3.7    0.0000   0.0000          ?        ? 10310.2080  75.3456          ?        ?     1015.4        3.7       ?       ? 
1 1 1   24   12   21 f    674.2    3.1    0.0000   0.0000          ?        ?  4546.2739  42.1424          ?        ?      674.2        3.1       ?       ? 
1 1 1   24   12   22 o   1023.2    3.8    0.0000   0.0000          ?        ? 10469.2002  78.5382          ?        ?     1023.2        3.8       ?       ? 
1 1 1   24   12   23 o    773.4    3.1    0.0000   0.0000          ?        ?  5981.0322  48.5276          ?        ?      773.4        3.1       ?       ? 
1 1 1   24   12   24 o    775.8    3.0    0.0000   0.0000          ?        ?  6018.7046  47.2506          ?        ?      775.8        3.0       ?       ? 
1 1 1   24   12   25 o   1302.1    4.5    0.0000   0.0000          ?        ? 16955.9414 116.2109          ?        ?     1302.1        4.5       ?       ? 
1 1 1   24   12   26 o    823.6    3.2    0.0000   0.0000          ?        ?  6783.6538  52.3588          ?        ?      823.6        3.2       ?       ? 
1 1 1   24   12   27 o    486.6    2.6    0.0000   0.0000          ?        ?  2368.2766  25.5409          ?        ?      486.6        2.6       ?       ? 
1 1 1   24   12   28 o    220.0    3.5    0.0000   0.0000          ?        ?   483.9994  15.3245          ?        ?      220.0        3.5       ?       ? 
1 1 1   24   12   29 o   1207.1    4.2    0.0000   0.0000          ?        ? 14572.9795 101.5249          ?        ?     1207.1        4.2       ?       ? 
1 1 1   24   12   30 o     41.9   15.9    0.0000   0.0000          ?        ?    12.1319  18.5171          ?        ?       41.9       15.9       ?       ? 
1 1 1   24   12   31 o    334.2    2.8    0.0000   0.0000          ?        ?  1116.7743  18.5171          ?        ?      334.2        2.8       ?       ? 
1 1 1   24   12   32 o    448.4    2.5    0.0000   0.0000          ?        ?  2010.7046  22.3483          ?        ?      448.4        2.5       ?       ? 
1 1 1   24   12   33 o    707.0    3.1    0.0000   0.0000          ?        ?  4998.9858  44.0580          ?        ?      707.0        3.1       ?       ? 
1 1 1   24   12   34 o    408.9    2.6    0.0000   0.0000          ?        ?  1672.2881  21.0712          ?        ?      408.9        2.6       ?       ? 
1 1 1   24   12   35 o    538.7    2.5    0.0000   0.0000          ?        ?  2902.0808  27.4564          ?        ?      538.7        2.5       ?       ? 
1 1 1   24   12   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   12   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   12   38 o    266.0    3.0    0.0000   0.0000          ?        ?   707.4820  15.9630          ?        ?      266.0        3.0       ?       ? 
1 1 1   24   12   39 o     36.9   14.4    0.0000   0.0000          ?        ?     8.3008  15.3245          ?        ?       36.9       14.4       ?       ? 
1 1 1   24   12   40 o    435.4    2.6    0.0000   0.0000          ?        ?  1895.7706  22.9868          ?        ?      435.4        2.6       ?       ? 
1 1 1   24   12   41 f    269.7    3.2    0.0000   0.0000          ?        ?   727.2761  17.2401          ?        ?      269.7        3.2       ?       ? 
1 1 1   24   12   42 o    180.4    4.6    0.0000   0.0000          ?        ?   325.6460  16.6016          ?        ?      180.4        4.6       ?       ? 
1 1 1   24   12   43 f    384.3    2.6    0.0000   0.0000          ?        ?  1476.9005  19.7942          ?        ?      384.3        2.6       ?       ? 
1 1 1   24   12   44 o    367.4    2.6    0.0000   0.0000          ?        ?  1349.8347  19.1556          ?        ?      367.4        2.6       ?       ? 
1 1 1   24   12   45 o    259.3    3.3    0.0000   0.0000          ?        ?   672.3633  17.2401          ?        ?      259.3        3.3       ?       ? 
1 1 1   24   12   46 o    131.5    6.1    0.0000   0.0000          ?        ?   173.0394  15.9630          ?        ?      131.5        6.1       ?       ? 
1 1 1   24   12   47 o    336.1    2.9    0.0000   0.0000          ?        ?  1130.1832  19.7942          ?        ?      336.1        2.9       ?       ? 
1 1 1   24   12   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   12   49 o    155.1    5.6    0.0000   0.0000          ?        ?   240.7227  17.2401          ?        ?      155.1        5.6       ?       ? 
1 1 1   24   12   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   12   51 o     33.7   14.4    0.0000   0.0000          ?        ?    -0.6385  17.2401          ?        ?       33.7       14.4       ?       ? 
1 1 1   24   12   52 o    325.1    3.0    0.0000   0.0000          ?        ?  1057.3918  19.7942          ?        ?      325.1        3.0       ?       ? 
1 1 1   24   12   53 o    385.4    2.9    0.0000   0.0000          ?        ?  1485.8398  22.3483          ?        ?      385.4        2.9       ?       ? 
1 1 1   24   12   54 o    223.8    4.0    0.0000   0.0000          ?        ?   501.2395  17.8786          ?        ?      223.8        4.0       ?       ? 
1 1 1   24   12   55 o    310.9    3.1    0.0000   0.0000          ?        ?   967.3603  19.1556          ?        ?      310.9        3.1       ?       ? 
1 1 1   24   12   56 o     67.2   13.8    0.0000   0.0000          ?        ?    47.2506  17.8786          ?        ?       67.2       13.8       ?       ? 
1 1 1   24   12   57 o     22.7   11.2    0.0000   0.0000          ?        ?   -41.5039  18.5171          ?        ?       22.7       11.2       ?       ? 
1 1 1   24   12   58 o     35.1   15.0    0.0000   0.0000          ?        ?     0.0000  18.5171          ?        ?       35.1       15.0       ?       ? 
1 1 1   24   12   59 o     22.9   11.4    0.0000   0.0000          ?        ?   -47.2506  19.7942          ?        ?       22.9       11.4       ?       ? 
1 1 1   24   12   60 o    106.9    9.3    0.0000   0.0000          ?        ?   114.9339  19.7942          ?        ?      106.9        9.3       ?       ? 
1 1 1   24   12   61 o    263.7    4.0    0.0000   0.0000          ?        ?   695.9886  21.0712          ?        ?      263.7        4.0       ?       ? 
1 1 1   24   12   62 o    401.6    3.0    0.0000   0.0000          ?        ?  1614.1827  24.2638          ?        ?      401.6        3.0       ?       ? 
1 1 1   24   12   63 o    274.7    3.7    0.0000   0.0000          ?        ?   755.3711  20.4327          ?        ?      274.7        3.7       ?       ? 
1 1 1   24   12   64 f    179.5    5.7    0.0000   0.0000          ?        ?   323.0919  20.4327          ?        ?      179.5        5.7       ?       ? 
1 1 1   24   12   65 o     20.4   10.3    0.0000   0.0000          ?        ?   -63.8522  19.7942          ?        ?       20.4       10.3       ?       ? 
1 1 1   24   12   66 o    279.8    3.9    0.0000   0.0000          ?        ?   784.1046  21.7097          ?        ?      279.8        3.9       ?       ? 
1 1 1   24   12   67 o    192.3    5.5    0.0000   0.0000          ?        ?   370.9810  21.0712          ?        ?      192.3        5.5       ?       ? 
1 1 1   24   12   68 o    188.4    5.4    0.0000   0.0000          ?        ?   356.2951  20.4327          ?        ?      188.4        5.4       ?       ? 
1 1 1   24   12   69 o    179.7    5.9    0.0000   0.0000          ?        ?   324.3690  21.0712          ?        ?      179.7        5.9       ?       ? 
1 1 1   24   12   70 o    127.5    7.8    0.0000   0.0000          ?        ?   164.1001  19.7942          ?        ?      127.5        7.8       ?       ? 
1 1 1   24   12   71 o     35.0   15.2    0.0000   0.0000          ?        ?    -1.9156  19.7942          ?        ?       35.0       15.2       ?       ? 
1 1 1   24   12   72 o     53.3   16.7    0.0000   0.0000          ?        ?    30.0105  19.7942          ?        ?       53.3       16.7       ?       ? 
1 1 1   24   13    0 o    169.7    4.9  288.6118  16.6016   288.6118  16.6016   288.6118  16.6016      169.7      4.9      169.7        4.9     0.0     0.0 
1 1 1   24   13    1 o    939.6    3.9    0.0000   0.0000          ?        ?  8829.4775  72.7915          ?        ?      939.6        3.9       ?       ? 
1 1 1   24   13    2 o   1280.1    5.3    0.0000   0.0000          ?        ? 16388.9336 134.7281          ?        ?     1280.1        5.3       ?       ? 
1 1 1   24   13    3 o   1024.3    3.9    0.0000   0.0000          ?        ? 10491.5488  79.8152          ?        ?     1024.3        3.9       ?       ? 
1 1 1   24   13    4 o    588.9    2.6    0.0000   0.0000          ?        ?  3467.8108  30.6490          ?        ?      588.9        2.6       ?       ? 
1 1 1   24   13    5 o   1275.4    4.7    0.0000   0.0000          ?        ? 16268.8916 119.4035          ?        ?     1275.4        4.7       ?       ? 
1 1 1   24   13    6 o    518.7    2.5    0.0000   0.0000          ?        ?  2690.0916  26.1794          ?        ?      518.7        2.5       ?       ? 
1 1 1   24   13    7 o    527.1    2.5    0.0000   0.0000          ?        ?  2778.2075  26.8179          ?        ?      527.1        2.5       ?       ? 
1 1 1   24   13    8 o    639.3    2.7    0.0000   0.0000          ?        ?  4086.5383  34.4802          ?        ?      639.3        2.7       ?       ? 
1 1 1   24   13    9 o    206.5    2.8    0.0000   0.0000          ?        ?   426.5325  11.4934          ?        ?      206.5        2.8       ?       ? 
1 1 1   24   13   10 f   1150.5    4.2    0.0000   0.0000          ?        ? 13238.4688  97.6938          ?        ?     1150.5        4.2       ?       ? 
1 1 1   24   13   11 o   1814.4    6.4    0.0000   0.0000          ?        ? 32924.7305 231.1448          ?        ?     1814.4        6.4       ?       ? 
1 1 1   24   13   12 o    390.1    2.3    0.0000   0.0000          ?        ?  1521.5970  17.8786          ?        ?      390.1        2.3       ?       ? 
1 1 1   24   13   13 o    821.3    3.3    0.0000   0.0000          ?        ?  6745.3428  54.9129          ?        ?      821.3        3.3       ?       ? 
1 1 1   24   13   14 o    889.5    3.3    0.0000   0.0000          ?        ?  7911.9214  58.7440          ?        ?      889.5        3.3       ?       ? 
1 1 1   24   13   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   13   16 o    793.4    3.3    0.0000   0.0000          ?        ?  6295.1851  52.9973          ?        ?      793.4        3.3       ?       ? 
1 1 1   24   13   17 o    674.2    2.9    0.0000   0.0000          ?        ?  4544.9971  39.5883          ?        ?      674.2        2.9       ?       ? 
1 1 1   24   13   18 o    898.8    3.5    0.0000   0.0000          ?        ?  8079.2144  63.2136          ?        ?      898.8        3.5       ?       ? 
1 1 1   24   13   19 o    278.0    2.6    0.0000   0.0000          ?        ?   772.6111  14.6860          ?        ?      278.0        2.6       ?       ? 
1 1 1   24   13   20 o    548.9    2.6    0.0000   0.0000          ?        ?  3012.5449  28.0950          ?        ?      548.9        2.6       ?       ? 
1 1 1   24   13   21 o   1057.9    3.9    0.0000   0.0000          ?        ? 11191.3682  81.7308          ?        ?     1057.9        3.9       ?       ? 
1 1 1   24   13   22 o    321.9    2.8    0.0000   0.0000          ?        ?  1036.3207  17.8786          ?        ?      321.9        2.8       ?       ? 
1 1 1   24   13   23 o    676.2    2.8    0.0000   0.0000          ?        ?  4572.4531  37.6728          ?        ?      676.2        2.8       ?       ? 
1 1 1   24   13   24 o   1001.1    3.7    0.0000   0.0000          ?        ? 10022.8740  73.4300          ?        ?     1001.1        3.7       ?       ? 
1 1 1   24   13   25 o   1023.6    3.8    0.0000   0.0000          ?        ? 10478.1396  78.5382          ?        ?     1023.6        3.8       ?       ? 
1 1 1   24   13   26 o    313.4    2.6    0.0000   0.0000          ?        ?   982.0463  16.6016          ?        ?      313.4        2.6       ?       ? 
1 1 1   24   13   27 o    835.4    3.2    0.0000   0.0000          ?        ?  6979.0415  53.6358          ?        ?      835.4        3.2       ?       ? 
1 1 1   24   13   28 o    665.3    2.8    0.0000   0.0000          ?        ?  4426.8701  37.6728          ?        ?      665.3        2.8       ?       ? 
1 1 1   24   13   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   13   30 f    322.9    2.7    0.0000   0.0000          ?        ?  1042.7058  17.2401          ?        ?      322.9        2.7       ?       ? 
1 1 1   24   13   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   13   32 o    384.5    2.6    0.0000   0.0000          ?        ?  1478.8162  19.7942          ?        ?      384.5        2.6       ?       ? 
1 1 1   24   13   33 o    471.3    2.6    0.0000   0.0000          ?        ?  2221.4167  24.9023          ?        ?      471.3        2.6       ?       ? 
1 1 1   24   13   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   13   35 o    697.4    3.0    0.0000   0.0000          ?        ?  4864.2578  41.5039          ?        ?      697.4        3.0       ?       ? 
1 1 1   24   13   36 o    586.2    2.7    0.0000   0.0000          ?        ?  3437.1619  31.2876          ?        ?      586.2        2.7       ?       ? 
1 1 1   24   13   37 o    889.9    3.4    0.0000   0.0000          ?        ?  7921.4990  60.6596          ?        ?      889.9        3.4       ?       ? 
1 1 1   24   13   38 o    101.0    7.9    0.0000   0.0000          ?        ?   102.1635  15.9630          ?        ?      101.0        7.9       ?       ? 
1 1 1   24   13   39 o    315.3    2.9    0.0000   0.0000          ?        ?   994.1782  18.5171          ?        ?      315.3        2.9       ?       ? 
1 1 1   24   13   40 o    159.0    4.8    0.0000   0.0000          ?        ?   252.8546  15.3245          ?        ?      159.0        4.8       ?       ? 
1 1 1   24   13   41 o    360.6    2.7    0.0000   0.0000          ?        ?  1300.6686  19.1556          ?        ?      360.6        2.7       ?       ? 
1 1 1   24   13   42 o    363.4    2.6    0.0000   0.0000          ?        ?  1320.4628  19.1556          ?        ?      363.4        2.6       ?       ? 
1 1 1   24   13   43 o    644.2    2.7    0.0000   0.0000          ?        ?  4151.0288  35.1187          ?        ?      644.2        2.7       ?       ? 
1 1 1   24   13   44 o     98.4    7.8    0.0000   0.0000          ?        ?    97.0553  15.3245          ?        ?       98.4        7.8       ?       ? 
1 1 1   24   13   45 f    153.6    5.2    0.0000   0.0000          ?        ?   236.2530  15.9630          ?        ?      153.6        5.2       ?       ? 
1 1 1   24   13   46 o    334.3    2.9    0.0000   0.0000          ?        ?  1118.0514  19.1556          ?        ?      334.3        2.9       ?       ? 
1 1 1   24   13   47 o    185.8    4.6    0.0000   0.0000          ?        ?   345.4402  17.2401          ?        ?      185.8        4.6       ?       ? 
1 1 1   24   13   48 o     46.7   15.4    0.0000   0.0000          ?        ?    21.0712  16.6016          ?        ?       46.7       15.4       ?       ? 
1 1 1   24   13   49 o    399.7    2.7    0.0000   0.0000          ?        ?  1598.2196  21.7097          ?        ?      399.7        2.7       ?       ? 
1 1 1   24   13   50 f    286.3    3.2    0.0000   0.0000          ?        ?   819.8618  18.5171          ?        ?      286.3        3.2       ?       ? 
1 1 1   24   13   51 o     83.3   10.0    0.0000   0.0000          ?        ?    69.5989  16.6016          ?        ?       83.3       10.0       ?       ? 
1 1 1   24   13   52 o    229.7    3.9    0.0000   0.0000          ?        ?   528.0574  17.8786          ?        ?      229.7        3.9       ?       ? 
1 1 1   24   13   53 o     36.9   15.0    0.0000   0.0000          ?        ?     5.7467  17.2401          ?        ?       36.9       15.0       ?       ? 
1 1 1   24   13   54 f    549.5    2.8    0.0000   0.0000          ?        ?  3020.8459  30.6490          ?        ?      549.5        2.8       ?       ? 
1 1 1   24   13   55 o    313.3    3.2    0.0000   0.0000          ?        ?   982.0463  19.7942          ?        ?      313.3        3.2       ?       ? 
1 1 1   24   13   56 o    338.2    3.0    0.0000   0.0000          ?        ?  1144.2307  20.4327          ?        ?      338.2        3.0       ?       ? 
1 1 1   24   13   57 o    174.6    5.3    0.0000   0.0000          ?        ?   305.2133  18.5171          ?        ?      174.6        5.3       ?       ? 
1 1 1   24   13   58 o    313.0    3.3    0.0000   0.0000          ?        ?   980.1307  20.4327          ?        ?      313.0        3.3       ?       ? 
1 1 1   24   13   59 o    194.3    5.1    0.0000   0.0000          ?        ?   378.0048  19.7942          ?        ?      194.3        5.1       ?       ? 
1 1 1   24   13   60 o     29.2   13.7    0.0000   0.0000          ?        ?   -19.1556  19.7942          ?        ?       29.2       13.7       ?       ? 
1 1 1   24   13   61 o     28.2   13.2    0.0000   0.0000          ?        ?   -17.8786  18.5171          ?        ?       28.2       13.2       ?       ? 
1 1 1   24   13   62 o    322.4    3.4    0.0000   0.0000          ?        ?  1040.1517  21.7097          ?        ?      322.4        3.4       ?       ? 
1 1 1   24   13   63 o    118.4    8.6    0.0000   0.0000          ?        ?   141.1133  20.4327          ?        ?      118.4        8.6       ?       ? 
1 1 1   24   13   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   13   65 o     87.7   11.3    0.0000   0.0000          ?        ?    77.8996  19.7942          ?        ?       87.7       11.3       ?       ? 
1 1 1   24   13   66 o    251.4    4.3    0.0000   0.0000          ?        ?   633.4135  21.7097          ?        ?      251.4        4.3       ?       ? 
1 1 1   24   13   67 o    194.2    5.4    0.0000   0.0000          ?        ?   378.6433  21.0712          ?        ?      194.2        5.4       ?       ? 
1 1 1   24   13   68 o     31.6   14.5    0.0000   0.0000          ?        ?   -14.6860  21.0712          ?        ?       31.6       14.5       ?       ? 
1 1 1   24   13   69 o    113.2    9.0    0.0000   0.0000          ?        ?   129.6199  20.4327          ?        ?      113.2        9.0       ?       ? 
1 1 1   24   13   70 o    162.6    6.3    0.0000   0.0000          ?        ?   266.2635  20.4327          ?        ?      162.6        6.3       ?       ? 
1 1 1   24   13   71 o     68.3   15.3    0.0000   0.0000          ?        ?    50.4432  20.4327          ?        ?       68.3       15.3       ?       ? 
1 1 1   24   13   72 o     26.9   12.9    0.0000   0.0000          ?        ?   -26.1794  19.7942          ?        ?       26.9       12.9       ?       ? 
1 1 1   24   14    0 o    555.9    4.1 3091.0833  45.9736  3091.0833  45.9736  3091.0833  45.9736      555.9      4.1      555.9        4.1     0.0     0.0 
1 1 1   24   14    1 o   1351.1    5.5    0.0000   0.0000          ?        ? 18257.2500 147.4985          ?        ?     1351.1        5.5       ?       ? 
1 1 1   24   14    2 o   1430.0    5.8    0.0000   0.0000          ?        ? 20450.5703 164.7386          ?        ?     1430.0        5.8       ?       ? 
1 1 1   24   14    3 o    264.5    3.0    0.0000   0.0000          ?        ?   699.8197  15.9630          ?        ?      264.5        3.0       ?       ? 
1 1 1   24   14    4 o    383.8    2.3    0.0000   0.0000          ?        ?  1473.0693  17.8786          ?        ?      383.8        2.3       ?       ? 
1 1 1   24   14    5 o    422.5    2.6    0.0000   0.0000          ?        ?  1785.3065  21.7097          ?        ?      422.5        2.6       ?       ? 
1 1 1   24   14    6 f    329.8    2.3    0.0000   0.0000          ?        ?  1087.4023  15.3245          ?        ?      329.8        2.3       ?       ? 
1 1 1   24   14    7 o   1032.1    3.8    0.0000   0.0000          ?        ? 10653.0947  79.1767          ?        ?     1032.1        3.8       ?       ? 
1 1 1   24   14    8 o   1151.0    4.2    0.0000   0.0000          ?        ? 13248.0469  97.6938          ?        ?     1151.0        4.2       ?       ? 
1 1 1   24   14    9 o    899.3    3.4    0.0000   0.0000          ?        ?  8088.1533  61.9366          ?        ?      899.3        3.4       ?       ? 
1 1 1   24   14   10 o    816.8    3.4    0.0000   0.0000          ?        ?  6671.9126  55.5514          ?        ?      816.8        3.4       ?       ? 
1 1 1   24   14   11 o    654.6    2.9    0.0000   0.0000          ?        ?  4285.1187  37.6728          ?        ?      654.6        2.9       ?       ? 
1 1 1   24   14   12 o   1055.6    4.1    0.0000   0.0000          ?        ? 11142.8408  86.8389          ?        ?     1055.6        4.1       ?       ? 
1 1 1   24   14   13 o    547.8    2.4    0.0000   0.0000          ?        ?  3001.0518  26.8179          ?        ?      547.8        2.4       ?       ? 
1 1 1   24   14   14 o    896.2    3.5    0.0000   0.0000          ?        ?  8031.9639  62.5751          ?        ?      896.2        3.5       ?       ? 
1 1 1   24   14   15 o   1040.8    3.9    0.0000   0.0000          ?        ? 10832.5195  81.0922          ?        ?     1040.8        3.9       ?       ? 
1 1 1   24   14   16 o    647.7    2.9    0.0000   0.0000          ?        ?  4195.0869  37.0343          ?        ?      647.7        2.9       ?       ? 
1 1 1   24   14   17 o   2570.9    9.0    0.0000   0.0000          ?        ? 66124.0234 464.8438          ?        ?     2570.9        9.0       ?       ? 
1 1 1   24   14   18 o   1265.6    4.6    0.0000   0.0000          ?        ? 16019.8682 115.5724          ?        ?     1265.6        4.6       ?       ? 
1 1 1   24   14   19 o   1382.5    4.8    0.0000   0.0000          ?        ? 19115.4219 133.4510          ?        ?     1382.5        4.8       ?       ? 
1 1 1   24   14   20 o    483.1    2.4    0.0000   0.0000          ?        ?  2333.7966  23.6253          ?        ?      483.1        2.4       ?       ? 
1 1 1   24   14   21 o    576.8    2.6    0.0000   0.0000          ?        ?  3326.6978  30.0105          ?        ?      576.8        2.6       ?       ? 
1 1 1   24   14   22 o    829.9    3.3    0.0000   0.0000          ?        ?  6887.7324  55.5514          ?        ?      829.9        3.3       ?       ? 
1 1 1   24   14   23 o    648.3    2.7    0.0000   0.0000          ?        ?  4203.3877  34.4802          ?        ?      648.3        2.7       ?       ? 
1 1 1   24   14   24 o    939.4    3.5    0.0000   0.0000          ?        ?  8825.0068  65.1292          ?        ?      939.4        3.5       ?       ? 
1 1 1   24   14   25 o    359.7    2.6    0.0000   0.0000          ?        ?  1293.6449  18.5171          ?        ?      359.7        2.6       ?       ? 
1 1 1   24   14   26 o   1191.7    4.2    0.0000   0.0000          ?        ? 14202.6367  99.6094          ?        ?     1191.7        4.2       ?       ? 
1 1 1   24   14   27 o    423.7    2.4    0.0000   0.0000          ?        ?  1794.8843  20.4327          ?        ?      423.7        2.4       ?       ? 
1 1 1   24   14   28 o    344.6    3.1    0.0000   0.0000          ?        ?  1187.6503  21.0712          ?        ?      344.6        3.1       ?       ? 
1 1 1   24   14   29 o    870.8    3.3    0.0000   0.0000          ?        ?  7583.0825  57.4669          ?        ?      870.8        3.3       ?       ? 
1 1 1   24   14   30 o    888.1    3.4    0.0000   0.0000          ?        ?  7887.6582  60.6596          ?        ?      888.1        3.4       ?       ? 
1 1 1   24   14   31 o    583.3    2.7    0.0000   0.0000          ?        ?  3402.6819  31.2876          ?        ?      583.3        2.7       ?       ? 
1 1 1   24   14   32 o    571.8    2.8    0.0000   0.0000          ?        ?  3269.8691  31.9261          ?        ?      571.8        2.8       ?       ? 
1 1 1   24   14   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   14   34 o   1038.4    3.8    0.0000   0.0000          ?        ? 10785.2686  78.5382          ?        ?     1038.4        3.8       ?       ? 
1 1 1   24   14   35 o    493.3    2.6    0.0000   0.0000          ?        ?  2434.0444  25.5409          ?        ?      493.3        2.6       ?       ? 
1 1 1   24   14   36 o    273.1    3.2    0.0000   0.0000          ?        ?   745.7933  17.2401          ?        ?      273.1        3.2       ?       ? 
1 1 1   24   14   37 o    405.1    2.6    0.0000   0.0000          ?        ?  1641.0006  21.0712          ?        ?      405.1        2.6       ?       ? 
1 1 1   24   14   38 o    651.6    2.8    0.0000   0.0000          ?        ?  4246.8071  37.0343          ?        ?      651.6        2.8       ?       ? 
1 1 1   24   14   39 o    196.8    4.1    0.0000   0.0000          ?        ?   387.5826  15.9630          ?        ?      196.8        4.1       ?       ? 
1 1 1   24   14   40 o    541.1    2.7    0.0000   0.0000          ?        ?  2928.8987  28.7335          ?        ?      541.1        2.7       ?       ? 
1 1 1   24   14   41 o    428.4    2.5    0.0000   0.0000          ?        ?  1835.7496  21.7097          ?        ?      428.4        2.5       ?       ? 
1 1 1   24   14   42 o    493.3    2.6    0.0000   0.0000          ?        ?  2433.4060  25.5409          ?        ?      493.3        2.6       ?       ? 
1 1 1   24   14   43 o    345.7    2.7    0.0000   0.0000          ?        ?  1195.3125  18.5171          ?        ?      345.7        2.7       ?       ? 
1 1 1   24   14   44 o    299.2    3.1    0.0000   0.0000          ?        ?   895.2073  18.5171          ?        ?      299.2        3.1       ?       ? 
1 1 1   24   14   45 o    251.4    3.2    0.0000   0.0000          ?        ?   632.1364  15.9630          ?        ?      251.4        3.2       ?       ? 
1 1 1   24   14   46 o     93.1    8.2    0.0000   0.0000          ?        ?    86.8389  15.3245          ?        ?       93.1        8.2       ?       ? 
1 1 1   24   14   47 o    193.7    4.6    0.0000   0.0000          ?        ?   375.4507  17.8786          ?        ?      193.7        4.6       ?       ? 
1 1 1   24   14   48 f    800.6    3.1    0.0000   0.0000          ?        ?  6412.0342  49.8047          ?        ?      800.6        3.1       ?       ? 
1 1 1   24   14   49 o    248.2    3.6    0.0000   0.0000          ?        ?   616.1733  17.8786          ?        ?      248.2        3.6       ?       ? 
1 1 1   24   14   50 o    237.4    3.6    0.0000   0.0000          ?        ?   563.8146  17.2401          ?        ?      237.4        3.6       ?       ? 
1 1 1   24   14   51 o    112.3    7.4    0.0000   0.0000          ?        ?   126.4273  16.6016          ?        ?      112.3        7.4       ?       ? 
1 1 1   24   14   52 o     45.7   15.4    0.0000   0.0000          ?        ?    19.7942  16.6016          ?        ?       45.7       15.4       ?       ? 
1 1 1   24   14   53 o    298.0    3.2    0.0000   0.0000          ?        ?   888.8221  19.1556          ?        ?      298.0        3.2       ?       ? 
1 1 1   24   14   54 o    134.0    6.7    0.0000   0.0000          ?        ?   180.0631  17.8786          ?        ?      134.0        6.7       ?       ? 
1 1 1   24   14   55 o    193.3    4.6    0.0000   0.0000          ?        ?   374.1737  17.8786          ?        ?      193.3        4.6       ?       ? 
1 1 1   24   14   56 o    271.3    3.6    0.0000   0.0000          ?        ?   736.8539  19.7942          ?        ?      271.3        3.6       ?       ? 
1 1 1   24   14   57 o    273.9    3.7    0.0000   0.0000          ?        ?   750.9014  20.4327          ?        ?      273.9        3.7       ?       ? 
1 1 1   24   14   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   14   59 o     33.5   14.7    0.0000   0.0000          ?        ?    -5.1082  19.1556          ?        ?       33.5       14.7       ?       ? 
1 1 1   24   14   60 o    298.3    3.4    0.0000   0.0000          ?        ?   890.7377  20.4327          ?        ?      298.3        3.4       ?       ? 
1 1 1   24   14   61 o     27.7   13.2    0.0000   0.0000          ?        ?   -24.2638  19.7942          ?        ?       27.7       13.2       ?       ? 
1 1 1   24   14   62 o    250.3    4.2    0.0000   0.0000          ?        ?   627.6667  21.0712          ?        ?      250.3        4.2       ?       ? 
1 1 1   24   14   63 o    383.6    3.1    0.0000   0.0000          ?        ?  1473.0693  23.6253          ?        ?      383.6        3.1       ?       ? 
1 1 1   24   14   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   14   65 o    241.6    4.5    0.0000   0.0000          ?        ?   584.8858  21.7097          ?        ?      241.6        4.5       ?       ? 
1 1 1   24   14   66 o    277.6    3.9    0.0000   0.0000          ?        ?   771.9727  21.7097          ?        ?      277.6        3.9       ?       ? 
1 1 1   24   14   67 o     42.1   16.4    0.0000   0.0000          ?        ?    12.1319  19.7942          ?        ?       42.1       16.4       ?       ? 
1 1 1   24   14   68 o     97.4   10.5    0.0000   0.0000          ?        ?    96.4168  20.4327          ?        ?       97.4       10.5       ?       ? 
1 1 1   24   14   69 o     91.3   10.8    0.0000   0.0000          ?        ?    84.9234  19.7942          ?        ?       91.3       10.8       ?       ? 
1 1 1   24   14   70 o    176.2    5.6    0.0000   0.0000          ?        ?   312.2371  19.7942          ?        ?      176.2        5.6       ?       ? 
1 1 1   24   14   71 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   15    0 o   1483.3    7.7 22006.0078 229.8678 22006.0078 229.8678 22006.0078 229.8678     1483.3      7.7     1483.3        7.7     0.0     0.0 
1 1 1   24   15    1 o    525.8    2.9    0.0000   0.0000          ?        ?  2764.7986  30.6490          ?        ?      525.8        2.9       ?       ? 
1 1 1   24   15    2 o    183.3    3.7    0.0000   0.0000          ?        ?   335.8624  13.4090          ?        ?      183.3        3.7       ?       ? 
1 1 1   24   15    3 o   1193.9    4.8    0.0000   0.0000          ?        ? 14254.3564 114.9339          ?        ?     1193.9        4.8       ?       ? 
1 1 1   24   15    4 o    527.2    2.7    0.0000   0.0000          ?        ?  2779.4846  28.7335          ?        ?      527.2        2.7       ?       ? 
1 1 1   24   15    5 o   1522.1    5.5    0.0000   0.0000          ?        ? 23170.0332 167.2927          ?        ?     1522.1        5.5       ?       ? 
1 1 1   24   15    6 o    913.2    3.7    0.0000   0.0000          ?        ?  8339.0928  67.0448          ?        ?      913.2        3.7       ?       ? 
1 1 1   24   15    7 o    810.6    3.4    0.0000   0.0000          ?        ?  6570.3877  55.5514          ?        ?      810.6        3.4       ?       ? 
1 1 1   24   15    8 o    999.4    3.8    0.0000   0.0000          ?        ?  9989.0322  75.3456          ?        ?      999.4        3.8       ?       ? 
1 1 1   24   15    9 o    881.6    3.4    0.0000   0.0000          ?        ?  7772.0850  60.6596          ?        ?      881.6        3.4       ?       ? 
1 1 1   24   15   10 o   1916.9    6.8    0.0000   0.0000          ?        ? 36753.3047 261.1554          ?        ?     1916.9        6.8       ?       ? 
1 1 1   24   15   11 o   1755.3    6.2    0.0000   0.0000          ?        ? 30816.3320 216.4588          ?        ?     1755.3        6.2       ?       ? 
1 1 1   24   15   12 o    486.2    2.6    0.0000   0.0000          ?        ?  2364.4456  24.9023          ?        ?      486.2        2.6       ?       ? 
1 1 1   24   15   13 o    271.8    2.3    0.0000   0.0000          ?        ?   738.7695  12.7704          ?        ?      271.8        2.3       ?       ? 
1 1 1   24   15   14 o    880.7    3.5    0.0000   0.0000          ?        ?  7756.7612  61.9366          ?        ?      880.7        3.5       ?       ? 
1 1 1   24   15   15 f    815.1    3.7    0.0000   0.0000          ?        ?  6643.8174  60.0210          ?        ?      815.1        3.7       ?       ? 
1 1 1   24   15   16 o    319.4    2.8    0.0000   0.0000          ?        ?  1020.3576  17.8786          ?        ?      319.4        2.8       ?       ? 
1 1 1   24   15   17 o   1206.4    4.3    0.0000   0.0000          ?        ? 14555.7393 103.4405          ?        ?     1206.4        4.3       ?       ? 
1 1 1   24   15   18 o    832.7    3.2    0.0000   0.0000          ?        ?  6933.7065  53.6358          ?        ?      832.7        3.2       ?       ? 
1 1 1   24   15   19 o    862.0    3.4    0.0000   0.0000          ?        ?  7430.4761  58.1055          ?        ?      862.0        3.4       ?       ? 
1 1 1   24   15   20 o    436.9    2.6    0.0000   0.0000          ?        ?  1909.1797  22.3483          ?        ?      436.9        2.6       ?       ? 
1 1 1   24   15   21 o   1167.0    4.3    0.0000   0.0000          ?        ? 13621.5820  99.6094          ?        ?     1167.0        4.3       ?       ? 
1 1 1   24   15   22 o    504.7    2.8    0.0000   0.0000          ?        ?  2547.0627  28.7335          ?        ?      504.7        2.8       ?       ? 
1 1 1   24   15   23 o    490.6    2.5    0.0000   0.0000          ?        ?  2406.5879  24.9023          ?        ?      490.6        2.5       ?       ? 
1 1 1   24   15   24 o    869.7    3.3    0.0000   0.0000          ?        ?  7565.2046  56.8284          ?        ?      869.7        3.3       ?       ? 
1 1 1   24   15   25 o    804.5    3.1    0.0000   0.0000          ?        ?  6473.3320  49.1662          ?        ?      804.5        3.1       ?       ? 
1 1 1   24   15   26 o   1628.6    5.4    0.0000   0.0000          ?        ? 26529.2949 176.8705          ?        ?     1628.6        5.4       ?       ? 
1 1 1   24   15   27 o    654.8    2.8    0.0000   0.0000          ?        ?  4287.6729  37.0343          ?        ?      654.8        2.8       ?       ? 
1 1 1   24   15   28 o    201.3    3.5    0.0000   0.0000          ?        ?   405.4612  14.0475          ?        ?      201.3        3.5       ?       ? 
1 1 1   24   15   29 o    901.6    3.4    0.0000   0.0000          ?        ?  8129.6572  61.2981          ?        ?      901.6        3.4       ?       ? 
1 1 1   24   15   30 o    382.8    2.6    0.0000   0.0000          ?        ?  1465.4071  19.7942          ?        ?      382.8        2.6       ?       ? 
1 1 1   24   15   31 o   1156.5    4.3    0.0000   0.0000          ?        ? 13377.0283  98.3323          ?        ?     1156.5        4.3       ?       ? 
1 1 1   24   15   32 o    844.0    3.3    0.0000   0.0000          ?        ?  7123.9854  55.5514          ?        ?      844.0        3.3       ?       ? 
1 1 1   24   15   33 o    308.5    3.0    0.0000   0.0000          ?        ?   952.0358  18.5171          ?        ?      308.5        3.0       ?       ? 
1 1 1   24   15   34 o    377.8    2.6    0.0000   0.0000          ?        ?  1427.7344  19.7942          ?        ?      377.8        2.6       ?       ? 
1 1 1   24   15   35 o    496.4    2.7    0.0000   0.0000          ?        ?  2464.0549  26.8179          ?        ?      496.4        2.7       ?       ? 
1 1 1   24   15   36 o    219.5    3.5    0.0000   0.0000          ?        ?   482.0838  15.3245          ?        ?      219.5        3.5       ?       ? 
1 1 1   24   15   37 o    289.9    2.9    0.0000   0.0000          ?        ?   840.2945  16.6016          ?        ?      289.9        2.9       ?       ? 
1 1 1   24   15   38 o    664.2    2.8    0.0000   0.0000          ?        ?  4412.1846  37.0343          ?        ?      664.2        2.8       ?       ? 
1 1 1   24   15   39 o    199.3    4.0    0.0000   0.0000          ?        ?   397.1605  15.9630          ?        ?      199.3        4.0       ?       ? 
1 1 1   24   15   40 o    321.6    2.9    0.0000   0.0000          ?        ?  1034.4050  18.5171          ?        ?      321.6        2.9       ?       ? 
1 1 1   24   15   41 o    293.7    2.9    0.0000   0.0000          ?        ?   862.6428  17.2401          ?        ?      293.7        2.9       ?       ? 
1 1 1   24   15   42 o    103.5    7.1    0.0000   0.0000          ?        ?   107.2716  14.6860          ?        ?      103.5        7.1       ?       ? 
1 1 1   24   15   43 o    299.9    3.1    0.0000   0.0000          ?        ?   899.6769  18.5171          ?        ?      299.9        3.1       ?       ? 
1 1 1   24   15   44 o    388.3    2.8    0.0000   0.0000          ?        ?  1508.1881  21.7097          ?        ?      388.3        2.8       ?       ? 
1 1 1   24   15   45 o     24.0   11.5    0.0000   0.0000          ?        ?   -20.4327  15.3245          ?        ?       24.0       11.5       ?       ? 
1 1 1   24   15   46 o     38.1   14.5    0.0000   0.0000          ?        ?    10.2163  15.3245          ?        ?       38.1       14.5       ?       ? 
1 1 1   24   15   47 o    331.0    2.9    0.0000   0.0000          ?        ?  1095.7031  19.1556          ?        ?      331.0        2.9       ?       ? 
1 1 1   24   15   48 o    440.8    2.6    0.0000   0.0000          ?        ?  1943.6598  22.9868          ?        ?      440.8        2.6       ?       ? 
1 1 1   24   15   49 o    360.6    2.9    0.0000   0.0000          ?        ?  1300.6686  21.0712          ?        ?      360.6        2.9       ?       ? 
1 1 1   24   15   50 o    430.0    2.6    0.0000   0.0000          ?        ?  1849.7972  22.3483          ?        ?      430.0        2.6       ?       ? 
1 1 1   24   15   51 o    232.5    3.8    0.0000   0.0000          ?        ?   540.8278  17.8786          ?        ?      232.5        3.8       ?       ? 
1 1 1   24   15   52 o    304.7    3.1    0.0000   0.0000          ?        ?   929.0490  19.1556          ?        ?      304.7        3.1       ?       ? 
1 1 1   24   15   53 o    220.3    4.2    0.0000   0.0000          ?        ?   485.9149  18.5171          ?        ?      220.3        4.2       ?       ? 
1 1 1   24   15   54 o     23.4   11.3    0.0000   0.0000          ?        ?   -28.0950  16.6016          ?        ?       23.4       11.3       ?       ? 
1 1 1   24   15   55 o     77.5   12.4    0.0000   0.0000          ?        ?    60.6596  19.1556          ?        ?       77.5       12.4       ?       ? 
1 1 1   24   15   56 o    374.7    3.0    0.0000   0.0000          ?        ?  1404.7476  22.3483          ?        ?      374.7        3.0       ?       ? 
1 1 1   24   15   57 o    255.8    3.9    0.0000   0.0000          ?        ?   655.1232  19.7942          ?        ?      255.8        3.9       ?       ? 
1 1 1   24   15   58 o    424.1    2.9    0.0000   0.0000          ?        ?  1799.3539  24.2638          ?        ?      424.1        2.9       ?       ? 
1 1 1   24   15   59 o    303.5    3.6    0.0000   0.0000          ?        ?   922.0252  21.7097          ?        ?      303.5        3.6       ?       ? 
1 1 1   24   15   60 o     21.2   10.6    0.0000   0.0000          ?        ?   -54.2743  19.1556          ?        ?       21.2       10.6       ?       ? 
1 1 1   24   15   61 o    134.6    7.4    0.0000   0.0000          ?        ?   181.9787  19.7942          ?        ?      134.6        7.4       ?       ? 
1 1 1   24   15   62 o    231.0    4.3    0.0000   0.0000          ?        ?   534.4426  19.7942          ?        ?      231.0        4.3       ?       ? 
1 1 1   24   15   63 o     49.0   17.0    0.0000   0.0000          ?        ?    22.3483  20.4327          ?        ?       49.0       17.0       ?       ? 
1 1 1   24   15   64 o    214.9    4.9    0.0000   0.0000          ?        ?   462.9282  21.0712          ?        ?      214.9        4.9       ?       ? 
1 1 1   24   15   65 o    231.0    4.7    0.0000   0.0000          ?        ?   535.0811  21.7097          ?        ?      231.0        4.7       ?       ? 
1 1 1   24   15   66 o    244.8    4.3    0.0000   0.0000          ?        ?   600.8488  21.0712          ?        ?      244.8        4.3       ?       ? 
1 1 1   24   15   67 o     77.4   12.8    0.0000   0.0000          ?        ?    61.2981  19.7942          ?        ?       77.4       12.8       ?       ? 
1 1 1   24   15   68 o    222.3    4.5    0.0000   0.0000          ?        ?   495.4928  19.7942          ?        ?      222.3        4.5       ?       ? 
1 1 1   24   15   69 o    138.7    7.4    0.0000   0.0000          ?        ?   194.1106  20.4327          ?        ?      138.7        7.4       ?       ? 
1 1 1   24   15   70 o     20.3   10.2    0.0000   0.0000          ?        ?   -64.4907  19.7942          ?        ?       20.3       10.2       ?       ? 
1 1 1   24   15   71 o     38.6   15.9    0.0000   0.0000          ?        ?     6.3852  19.7942          ?        ?       38.6       15.9       ?       ? 
1 1 1   24   16    0 o     64.3   12.2   45.3350  14.0475    45.3350  14.0475    45.3350  14.0475       64.3     12.2       64.3       12.2     0.0     0.0 
1 1 1   24   16    1 o    779.8    3.5    0.0000   0.0000          ?        ?  6080.6416  54.2743          ?        ?      779.8        3.5       ?       ? 
1 1 1   24   16    2 o   1115.3    4.8    0.0000   0.0000          ?        ? 12440.9551 106.6331          ?        ?     1115.3        4.8       ?       ? 
1 1 1   24   16    3 o   2411.7    9.3    0.0000   0.0000          ?        ? 58185.2852 447.6036          ?        ?     2411.7        9.3       ?       ? 
1 1 1   24   16    4 o    615.0    3.5    0.0000   0.0000          ?        ?  3781.9636  43.4195          ?        ?      615.0        3.5       ?       ? 
1 1 1   24   16    5 o    981.4    4.0    0.0000   0.0000          ?        ?  9632.7373  79.1767          ?        ?      981.4        4.0       ?       ? 
1 1 1   24   16    6 o   1260.7    4.8    0.0000   0.0000          ?        ? 15895.3564 121.9576          ?        ?     1260.7        4.8       ?       ? 
1 1 1   24   16    7 o   1392.5    5.3    0.0000   0.0000          ?        ? 19393.1777 146.8600          ?        ?     1392.5        5.3       ?       ? 
1 1 1   24   16    8 o   1412.7    5.3    0.0000   0.0000          ?        ? 19960.8242 150.6911          ?        ?     1412.7        5.3       ?       ? 
1 1 1   24   16    9 o    686.9    2.7    0.0000   0.0000          ?        ?  4718.0366  37.6728          ?        ?      686.9        2.7       ?       ? 
1 1 1   24   16   10 o    322.5    2.3    0.0000   0.0000          ?        ?  1040.1517  14.6860          ?        ?      322.5        2.3       ?       ? 
1 1 1   24   16   11 o   1096.9    4.0    0.0000   0.0000          ?        ? 12032.9404  88.7545          ?        ?     1096.9        4.0       ?       ? 
1 1 1   24   16   12 o    306.6    2.4    0.0000   0.0000          ?        ?   939.9038  14.6860          ?        ?      306.6        2.4       ?       ? 
1 1 1   24   16   13 o   1116.1    4.1    0.0000   0.0000          ?        ? 12456.9189  91.9471          ?        ?     1116.1        4.1       ?       ? 
1 1 1   24   16   14 o    221.9    2.6    0.0000   0.0000          ?        ?   492.3002  11.4934          ?        ?      221.9        2.6       ?       ? 
1 1 1   24   16   15 o   1017.5    3.9    0.0000   0.0000          ?        ? 10352.9902  78.5382          ?        ?     1017.5        3.9       ?       ? 
1 1 1   24   16   16 o    826.8    3.4    0.0000   0.0000          ?        ?  6836.0122  55.5514          ?        ?      826.8        3.4       ?       ? 
1 1 1   24   16   17 o    753.1    3.2    0.0000   0.0000          ?        ?  5672.6265  48.5276          ?        ?      753.1        3.2       ?       ? 
1 1 1   24   16   18 o    290.6    4.1    0.0000   0.0000          ?        ?   844.7642  23.6253          ?        ?      290.6        4.1       ?       ? 
1 1 1   24   16   19 o   1170.3    4.3    0.0000   0.0000          ?        ? 13696.9277 100.2479          ?        ?     1170.3        4.3       ?       ? 
1 1 1   24   16   20 o    644.9    2.7    0.0000   0.0000          ?        ?  4158.6914  35.1187          ?        ?      644.9        2.7       ?       ? 
1 1 1   24   16   21 o    339.8    2.6    0.0000   0.0000          ?        ?  1154.4471  17.8786          ?        ?      339.8        2.6       ?       ? 
1 1 1   24   16   22 o   2180.9    7.3    0.0000   0.0000          ?        ? 47580.0781 317.3452          ?        ?     2180.9        7.3       ?       ? 
1 1 1   24   16   23 o    868.7    3.3    0.0000   0.0000          ?        ?  7547.3257  58.1055          ?        ?      868.7        3.3       ?       ? 
1 1 1   24   16   24 o    219.8    3.2    0.0000   0.0000          ?        ?   483.3608  14.0475          ?        ?      219.8        3.2       ?       ? 
1 1 1   24   16   25 o    708.5    2.8    0.0000   0.0000          ?        ?  5019.4185  39.5883          ?        ?      708.5        2.8       ?       ? 
1 1 1   24   16   26 o    834.1    3.2    0.0000   0.0000          ?        ?  6957.9697  52.9973          ?        ?      834.1        3.2       ?       ? 
1 1 1   24   16   27 o    482.0    2.5    0.0000   0.0000          ?        ?  2322.9417  23.6253          ?        ?      482.0        2.5       ?       ? 
1 1 1   24   16   28 o    128.8    5.2    0.0000   0.0000          ?        ?   166.0156  13.4090          ?        ?      128.8        5.2       ?       ? 
1 1 1   24   16   29 o    456.4    2.8    0.0000   0.0000          ?        ?  2082.8577  25.5409          ?        ?      456.4        2.8       ?       ? 
1 1 1   24   16   30 o    416.2    2.5    0.0000   0.0000          ?        ?  1732.3091  21.0712          ?        ?      416.2        2.5       ?       ? 
1 1 1   24   16   31 o    701.2    2.9    0.0000   0.0000          ?        ?  4917.2549  40.8654          ?        ?      701.2        2.9       ?       ? 
1 1 1   24   16   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   16   33 o    401.0    2.7    0.0000   0.0000          ?        ?  1608.4359  21.7097          ?        ?      401.0        2.7       ?       ? 
1 1 1   24   16   34 o    671.9    2.9    0.0000   0.0000          ?        ?  4514.9863  38.3113          ?        ?      671.9        2.9       ?       ? 
1 1 1   24   16   35 o    609.5    2.6    0.0000   0.0000          ?        ?  3715.5576  31.9261          ?        ?      609.5        2.6       ?       ? 
1 1 1   24   16   36 o     96.5    7.3    0.0000   0.0000          ?        ?    93.2242  14.0475          ?        ?       96.5        7.3       ?       ? 
1 1 1   24   16   37 o    621.0    2.7    0.0000   0.0000          ?        ?  3857.3091  33.2031          ?        ?      621.0        2.7       ?       ? 
1 1 1   24   16   38 o    512.4    2.5    0.0000   0.0000          ?        ?  2625.6011  25.5409          ?        ?      512.4        2.5       ?       ? 
1 1 1   24   16   39 f    356.3    2.7    0.0000   0.0000          ?        ?  1269.3810  19.1556          ?        ?      356.3        2.7       ?       ? 
1 1 1   24   16   40 o    241.2    3.2    0.0000   0.0000          ?        ?   581.6932  15.3245          ?        ?      241.2        3.2       ?       ? 
1 1 1   24   16   41 f    375.0    2.7    0.0000   0.0000          ?        ?  1406.6632  20.4327          ?        ?      375.0        2.7       ?       ? 
1 1 1   24   16   42 o    187.3    4.3    0.0000   0.0000          ?        ?   351.1869  15.9630          ?        ?      187.3        4.3       ?       ? 
1 1 1   24   16   43 o    668.4    2.8    0.0000   0.0000          ?        ?  4468.3740  37.6728          ?        ?      668.4        2.8       ?       ? 
1 1 1   24   16   44 o    283.7    3.3    0.0000   0.0000          ?        ?   805.1758  18.5171          ?        ?      283.7        3.3       ?       ? 
1 1 1   24   16   45 o    415.4    2.6    0.0000   0.0000          ?        ?  1725.9238  21.7097          ?        ?      415.4        2.6       ?       ? 
1 1 1   24   16   46 f    350.1    2.9    0.0000   0.0000          ?        ?  1225.9615  20.4327          ?        ?      350.1        2.9       ?       ? 
1 1 1   24   16   47 o    142.6    6.0    0.0000   0.0000          ?        ?   203.6884  17.2401          ?        ?      142.6        6.0       ?       ? 
1 1 1   24   16   48 o    304.5    3.1    0.0000   0.0000          ?        ?   927.7720  19.1556          ?        ?      304.5        3.1       ?       ? 
1 1 1   24   16   49 o    192.9    4.5    0.0000   0.0000          ?        ?   372.2581  17.2401          ?        ?      192.9        4.5       ?       ? 
1 1 1   24   16   50 o    115.4    7.5    0.0000   0.0000          ?        ?   133.4510  17.2401          ?        ?      115.4        7.5       ?       ? 
1 1 1   24   16   51 o    273.5    3.3    0.0000   0.0000          ?        ?   748.3474  17.8786          ?        ?      273.5        3.3       ?       ? 
1 1 1   24   16   52 o    284.5    3.3    0.0000   0.0000          ?        ?   809.6454  18.5171          ?        ?      284.5        3.3       ?       ? 
1 1 1   24   16   53 o     51.7   15.5    0.0000   0.0000          ?        ?    27.4564  17.2401          ?        ?       51.7       15.5       ?       ? 
1 1 1   24   16   54 o    135.2    6.4    0.0000   0.0000          ?        ?   183.2557  17.2401          ?        ?      135.2        6.4       ?       ? 
1 1 1   24   16   55 o     21.5   10.7    0.0000   0.0000          ?        ?   -48.5276  18.5171          ?        ?       21.5       10.7       ?       ? 
1 1 1   24   16   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   16   57 o     27.4   13.1    0.0000   0.0000          ?        ?   -25.5409  19.7942          ?        ?       27.4       13.1       ?       ? 
1 1 1   24   16   58 o    130.3    7.1    0.0000   0.0000          ?        ?   170.4853  18.5171          ?        ?      130.3        7.1       ?       ? 
1 1 1   24   16   59 o     28.4   13.3    0.0000   0.0000          ?        ?   -17.2401  18.5171          ?        ?       28.4       13.3       ?       ? 
1 1 1   24   16   60 o    130.3    7.6    0.0000   0.0000          ?        ?   170.4853  19.7942          ?        ?      130.3        7.6       ?       ? 
1 1 1   24   16   61 o    416.1    2.9    0.0000   0.0000          ?        ?  1732.9476  24.2638          ?        ?      416.1        2.9       ?       ? 
1 1 1   24   16   62 o     37.0   15.6    0.0000   0.0000          ?        ?     1.9156  19.7942          ?        ?       37.0       15.6       ?       ? 
1 1 1   24   16   63 o     68.9   15.2    0.0000   0.0000          ?        ?    50.4432  20.4327          ?        ?       68.9       15.2       ?       ? 
1 1 1   24   16   64 o     33.5   14.9    0.0000   0.0000          ?        ?    -7.6623  20.4327          ?        ?       33.5       14.9       ?       ? 
1 1 1   24   16   65 o    165.1    6.0    0.0000   0.0000          ?        ?   273.9258  19.7942          ?        ?      165.1        6.0       ?       ? 
1 1 1   24   16   66 o     22.7   11.3    0.0000   0.0000          ?        ?   -47.8891  19.7942          ?        ?       22.7       11.3       ?       ? 
1 1 1   24   16   67 o    117.6    8.7    0.0000   0.0000          ?        ?   139.8362  20.4327          ?        ?      117.6        8.7       ?       ? 
1 1 1   24   16   68 o     69.3   15.1    0.0000   0.0000          ?        ?    51.7203  20.4327          ?        ?       69.3       15.1       ?       ? 
1 1 1   24   16   69 o    264.8    4.2    0.0000   0.0000          ?        ?   703.6508  22.3483          ?        ?      264.8        4.2       ?       ? 
1 1 1   24   16   70 o     74.4   14.2    0.0000   0.0000          ?        ?    59.3825  20.4327          ?        ?       74.4       14.2       ?       ? 
1 1 1   24   17    0 o   1126.1    6.9 12682.9551 155.1608 12682.9551 155.1608 12682.9551 155.1608     1126.1      6.9     1126.1        6.9     0.0     0.0 
1 1 1   24   17    1 o    408.6    2.5    0.0000   0.0000          ?        ?  1669.7340  20.4327          ?        ?      408.6        2.5       ?       ? 
1 1 1   24   17    2 o    848.1    4.0    0.0000   0.0000          ?        ?  7192.9463  67.0448          ?        ?      848.1        4.0       ?       ? 
1 1 1   24   17    3 o    297.8    2.7    0.0000   0.0000          ?        ?   886.9065  15.9630          ?        ?      297.8        2.7       ?       ? 
1 1 1   24   17    4 o    752.5    3.6    0.0000   0.0000          ?        ?  5663.0483  53.6358          ?        ?      752.5        3.6       ?       ? 
1 1 1   24   17    5 o    952.7    4.2    0.0000   0.0000          ?        ?  9076.5850  79.8152          ?        ?      952.7        4.2       ?       ? 
1 1 1   24   17    6 o    276.3    2.8    0.0000   0.0000          ?        ?   763.6719  15.3245          ?        ?      276.3        2.8       ?       ? 
1 1 1   24   17    7 o    777.8    3.4    0.0000   0.0000          ?        ?  6050.6309  52.3588          ?        ?      777.8        3.4       ?       ? 
1 1 1   24   17    8 o    870.8    3.7    0.0000   0.0000          ?        ?  7583.0825  63.8522          ?        ?      870.8        3.7       ?       ? 
1 1 1   24   17    9 o     53.6    7.1    0.0000   0.0000          ?        ?    28.7335   7.6623          ?        ?       53.6        7.1       ?       ? 
1 1 1   24   17   10 o    880.5    3.7    0.0000   0.0000          ?        ?  7753.5684  64.4907          ?        ?      880.5        3.7       ?       ? 
1 1 1   24   17   11 o    585.1    2.6    0.0000   0.0000          ?        ?  3423.1143  30.0105          ?        ?      585.1        2.6       ?       ? 
1 1 1   24   17   12 o   1419.3    4.9    0.0000   0.0000          ?        ? 20147.2734 138.5592          ?        ?     1419.3        4.9       ?       ? 
1 1 1   24   17   13 o    243.2    2.5    0.0000   0.0000          ?        ?   591.2710  12.1319          ?        ?      243.2        2.5       ?       ? 
1 1 1   24   17   14 o    692.1    2.8    0.0000   0.0000          ?        ?  4789.5508  38.3113          ?        ?      692.1        2.8       ?       ? 
1 1 1   24   17   15 o    634.2    2.7    0.0000   0.0000          ?        ?  4022.6863  34.4802          ?        ?      634.2        2.7       ?       ? 
1 1 1   24   17   16 o    734.6    2.9    0.0000   0.0000          ?        ?  5396.1460  42.7809          ?        ?      734.6        2.9       ?       ? 
1 1 1   24   17   17 o    963.0    3.5    0.0000   0.0000          ?        ?  9275.1650  68.3218          ?        ?      963.0        3.5       ?       ? 
1 1 1   24   17   18 o   1167.4    4.2    0.0000   0.0000          ?        ? 13630.5205  97.6938          ?        ?     1167.4        4.2       ?       ? 
1 1 1   24   17   19 o    718.2    3.0    0.0000   0.0000          ?        ?  5157.9775  42.7809          ?        ?      718.2        3.0       ?       ? 
1 1 1   24   17   20 o    397.9    2.6    0.0000   0.0000          ?        ?  1583.5337  20.4327          ?        ?      397.9        2.6       ?       ? 
1 1 1   24   17   21 o    838.0    3.2    0.0000   0.0000          ?        ?  7023.0996  53.6358          ?        ?      838.0        3.2       ?       ? 
1 1 1   24   17   22 o   1408.3    4.8    0.0000   0.0000          ?        ? 19837.5898 134.0895          ?        ?     1408.3        4.8       ?       ? 
1 1 1   24   17   23 o   1481.0    5.0    0.0000   0.0000          ?        ? 21938.3262 148.1370          ?        ?     1481.0        5.0       ?       ? 
1 1 1   24   17   24 o    492.8    2.5    0.0000   0.0000          ?        ?  2428.9363  24.2638          ?        ?      492.8        2.5       ?       ? 
1 1 1   24   17   25 o    310.1    2.7    0.0000   0.0000          ?        ?   961.6136  16.6016          ?        ?      310.1        2.7       ?       ? 
1 1 1   24   17   26 o    203.4    3.5    0.0000   0.0000          ?        ?   413.7620  14.0475          ?        ?      203.4        3.5       ?       ? 
1 1 1   24   17   27 o    891.7    3.4    0.0000   0.0000          ?        ?  7952.7866  61.2981          ?        ?      891.7        3.4       ?       ? 
1 1 1   24   17   28 o    214.7    3.4    0.0000   0.0000          ?        ?   461.0126  14.6860          ?        ?      214.7        3.4       ?       ? 
1 1 1   24   17   29 o    419.2    2.6    0.0000   0.0000          ?        ?  1757.8500  21.7097          ?        ?      419.2        2.6       ?       ? 
1 1 1   24   17   30 o    303.3    2.8    0.0000   0.0000          ?        ?   920.1097  17.2401          ?        ?      303.3        2.8       ?       ? 
1 1 1   24   17   31 o     83.4    8.8    0.0000   0.0000          ?        ?    69.5989  14.6860          ?        ?       83.4        8.8       ?       ? 
1 1 1   24   17   32 f    211.5    3.6    0.0000   0.0000          ?        ?   447.6036  15.3245          ?        ?      211.5        3.6       ?       ? 
1 1 1   24   17   33 o    419.2    2.7    0.0000   0.0000          ?        ?  1757.8500  22.9868          ?        ?      419.2        2.7       ?       ? 
1 1 1   24   17   34 o    664.3    2.7    0.0000   0.0000          ?        ?  4414.1001  36.3957          ?        ?      664.3        2.7       ?       ? 
1 1 1   24   17   35 o    339.9    2.6    0.0000   0.0000          ?        ?  1155.7241  17.8786          ?        ?      339.9        2.6       ?       ? 
1 1 1   24   17   36 o    377.5    2.5    0.0000   0.0000          ?        ?  1425.1803  19.1556          ?        ?      377.5        2.5       ?       ? 
1 1 1   24   17   37 o    243.4    3.3    0.0000   0.0000          ?        ?   592.5481  15.9630          ?        ?      243.4        3.3       ?       ? 
1 1 1   24   17   38 o    408.5    2.9    0.0000   0.0000          ?        ?  1669.0955  23.6253          ?        ?      408.5        2.9       ?       ? 
1 1 1   24   17   39 o    389.4    2.6    0.0000   0.0000          ?        ?  1516.4889  20.4327          ?        ?      389.4        2.6       ?       ? 
1 1 1   24   17   40 o     92.8    7.9    0.0000   0.0000          ?        ?    86.2004  14.6860          ?        ?       92.8        7.9       ?       ? 
1 1 1   24   17   41 o    270.1    3.1    0.0000   0.0000          ?        ?   729.8303  16.6016          ?        ?      270.1        3.1       ?       ? 
1 1 1   24   17   42 o    155.9    5.3    0.0000   0.0000          ?        ?   243.2767  16.6016          ?        ?      155.9        5.3       ?       ? 
1 1 1   24   17   43 o    187.9    4.2    0.0000   0.0000          ?        ?   353.1024  15.9630          ?        ?      187.9        4.2       ?       ? 
1 1 1   24   17   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   17   45 o     53.2   14.6    0.0000   0.0000          ?        ?    29.3720  15.9630          ?        ?       53.2       14.6       ?       ? 
1 1 1   24   17   46 o    210.0    4.0    0.0000   0.0000          ?        ?   441.2184  16.6016          ?        ?      210.0        4.0       ?       ? 
1 1 1   24   17   47 o    142.9    5.6    0.0000   0.0000          ?        ?   204.3269  15.9630          ?        ?      142.9        5.6       ?       ? 
1 1 1   24   17   48 o    273.7    3.3    0.0000   0.0000          ?        ?   749.6244  17.8786          ?        ?      273.7        3.3       ?       ? 
1 1 1   24   17   49 o     20.0   10.0    0.0000   0.0000          ?        ?   -45.3350  16.6016          ?        ?       20.0       10.0       ?       ? 
1 1 1   24   17   50 o    195.0    4.4    0.0000   0.0000          ?        ?   380.5589  17.2401          ?        ?      195.0        4.4       ?       ? 
1 1 1   24   17   51 o     98.6    9.1    0.0000   0.0000          ?        ?    97.6938  17.8786          ?        ?       98.6        9.1       ?       ? 
1 1 1   24   17   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   17   53 o    359.9    3.1    0.0000   0.0000          ?        ?  1296.1989  22.3483          ?        ?      359.9        3.1       ?       ? 
1 1 1   24   17   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   17   55 o    812.5    3.2    0.0000   0.0000          ?        ?  6606.1445  51.7203          ?        ?      812.5        3.2       ?       ? 
1 1 1   24   17   56 o    370.9    3.1    0.0000   0.0000          ?        ?  1376.6527  22.9868          ?        ?      370.9        3.1       ?       ? 
1 1 1   24   17   57 o     25.4   12.3    0.0000   0.0000          ?        ?   -31.2876  19.1556          ?        ?       25.4       12.3       ?       ? 
1 1 1   24   17   58 o     28.7   13.4    0.0000   0.0000          ?        ?   -18.5171  19.1556          ?        ?       28.7       13.4       ?       ? 
1 1 1   24   17   59 o     79.0   12.5    0.0000   0.0000          ?        ?    63.2136  19.7942          ?        ?       79.0       12.5       ?       ? 
1 1 1   24   17   60 o    244.7    4.4    0.0000   0.0000          ?        ?   599.5718  21.7097          ?        ?      244.7        4.4       ?       ? 
1 1 1   24   17   61 o     58.2   16.0    0.0000   0.0000          ?        ?    35.7572  19.1556          ?        ?       58.2       16.0       ?       ? 
1 1 1   24   17   62 o     64.8   15.9    0.0000   0.0000          ?        ?    44.6965  20.4327          ?        ?       64.8       15.9       ?       ? 
1 1 1   24   17   63 o    154.4    6.6    0.0000   0.0000          ?        ?   239.4456  20.4327          ?        ?      154.4        6.6       ?       ? 
1 1 1   24   17   64 o    235.6    4.3    0.0000   0.0000          ?        ?   556.1523  20.4327          ?        ?      235.6        4.3       ?       ? 
1 1 1   24   17   65 o    145.6    6.8    0.0000   0.0000          ?        ?   213.2662  19.7942          ?        ?      145.6        6.8       ?       ? 
1 1 1   24   17   66 o    102.9    9.9    0.0000   0.0000          ?        ?   107.2716  20.4327          ?        ?      102.9        9.9       ?       ? 
1 1 1   24   17   67 o    108.0    9.2    0.0000   0.0000          ?        ?   118.1265  19.7942          ?        ?      108.0        9.2       ?       ? 
1 1 1   24   17   68 o    168.6    6.1    0.0000   0.0000          ?        ?   286.0577  20.4327          ?        ?      168.6        6.1       ?       ? 
1 1 1   24   17   69 o     25.6   12.4    0.0000   0.0000          ?        ?   -31.9261  19.7942          ?        ?       25.6       12.4       ?       ? 
1 1 1   24   18    0 o    646.5    4.0 4180.4014  52.3588  4180.4014  52.3588  4180.4014  52.3588      646.5      4.0      646.5        4.0     0.0     0.0 
1 1 1   24   18    1 o    969.9    4.0    0.0000   0.0000          ?        ?  9407.9775  77.2611          ?        ?      969.9        4.0       ?       ? 
1 1 1   24   18    2 o    255.8    3.4    0.0000   0.0000          ?        ?   654.4847  17.2401          ?        ?      255.8        3.4       ?       ? 
1 1 1   24   18    3 o    255.8    4.2    0.0000   0.0000          ?        ?   654.4847  21.7097          ?        ?      255.8        4.2       ?       ? 
1 1 1   24   18    4 o    275.0    2.9    0.0000   0.0000          ?        ?   756.0096  15.9630          ?        ?      275.0        2.9       ?       ? 
1 1 1   24   18    5 o   1026.2    4.1    0.0000   0.0000          ?        ? 10532.4141  84.2849          ?        ?     1026.2        4.1       ?       ? 
1 1 1   24   18    6 o    886.4    3.5    0.0000   0.0000          ?        ?  7857.0088  62.5751          ?        ?      886.4        3.5       ?       ? 
1 1 1   24   18    7 o   1126.1    4.4    0.0000   0.0000          ?        ? 12682.3164  98.9709          ?        ?     1126.1        4.4       ?       ? 
1 1 1   24   18    8 o    502.3    2.4    0.0000   0.0000          ?        ?  2522.7991  24.2638          ?        ?      502.3        2.4       ?       ? 
1 1 1   24   18    9 o    912.3    3.4    0.0000   0.0000          ?        ?  8323.1299  61.9366          ?        ?      912.3        3.4       ?       ? 
1 1 1   24   18   10 o    636.2    2.6    0.0000   0.0000          ?        ?  4047.5889  33.2031          ?        ?      636.2        2.6       ?       ? 
1 1 1   24   18   11 o    776.5    2.9    0.0000   0.0000          ?        ?  6029.5596  45.3350          ?        ?      776.5        2.9       ?       ? 
1 1 1   24   18   12 o   1075.4    3.9    0.0000   0.0000          ?        ? 11566.1807  83.0078          ?        ?     1075.4        3.9       ?       ? 
1 1 1   24   18   13 o   1159.3    4.0    0.0000   0.0000          ?        ? 13440.2412  92.5856          ?        ?     1159.3        4.0       ?       ? 
1 1 1   24   18   14 o    297.2    2.5    0.0000   0.0000          ?        ?   883.0754  14.6860          ?        ?      297.2        2.5       ?       ? 
1 1 1   24   18   15 o    608.8    2.6    0.0000   0.0000          ?        ?  3706.6179  31.9261          ?        ?      608.8        2.6       ?       ? 
1 1 1   24   18   16 o    883.2    3.4    0.0000   0.0000          ?        ?  7800.8184  59.3825          ?        ?      883.2        3.4       ?       ? 
1 1 1   24   18   17 o    424.6    2.5    0.0000   0.0000          ?        ?  1803.1851  21.0712          ?        ?      424.6        2.5       ?       ? 
1 1 1   24   18   18 o    641.3    2.8    0.0000   0.0000          ?        ?  4113.3564  35.7572          ?        ?      641.3        2.8       ?       ? 
1 1 1   24   18   19 f    802.9    3.1    0.0000   0.0000          ?        ?  6446.5142  49.1662          ?        ?      802.9        3.1       ?       ? 
1 1 1   24   18   20 o    815.0    3.1    0.0000   0.0000          ?        ?  6642.5410  50.4432          ?        ?      815.0        3.1       ?       ? 
1 1 1   24   18   21 o    679.7    2.8    0.0000   0.0000          ?        ?  4620.3423  38.3113          ?        ?      679.7        2.8       ?       ? 
1 1 1   24   18   22 o    158.0    4.4    0.0000   0.0000          ?        ?   249.6619  14.0475          ?        ?      158.0        4.4       ?       ? 
1 1 1   24   18   23 f    233.9    3.4    0.0000   0.0000          ?        ?   547.2130  15.9630          ?        ?      233.9        3.4       ?       ? 
1 1 1   24   18   24 o    445.8    2.5    0.0000   0.0000          ?        ?  1987.7178  22.3483          ?        ?      445.8        2.5       ?       ? 
1 1 1   24   18   25 o    875.0    3.3    0.0000   0.0000          ?        ?  7656.5127  58.1055          ?        ?      875.0        3.3       ?       ? 
1 1 1   24   18   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   18   27 o    367.5    2.5    0.0000   0.0000          ?        ?  1350.4733  18.5171          ?        ?      367.5        2.5       ?       ? 
1 1 1   24   18   28 o    364.7    2.5    0.0000   0.0000          ?        ?  1330.0405  18.5171          ?        ?      364.7        2.5       ?       ? 
1 1 1   24   18   29 o    170.8    4.5    0.0000   0.0000          ?        ?   291.8044  15.3245          ?        ?      170.8        4.5       ?       ? 
1 1 1   24   18   30 o   1155.3    4.2    0.0000   0.0000          ?        ? 13351.4873  97.6938          ?        ?     1155.3        4.2       ?       ? 
1 1 1   24   18   31 o    632.2    2.8    0.0000   0.0000          ?        ?  3997.1453  35.1187          ?        ?      632.2        2.8       ?       ? 
1 1 1   24   18   32 o    626.8    2.9    0.0000   0.0000          ?        ?  3928.8235  35.7572          ?        ?      626.8        2.9       ?       ? 
1 1 1   24   18   33 o    409.4    2.5    0.0000   0.0000          ?        ?  1676.1193  20.4327          ?        ?      409.4        2.5       ?       ? 
1 1 1   24   18   34 o    363.5    2.6    0.0000   0.0000          ?        ?  1321.7397  19.1556          ?        ?      363.5        2.6       ?       ? 
1 1 1   24   18   35 o    448.5    2.5    0.0000   0.0000          ?        ?  2011.9817  22.3483          ?        ?      448.5        2.5       ?       ? 
1 1 1   24   18   36 o    230.9    3.5    0.0000   0.0000          ?        ?   533.1656  15.9630          ?        ?      230.9        3.5       ?       ? 
1 1 1   24   18   37 o    232.0    3.6    0.0000   0.0000          ?        ?   538.2737  16.6016          ?        ?      232.0        3.6       ?       ? 
1 1 1   24   18   38 o    264.4    3.1    0.0000   0.0000          ?        ?   699.1812  16.6016          ?        ?      264.4        3.1       ?       ? 
1 1 1   24   18   39 f    653.1    2.8    0.0000   0.0000          ?        ?  4265.9629  36.3957          ?        ?      653.1        2.8       ?       ? 
1 1 1   24   18   40 o    409.4    2.7    0.0000   0.0000          ?        ?  1676.1193  21.7097          ?        ?      409.4        2.7       ?       ? 
1 1 1   24   18   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   18   42 o    423.8    2.6    0.0000   0.0000          ?        ?  1796.1613  21.7097          ?        ?      423.8        2.6       ?       ? 
1 1 1   24   18   43 o    273.3    3.0    0.0000   0.0000          ?        ?   747.0703  16.6016          ?        ?      273.3        3.0       ?       ? 
1 1 1   24   18   44 o     76.9   10.0    0.0000   0.0000          ?        ?    59.3825  15.3245          ?        ?       76.9       10.0       ?       ? 
1 1 1   24   18   45 o    328.3    2.8    0.0000   0.0000          ?        ?  1078.4630  18.5171          ?        ?      328.3        2.8       ?       ? 
1 1 1   24   18   46 o     35.7   14.6    0.0000   0.0000          ?        ?     4.4697  16.6016          ?        ?       35.7       14.6       ?       ? 
1 1 1   24   18   47 o    446.7    2.6    0.0000   0.0000          ?        ?  1996.0187  22.9868          ?        ?      446.7        2.6       ?       ? 
1 1 1   24   18   48 o    321.1    3.0    0.0000   0.0000          ?        ?  1031.2124  19.1556          ?        ?      321.1        3.0       ?       ? 
1 1 1   24   18   49 o    145.5    5.5    0.0000   0.0000          ?        ?   211.9892  15.9630          ?        ?      145.5        5.5       ?       ? 
1 1 1   24   18   50 o    287.3    3.1    0.0000   0.0000          ?        ?   825.6085  17.8786          ?        ?      287.3        3.1       ?       ? 
1 1 1   24   18   51 o     23.1   11.3    0.0000   0.0000          ?        ?   -35.7572  17.8786          ?        ?       23.1       11.3       ?       ? 
1 1 1   24   18   52 o    140.5    6.1    0.0000   0.0000          ?        ?   197.9417  17.2401          ?        ?      140.5        6.1       ?       ? 
1 1 1   24   18   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   18   54 o    408.0    2.9    0.0000   0.0000          ?        ?  1665.9028  23.6253          ?        ?      408.0        2.9       ?       ? 
1 1 1   24   18   55 o     21.6   10.8    0.0000   0.0000          ?        ?   -51.7203  19.1556          ?        ?       21.6       10.8       ?       ? 
1 1 1   24   18   56 o     60.8   16.0    0.0000   0.0000          ?        ?    38.9498  19.7942          ?        ?       60.8       16.0       ?       ? 
1 1 1   24   18   57 o     24.8   12.1    0.0000   0.0000          ?        ?   -33.8416  19.1556          ?        ?       24.8       12.1       ?       ? 
1 1 1   24   18   58 o    393.3    3.0    0.0000   0.0000          ?        ?  1547.7764  23.6253          ?        ?      393.3        3.0       ?       ? 
1 1 1   24   18   59 o     34.5   15.0    0.0000   0.0000          ?        ?    -2.5541  19.1556          ?        ?       34.5       15.0       ?       ? 
1 1 1   24   18   60 o    278.0    3.9    0.0000   0.0000          ?        ?   773.8882  21.7097          ?        ?      278.0        3.9       ?       ? 
1 1 1   24   18   61 o    205.7    5.0    0.0000   0.0000          ?        ?   423.9784  20.4327          ?        ?      205.7        5.0       ?       ? 
1 1 1   24   18   62 o    125.2    7.9    0.0000   0.0000          ?        ?   157.7148  19.7942          ?        ?      125.2        7.9       ?       ? 
1 1 1   24   18   63 o    170.3    6.0    0.0000   0.0000          ?        ?   291.1659  20.4327          ?        ?      170.3        6.0       ?       ? 
1 1 1   24   18   64 o    279.6    3.9    0.0000   0.0000          ?        ?   783.4660  21.7097          ?        ?      279.6        3.9       ?       ? 
1 1 1   24   18   65 o     24.8   12.1    0.0000   0.0000          ?        ?   -36.3957  19.7942          ?        ?       24.8       12.1       ?       ? 
1 1 1   24   18   66 o    123.2    7.8    0.0000   0.0000          ?        ?   153.2452  19.1556          ?        ?      123.2        7.8       ?       ? 
1 1 1   24   18   67 o    134.1    7.1    0.0000   0.0000          ?        ?   181.3401  19.1556          ?        ?      134.1        7.1       ?       ? 
1 1 1   24   18   68 o     21.6   10.8    0.0000   0.0000          ?        ?   -54.2743  19.7942          ?        ?       21.6       10.8       ?       ? 
1 1 1   24   18   69 o     84.1   11.8    0.0000   0.0000          ?        ?    72.7915  19.7942          ?        ?       84.1       11.8       ?       ? 
1 1 1   24   19    0 o    644.3    4.6 4151.6675  58.7440  4151.6675  58.7440  4151.6675  58.7440      644.3      4.6      644.3        4.6     0.0     0.0 
1 1 1   24   19    1 o   1020.0    4.4    0.0000   0.0000          ?        ? 10405.9863  90.6701          ?        ?     1020.0        4.4       ?       ? 
1 1 1   24   19    2 o    427.3    2.8    0.0000   0.0000          ?        ?  1825.5333  23.6253          ?        ?      427.3        2.8       ?       ? 
1 1 1   24   19    3 f   1077.1    4.3    0.0000   0.0000          ?        ? 11603.2148  93.2242          ?        ?     1077.1        4.3       ?       ? 
1 1 1   24   19    4 o    512.8    2.8    0.0000   0.0000          ?        ?  2630.0706  28.7335          ?        ?      512.8        2.8       ?       ? 
1 1 1   24   19    5 o    161.8    2.8    0.0000   0.0000          ?        ?   261.7939   8.9393          ?        ?      161.8        2.8       ?       ? 
1 1 1   24   19    6 o   1356.1    5.3    0.0000   0.0000          ?        ? 18391.9766 144.9444          ?        ?     1356.1        5.3       ?       ? 
1 1 1   24   19    7 o    907.2    3.5    0.0000   0.0000          ?        ?  8229.9053  63.8522          ?        ?      907.2        3.5       ?       ? 
1 1 1   24   19    8 o    574.5    2.6    0.0000   0.0000          ?        ?  3301.1567  29.3720          ?        ?      574.5        2.6       ?       ? 
1 1 1   24   19    9 o    926.9    3.5    0.0000   0.0000          ?        ?  8591.3086  65.1292          ?        ?      926.9        3.5       ?       ? 
1 1 1   24   19   10 o    131.1    3.7    0.0000   0.0000          ?        ?   171.7623   9.5778          ?        ?      131.1        3.7       ?       ? 
1 1 1   24   19   11 o    670.4    2.9    0.0000   0.0000          ?        ?  4495.1924  38.3113          ?        ?      670.4        2.9       ?       ? 
1 1 1   24   19   12 o    913.5    3.4    0.0000   0.0000          ?        ?  8344.8389  61.2981          ?        ?      913.5        3.4       ?       ? 
1 1 1   24   19   13 o   1136.7    3.9    0.0000   0.0000          ?        ? 12923.0391  88.1160          ?        ?     1136.7        3.9       ?       ? 
1 1 1   24   19   14 o    762.5    3.0    0.0000   0.0000          ?        ?  5814.3779  45.3350          ?        ?      762.5        3.0       ?       ? 
1 1 1   24   19   15 o    695.2    2.8    0.0000   0.0000          ?        ?  4832.9702  38.9498          ?        ?      695.2        2.8       ?       ? 
1 1 1   24   19   16 o   1487.8    5.1    0.0000   0.0000          ?        ? 22141.3770 151.9681          ?        ?     1487.8        5.1       ?       ? 
1 1 1   24   19   17 o    669.8    2.8    0.0000   0.0000          ?        ?  4486.2529  37.6728          ?        ?      669.8        2.8       ?       ? 
1 1 1   24   19   18 o    560.2    2.8    0.0000   0.0000          ?        ?  3138.3337  31.2876          ?        ?      560.2        2.8       ?       ? 
1 1 1   24   19   19 o    359.8    2.6    0.0000   0.0000          ?        ?  1294.9219  18.5171          ?        ?      359.8        2.6       ?       ? 
1 1 1   24   19   20 o    397.1    2.5    0.0000   0.0000          ?        ?  1577.1484  19.7942          ?        ?      397.1        2.5       ?       ? 
1 1 1   24   19   21 o    288.4    2.7    0.0000   0.0000          ?        ?   831.9937  15.3245          ?        ?      288.4        2.7       ?       ? 
1 1 1   24   19   22 f    147.8    4.3    0.0000   0.0000          ?        ?   218.3744  12.7704          ?        ?      147.8        4.3       ?       ? 
1 1 1   24   19   23 o    748.6    3.0    0.0000   0.0000          ?        ?  5604.3042  45.3350          ?        ?      748.6        3.0       ?       ? 
1 1 1   24   19   24 f    824.8    3.3    0.0000   0.0000          ?        ?  6803.4478  53.6358          ?        ?      824.8        3.3       ?       ? 
1 1 1   24   19   25 o    398.3    2.6    0.0000   0.0000          ?        ?  1586.7262  20.4327          ?        ?      398.3        2.6       ?       ? 
1 1 1   24   19   26 o    193.3    3.6    0.0000   0.0000          ?        ?   373.5352  14.0475          ?        ?      193.3        3.6       ?       ? 
1 1 1   24   19   27 o    247.4    3.1    0.0000   0.0000          ?        ?   612.3422  15.3245          ?        ?      247.4        3.1       ?       ? 
1 1 1   24   19   28 o    598.3    2.8    0.0000   0.0000          ?        ?  3579.5520  33.8416          ?        ?      598.3        2.8       ?       ? 
1 1 1   24   19   29 o    476.2    2.5    0.0000   0.0000          ?        ?  2268.0288  23.6253          ?        ?      476.2        2.5       ?       ? 
1 1 1   24   19   30 o    558.4    2.7    0.0000   0.0000          ?        ?  3118.5396  30.0105          ?        ?      558.4        2.7       ?       ? 
1 1 1   24   19   31 o     69.1   10.2    0.0000   0.0000          ?        ?    47.8891  14.0475          ?        ?       69.1       10.2       ?       ? 
1 1 1   24   19   32 o    590.3    2.5    0.0000   0.0000          ?        ?  3484.4126  30.0105          ?        ?      590.3        2.5       ?       ? 
1 1 1   24   19   33 o    445.9    2.6    0.0000   0.0000          ?        ?  1988.3563  23.6253          ?        ?      445.9        2.6       ?       ? 
1 1 1   24   19   34 o    609.6    2.7    0.0000   0.0000          ?        ?  3716.8342  33.2031          ?        ?      609.6        2.7       ?       ? 
1 1 1   24   19   35 o    238.8    3.3    0.0000   0.0000          ?        ?   570.1998  15.9630          ?        ?      238.8        3.3       ?       ? 
1 1 1   24   19   36 o    130.0    5.6    0.0000   0.0000          ?        ?   169.2082  14.6860          ?        ?      130.0        5.6       ?       ? 
1 1 1   24   19   37 o    425.7    2.5    0.0000   0.0000          ?        ?  1812.7628  21.0712          ?        ?      425.7        2.5       ?       ? 
1 1 1   24   19   38 o    297.6    2.9    0.0000   0.0000          ?        ?   885.6295  17.2401          ?        ?      297.6        2.9       ?       ? 
1 1 1   24   19   39 o    197.5    4.0    0.0000   0.0000          ?        ?   390.1367  15.9630          ?        ?      197.5        4.0       ?       ? 
1 1 1   24   19   40 o     94.1    8.1    0.0000   0.0000          ?        ?    88.7545  15.3245          ?        ?       94.1        8.1       ?       ? 
1 1 1   24   19   41 o    167.4    4.6    0.0000   0.0000          ?        ?   280.3110  15.3245          ?        ?      167.4        4.6       ?       ? 
1 1 1   24   19   42 o    276.4    3.0    0.0000   0.0000          ?        ?   764.3104  16.6016          ?        ?      276.4        3.0       ?       ? 
1 1 1   24   19   43 o    122.2    6.0    0.0000   0.0000          ?        ?   149.4141  14.6860          ?        ?      122.2        6.0       ?       ? 
1 1 1   24   19   44 o    232.1    3.7    0.0000   0.0000          ?        ?   538.9123  17.2401          ?        ?      232.1        3.7       ?       ? 
1 1 1   24   19   45 o     21.9   10.7    0.0000   0.0000          ?        ?   -31.9261  15.9630          ?        ?       21.9       10.7       ?       ? 
1 1 1   24   19   46 o    289.6    3.1    0.0000   0.0000          ?        ?   839.0174  17.8786          ?        ?      289.6        3.1       ?       ? 
1 1 1   24   19   47 f    309.1    3.1    0.0000   0.0000          ?        ?   955.8669  19.1556          ?        ?      309.1        3.1       ?       ? 
1 1 1   24   19   48 f    195.8    4.4    0.0000   0.0000          ?        ?   383.7515  17.2401          ?        ?      195.8        4.4       ?       ? 
1 1 1   24   19   49 o    513.0    2.6    0.0000   0.0000          ?        ?  2632.6245  26.8179          ?        ?      513.0        2.6       ?       ? 
1 1 1   24   19   50 o    219.0    4.2    0.0000   0.0000          ?        ?   480.1682  18.5171          ?        ?      219.0        4.2       ?       ? 
1 1 1   24   19   51 o    125.7    6.9    0.0000   0.0000          ?        ?   158.3534  17.2401          ?        ?      125.7        6.9       ?       ? 
1 1 1   24   19   52 o     49.0   15.9    0.0000   0.0000          ?        ?    23.6253  17.8786          ?        ?       49.0       15.9       ?       ? 
1 1 1   24   19   53 o    225.5    4.1    0.0000   0.0000          ?        ?   508.9017  18.5171          ?        ?      225.5        4.1       ?       ? 
1 1 1   24   19   54 o    459.3    2.9    0.0000   0.0000          ?        ?  2110.9526  26.8179          ?        ?      459.3        2.9       ?       ? 
1 1 1   24   19   55 o     30.2   13.8    0.0000   0.0000          ?        ?   -14.0475  19.1556          ?        ?       30.2       13.8       ?       ? 
1 1 1   24   19   56 o    132.5    7.2    0.0000   0.0000          ?        ?   176.2320  19.1556          ?        ?      132.5        7.2       ?       ? 
1 1 1   24   19   57 o    159.0    6.0    0.0000   0.0000          ?        ?   253.4931  19.1556          ?        ?      159.0        6.0       ?       ? 
1 1 1   24   19   58 o     33.4   14.7    0.0000   0.0000          ?        ?    -5.1082  19.1556          ?        ?       33.4       14.7       ?       ? 
1 1 1   24   19   59 o     39.4   15.9    0.0000   0.0000          ?        ?     7.6623  19.1556          ?        ?       39.4       15.9       ?       ? 
1 1 1   24   19   60 o    354.9    3.1    0.0000   0.0000          ?        ?  1260.4417  22.3483          ?        ?      354.9        3.1       ?       ? 
1 1 1   24   19   61 o    446.9    2.9    0.0000   0.0000          ?        ?  1999.2113  26.1794          ?        ?      446.9        2.9       ?       ? 
1 1 1   24   19   62 o     25.3   12.2    0.0000   0.0000          ?        ?   -31.2876  19.1556          ?        ?       25.3       12.2       ?       ? 
1 1 1   24   19   63 f    222.9    4.6    0.0000   0.0000          ?        ?   498.0469  20.4327          ?        ?      222.9        4.6       ?       ? 
1 1 1   24   19   64 o     66.0   15.3    0.0000   0.0000          ?        ?    46.6121  19.7942          ?        ?       66.0       15.3       ?       ? 
1 1 1   24   19   65 o     82.9   11.9    0.0000   0.0000          ?        ?    70.2374  19.7942          ?        ?       82.9       11.9       ?       ? 
1 1 1   24   19   66 o    336.4    3.3    0.0000   0.0000          ?        ?  1133.3759  22.3483          ?        ?      336.4        3.3       ?       ? 
1 1 1   24   19   67 o     73.0   14.1    0.0000   0.0000          ?        ?    56.8284  19.7942          ?        ?       73.0       14.1       ?       ? 
1 1 1   24   19   68 o    121.4    8.2    0.0000   0.0000          ?        ?   149.4141  19.7942          ?        ?      121.4        8.2       ?       ? 
1 1 1   24   20    0 o    755.0    5.1 5701.3599  76.6226  5701.3599  76.6226  5701.3599  76.6226      755.0      5.1      755.0        5.1     0.0     0.0 
1 1 1   24   20    1 o    285.7    3.1    0.0000   0.0000          ?        ?   816.0306  17.8786          ?        ?      285.7        3.1       ?       ? 
1 1 1   24   20    2 o    909.4    4.2    0.0000   0.0000          ?        ?  8271.4092  75.9841          ?        ?      909.4        4.2       ?       ? 
1 1 1   24   20    3 o    197.8    4.2    0.0000   0.0000          ?        ?   391.4138  16.6016          ?        ?      197.8        4.2       ?       ? 
1 1 1   24   20    4 o    540.5    2.7    0.0000   0.0000          ?        ?  2921.2363  28.7335          ?        ?      540.5        2.7       ?       ? 
1 1 1   24   20    5 o    986.5    3.9    0.0000   0.0000          ?        ?  9732.9854  75.9841          ?        ?      986.5        3.9       ?       ? 
1 1 1   24   20    6 o    560.3    2.7    0.0000   0.0000          ?        ?  3138.9724  30.6490          ?        ?      560.3        2.7       ?       ? 
1 1 1   24   20    7 o    425.1    2.3    0.0000   0.0000          ?        ?  1807.0162  19.1556          ?        ?      425.1        2.3       ?       ? 
1 1 1   24   20    8 o    786.2    3.1    0.0000   0.0000          ?        ?  6182.1665  48.5276          ?        ?      786.2        3.1       ?       ? 
1 1 1   24   20    9 o    541.9    2.5    0.0000   0.0000          ?        ?  2937.1995  27.4564          ?        ?      541.9        2.5       ?       ? 
1 1 1   24   20   10 o    987.6    3.6    0.0000   0.0000          ?        ?  9754.0566  71.5144          ?        ?      987.6        3.6       ?       ? 
1 1 1   24   20   11 o    852.7    3.3    0.0000   0.0000          ?        ?  7271.4844  55.5514          ?        ?      852.7        3.3       ?       ? 
1 1 1   24   20   12 o   1632.1    5.5    0.0000   0.0000          ?        ? 26644.8691 180.7016          ?        ?     1632.1        5.5       ?       ? 
1 1 1   24   20   13 o    474.5    2.4    0.0000   0.0000          ?        ?  2252.0659  22.9868          ?        ?      474.5        2.4       ?       ? 
1 1 1   24   20   14 o    332.5    2.2    0.0000   0.0000          ?        ?  1105.2810  14.6860          ?        ?      332.5        2.2       ?       ? 
1 1 1   24   20   15 f    405.7    2.4    0.0000   0.0000          ?        ?  1646.1086  19.1556          ?        ?      405.7        2.4       ?       ? 
1 1 1   24   20   16 o    653.7    2.9    0.0000   0.0000          ?        ?  4272.9868  37.6728          ?        ?      653.7        2.9       ?       ? 
1 1 1   24   20   17 f    999.2    3.6    0.0000   0.0000          ?        ?  9985.2012  72.7915          ?        ?      999.2        3.6       ?       ? 
1 1 1   24   20   18 o    812.4    3.1    0.0000   0.0000          ?        ?  6600.3979  49.8047          ?        ?      812.4        3.1       ?       ? 
1 1 1   24   20   19 o    642.4    2.7    0.0000   0.0000          ?        ?  4126.7651  34.4802          ?        ?      642.4        2.7       ?       ? 
1 1 1   24   20   20 o   1268.9    4.4    0.0000   0.0000          ?        ? 16103.5156 110.4642          ?        ?     1268.9        4.4       ?       ? 
1 1 1   24   20   21 o    754.8    3.0    0.0000   0.0000          ?        ?  5697.5283  45.3350          ?        ?      754.8        3.0       ?       ? 
1 1 1   24   20   22 o    668.0    2.8    0.0000   0.0000          ?        ?  4462.6279  37.0343          ?        ?      668.0        2.8       ?       ? 
1 1 1   24   20   23 o    376.2    2.4    0.0000   0.0000          ?        ?  1415.6024  17.8786          ?        ?      376.2        2.4       ?       ? 
1 1 1   24   20   24 o   1125.5    4.0    0.0000   0.0000          ?        ? 12670.8232  90.6701          ?        ?     1125.5        4.0       ?       ? 
1 1 1   24   20   25 o    637.6    2.8    0.0000   0.0000          ?        ?  4065.4673  35.7572          ?        ?      637.6        2.8       ?       ? 
1 1 1   24   20   26 o    990.2    3.7    0.0000   0.0000          ?        ?  9807.6924  73.4300          ?        ?      990.2        3.7       ?       ? 
1 1 1   24   20   27 o    757.5    3.0    0.0000   0.0000          ?        ?  5739.0322  45.9736          ?        ?      757.5        3.0       ?       ? 
1 1 1   24   20   28 o    458.1    2.5    0.0000   0.0000          ?        ?  2098.8206  22.9868          ?        ?      458.1        2.5       ?       ? 
1 1 1   24   20   29 o    430.2    2.6    0.0000   0.0000          ?        ?  1851.0741  22.3483          ?        ?      430.2        2.6       ?       ? 
1 1 1   24   20   30 o    883.6    3.5    0.0000   0.0000          ?        ?  7809.1196  61.2981          ?        ?      883.6        3.5       ?       ? 
1 1 1   24   20   31 o    503.0    2.5    0.0000   0.0000          ?        ?  2530.4612  25.5409          ?        ?      503.0        2.5       ?       ? 
1 1 1   24   20   32 o    542.8    2.6    0.0000   0.0000          ?        ?  2946.7773  28.7335          ?        ?      542.8        2.6       ?       ? 
1 1 1   24   20   33 o    147.7    4.8    0.0000   0.0000          ?        ?   218.3744  14.0475          ?        ?      147.7        4.8       ?       ? 
1 1 1   24   20   34 o     58.0   13.0    0.0000   0.0000          ?        ?    35.1187  14.6860          ?        ?       58.0       13.0       ?       ? 
1 1 1   24   20   35 o    277.2    3.0    0.0000   0.0000          ?        ?   768.7800  16.6016          ?        ?      277.2        3.0       ?       ? 
1 1 1   24   20   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   20   37 o    347.1    2.9    0.0000   0.0000          ?        ?  1204.8903  19.7942          ?        ?      347.1        2.9       ?       ? 
1 1 1   24   20   38 o    262.9    2.9    0.0000   0.0000          ?        ?   691.5189  15.3245          ?        ?      262.9        2.9       ?       ? 
1 1 1   24   20   39 o    175.2    4.2    0.0000   0.0000          ?        ?   307.1289  14.6860          ?        ?      175.2        4.2       ?       ? 
1 1 1   24   20   40 o    358.6    2.8    0.0000   0.0000          ?        ?  1285.9825  19.7942          ?        ?      358.6        2.8       ?       ? 
1 1 1   24   20   41 o    386.2    2.6    0.0000   0.0000          ?        ?  1491.5865  20.4327          ?        ?      386.2        2.6       ?       ? 
1 1 1   24   20   42 o    463.1    2.6    0.0000   0.0000          ?        ?  2144.7942  23.6253          ?        ?      463.1        2.6       ?       ? 
1 1 1   24   20   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   20   44 o    292.2    3.1    0.0000   0.0000          ?        ?   854.3420  17.8786          ?        ?      292.2        3.1       ?       ? 
1 1 1   24   20   45 o    281.9    3.2    0.0000   0.0000          ?        ?   794.9594  17.8786          ?        ?      281.9        3.2       ?       ? 
1 1 1   24   20   46 o     17.9    9.0    0.0000   0.0000          ?        ?   -55.5514  15.9630          ?        ?       17.9        9.0       ?       ? 
1 1 1   24   20   47 o     29.2   13.1    0.0000   0.0000          ?        ?    -7.6623  15.9630          ?        ?       29.2       13.1       ?       ? 
1 1 1   24   20   48 o    375.1    2.7    0.0000   0.0000          ?        ?  1407.3016  20.4327          ?        ?      375.1        2.7       ?       ? 
1 1 1   24   20   49 o    202.4    4.4    0.0000   0.0000          ?        ?   409.9309  17.8786          ?        ?      202.4        4.4       ?       ? 
1 1 1   24   20   50 o    532.2    2.6    0.0000   0.0000          ?        ?  2833.1206  28.0950          ?        ?      532.2        2.6       ?       ? 
1 1 1   24   20   51 o    300.0    3.3    0.0000   0.0000          ?        ?   900.3155  19.7942          ?        ?      300.0        3.3       ?       ? 
1 1 1   24   20   52 o    333.0    3.1    0.0000   0.0000          ?        ?  1109.7506  20.4327          ?        ?      333.0        3.1       ?       ? 
1 1 1   24   20   53 o    169.1    5.9    0.0000   0.0000          ?        ?   286.6962  19.7942          ?        ?      169.1        5.9       ?       ? 
1 1 1   24   20   54 o    193.1    5.0    0.0000   0.0000          ?        ?   373.5352  19.1556          ?        ?      193.1        5.0       ?       ? 
1 1 1   24   20   55 o    162.6    5.9    0.0000   0.0000          ?        ?   264.9865  19.1556          ?        ?      162.6        5.9       ?       ? 
1 1 1   24   20   56 o    184.6    5.2    0.0000   0.0000          ?        ?   341.6091  19.1556          ?        ?      184.6        5.2       ?       ? 
1 1 1   24   20   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   20   58 o    250.4    4.0    0.0000   0.0000          ?        ?   627.6667  19.7942          ?        ?      250.4        4.0       ?       ? 
1 1 1   24   20   59 o    171.7    5.6    0.0000   0.0000          ?        ?   295.6355  19.1556          ?        ?      171.7        5.6       ?       ? 
1 1 1   24   20   60 o     31.6   14.3    0.0000   0.0000          ?        ?   -11.4934  19.7942          ?        ?       31.6       14.3       ?       ? 
1 1 1   24   20   61 o    144.8    6.6    0.0000   0.0000          ?        ?   210.7121  19.1556          ?        ?      144.8        6.6       ?       ? 
1 1 1   24   20   62 o     40.3   16.0    0.0000   0.0000          ?        ?     9.5778  19.1556          ?        ?       40.3       16.0       ?       ? 
1 1 1   24   20   63 o    113.0    9.0    0.0000   0.0000          ?        ?   128.9814  20.4327          ?        ?      113.0        9.0       ?       ? 
1 1 1   24   20   64 f    131.7    7.8    0.0000   0.0000          ?        ?   174.9549  20.4327          ?        ?      131.7        7.8       ?       ? 
1 1 1   24   20   65 o    237.5    4.6    0.0000   0.0000          ?        ?   565.7302  21.7097          ?        ?      237.5        4.6       ?       ? 
1 1 1   24   20   66 o     90.1   11.0    0.0000   0.0000          ?        ?    83.0078  19.7942          ?        ?       90.1       11.0       ?       ? 
1 1 1   24   20   67 o     46.8   16.7    0.0000   0.0000          ?        ?    20.4327  19.7942          ?        ?       46.8       16.7       ?       ? 
1 1 1   24   21    0 o    508.4    4.7 2586.0127  47.8891  2586.0127  47.8891  2586.0127  47.8891      508.4      4.7      508.4        4.7     0.0     0.0 
1 1 1   24   21    1 o    497.0    3.5    0.0000   0.0000          ?        ?  2470.4402  34.4802          ?        ?      497.0        3.5       ?       ? 
1 1 1   24   21    2 o   1293.2    5.3    0.0000   0.0000          ?        ? 16726.7129 137.9207          ?        ?     1293.2        5.3       ?       ? 
1 1 1   24   21    3 o   1025.5    4.4    0.0000   0.0000          ?        ? 10519.0059  90.6701          ?        ?     1025.5        4.4       ?       ? 
1 1 1   24   21    4 o    517.1    2.8    0.0000   0.0000          ?        ?  2674.1284  29.3720          ?        ?      517.1        2.8       ?       ? 
1 1 1   24   21    5 o    788.7    3.6    0.0000   0.0000          ?        ?  6221.1162  56.1899          ?        ?      788.7        3.6       ?       ? 
1 1 1   24   21    6 o    853.0    3.6    0.0000   0.0000          ?        ?  7276.5923  61.9366          ?        ?      853.0        3.6       ?       ? 
1 1 1   24   21    7 o    635.8    2.7    0.0000   0.0000          ?        ?  4042.4802  34.4802          ?        ?      635.8        2.7       ?       ? 
1 1 1   24   21    8 o    233.9    2.5    0.0000   0.0000          ?        ?   547.2130  11.4934          ?        ?      233.9        2.5       ?       ? 
1 1 1   24   21    9 o   1178.5    4.3    0.0000   0.0000          ?        ? 13891.0381 100.8864          ?        ?     1178.5        4.3       ?       ? 
1 1 1   24   21   10 o   1108.3    3.8    0.0000   0.0000          ?        ? 12285.1562  84.9234          ?        ?     1108.3        3.8       ?       ? 
1 1 1   24   21   11 o    701.1    2.6    0.0000   0.0000          ?        ?  4915.9780  37.0343          ?        ?      701.1        2.6       ?       ? 
1 1 1   24   21   12 o    399.1    2.2    0.0000   0.0000          ?        ?  1593.1115  17.8786          ?        ?      399.1        2.2       ?       ? 
1 1 1   24   21   13 o    813.3    3.0    0.0000   0.0000          ?        ?  6615.0840  49.1662          ?        ?      813.3        3.0       ?       ? 
1 1 1   24   21   14 o    173.2    3.1    0.0000   0.0000          ?        ?   300.1052  10.8549          ?        ?      173.2        3.1       ?       ? 
1 1 1   24   21   15 o    893.8    3.3    0.0000   0.0000          ?        ?  7989.8213  58.1055          ?        ?      893.8        3.3       ?       ? 
1 1 1   24   21   16 o    199.8    3.0    0.0000   0.0000          ?        ?   399.0760  12.1319          ?        ?      199.8        3.0       ?       ? 
1 1 1   24   21   17 o    467.3    2.5    0.0000   0.0000          ?        ?  2183.7439  22.9868          ?        ?      467.3        2.5       ?       ? 
1 1 1   24   21   18 o    425.9    2.5    0.0000   0.0000          ?        ?  1814.0400  21.0712          ?        ?      425.9        2.5       ?       ? 
1 1 1   24   21   19 o    281.0    2.8    0.0000   0.0000          ?        ?   789.8513  15.9630          ?        ?      281.0        2.8       ?       ? 
1 1 1   24   21   20 o    589.2    2.7    0.0000   0.0000          ?        ?  3471.6421  31.2876          ?        ?      589.2        2.7       ?       ? 
1 1 1   24   21   21 o    658.3    2.9    0.0000   0.0000          ?        ?  4334.2847  37.6728          ?        ?      658.3        2.9       ?       ? 
1 1 1   24   21   22 o    212.5    3.2    0.0000   0.0000          ?        ?   451.4348  13.4090          ?        ?      212.5        3.2       ?       ? 
1 1 1   24   21   23 o    155.3    3.9    0.0000   0.0000          ?        ?   241.3612  12.1319          ?        ?      155.3        3.9       ?       ? 
1 1 1   24   21   24 o    364.2    2.4    0.0000   0.0000          ?        ?  1326.2094  17.2401          ?        ?      364.2        2.4       ?       ? 
1 1 1   24   21   25 o     26.6   12.0    0.0000   0.0000          ?        ?    -7.0237  13.4090          ?        ?       26.6       12.0       ?       ? 
1 1 1   24   21   26 o    387.8    2.4    0.0000   0.0000          ?        ?  1504.3569  18.5171          ?        ?      387.8        2.4       ?       ? 
1 1 1   24   21   27 o    122.2    5.5    0.0000   0.0000          ?        ?   149.4141  13.4090          ?        ?      122.2        5.5       ?       ? 
1 1 1   24   21   28 o    365.7    2.4    0.0000   0.0000          ?        ?  1337.7028  17.8786          ?        ?      365.7        2.4       ?       ? 
1 1 1   24   21   29 o    382.8    2.4    0.0000   0.0000          ?        ?  1465.4071  18.5171          ?        ?      382.8        2.4       ?       ? 
1 1 1   24   21   30 o    140.4    5.0    0.0000   0.0000          ?        ?   197.3032  14.0475          ?        ?      140.4        5.0       ?       ? 
1 1 1   24   21   31 o     31.8   13.6    0.0000   0.0000          ?        ?    -0.6385  15.3245          ?        ?       31.8       13.6       ?       ? 
1 1 1   24   21   32 o    543.8    2.8    0.0000   0.0000          ?        ?  2958.2705  30.6490          ?        ?      543.8        2.8       ?       ? 
1 1 1   24   21   33 o    830.1    3.2    0.0000   0.0000          ?        ?  6892.2026  52.9973          ?        ?      830.1        3.2       ?       ? 
1 1 1   24   21   34 o    444.3    2.7    0.0000   0.0000          ?        ?  1974.3090  23.6253          ?        ?      444.3        2.7       ?       ? 
1 1 1   24   21   35 f    281.1    3.1    0.0000   0.0000          ?        ?   790.4898  17.2401          ?        ?      281.1        3.1       ?       ? 
1 1 1   24   21   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   21   37 o    163.5    5.1    0.0000   0.0000          ?        ?   267.5406  16.6016          ?        ?      163.5        5.1       ?       ? 
1 1 1   24   21   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   21   39 o    315.9    2.7    0.0000   0.0000          ?        ?   998.0093  17.2401          ?        ?      315.9        2.7       ?       ? 
1 1 1   24   21   40 o    318.1    2.9    0.0000   0.0000          ?        ?  1012.0568  18.5171          ?        ?      318.1        2.9       ?       ? 
1 1 1   24   21   41 o    441.5    2.5    0.0000   0.0000          ?        ?  1949.4065  22.3483          ?        ?      441.5        2.5       ?       ? 
1 1 1   24   21   42 o    403.9    2.7    0.0000   0.0000          ?        ?  1632.0613  21.7097          ?        ?      403.9        2.7       ?       ? 
1 1 1   24   21   43 o    163.3    4.9    0.0000   0.0000          ?        ?   266.9020  15.9630          ?        ?      163.3        4.9       ?       ? 
1 1 1   24   21   44 o    328.3    2.9    0.0000   0.0000          ?        ?  1078.4630  19.1556          ?        ?      328.3        2.9       ?       ? 
1 1 1   24   21   45 o    312.7    3.1    0.0000   0.0000          ?        ?   978.2151  19.1556          ?        ?      312.7        3.1       ?       ? 
1 1 1   24   21   46 o    212.2    4.1    0.0000   0.0000          ?        ?   450.7963  17.2401          ?        ?      212.2        4.1       ?       ? 
1 1 1   24   21   47 o     69.4   11.5    0.0000   0.0000          ?        ?    48.5276  15.9630          ?        ?       69.4       11.5       ?       ? 
1 1 1   24   21   48 o    357.9    2.8    0.0000   0.0000          ?        ?  1281.5129  19.7942          ?        ?      357.9        2.8       ?       ? 
1 1 1   24   21   49 o     64.4   13.3    0.0000   0.0000          ?        ?    43.4195  16.6016          ?        ?       64.4       13.3       ?       ? 
1 1 1   24   21   50 f    117.0    7.4    0.0000   0.0000          ?        ?   137.2822  17.2401          ?        ?      117.0        7.4       ?       ? 
1 1 1   24   21   51 f    348.8    2.9    0.0000   0.0000          ?        ?  1217.0222  20.4327          ?        ?      348.8        2.9       ?       ? 
1 1 1   24   21   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   21   53 o    253.7    4.0    0.0000   0.0000          ?        ?   644.2683  20.4327          ?        ?      253.7        4.0       ?       ? 
1 1 1   24   21   54 o    274.0    3.6    0.0000   0.0000          ?        ?   751.5399  19.7942          ?        ?      274.0        3.6       ?       ? 
1 1 1   24   21   55 o    176.2    5.3    0.0000   0.0000          ?        ?   310.9600  18.5171          ?        ?      176.2        5.3       ?       ? 
1 1 1   24   21   56 o    120.6    8.2    0.0000   0.0000          ?        ?   146.2215  19.7942          ?        ?      120.6        8.2       ?       ? 
1 1 1   24   21   57 o     24.7   12.0    0.0000   0.0000          ?        ?   -31.2876  18.5171          ?        ?       24.7       12.0       ?       ? 
1 1 1   24   21   58 f    113.2    8.5    0.0000   0.0000          ?        ?   128.9814  19.1556          ?        ?      113.2        8.5       ?       ? 
1 1 1   24   21   59 o     86.7   10.7    0.0000   0.0000          ?        ?    75.9841  18.5171          ?        ?       86.7       10.7       ?       ? 
1 1 1   24   21   60 o     65.3   15.0    0.0000   0.0000          ?        ?    45.3350  19.1556          ?        ?       65.3       15.0       ?       ? 
1 1 1   24   21   61 f    152.7    6.3    0.0000   0.0000          ?        ?   234.3374  19.1556          ?        ?      152.7        6.3       ?       ? 
1 1 1   24   21   62 o     59.0   16.6    0.0000   0.0000          ?        ?    37.0343  20.4327          ?        ?       59.0       16.6       ?       ? 
1 1 1   24   21   63 o    179.2    5.7    0.0000   0.0000          ?        ?   322.4534  20.4327          ?        ?      179.2        5.7       ?       ? 
1 1 1   24   21   64 o     29.0   13.6    0.0000   0.0000          ?        ?   -21.0712  20.4327          ?        ?       29.0       13.6       ?       ? 
1 1 1   24   21   65 f    100.9    9.8    0.0000   0.0000          ?        ?   103.4405  19.7942          ?        ?      100.9        9.8       ?       ? 
1 1 1   24   21   66 o     45.2   16.6    0.0000   0.0000          ?        ?    17.8786  19.7942          ?        ?       45.2       16.6       ?       ? 
1 1 1   24   21   67 o     47.5   16.7    0.0000   0.0000          ?        ?    21.7097  19.7942          ?        ?       47.5       16.7       ?       ? 
1 1 1   24   22    0 o    218.4    6.6  478.2527  28.7335   478.2527  28.7335   478.2527  28.7335      218.4      6.6      218.4        6.6     0.0     0.0 
1 1 1   24   22    1 o    429.0    3.1    0.0000   0.0000          ?        ?  1840.8578  26.8179          ?        ?      429.0        3.1       ?       ? 
1 1 1   24   22    2 o     87.1    9.9    0.0000   0.0000          ?        ?    75.9841  17.2401          ?        ?       87.1        9.9       ?       ? 
1 1 1   24   22    3 o    587.5    3.4    0.0000   0.0000          ?        ?  3452.4866  40.2269          ?        ?      587.5        3.4       ?       ? 
1 1 1   24   22    4 o    396.7    3.1    0.0000   0.0000          ?        ?  1573.9558  24.2638          ?        ?      396.7        3.1       ?       ? 
1 1 1   24   22    5 o    389.9    2.8    0.0000   0.0000          ?        ?  1520.3201  21.7097          ?        ?      389.9        2.8       ?       ? 
1 1 1   24   22    6 o    520.1    2.8    0.0000   0.0000          ?        ?  2705.4163  28.7335          ?        ?      520.1        2.8       ?       ? 
1 1 1   24   22    7 o    905.0    3.6    0.0000   0.0000          ?        ?  8191.5942  65.1292          ?        ?      905.0        3.6       ?       ? 
1 1 1   24   22    8 o    909.2    3.4    0.0000   0.0000          ?        ?  8266.9395  61.9366          ?        ?      909.2        3.4       ?       ? 
1 1 1   24   22    9 o    576.0    2.8    0.0000   0.0000          ?        ?  3317.7583  31.9261          ?        ?      576.0        2.8       ?       ? 
1 1 1   24   22   10 o    308.2    1.9    0.0000   0.0000          ?        ?   950.1202  11.4934          ?        ?      308.2        1.9       ?       ? 
1 1 1   24   22   11 f    831.3    3.1    0.0000   0.0000          ?        ?  6911.3584  51.0817          ?        ?      831.3        3.1       ?       ? 
1 1 1   24   22   12 o    282.8    2.3    0.0000   0.0000          ?        ?   800.0676  12.7704          ?        ?      282.8        2.3       ?       ? 
1 1 1   24   22   13 o    234.2    2.5    0.0000   0.0000          ?        ?   548.4901  11.4934          ?        ?      234.2        2.5       ?       ? 
1 1 1   24   22   14 o    700.6    2.9    0.0000   0.0000          ?        ?  4908.3159  40.8654          ?        ?      700.6        2.9       ?       ? 
1 1 1   24   22   15 o    267.4    2.4    0.0000   0.0000          ?        ?   715.1442  12.7704          ?        ?      267.4        2.4       ?       ? 
1 1 1   24   22   16 o    646.4    2.7    0.0000   0.0000          ?        ?  4178.4858  35.1187          ?        ?      646.4        2.7       ?       ? 
1 1 1   24   22   17 o    383.4    2.2    0.0000   0.0000          ?        ?  1469.8767  17.2401          ?        ?      383.4        2.2       ?       ? 
1 1 1   24   22   18 o    368.2    2.3    0.0000   0.0000          ?        ?  1355.5814  16.6016          ?        ?      368.2        2.3       ?       ? 
1 1 1   24   22   19 o    459.6    2.3    0.0000   0.0000          ?        ?  2112.8679  21.0712          ?        ?      459.6        2.3       ?       ? 
1 1 1   24   22   20 o    383.1    2.3    0.0000   0.0000          ?        ?  1467.9612  17.8786          ?        ?      383.1        2.3       ?       ? 
1 1 1   24   22   21 o    616.7    2.7    0.0000   0.0000          ?        ?  3803.0347  33.2031          ?        ?      616.7        2.7       ?       ? 
1 1 1   24   22   22 o    328.1    2.5    0.0000   0.0000          ?        ?  1076.5475  16.6016          ?        ?      328.1        2.5       ?       ? 
1 1 1   24   22   23 o    302.8    2.5    0.0000   0.0000          ?        ?   916.9171  15.3245          ?        ?      302.8        2.5       ?       ? 
1 1 1   24   22   24 o    459.9    2.4    0.0000   0.0000          ?        ?  2115.4221  21.7097          ?        ?      459.9        2.4       ?       ? 
1 1 1   24   22   25 o    235.5    2.8    0.0000   0.0000          ?        ?   554.8753  13.4090          ?        ?      235.5        2.8       ?       ? 
1 1 1   24   22   26 o    209.7    3.2    0.0000   0.0000          ?        ?   439.9414  13.4090          ?        ?      209.7        3.2       ?       ? 
1 1 1   24   22   27 o    164.3    3.9    0.0000   0.0000          ?        ?   270.0946  12.7704          ?        ?      164.3        3.9       ?       ? 
1 1 1   24   22   28 o    245.4    2.9    0.0000   0.0000          ?        ?   602.1259  14.0475          ?        ?      245.4        2.9       ?       ? 
1 1 1   24   22   29 o    601.1    2.6    0.0000   0.0000          ?        ?  3613.3940  31.2876          ?        ?      601.1        2.6       ?       ? 
1 1 1   24   22   30 o    443.6    2.4    0.0000   0.0000          ?        ?  1967.9237  21.7097          ?        ?      443.6        2.4       ?       ? 
1 1 1   24   22   31 o    205.7    3.7    0.0000   0.0000          ?        ?   423.3398  15.3245          ?        ?      205.7        3.7       ?       ? 
1 1 1   24   22   32 o     25.3   11.7    0.0000   0.0000          ?        ?   -12.1319  14.0475          ?        ?       25.3       11.7       ?       ? 
1 1 1   24   22   33 o    424.1    2.5    0.0000   0.0000          ?        ?  1798.7155  21.0712          ?        ?      424.1        2.5       ?       ? 
1 1 1   24   22   34 o    475.2    2.5    0.0000   0.0000          ?        ?  2258.4512  23.6253          ?        ?      475.2        2.5       ?       ? 
1 1 1   24   22   35 o    489.3    2.5    0.0000   0.0000          ?        ?  2395.0947  24.9023          ?        ?      489.3        2.5       ?       ? 
1 1 1   24   22   36 o    452.8    2.5    0.0000   0.0000          ?        ?  2050.2930  22.3483          ?        ?      452.8        2.5       ?       ? 
1 1 1   24   22   37 o    362.1    2.6    0.0000   0.0000          ?        ?  1311.5234  19.1556          ?        ?      362.1        2.6       ?       ? 
1 1 1   24   22   38 f    436.3    2.6    0.0000   0.0000          ?        ?  1904.0715  22.9868          ?        ?      436.3        2.6       ?       ? 
1 1 1   24   22   39 o    173.9    4.6    0.0000   0.0000          ?        ?   302.6593  15.9630          ?        ?      173.9        4.6       ?       ? 
1 1 1   24   22   40 o    318.9    3.1    0.0000   0.0000          ?        ?  1017.1650  19.7942          ?        ?      318.9        3.1       ?       ? 
1 1 1   24   22   41 o    183.2    4.4    0.0000   0.0000          ?        ?   335.8624  15.9630          ?        ?      183.2        4.4       ?       ? 
1 1 1   24   22   42 o    295.5    3.1    0.0000   0.0000          ?        ?   873.4976  18.5171          ?        ?      295.5        3.1       ?       ? 
1 1 1   24   22   43 o    284.6    3.4    0.0000   0.0000          ?        ?   810.2839  19.1556          ?        ?      284.6        3.4       ?       ? 
1 1 1   24   22   44 o    335.4    3.0    0.0000   0.0000          ?        ?  1125.7136  20.4327          ?        ?      335.4        3.0       ?       ? 
1 1 1   24   22   45 o    153.0    5.6    0.0000   0.0000          ?        ?   234.3374  17.2401          ?        ?      153.0        5.6       ?       ? 
1 1 1   24   22   46 o     41.1   15.2    0.0000   0.0000          ?        ?    13.4090  16.6016          ?        ?       41.1       15.2       ?       ? 
1 1 1   24   22   47 o    161.9    5.3    0.0000   0.0000          ?        ?   262.4324  17.2401          ?        ?      161.9        5.3       ?       ? 
1 1 1   24   22   48 o    125.4    6.6    0.0000   0.0000          ?        ?   157.7148  16.6016          ?        ?      125.4        6.6       ?       ? 
1 1 1   24   22   49 o    104.9    7.6    0.0000   0.0000          ?        ?   110.4642  15.9630          ?        ?      104.9        7.6       ?       ? 
1 1 1   24   22   50 o    207.5    4.5    0.0000   0.0000          ?        ?   431.0021  18.5171          ?        ?      207.5        4.5       ?       ? 
1 1 1   24   22   51 o     19.7    9.9    0.0000   0.0000          ?        ?   -51.0817  17.2401          ?        ?       19.7        9.9       ?       ? 
1 1 1   24   22   52 o     95.6    9.4    0.0000   0.0000          ?        ?    91.9471  17.8786          ?        ?       95.6        9.4       ?       ? 
1 1 1   24   22   53 o     18.8    9.5    0.0000   0.0000          ?        ?   -62.5751  17.8786          ?        ?       18.8        9.5       ?       ? 
1 1 1   24   22   54 o    353.0    3.1    0.0000   0.0000          ?        ?  1247.0327  21.7097          ?        ?      353.0        3.1       ?       ? 
1 1 1   24   22   55 o    415.6    2.9    0.0000   0.0000          ?        ?  1728.4781  24.2638          ?        ?      415.6        2.9       ?       ? 
1 1 1   24   22   56 f    164.1    5.6    0.0000   0.0000          ?        ?   270.0946  18.5171          ?        ?      164.1        5.6       ?       ? 
1 1 1   24   22   57 o    125.0    7.7    0.0000   0.0000          ?        ?   157.0763  19.1556          ?        ?      125.0        7.7       ?       ? 
1 1 1   24   22   58 o     99.6    9.9    0.0000   0.0000          ?        ?   100.2479  19.7942          ?        ?       99.6        9.9       ?       ? 
1 1 1   24   22   59 o    233.8    4.2    0.0000   0.0000          ?        ?   547.8516  19.7942          ?        ?      233.8        4.2       ?       ? 
1 1 1   24   22   60 f    223.6    4.4    0.0000   0.0000          ?        ?   501.2395  19.7942          ?        ?      223.6        4.4       ?       ? 
1 1 1   24   22   61 o    296.5    3.8    0.0000   0.0000          ?        ?   880.5213  22.3483          ?        ?      296.5        3.8       ?       ? 
1 1 1   24   22   62 o    152.2    6.5    0.0000   0.0000          ?        ?   233.0604  19.7942          ?        ?      152.2        6.5       ?       ? 
1 1 1   24   22   63 o     53.1   16.7    0.0000   0.0000          ?        ?    29.3720  19.7942          ?        ?       53.1       16.7       ?       ? 
1 1 1   24   22   64 o    135.0    7.3    0.0000   0.0000          ?        ?   183.8942  19.7942          ?        ?      135.0        7.3       ?       ? 
1 1 1   24   22   65 o     63.3   15.3    0.0000   0.0000          ?        ?    43.4195  19.1556          ?        ?       63.3       15.3       ?       ? 
1 1 1   24   22   66 o    223.7    4.6    0.0000   0.0000          ?        ?   502.5165  20.4327          ?        ?      223.7        4.6       ?       ? 
1 1 1   24   23    0 o   1178.9    7.9 13903.1689 185.8098 13903.1689 185.8098 13903.1689 185.8098     1178.9      7.9     1178.9        7.9     0.0     0.0 
1 1 1   24   23    1 o    725.1    4.0    0.0000   0.0000          ?        ?  5258.8638  58.1055          ?        ?      725.1        4.0       ?       ? 
1 1 1   24   23    2 o    209.7    4.1    0.0000   0.0000          ?        ?   439.9414  17.2401          ?        ?      209.7        4.1       ?       ? 
1 1 1   24   23    3 o    246.0    4.0    0.0000   0.0000          ?        ?   605.3185  19.7942          ?        ?      246.0        4.0       ?       ? 
1 1 1   24   23    4 o    590.8    3.5    0.0000   0.0000          ?        ?  3490.7979  41.5039          ?        ?      590.8        3.5       ?       ? 
1 1 1   24   23    5 o    950.1    4.2    0.0000   0.0000          ?        ?  9029.3340  79.1767          ?        ?      950.1        4.2       ?       ? 
1 1 1   24   23    6 o    348.8    2.8    0.0000   0.0000          ?        ?  1216.3837  19.7942          ?        ?      348.8        2.8       ?       ? 
1 1 1   24   23    7 o    644.9    3.0    0.0000   0.0000          ?        ?  4159.9683  38.9498          ?        ?      644.9        3.0       ?       ? 
1 1 1   24   23    8 o    944.3    3.7    0.0000   0.0000          ?        ?  8918.8701  70.2374          ?        ?      944.3        3.7       ?       ? 
1 1 1   24   23    9 o    435.0    2.2    0.0000   0.0000          ?        ?  1891.9395  19.1556          ?        ?      435.0        2.2       ?       ? 
1 1 1   24   23   10 o     23.0    9.2    0.0000   0.0000          ?        ?     2.5541   6.3852          ?        ?       23.0        9.2       ?       ? 
1 1 1   24   23   11 o    590.3    2.5    0.0000   0.0000          ?        ?  3485.0510  29.3720          ?        ?      590.3        2.5       ?       ? 
1 1 1   24   23   12 o    499.6    2.3    0.0000   0.0000          ?        ?  2496.6196  22.9868          ?        ?      499.6        2.3       ?       ? 
1 1 1   24   23   13 o    223.4    3.0    0.0000   0.0000          ?        ?   499.3239  13.4090          ?        ?      223.4        3.0       ?       ? 
1 1 1   24   23   14 o    199.1    2.9    0.0000   0.0000          ?        ?   396.5219  11.4934          ?        ?      199.1        2.9       ?       ? 
1 1 1   24   23   15 o    242.1    2.6    0.0000   0.0000          ?        ?   586.1629  12.7704          ?        ?      242.1        2.6       ?       ? 
1 1 1   24   23   16 o    535.3    2.5    0.0000   0.0000          ?        ?  2865.6851  26.8179          ?        ?      535.3        2.5       ?       ? 
1 1 1   24   23   17 o    424.8    2.3    0.0000   0.0000          ?        ?  1804.4622  19.1556          ?        ?      424.8        2.3       ?       ? 
1 1 1   24   23   18 o    102.0    5.0    0.0000   0.0000          ?        ?   104.0790  10.2163          ?        ?      102.0        5.0       ?       ? 
1 1 1   24   23   19 f    513.0    2.4    0.0000   0.0000          ?        ?  2631.9863  24.9023          ?        ?      513.0        2.4       ?       ? 
1 1 1   24   23   20 o    461.7    2.4    0.0000   0.0000          ?        ?  2132.0237  21.7097          ?        ?      461.7        2.4       ?       ? 
1 1 1   24   23   21 o    513.8    2.5    0.0000   0.0000          ?        ?  2640.2869  25.5409          ?        ?      513.8        2.5       ?       ? 
1 1 1   24   23   22 o    445.9    2.4    0.0000   0.0000          ?        ?  1988.3563  21.0712          ?        ?      445.9        2.4       ?       ? 
1 1 1   24   23   23 o    469.5    2.4    0.0000   0.0000          ?        ?  2204.8152  22.3483          ?        ?      469.5        2.4       ?       ? 
1 1 1   24   23   24 o    358.7    2.4    0.0000   0.0000          ?        ?  1286.6211  17.2401          ?        ?      358.7        2.4       ?       ? 
1 1 1   24   23   25 o    424.0    2.4    0.0000   0.0000          ?        ?  1798.0769  20.4327          ?        ?      424.0        2.4       ?       ? 
1 1 1   24   23   26 o    608.0    2.6    0.0000   0.0000          ?        ?  3697.0403  31.9261          ?        ?      608.0        2.6       ?       ? 
1 1 1   24   23   27 o    195.9    3.6    0.0000   0.0000          ?        ?   383.7515  14.0475          ?        ?      195.9        3.6       ?       ? 
1 1 1   24   23   28 o    226.0    3.2    0.0000   0.0000          ?        ?   510.8173  14.6860          ?        ?      226.0        3.2       ?       ? 
1 1 1   24   23   29 o    376.5    2.5    0.0000   0.0000          ?        ?  1417.5181  18.5171          ?        ?      376.5        2.5       ?       ? 
1 1 1   24   23   30 o    237.8    3.2    0.0000   0.0000          ?        ?   565.7302  15.3245          ?        ?      237.8        3.2       ?       ? 
1 1 1   24   23   31 o    422.9    2.5    0.0000   0.0000          ?        ?  1788.4991  21.0712          ?        ?      422.9        2.5       ?       ? 
1 1 1   24   23   32 o    350.5    2.9    0.0000   0.0000          ?        ?  1228.5156  20.4327          ?        ?      350.5        2.9       ?       ? 
1 1 1   24   23   33 o    125.5    5.9    0.0000   0.0000          ?        ?   157.7148  14.6860          ?        ?      125.5        5.9       ?       ? 
1 1 1   24   23   34 o    576.9    2.7    0.0000   0.0000          ?        ?  3328.6133  30.6490          ?        ?      576.9        2.7       ?       ? 
1 1 1   24   23   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   23   36 o    343.5    2.5    0.0000   0.0000          ?        ?  1179.9880  17.2401          ?        ?      343.5        2.5       ?       ? 
1 1 1   24   23   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   23   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   23   39 o    177.5    4.3    0.0000   0.0000          ?        ?   315.4297  15.3245          ?        ?      177.5        4.3       ?       ? 
1 1 1   24   23   40 o    190.0    4.2    0.0000   0.0000          ?        ?   361.4032  15.9630          ?        ?      190.0        4.2       ?       ? 
1 1 1   24   23   41 o    497.0    2.6    0.0000   0.0000          ?        ?  2470.4402  25.5409          ?        ?      497.0        2.6       ?       ? 
1 1 1   24   23   42 o    132.2    6.0    0.0000   0.0000          ?        ?   174.9549  15.9630          ?        ?      132.2        6.0       ?       ? 
1 1 1   24   23   43 o    444.0    2.6    0.0000   0.0000          ?        ?  1972.3933  22.9868          ?        ?      444.0        2.6       ?       ? 
1 1 1   24   23   44 o     24.2   11.7    0.0000   0.0000          ?        ?   -24.9023  16.6016          ?        ?       24.2       11.7       ?       ? 
1 1 1   24   23   45 o    231.8    3.9    0.0000   0.0000          ?        ?   537.6352  17.8786          ?        ?      231.8        3.9       ?       ? 
1 1 1   24   23   46 o    286.9    3.3    0.0000   0.0000          ?        ?   823.6929  19.1556          ?        ?      286.9        3.3       ?       ? 
1 1 1   24   23   47 o     29.3   13.3    0.0000   0.0000          ?        ?   -10.8549  17.2401          ?        ?       29.3       13.3       ?       ? 
1 1 1   24   23   48 o     30.8   13.7    0.0000   0.0000          ?        ?    -7.0237  17.2401          ?        ?       30.8       13.7       ?       ? 
1 1 1   24   23   49 o     33.3   14.5    0.0000   0.0000          ?        ?    -2.5541  17.8786          ?        ?       33.3       14.5       ?       ? 
1 1 1   24   23   50 o    119.1    7.8    0.0000   0.0000          ?        ?   142.3903  18.5171          ?        ?      119.1        7.8       ?       ? 
1 1 1   24   23   51 o     31.1   14.0    0.0000   0.0000          ?        ?    -9.5778  18.5171          ?        ?       31.1       14.0       ?       ? 
1 1 1   24   23   52 o    164.7    5.6    0.0000   0.0000          ?        ?   272.0102  18.5171          ?        ?      164.7        5.6       ?       ? 
1 1 1   24   23   53 o    176.7    5.2    0.0000   0.0000          ?        ?   312.8756  18.5171          ?        ?      176.7        5.2       ?       ? 
1 1 1   24   23   54 o    106.9    8.7    0.0000   0.0000          ?        ?   114.9339  18.5171          ?        ?      106.9        8.7       ?       ? 
1 1 1   24   23   55 o    235.8    4.3    0.0000   0.0000          ?        ?   556.7908  20.4327          ?        ?      235.8        4.3       ?       ? 
1 1 1   24   23   56 o    111.2    8.6    0.0000   0.0000          ?        ?   124.5117  19.1556          ?        ?      111.2        8.6       ?       ? 
1 1 1   24   23   57 o    127.0    7.5    0.0000   0.0000          ?        ?   162.1845  19.1556          ?        ?      127.0        7.5       ?       ? 
1 1 1   24   23   58 o    114.5    8.9    0.0000   0.0000          ?        ?   132.1740  20.4327          ?        ?      114.5        8.9       ?       ? 
1 1 1   24   23   59 o    110.2    8.7    0.0000   0.0000          ?        ?   122.5962  19.1556          ?        ?      110.2        8.7       ?       ? 
1 1 1   24   23   60 o    122.0    8.1    0.0000   0.0000          ?        ?   150.0526  19.7942          ?        ?      122.0        8.1       ?       ? 
1 1 1   24   23   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   23   62 o    105.9    9.7    0.0000   0.0000          ?        ?   113.6568  20.4327          ?        ?      105.9        9.7       ?       ? 
1 1 1   24   23   63 f    252.5    4.0    0.0000   0.0000          ?        ?   639.1602  20.4327          ?        ?      252.5        4.0       ?       ? 
1 1 1   24   23   64 o     23.5   11.6    0.0000   0.0000          ?        ?   -42.7809  19.7942          ?        ?       23.5       11.6       ?       ? 
1 1 1   24   23   65 o    171.8    5.6    0.0000   0.0000          ?        ?   296.9126  19.1556          ?        ?      171.8        5.6       ?       ? 
1 1 1   24   24    0 o    638.5    7.6 4078.8760  97.0553  4078.8760  97.0553  4078.8760  97.0553      638.5      7.6      638.5        7.6     0.0     0.0 
1 1 1   24   24    1 o    377.4    4.4 1425.1803  33.2031  1425.1803  33.2031  1425.1803  33.2031      377.4      4.4      377.4        4.4     0.0     0.0 
1 1 1   24   24    2 f    262.9    6.6  692.7960  34.4802   692.7960  34.4802   692.7960  34.4802      262.9      6.6      262.9        6.6     0.0     0.0 
1 1 1   24   24    3 o   1179.9    7.3 13927.4336 171.1238 13927.4336 171.1238 13927.4336 171.1238     1179.9      7.3     1179.9        7.3     0.0     0.0 
1 1 1   24   24    4 o    389.7    5.2 1519.6815  40.2269  1519.6815  40.2269  1519.6815  40.2269      389.7      5.2      389.7        5.2     0.0     0.0 
1 1 1   24   24    5 f    613.5    4.7 3765.3621  58.1055  3765.3621  58.1055  3765.3621  58.1055      613.5      4.7      613.5        4.7     0.0     0.0 
1 1 1   24   24    6 o    138.3    9.8  194.1106  26.8179   194.1106  26.8179   194.1106  26.8179      138.3      9.8      138.3        9.8     0.0     0.0 
1 1 1   24   24    7 o    793.3    4.6 6294.5459  73.4300  6294.5459  73.4300  6294.5459  73.4300      793.3      4.6      793.3        4.6     0.0     0.0 
1 1 1   24   24    8 o    188.1    4.4  354.3795  16.6016   354.3795  16.6016   354.3795  16.6016      188.1      4.4      188.1        4.4     0.0     0.0 
1 1 1   24   24    9 o    162.4    4.7  264.3480  15.3245   264.3480  15.3245   264.3480  15.3245      162.4      4.7      162.4        4.7     0.0     0.0 
1 1 1   24   24   10 o    364.8    2.8 1331.3176  20.4327  1331.3176  20.4327  1331.3176  20.4327      364.8      2.8      364.8        2.8     0.0     0.0 
1 1 1   24   24   11 o    501.8    3.3 2518.3293  33.2031  2518.3293  33.2031  2518.3293  33.2031      501.8      3.3      501.8        3.3     0.0     0.0 
1 1 1   24   24   12 o    354.7    3.1 1258.5261  21.7097  1258.5261  21.7097  1258.5261  21.7097      354.7      3.1      354.7        3.1     0.0     0.0 
1 1 1   24   24   13 o    967.9    5.3 9370.9434 102.8020  9370.9434 102.8020  9370.9434 102.8020      967.9      5.3      967.9        5.3     0.0     0.0 
1 1 1   24   24   14 o    351.2    3.5 1233.6238  24.2638  1233.6238  24.2638  1233.6238  24.2638      351.2      3.5      351.2        3.5     0.0     0.0 
1 1 1   24   24   15 o   1394.6    6.9 19456.3926 192.1950 19456.3926 192.1950 19456.3926 192.1950     1394.6      6.9     1394.6        6.9     0.0     0.0 
1 1 1   24   24   16 o    461.7    3.5 2132.6624  31.9261  2132.6624  31.9261  2132.6624  31.9261      461.7      3.5      461.7        3.5     0.0     0.0 
1 1 1   24   24   17 o    105.3    7.0  112.3798  14.6860   112.3798  14.6860   112.3798  14.6860      105.3      7.0      105.3        7.0     0.0     0.0 
1 1 1   24   24   18 f    485.6    3.5 2358.6987  33.8416  2358.6987  33.8416  2358.6987  33.8416      485.6      3.5      485.6        3.5     0.0     0.0 
1 1 1   24   24   19 o    175.0    5.1  307.1289  17.8786   307.1289  17.8786   307.1289  17.8786      175.0      5.1      175.0        5.1     0.0     0.0 
1 1 1   24   24   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   24   21 o    594.1    3.7 3530.3862  43.4195  3530.3862  43.4195  3530.3862  43.4195      594.1      3.7      594.1        3.7     0.0     0.0 
1 1 1   24   24   22 o    348.6    3.3 1215.7451  22.9868  1215.7451  22.9868  1215.7451  22.9868      348.6      3.3      348.6        3.3     0.0     0.0 
1 1 1   24   24   23 o    677.2    3.9 4587.7778  52.3588  4587.7778  52.3588  4587.7778  52.3588      677.2      3.9      677.2        3.9     0.0     0.0 
1 1 1   24   24   24 o    805.4    4.3 6488.0181  69.5989  6488.0181  69.5989  6488.0181  69.5989      805.4      4.3      805.4        4.3     0.0     0.0 
1 1 1   24   24   25 o    559.4    3.6 3130.0332  40.2269  3130.0332  40.2269  3130.0332  40.2269      559.4      3.6      559.4        3.6     0.0     0.0 
1 1 1   24   24   26 o    454.8    3.7 2069.4487  33.2031  2069.4487  33.2031  2069.4487  33.2031      454.8      3.7      454.8        3.7     0.0     0.0 
1 1 1   24   24   27 o   1060.6    5.4 11254.5820 113.6568 11254.5820 113.6568 11254.5820 113.6568     1060.6      5.4     1060.6        5.4     0.0     0.0 
1 1 1   24   24   28 o    345.7    3.5 1195.9510  24.2638  1195.9510  24.2638  1195.9510  24.2638      345.7      3.5      345.7        3.5     0.0     0.0 
1 1 1   24   24   29 o     14.9   11.0  -39.5883  18.5171   -39.5883  18.5171   -39.5883  18.5171       14.9     11.0       14.9       11.0     0.0     0.0 
1 1 1   24   24   30 o    430.6    3.3 1854.9053  28.7335  1854.9053  28.7335  1854.9053  28.7335      430.6      3.3      430.6        3.3     0.0     0.0 
1 1 1   24   24   31 o     98.4   10.6  100.2479  20.4327   100.2479  20.4327   100.2479  20.4327       98.4     10.6       98.4       10.6     0.0     0.0 
1 1 1   24   24   32 o    118.2   10.1  143.0288  23.6253   143.0288  23.6253   143.0288  23.6253      118.2     10.1      118.2       10.1     0.0     0.0 
1 1 1   24   24   33 o   1237.2    6.1 15317.4951 150.6911 15317.4951 150.6911 15317.4951 150.6911     1237.2      6.1     1237.2        6.1     0.0     0.0 
1 1 1   24   24   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   24   35 o    443.3    3.6 1966.0081  31.9261  1966.0081  31.9261  1966.0081  31.9261      443.3      3.6      443.3        3.6     0.0     0.0 
1 1 1   24   24   36 o    467.0    3.6 2181.8284  33.8416  2181.8284  33.8416  2181.8284  33.8416      467.0      3.6      467.0        3.6     0.0     0.0 
1 1 1   24   24   37 o    148.6    7.6  222.8441  22.3483   222.8441  22.3483   222.8441  22.3483      148.6      7.6      148.6        7.6     0.0     0.0 
1 1 1   24   24   38 o    191.8    5.3  369.0655  20.4327   369.0655  20.4327   369.0655  20.4327      191.8      5.3      191.8        5.3     0.0     0.0 
1 1 1   24   24   39 o    739.6    4.3 5473.4072  63.2136  5473.4072  63.2136  5473.4072  63.2136      739.6      4.3      739.6        4.3     0.0     0.0 
1 1 1   24   24   40 o    693.3    4.1 4808.7061  56.8284  4808.7061  56.8284  4808.7061  56.8284      693.3      4.1      693.3        4.1     0.0     0.0 
1 1 1   24   24   41 o     43.4   21.5   28.0950  22.3483    28.0950  22.3483    28.0950  22.3483       43.4     21.5       43.4       21.5     0.0     0.0 
1 1 1   24   24   42 o    204.1    5.5  417.5931  22.3483   417.5931  22.3483   417.5931  22.3483      204.1      5.5      204.1        5.5     0.0     0.0 
1 1 1   24   24   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   24   44 o    524.8    3.7 2755.2207  38.3113  2755.2207  38.3113  2755.2207  38.3113      524.8      3.7      524.8        3.7     0.0     0.0 
1 1 1   24   24   45 o    167.1    6.5  280.9495  21.7097   280.9495  21.7097   280.9495  21.7097      167.1      6.5      167.1        6.5     0.0     0.0 
1 1 1   24   24   46 o     76.9   16.6   67.0448  22.3483    67.0448  22.3483    67.0448  22.3483       76.9     16.6       76.9       16.6     0.0     0.0 
1 1 1   24   24   47 o    368.8    4.1 1361.3281  30.0105  1361.3281  30.0105  1361.3281  30.0105      368.8      4.1      368.8        4.1     0.0     0.0 
1 1 1   24   24   48 o    132.9    9.0  179.4246  23.6253   179.4246  23.6253   179.4246  23.6253      132.9      9.0      132.9        9.0     0.0     0.0 
1 1 1   24   24   49 o    209.9    6.2  442.4955  26.1794   442.4955  26.1794   442.4955  26.1794      209.9      6.2      209.9        6.2     0.0     0.0 
1 1 1   24   24   50 o    231.8    5.8  538.9123  26.8179   538.9123  26.8179   538.9123  26.8179      231.8      5.8      231.8        5.8     0.0     0.0 
1 1 1   24   24   51 o     18.8   13.6  -42.1424  24.9023   -42.1424  24.9023   -42.1424  24.9023       18.8     13.6       18.8       13.6     0.0     0.0 
1 1 1   24   24   52 o     19.1   13.9  -42.1424  25.5409   -42.1424  25.5409   -42.1424  25.5409       19.1     13.9       19.1       13.9     0.0     0.0 
1 1 1   24   24   53 o     71.0   20.3   61.9366  24.9023    61.9366  24.9023    61.9366  24.9023       71.0     20.3       71.0       20.3     0.0     0.0 
1 1 1   24   24   54 o    323.3    4.8 1047.1754  31.2876  1047.1754  31.2876  1047.1754  31.2876      323.3      4.8      323.3        4.8     0.0     0.0 
1 1 1   24   24   55 o     24.6   17.1  -18.5171  27.4564   -18.5171  27.4564   -18.5171  27.4564       24.6     17.1       24.6       17.1     0.0     0.0 
1 1 1   24   24   56 o    103.3   13.2  109.1872  27.4564   109.1872  27.4564   109.1872  27.4564      103.3     13.2      103.3       13.2     0.0     0.0 
1 1 1   24   24   57 o    146.5    9.5  218.3744  27.4564   218.3744  27.4564   218.3744  27.4564      146.5      9.5      146.5        9.5     0.0     0.0 
1 1 1   24   24   58 o     18.2   13.3  -58.1055  27.4564   -58.1055  27.4564   -58.1055  27.4564       18.2     13.3       18.2       13.3     0.0     0.0 
1 1 1   24   24   59 o     28.3   19.0   -8.3008  29.3720    -8.3008  29.3720    -8.3008  29.3720       28.3     19.0       28.3       19.0     0.0     0.0 
1 1 1   24   24   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   24   24   61 o    416.1    4.3 1734.2247  35.7572  1734.2247  35.7572  1734.2247  35.7572      416.1      4.3      416.1        4.3     0.0     0.0 
1 1 1   24   24   62 o     23.0   16.3  -29.3720  28.7335   -29.3720  28.7335   -29.3720  28.7335       23.0     16.3       23.0       16.3     0.0     0.0 
1 1 1   24   24   63 o     20.1   14.7  -56.1899  30.6490   -56.1899  30.6490   -56.1899  30.6490       20.1     14.7       20.1       14.7     0.0     0.0 
1 1 1   24   24   64 o     54.5   24.1   44.6965  27.4564    44.6965  27.4564    44.6965  27.4564       54.5     24.1       54.5       24.1     0.0     0.0 
1 1 1   25    0    0 o     91.2    6.0   84.2849  10.8549    84.2849  10.8549    84.2849  10.8549       91.2      6.0       91.2        6.0     0.0     0.0 
1 1 1   25    0    1 o    334.9    2.6 1121.8824  17.2401  1121.8824  17.2401  1121.8824  17.2401      334.9      2.6      334.9        2.6     0.0     0.0 
1 1 1   25    0    2 o   1152.9    5.6 13293.3809 130.2584 13293.3809 130.2584 13293.3809 130.2584     1152.9      5.6     1152.9        5.6     0.0     0.0 
1 1 1   25    0    3 o    215.6    2.5  464.8438  10.8549   464.8438  10.8549   464.8438  10.8549      215.6      2.5      215.6        2.5     0.0     0.0 
1 1 1   25    0    4 o     87.6    4.4   77.2611   7.6623    77.2611   7.6623    77.2611   7.6623       87.6      4.4       87.6        4.4     0.0     0.0 
1 1 1   25    0    5 o    572.2    3.3 3274.9775  37.6728  3274.9775  37.6728  3274.9775  37.6728      572.2      3.3      572.2        3.3     0.0     0.0 
1 1 1   25    0    6 o    257.5    2.5  663.4240  12.7704   663.4240  12.7704   663.4240  12.7704      257.5      2.5      257.5        2.5     0.0     0.0 
1 1 1   25    0    7 o    182.7    3.1  333.9468  11.4934   333.9468  11.4934   333.9468  11.4934      182.7      3.1      182.7        3.1     0.0     0.0 
1 1 1   25    0    8 f    398.3    2.9 1586.7262  22.9868  1586.7262  22.9868  1586.7262  22.9868      398.3      2.9      398.3        2.9     0.0     0.0 
1 1 1   25    0    9 o    435.1    3.0 1893.2167  26.1794  1893.2167  26.1794  1893.2167  26.1794      435.1      3.0      435.1        3.0     0.0     0.0 
1 1 1   25    0   10 o    931.0    5.2 8668.5693  96.4168  8668.5693  96.4168  8668.5693  96.4168      931.0      5.2      931.0        5.2     0.0     0.0 
1 1 1   25    0   11 o    927.6    4.7 8604.7168  87.4775  8604.7168  87.4775  8604.7168  87.4775      927.6      4.7      927.6        4.7     0.0     0.0 
1 1 1   25    0   12 o   1680.2    7.8 28236.0664 262.4324 28236.0664 262.4324 28236.0664 262.4324     1680.2      7.8     1680.2        7.8     0.0     0.0 
1 1 1   25    0   13 o   1538.7    7.2 23679.5742 222.8441 23679.5742 222.8441 23679.5742 222.8441     1538.7      7.2     1538.7        7.2     0.0     0.0 
1 1 1   25    0   14 o   1433.5    6.8 20552.7344 195.3876 20552.7344 195.3876 20552.7344 195.3876     1433.5      6.8     1433.5        6.8     0.0     0.0 
1 1 1   25    0   15 o   1195.1    6.1 14284.3682 146.2215 14284.3682 146.2215 14284.3682 146.2215     1195.1      6.1     1195.1        6.1     0.0     0.0 
1 1 1   25    0   16 o    534.6    3.5 2858.0229  37.0343  2858.0229  37.0343  2858.0229  37.0343      534.6      3.5      534.6        3.5     0.0     0.0 
1 1 1   25    0   17 o   1751.1    8.2 30668.1934 286.6962 30668.1934 286.6962 30668.1934 286.6962     1751.1      8.2     1751.1        8.2     0.0     0.0 
1 1 1   25    0   18 o   1746.2    7.8 30495.1543 273.2873 30495.1543 273.2873 30495.1543 273.2873     1746.2      7.8     1746.2        7.8     0.0     0.0 
1 1 1   25    0   19 o   1812.0    8.4 32837.2539 304.5748 32837.2539 304.5748 32837.2539 304.5748     1812.0      8.4     1812.0        8.4     0.0     0.0 
1 1 1   25    0   20 o   1890.0    8.7 35726.5625 328.8386 35726.5625 328.8386 35726.5625 328.8386     1890.0      8.7     1890.0        8.7     0.0     0.0 
1 1 1   25    0   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    0   22 o    318.0    3.2 1011.4182  20.4327  1011.4182  20.4327  1011.4182  20.4327      318.0      3.2      318.0        3.2     0.0     0.0 
1 1 1   25    0   23 o    683.7    3.8 4675.2554  51.7203  4675.2554  51.7203  4675.2554  51.7203      683.7      3.8      683.7        3.8     0.0     0.0 
1 1 1   25    0   24 o    920.6    5.1 8475.7363  93.2242  8475.7363  93.2242  8475.7363  93.2242      920.6      5.1      920.6        5.1     0.0     0.0 
1 1 1   25    0   25 o    343.8    3.3 1182.5420  22.3483  1182.5420  22.3483  1182.5420  22.3483      343.8      3.3      343.8        3.3     0.0     0.0 
1 1 1   25    0   26 o   2236.2   10.3 50021.7852 459.0970 50021.7852 459.0970 50021.7852 459.0970     2236.2     10.3     2236.2       10.3     0.0     0.0 
1 1 1   25    0   27 o    609.2    3.9 3712.3650  47.2506  3712.3650  47.2506  3712.3650  47.2506      609.2      3.9      609.2        3.9     0.0     0.0 
1 1 1   25    0   28 o    784.5    5.3 6155.3486  83.0078  6155.3486  83.0078  6155.3486  83.0078      784.5      5.3      784.5        5.3     0.0     0.0 
1 1 1   25    0   29 o   1883.6    8.7 35489.0312 328.2001 35489.0312 328.2001 35489.0312 328.2001     1883.6      8.7     1883.6        8.7     0.0     0.0 
1 1 1   25    0   30 o    355.4    3.7 1263.6343  26.1794  1263.6343  26.1794  1263.6343  26.1794      355.4      3.7      355.4        3.7     0.0     0.0 
1 1 1   25    0   31 o   1275.9    7.3 16282.3018 187.0868 16282.3018 187.0868 16282.3018 187.0868     1275.9      7.3     1275.9        7.3     0.0     0.0 
1 1 1   25    0   32 o    823.8    4.6 6786.8467  75.9841  6786.8467  75.9841  6786.8467  75.9841      823.8      4.6      823.8        4.6     0.0     0.0 
1 1 1   25    0   33 o    656.9    4.4 4315.7681  57.4669  4315.7681  57.4669  4315.7681  57.4669      656.9      4.4      656.9        4.4     0.0     0.0 
1 1 1   25    0   34 o     15.8   11.7  -56.8284  22.9868   -56.8284  22.9868   -56.8284  22.9868       15.8     11.7       15.8       11.7     0.0     0.0 
1 1 1   25    0   35 o     20.3   14.7  -47.8891  28.7335   -47.8891  28.7335   -47.8891  28.7335       20.3     14.7       20.3       14.7     0.0     0.0 
1 1 1   25    0   36 o    952.8    5.0 9080.4160  95.1397  9080.4160  95.1397  9080.4160  95.1397      952.8      5.0      952.8        5.0     0.0     0.0 
1 1 1   25    0   37 o    101.8   11.9  107.9102  23.6253   107.9102  23.6253   107.9102  23.6253      101.8     11.9      101.8       11.9     0.0     0.0 
1 1 1   25    0   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    0   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    0   40 o    350.2    4.2 1227.2385  29.3720  1227.2385  29.3720  1227.2385  29.3720      350.2      4.2      350.2        4.2     0.0     0.0 
1 1 1   25    0   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    0   42 o    493.9    3.7 2440.4297  37.0343  2440.4297  37.0343  2440.4297  37.0343      493.9      3.7      493.9        3.7     0.0     0.0 
1 1 1   25    0   43 o     17.7   13.0  -53.6358  25.5409   -53.6358  25.5409   -53.6358  25.5409       17.7     13.0       17.7       13.0     0.0     0.0 
1 1 1   25    0   44 o    447.8    4.2 2006.2350  37.6728  2006.2350  37.6728  2006.2350  37.6728      447.8      4.2      447.8        4.2     0.0     0.0 
1 1 1   25    0   45 o    967.9    5.2 9370.3047 100.8864  9370.3047 100.8864  9370.3047 100.8864      967.9      5.2      967.9        5.2     0.0     0.0 
1 1 1   25    0   46 o    310.3    5.1  964.1677  31.9261   964.1677  31.9261   964.1677  31.9261      310.3      5.1      310.3        5.1     0.0     0.0 
1 1 1   25    0   47 o     20.9   15.1  -40.8654  28.0950   -40.8654  28.0950   -40.8654  28.0950       20.9     15.1       20.9       15.1     0.0     0.0 
1 1 1   25    0   48 o    300.5    4.7  904.1467  28.0950   904.1467  28.0950   904.1467  28.0950      300.5      4.7      300.5        4.7     0.0     0.0 
1 1 1   25    0   49 o    181.8    6.9  332.0312  24.9023   332.0312  24.9023   332.0312  24.9023      181.8      6.9      181.8        6.9     0.0     0.0 
1 1 1   25    0   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    0   51 o    137.5    8.7  191.5565  23.6253   191.5565  23.6253   191.5565  23.6253      137.5      8.7      137.5        8.7     0.0     0.0 
1 1 1   25    0   52 o     63.1   22.7   52.9973  26.1794    52.9973  26.1794    52.9973  26.1794       63.1     22.7       63.1       22.7     0.0     0.0 
1 1 1   25    0   53 o    565.3    3.9 3196.4392  44.0580  3196.4392  44.0580  3196.4392  44.0580      565.3      3.9      565.3        3.9     0.0     0.0 
1 1 1   25    0   54 o    257.1    5.6  662.1469  28.7335   662.1469  28.7335   662.1469  28.7335      257.1      5.6      257.1        5.6     0.0     0.0 
1 1 1   25    0   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    0   56 o   1210.5    5.9 14664.2881 141.7518 14664.2881 141.7518 14664.2881 141.7518     1210.5      5.9     1210.5        5.9     0.0     0.0 
1 1 1   25    0   57 o    159.2    8.7  256.0471  27.4564   256.0471  27.4564   256.0471  27.4564      159.2      8.7      159.2        8.7     0.0     0.0 
1 1 1   25    0   58 o    764.4    4.7 5846.3037  71.5144  5846.3037  71.5144  5846.3037  71.5144      764.4      4.7      764.4        4.7     0.0     0.0 
1 1 1   25    0   59 o    238.8    6.2  572.1154  29.3720   572.1154  29.3720   572.1154  29.3720      238.8      6.2      238.8        6.2     0.0     0.0 
1 1 1   25    0   60 o    508.1    3.8 2582.8201  38.3113  2582.8201  38.3113  2582.8201  38.3113      508.1      3.8      508.1        3.8     0.0     0.0 
1 1 1   25    0   61 o     17.3   12.9  -89.3930  31.2876   -89.3930  31.2876   -89.3930  31.2876       17.3     12.9       17.3       12.9     0.0     0.0 
1 1 1   25    0   62 o     16.3   12.1  -74.0685  26.8179   -74.0685  26.8179   -74.0685  26.8179       16.3     12.1       16.3       12.1     0.0     0.0 
1 1 1   25    0   63 o    230.9    6.2  535.0811  28.7335   535.0811  28.7335   535.0811  28.7335      230.9      6.2      230.9        6.2     0.0     0.0 
1 1 1   25    0   64 o     42.1   23.1   25.5409  27.4564    25.5409  27.4564    25.5409  27.4564       42.1     23.1       42.1       23.1     0.0     0.0 
1 1 1   25    0   65 o    248.0    5.8  616.8119  28.7335   616.8119  28.7335   616.8119  28.7335      248.0      5.8      248.0        5.8     0.0     0.0 
1 1 1   25    0   66 o    211.5    6.8  449.5192  28.7335   449.5192  28.7335   449.5192  28.7335      211.5      6.8      211.5        6.8     0.0     0.0 
1 1 1   25    0   67 o     15.5   11.6 -111.1028  30.6490  -111.1028  30.6490  -111.1028  30.6490       15.5     11.6       15.5       11.6     0.0     0.0 
1 1 1   25    0   68 o    406.7    4.7 1656.3251  38.3113  1656.3251  38.3113  1656.3251  38.3113      406.7      4.7      406.7        4.7     0.0     0.0 
1 1 1   25    0   69 o     16.6   12.5 -126.4273  35.1187  -126.4273  35.1187  -126.4273  35.1187       16.6     12.5       16.6       12.5     0.0     0.0 
1 1 1   25    0   70 o    156.7   11.1  250.9390  34.4802   250.9390  34.4802   250.9390  34.4802      156.7     11.1      156.7       11.1     0.0     0.0 
1 1 1   25    0   71 o     17.7   13.1  -72.7915  29.3720   -72.7915  29.3720   -72.7915  29.3720       17.7     13.1       17.7       13.1     0.0     0.0 
1 1 1   25    0   72 o    114.1   13.8  137.2822  30.6490   137.2822  30.6490   137.2822  30.6490      114.1     13.8      114.1       13.8     0.0     0.0 
1 1 1   25    0   73 o     22.6   16.2  -38.3113  30.6490   -38.3113  30.6490   -38.3113  30.6490       22.6     16.2       22.6       16.2     0.0     0.0 
1 1 1   25    0   74 o    132.6   12.0  181.9787  31.2876   181.9787  31.2876   181.9787  31.2876      132.6     12.0      132.6       12.0     0.0     0.0 
1 1 1   25    0   75 o     19.1   14.1  -61.2981  30.0105   -61.2981  30.0105   -61.2981  30.0105       19.1     14.1       19.1       14.1     0.0     0.0 
1 1 1   25    0   76 o     27.6   18.8  -11.4934  30.0105   -11.4934  30.0105   -11.4934  30.0105       27.6     18.8       27.6       18.8     0.0     0.0 
1 1 1   25    1    0 o     89.4    4.3   80.4537   7.6623    80.4537   7.6623    80.4537   7.6623       89.4      4.3       89.4        4.3     0.0     0.0 
1 1 1   25    1    1 o    805.9    3.0    0.0000   0.0000          ?        ?  6495.0420  47.8891          ?        ?      805.9        3.0       ?       ? 
1 1 1   25    1    2 o   1094.6    3.8    0.0000   0.0000          ?        ? 11982.4971  84.2849          ?        ?     1094.6        3.8       ?       ? 
1 1 1   25    1    3 o   1475.1    5.0    0.0000   0.0000          ?        ? 21760.8164 146.2215          ?        ?     1475.1        5.0       ?       ? 
1 1 1   25    1    4 o    873.9    3.2    0.0000   0.0000          ?        ?  7636.7188  55.5514          ?        ?      873.9        3.2       ?       ? 
1 1 1   25    1    5 o    357.4    2.0    0.0000   0.0000          ?        ?  1277.6818  14.0475          ?        ?      357.4        2.0       ?       ? 
1 1 1   25    1    6 o    749.8    3.1    0.0000   0.0000          ?        ?  5622.8213  45.9736          ?        ?      749.8        3.1       ?       ? 
1 1 1   25    1    7 o    198.2    2.1    0.0000   0.0000          ?        ?   392.6908   8.3008          ?        ?      198.2        2.1       ?       ? 
1 1 1   25    1    8 o    942.4    3.5    0.0000   0.0000          ?        ?  8881.1973  66.4062          ?        ?      942.4        3.5       ?       ? 
1 1 1   25    1    9 o   1539.4    5.2    0.0000   0.0000          ?        ? 23699.3691 158.9919          ?        ?     1539.4        5.2       ?       ? 
1 1 1   25    1   10 o   1054.2    3.7    0.0000   0.0000          ?        ? 11112.8301  77.2611          ?        ?     1054.2        3.7       ?       ? 
1 1 1   25    1   11 o   1635.7    5.4    0.0000   0.0000          ?        ? 26756.6094 176.2320          ?        ?     1635.7        5.4       ?       ? 
1 1 1   25    1   12 o   1111.6    3.8    0.0000   0.0000          ?        ? 12356.0322  85.5619          ?        ?     1111.6        3.8       ?       ? 
1 1 1   25    1   13 o   2136.6    6.9    0.0000   0.0000          ?        ? 45656.2109 296.2740          ?        ?     2136.6        6.9       ?       ? 
1 1 1   25    1   14 o    827.0    3.3    0.0000   0.0000          ?        ?  6839.8433  54.9129          ?        ?      827.0        3.3       ?       ? 
1 1 1   25    1   15 o   1423.3    4.9    0.0000   0.0000          ?        ? 20258.3750 139.1977          ?        ?     1423.3        4.9       ?       ? 
1 1 1   25    1   16 o   2043.0    6.7    0.0000   0.0000          ?        ? 41742.0742 273.2873          ?        ?     2043.0        6.7       ?       ? 
1 1 1   25    1   17 o    724.2    2.7    0.0000   0.0000          ?        ?  5245.4551  39.5883          ?        ?      724.2        2.7       ?       ? 
1 1 1   25    1   18 o   1965.6    6.4    0.0000   0.0000          ?        ? 38642.0508 251.5775          ?        ?     1965.6        6.4       ?       ? 
1 1 1   25    1   19 o    449.1    2.1    0.0000   0.0000          ?        ?  2017.0897  19.1556          ?        ?      449.1        2.1       ?       ? 
1 1 1   25    1   20 o    238.1    2.5    0.0000   0.0000          ?        ?   567.0072  12.1319          ?        ?      238.1        2.5       ?       ? 
1 1 1   25    1   21 o    776.2    2.9    0.0000   0.0000          ?        ?  6025.7285  45.3350          ?        ?      776.2        2.9       ?       ? 
1 1 1   25    1   22 o    359.1    2.1    0.0000   0.0000          ?        ?  1289.8137  15.3245          ?        ?      359.1        2.1       ?       ? 
1 1 1   25    1   23 o    505.4    2.3    0.0000   0.0000          ?        ?  2554.7251  23.6253          ?        ?      505.4        2.3       ?       ? 
1 1 1   25    1   24 o    206.1    3.3    0.0000   0.0000          ?        ?   424.6169  13.4090          ?        ?      206.1        3.3       ?       ? 
1 1 1   25    1   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    1   26 o    961.1    3.5    0.0000   0.0000          ?        ?  9237.4922  67.6833          ?        ?      961.1        3.5       ?       ? 
1 1 1   25    1   27 o    488.7    2.5    0.0000   0.0000          ?        ?  2388.0708  24.9023          ?        ?      488.7        2.5       ?       ? 
1 1 1   25    1   28 o   1036.1    3.8    0.0000   0.0000          ?        ? 10736.7412  77.8996          ?        ?     1036.1        3.8       ?       ? 
1 1 1   25    1   29 f   1625.1    5.4    0.0000   0.0000          ?        ? 26412.4473 175.5934          ?        ?     1625.1        5.4       ?       ? 
1 1 1   25    1   30 o    563.9    2.7    0.0000   0.0000          ?        ?  3180.4763  30.6490          ?        ?      563.9        2.7       ?       ? 
1 1 1   25    1   31 o    785.4    3.7    0.0000   0.0000          ?        ?  6169.3960  57.4669          ?        ?      785.4        3.7       ?       ? 
1 1 1   25    1   32 o    537.1    2.9    0.0000   0.0000          ?        ?  2884.8406  30.6490          ?        ?      537.1        2.9       ?       ? 
1 1 1   25    1   33 o   1288.7    5.0    0.0000   0.0000          ?        ? 16610.5000 128.9814          ?        ?     1288.7        5.0       ?       ? 
1 1 1   25    1   34 o    954.3    3.6    0.0000   0.0000          ?        ?  9107.8730  69.5989          ?        ?      954.3        3.6       ?       ? 
1 1 1   25    1   35 o   1044.8    3.9    0.0000   0.0000          ?        ? 10917.4434  82.3693          ?        ?     1044.8        3.9       ?       ? 
1 1 1   25    1   36 o   1078.0    4.0    0.0000   0.0000          ?        ? 11623.0098  86.8389          ?        ?     1078.0        4.0       ?       ? 
1 1 1   25    1   37 o    695.5    3.0    0.0000   0.0000          ?        ?  4838.0786  42.1424          ?        ?      695.5        3.0       ?       ? 
1 1 1   25    1   38 o   1068.8    4.0    0.0000   0.0000          ?        ? 11425.7061  84.9234          ?        ?     1068.8        4.0       ?       ? 
1 1 1   25    1   39 o    197.5    4.2    0.0000   0.0000          ?        ?   390.1367  16.6016          ?        ?      197.5        4.2       ?       ? 
1 1 1   25    1   40 o    149.0    6.0    0.0000   0.0000          ?        ?   222.2055  17.8786          ?        ?      149.0        6.0       ?       ? 
1 1 1   25    1   41 o    731.6    3.1    0.0000   0.0000          ?        ?  5353.3652  45.3350          ?        ?      731.6        3.1       ?       ? 
1 1 1   25    1   42 o    407.1    2.7    0.0000   0.0000          ?        ?  1657.6022  22.3483          ?        ?      407.1        2.7       ?       ? 
1 1 1   25    1   43 o    497.1    2.7    0.0000   0.0000          ?        ?  2471.0786  26.8179          ?        ?      497.1        2.7       ?       ? 
1 1 1   25    1   44 o    670.2    2.9    0.0000   0.0000          ?        ?  4492.6382  38.3113          ?        ?      670.2        2.9       ?       ? 
1 1 1   25    1   45 o    836.8    3.2    0.0000   0.0000          ?        ?  7003.3057  53.6358          ?        ?      836.8        3.2       ?       ? 
1 1 1   25    1   46 o    556.7    2.8    0.0000   0.0000          ?        ?  3100.0225  31.2876          ?        ?      556.7        2.8       ?       ? 
1 1 1   25    1   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    1   48 o    111.5    7.4    0.0000   0.0000          ?        ?   124.5117  16.6016          ?        ?      111.5        7.4       ?       ? 
1 1 1   25    1   49 o    399.3    2.6    0.0000   0.0000          ?        ?  1595.0271  21.0712          ?        ?      399.3        2.6       ?       ? 
1 1 1   25    1   50 o    406.9    2.7    0.0000   0.0000          ?        ?  1655.6865  21.7097          ?        ?      406.9        2.7       ?       ? 
1 1 1   25    1   51 o    146.2    6.1    0.0000   0.0000          ?        ?   213.9047  17.8786          ?        ?      146.2        6.1       ?       ? 
1 1 1   25    1   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    1   53 o    409.1    2.8    0.0000   0.0000          ?        ?  1674.2037  22.9868          ?        ?      409.1        2.8       ?       ? 
1 1 1   25    1   54 o    283.9    3.4    0.0000   0.0000          ?        ?   806.4528  19.1556          ?        ?      283.9        3.4       ?       ? 
1 1 1   25    1   55 o    307.9    3.2    0.0000   0.0000          ?        ?   948.2046  19.7942          ?        ?      307.9        3.2       ?       ? 
1 1 1   25    1   56 o    608.0    2.8    0.0000   0.0000          ?        ?  3698.3174  34.4802          ?        ?      608.0        2.8       ?       ? 
1 1 1   25    1   57 o    464.2    2.7    0.0000   0.0000          ?        ?  2155.6492  24.9023          ?        ?      464.2        2.7       ?       ? 
1 1 1   25    1   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    1   59 f    347.9    3.3    0.0000   0.0000          ?        ?  1211.2755  22.9868          ?        ?      347.9        3.3       ?       ? 
1 1 1   25    1   60 o    370.8    3.1    0.0000   0.0000          ?        ?  1376.0142  22.9868          ?        ?      370.8        3.1       ?       ? 
1 1 1   25    1   61 o    376.9    3.3    0.0000   0.0000          ?        ?  1421.3491  24.9023          ?        ?      376.9        3.3       ?       ? 
1 1 1   25    1   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    1   63 o    267.2    4.1    0.0000   0.0000          ?        ?   714.5057  21.7097          ?        ?      267.2        4.1       ?       ? 
1 1 1   25    1   64 o     22.2   11.0    0.0000   0.0000          ?        ?   -47.8891  19.1556          ?        ?       22.2       11.0       ?       ? 
1 1 1   25    1   65 o    136.3    7.5    0.0000   0.0000          ?        ?   186.4483  20.4327          ?        ?      136.3        7.5       ?       ? 
1 1 1   25    1   66 o    369.7    3.2    0.0000   0.0000          ?        ?  1367.7133  23.6253          ?        ?      369.7        3.2       ?       ? 
1 1 1   25    1   67 o     27.6   13.2    0.0000   0.0000          ?        ?   -30.0105  21.0712          ?        ?       27.6       13.2       ?       ? 
1 1 1   25    1   68 o    279.8    4.1    0.0000   0.0000          ?        ?   784.1046  22.9868          ?        ?      279.8        4.1       ?       ? 
1 1 1   25    1   69 o     42.0   16.9    0.0000   0.0000          ?        ?     8.9393  21.7097          ?        ?       42.0       16.9       ?       ? 
1 1 1   25    1   70 f    160.6    7.0    0.0000   0.0000          ?        ?   259.2398  22.3483          ?        ?      160.6        7.0       ?       ? 
1 1 1   25    1   71 o     28.4   13.6    0.0000   0.0000          ?        ?   -28.7335  21.7097          ?        ?       28.4       13.6       ?       ? 
1 1 1   25    1   72 o    194.2    5.6    0.0000   0.0000          ?        ?   378.6433  21.7097          ?        ?      194.2        5.6       ?       ? 
1 1 1   25    1   73 o     40.2   16.6    0.0000   0.0000          ?        ?     5.7467  21.7097          ?        ?       40.2       16.6       ?       ? 
1 1 1   25    1   74 o     45.4   16.6    0.0000   0.0000          ?        ?    17.8786  19.7942          ?        ?       45.4       16.6       ?       ? 
1 1 1   25    1   75 f     83.0   12.7    0.0000   0.0000          ?        ?    70.8759  21.0712          ?        ?       83.0       12.7       ?       ? 
1 1 1   25    1   76 o    304.1    3.7    0.0000   0.0000          ?        ?   927.1334  22.3483          ?        ?      304.1        3.7       ?       ? 
1 1 1   25    2    0 o    518.7    3.4 2691.3687  35.1187  2691.3687  35.1187  2691.3687  35.1187      518.7      3.4      518.7        3.4     0.0     0.0 
1 1 1   25    2    1 o    615.9    2.7    0.0000   0.0000          ?        ?  3792.8184  33.2031          ?        ?      615.9        2.7       ?       ? 
1 1 1   25    2    2 o   1355.3    5.1    0.0000   0.0000          ?        ? 18370.9062 137.2822          ?        ?     1355.3        5.1       ?       ? 
1 1 1   25    2    3 o   1329.5    5.0    0.0000   0.0000          ?        ? 17677.4707 132.1740          ?        ?     1329.5        5.0       ?       ? 
1 1 1   25    2    4 o   1198.4    4.3    0.0000   0.0000          ?        ? 14362.9053 103.4405          ?        ?     1198.4        4.3       ?       ? 
1 1 1   25    2    5 o   1116.3    4.1    0.0000   0.0000          ?        ? 12461.3877  90.6701          ?        ?     1116.3        4.1       ?       ? 
1 1 1   25    2    6 f   1525.2    5.4    0.0000   0.0000          ?        ? 23265.8125 163.4615          ?        ?     1525.2        5.4       ?       ? 
1 1 1   25    2    7 o    183.8    2.1    0.0000   0.0000          ?        ?   337.7780   7.6623          ?        ?      183.8        2.1       ?       ? 
1 1 1   25    2    8 o   1454.0    4.9    0.0000   0.0000          ?        ? 21142.7285 141.1133          ?        ?     1454.0        4.9       ?       ? 
1 1 1   25    2    9 o   1205.6    4.2    0.0000   0.0000          ?        ? 14535.3057 100.2479          ?        ?     1205.6        4.2       ?       ? 
1 1 1   25    2   10 o   1089.1    3.8    0.0000   0.0000          ?        ? 11861.1777  83.0078          ?        ?     1089.1        3.8       ?       ? 
1 1 1   25    2   11 o    521.6    2.2    0.0000   0.0000          ?        ?  2720.7407  22.9868          ?        ?      521.6        2.2       ?       ? 
1 1 1   25    2   12 o   1508.6    5.3    0.0000   0.0000          ?        ? 22760.7422 159.6304          ?        ?     1508.6        5.3       ?       ? 
1 1 1   25    2   13 o   1224.7    4.6    0.0000   0.0000          ?        ? 15000.7891 112.3798          ?        ?     1224.7        4.6       ?       ? 
1 1 1   25    2   14 o   1100.0    3.9    0.0000   0.0000          ?        ? 12100.6230  86.2004          ?        ?     1100.0        3.9       ?       ? 
1 1 1   25    2   15 o   2092.6    6.8    0.0000   0.0000          ?        ? 43793.6445 284.7806          ?        ?     2092.6        6.8       ?       ? 
1 1 1   25    2   16 o    973.9    3.5    0.0000   0.0000          ?        ?  9485.2383  67.6833          ?        ?      973.9        3.5       ?       ? 
1 1 1   25    2   17 o    120.4    4.2    0.0000   0.0000          ?        ?   144.9444  10.2163          ?        ?      120.4        4.2       ?       ? 
1 1 1   25    2   18 o    312.8    2.2    0.0000   0.0000          ?        ?   978.2151  14.0475          ?        ?      312.8        2.2       ?       ? 
1 1 1   25    2   19 o   2355.0    7.7    0.0000   0.0000          ?        ? 55469.0078 363.9573          ?        ?     2355.0        7.7       ?       ? 
1 1 1   25    2   20 o    663.4    2.7    0.0000   0.0000          ?        ?  4400.6909  35.7572          ?        ?      663.4        2.7       ?       ? 
1 1 1   25    2   21 o    205.4    2.8    0.0000   0.0000          ?        ?   422.0628  11.4934          ?        ?      205.4        2.8       ?       ? 
1 1 1   25    2   22 o    817.5    3.1    0.0000   0.0000          ?        ?  6683.4058  51.0817          ?        ?      817.5        3.1       ?       ? 
1 1 1   25    2   23 o    871.1    3.3    0.0000   0.0000          ?        ?  7588.8296  57.4669          ?        ?      871.1        3.3       ?       ? 
1 1 1   25    2   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    2   25 o   1247.7    4.4    0.0000   0.0000          ?        ? 15569.0732 109.8257          ?        ?     1247.7        4.4       ?       ? 
1 1 1   25    2   26 o    115.8    6.6    0.0000   0.0000          ?        ?   134.0895  15.3245          ?        ?      115.8        6.6       ?       ? 
1 1 1   25    2   27 f    438.0    2.7    0.0000   0.0000          ?        ?  1918.7574  23.6253          ?        ?      438.0        2.7       ?       ? 
1 1 1   25    2   28 o    468.9    2.4    0.0000   0.0000          ?        ?  2199.0684  22.3483          ?        ?      468.9        2.4       ?       ? 
1 1 1   25    2   29 o    304.4    3.0    0.0000   0.0000          ?        ?   926.4949  18.5171          ?        ?      304.4        3.0       ?       ? 
1 1 1   25    2   30 o   1100.6    4.1    0.0000   0.0000          ?        ? 12114.6709  89.3930          ?        ?     1100.6        4.1       ?       ? 
1 1 1   25    2   31 o    927.0    3.8    0.0000   0.0000          ?        ?  8593.2246  70.8759          ?        ?      927.0        3.8       ?       ? 
1 1 1   25    2   32 o    870.7    3.5    0.0000   0.0000          ?        ?  7581.8062  60.6596          ?        ?      870.7        3.5       ?       ? 
1 1 1   25    2   33 o    800.3    3.3    0.0000   0.0000          ?        ?  6405.0103  52.9973          ?        ?      800.3        3.3       ?       ? 
1 1 1   25    2   34 o    562.0    2.8    0.0000   0.0000          ?        ?  3158.1279  31.9261          ?        ?      562.0        2.8       ?       ? 
1 1 1   25    2   35 o   1044.8    3.7    0.0000   0.0000          ?        ? 10917.4434  77.2611          ?        ?     1044.8        3.7       ?       ? 
1 1 1   25    2   36 o    940.9    3.6    0.0000   0.0000          ?        ?  8853.1025  67.6833          ?        ?      940.9        3.6       ?       ? 
1 1 1   25    2   37 o    485.5    2.8    0.0000   0.0000          ?        ?  2357.4219  27.4564          ?        ?      485.5        2.8       ?       ? 
1 1 1   25    2   38 o    207.7    4.6    0.0000   0.0000          ?        ?   431.6406  19.1556          ?        ?      207.7        4.6       ?       ? 
1 1 1   25    2   39 o    568.1    2.8    0.0000   0.0000          ?        ?  3227.7268  31.2876          ?        ?      568.1        2.8       ?       ? 
1 1 1   25    2   40 o    743.1    3.0    0.0000   0.0000          ?        ?  5521.9351  44.6965          ?        ?      743.1        3.0       ?       ? 
1 1 1   25    2   41 o    575.7    2.7    0.0000   0.0000          ?        ?  3314.5657  30.6490          ?        ?      575.7        2.7       ?       ? 
1 1 1   25    2   42 o    715.5    3.1    0.0000   0.0000          ?        ?  5119.6665  44.0580          ?        ?      715.5        3.1       ?       ? 
1 1 1   25    2   43 o    333.8    3.0    0.0000   0.0000          ?        ?  1114.2202  19.7942          ?        ?      333.8        3.0       ?       ? 
1 1 1   25    2   44 o    890.4    3.4    0.0000   0.0000          ?        ?  7929.8003  60.6596          ?        ?      890.4        3.4       ?       ? 
1 1 1   25    2   45 o    380.9    2.8    0.0000   0.0000          ?        ?  1451.3596  21.7097          ?        ?      380.9        2.8       ?       ? 
1 1 1   25    2   46 o    159.2    5.6    0.0000   0.0000          ?        ?   253.4931  17.8786          ?        ?      159.2        5.6       ?       ? 
1 1 1   25    2   47 o    769.1    3.2    0.0000   0.0000          ?        ?  5917.1802  49.8047          ?        ?      769.1        3.2       ?       ? 
1 1 1   25    2   48 o    383.9    2.9    0.0000   0.0000          ?        ?  1474.3464  22.3483          ?        ?      383.9        2.9       ?       ? 
1 1 1   25    2   49 o    205.9    4.5    0.0000   0.0000          ?        ?   423.9784  18.5171          ?        ?      205.9        4.5       ?       ? 
1 1 1   25    2   50 o    580.5    2.8    0.0000   0.0000          ?        ?  3370.7559  32.5646          ?        ?      580.5        2.8       ?       ? 
1 1 1   25    2   51 o     94.4   10.1    0.0000   0.0000          ?        ?    89.3930  19.1556          ?        ?       94.4       10.1       ?       ? 
1 1 1   25    2   52 o    631.0    2.9    0.0000   0.0000          ?        ?  3982.4595  37.0343          ?        ?      631.0        2.9       ?       ? 
1 1 1   25    2   53 o    532.0    2.8    0.0000   0.0000          ?        ?  2830.5664  29.3720          ?        ?      532.0        2.8       ?       ? 
1 1 1   25    2   54 o    234.7    4.1    0.0000   0.0000          ?        ?   551.0442  19.1556          ?        ?      234.7        4.1       ?       ? 
1 1 1   25    2   55 o     63.4   15.3    0.0000   0.0000          ?        ?    42.1424  19.1556          ?        ?       63.4       15.3       ?       ? 
1 1 1   25    2   56 o    295.0    3.4    0.0000   0.0000          ?        ?   870.9435  19.7942          ?        ?      295.0        3.4       ?       ? 
1 1 1   25    2   57 o    112.3    8.5    0.0000   0.0000          ?        ?   126.4273  19.1556          ?        ?      112.3        8.5       ?       ? 
1 1 1   25    2   58 o    209.6    4.7    0.0000   0.0000          ?        ?   439.9414  19.7942          ?        ?      209.6        4.7       ?       ? 
1 1 1   25    2   59 o    351.1    2.9    0.0000   0.0000          ?        ?  1232.9854  20.4327          ?        ?      351.1        2.9       ?       ? 
1 1 1   25    2   60 o    291.9    3.5    0.0000   0.0000          ?        ?   852.4264  20.4327          ?        ?      291.9        3.5       ?       ? 
1 1 1   25    2   61 o    175.1    5.7    0.0000   0.0000          ?        ?   307.1289  19.7942          ?        ?      175.1        5.7       ?       ? 
1 1 1   25    2   62 o    301.9    3.4    0.0000   0.0000          ?        ?   911.8089  20.4327          ?        ?      301.9        3.4       ?       ? 
1 1 1   25    2   63 o    203.9    4.9    0.0000   0.0000          ?        ?   416.3161  19.7942          ?        ?      203.9        4.9       ?       ? 
1 1 1   25    2   64 o     94.2   10.8    0.0000   0.0000          ?        ?    89.3930  20.4327          ?        ?       94.2       10.8       ?       ? 
1 1 1   25    2   65 o    213.1    4.6    0.0000   0.0000          ?        ?   454.6274  19.7942          ?        ?      213.1        4.6       ?       ? 
1 1 1   25    2   66 o    293.9    3.9    0.0000   0.0000          ?        ?   864.5582  22.9868          ?        ?      293.9        3.9       ?       ? 
1 1 1   25    2   67 o     89.2   11.8    0.0000   0.0000          ?        ?    80.4537  21.0712          ?        ?       89.2       11.8       ?       ? 
1 1 1   25    2   68 o     35.7   15.6    0.0000   0.0000          ?        ?    -3.8311  21.0712          ?        ?       35.7       15.6       ?       ? 
1 1 1   25    2   69 o    317.8    3.8    0.0000   0.0000          ?        ?  1011.4182  24.2638          ?        ?      317.8        3.8       ?       ? 
1 1 1   25    2   70 o     29.6   14.0    0.0000   0.0000          ?        ?   -26.1794  22.3483          ?        ?       29.6       14.0       ?       ? 
1 1 1   25    2   71 o    183.2    5.9    0.0000   0.0000          ?        ?   337.1394  21.7097          ?        ?      183.2        5.9       ?       ? 
1 1 1   25    2   72 o    179.3    5.9    0.0000   0.0000          ?        ?   323.0919  21.0712          ?        ?      179.3        5.9       ?       ? 
1 1 1   25    2   73 o     99.8   11.2    0.0000   0.0000          ?        ?   101.5249  22.3483          ?        ?       99.8       11.2       ?       ? 
1 1 1   25    2   74 o     56.5   17.2    0.0000   0.0000          ?        ?    33.8416  21.0712          ?        ?       56.5       17.2       ?       ? 
1 1 1   25    2   75 o    165.8    6.5    0.0000   0.0000          ?        ?   277.1184  21.7097          ?        ?      165.8        6.5       ?       ? 
1 1 1   25    2   76 o     35.8   15.8    0.0000   0.0000          ?        ?    -5.1082  22.3483          ?        ?       35.8       15.8       ?       ? 
1 1 1   25    3    0 o   1313.3    7.0 17250.3008 182.6172 17250.3008 182.6172 17250.3008 182.6172     1313.3      7.0     1313.3        7.0     0.0     0.0 
1 1 1   25    3    1 o   1566.6    5.6    0.0000   0.0000          ?        ? 24544.7715 174.9549          ?        ?     1566.6        5.6       ?       ? 
1 1 1   25    3    2 o   2103.6    7.2    0.0000   0.0000          ?        ? 44260.4062 301.3822          ?        ?     2103.6        7.2       ?       ? 
1 1 1   25    3    3 o   1107.8    3.9    0.0000   0.0000          ?        ? 12272.3857  87.4775          ?        ?     1107.8        3.9       ?       ? 
1 1 1   25    3    4 o   2160.5    7.2    0.0000   0.0000          ?        ? 46683.5938 310.3215          ?        ?     2160.5        7.2       ?       ? 
1 1 1   25    3    5 o    391.5    2.1    0.0000   0.0000          ?        ?  1533.0905  16.6016          ?        ?      391.5        2.1       ?       ? 
1 1 1   25    3    6 o   1765.2    6.0    0.0000   0.0000          ?        ? 31163.0488 210.7121          ?        ?     1765.2        6.0       ?       ? 
1 1 1   25    3    7 o    736.9    2.9    0.0000   0.0000          ?        ?  5429.9883  42.1424          ?        ?      736.9        2.9       ?       ? 
1 1 1   25    3    8 o    770.9    2.9    0.0000   0.0000          ?        ?  5942.7207  45.3350          ?        ?      770.9        2.9       ?       ? 
1 1 1   25    3    9 o   1084.7    3.9    0.0000   0.0000          ?        ? 11767.3154  84.2849          ?        ?     1084.7        3.9       ?       ? 
1 1 1   25    3   10 o   1013.4    3.8    0.0000   0.0000          ?        ? 10269.3438  77.2611          ?        ?     1013.4        3.8       ?       ? 
1 1 1   25    3   11 o   1399.3    5.2    0.0000   0.0000          ?        ? 19580.9043 144.3059          ?        ?     1399.3        5.2       ?       ? 
1 1 1   25    3   12 o    716.3    2.8    0.0000   0.0000          ?        ?  5130.5215  39.5883          ?        ?      716.3        2.8       ?       ? 
1 1 1   25    3   13 o   1586.5    5.4    0.0000   0.0000          ?        ? 25173.0762 171.7623          ?        ?     1586.5        5.4       ?       ? 
1 1 1   25    3   14 o    459.5    2.3    0.0000   0.0000          ?        ?  2111.5911  21.0712          ?        ?      459.5        2.3       ?       ? 
1 1 1   25    3   15 o    519.1    2.3    0.0000   0.0000          ?        ?  2694.5613  23.6253          ?        ?      519.1        2.3       ?       ? 
1 1 1   25    3   16 o   1164.8    4.0    0.0000   0.0000          ?        ? 13567.9453  92.5856          ?        ?     1164.8        4.0       ?       ? 
1 1 1   25    3   17 o    254.3    2.4    0.0000   0.0000          ?        ?   646.8224  12.1319          ?        ?      254.3        2.4       ?       ? 
1 1 1   25    3   18 o    930.6    3.4    0.0000   0.0000          ?        ?  8660.2695  62.5751          ?        ?      930.6        3.4       ?       ? 
1 1 1   25    3   19 o    542.1    2.4    0.0000   0.0000          ?        ?  2938.4766  25.5409          ?        ?      542.1        2.4       ?       ? 
1 1 1   25    3   20 o   1205.5    4.1    0.0000   0.0000          ?        ? 14532.1133  99.6094          ?        ?     1205.5        4.1       ?       ? 
1 1 1   25    3   21 o   1334.8    4.5    0.0000   0.0000          ?        ? 17817.3066 120.6806          ?        ?     1334.8        4.5       ?       ? 
1 1 1   25    3   22 o    292.1    2.3    0.0000   0.0000          ?        ?   853.0649  13.4090          ?        ?      292.1        2.3       ?       ? 
1 1 1   25    3   23 o    855.6    3.2    0.0000   0.0000          ?        ?  7320.6504  54.2743          ?        ?      855.6        3.2       ?       ? 
1 1 1   25    3   24 o    765.8    2.9    0.0000   0.0000          ?        ?  5865.4595  44.0580          ?        ?      765.8        2.9       ?       ? 
1 1 1   25    3   25 o   1007.4    3.8    0.0000   0.0000          ?        ? 10149.9395  76.6226          ?        ?     1007.4        3.8       ?       ? 
1 1 1   25    3   26 o   1285.5    4.7    0.0000   0.0000          ?        ? 16526.8555 120.6806          ?        ?     1285.5        4.7       ?       ? 
1 1 1   25    3   27 f    252.3    2.9    0.0000   0.0000          ?        ?   636.6060  14.6860          ?        ?      252.3        2.9       ?       ? 
1 1 1   25    3   28 o    456.0    2.5    0.0000   0.0000          ?        ?  2079.6650  22.9868          ?        ?      456.0        2.5       ?       ? 
1 1 1   25    3   29 o    452.0    3.2    0.0000   0.0000          ?        ?  2043.2692  29.3720          ?        ?      452.0        3.2       ?       ? 
1 1 1   25    3   30 o    963.3    3.8    0.0000   0.0000          ?        ?  9280.2734  74.0685          ?        ?      963.3        3.8       ?       ? 
1 1 1   25    3   31 o    560.0    3.0    0.0000   0.0000          ?        ?  3135.7798  33.8416          ?        ?      560.0        3.0       ?       ? 
1 1 1   25    3   32 f    858.6    3.4    0.0000   0.0000          ?        ?  7371.7319  58.7440          ?        ?      858.6        3.4       ?       ? 
1 1 1   25    3   33 o    651.6    3.0    0.0000   0.0000          ?        ?  4246.1689  38.9498          ?        ?      651.6        3.0       ?       ? 
1 1 1   25    3   34 o   1007.4    3.9    0.0000   0.0000          ?        ? 10148.6631  78.5382          ?        ?     1007.4        3.9       ?       ? 
1 1 1   25    3   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    3   36 o    232.4    3.7    0.0000   0.0000          ?        ?   540.1893  17.2401          ?        ?      232.4        3.7       ?       ? 
1 1 1   25    3   37 o    742.3    3.2    0.0000   0.0000          ?        ?  5510.4414  47.8891          ?        ?      742.3        3.2       ?       ? 
1 1 1   25    3   38 o    612.5    3.0    0.0000   0.0000          ?        ?  3751.9529  37.0343          ?        ?      612.5        3.0       ?       ? 
1 1 1   25    3   39 o    577.2    2.9    0.0000   0.0000          ?        ?  3331.8057  33.8416          ?        ?      577.2        2.9       ?       ? 
1 1 1   25    3   40 o    460.4    2.8    0.0000   0.0000          ?        ?  2119.8918  25.5409          ?        ?      460.4        2.8       ?       ? 
1 1 1   25    3   41 o    228.0    4.3    0.0000   0.0000          ?        ?   519.7566  19.7942          ?        ?      228.0        4.3       ?       ? 
1 1 1   25    3   42 o    421.3    2.8    0.0000   0.0000          ?        ?  1775.0901  23.6253          ?        ?      421.3        2.8       ?       ? 
1 1 1   25    3   43 o    314.7    3.0    0.0000   0.0000          ?        ?   990.3471  19.1556          ?        ?      314.7        3.0       ?       ? 
1 1 1   25    3   44 o    332.6    3.1    0.0000   0.0000          ?        ?  1106.5580  20.4327          ?        ?      332.6        3.1       ?       ? 
1 1 1   25    3   45 f    454.5    2.8    0.0000   0.0000          ?        ?  2065.6174  25.5409          ?        ?      454.5        2.8       ?       ? 
1 1 1   25    3   46 f    708.7    3.0    0.0000   0.0000          ?        ?  5023.8882  42.1424          ?        ?      708.7        3.0       ?       ? 
1 1 1   25    3   47 o    305.4    3.1    0.0000   0.0000          ?        ?   932.8801  19.1556          ?        ?      305.4        3.1       ?       ? 
1 1 1   25    3   48 o    106.8    8.1    0.0000   0.0000          ?        ?   114.2954  17.2401          ?        ?      106.8        8.1       ?       ? 
1 1 1   25    3   49 o     19.8   10.0    0.0000   0.0000          ?        ?   -65.1292  19.1556          ?        ?       19.8       10.0       ?       ? 
1 1 1   25    3   50 o    365.0    2.8    0.0000   0.0000          ?        ?  1332.5946  20.4327          ?        ?      365.0        2.8       ?       ? 
1 1 1   25    3   51 o    625.2    2.7    0.0000   0.0000          ?        ?  3909.6677  33.8416          ?        ?      625.2        2.7       ?       ? 
1 1 1   25    3   52 f    579.3    2.6    0.0000   0.0000          ?        ?  3356.0696  30.0105          ?        ?      579.3        2.6       ?       ? 
1 1 1   25    3   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    3   54 o    212.2    4.4    0.0000   0.0000          ?        ?   450.7963  18.5171          ?        ?      212.2        4.4       ?       ? 
1 1 1   25    3   55 o    223.0    4.2    0.0000   0.0000          ?        ?   497.4084  18.5171          ?        ?      223.0        4.2       ?       ? 
1 1 1   25    3   56 o    305.9    3.3    0.0000   0.0000          ?        ?   936.0728  20.4327          ?        ?      305.9        3.3       ?       ? 
1 1 1   25    3   57 o    437.1    2.8    0.0000   0.0000          ?        ?  1911.0951  24.2638          ?        ?      437.1        2.8       ?       ? 
1 1 1   25    3   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    3   59 o     19.5    9.9    0.0000   0.0000          ?        ?   -67.0448  19.1556          ?        ?       19.5        9.9       ?       ? 
1 1 1   25    3   60 o    188.4    5.4    0.0000   0.0000          ?        ?   355.6566  20.4327          ?        ?      188.4        5.4       ?       ? 
1 1 1   25    3   61 o    248.6    4.2    0.0000   0.0000          ?        ?   618.7275  21.0712          ?        ?      248.6        4.2       ?       ? 
1 1 1   25    3   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    3   63 o    177.1    5.6    0.0000   0.0000          ?        ?   314.1526  19.7942          ?        ?      177.1        5.6       ?       ? 
1 1 1   25    3   64 o    210.8    5.0    0.0000   0.0000          ?        ?   445.0496  21.0712          ?        ?      210.8        5.0       ?       ? 
1 1 1   25    3   65 o     85.6   11.9    0.0000   0.0000          ?        ?    74.0685  20.4327          ?        ?       85.6       11.9       ?       ? 
1 1 1   25    3   66 o     22.3   11.1    0.0000   0.0000          ?        ?   -54.9129  20.4327          ?        ?       22.3       11.1       ?       ? 
1 1 1   25    3   67 o    321.5    3.6    0.0000   0.0000          ?        ?  1035.0436  22.9868          ?        ?      321.5        3.6       ?       ? 
1 1 1   25    3   68 o     95.0   11.1    0.0000   0.0000          ?        ?    91.3086  21.0712          ?        ?       95.0       11.1       ?       ? 
1 1 1   25    3   69 o     39.0   16.3    0.0000   0.0000          ?        ?     3.8311  21.0712          ?        ?       39.0       16.3       ?       ? 
1 1 1   25    3   70 o    144.5    7.5    0.0000   0.0000          ?        ?   210.0736  21.7097          ?        ?      144.5        7.5       ?       ? 
1 1 1   25    3   71 f    318.2    3.7    0.0000   0.0000          ?        ?  1013.9724  23.6253          ?        ?      318.2        3.7       ?       ? 
1 1 1   25    3   72 o     39.0   16.4    0.0000   0.0000          ?        ?     3.1926  21.7097          ?        ?       39.0       16.4       ?       ? 
1 1 1   25    3   73 o    224.5    5.0    0.0000   0.0000          ?        ?   505.7091  22.3483          ?        ?      224.5        5.0       ?       ? 
1 1 1   25    3   74 o    171.6    6.1    0.0000   0.0000          ?        ?   296.2740  21.0712          ?        ?      171.6        6.1       ?       ? 
1 1 1   25    3   75 o     50.4   17.0    0.0000   0.0000          ?        ?    25.5409  20.4327          ?        ?       50.4       17.0       ?       ? 
1 1 1   25    4    0 o     56.6    8.2   33.2031   8.9393    33.2031   8.9393    33.2031   8.9393       56.6      8.2       56.6        8.2     0.0     0.0 
1 1 1   25    4    1 o   1023.4    3.7    0.0000   0.0000          ?        ? 10474.3086  75.3456          ?        ?     1023.4        3.7       ?       ? 
1 1 1   25    4    2 o   1742.5    5.8    0.0000   0.0000          ?        ? 30366.8105 201.1343          ?        ?     1742.5        5.8       ?       ? 
1 1 1   25    4    3 o   1418.9    4.8    0.0000   0.0000          ?        ? 20133.8633 136.6436          ?        ?     1418.9        4.8       ?       ? 
1 1 1   25    4    4 o    661.0    2.6    0.0000   0.0000          ?        ?  4368.7651  34.4802          ?        ?      661.0        2.6       ?       ? 
1 1 1   25    4    5 o    345.4    1.8    0.0000   0.0000          ?        ?  1192.7584  12.7704          ?        ?      345.4        1.8       ?       ? 
1 1 1   25    4    6 o    684.2    2.8    0.0000   0.0000          ?        ?  4681.0020  37.6728          ?        ?      684.2        2.8       ?       ? 
1 1 1   25    4    7 o    405.9    2.0    0.0000   0.0000          ?        ?  1647.3857  16.6016          ?        ?      405.9        2.0       ?       ? 
1 1 1   25    4    8 o    973.0    3.6    0.0000   0.0000          ?        ?  9466.7217  70.2374          ?        ?      973.0        3.6       ?       ? 
1 1 1   25    4    9 o   1387.8    4.7    0.0000   0.0000          ?        ? 19261.6445 131.5355          ?        ?     1387.8        4.7       ?       ? 
1 1 1   25    4   10 o    902.0    3.4    0.0000   0.0000          ?        ?  8136.0425  61.9366          ?        ?      902.0        3.4       ?       ? 
1 1 1   25    4   11 o    893.1    3.4    0.0000   0.0000          ?        ?  7977.0508  60.0210          ?        ?      893.1        3.4       ?       ? 
1 1 1   25    4   12 o   1297.8    4.4    0.0000   0.0000          ?        ? 16843.5605 114.2954          ?        ?     1297.8        4.4       ?       ? 
1 1 1   25    4   13 o    498.4    2.3    0.0000   0.0000          ?        ?  2483.8491  22.9868          ?        ?      498.4        2.3       ?       ? 
1 1 1   25    4   14 o   1415.4    4.8    0.0000   0.0000          ?        ? 20034.2559 135.3666          ?        ?     1415.4        4.8       ?       ? 
1 1 1   25    4   15 o   1986.4    6.5    0.0000   0.0000          ?        ? 39461.9141 257.3242          ?        ?     1986.4        6.5       ?       ? 
1 1 1   25    4   16 o   1446.0    4.8    0.0000   0.0000          ?        ? 20910.9434 139.8362          ?        ?     1446.0        4.8       ?       ? 
1 1 1   25    4   17 f   1299.8    4.4    0.0000   0.0000          ?        ? 16896.5586 113.6568          ?        ?     1299.8        4.4       ?       ? 
1 1 1   25    4   18 o   1636.9    5.4    0.0000   0.0000          ?        ? 26795.5605 177.5090          ?        ?     1636.9        5.4       ?       ? 
1 1 1   25    4   19 o    565.9    2.5    0.0000   0.0000          ?        ?  3202.8245  28.0950          ?        ?      565.9        2.5       ?       ? 
1 1 1   25    4   20 o   1003.4    3.6    0.0000   0.0000          ?        ? 10068.8477  72.7915          ?        ?     1003.4        3.6       ?       ? 
1 1 1   25    4   21 o    596.0    2.6    0.0000   0.0000          ?        ?  3552.0957  30.6490          ?        ?      596.0        2.6       ?       ? 
1 1 1   25    4   22 o    400.6    2.3    0.0000   0.0000          ?        ?  1604.6049  18.5171          ?        ?      400.6        2.3       ?       ? 
1 1 1   25    4   23 o     36.7   13.4    0.0000   0.0000          ?        ?    10.8549  12.7704          ?        ?       36.7       13.4       ?       ? 
1 1 1   25    4   24 o   1293.9    4.8    0.0000   0.0000          ?        ? 16743.9531 125.1502          ?        ?     1293.9        4.8       ?       ? 
1 1 1   25    4   25 o   1340.3    5.0    0.0000   0.0000          ?        ? 17965.4453 134.7281          ?        ?     1340.3        5.0       ?       ? 
1 1 1   25    4   26 o   1003.6    3.8    0.0000   0.0000          ?        ? 10073.3174  76.6226          ?        ?     1003.6        3.8       ?       ? 
1 1 1   25    4   27 o     46.6   15.1    0.0000   0.0000          ?        ?    21.0712  15.9630          ?        ?       46.6       15.1       ?       ? 
1 1 1   25    4   28 o   1014.1    4.1    0.0000   0.0000          ?        ? 10284.0293  83.0078          ?        ?     1014.1        4.1       ?       ? 
1 1 1   25    4   29 o   1351.0    5.1    0.0000   0.0000          ?        ? 18253.4180 137.2822          ?        ?     1351.0        5.1       ?       ? 
1 1 1   25    4   30 o   1030.2    3.9    0.0000   0.0000          ?        ? 10614.1455  81.0922          ?        ?     1030.2        3.9       ?       ? 
1 1 1   25    4   31 o   1318.6    4.6    0.0000   0.0000          ?        ? 17388.2207 121.3191          ?        ?     1318.6        4.6       ?       ? 
1 1 1   25    4   32 o    654.3    3.0    0.0000   0.0000          ?        ?  4281.2876  38.9498          ?        ?      654.3        3.0       ?       ? 
1 1 1   25    4   33 o    139.8    5.3    0.0000   0.0000          ?        ?   195.3876  14.6860          ?        ?      139.8        5.3       ?       ? 
1 1 1   25    4   34 o    807.9    3.3    0.0000   0.0000          ?        ?  6526.9683  52.9973          ?        ?      807.9        3.3       ?       ? 
1 1 1   25    4   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    4   36 o    748.8    3.0    0.0000   0.0000          ?        ?  5606.8584  45.3350          ?        ?      748.8        3.0       ?       ? 
1 1 1   25    4   37 o   1068.8    3.9    0.0000   0.0000          ?        ? 11425.7061  84.2849          ?        ?     1068.8        3.9       ?       ? 
1 1 1   25    4   38 o    656.2    2.9    0.0000   0.0000          ?        ?  4306.8286  38.3113          ?        ?      656.2        2.9       ?       ? 
1 1 1   25    4   39 o    344.8    3.0    0.0000   0.0000          ?        ?  1188.9272  20.4327          ?        ?      344.8        3.0       ?       ? 
1 1 1   25    4   40 o    163.1    5.9    0.0000   0.0000          ?        ?   266.2635  19.1556          ?        ?      163.1        5.9       ?       ? 
1 1 1   25    4   41 o    564.3    2.6    0.0000   0.0000          ?        ?  3184.3074  29.3720          ?        ?      564.3        2.6       ?       ? 
1 1 1   25    4   42 o    463.1    2.6    0.0000   0.0000          ?        ?  2144.7942  24.2638          ?        ?      463.1        2.6       ?       ? 
1 1 1   25    4   43 f    462.0    2.6    0.0000   0.0000          ?        ?  2134.5776  24.2638          ?        ?      462.0        2.6       ?       ? 
1 1 1   25    4   44 o    102.6    8.1    0.0000   0.0000          ?        ?   105.3561  16.6016          ?        ?      102.6        8.1       ?       ? 
1 1 1   25    4   45 o    458.9    2.6    0.0000   0.0000          ?        ?  2106.4829  24.2638          ?        ?      458.9        2.6       ?       ? 
1 1 1   25    4   46 o    325.5    3.0    0.0000   0.0000          ?        ?  1059.9459  19.7942          ?        ?      325.5        3.0       ?       ? 
1 1 1   25    4   47 o    517.8    2.7    0.0000   0.0000          ?        ?  2681.7908  27.4564          ?        ?      517.8        2.7       ?       ? 
1 1 1   25    4   48 o    486.7    2.6    0.0000   0.0000          ?        ?  2368.9153  25.5409          ?        ?      486.7        2.6       ?       ? 
1 1 1   25    4   49 o    573.8    2.9    0.0000   0.0000          ?        ?  3292.8562  33.8416          ?        ?      573.8        2.9       ?       ? 
1 1 1   25    4   50 o     49.2   15.9    0.0000   0.0000          ?        ?    23.6253  17.8786          ?        ?       49.2       15.9       ?       ? 
1 1 1   25    4   51 o    348.6    2.9    0.0000   0.0000          ?        ?  1215.7451  20.4327          ?        ?      348.6        2.9       ?       ? 
1 1 1   25    4   52 o     18.5    9.4    0.0000   0.0000          ?        ?   -60.6596  17.2401          ?        ?       18.5        9.4       ?       ? 
1 1 1   25    4   53 o    384.8    2.9    0.0000   0.0000          ?        ?  1481.3701  22.3483          ?        ?      384.8        2.9       ?       ? 
1 1 1   25    4   54 o    320.6    3.3    0.0000   0.0000          ?        ?  1028.0198  21.0712          ?        ?      320.6        3.3       ?       ? 
1 1 1   25    4   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    4   56 o     61.9   15.1    0.0000   0.0000          ?        ?    40.2269  18.5171          ?        ?       61.9       15.1       ?       ? 
1 1 1   25    4   57 o    576.2    2.9    0.0000   0.0000          ?        ?  3321.5896  33.2031          ?        ?      576.2        2.9       ?       ? 
1 1 1   25    4   58 o    405.7    2.9    0.0000   0.0000          ?        ?  1646.7472  23.6253          ?        ?      405.7        2.9       ?       ? 
1 1 1   25    4   59 o    503.8    2.7    0.0000   0.0000          ?        ?  2539.4006  27.4564          ?        ?      503.8        2.7       ?       ? 
1 1 1   25    4   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    4   61 o    319.4    3.5    0.0000   0.0000          ?        ?  1020.9960  22.3483          ?        ?      319.4        3.5       ?       ? 
1 1 1   25    4   62 o    362.7    3.3    0.0000   0.0000          ?        ?  1316.6316  23.6253          ?        ?      362.7        3.3       ?       ? 
1 1 1   25    4   63 f    338.4    3.3    0.0000   0.0000          ?        ?  1146.1464  22.3483          ?        ?      338.4        3.3       ?       ? 
1 1 1   25    4   64 o    350.9    3.4    0.0000   0.0000          ?        ?  1232.3467  23.6253          ?        ?      350.9        3.4       ?       ? 
1 1 1   25    4   65 o    212.3    4.8    0.0000   0.0000          ?        ?   451.4348  20.4327          ?        ?      212.3        4.8       ?       ? 
1 1 1   25    4   66 o    157.3    6.9    0.0000   0.0000          ?        ?   248.3849  21.7097          ?        ?      157.3        6.9       ?       ? 
1 1 1   25    4   67 o    190.6    5.9    0.0000   0.0000          ?        ?   364.5958  22.3483          ?        ?      190.6        5.9       ?       ? 
1 1 1   25    4   68 o    115.3    9.1    0.0000   0.0000          ?        ?   134.0895  21.0712          ?        ?      115.3        9.1       ?       ? 
1 1 1   25    4   69 o     31.3   14.5    0.0000   0.0000          ?        ?   -17.8786  21.7097          ?        ?       31.3       14.5       ?       ? 
1 1 1   25    4   70 o     57.8   17.1    0.0000   0.0000          ?        ?    35.1187  21.0712          ?        ?       57.8       17.1       ?       ? 
1 1 1   25    4   71 o     44.9   17.4    0.0000   0.0000          ?        ?    14.0475  22.3483          ?        ?       44.9       17.4       ?       ? 
1 1 1   25    4   72 o     40.1   16.7    0.0000   0.0000          ?        ?     4.4697  22.3483          ?        ?       40.1       16.7       ?       ? 
1 1 1   25    4   73 o     28.9   13.7    0.0000   0.0000          ?        ?   -23.6253  21.0712          ?        ?       28.9       13.7       ?       ? 
1 1 1   25    4   74 o     75.3   14.5    0.0000   0.0000          ?        ?    60.6596  21.0712          ?        ?       75.3       14.5       ?       ? 
1 1 1   25    4   75 o    144.8    7.5    0.0000   0.0000          ?        ?   211.9892  21.7097          ?        ?      144.8        7.5       ?       ? 
1 1 1   25    5    0 o   1123.8    5.7 12631.8740 128.3428 12631.8740 128.3428 12631.8740 128.3428     1123.8      5.7     1123.8        5.7     0.0     0.0 
1 1 1   25    5    1 o    950.7    3.5    0.0000   0.0000          ?        ?  9039.5508  67.0448          ?        ?      950.7        3.5       ?       ? 
1 1 1   25    5    2 o   1517.8    5.3    0.0000   0.0000          ?        ? 23037.8594 160.2689          ?        ?     1517.8        5.3       ?       ? 
1 1 1   25    5    3 o   1572.3    5.5    0.0000   0.0000          ?        ? 24724.1973 171.7623          ?        ?     1572.3        5.5       ?       ? 
1 1 1   25    5    4 o   1071.9    4.0    0.0000   0.0000          ?        ? 11490.8350  85.5619          ?        ?     1071.9        4.0       ?       ? 
1 1 1   25    5    5 o    718.1    2.9    0.0000   0.0000          ?        ?  5156.7007  42.1424          ?        ?      718.1        2.9       ?       ? 
1 1 1   25    5    6 o    127.8    4.0    0.0000   0.0000          ?        ?   163.4615  10.2163          ?        ?      127.8        4.0       ?       ? 
1 1 1   25    5    7 o    752.0    3.0    0.0000   0.0000          ?        ?  5655.3862  44.6965          ?        ?      752.0        3.0       ?       ? 
1 1 1   25    5    8 o    896.7    3.4    0.0000   0.0000          ?        ?  8040.9033  61.2981          ?        ?      896.7        3.4       ?       ? 
1 1 1   25    5    9 o   1194.7    4.4    0.0000   0.0000          ?        ? 14273.5117 104.7175          ?        ?     1194.7        4.4       ?       ? 
1 1 1   25    5   10 f    326.0    2.1    0.0000   0.0000          ?        ?  1062.5000  13.4090          ?        ?      326.0        2.1       ?       ? 
1 1 1   25    5   11 o   1090.2    3.9    0.0000   0.0000          ?        ? 11885.4414  84.2849          ?        ?     1090.2        3.9       ?       ? 
1 1 1   25    5   12 o    927.0    3.4    0.0000   0.0000          ?        ?  8593.8623  63.2136          ?        ?      927.0        3.4       ?       ? 
1 1 1   25    5   13 o    762.3    3.1    0.0000   0.0000          ?        ?  5811.1851  47.2506          ?        ?      762.3        3.1       ?       ? 
1 1 1   25    5   14 o    864.2    3.3    0.0000   0.0000          ?        ?  7468.1489  56.1899          ?        ?      864.2        3.3       ?       ? 
1 1 1   25    5   15 o    673.1    2.7    0.0000   0.0000          ?        ?  4530.9492  36.3957          ?        ?      673.1        2.7       ?       ? 
1 1 1   25    5   16 o   1477.5    4.9    0.0000   0.0000          ?        ? 21832.3320 146.2215          ?        ?     1477.5        4.9       ?       ? 
1 1 1   25    5   17 o    300.4    2.2    0.0000   0.0000          ?        ?   902.2311  13.4090          ?        ?      300.4        2.2       ?       ? 
1 1 1   25    5   18 o   1426.3    4.8    0.0000   0.0000          ?        ? 20344.5762 136.6436          ?        ?     1426.3        4.8       ?       ? 
1 1 1   25    5   19 o    433.7    2.3    0.0000   0.0000          ?        ?  1881.0847  19.7942          ?        ?      433.7        2.3       ?       ? 
1 1 1   25    5   20 o    351.3    2.4    0.0000   0.0000          ?        ?  1234.2623  16.6016          ?        ?      351.3        2.4       ?       ? 
1 1 1   25    5   21 o    294.5    2.6    0.0000   0.0000          ?        ?   867.1124  15.3245          ?        ?      294.5        2.6       ?       ? 
1 1 1   25    5   22 o    558.8    2.5    0.0000   0.0000          ?        ?  3123.0093  28.0950          ?        ?      558.8        2.5       ?       ? 
1 1 1   25    5   23 o   1328.5    4.7    0.0000   0.0000          ?        ? 17650.0137 125.7888          ?        ?     1328.5        4.7       ?       ? 
1 1 1   25    5   24 o   1094.5    3.9    0.0000   0.0000          ?        ? 11980.5820  86.2004          ?        ?     1094.5        3.9       ?       ? 
1 1 1   25    5   25 o    714.4    2.9    0.0000   0.0000          ?        ?  5104.3418  41.5039          ?        ?      714.4        2.9       ?       ? 
1 1 1   25    5   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    5   27 o    754.4    3.3    0.0000   0.0000          ?        ?  5691.7817  49.8047          ?        ?      754.4        3.3       ?       ? 
1 1 1   25    5   28 o   1021.5    3.7    0.0000   0.0000          ?        ? 10434.7197  75.9841          ?        ?     1021.5        3.7       ?       ? 
1 1 1   25    5   29 o    257.8    3.2    0.0000   0.0000          ?        ?   664.7010  16.6016          ?        ?      257.8        3.2       ?       ? 
1 1 1   25    5   30 o    473.1    2.6    0.0000   0.0000          ?        ?  2238.6570  24.2638          ?        ?      473.1        2.6       ?       ? 
1 1 1   25    5   31 o    705.6    3.1    0.0000   0.0000          ?        ?  4978.5532  43.4195          ?        ?      705.6        3.1       ?       ? 
1 1 1   25    5   32 o    471.2    2.6    0.0000   0.0000          ?        ?  2220.1399  24.2638          ?        ?      471.2        2.6       ?       ? 
1 1 1   25    5   33 o    145.6    5.5    0.0000   0.0000          ?        ?   211.9892  15.9630          ?        ?      145.6        5.5       ?       ? 
1 1 1   25    5   34 o    902.9    3.4    0.0000   0.0000          ?        ?  8152.6445  60.6596          ?        ?      902.9        3.4       ?       ? 
1 1 1   25    5   35 o    728.7    3.2    0.0000   0.0000          ?        ?  5309.9458  45.9736          ?        ?      728.7        3.2       ?       ? 
1 1 1   25    5   36 o    804.1    3.3    0.0000   0.0000          ?        ?  6466.3086  52.3588          ?        ?      804.1        3.3       ?       ? 
1 1 1   25    5   37 o   1172.7    4.2    0.0000   0.0000          ?        ? 13755.0322  98.9709          ?        ?     1172.7        4.2       ?       ? 
1 1 1   25    5   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    5   39 f    238.1    4.2    0.0000   0.0000          ?        ?   567.0072  19.7942          ?        ?      238.1        4.2       ?       ? 
1 1 1   25    5   40 o    808.6    3.2    0.0000   0.0000          ?        ?  6538.4614  51.7203          ?        ?      808.6        3.2       ?       ? 
1 1 1   25    5   41 o    970.1    3.6    0.0000   0.0000          ?        ?  9412.4473  69.5989          ?        ?      970.1        3.6       ?       ? 
1 1 1   25    5   42 o    281.0    3.4    0.0000   0.0000          ?        ?   789.8513  19.1556          ?        ?      281.0        3.4       ?       ? 
1 1 1   25    5   43 o    309.0    3.1    0.0000   0.0000          ?        ?   955.2284  19.1556          ?        ?      309.0        3.1       ?       ? 
1 1 1   25    5   44 o    690.6    2.9    0.0000   0.0000          ?        ?  4769.7563  40.2269          ?        ?      690.6        2.9       ?       ? 
1 1 1   25    5   45 o    503.9    2.8    0.0000   0.0000          ?        ?  2540.0391  28.0950          ?        ?      503.9        2.8       ?       ? 
1 1 1   25    5   46 o    669.5    2.7    0.0000   0.0000          ?        ?  4482.4219  36.3957          ?        ?      669.5        2.7       ?       ? 
1 1 1   25    5   47 o    364.0    2.8    0.0000   0.0000          ?        ?  1324.9324  20.4327          ?        ?      364.0        2.8       ?       ? 
1 1 1   25    5   48 o     25.0   12.0    0.0000   0.0000          ?        ?   -24.9023  17.2401          ?        ?       25.0       12.0       ?       ? 
1 1 1   25    5   49 o    150.7    5.7    0.0000   0.0000          ?        ?   227.3137  17.2401          ?        ?      150.7        5.7       ?       ? 
1 1 1   25    5   50 o    428.0    2.5    0.0000   0.0000          ?        ?  1831.9185  21.7097          ?        ?      428.0        2.5       ?       ? 
1 1 1   25    5   51 o    353.0    2.9    0.0000   0.0000          ?        ?  1246.3942  20.4327          ?        ?      353.0        2.9       ?       ? 
1 1 1   25    5   52 o    118.7    7.3    0.0000   0.0000          ?        ?   141.1133  17.2401          ?        ?      118.7        7.3       ?       ? 
1 1 1   25    5   53 o    141.3    6.3    0.0000   0.0000          ?        ?   199.8573  17.8786          ?        ?      141.3        6.3       ?       ? 
1 1 1   25    5   54 o    274.1    3.5    0.0000   0.0000          ?        ?   751.5399  19.1556          ?        ?      274.1        3.5       ?       ? 
1 1 1   25    5   55 o    423.1    2.7    0.0000   0.0000          ?        ?  1791.0532  22.9868          ?        ?      423.1        2.7       ?       ? 
1 1 1   25    5   56 o     27.0   12.7    0.0000   0.0000          ?        ?   -19.7942  17.8786          ?        ?       27.0       12.7       ?       ? 
1 1 1   25    5   57 o     51.2   16.2    0.0000   0.0000          ?        ?    26.1794  18.5171          ?        ?       51.2       16.2       ?       ? 
1 1 1   25    5   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    5   59 o    394.1    2.9    0.0000   0.0000          ?        ?  1554.1616  22.9868          ?        ?      394.1        2.9       ?       ? 
1 1 1   25    5   60 o     21.5   10.7    0.0000   0.0000          ?        ?   -52.3588  19.1556          ?        ?       21.5       10.7       ?       ? 
1 1 1   25    5   61 f    131.6    7.5    0.0000   0.0000          ?        ?   173.6779  19.7942          ?        ?      131.6        7.5       ?       ? 
1 1 1   25    5   62 f    138.9    7.4    0.0000   0.0000          ?        ?   193.4720  20.4327          ?        ?      138.9        7.4       ?       ? 
1 1 1   25    5   63 o    172.8    5.9    0.0000   0.0000          ?        ?   299.4666  20.4327          ?        ?      172.8        5.9       ?       ? 
1 1 1   25    5   64 o     39.2   16.2    0.0000   0.0000          ?        ?     5.1082  20.4327          ?        ?       39.2       16.2       ?       ? 
1 1 1   25    5   65 o    183.4    5.4    0.0000   0.0000          ?        ?   337.1394  19.7942          ?        ?      183.4        5.4       ?       ? 
1 1 1   25    5   66 o    219.7    4.7    0.0000   0.0000          ?        ?   483.3608  20.4327          ?        ?      219.7        4.7       ?       ? 
1 1 1   25    5   67 f     47.0   16.9    0.0000   0.0000          ?        ?    19.1556  20.4327          ?        ?       47.0       16.9       ?       ? 
1 1 1   25    5   68 o    235.0    4.5    0.0000   0.0000          ?        ?   553.5982  21.0712          ?        ?      235.0        4.5       ?       ? 
1 1 1   25    5   69 o    103.4    9.6    0.0000   0.0000          ?        ?   107.9102  19.7942          ?        ?      103.4        9.6       ?       ? 
1 1 1   25    5   70 o    165.3    6.4    0.0000   0.0000          ?        ?   274.5643  21.0712          ?        ?      165.3        6.4       ?       ? 
1 1 1   25    5   71 o     24.9   12.2    0.0000   0.0000          ?        ?   -38.9498  20.4327          ?        ?       24.9       12.2       ?       ? 
1 1 1   25    5   72 o    135.7    8.0    0.0000   0.0000          ?        ?   185.8098  21.7097          ?        ?      135.7        8.0       ?       ? 
1 1 1   25    5   73 o    149.9    7.0    0.0000   0.0000          ?        ?   226.6752  21.0712          ?        ?      149.9        7.0       ?       ? 
1 1 1   25    5   74 o    278.5    4.1    0.0000   0.0000          ?        ?   778.3578  22.9868          ?        ?      278.5        4.1       ?       ? 
1 1 1   25    5   75 o     30.0   14.0    0.0000   0.0000          ?        ?   -17.2401  20.4327          ?        ?       30.0       14.0       ?       ? 
1 1 1   25    6    0 o    937.6    4.8 8791.8047  89.3930  8791.8047  89.3930  8791.8047  89.3930      937.6      4.8      937.6        4.8     0.0     0.0 
1 1 1   25    6    1 o   1282.0    4.4    0.0000   0.0000          ?        ? 16435.5469 112.3798          ?        ?     1282.0        4.4       ?       ? 
1 1 1   25    6    2 o   1220.3    4.2    0.0000   0.0000          ?        ? 14890.9639 103.4405          ?        ?     1220.3        4.2       ?       ? 
1 1 1   25    6    3 o   1979.0    6.5    0.0000   0.0000          ?        ? 39170.1094 257.3242          ?        ?     1979.0        6.5       ?       ? 
1 1 1   25    6    4 o    981.2    3.6    0.0000   0.0000          ?        ?  9628.2676  70.2374          ?        ?      981.2        3.6       ?       ? 
1 1 1   25    6    5 o   2339.8    7.9    0.0000   0.0000          ?        ? 54754.5078 371.6196          ?        ?     2339.8        7.9       ?       ? 
1 1 1   25    6    6 o    980.9    3.7    0.0000   0.0000          ?        ?  9622.5205  73.4300          ?        ?      980.9        3.7       ?       ? 
1 1 1   25    6    7 o   1864.7    6.6    0.0000   0.0000          ?        ? 34773.8867 244.5538          ?        ?     1864.7        6.6       ?       ? 
1 1 1   25    6    8 o   1844.4    6.1    0.0000   0.0000          ?        ? 34021.0703 224.7596          ?        ?     1844.4        6.1       ?       ? 
1 1 1   25    6    9 o    655.9    2.7    0.0000   0.0000          ?        ?  4301.7202  35.7572          ?        ?      655.9        2.7       ?       ? 
1 1 1   25    6   10 o   1632.5    5.6    0.0000   0.0000          ?        ? 26654.4453 183.8942          ?        ?     1632.5        5.6       ?       ? 
1 1 1   25    6   11 o    687.6    2.8    0.0000   0.0000          ?        ?  4728.2524  38.3113          ?        ?      687.6        2.8       ?       ? 
1 1 1   25    6   12 o    433.6    2.4    0.0000   0.0000          ?        ?  1879.8076  21.0712          ?        ?      433.6        2.4       ?       ? 
1 1 1   25    6   13 o    321.0    2.5    0.0000   0.0000          ?        ?  1030.5739  15.9630          ?        ?      321.0        2.5       ?       ? 
1 1 1   25    6   14 o    147.8    4.1    0.0000   0.0000          ?        ?   218.3744  12.1319          ?        ?      147.8        4.1       ?       ? 
1 1 1   25    6   15 o    995.2    3.8    0.0000   0.0000          ?        ?  9905.3867  75.3456          ?        ?      995.2        3.8       ?       ? 
1 1 1   25    6   16 o    987.9    3.6    0.0000   0.0000          ?        ?  9760.4414  70.8759          ?        ?      987.9        3.6       ?       ? 
1 1 1   25    6   17 o   1389.3    4.8    0.0000   0.0000          ?        ? 19302.5078 132.8125          ?        ?     1389.3        4.8       ?       ? 
1 1 1   25    6   18 o     18.4    9.3    0.0000   0.0000          ?        ?   -51.7203  15.9630          ?        ?       18.4        9.3       ?       ? 
1 1 1   25    6   19 o   1309.3    4.6    0.0000   0.0000          ?        ? 17143.6660 120.0421          ?        ?     1309.3        4.6       ?       ? 
1 1 1   25    6   20 o    300.8    2.2    0.0000   0.0000          ?        ?   904.7851  13.4090          ?        ?      300.8        2.2       ?       ? 
1 1 1   25    6   21 o    556.5    2.6    0.0000   0.0000          ?        ?  3097.4685  29.3720          ?        ?      556.5        2.6       ?       ? 
1 1 1   25    6   22 o    492.5    2.6    0.0000   0.0000          ?        ?  2425.7437  25.5409          ?        ?      492.5        2.6       ?       ? 
1 1 1   25    6   23 o    556.9    2.8    0.0000   0.0000          ?        ?  3101.2996  30.6490          ?        ?      556.9        2.8       ?       ? 
1 1 1   25    6   24 o    868.5    3.3    0.0000   0.0000          ?        ?  7543.4946  58.1055          ?        ?      868.5        3.3       ?       ? 
1 1 1   25    6   25 o   1455.7    5.4    0.0000   0.0000          ?        ? 21193.1719 158.3534          ?        ?     1455.7        5.4       ?       ? 
1 1 1   25    6   26 o    516.6    2.8    0.0000   0.0000          ?        ?  2668.3818  29.3720          ?        ?      516.6        2.8       ?       ? 
1 1 1   25    6   27 o    690.6    3.2    0.0000   0.0000          ?        ?  4769.1182  44.6965          ?        ?      690.6        3.2       ?       ? 
1 1 1   25    6   28 o    273.3    2.7    0.0000   0.0000          ?        ?   747.0703  14.6860          ?        ?      273.3        2.7       ?       ? 
1 1 1   25    6   29 o    375.1    2.7    0.0000   0.0000          ?        ?  1407.3016  20.4327          ?        ?      375.1        2.7       ?       ? 
1 1 1   25    6   30 o    409.9    2.5    0.0000   0.0000          ?        ?  1679.9504  20.4327          ?        ?      409.9        2.5       ?       ? 
1 1 1   25    6   31 f    653.0    2.9    0.0000   0.0000          ?        ?  4264.6860  38.3113          ?        ?      653.0        2.9       ?       ? 
1 1 1   25    6   32 o    564.5    2.7    0.0000   0.0000          ?        ?  3186.8616  30.0105          ?        ?      564.5        2.7       ?       ? 
1 1 1   25    6   33 o    849.5    3.4    0.0000   0.0000          ?        ?  7217.2104  58.1055          ?        ?      849.5        3.4       ?       ? 
1 1 1   25    6   34 o    472.8    2.7    0.0000   0.0000          ?        ?  2235.4644  25.5409          ?        ?      472.8        2.7       ?       ? 
1 1 1   25    6   35 o   1051.8    4.0    0.0000   0.0000          ?        ? 11064.3027  84.9234          ?        ?     1051.8        4.0       ?       ? 
1 1 1   25    6   36 o    310.2    3.1    0.0000   0.0000          ?        ?   962.2521  19.1556          ?        ?      310.2        3.1       ?       ? 
1 1 1   25    6   37 o    277.1    3.2    0.0000   0.0000          ?        ?   768.1415  17.8786          ?        ?      277.1        3.2       ?       ? 
1 1 1   25    6   38 o    406.4    2.6    0.0000   0.0000          ?        ?  1651.8555  21.0712          ?        ?      406.4        2.6       ?       ? 
1 1 1   25    6   39 o    217.4    4.0    0.0000   0.0000          ?        ?   472.5060  17.2401          ?        ?      217.4        4.0       ?       ? 
1 1 1   25    6   40 o    386.5    2.8    0.0000   0.0000          ?        ?  1494.1406  21.7097          ?        ?      386.5        2.8       ?       ? 
1 1 1   25    6   41 o    374.4    2.7    0.0000   0.0000          ?        ?  1401.5549  20.4327          ?        ?      374.4        2.7       ?       ? 
1 1 1   25    6   42 o    307.2    3.0    0.0000   0.0000          ?        ?   943.7350  18.5171          ?        ?      307.2        3.0       ?       ? 
1 1 1   25    6   43 o    368.9    2.7    0.0000   0.0000          ?        ?  1361.3281  19.7942          ?        ?      368.9        2.7       ?       ? 
1 1 1   25    6   44 o    434.9    2.6    0.0000   0.0000          ?        ?  1891.9395  22.3483          ?        ?      434.9        2.6       ?       ? 
1 1 1   25    6   45 o    250.4    3.4    0.0000   0.0000          ?        ?   627.0282  17.2401          ?        ?      250.4        3.4       ?       ? 
1 1 1   25    6   46 o    450.4    2.6    0.0000   0.0000          ?        ?  2029.2217  23.6253          ?        ?      450.4        2.6       ?       ? 
1 1 1   25    6   47 o     58.5   14.7    0.0000   0.0000          ?        ?    35.7572  17.2401          ?        ?       58.5       14.7       ?       ? 
1 1 1   25    6   48 o    331.2    2.9    0.0000   0.0000          ?        ?  1096.9802  19.1556          ?        ?      331.2        2.9       ?       ? 
1 1 1   25    6   49 o     85.2    9.7    0.0000   0.0000          ?        ?    72.7915  16.6016          ?        ?       85.2        9.7       ?       ? 
1 1 1   25    6   50 o    113.8    7.3    0.0000   0.0000          ?        ?   129.6199  16.6016          ?        ?      113.8        7.3       ?       ? 
1 1 1   25    6   51 o    370.0    2.8    0.0000   0.0000          ?        ?  1369.6289  20.4327          ?        ?      370.0        2.8       ?       ? 
1 1 1   25    6   52 o    149.0    5.8    0.0000   0.0000          ?        ?   222.2055  17.2401          ?        ?      149.0        5.8       ?       ? 
1 1 1   25    6   53 o    544.5    2.8    0.0000   0.0000          ?        ?  2965.9329  30.0105          ?        ?      544.5        2.8       ?       ? 
1 1 1   25    6   54 o    135.7    6.6    0.0000   0.0000          ?        ?   184.5327  17.8786          ?        ?      135.7        6.6       ?       ? 
1 1 1   25    6   55 o    390.4    2.9    0.0000   0.0000          ?        ?  1524.7897  22.3483          ?        ?      390.4        2.9       ?       ? 
1 1 1   25    6   56 o     46.2   16.2    0.0000   0.0000          ?        ?    19.1556  18.5171          ?        ?       46.2       16.2       ?       ? 
1 1 1   25    6   57 o    208.1    4.4    0.0000   0.0000          ?        ?   433.5562  18.5171          ?        ?      208.1        4.4       ?       ? 
1 1 1   25    6   58 o    235.7    4.1    0.0000   0.0000          ?        ?   556.1523  19.1556          ?        ?      235.7        4.1       ?       ? 
1 1 1   25    6   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    6   60 o    175.8    5.6    0.0000   0.0000          ?        ?   309.6830  19.7942          ?        ?      175.8        5.6       ?       ? 
1 1 1   25    6   61 o    126.1    8.1    0.0000   0.0000          ?        ?   159.6304  20.4327          ?        ?      126.1        8.1       ?       ? 
1 1 1   25    6   62 o     34.0   15.1    0.0000   0.0000          ?        ?    -7.0237  20.4327          ?        ?       34.0       15.1       ?       ? 
1 1 1   25    6   63 o    240.2    4.4    0.0000   0.0000          ?        ?   577.8621  21.0712          ?        ?      240.2        4.4       ?       ? 
1 1 1   25    6   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    6   65 o    122.9    8.3    0.0000   0.0000          ?        ?   151.9681  20.4327          ?        ?      122.9        8.3       ?       ? 
1 1 1   25    6   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    6   67 o    107.3   10.1    0.0000   0.0000          ?        ?   116.2109  21.7097          ?        ?      107.3       10.1       ?       ? 
1 1 1   25    6   68 o     98.9   10.3    0.0000   0.0000          ?        ?    98.9709  20.4327          ?        ?       98.9       10.3       ?       ? 
1 1 1   25    6   69 o    142.0    7.4    0.0000   0.0000          ?        ?   203.0499  21.0712          ?        ?      142.0        7.4       ?       ? 
1 1 1   25    6   70 o     39.6   16.2    0.0000   0.0000          ?        ?     6.3852  20.4327          ?        ?       39.6       16.2       ?       ? 
1 1 1   25    6   71 o     24.4   12.1    0.0000   0.0000          ?        ?   -48.5276  21.7097          ?        ?       24.4       12.1       ?       ? 
1 1 1   25    6   72 o     90.4   12.4    0.0000   0.0000          ?        ?    83.6463  22.3483          ?        ?       90.4       12.4       ?       ? 
1 1 1   25    6   73 o     62.3   17.6    0.0000   0.0000          ?        ?    42.1424  22.9868          ?        ?       62.3       17.6       ?       ? 
1 1 1   25    6   74 o    214.6    5.4    0.0000   0.0000          ?        ?   462.9282  22.9868          ?        ?      214.6        5.4       ?       ? 
1 1 1   25    7    0 o   2230.8   10.8 49775.9531 480.1682 49775.9531 480.1682 49775.9531 480.1682     2230.8     10.8     2230.8       10.8     0.0     0.0 
1 1 1   25    7    1 o    990.3    3.8    0.0000   0.0000          ?        ?  9807.0537  75.3456          ?        ?      990.3        3.8       ?       ? 
1 1 1   25    7    2 o   1497.3    5.4    0.0000   0.0000          ?        ? 22419.7715 162.1845          ?        ?     1497.3        5.4       ?       ? 
1 1 1   25    7    3 o    756.6    3.1    0.0000   0.0000          ?        ?  5724.9849  46.6121          ?        ?      756.6        3.1       ?       ? 
1 1 1   25    7    4 o    746.9    3.1    0.0000   0.0000          ?        ?  5579.4019  45.9736          ?        ?      746.9        3.1       ?       ? 
1 1 1   25    7    5 o   1751.5    5.9    0.0000   0.0000          ?        ? 30679.0508 207.5195          ?        ?     1751.5        5.9       ?       ? 
1 1 1   25    7    6 o    423.7    2.3    0.0000   0.0000          ?        ?  1794.8843  19.1556          ?        ?      423.7        2.3       ?       ? 
1 1 1   25    7    7 o    601.8    2.6    0.0000   0.0000          ?        ?  3621.6948  31.2876          ?        ?      601.8        2.6       ?       ? 
1 1 1   25    7    8 o    738.3    3.0    0.0000   0.0000          ?        ?  5451.0591  44.0580          ?        ?      738.3        3.0       ?       ? 
1 1 1   25    7    9 o   1007.2    3.7    0.0000   0.0000          ?        ? 10144.8320  75.3456          ?        ?     1007.2        3.7       ?       ? 
1 1 1   25    7   10 o    845.8    3.2    0.0000   0.0000          ?        ?  7154.6348  54.9129          ?        ?      845.8        3.2       ?       ? 
1 1 1   25    7   11 o   1505.3    5.3    0.0000   0.0000          ?        ? 22661.1328 158.9919          ?        ?     1505.3        5.3       ?       ? 
1 1 1   25    7   12 o    805.9    3.2    0.0000   0.0000          ?        ?  6494.4033  51.0817          ?        ?      805.9        3.2       ?       ? 
1 1 1   25    7   13 o   1872.8    6.6    0.0000   0.0000          ?        ? 35080.3789 247.1079          ?        ?     1872.8        6.6       ?       ? 
1 1 1   25    7   14 o   1134.4    4.2    0.0000   0.0000          ?        ? 12870.0420  95.1397          ?        ?     1134.4        4.2       ?       ? 
1 1 1   25    7   15 o   1693.2    5.9    0.0000   0.0000          ?        ? 28673.4531 198.5802          ?        ?     1693.2        5.9       ?       ? 
1 1 1   25    7   16 o   1017.4    3.8    0.0000   0.0000          ?        ? 10352.3516  76.6226          ?        ?     1017.4        3.8       ?       ? 
1 1 1   25    7   17 o   1289.0    4.7    0.0000   0.0000          ?        ? 16615.6094 121.9576          ?        ?     1289.0        4.7       ?       ? 
1 1 1   25    7   18 o   1479.8    5.2    0.0000   0.0000          ?        ? 21899.3750 153.8837          ?        ?     1479.8        5.2       ?       ? 
1 1 1   25    7   19 o    157.0    5.1    0.0000   0.0000          ?        ?   246.4693  15.9630          ?        ?      157.0        5.1       ?       ? 
1 1 1   25    7   20 o    262.5    2.6    0.0000   0.0000          ?        ?   688.9648  13.4090          ?        ?      262.5        2.6       ?       ? 
1 1 1   25    7   21 o    400.7    2.6    0.0000   0.0000          ?        ?  1605.8818  21.0712          ?        ?      400.7        2.6       ?       ? 
1 1 1   25    7   22 o    808.6    3.1    0.0000   0.0000          ?        ?  6537.8232  49.8047          ?        ?      808.6        3.1       ?       ? 
1 1 1   25    7   23 o   1278.9    4.7    0.0000   0.0000          ?        ? 16356.3711 120.0421          ?        ?     1278.9        4.7       ?       ? 
1 1 1   25    7   24 o    464.0    2.5    0.0000   0.0000          ?        ?  2153.0950  22.9868          ?        ?      464.0        2.5       ?       ? 
1 1 1   25    7   25 o    603.8    2.7    0.0000   0.0000          ?        ?  3645.3201  33.2031          ?        ?      603.8        2.7       ?       ? 
1 1 1   25    7   26 o   1353.0    4.6    0.0000   0.0000          ?        ? 18308.3301 123.8732          ?        ?     1353.0        4.6       ?       ? 
1 1 1   25    7   27 o    979.4    4.0    0.0000   0.0000          ?        ?  9592.5107  77.8996          ?        ?      979.4        4.0       ?       ? 
1 1 1   25    7   28 o    115.5    6.4    0.0000   0.0000          ?        ?   133.4510  14.6860          ?        ?      115.5        6.4       ?       ? 
1 1 1   25    7   29 o    490.2    2.5    0.0000   0.0000          ?        ?  2403.3953  24.2638          ?        ?      490.2        2.5       ?       ? 
1 1 1   25    7   30 o    389.9    2.5    0.0000   0.0000          ?        ?  1520.3201  19.7942          ?        ?      389.9        2.5       ?       ? 
1 1 1   25    7   31 o    494.8    2.5    0.0000   0.0000          ?        ?  2448.7305  24.9023          ?        ?      494.8        2.5       ?       ? 
1 1 1   25    7   32 o    111.0    7.5    0.0000   0.0000          ?        ?   123.2347  16.6016          ?        ?      111.0        7.5       ?       ? 
1 1 1   25    7   33 o    729.2    3.2    0.0000   0.0000          ?        ?  5317.6079  45.9736          ?        ?      729.2        3.2       ?       ? 
1 1 1   25    7   34 o    434.1    2.7    0.0000   0.0000          ?        ?  1884.2773  23.6253          ?        ?      434.1        2.7       ?       ? 
1 1 1   25    7   35 o    665.1    2.9    0.0000   0.0000          ?        ?  4423.6777  38.3113          ?        ?      665.1        2.9       ?       ? 
1 1 1   25    7   36 o    792.4    3.1    0.0000   0.0000          ?        ?  6279.8604  49.1662          ?        ?      792.4        3.1       ?       ? 
1 1 1   25    7   37 o    549.8    2.7    0.0000   0.0000          ?        ?  3022.7612  30.0105          ?        ?      549.8        2.7       ?       ? 
1 1 1   25    7   38 o    551.0    2.6    0.0000   0.0000          ?        ?  3036.1704  28.7335          ?        ?      551.0        2.6       ?       ? 
1 1 1   25    7   39 o    391.4    2.6    0.0000   0.0000          ?        ?  1531.8134  20.4327          ?        ?      391.4        2.6       ?       ? 
1 1 1   25    7   40 f    839.4    3.2    0.0000   0.0000          ?        ?  7047.3628  52.9973          ?        ?      839.4        3.2       ?       ? 
1 1 1   25    7   41 o    421.7    2.6    0.0000   0.0000          ?        ?  1778.2827  21.7097          ?        ?      421.7        2.6       ?       ? 
1 1 1   25    7   42 o    491.0    2.7    0.0000   0.0000          ?        ?  2411.0576  26.8179          ?        ?      491.0        2.7       ?       ? 
1 1 1   25    7   43 o    419.8    2.7    0.0000   0.0000          ?        ?  1762.3197  22.3483          ?        ?      419.8        2.7       ?       ? 
1 1 1   25    7   44 o    110.7    7.5    0.0000   0.0000          ?        ?   122.5962  16.6016          ?        ?      110.7        7.5       ?       ? 
1 1 1   25    7   45 o    308.3    3.0    0.0000   0.0000          ?        ?   950.7587  18.5171          ?        ?      308.3        3.0       ?       ? 
1 1 1   25    7   46 o    479.3    2.5    0.0000   0.0000          ?        ?  2298.0393  24.2638          ?        ?      479.3        2.5       ?       ? 
1 1 1   25    7   47 o    355.1    2.9    0.0000   0.0000          ?        ?  1261.0802  20.4327          ?        ?      355.1        2.9       ?       ? 
1 1 1   25    7   48 o    505.1    2.5    0.0000   0.0000          ?        ?  2552.1709  24.9023          ?        ?      505.1        2.5       ?       ? 
1 1 1   25    7   49 o    142.9    6.0    0.0000   0.0000          ?        ?   204.3269  17.2401          ?        ?      142.9        6.0       ?       ? 
1 1 1   25    7   50 o    217.3    4.1    0.0000   0.0000          ?        ?   472.5060  17.8786          ?        ?      217.3        4.1       ?       ? 
1 1 1   25    7   51 o    185.3    4.8    0.0000   0.0000          ?        ?   343.5246  17.8786          ?        ?      185.3        4.8       ?       ? 
1 1 1   25    7   52 o    378.1    2.9    0.0000   0.0000          ?        ?  1430.2885  21.7097          ?        ?      378.1        2.9       ?       ? 
1 1 1   25    7   53 o    194.0    4.6    0.0000   0.0000          ?        ?   376.7278  17.8786          ?        ?      194.0        4.6       ?       ? 
1 1 1   25    7   54 o    425.7    2.9    0.0000   0.0000          ?        ?  1812.7628  24.9023          ?        ?      425.7        2.9       ?       ? 
1 1 1   25    7   55 o    576.2    2.8    0.0000   0.0000          ?        ?  3320.9509  31.9261          ?        ?      576.2        2.8       ?       ? 
1 1 1   25    7   56 f    362.8    3.0    0.0000   0.0000          ?        ?  1316.6316  21.7097          ?        ?      362.8        3.0       ?       ? 
1 1 1   25    7   57 o     31.5   14.0    0.0000   0.0000          ?        ?    -7.0237  17.8786          ?        ?       31.5       14.0       ?       ? 
1 1 1   25    7   58 o    447.6    2.8    0.0000   0.0000          ?        ?  2004.3193  24.9023          ?        ?      447.6        2.8       ?       ? 
1 1 1   25    7   59 o    134.7    7.1    0.0000   0.0000          ?        ?   181.9787  19.1556          ?        ?      134.7        7.1       ?       ? 
1 1 1   25    7   60 o    212.3    4.7    0.0000   0.0000          ?        ?   451.4348  19.7942          ?        ?      212.3        4.7       ?       ? 
1 1 1   25    7   61 o    101.7    9.4    0.0000   0.0000          ?        ?   104.0790  19.1556          ?        ?      101.7        9.4       ?       ? 
1 1 1   25    7   62 o     58.8   15.9    0.0000   0.0000          ?        ?    36.3957  19.1556          ?        ?       58.8       15.9       ?       ? 
1 1 1   25    7   63 o    210.6    5.0    0.0000   0.0000          ?        ?   444.4110  21.0712          ?        ?      210.6        5.0       ?       ? 
1 1 1   25    7   64 o     40.6   16.5    0.0000   0.0000          ?        ?     7.0237  21.0712          ?        ?       40.6       16.5       ?       ? 
1 1 1   25    7   65 o     64.9   15.4    0.0000   0.0000          ?        ?    44.6965  19.7942          ?        ?       64.9       15.4       ?       ? 
1 1 1   25    7   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    7   67 o    186.2    5.7    0.0000   0.0000          ?        ?   347.9943  21.0712          ?        ?      186.2        5.7       ?       ? 
1 1 1   25    7   68 o    225.0    5.0    0.0000   0.0000          ?        ?   507.6247  22.3483          ?        ?      225.0        5.0       ?       ? 
1 1 1   25    7   69 o    165.1    6.4    0.0000   0.0000          ?        ?   273.9258  21.0712          ?        ?      165.1        6.4       ?       ? 
1 1 1   25    7   70 o    163.9    6.4    0.0000   0.0000          ?        ?   270.0946  21.0712          ?        ?      163.9        6.4       ?       ? 
1 1 1   25    7   71 f     73.9   14.8    0.0000   0.0000          ?        ?    58.1055  21.0712          ?        ?       73.9       14.8       ?       ? 
1 1 1   25    7   72 o     46.9   16.9    0.0000   0.0000          ?        ?    19.7942  20.4327          ?        ?       46.9       16.9       ?       ? 
1 1 1   25    7   73 o     44.9   16.8    0.0000   0.0000          ?        ?    16.6016  20.4327          ?        ?       44.9       16.8       ?       ? 
1 1 1   25    7   74 o     49.7   17.3    0.0000   0.0000          ?        ?    24.2638  21.0712          ?        ?       49.7       17.3       ?       ? 
1 1 1   25    8    0 o    525.4    3.3 2760.3289  35.1187  2760.3289  35.1187  2760.3289  35.1187      525.4      3.3      525.4        3.3     0.0     0.0 
1 1 1   25    8    1 o    938.1    3.4    0.0000   0.0000          ?        ?  8800.1045  63.8522          ?        ?      938.1        3.4       ?       ? 
1 1 1   25    8    2 o    736.0    2.9    0.0000   0.0000          ?        ?  5417.2178  42.1424          ?        ?      736.0        2.9       ?       ? 
1 1 1   25    8    3 o    857.9    3.2    0.0000   0.0000          ?        ?  7360.2383  55.5514          ?        ?      857.9        3.2       ?       ? 
1 1 1   25    8    4 o   1344.7    4.6    0.0000   0.0000          ?        ? 18083.5723 123.8732          ?        ?     1344.7        4.6       ?       ? 
1 1 1   25    8    5 o    471.0    2.2    0.0000   0.0000          ?        ?  2218.2241  21.0712          ?        ?      471.0        2.2       ?       ? 
1 1 1   25    8    6 o    139.6    3.2    0.0000   0.0000          ?        ?   194.7491   8.9393          ?        ?      139.6        3.2       ?       ? 
1 1 1   25    8    7 o    465.7    2.3    0.0000   0.0000          ?        ?  2169.0581  21.7097          ?        ?      465.7        2.3       ?       ? 
1 1 1   25    8    8 o    974.3    3.5    0.0000   0.0000          ?        ?  9492.2627  68.3218          ?        ?      974.3        3.5       ?       ? 
1 1 1   25    8    9 o   1289.4    4.5    0.0000   0.0000          ?        ? 16627.1035 115.5724          ?        ?     1289.4        4.5       ?       ? 
1 1 1   25    8   10 o    841.5    3.2    0.0000   0.0000          ?        ?  7081.2051  53.6358          ?        ?      841.5        3.2       ?       ? 
1 1 1   25    8   11 o   1636.5    5.5    0.0000   0.0000          ?        ? 26782.7891 181.3401          ?        ?     1636.5        5.5       ?       ? 
1 1 1   25    8   12 o    440.2    2.2    0.0000   0.0000          ?        ?  1937.9131  19.7942          ?        ?      440.2        2.2       ?       ? 
1 1 1   25    8   13 o    263.4    2.4    0.0000   0.0000          ?        ?   694.0730  12.7704          ?        ?      263.4        2.4       ?       ? 
1 1 1   25    8   14 o    490.9    2.3    0.0000   0.0000          ?        ?  2409.7805  22.3483          ?        ?      490.9        2.3       ?       ? 
1 1 1   25    8   15 o    675.7    2.7    0.0000   0.0000          ?        ?  4566.0679  36.3957          ?        ?      675.7        2.7       ?       ? 
1 1 1   25    8   16 o    531.5    2.5    0.0000   0.0000          ?        ?  2825.4583  26.8179          ?        ?      531.5        2.5       ?       ? 
1 1 1   25    8   17 o    780.4    3.1    0.0000   0.0000          ?        ?  6090.8579  49.1662          ?        ?      780.4        3.1       ?       ? 
1 1 1   25    8   18 o   1153.4    4.1    0.0000   0.0000          ?        ? 13303.5977  94.5012          ?        ?     1153.4        4.1       ?       ? 
1 1 1   25    8   19 o   1079.0    4.1    0.0000   0.0000          ?        ? 11644.0801  87.4775          ?        ?     1079.0        4.1       ?       ? 
1 1 1   25    8   20 o   1304.1    4.5    0.0000   0.0000          ?        ? 17007.6621 118.1265          ?        ?     1304.1        4.5       ?       ? 
1 1 1   25    8   21 o    616.4    2.7    0.0000   0.0000          ?        ?  3799.8420  33.2031          ?        ?      616.4        2.7       ?       ? 
1 1 1   25    8   22 o    535.6    2.5    0.0000   0.0000          ?        ?  2868.2393  26.8179          ?        ?      535.6        2.5       ?       ? 
1 1 1   25    8   23 o    465.2    2.6    0.0000   0.0000          ?        ?  2164.5884  24.2638          ?        ?      465.2        2.6       ?       ? 
1 1 1   25    8   24 o    463.8    2.8    0.0000   0.0000          ?        ?  2151.1792  25.5409          ?        ?      463.8        2.8       ?       ? 
1 1 1   25    8   25 o    534.2    2.6    0.0000   0.0000          ?        ?  2853.5532  27.4564          ?        ?      534.2        2.6       ?       ? 
1 1 1   25    8   26 o   1279.5    4.6    0.0000   0.0000          ?        ? 16372.9717 117.4880          ?        ?     1279.5        4.6       ?       ? 
1 1 1   25    8   27 o    440.0    2.5    0.0000   0.0000          ?        ?  1935.9977  22.3483          ?        ?      440.0        2.5       ?       ? 
1 1 1   25    8   28 o    980.9    3.5    0.0000   0.0000          ?        ?  9621.8828  69.5989          ?        ?      980.9        3.5       ?       ? 
1 1 1   25    8   29 o    674.3    3.3    0.0000   0.0000          ?        ?  4547.5513  44.6965          ?        ?      674.3        3.3       ?       ? 
1 1 1   25    8   30 o    493.5    2.8    0.0000   0.0000          ?        ?  2435.9600  28.0950          ?        ?      493.5        2.8       ?       ? 
1 1 1   25    8   31 o    345.6    2.7    0.0000   0.0000          ?        ?  1194.6740  18.5171          ?        ?      345.6        2.7       ?       ? 
1 1 1   25    8   32 o    668.3    3.0    0.0000   0.0000          ?        ?  4467.0972  39.5883          ?        ?      668.3        3.0       ?       ? 
1 1 1   25    8   33 o    222.1    4.2    0.0000   0.0000          ?        ?   493.5772  18.5171          ?        ?      222.1        4.2       ?       ? 
1 1 1   25    8   34 o   1027.2    3.9    0.0000   0.0000          ?        ? 10552.2080  81.0922          ?        ?     1027.2        3.9       ?       ? 
1 1 1   25    8   35 o    760.7    3.1    0.0000   0.0000          ?        ?  5786.9214  46.6121          ?        ?      760.7        3.1       ?       ? 
1 1 1   25    8   36 o    247.7    3.5    0.0000   0.0000          ?        ?   613.6193  17.2401          ?        ?      247.7        3.5       ?       ? 
1 1 1   25    8   37 f    376.7    2.7    0.0000   0.0000          ?        ?  1419.4336  20.4327          ?        ?      376.7        2.7       ?       ? 
1 1 1   25    8   38 o    486.1    2.8    0.0000   0.0000          ?        ?  2363.1685  26.8179          ?        ?      486.1        2.8       ?       ? 
1 1 1   25    8   39 f    453.0    2.6    0.0000   0.0000          ?        ?  2052.2085  23.6253          ?        ?      453.0        2.6       ?       ? 
1 1 1   25    8   40 o    663.4    2.8    0.0000   0.0000          ?        ?  4401.3296  37.6728          ?        ?      663.4        2.8       ?       ? 
1 1 1   25    8   41 o     30.8   13.6    0.0000   0.0000          ?        ?    -5.7467  16.6016          ?        ?       30.8       13.6       ?       ? 
1 1 1   25    8   42 o    266.6    3.2    0.0000   0.0000          ?        ?   710.6746  17.2401          ?        ?      266.6        3.2       ?       ? 
1 1 1   25    8   43 o    678.4    2.8    0.0000   0.0000          ?        ?  4602.4639  38.3113          ?        ?      678.4        2.8       ?       ? 
1 1 1   25    8   44 o    144.2    5.8    0.0000   0.0000          ?        ?   208.1580  16.6016          ?        ?      144.2        5.8       ?       ? 
1 1 1   25    8   45 o    157.7    5.3    0.0000   0.0000          ?        ?   249.0234  16.6016          ?        ?      157.7        5.3       ?       ? 
1 1 1   25    8   46 o    309.9    3.0    0.0000   0.0000          ?        ?   960.3365  18.5171          ?        ?      309.9        3.0       ?       ? 
1 1 1   25    8   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    8   48 o    368.3    2.8    0.0000   0.0000          ?        ?  1356.8584  20.4327          ?        ?      368.3        2.8       ?       ? 
1 1 1   25    8   49 o    252.8    3.5    0.0000   0.0000          ?        ?   639.1602  17.8786          ?        ?      252.8        3.5       ?       ? 
1 1 1   25    8   50 o    317.4    3.0    0.0000   0.0000          ?        ?  1007.5872  19.1556          ?        ?      317.4        3.0       ?       ? 
1 1 1   25    8   51 o    309.7    3.3    0.0000   0.0000          ?        ?   959.6980  20.4327          ?        ?      309.7        3.3       ?       ? 
1 1 1   25    8   52 o    380.2    2.9    0.0000   0.0000          ?        ?  1445.6129  21.7097          ?        ?      380.2        2.9       ?       ? 
1 1 1   25    8   53 o    180.4    4.8    0.0000   0.0000          ?        ?   325.6460  17.2401          ?        ?      180.4        4.8       ?       ? 
1 1 1   25    8   54 o    176.1    5.1    0.0000   0.0000          ?        ?   310.3215  17.8786          ?        ?      176.1        5.1       ?       ? 
1 1 1   25    8   55 o    157.5    5.5    0.0000   0.0000          ?        ?   248.3849  17.2401          ?        ?      157.5        5.5       ?       ? 
1 1 1   25    8   56 o    284.2    3.5    0.0000   0.0000          ?        ?   808.3683  19.7942          ?        ?      284.2        3.5       ?       ? 
1 1 1   25    8   57 o    173.3    5.3    0.0000   0.0000          ?        ?   300.7437  18.5171          ?        ?      173.3        5.3       ?       ? 
1 1 1   25    8   58 o    233.5    4.1    0.0000   0.0000          ?        ?   545.9360  19.1556          ?        ?      233.5        4.1       ?       ? 
1 1 1   25    8   59 o    157.8    6.1    0.0000   0.0000          ?        ?   249.6619  19.1556          ?        ?      157.8        6.1       ?       ? 
1 1 1   25    8   60 o     47.8   16.5    0.0000   0.0000          ?        ?    21.0712  19.1556          ?        ?       47.8       16.5       ?       ? 
1 1 1   25    8   61 o    293.5    3.6    0.0000   0.0000          ?        ?   862.0042  21.0712          ?        ?      293.5        3.6       ?       ? 
1 1 1   25    8   62 o    117.4    8.7    0.0000   0.0000          ?        ?   138.5592  20.4327          ?        ?      117.4        8.7       ?       ? 
1 1 1   25    8   63 o    294.1    3.7    0.0000   0.0000          ?        ?   865.8354  21.7097          ?        ?      294.1        3.7       ?       ? 
1 1 1   25    8   64 o    119.8    8.5    0.0000   0.0000          ?        ?   144.3059  20.4327          ?        ?      119.8        8.5       ?       ? 
1 1 1   25    8   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    8   66 o    279.3    4.0    0.0000   0.0000          ?        ?   781.5505  22.3483          ?        ?      279.3        4.0       ?       ? 
1 1 1   25    8   67 o    177.1    5.9    0.0000   0.0000          ?        ?   314.7912  21.0712          ?        ?      177.1        5.9       ?       ? 
1 1 1   25    8   68 o    227.8    4.6    0.0000   0.0000          ?        ?   520.3951  21.0712          ?        ?      227.8        4.6       ?       ? 
1 1 1   25    8   69 o     26.7   12.9    0.0000   0.0000          ?        ?   -30.6490  20.4327          ?        ?       26.7       12.9       ?       ? 
1 1 1   25    8   70 o     67.2   15.9    0.0000   0.0000          ?        ?    48.5276  21.0712          ?        ?       67.2       15.9       ?       ? 
1 1 1   25    8   71 f    148.9    7.3    0.0000   0.0000          ?        ?   223.4826  21.7097          ?        ?      148.9        7.3       ?       ? 
1 1 1   25    8   72 o    110.4    9.5    0.0000   0.0000          ?        ?   123.8732  21.0712          ?        ?      110.4        9.5       ?       ? 
1 1 1   25    8   73 o    108.1    9.5    0.0000   0.0000          ?        ?   118.7650  20.4327          ?        ?      108.1        9.5       ?       ? 
1 1 1   25    8   74 o    117.8    8.9    0.0000   0.0000          ?        ?   141.1133  21.0712          ?        ?      117.8        8.9       ?       ? 
1 1 1   25    9    0 o   2789.2   14.7 77828.7656 821.7773 77828.7656 821.7773 77828.7656 821.7773     2789.2     14.7     2789.2       14.7     0.0     0.0 
1 1 1   25    9    1 o    640.6    2.8    0.0000   0.0000          ?        ?  4104.4170  35.7572          ?        ?      640.6        2.8       ?       ? 
1 1 1   25    9    2 f    540.7    2.3    0.0000   0.0000          ?        ?  2923.7905  24.9023          ?        ?      540.7        2.3       ?       ? 
1 1 1   25    9    3 o    704.5    2.8    0.0000   0.0000          ?        ?  4963.2285  38.9498          ?        ?      704.5        2.8       ?       ? 
1 1 1   25    9    4 o   1709.8    5.8    0.0000   0.0000          ?        ? 29238.5449 198.5802          ?        ?     1709.8        5.8       ?       ? 
1 1 1   25    9    5 o    578.9    2.4    0.0000   0.0000          ?        ?  3351.6001  28.0950          ?        ?      578.9        2.4       ?       ? 
1 1 1   25    9    6 o   1416.3    4.8    0.0000   0.0000          ?        ? 20060.4336 135.3666          ?        ?     1416.3        4.8       ?       ? 
1 1 1   25    9    7 o    148.2    2.6    0.0000   0.0000          ?        ?   219.6514   7.6623          ?        ?      148.2        2.6       ?       ? 
1 1 1   25    9    8 o    360.7    2.2    0.0000   0.0000          ?        ?  1301.3071  15.9630          ?        ?      360.7        2.2       ?       ? 
1 1 1   25    9    9 o    649.3    2.7    0.0000   0.0000          ?        ?  4216.1582  35.1187          ?        ?      649.3        2.7       ?       ? 
1 1 1   25    9   10 o    595.6    2.5    0.0000   0.0000          ?        ?  3547.6260  30.0105          ?        ?      595.6        2.5       ?       ? 
1 1 1   25    9   11 o   1282.6    4.5    0.0000   0.0000          ?        ? 16450.8711 116.2109          ?        ?     1282.6        4.5       ?       ? 
1 1 1   25    9   12 o     96.9    5.6    0.0000   0.0000          ?        ?    93.8627  10.8549          ?        ?       96.9        5.6       ?       ? 
1 1 1   25    9   13 f     38.7   14.0    0.0000   0.0000          ?        ?    12.1319  14.0475          ?        ?       38.7       14.0       ?       ? 
1 1 1   25    9   14 o   1148.6    4.1    0.0000   0.0000          ?        ? 13194.4102  94.5012          ?        ?     1148.6        4.1       ?       ? 
1 1 1   25    9   15 o    600.4    2.6    0.0000   0.0000          ?        ?  3604.4546  31.2876          ?        ?      600.4        2.6       ?       ? 
1 1 1   25    9   16 o   1616.9    5.6    0.0000   0.0000          ?        ? 26146.8223 182.6172          ?        ?     1616.9        5.6       ?       ? 
1 1 1   25    9   17 o    957.4    3.7    0.0000   0.0000          ?        ?  9166.6162  70.8759          ?        ?      957.4        3.7       ?       ? 
1 1 1   25    9   18 o   1094.9    4.0    0.0000   0.0000          ?        ? 11988.2432  87.4775          ?        ?     1094.9        4.0       ?       ? 
1 1 1   25    9   19 o    389.2    2.5    0.0000   0.0000          ?        ?  1514.5732  19.7942          ?        ?      389.2        2.5       ?       ? 
1 1 1   25    9   20 o    664.9    3.1    0.0000   0.0000          ?        ?  4421.7622  40.8654          ?        ?      664.9        3.1       ?       ? 
1 1 1   25    9   21 o    278.1    2.5    0.0000   0.0000          ?        ?   773.2497  14.0475          ?        ?      278.1        2.5       ?       ? 
1 1 1   25    9   22 o   1329.1    4.7    0.0000   0.0000          ?        ? 17667.2539 125.7888          ?        ?     1329.1        4.7       ?       ? 
1 1 1   25    9   23 o    402.9    2.8    0.0000   0.0000          ?        ?  1623.1219  22.3483          ?        ?      402.9        2.8       ?       ? 
1 1 1   25    9   24 o   1814.8    6.4    0.0000   0.0000          ?        ? 32941.3320 230.5063          ?        ?     1814.8        6.4       ?       ? 
1 1 1   25    9   25 o    980.4    3.8    0.0000   0.0000          ?        ?  9611.6660  74.0685          ?        ?      980.4        3.8       ?       ? 
1 1 1   25    9   26 f    538.8    2.7    0.0000   0.0000          ?        ?  2902.7192  29.3720          ?        ?      538.8        2.7       ?       ? 
1 1 1   25    9   27 o     36.9   14.8    0.0000   0.0000          ?        ?     6.3852  16.6016          ?        ?       36.9       14.8       ?       ? 
1 1 1   25    9   28 o    411.3    2.6    0.0000   0.0000          ?        ?  1692.0823  21.7097          ?        ?      411.3        2.6       ?       ? 
1 1 1   25    9   29 o    852.2    3.5    0.0000   0.0000          ?        ?  7263.8218  60.0210          ?        ?      852.2        3.5       ?       ? 
1 1 1   25    9   30 o     96.5    7.6    0.0000   0.0000          ?        ?    93.2242  14.6860          ?        ?       96.5        7.6       ?       ? 
1 1 1   25    9   31 o    557.8    3.0    0.0000   0.0000          ?        ?  3112.1543  33.2031          ?        ?      557.8        3.0       ?       ? 
1 1 1   25    9   32 o    347.0    2.9    0.0000   0.0000          ?        ?  1204.2518  20.4327          ?        ?      347.0        2.9       ?       ? 
1 1 1   25    9   33 o   1215.7    4.6    0.0000   0.0000          ?        ? 14781.1367 111.7413          ?        ?     1215.7        4.6       ?       ? 
1 1 1   25    9   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    9   35 o    180.4    4.4    0.0000   0.0000          ?        ?   325.6460  15.9630          ?        ?      180.4        4.4       ?       ? 
1 1 1   25    9   36 o    659.5    2.8    0.0000   0.0000          ?        ?  4349.6094  37.0343          ?        ?      659.5        2.8       ?       ? 
1 1 1   25    9   37 o    300.6    3.1    0.0000   0.0000          ?        ?   903.5081  18.5171          ?        ?      300.6        3.1       ?       ? 
1 1 1   25    9   38 o    146.9    5.4    0.0000   0.0000          ?        ?   215.8203  15.9630          ?        ?      146.9        5.4       ?       ? 
1 1 1   25    9   39 o    263.6    3.3    0.0000   0.0000          ?        ?   694.7115  17.2401          ?        ?      263.6        3.3       ?       ? 
1 1 1   25    9   40 o    364.2    2.7    0.0000   0.0000          ?        ?  1326.8479  19.7942          ?        ?      364.2        2.7       ?       ? 
1 1 1   25    9   41 o    686.5    3.0    0.0000   0.0000          ?        ?  4714.2051  40.8654          ?        ?      686.5        3.0       ?       ? 
1 1 1   25    9   42 o    344.9    3.0    0.0000   0.0000          ?        ?  1189.5658  20.4327          ?        ?      344.9        3.0       ?       ? 
1 1 1   25    9   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    9   44 o    126.8    6.3    0.0000   0.0000          ?        ?   160.9075  15.9630          ?        ?      126.8        6.3       ?       ? 
1 1 1   25    9   45 o    154.1    5.4    0.0000   0.0000          ?        ?   237.5300  16.6016          ?        ?      154.1        5.4       ?       ? 
1 1 1   25    9   46 o    486.5    2.6    0.0000   0.0000          ?        ?  2366.9998  25.5409          ?        ?      486.5        2.6       ?       ? 
1 1 1   25    9   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25    9   48 f    516.8    2.7    0.0000   0.0000          ?        ?  2670.9358  28.0950          ?        ?      516.8        2.7       ?       ? 
1 1 1   25    9   49 o    695.6    3.0    0.0000   0.0000          ?        ?  4839.3555  41.5039          ?        ?      695.6        3.0       ?       ? 
1 1 1   25    9   50 o    154.2    5.8    0.0000   0.0000          ?        ?   238.1686  17.8786          ?        ?      154.2        5.8       ?       ? 
1 1 1   25    9   51 o    186.3    4.6    0.0000   0.0000          ?        ?   347.3558  17.2401          ?        ?      186.3        4.6       ?       ? 
1 1 1   25    9   52 o    311.5    3.2    0.0000   0.0000          ?        ?   970.5529  19.7942          ?        ?      311.5        3.2       ?       ? 
1 1 1   25    9   53 o    143.9    6.7    0.0000   0.0000          ?        ?   207.5195  19.1556          ?        ?      143.9        6.7       ?       ? 
1 1 1   25    9   54 o    474.1    2.7    0.0000   0.0000          ?        ?  2248.2346  25.5409          ?        ?      474.1        2.7       ?       ? 
1 1 1   25    9   55 o     19.7    9.9    0.0000   0.0000          ?        ?   -65.7677  19.1556          ?        ?       19.7        9.9       ?       ? 
1 1 1   25    9   56 o    243.5    3.8    0.0000   0.0000          ?        ?   593.1866  18.5171          ?        ?      243.5        3.8       ?       ? 
1 1 1   25    9   57 o    311.6    3.3    0.0000   0.0000          ?        ?   971.8299  20.4327          ?        ?      311.6        3.3       ?       ? 
1 1 1   25    9   58 f    132.5    7.5    0.0000   0.0000          ?        ?   176.2320  19.7942          ?        ?      132.5        7.5       ?       ? 
1 1 1   25    9   59 o    187.8    5.3    0.0000   0.0000          ?        ?   353.1024  19.7942          ?        ?      187.8        5.3       ?       ? 
1 1 1   25    9   60 o    340.7    3.3    0.0000   0.0000          ?        ?  1161.4708  22.3483          ?        ?      340.7        3.3       ?       ? 
1 1 1   25    9   61 o     43.6   16.3    0.0000   0.0000          ?        ?    14.6860  19.1556          ?        ?       43.6       16.3       ?       ? 
1 1 1   25    9   62 o     19.6    9.9    0.0000   0.0000          ?        ?   -71.5144  19.7942          ?        ?       19.6        9.9       ?       ? 
1 1 1   25    9   63 o     84.1   11.8    0.0000   0.0000          ?        ?    71.5144  19.7942          ?        ?       84.1       11.8       ?       ? 
1 1 1   25    9   64 o    332.0    3.4    0.0000   0.0000          ?        ?  1103.3654  22.3483          ?        ?      332.0        3.4       ?       ? 
1 1 1   25    9   65 o    300.9    3.5    0.0000   0.0000          ?        ?   906.7007  21.0712          ?        ?      300.9        3.5       ?       ? 
1 1 1   25    9   66 o     28.5   13.5    0.0000   0.0000          ?        ?   -23.6253  20.4327          ?        ?       28.5       13.5       ?       ? 
1 1 1   25    9   67 o     30.3   14.0    0.0000   0.0000          ?        ?   -15.3245  19.7942          ?        ?       30.3       14.0       ?       ? 
1 1 1   25    9   68 o    244.7    4.4    0.0000   0.0000          ?        ?   600.2103  21.7097          ?        ?      244.7        4.4       ?       ? 
1 1 1   25    9   69 o    129.3    7.7    0.0000   0.0000          ?        ?   168.5697  19.7942          ?        ?      129.3        7.7       ?       ? 
1 1 1   25    9   70 o    163.3    6.3    0.0000   0.0000          ?        ?   268.1791  20.4327          ?        ?      163.3        6.3       ?       ? 
1 1 1   25    9   71 o    190.2    5.4    0.0000   0.0000          ?        ?   363.3188  20.4327          ?        ?      190.2        5.4       ?       ? 
1 1 1   25    9   72 o     68.7   15.7    0.0000   0.0000          ?        ?    51.0817  21.0712          ?        ?       68.7       15.7       ?       ? 
1 1 1   25    9   73 o     34.7   15.4    0.0000   0.0000          ?        ?    -5.1082  21.0712          ?        ?       34.7       15.4       ?       ? 
1 1 1   25   10    0 o   1256.2    6.8 15782.9775 169.8468 15782.9775 169.8468 15782.9775 169.8468     1256.2      6.8     1256.2        6.8     0.0     0.0 
1 1 1   25   10    1 o   1104.1    4.0    0.0000   0.0000          ?        ? 12191.9316  88.7545          ?        ?     1104.1        4.0       ?       ? 
1 1 1   25   10    2 o   1291.4    4.5    0.0000   0.0000          ?        ? 16679.4609 115.5724          ?        ?     1291.4        4.5       ?       ? 
1 1 1   25   10    3 o   1261.7    4.3    0.0000   0.0000          ?        ? 15919.6211 109.1872          ?        ?     1261.7        4.3       ?       ? 
1 1 1   25   10    4 o   1134.8    4.0    0.0000   0.0000          ?        ? 12877.7041  91.3086          ?        ?     1134.8        4.0       ?       ? 
1 1 1   25   10    5 o    651.7    2.6    0.0000   0.0000          ?        ?  4247.4458  34.4802          ?        ?      651.7        2.6       ?       ? 
1 1 1   25   10    6 o    946.9    3.4    0.0000   0.0000          ?        ?  8966.7598  64.4907          ?        ?      946.9        3.4       ?       ? 
1 1 1   25   10    7 o   1339.0    4.5    0.0000   0.0000          ?        ? 17931.6035 121.3191          ?        ?     1339.0        4.5       ?       ? 
1 1 1   25   10    8 o   1263.3    4.4    0.0000   0.0000          ?        ? 15959.2090 112.3798          ?        ?     1263.3        4.4       ?       ? 
1 1 1   25   10    9 o   1992.3    6.8    0.0000   0.0000          ?        ? 39701.3594 272.0102          ?        ?     1992.3        6.8       ?       ? 
1 1 1   25   10   10 o    856.2    3.2    0.0000   0.0000          ?        ?  7331.5049  54.9129          ?        ?      856.2        3.2       ?       ? 
1 1 1   25   10   11 o    862.7    3.2    0.0000   0.0000          ?        ?  7443.2461  55.5514          ?        ?      862.7        3.2       ?       ? 
1 1 1   25   10   12 o    890.2    3.4    0.0000   0.0000          ?        ?  7924.6919  60.0210          ?        ?      890.2        3.4       ?       ? 
1 1 1   25   10   13 o   1801.2    6.1    0.0000   0.0000          ?        ? 32447.7539 218.3744          ?        ?     1801.2        6.1       ?       ? 
1 1 1   25   10   14 o   1443.6    4.9    0.0000   0.0000          ?        ? 20842.6230 140.4748          ?        ?     1443.6        4.9       ?       ? 
1 1 1   25   10   15 o    370.6    2.6    0.0000   0.0000          ?        ?  1373.4601  19.1556          ?        ?      370.6        2.6       ?       ? 
1 1 1   25   10   16 o   1329.4    4.8    0.0000   0.0000          ?        ? 17675.5547 128.3428          ?        ?     1329.4        4.8       ?       ? 
1 1 1   25   10   17 o   1271.2    4.5    0.0000   0.0000          ?        ? 16160.9824 114.9339          ?        ?     1271.2        4.5       ?       ? 
1 1 1   25   10   18 o    590.5    2.9    0.0000   0.0000          ?        ?  3486.9666  33.8416          ?        ?      590.5        2.9       ?       ? 
1 1 1   25   10   19 o    592.1    2.6    0.0000   0.0000          ?        ?  3505.4836  31.2876          ?        ?      592.1        2.6       ?       ? 
1 1 1   25   10   20 o    650.6    3.0    0.0000   0.0000          ?        ?  4232.7603  38.9498          ?        ?      650.6        3.0       ?       ? 
1 1 1   25   10   21 f    472.0    2.4    0.0000   0.0000          ?        ?  2227.8020  22.9868          ?        ?      472.0        2.4       ?       ? 
1 1 1   25   10   22 o   1487.9    5.3    0.0000   0.0000          ?        ? 22140.7383 158.9919          ?        ?     1487.9        5.3       ?       ? 
1 1 1   25   10   23 o    656.2    2.9    0.0000   0.0000          ?        ?  4305.5513  38.3113          ?        ?      656.2        2.9       ?       ? 
1 1 1   25   10   24 o   1024.3    3.9    0.0000   0.0000          ?        ? 10492.8262  80.4537          ?        ?     1024.3        3.9       ?       ? 
1 1 1   25   10   25 o    729.9    3.1    0.0000   0.0000          ?        ?  5328.4629  45.3350          ?        ?      729.9        3.1       ?       ? 
1 1 1   25   10   26 o    192.6    3.5    0.0000   0.0000          ?        ?   370.9810  13.4090          ?        ?      192.6        3.5       ?       ? 
1 1 1   25   10   27 o    718.1    2.9    0.0000   0.0000          ?        ?  5157.3394  42.1424          ?        ?      718.1        2.9       ?       ? 
1 1 1   25   10   28 o    309.7    2.9    0.0000   0.0000          ?        ?   959.0594  17.8786          ?        ?      309.7        2.9       ?       ? 
1 1 1   25   10   29 o    582.9    2.8    0.0000   0.0000          ?        ?  3397.5735  32.5646          ?        ?      582.9        2.8       ?       ? 
1 1 1   25   10   30 o     65.5   14.5    0.0000   0.0000          ?        ?    44.6965  18.5171          ?        ?       65.5       14.5       ?       ? 
1 1 1   25   10   31 o    670.4    3.6    0.0000   0.0000          ?        ?  4495.1924  47.8891          ?        ?      670.4        3.6       ?       ? 
1 1 1   25   10   32 o    793.5    3.3    0.0000   0.0000          ?        ?  6296.4614  51.7203          ?        ?      793.5        3.3       ?       ? 
1 1 1   25   10   33 o    486.8    2.6    0.0000   0.0000          ?        ?  2370.1924  24.9023          ?        ?      486.8        2.6       ?       ? 
1 1 1   25   10   34 o    192.9    4.0    0.0000   0.0000          ?        ?   372.2581  15.3245          ?        ?      192.9        4.0       ?       ? 
1 1 1   25   10   35 o    154.9    4.9    0.0000   0.0000          ?        ?   240.0841  15.3245          ?        ?      154.9        4.9       ?       ? 
1 1 1   25   10   36 o    394.0    2.6    0.0000   0.0000          ?        ?  1552.2461  20.4327          ?        ?      394.0        2.6       ?       ? 
1 1 1   25   10   37 o    407.7    2.6    0.0000   0.0000          ?        ?  1662.7103  21.0712          ?        ?      407.7        2.6       ?       ? 
1 1 1   25   10   38 o    566.5    2.6    0.0000   0.0000          ?        ?  3209.2097  29.3720          ?        ?      566.5        2.6       ?       ? 
1 1 1   25   10   39 f    422.6    2.5    0.0000   0.0000          ?        ?  1785.9451  21.0712          ?        ?      422.6        2.5       ?       ? 
1 1 1   25   10   40 o    471.2    2.6    0.0000   0.0000          ?        ?  2220.7781  24.9023          ?        ?      471.2        2.6       ?       ? 
1 1 1   25   10   41 o    557.7    2.6    0.0000   0.0000          ?        ?  3110.8774  28.7335          ?        ?      557.7        2.6       ?       ? 
1 1 1   25   10   42 o    283.7    3.0    0.0000   0.0000          ?        ?   805.1758  17.2401          ?        ?      283.7        3.0       ?       ? 
1 1 1   25   10   43 o    321.0    2.8    0.0000   0.0000          ?        ?  1030.5739  17.8786          ?        ?      321.0        2.8       ?       ? 
1 1 1   25   10   44 o    361.1    2.7    0.0000   0.0000          ?        ?  1304.4998  19.1556          ?        ?      361.1        2.7       ?       ? 
1 1 1   25   10   45 o    384.4    2.7    0.0000   0.0000          ?        ?  1477.5391  20.4327          ?        ?      384.4        2.7       ?       ? 
1 1 1   25   10   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   10   47 o    303.5    3.3    0.0000   0.0000          ?        ?   921.3867  19.7942          ?        ?      303.5        3.3       ?       ? 
1 1 1   25   10   48 o    203.0    4.1    0.0000   0.0000          ?        ?   412.4850  16.6016          ?        ?      203.0        4.1       ?       ? 
1 1 1   25   10   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   10   50 o    305.2    3.2    0.0000   0.0000          ?        ?   931.6030  19.7942          ?        ?      305.2        3.2       ?       ? 
1 1 1   25   10   51 o    474.6    2.6    0.0000   0.0000          ?        ?  2252.7041  24.2638          ?        ?      474.6        2.6       ?       ? 
1 1 1   25   10   52 o    386.5    2.8    0.0000   0.0000          ?        ?  1494.1406  21.7097          ?        ?      386.5        2.8       ?       ? 
1 1 1   25   10   53 o    117.8    7.3    0.0000   0.0000          ?        ?   139.1977  17.2401          ?        ?      117.8        7.3       ?       ? 
1 1 1   25   10   54 o     20.9   10.4    0.0000   0.0000          ?        ?   -40.2269  16.6016          ?        ?       20.9       10.4       ?       ? 
1 1 1   25   10   55 o    295.8    3.1    0.0000   0.0000          ?        ?   875.4132  18.5171          ?        ?      295.8        3.1       ?       ? 
1 1 1   25   10   56 o    220.6    4.1    0.0000   0.0000          ?        ?   487.1920  17.8786          ?        ?      220.6        4.1       ?       ? 
1 1 1   25   10   57 o    126.1    7.3    0.0000   0.0000          ?        ?   159.6304  18.5171          ?        ?      126.1        7.3       ?       ? 
1 1 1   25   10   58 o    537.9    2.8    0.0000   0.0000          ?        ?  2894.4185  30.6490          ?        ?      537.9        2.8       ?       ? 
1 1 1   25   10   59 o    342.9    3.3    0.0000   0.0000          ?        ?  1176.7954  22.3483          ?        ?      342.9        3.3       ?       ? 
1 1 1   25   10   60 o    129.4    7.4    0.0000   0.0000          ?        ?   167.9312  19.1556          ?        ?      129.4        7.4       ?       ? 
1 1 1   25   10   61 o     41.0   16.3    0.0000   0.0000          ?        ?     9.5778  19.7942          ?        ?       41.0       16.3       ?       ? 
1 1 1   25   10   62 o     64.6   15.1    0.0000   0.0000          ?        ?    44.0580  19.1556          ?        ?       64.6       15.1       ?       ? 
1 1 1   25   10   63 o    208.6    4.9    0.0000   0.0000          ?        ?   436.1103  20.4327          ?        ?      208.6        4.9       ?       ? 
1 1 1   25   10   64 o    144.2    6.9    0.0000   0.0000          ?        ?   208.7966  19.7942          ?        ?      144.2        6.9       ?       ? 
1 1 1   25   10   65 o    157.7    6.5    0.0000   0.0000          ?        ?   249.6619  20.4327          ?        ?      157.7        6.5       ?       ? 
1 1 1   25   10   66 o    185.4    5.9    0.0000   0.0000          ?        ?   344.8017  21.7097          ?        ?      185.4        5.9       ?       ? 
1 1 1   25   10   67 o    223.0    4.9    0.0000   0.0000          ?        ?   498.6854  21.7097          ?        ?      223.0        4.9       ?       ? 
1 1 1   25   10   68 o     53.8   16.7    0.0000   0.0000          ?        ?    30.0105  19.7942          ?        ?       53.8       16.7       ?       ? 
1 1 1   25   10   69 f     65.9   15.7    0.0000   0.0000          ?        ?    46.6121  20.4327          ?        ?       65.9       15.7       ?       ? 
1 1 1   25   10   70 o    108.8    9.7    0.0000   0.0000          ?        ?   120.0421  21.0712          ?        ?      108.8        9.7       ?       ? 
1 1 1   25   10   71 o     26.1   12.6    0.0000   0.0000          ?        ?   -32.5646  20.4327          ?        ?       26.1       12.6       ?       ? 
1 1 1   25   10   72 o     24.2   11.9    0.0000   0.0000          ?        ?   -38.9498  19.7942          ?        ?       24.2       11.9       ?       ? 
1 1 1   25   10   73 o     39.5   16.5    0.0000   0.0000          ?        ?     5.1082  21.7097          ?        ?       39.5       16.5       ?       ? 
1 1 1   25   11    0 o   1262.0    6.7 15928.5615 169.8468 15928.5615 169.8468 15928.5615 169.8468     1262.0      6.7     1262.0        6.7     0.0     0.0 
1 1 1   25   11    1 o    709.4    2.9    0.0000   0.0000          ?        ?  5032.1890  41.5039          ?        ?      709.4        2.9       ?       ? 
1 1 1   25   11    2 o    892.6    3.5    0.0000   0.0000          ?        ?  7967.4731  62.5751          ?        ?      892.6        3.5       ?       ? 
1 1 1   25   11    3 o    286.7    2.6    0.0000   0.0000          ?        ?   821.7773  14.6860          ?        ?      286.7        2.6       ?       ? 
1 1 1   25   11    4 o    183.6    2.8    0.0000   0.0000          ?        ?   337.1394  10.2163          ?        ?      183.6        2.8       ?       ? 
1 1 1   25   11    5 o    665.4    2.7    0.0000   0.0000          ?        ?  4427.5093  36.3957          ?        ?      665.4        2.7       ?       ? 
1 1 1   25   11    6 o   1096.5    4.2    0.0000   0.0000          ?        ? 12024.0010  92.5856          ?        ?     1096.5        4.2       ?       ? 
1 1 1   25   11    7 o    925.2    3.6    0.0000   0.0000          ?        ?  8561.2979  67.0448          ?        ?      925.2        3.6       ?       ? 
1 1 1   25   11    8 o    818.9    3.1    0.0000   0.0000          ?        ?  6705.7539  50.4432          ?        ?      818.9        3.1       ?       ? 
1 1 1   25   11    9 o    436.3    2.2    0.0000   0.0000          ?        ?  1903.4330  19.1556          ?        ?      436.3        2.2       ?       ? 
1 1 1   25   11   10 o    773.9    3.0    0.0000   0.0000          ?        ?  5988.6943  45.9736          ?        ?      773.9        3.0       ?       ? 
1 1 1   25   11   11 o   1060.4    3.8    0.0000   0.0000          ?        ? 11245.0039  80.4537          ?        ?     1060.4        3.8       ?       ? 
1 1 1   25   11   12 o   1106.2    4.0    0.0000   0.0000          ?        ? 12237.2666  87.4775          ?        ?     1106.2        4.0       ?       ? 
1 1 1   25   11   13 o    713.6    3.0    0.0000   0.0000          ?        ?  5092.2100  42.1424          ?        ?      713.6        3.0       ?       ? 
1 1 1   25   11   14 o   1030.8    3.9    0.0000   0.0000          ?        ? 10626.2764  81.0922          ?        ?     1030.8        3.9       ?       ? 
1 1 1   25   11   15 o    473.1    2.7    0.0000   0.0000          ?        ?  2238.6570  25.5409          ?        ?      473.1        2.7       ?       ? 
1 1 1   25   11   16 o    393.2    2.6    0.0000   0.0000          ?        ?  1545.8608  20.4327          ?        ?      393.2        2.6       ?       ? 
1 1 1   25   11   17 o   1193.1    4.5    0.0000   0.0000          ?        ? 14236.4785 107.9102          ?        ?     1193.1        4.5       ?       ? 
1 1 1   25   11   18 o   1303.4    4.7    0.0000   0.0000          ?        ? 16989.1445 123.2347          ?        ?     1303.4        4.7       ?       ? 
1 1 1   25   11   19 o    171.4    4.1    0.0000   0.0000          ?        ?   293.7199  14.0475          ?        ?      171.4        4.1       ?       ? 
1 1 1   25   11   20 o    570.0    2.7    0.0000   0.0000          ?        ?  3249.4365  30.6490          ?        ?      570.0        2.7       ?       ? 
1 1 1   25   11   21 o   1282.1    4.6    0.0000   0.0000          ?        ? 16440.0156 118.7650          ?        ?     1282.1        4.6       ?       ? 
1 1 1   25   11   22 o   1494.1    5.3    0.0000   0.0000          ?        ? 22325.2695 158.3534          ?        ?     1494.1        5.3       ?       ? 
1 1 1   25   11   23 o   1165.2    4.3    0.0000   0.0000          ?        ? 13579.4395 100.2479          ?        ?     1165.2        4.3       ?       ? 
1 1 1   25   11   24 o   1429.8    4.9    0.0000   0.0000          ?        ? 20446.7383 139.1977          ?        ?     1429.8        4.9       ?       ? 
1 1 1   25   11   25 o    868.9    3.4    0.0000   0.0000          ?        ?  7550.5181  58.7440          ?        ?      868.9        3.4       ?       ? 
1 1 1   25   11   26 o    640.2    2.9    0.0000   0.0000          ?        ?  4099.3091  37.6728          ?        ?      640.2        2.9       ?       ? 
1 1 1   25   11   27 o   1104.0    4.0    0.0000   0.0000          ?        ? 12190.0166  88.1160          ?        ?     1104.0        4.0       ?       ? 
1 1 1   25   11   28 o   1023.6    3.9    0.0000   0.0000          ?        ? 10479.4170  79.8152          ?        ?     1023.6        3.9       ?       ? 
1 1 1   25   11   29 o    874.6    3.3    0.0000   0.0000          ?        ?  7650.1274  58.1055          ?        ?      874.6        3.3       ?       ? 
1 1 1   25   11   30 o    541.6    2.7    0.0000   0.0000          ?        ?  2934.0068  28.7335          ?        ?      541.6        2.7       ?       ? 
1 1 1   25   11   31 o    829.8    3.3    0.0000   0.0000          ?        ?  6887.0942  54.9129          ?        ?      829.8        3.3       ?       ? 
1 1 1   25   11   32 o    576.9    2.7    0.0000   0.0000          ?        ?  3327.9749  30.6490          ?        ?      576.9        2.7       ?       ? 
1 1 1   25   11   33 o    538.0    2.6    0.0000   0.0000          ?        ?  2895.0571  28.0950          ?        ?      538.0        2.6       ?       ? 
1 1 1   25   11   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   11   35 o    267.0    3.1    0.0000   0.0000          ?        ?   713.2286  16.6016          ?        ?      267.0        3.1       ?       ? 
1 1 1   25   11   36 o    333.4    3.0    0.0000   0.0000          ?        ?  1111.6661  19.7942          ?        ?      333.4        3.0       ?       ? 
1 1 1   25   11   37 o    589.1    2.6    0.0000   0.0000          ?        ?  3471.0034  30.6490          ?        ?      589.1        2.6       ?       ? 
1 1 1   25   11   38 o    200.5    3.8    0.0000   0.0000          ?        ?   402.2686  15.3245          ?        ?      200.5        3.8       ?       ? 
1 1 1   25   11   39 o    288.4    3.0    0.0000   0.0000          ?        ?   831.9937  17.2401          ?        ?      288.4        3.0       ?       ? 
1 1 1   25   11   40 o    190.2    4.0    0.0000   0.0000          ?        ?   362.0418  15.3245          ?        ?      190.2        4.0       ?       ? 
1 1 1   25   11   41 o    177.6    4.7    0.0000   0.0000          ?        ?   315.4297  16.6016          ?        ?      177.6        4.7       ?       ? 
1 1 1   25   11   42 o    180.8    4.4    0.0000   0.0000          ?        ?   326.9231  15.9630          ?        ?      180.8        4.4       ?       ? 
1 1 1   25   11   43 o    286.5    2.9    0.0000   0.0000          ?        ?   821.1389  16.6016          ?        ?      286.5        2.9       ?       ? 
1 1 1   25   11   44 o     30.8   13.4    0.0000   0.0000          ?        ?    -2.5541  15.3245          ?        ?       30.8       13.4       ?       ? 
1 1 1   25   11   45 o    335.0    3.0    0.0000   0.0000          ?        ?  1122.5210  19.7942          ?        ?      335.0        3.0       ?       ? 
1 1 1   25   11   46 o    115.2    6.9    0.0000   0.0000          ?        ?   132.8125  15.9630          ?        ?      115.2        6.9       ?       ? 
1 1 1   25   11   47 o    165.2    5.0    0.0000   0.0000          ?        ?   273.2873  16.6016          ?        ?      165.2        5.0       ?       ? 
1 1 1   25   11   48 o    267.4    3.3    0.0000   0.0000          ?        ?   715.1442  17.8786          ?        ?      267.4        3.3       ?       ? 
1 1 1   25   11   49 o    339.6    2.9    0.0000   0.0000          ?        ?  1153.8086  19.7942          ?        ?      339.6        2.9       ?       ? 
1 1 1   25   11   50 o    172.2    5.2    0.0000   0.0000          ?        ?   296.9126  17.8786          ?        ?      172.2        5.2       ?       ? 
1 1 1   25   11   51 o    374.7    2.8    0.0000   0.0000          ?        ?  1404.1090  21.0712          ?        ?      374.7        2.8       ?       ? 
1 1 1   25   11   52 o    141.7    6.1    0.0000   0.0000          ?        ?   201.1343  17.2401          ?        ?      141.7        6.1       ?       ? 
1 1 1   25   11   53 o    230.0    3.9    0.0000   0.0000          ?        ?   529.3344  17.8786          ?        ?      230.0        3.9       ?       ? 
1 1 1   25   11   54 o    273.4    3.2    0.0000   0.0000          ?        ?   747.7088  17.2401          ?        ?      273.4        3.2       ?       ? 
1 1 1   25   11   55 o     21.0   10.5    0.0000   0.0000          ?        ?   -47.2506  17.8786          ?        ?       21.0       10.5       ?       ? 
1 1 1   25   11   56 o    139.4    6.4    0.0000   0.0000          ?        ?   194.7491  17.8786          ?        ?      139.4        6.4       ?       ? 
1 1 1   25   11   57 o    428.8    2.8    0.0000   0.0000          ?        ?  1839.5808  24.2638          ?        ?      428.8        2.8       ?       ? 
1 1 1   25   11   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   11   59 o     87.5   11.7    0.0000   0.0000          ?        ?    77.2611  20.4327          ?        ?       87.5       11.7       ?       ? 
1 1 1   25   11   60 o    307.3    3.4    0.0000   0.0000          ?        ?   945.0120  21.0712          ?        ?      307.3        3.4       ?       ? 
1 1 1   25   11   61 o    153.5    6.4    0.0000   0.0000          ?        ?   236.2530  19.7942          ?        ?      153.5        6.4       ?       ? 
1 1 1   25   11   62 o     45.6   16.2    0.0000   0.0000          ?        ?    18.5171  18.5171          ?        ?       45.6       16.2       ?       ? 
1 1 1   25   11   63 o    185.1    5.3    0.0000   0.0000          ?        ?   343.5246  19.7942          ?        ?      185.1        5.3       ?       ? 
1 1 1   25   11   64 o    101.6    9.7    0.0000   0.0000          ?        ?   104.0790  19.7942          ?        ?      101.6        9.7       ?       ? 
1 1 1   25   11   65 o    207.0    5.1    0.0000   0.0000          ?        ?   429.7251  21.0712          ?        ?      207.0        5.1       ?       ? 
1 1 1   25   11   66 o    230.9    4.4    0.0000   0.0000          ?        ?   534.4426  20.4327          ?        ?      230.9        4.4       ?       ? 
1 1 1   25   11   67 o    180.0    6.2    0.0000   0.0000          ?        ?   325.6460  22.3483          ?        ?      180.0        6.2       ?       ? 
1 1 1   25   11   68 o     98.5   10.4    0.0000   0.0000          ?        ?    98.3323  20.4327          ?        ?       98.5       10.4       ?       ? 
1 1 1   25   11   69 o     36.2   15.6    0.0000   0.0000          ?        ?    -0.6385  20.4327          ?        ?       36.2       15.6       ?       ? 
1 1 1   25   11   70 o    112.5    9.1    0.0000   0.0000          ?        ?   128.3428  20.4327          ?        ?      112.5        9.1       ?       ? 
1 1 1   25   11   71 o    155.6    6.6    0.0000   0.0000          ?        ?   243.9153  20.4327          ?        ?      155.6        6.6       ?       ? 
1 1 1   25   11   72 o     39.8   16.2    0.0000   0.0000          ?        ?     7.6623  20.4327          ?        ?       39.8       16.2       ?       ? 
1 1 1   25   12    0 o    436.7    3.7 1907.2642  31.9261  1907.2642  31.9261  1907.2642  31.9261      436.7      3.7      436.7        3.7     0.0     0.0 
1 1 1   25   12    1 o    707.2    3.2    0.0000   0.0000          ?        ?  5002.1787  44.6965          ?        ?      707.2        3.2       ?       ? 
1 1 1   25   12    2 o    958.4    3.7    0.0000   0.0000          ?        ?  9185.7715  71.5144          ?        ?      958.4        3.7       ?       ? 
1 1 1   25   12    3 o    641.8    2.9    0.0000   0.0000          ?        ?  4119.1030  37.0343          ?        ?      641.8        2.9       ?       ? 
1 1 1   25   12    4 o   1104.2    4.1    0.0000   0.0000          ?        ? 12193.2090  90.6701          ?        ?     1104.2        4.1       ?       ? 
1 1 1   25   12    5 o   1391.2    4.8    0.0000   0.0000          ?        ? 19356.1445 133.4510          ?        ?     1391.2        4.8       ?       ? 
1 1 1   25   12    6 o    672.2    2.7    0.0000   0.0000          ?        ?  4518.1787  35.7572          ?        ?      672.2        2.7       ?       ? 
1 1 1   25   12    7 o   1007.1    3.6    0.0000   0.0000          ?        ? 10142.9160  72.7915          ?        ?     1007.1        3.6       ?       ? 
1 1 1   25   12    8 o    817.5    3.0    0.0000   0.0000          ?        ?  6683.4058  49.1662          ?        ?      817.5        3.0       ?       ? 
1 1 1   25   12    9 o    322.3    2.2    0.0000   0.0000          ?        ?  1038.8746  14.0475          ?        ?      322.3        2.2       ?       ? 
1 1 1   25   12   10 o    240.8    2.4    0.0000   0.0000          ?        ?   579.7776  11.4934          ?        ?      240.8        2.4       ?       ? 
1 1 1   25   12   11 o   1325.7    4.5    0.0000   0.0000          ?        ? 17575.9473 118.7650          ?        ?     1325.7        4.5       ?       ? 
1 1 1   25   12   12 o    198.2    2.7    0.0000   0.0000          ?        ?   392.6908  10.8549          ?        ?      198.2        2.7       ?       ? 
1 1 1   25   12   13 o    372.7    2.2    0.0000   0.0000          ?        ?  1389.4231  16.6016          ?        ?      372.7        2.2       ?       ? 
1 1 1   25   12   14 o    986.0    4.1    0.0000   0.0000          ?        ?  9723.4072  80.4537          ?        ?      986.0        4.1       ?       ? 
1 1 1   25   12   15 f   2293.7    8.3    0.0000   0.0000          ?        ? 52627.5898 382.4745          ?        ?     2293.7        8.3       ?       ? 
1 1 1   25   12   16 o   1119.5    4.4    0.0000   0.0000          ?        ? 12533.5410  98.3323          ?        ?     1119.5        4.4       ?       ? 
1 1 1   25   12   17 o   1532.8    5.6    0.0000   0.0000          ?        ? 23498.8730 172.4008          ?        ?     1532.8        5.6       ?       ? 
1 1 1   25   12   18 o    168.0    4.2    0.0000   0.0000          ?        ?   282.2266  14.0475          ?        ?      168.0        4.2       ?       ? 
1 1 1   25   12   19 f   1641.4    5.7    0.0000   0.0000          ?        ? 26945.6133 187.0868          ?        ?     1641.4        5.7       ?       ? 
1 1 1   25   12   20 o    777.9    3.1    0.0000   0.0000          ?        ?  6051.9077  48.5276          ?        ?      777.9        3.1       ?       ? 
1 1 1   25   12   21 o   1726.8    6.0    0.0000   0.0000          ?        ? 29824.7051 206.2425          ?        ?     1726.8        6.0       ?       ? 
1 1 1   25   12   22 o    995.2    4.0    0.0000   0.0000          ?        ?  9906.0244  79.1767          ?        ?      995.2        4.0       ?       ? 
1 1 1   25   12   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   12   24 o    776.7    3.1    0.0000   0.0000          ?        ?  6033.3911  47.8891          ?        ?      776.7        3.1       ?       ? 
1 1 1   25   12   25 o    274.8    3.4    0.0000   0.0000          ?        ?   755.3711  18.5171          ?        ?      274.8        3.4       ?       ? 
1 1 1   25   12   26 o    674.4    2.8    0.0000   0.0000          ?        ?  4548.8281  38.3113          ?        ?      674.4        2.8       ?       ? 
1 1 1   25   12   27 o    319.5    2.7    0.0000   0.0000          ?        ?  1020.9960  17.2401          ?        ?      319.5        2.7       ?       ? 
1 1 1   25   12   28 o    714.1    3.1    0.0000   0.0000          ?        ?  5100.5107  44.6965          ?        ?      714.1        3.1       ?       ? 
1 1 1   25   12   29 o    880.7    3.4    0.0000   0.0000          ?        ?  7756.7612  60.0210          ?        ?      880.7        3.4       ?       ? 
1 1 1   25   12   30 o    508.4    2.6    0.0000   0.0000          ?        ?  2584.7354  26.1794          ?        ?      508.4        2.6       ?       ? 
1 1 1   25   12   31 o     94.2    7.8    0.0000   0.0000          ?        ?    88.7545  14.6860          ?        ?       94.2        7.8       ?       ? 
1 1 1   25   12   32 o    582.3    2.9    0.0000   0.0000          ?        ?  3391.1882  33.8416          ?        ?      582.3        2.9       ?       ? 
1 1 1   25   12   33 o    270.4    3.1    0.0000   0.0000          ?        ?   731.1072  16.6016          ?        ?      270.4        3.1       ?       ? 
1 1 1   25   12   34 o    364.2    2.5    0.0000   0.0000          ?        ?  1326.2094  18.5171          ?        ?      364.2        2.5       ?       ? 
1 1 1   25   12   35 f    168.0    4.6    0.0000   0.0000          ?        ?   282.2266  15.3245          ?        ?      168.0        4.6       ?       ? 
1 1 1   25   12   36 o    787.8    3.1    0.0000   0.0000          ?        ?  6207.7075  49.1662          ?        ?      787.8        3.1       ?       ? 
1 1 1   25   12   37 o     33.9   14.0    0.0000   0.0000          ?        ?     3.1926  15.3245          ?        ?       33.9       14.0       ?       ? 
1 1 1   25   12   38 o    176.7    4.3    0.0000   0.0000          ?        ?   312.2371  15.3245          ?        ?      176.7        4.3       ?       ? 
1 1 1   25   12   39 o    441.0    2.8    0.0000   0.0000          ?        ?  1944.9369  24.2638          ?        ?      441.0        2.8       ?       ? 
1 1 1   25   12   40 o    489.4    2.5    0.0000   0.0000          ?        ?  2395.0947  24.9023          ?        ?      489.4        2.5       ?       ? 
1 1 1   25   12   41 o    260.5    3.2    0.0000   0.0000          ?        ?   678.7485  16.6016          ?        ?      260.5        3.2       ?       ? 
1 1 1   25   12   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   12   43 o    152.4    5.2    0.0000   0.0000          ?        ?   232.4219  15.9630          ?        ?      152.4        5.2       ?       ? 
1 1 1   25   12   44 o    111.5    7.2    0.0000   0.0000          ?        ?   124.5117  15.9630          ?        ?      111.5        7.2       ?       ? 
1 1 1   25   12   45 o    390.5    2.7    0.0000   0.0000          ?        ?  1525.4281  21.0712          ?        ?      390.5        2.7       ?       ? 
1 1 1   25   12   46 o    159.7    5.4    0.0000   0.0000          ?        ?   255.4086  17.2401          ?        ?      159.7        5.4       ?       ? 
1 1 1   25   12   47 o    504.1    2.7    0.0000   0.0000          ?        ?  2541.9546  26.8179          ?        ?      504.1        2.7       ?       ? 
1 1 1   25   12   48 o    480.0    2.6    0.0000   0.0000          ?        ?  2304.4246  24.9023          ?        ?      480.0        2.6       ?       ? 
1 1 1   25   12   49 o    336.4    2.9    0.0000   0.0000          ?        ?  1132.0989  19.7942          ?        ?      336.4        2.9       ?       ? 
1 1 1   25   12   50 o    296.4    3.2    0.0000   0.0000          ?        ?   878.6058  19.1556          ?        ?      296.4        3.2       ?       ? 
1 1 1   25   12   51 o    544.0    2.7    0.0000   0.0000          ?        ?  2960.8250  29.3720          ?        ?      544.0        2.7       ?       ? 
1 1 1   25   12   52 o    393.0    2.8    0.0000   0.0000          ?        ?  1545.2223  21.7097          ?        ?      393.0        2.8       ?       ? 
1 1 1   25   12   53 o    122.6    7.0    0.0000   0.0000          ?        ?   150.6911  17.2401          ?        ?      122.6        7.0       ?       ? 
1 1 1   25   12   54 o    175.1    5.1    0.0000   0.0000          ?        ?   307.1289  17.8786          ?        ?      175.1        5.1       ?       ? 
1 1 1   25   12   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   12   56 o     72.5   11.9    0.0000   0.0000          ?        ?    52.9973  17.2401          ?        ?       72.5       11.9       ?       ? 
1 1 1   25   12   57 o    255.1    3.8    0.0000   0.0000          ?        ?   651.2921  19.1556          ?        ?      255.1        3.8       ?       ? 
1 1 1   25   12   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   12   59 o    381.4    3.0    0.0000   0.0000          ?        ?  1455.8293  22.9868          ?        ?      381.4        3.0       ?       ? 
1 1 1   25   12   60 o    184.6    5.4    0.0000   0.0000          ?        ?   341.6091  19.7942          ?        ?      184.6        5.4       ?       ? 
1 1 1   25   12   61 o    273.1    3.7    0.0000   0.0000          ?        ?   746.4318  20.4327          ?        ?      273.1        3.7       ?       ? 
1 1 1   25   12   62 o    250.5    4.1    0.0000   0.0000          ?        ?   628.3053  20.4327          ?        ?      250.5        4.1       ?       ? 
1 1 1   25   12   63 o    127.3    7.8    0.0000   0.0000          ?        ?   162.8230  19.7942          ?        ?      127.3        7.8       ?       ? 
1 1 1   25   12   64 o     29.5   13.7    0.0000   0.0000          ?        ?   -17.8786  19.7942          ?        ?       29.5       13.7       ?       ? 
1 1 1   25   12   65 o    245.8    4.3    0.0000   0.0000          ?        ?   605.3185  21.0712          ?        ?      245.8        4.3       ?       ? 
1 1 1   25   12   66 o    319.1    3.5    0.0000   0.0000          ?        ?  1019.7190  22.3483          ?        ?      319.1        3.5       ?       ? 
1 1 1   25   12   67 o    206.5    4.9    0.0000   0.0000          ?        ?   427.8095  20.4327          ?        ?      206.5        4.9       ?       ? 
1 1 1   25   12   68 o     69.1   15.2    0.0000   0.0000          ?        ?    51.0817  20.4327          ?        ?       69.1       15.2       ?       ? 
1 1 1   25   12   69 o    134.6    7.4    0.0000   0.0000          ?        ?   182.6172  19.7942          ?        ?      134.6        7.4       ?       ? 
1 1 1   25   12   70 o     31.8   14.4    0.0000   0.0000          ?        ?   -10.2163  19.7942          ?        ?       31.8       14.4       ?       ? 
1 1 1   25   12   71 f     66.6   14.8    0.0000   0.0000          ?        ?    47.8891  19.1556          ?        ?       66.6       14.8       ?       ? 
1 1 1   25   12   72 o     94.5   10.1    0.0000   0.0000          ?        ?    91.3086  19.1556          ?        ?       94.5       10.1       ?       ? 
1 1 1   25   13    0 o    385.6    3.6 1487.1168  27.4564  1487.1168  27.4564  1487.1168  27.4564      385.6      3.6      385.6        3.6     0.0     0.0 
1 1 1   25   13    1 o    954.9    3.9    0.0000   0.0000          ?        ?  9118.0889  74.7070          ?        ?      954.9        3.9       ?       ? 
1 1 1   25   13    2 o   1522.9    5.8    0.0000   0.0000          ?        ? 23195.5742 176.2320          ?        ?     1522.9        5.8       ?       ? 
1 1 1   25   13    3 o    331.5    2.3    0.0000   0.0000          ?        ?  1098.8958  15.3245          ?        ?      331.5        2.3       ?       ? 
1 1 1   25   13    4 o     80.7    6.3    0.0000   0.0000          ?        ?    65.1292  10.2163          ?        ?       80.7        6.3       ?       ? 
1 1 1   25   13    5 o    541.9    2.9    0.0000   0.0000          ?        ?  2937.1995  31.9261          ?        ?      541.9        2.9       ?       ? 
1 1 1   25   13    6 o   1655.0    5.9    0.0000   0.0000          ?        ? 27395.1309 194.1106          ?        ?     1655.0        5.9       ?       ? 
1 1 1   25   13    7 o   1108.6    4.3    0.0000   0.0000          ?        ? 12291.5410  95.1397          ?        ?     1108.6        4.3       ?       ? 
1 1 1   25   13    8 o     94.2    4.4    0.0000   0.0000          ?        ?    88.7545   8.3008          ?        ?       94.2        4.4       ?       ? 
1 1 1   25   13    9 o    967.4    3.6    0.0000   0.0000          ?        ?  9360.0889  70.2374          ?        ?      967.4        3.6       ?       ? 
1 1 1   25   13   10 o    972.0    3.5    0.0000   0.0000          ?        ?  9447.5654  68.3218          ?        ?      972.0        3.5       ?       ? 
1 1 1   25   13   11 o    663.5    2.9    0.0000   0.0000          ?        ?  4402.6064  38.9498          ?        ?      663.5        2.9       ?       ? 
1 1 1   25   13   12 o   1907.1    6.8    0.0000   0.0000          ?        ? 36376.5781 261.1554          ?        ?     1907.1        6.8       ?       ? 
1 1 1   25   13   13 o   1122.9    4.3    0.0000   0.0000          ?        ? 12609.5254  95.7782          ?        ?     1122.9        4.3       ?       ? 
1 1 1   25   13   14 o    665.1    2.9    0.0000   0.0000          ?        ?  4423.6777  38.9498          ?        ?      665.1        2.9       ?       ? 
1 1 1   25   13   15 o    198.5    3.4    0.0000   0.0000          ?        ?   393.9678  13.4090          ?        ?      198.5        3.4       ?       ? 
1 1 1   25   13   16 o   1134.0    4.3    0.0000   0.0000          ?        ? 12861.7412  98.3323          ?        ?     1134.0        4.3       ?       ? 
1 1 1   25   13   17 o    226.1    3.8    0.0000   0.0000          ?        ?   511.4558  17.2401          ?        ?      226.1        3.8       ?       ? 
1 1 1   25   13   18 o    659.1    2.9    0.0000   0.0000          ?        ?  4343.8623  37.6728          ?        ?      659.1        2.9       ?       ? 
1 1 1   25   13   19 o   1092.9    4.1    0.0000   0.0000          ?        ? 11944.8242  90.0316          ?        ?     1092.9        4.1       ?       ? 
1 1 1   25   13   20 o   1221.6    4.5    0.0000   0.0000          ?        ? 14923.5273 109.1872          ?        ?     1221.6        4.5       ?       ? 
1 1 1   25   13   21 o   1277.1    4.6    0.0000   0.0000          ?        ? 16311.0352 118.1265          ?        ?     1277.1        4.6       ?       ? 
1 1 1   25   13   22 o   1555.1    5.3    0.0000   0.0000          ?        ? 24186.5605 164.7386          ?        ?     1555.1        5.3       ?       ? 
1 1 1   25   13   23 o    865.5    3.4    0.0000   0.0000          ?        ?  7491.7744  59.3825          ?        ?      865.5        3.4       ?       ? 
1 1 1   25   13   24 o    447.3    2.6    0.0000   0.0000          ?        ?  2000.4882  22.9868          ?        ?      447.3        2.6       ?       ? 
1 1 1   25   13   25 o    784.0    3.1    0.0000   0.0000          ?        ?  6147.0479  49.1662          ?        ?      784.0        3.1       ?       ? 
1 1 1   25   13   26 o    657.0    2.9    0.0000   0.0000          ?        ?  4316.4062  37.6728          ?        ?      657.0        2.9       ?       ? 
1 1 1   25   13   27 o    157.4    5.1    0.0000   0.0000          ?        ?   247.7464  15.9630          ?        ?      157.4        5.1       ?       ? 
1 1 1   25   13   28 o    550.4    2.6    0.0000   0.0000          ?        ?  3029.1465  28.7335          ?        ?      550.4        2.6       ?       ? 
1 1 1   25   13   29 o    310.7    2.6    0.0000   0.0000          ?        ?   965.4447  15.9630          ?        ?      310.7        2.6       ?       ? 
1 1 1   25   13   30 o    831.3    3.3    0.0000   0.0000          ?        ?  6911.9966  54.9129          ?        ?      831.3        3.3       ?       ? 
1 1 1   25   13   31 o    579.8    2.7    0.0000   0.0000          ?        ?  3361.8164  31.2876          ?        ?      579.8        2.7       ?       ? 
1 1 1   25   13   32 o    559.0    2.7    0.0000   0.0000          ?        ?  3124.9248  30.0105          ?        ?      559.0        2.7       ?       ? 
1 1 1   25   13   33 o   1466.1    4.9    0.0000   0.0000          ?        ? 21500.3008 144.9444          ?        ?     1466.1        4.9       ?       ? 
1 1 1   25   13   34 f    311.3    2.9    0.0000   0.0000          ?        ?   969.2759  17.8786          ?        ?      311.3        2.9       ?       ? 
1 1 1   25   13   35 o    163.9    4.7    0.0000   0.0000          ?        ?   268.8176  15.3245          ?        ?      163.9        4.7       ?       ? 
1 1 1   25   13   36 o    181.8    4.2    0.0000   0.0000          ?        ?   330.7542  15.3245          ?        ?      181.8        4.2       ?       ? 
1 1 1   25   13   37 o    132.7    5.8    0.0000   0.0000          ?        ?   176.2320  15.3245          ?        ?      132.7        5.8       ?       ? 
1 1 1   25   13   38 o    514.7    2.5    0.0000   0.0000          ?        ?  2649.8647  26.1794          ?        ?      514.7        2.5       ?       ? 
1 1 1   25   13   39 o    587.6    2.7    0.0000   0.0000          ?        ?  3453.1250  31.9261          ?        ?      587.6        2.7       ?       ? 
1 1 1   25   13   40 o    520.9    2.5    0.0000   0.0000          ?        ?  2713.7168  26.1794          ?        ?      520.9        2.5       ?       ? 
1 1 1   25   13   41 o     73.1   10.5    0.0000   0.0000          ?        ?    53.6358  15.3245          ?        ?       73.1       10.5       ?       ? 
1 1 1   25   13   42 o    425.3    2.6    0.0000   0.0000          ?        ?  1808.9316  21.7097          ?        ?      425.3        2.6       ?       ? 
1 1 1   25   13   43 o    467.8    2.5    0.0000   0.0000          ?        ?  2188.8521  23.6253          ?        ?      467.8        2.5       ?       ? 
1 1 1   25   13   44 o    188.5    4.4    0.0000   0.0000          ?        ?   355.6566  16.6016          ?        ?      188.5        4.4       ?       ? 
1 1 1   25   13   45 o     37.8   14.7    0.0000   0.0000          ?        ?     8.9393  15.9630          ?        ?       37.8       14.7       ?       ? 
1 1 1   25   13   46 o    188.0    4.4    0.0000   0.0000          ?        ?   353.7410  16.6016          ?        ?      188.0        4.4       ?       ? 
1 1 1   25   13   47 o    102.5    8.1    0.0000   0.0000          ?        ?   105.3561  16.6016          ?        ?      102.5        8.1       ?       ? 
1 1 1   25   13   48 o    258.7    3.5    0.0000   0.0000          ?        ?   669.8092  17.8786          ?        ?      258.7        3.5       ?       ? 
1 1 1   25   13   49 o    326.8    3.1    0.0000   0.0000          ?        ?  1068.2467  20.4327          ?        ?      326.8        3.1       ?       ? 
1 1 1   25   13   50 o    348.6    2.8    0.0000   0.0000          ?        ?  1215.7451  19.7942          ?        ?      348.6        2.8       ?       ? 
1 1 1   25   13   51 o    418.2    2.7    0.0000   0.0000          ?        ?  1749.5493  22.9868          ?        ?      418.2        2.7       ?       ? 
1 1 1   25   13   52 o     79.3   10.9    0.0000   0.0000          ?        ?    63.2136  17.2401          ?        ?       79.3       10.9       ?       ? 
1 1 1   25   13   53 o    301.9    3.2    0.0000   0.0000          ?        ?   911.8089  19.1556          ?        ?      301.9        3.2       ?       ? 
1 1 1   25   13   54 o    237.2    3.9    0.0000   0.0000          ?        ?   563.1760  18.5171          ?        ?      237.2        3.9       ?       ? 
1 1 1   25   13   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   13   56 o    501.7    2.7    0.0000   0.0000          ?        ?  2517.6907  27.4564          ?        ?      501.7        2.7       ?       ? 
1 1 1   25   13   57 o    327.9    3.3    0.0000   0.0000          ?        ?  1075.9089  21.7097          ?        ?      327.9        3.3       ?       ? 
1 1 1   25   13   58 o    335.8    3.1    0.0000   0.0000          ?        ?  1128.2677  21.0712          ?        ?      335.8        3.1       ?       ? 
1 1 1   25   13   59 f    252.2    4.1    0.0000   0.0000          ?        ?   636.6060  20.4327          ?        ?      252.2        4.1       ?       ? 
1 1 1   25   13   60 o     23.2   11.4    0.0000   0.0000          ?        ?   -42.1424  19.1556          ?        ?       23.2       11.4       ?       ? 
1 1 1   25   13   61 o    225.8    4.5    0.0000   0.0000          ?        ?   510.8173  20.4327          ?        ?      225.8        4.5       ?       ? 
1 1 1   25   13   62 o    119.3    8.0    0.0000   0.0000          ?        ?   143.0288  19.1556          ?        ?      119.3        8.0       ?       ? 
1 1 1   25   13   63 o    255.3    4.0    0.0000   0.0000          ?        ?   652.5691  20.4327          ?        ?      255.3        4.0       ?       ? 
1 1 1   25   13   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   13   65 o     40.5   16.2    0.0000   0.0000          ?        ?     8.9393  19.7942          ?        ?       40.5       16.2       ?       ? 
1 1 1   25   13   66 o     93.9   10.9    0.0000   0.0000          ?        ?    89.3930  20.4327          ?        ?       93.9       10.9       ?       ? 
1 1 1   25   13   67 o    149.7    6.6    0.0000   0.0000          ?        ?   225.3981  19.7942          ?        ?      149.7        6.6       ?       ? 
1 1 1   25   13   68 o    160.1    6.6    0.0000   0.0000          ?        ?   257.9627  21.0712          ?        ?      160.1        6.6       ?       ? 
1 1 1   25   13   69 o    118.6    8.6    0.0000   0.0000          ?        ?   142.3903  20.4327          ?        ?      118.6        8.6       ?       ? 
1 1 1   25   13   70 o     32.2   14.5    0.0000   0.0000          ?        ?    -8.9393  19.7942          ?        ?       32.2       14.5       ?       ? 
1 1 1   25   13   71 o     58.4   16.3    0.0000   0.0000          ?        ?    37.0343  19.7942          ?        ?       58.4       16.3       ?       ? 
1 1 1   25   14    0 o    607.0    4.5 3685.5469  54.2743  3685.5469  54.2743  3685.5469  54.2743      607.0      4.5      607.0        4.5     0.0     0.0 
1 1 1   25   14    1 o    834.2    3.9    0.0000   0.0000          ?        ?  6959.2476  64.4907          ?        ?      834.2        3.9       ?       ? 
1 1 1   25   14    2 o    626.8    3.0    0.0000   0.0000          ?        ?  3928.8235  37.0343          ?        ?      626.8        3.0       ?       ? 
1 1 1   25   14    3 o    905.2    3.8    0.0000   0.0000          ?        ?  8194.7871  68.9603          ?        ?      905.2        3.8       ?       ? 
1 1 1   25   14    4 o    417.9    2.8    0.0000   0.0000          ?        ?  1746.3567  22.9868          ?        ?      417.9        2.8       ?       ? 
1 1 1   25   14    5 o   1470.4    5.5    0.0000   0.0000          ?        ? 21622.8965 162.8230          ?        ?     1470.4        5.5       ?       ? 
1 1 1   25   14    6 o    259.9    2.5    0.0000   0.0000          ?        ?   675.5559  12.7704          ?        ?      259.9        2.5       ?       ? 
1 1 1   25   14    7 o    816.0    3.2    0.0000   0.0000          ?        ?  6659.1421  52.3588          ?        ?      816.0        3.2       ?       ? 
1 1 1   25   14    8 o    600.4    2.6    0.0000   0.0000          ?        ?  3604.4546  30.6490          ?        ?      600.4        2.6       ?       ? 
1 1 1   25   14    9 o    670.2    3.0    0.0000   0.0000          ?        ?  4491.3613  39.5883          ?        ?      670.2        3.0       ?       ? 
1 1 1   25   14   10 o   1146.9    4.6    0.0000   0.0000          ?        ? 13156.0986 105.9946          ?        ?     1146.9        4.6       ?       ? 
1 1 1   25   14   11 o    462.0    2.4    0.0000   0.0000          ?        ?  2134.5776  22.3483          ?        ?      462.0        2.4       ?       ? 
1 1 1   25   14   12 o    720.2    3.0    0.0000   0.0000          ?        ?  5187.3496  43.4195          ?        ?      720.2        3.0       ?       ? 
1 1 1   25   14   13 o    418.7    2.3    0.0000   0.0000          ?        ?  1753.3804  19.1556          ?        ?      418.7        2.3       ?       ? 
1 1 1   25   14   14 o    838.3    3.5    0.0000   0.0000          ?        ?  7028.2070  58.7440          ?        ?      838.3        3.5       ?       ? 
1 1 1   25   14   15 o    669.2    2.8    0.0000   0.0000          ?        ?  4478.5908  37.0343          ?        ?      669.2        2.8       ?       ? 
1 1 1   25   14   16 o   1169.4    4.2    0.0000   0.0000          ?        ? 13675.8564  97.6938          ?        ?     1169.4        4.2       ?       ? 
1 1 1   25   14   17 o    190.9    4.0    0.0000   0.0000          ?        ?   364.5958  15.3245          ?        ?      190.9        4.0       ?       ? 
1 1 1   25   14   18 o   1624.7    5.8    0.0000   0.0000          ?        ? 26402.2305 189.6409          ?        ?     1624.7        5.8       ?       ? 
1 1 1   25   14   19 o   1372.0    5.0    0.0000   0.0000          ?        ? 18826.1719 137.9207          ?        ?     1372.0        5.0       ?       ? 
1 1 1   25   14   20 o   1421.1    5.3    0.0000   0.0000          ?        ? 20198.9922 150.0526          ?        ?     1421.1        5.3       ?       ? 
1 1 1   25   14   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   14   22 o   1023.4    3.7    0.0000   0.0000          ?        ? 10474.9473  75.3456          ?        ?     1023.4        3.7       ?       ? 
1 1 1   25   14   23 o    856.4    3.3    0.0000   0.0000          ?        ?  7335.3369  56.1899          ?        ?      856.4        3.3       ?       ? 
1 1 1   25   14   24 o    871.7    3.4    0.0000   0.0000          ?        ?  7598.4072  58.7440          ?        ?      871.7        3.4       ?       ? 
1 1 1   25   14   25 o    402.6    2.5    0.0000   0.0000          ?        ?  1620.5679  20.4327          ?        ?      402.6        2.5       ?       ? 
1 1 1   25   14   26 o    569.1    2.7    0.0000   0.0000          ?        ?  3239.2202  30.6490          ?        ?      569.1        2.7       ?       ? 
1 1 1   25   14   27 o   1086.7    3.9    0.0000   0.0000          ?        ? 11811.3730  84.9234          ?        ?     1086.7        3.9       ?       ? 
1 1 1   25   14   28 o    110.7    6.3    0.0000   0.0000          ?        ?   122.5962  14.0475          ?        ?      110.7        6.3       ?       ? 
1 1 1   25   14   29 o    500.2    2.5    0.0000   0.0000          ?        ?  2502.3662  24.9023          ?        ?      500.2        2.5       ?       ? 
1 1 1   25   14   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   14   31 f    138.8    5.5    0.0000   0.0000          ?        ?   192.8335  15.3245          ?        ?      138.8        5.5       ?       ? 
1 1 1   25   14   32 o    496.6    2.4    0.0000   0.0000          ?        ?  2465.9707  24.2638          ?        ?      496.6        2.4       ?       ? 
1 1 1   25   14   33 o    332.5    3.0    0.0000   0.0000          ?        ?  1105.9194  19.7942          ?        ?      332.5        3.0       ?       ? 
1 1 1   25   14   34 o    191.7    4.5    0.0000   0.0000          ?        ?   367.7885  17.2401          ?        ?      191.7        4.5       ?       ? 
1 1 1   25   14   35 o    766.9    3.1    0.0000   0.0000          ?        ?  5882.6997  47.2506          ?        ?      766.9        3.1       ?       ? 
1 1 1   25   14   36 o    664.2    2.8    0.0000   0.0000          ?        ?  4412.1846  37.0343          ?        ?      664.2        2.8       ?       ? 
1 1 1   25   14   37 o     18.4    9.2    0.0000   0.0000          ?        ?   -47.2506  15.3245          ?        ?       18.4        9.2       ?       ? 
1 1 1   25   14   38 o    257.8    3.3    0.0000   0.0000          ?        ?   664.7010  17.2401          ?        ?      257.8        3.3       ?       ? 
1 1 1   25   14   39 o     88.9    8.6    0.0000   0.0000          ?        ?    79.1767  15.3245          ?        ?       88.9        8.6       ?       ? 
1 1 1   25   14   40 o    691.6    2.9    0.0000   0.0000          ?        ?  4784.4424  39.5883          ?        ?      691.6        2.9       ?       ? 
1 1 1   25   14   41 o    282.4    2.9    0.0000   0.0000          ?        ?   797.5135  16.6016          ?        ?      282.4        2.9       ?       ? 
1 1 1   25   14   42 o    161.5    4.9    0.0000   0.0000          ?        ?   261.1554  15.9630          ?        ?      161.5        4.9       ?       ? 
1 1 1   25   14   43 f    211.1    3.9    0.0000   0.0000          ?        ?   445.6881  16.6016          ?        ?      211.1        3.9       ?       ? 
1 1 1   25   14   44 o     75.3   10.6    0.0000   0.0000          ?        ?    56.8284  15.9630          ?        ?       75.3       10.6       ?       ? 
1 1 1   25   14   45 o     42.7   14.7    0.0000   0.0000          ?        ?    16.6016  15.3245          ?        ?       42.7       14.7       ?       ? 
1 1 1   25   14   46 o    374.8    2.6    0.0000   0.0000          ?        ?  1404.7476  19.7942          ?        ?      374.8        2.6       ?       ? 
1 1 1   25   14   47 o    314.3    3.0    0.0000   0.0000          ?        ?   988.4315  19.1556          ?        ?      314.3        3.0       ?       ? 
1 1 1   25   14   48 o    427.3    2.8    0.0000   0.0000          ?        ?  1826.8104  23.6253          ?        ?      427.3        2.8       ?       ? 
1 1 1   25   14   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   14   50 o    142.8    5.8    0.0000   0.0000          ?        ?   204.3269  16.6016          ?        ?      142.8        5.8       ?       ? 
1 1 1   25   14   51 o    197.7    4.5    0.0000   0.0000          ?        ?   391.4138  17.8786          ?        ?      197.7        4.5       ?       ? 
1 1 1   25   14   52 o     58.4   15.2    0.0000   0.0000          ?        ?    35.7572  17.8786          ?        ?       58.4       15.2       ?       ? 
1 1 1   25   14   53 o    270.8    3.5    0.0000   0.0000          ?        ?   733.6614  19.1556          ?        ?      270.8        3.5       ?       ? 
1 1 1   25   14   54 o     21.6   10.7    0.0000   0.0000          ?        ?   -40.2269  17.2401          ?        ?       21.6       10.7       ?       ? 
1 1 1   25   14   55 o    221.0    4.2    0.0000   0.0000          ?        ?   489.1075  18.5171          ?        ?      221.0        4.2       ?       ? 
1 1 1   25   14   56 o    242.1    4.1    0.0000   0.0000          ?        ?   586.8014  19.7942          ?        ?      242.1        4.1       ?       ? 
1 1 1   25   14   57 o    237.7    4.2    0.0000   0.0000          ?        ?   565.7302  19.7942          ?        ?      237.7        4.2       ?       ? 
1 1 1   25   14   58 o    280.5    3.6    0.0000   0.0000          ?        ?   787.2972  20.4327          ?        ?      280.5        3.6       ?       ? 
1 1 1   25   14   59 o     63.1   15.3    0.0000   0.0000          ?        ?    42.1424  19.1556          ?        ?       63.1       15.3       ?       ? 
1 1 1   25   14   60 o    188.9    5.4    0.0000   0.0000          ?        ?   357.5721  20.4327          ?        ?      188.9        5.4       ?       ? 
1 1 1   25   14   61 o    212.7    4.7    0.0000   0.0000          ?        ?   453.3503  19.7942          ?        ?      212.7        4.7       ?       ? 
1 1 1   25   14   62 o     36.2   15.6    0.0000   0.0000          ?        ?    -1.2770  20.4327          ?        ?       36.2       15.6       ?       ? 
1 1 1   25   14   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   14   64 o    112.5    8.8    0.0000   0.0000          ?        ?   127.7043  19.7942          ?        ?      112.5        8.8       ?       ? 
1 1 1   25   14   65 o    187.8    5.3    0.0000   0.0000          ?        ?   353.7410  19.7942          ?        ?      187.8        5.3       ?       ? 
1 1 1   25   14   66 o    243.3    4.3    0.0000   0.0000          ?        ?   593.1866  21.0712          ?        ?      243.3        4.3       ?       ? 
1 1 1   25   14   67 o    195.7    5.2    0.0000   0.0000          ?        ?   384.3900  20.4327          ?        ?      195.7        5.2       ?       ? 
1 1 1   25   14   68 f    256.6    4.1    0.0000   0.0000          ?        ?   660.2314  21.0712          ?        ?      256.6        4.1       ?       ? 
1 1 1   25   14   69 o     58.2   16.7    0.0000   0.0000          ?        ?    36.3957  20.4327          ?        ?       58.2       16.7       ?       ? 
1 1 1   25   14   70 o     32.9   14.7    0.0000   0.0000          ?        ?    -7.0237  19.7942          ?        ?       32.9       14.7       ?       ? 
1 1 1   25   14   71 o     91.7   10.8    0.0000   0.0000          ?        ?    86.2004  19.7942          ?        ?       91.7       10.8       ?       ? 
1 1 1   25   15    0 o     51.6   18.4   35.1187  17.2401    35.1187  17.2401    35.1187  17.2401       51.6     18.4       51.6       18.4     0.0     0.0 
1 1 1   25   15    1 o    726.8    3.5    0.0000   0.0000          ?        ?  5282.4893  51.0817          ?        ?      726.8        3.5       ?       ? 
1 1 1   25   15    2 o   1105.6    4.6    0.0000   0.0000          ?        ? 12224.4961 102.8020          ?        ?     1105.6        4.6       ?       ? 
1 1 1   25   15    3 o    579.2    3.0    0.0000   0.0000          ?        ?  3355.4312  35.1187          ?        ?      579.2        3.0       ?       ? 
1 1 1   25   15    4 o   1007.9    4.1    0.0000   0.0000          ?        ? 10160.1562  82.3693          ?        ?     1007.9        4.1       ?       ? 
1 1 1   25   15    5 o   1187.9    4.8    0.0000   0.0000          ?        ? 14111.9668 113.0183          ?        ?     1187.9        4.8       ?       ? 
1 1 1   25   15    6 o    623.2    2.9    0.0000   0.0000          ?        ?  3884.1270  36.3957          ?        ?      623.2        2.9       ?       ? 
1 1 1   25   15    7 o    671.5    3.1    0.0000   0.0000          ?        ?  4509.2397  41.5039          ?        ?      671.5        3.1       ?       ? 
1 1 1   25   15    8 o    146.3    2.6    0.0000   0.0000          ?        ?   213.9047   7.6623          ?        ?      146.3        2.6       ?       ? 
1 1 1   25   15    9 o    784.5    3.2    0.0000   0.0000          ?        ?  6155.3486  49.8047          ?        ?      784.5        3.2       ?       ? 
1 1 1   25   15   10 o    936.3    3.9    0.0000   0.0000          ?        ?  8767.5400  72.1529          ?        ?      936.3        3.9       ?       ? 
1 1 1   25   15   11 o    828.9    3.4    0.0000   0.0000          ?        ?  6871.7695  55.5514          ?        ?      828.9        3.4       ?       ? 
1 1 1   25   15   12 o    770.7    3.1    0.0000   0.0000          ?        ?  5940.1665  48.5276          ?        ?      770.7        3.1       ?       ? 
1 1 1   25   15   13 o   1031.1    3.8    0.0000   0.0000          ?        ? 10633.3008  79.1767          ?        ?     1031.1        3.8       ?       ? 
1 1 1   25   15   14 o    694.7    2.8    0.0000   0.0000          ?        ?  4826.5850  38.3113          ?        ?      694.7        2.8       ?       ? 
1 1 1   25   15   15 f    767.5    3.3    0.0000   0.0000          ?        ?  5891.0005  50.4432          ?        ?      767.5        3.3       ?       ? 
1 1 1   25   15   16 o    189.9    3.9    0.0000   0.0000          ?        ?   360.7647  14.6860          ?        ?      189.9        3.9       ?       ? 
1 1 1   25   15   17 o    556.1    2.7    0.0000   0.0000          ?        ?  3092.9988  30.0105          ?        ?      556.1        2.7       ?       ? 
1 1 1   25   15   18 o    350.1    2.6    0.0000   0.0000          ?        ?  1225.9615  17.8786          ?        ?      350.1        2.6       ?       ? 
1 1 1   25   15   19 o   1300.4    4.7    0.0000   0.0000          ?        ? 16911.8848 123.2347          ?        ?     1300.4        4.7       ?       ? 
1 1 1   25   15   20 o    901.3    3.5    0.0000   0.0000          ?        ?  8124.5493  62.5751          ?        ?      901.3        3.5       ?       ? 
1 1 1   25   15   21 f   1614.4    5.8    0.0000   0.0000          ?        ? 26068.2852 186.4483          ?        ?     1614.4        5.8       ?       ? 
1 1 1   25   15   22 o    183.6    3.8    0.0000   0.0000          ?        ?   337.1394  14.0475          ?        ?      183.6        3.8       ?       ? 
1 1 1   25   15   23 o    823.6    3.2    0.0000   0.0000          ?        ?  6783.0156  52.3588          ?        ?      823.6        3.2       ?       ? 
1 1 1   25   15   24 o    456.0    2.4    0.0000   0.0000          ?        ?  2079.6650  21.7097          ?        ?      456.0        2.4       ?       ? 
1 1 1   25   15   25 o    835.0    3.1    0.0000   0.0000          ?        ?  6973.2944  52.3588          ?        ?      835.0        3.1       ?       ? 
1 1 1   25   15   26 o    249.4    3.1    0.0000   0.0000          ?        ?   621.9200  15.3245          ?        ?      249.4        3.1       ?       ? 
1 1 1   25   15   27 o    371.0    2.6    0.0000   0.0000          ?        ?  1376.6527  19.1556          ?        ?      371.0        2.6       ?       ? 
1 1 1   25   15   28 o    543.6    2.5    0.0000   0.0000          ?        ?  2955.7166  27.4564          ?        ?      543.6        2.5       ?       ? 
1 1 1   25   15   29 o    250.1    3.2    0.0000   0.0000          ?        ?   625.7512  15.9630          ?        ?      250.1        3.2       ?       ? 
1 1 1   25   15   30 o   1221.1    4.4    0.0000   0.0000          ?        ? 14913.9492 108.5487          ?        ?     1221.1        4.4       ?       ? 
1 1 1   25   15   31 o    465.7    2.5    0.0000   0.0000          ?        ?  2169.0581  23.6253          ?        ?      465.7        2.5       ?       ? 
1 1 1   25   15   32 f     19.9   10.0    0.0000   0.0000          ?        ?   -50.4432  17.2401          ?        ?       19.9       10.0       ?       ? 
1 1 1   25   15   33 o    236.1    3.4    0.0000   0.0000          ?        ?   557.4294  15.9630          ?        ?      236.1        3.4       ?       ? 
1 1 1   25   15   34 o    465.8    2.5    0.0000   0.0000          ?        ?  2170.3350  22.9868          ?        ?      465.8        2.5       ?       ? 
1 1 1   25   15   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   15   36 o    171.2    4.5    0.0000   0.0000          ?        ?   293.0815  15.3245          ?        ?      171.2        4.5       ?       ? 
1 1 1   25   15   37 o    365.1    2.6    0.0000   0.0000          ?        ?  1333.2332  19.1556          ?        ?      365.1        2.6       ?       ? 
1 1 1   25   15   38 o    249.7    3.2    0.0000   0.0000          ?        ?   623.8356  15.9630          ?        ?      249.7        3.2       ?       ? 
1 1 1   25   15   39 o    150.7    5.1    0.0000   0.0000          ?        ?   227.3137  15.3245          ?        ?      150.7        5.1       ?       ? 
1 1 1   25   15   40 o    407.3    2.6    0.0000   0.0000          ?        ?  1658.8792  21.0712          ?        ?      407.3        2.6       ?       ? 
1 1 1   25   15   41 o    205.1    3.9    0.0000   0.0000          ?        ?   420.7858  15.9630          ?        ?      205.1        3.9       ?       ? 
1 1 1   25   15   42 o    168.1    4.6    0.0000   0.0000          ?        ?   282.8651  15.3245          ?        ?      168.1        4.6       ?       ? 
1 1 1   25   15   43 o    360.7    2.7    0.0000   0.0000          ?        ?  1301.3071  19.1556          ?        ?      360.7        2.7       ?       ? 
1 1 1   25   15   44 o    222.1    3.9    0.0000   0.0000          ?        ?   493.5772  17.2401          ?        ?      222.1        3.9       ?       ? 
1 1 1   25   15   45 o    135.3    5.9    0.0000   0.0000          ?        ?   183.2557  15.9630          ?        ?      135.3        5.9       ?       ? 
1 1 1   25   15   46 o    157.9    5.3    0.0000   0.0000          ?        ?   249.6619  16.6016          ?        ?      157.9        5.3       ?       ? 
1 1 1   25   15   47 o    123.2    7.0    0.0000   0.0000          ?        ?   151.9681  17.2401          ?        ?      123.2        7.0       ?       ? 
1 1 1   25   15   48 o     20.1   10.0    0.0000   0.0000          ?        ?   -40.8654  15.9630          ?        ?       20.1       10.0       ?       ? 
1 1 1   25   15   49 o    148.1    5.8    0.0000   0.0000          ?        ?   219.6514  17.2401          ?        ?      148.1        5.8       ?       ? 
1 1 1   25   15   50 o    337.4    3.0    0.0000   0.0000          ?        ?  1139.1226  20.4327          ?        ?      337.4        3.0       ?       ? 
1 1 1   25   15   51 o    231.4    4.1    0.0000   0.0000          ?        ?   535.7197  19.1556          ?        ?      231.4        4.1       ?       ? 
1 1 1   25   15   52 o    128.4    6.7    0.0000   0.0000          ?        ?   165.3771  17.2401          ?        ?      128.4        6.7       ?       ? 
1 1 1   25   15   53 o     23.2   11.3    0.0000   0.0000          ?        ?   -31.9261  17.2401          ?        ?       23.2       11.3       ?       ? 
1 1 1   25   15   54 o    255.6    3.7    0.0000   0.0000          ?        ?   653.8461  19.1556          ?        ?      255.6        3.7       ?       ? 
1 1 1   25   15   55 o    307.0    3.3    0.0000   0.0000          ?        ?   943.0964  20.4327          ?        ?      307.0        3.3       ?       ? 
1 1 1   25   15   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   15   57 o    550.3    2.8    0.0000   0.0000          ?        ?  3029.7852  30.6490          ?        ?      550.3        2.8       ?       ? 
1 1 1   25   15   58 o    260.9    3.9    0.0000   0.0000          ?        ?   681.3026  20.4327          ?        ?      260.9        3.9       ?       ? 
1 1 1   25   15   59 o     73.2   14.0    0.0000   0.0000          ?        ?    56.1899  19.7942          ?        ?       73.2       14.0       ?       ? 
1 1 1   25   15   60 o     51.2   16.5    0.0000   0.0000          ?        ?    26.1794  19.1556          ?        ?       51.2       16.5       ?       ? 
1 1 1   25   15   61 o    209.8    4.7    0.0000   0.0000          ?        ?   441.2184  19.7942          ?        ?      209.8        4.7       ?       ? 
1 1 1   25   15   62 o    110.9    8.6    0.0000   0.0000          ?        ?   123.8732  19.1556          ?        ?      110.9        8.6       ?       ? 
1 1 1   25   15   63 o    128.0    7.7    0.0000   0.0000          ?        ?   164.7386  19.7942          ?        ?      128.0        7.7       ?       ? 
1 1 1   25   15   64 o    217.0    4.6    0.0000   0.0000          ?        ?   471.8675  19.7942          ?        ?      217.0        4.6       ?       ? 
1 1 1   25   15   65 o     25.9   12.5    0.0000   0.0000          ?        ?   -31.2876  19.7942          ?        ?       25.9       12.5       ?       ? 
1 1 1   25   15   66 o     43.6   16.5    0.0000   0.0000          ?        ?    14.6860  19.7942          ?        ?       43.6       16.5       ?       ? 
1 1 1   25   15   67 o    207.2    4.9    0.0000   0.0000          ?        ?   431.0021  20.4327          ?        ?      207.2        4.9       ?       ? 
1 1 1   25   15   68 o     31.2   14.2    0.0000   0.0000          ?        ?   -10.2163  19.1556          ?        ?       31.2       14.2       ?       ? 
1 1 1   25   15   69 o    143.6    6.9    0.0000   0.0000          ?        ?   208.1580  19.7942          ?        ?      143.6        6.9       ?       ? 
1 1 1   25   15   70 o     46.6   16.9    0.0000   0.0000          ?        ?    19.7942  20.4327          ?        ?       46.6       16.9       ?       ? 
1 1 1   25   16    0 o   1087.9    6.7 11838.8291 145.5829 11838.8291 145.5829 11838.8291 145.5829     1087.9      6.7     1087.9        6.7     0.0     0.0 
1 1 1   25   16    1 o    233.6    2.6    0.0000   0.0000          ?        ?   545.9360  12.1319          ?        ?      233.6        2.6       ?       ? 
1 1 1   25   16    2 o    846.3    3.7    0.0000   0.0000          ?        ?  7162.2969  63.2136          ?        ?      846.3        3.7       ?       ? 
1 1 1   25   16    3 o    412.3    2.9    0.0000   0.0000          ?        ?  1700.3831  24.2638          ?        ?      412.3        2.9       ?       ? 
1 1 1   25   16    4 o   1397.1    5.6    0.0000   0.0000          ?        ? 19521.5215 157.0763          ?        ?     1397.1        5.6       ?       ? 
1 1 1   25   16    5 o    329.5    2.8    0.0000   0.0000          ?        ?  1085.4868  18.5171          ?        ?      329.5        2.8       ?       ? 
1 1 1   25   16    6 o    763.5    3.3    0.0000   0.0000          ?        ?  5829.7026  51.0817          ?        ?      763.5        3.3       ?       ? 
1 1 1   25   16    7 o    953.7    4.1    0.0000   0.0000          ?        ?  9097.0176  78.5382          ?        ?      953.7        4.1       ?       ? 
1 1 1   25   16    8 o    186.5    5.3    0.0000   0.0000          ?        ?   347.9943  19.7942          ?        ?      186.5        5.3       ?       ? 
1 1 1   25   16    9 o    348.1    2.3    0.0000   0.0000          ?        ?  1211.9141  15.9630          ?        ?      348.1        2.3       ?       ? 
1 1 1   25   16   10 o    318.3    2.2    0.0000   0.0000          ?        ?  1013.3338  14.0475          ?        ?      318.3        2.2       ?       ? 
1 1 1   25   16   11 o    704.3    2.9    0.0000   0.0000          ?        ?  4960.0361  40.8654          ?        ?      704.3        2.9       ?       ? 
1 1 1   25   16   12 o    594.6    2.7    0.0000   0.0000          ?        ?  3535.4944  31.9261          ?        ?      594.6        2.7       ?       ? 
1 1 1   25   16   13 o    805.7    3.1    0.0000   0.0000          ?        ?  6492.4878  50.4432          ?        ?      805.7        3.1       ?       ? 
1 1 1   25   16   14 o    402.6    2.4    0.0000   0.0000          ?        ?  1620.5679  19.1556          ?        ?      402.6        2.4       ?       ? 
1 1 1   25   16   15 o     83.4    6.9    0.0000   0.0000          ?        ?    69.5989  11.4934          ?        ?       83.4        6.9       ?       ? 
1 1 1   25   16   16 o    907.4    3.9    0.0000   0.0000          ?        ?  8234.3750  70.8759          ?        ?      907.4        3.9       ?       ? 
1 1 1   25   16   17 o   1148.5    4.2    0.0000   0.0000          ?        ? 13192.4961  97.0553          ?        ?     1148.5        4.2       ?       ? 
1 1 1   25   16   18 o   1635.9    5.7    0.0000   0.0000          ?        ? 26766.1875 185.8098          ?        ?     1635.9        5.7       ?       ? 
1 1 1   25   16   19 o    427.5    2.5    0.0000   0.0000          ?        ?  1827.4490  21.0712          ?        ?      427.5        2.5       ?       ? 
1 1 1   25   16   20 o    642.9    2.8    0.0000   0.0000          ?        ?  4133.7891  35.7572          ?        ?      642.9        2.8       ?       ? 
1 1 1   25   16   21 o    989.8    3.8    0.0000   0.0000          ?        ?  9798.1143  74.7070          ?        ?      989.8        3.8       ?       ? 
1 1 1   25   16   22 o    330.0    4.1    0.0000   0.0000          ?        ?  1089.3180  26.8179          ?        ?      330.0        4.1       ?       ? 
1 1 1   25   16   23 o    321.4    3.0    0.0000   0.0000          ?        ?  1033.1281  19.1556          ?        ?      321.4        3.0       ?       ? 
1 1 1   25   16   24 o    417.3    2.4    0.0000   0.0000          ?        ?  1741.2485  20.4327          ?        ?      417.3        2.4       ?       ? 
1 1 1   25   16   25 o    414.0    2.5    0.0000   0.0000          ?        ?  1713.7920  20.4327          ?        ?      414.0        2.5       ?       ? 
1 1 1   25   16   26 o    347.7    2.5    0.0000   0.0000          ?        ?  1209.3599  17.2401          ?        ?      347.7        2.5       ?       ? 
1 1 1   25   16   27 o    439.2    2.4    0.0000   0.0000          ?        ?  1928.9739  21.0712          ?        ?      439.2        2.4       ?       ? 
1 1 1   25   16   28 o    321.1    2.6    0.0000   0.0000          ?        ?  1031.2124  16.6016          ?        ?      321.1        2.6       ?       ? 
1 1 1   25   16   29 f    492.4    2.5    0.0000   0.0000          ?        ?  2424.4668  24.2638          ?        ?      492.4        2.5       ?       ? 
1 1 1   25   16   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   16   31 o    411.7    2.6    0.0000   0.0000          ?        ?  1695.2749  21.0712          ?        ?      411.7        2.6       ?       ? 
1 1 1   25   16   32 o    177.4    4.0    0.0000   0.0000          ?        ?   314.7912  14.0475          ?        ?      177.4        4.0       ?       ? 
1 1 1   25   16   33 o    552.5    2.5    0.0000   0.0000          ?        ?  3053.4104  28.0950          ?        ?      552.5        2.5       ?       ? 
1 1 1   25   16   34 o    509.1    2.4    0.0000   0.0000          ?        ?  2592.3977  24.9023          ?        ?      509.1        2.4       ?       ? 
1 1 1   25   16   35 o    427.5    2.5    0.0000   0.0000          ?        ?  1827.4490  21.0712          ?        ?      427.5        2.5       ?       ? 
1 1 1   25   16   36 o    206.2    3.7    0.0000   0.0000          ?        ?   425.2554  15.3245          ?        ?      206.2        3.7       ?       ? 
1 1 1   25   16   37 o    435.8    2.6    0.0000   0.0000          ?        ?  1899.6018  22.3483          ?        ?      435.8        2.6       ?       ? 
1 1 1   25   16   38 o    530.1    2.5    0.0000   0.0000          ?        ?  2810.1338  26.8179          ?        ?      530.1        2.5       ?       ? 
1 1 1   25   16   39 o    357.0    2.6    0.0000   0.0000          ?        ?  1274.4893  18.5171          ?        ?      357.0        2.6       ?       ? 
1 1 1   25   16   40 o    330.4    2.8    0.0000   0.0000          ?        ?  1091.8719  18.5171          ?        ?      330.4        2.8       ?       ? 
1 1 1   25   16   41 o    147.5    5.2    0.0000   0.0000          ?        ?   217.7359  15.3245          ?        ?      147.5        5.2       ?       ? 
1 1 1   25   16   42 o     33.4   14.1    0.0000   0.0000          ?        ?     1.2770  15.9630          ?        ?       33.4       14.1       ?       ? 
1 1 1   25   16   43 o    220.4    3.6    0.0000   0.0000          ?        ?   485.9149  15.9630          ?        ?      220.4        3.6       ?       ? 
1 1 1   25   16   44 o    143.5    5.8    0.0000   0.0000          ?        ?   206.2425  16.6016          ?        ?      143.5        5.8       ?       ? 
1 1 1   25   16   45 o    337.2    2.8    0.0000   0.0000          ?        ?  1137.2070  19.1556          ?        ?      337.2        2.8       ?       ? 
1 1 1   25   16   46 o     59.4   14.6    0.0000   0.0000          ?        ?    37.0343  17.2401          ?        ?       59.4       14.6       ?       ? 
1 1 1   25   16   47 o    384.2    2.7    0.0000   0.0000          ?        ?  1476.9005  21.0712          ?        ?      384.2        2.7       ?       ? 
1 1 1   25   16   48 o    444.3    2.5    0.0000   0.0000          ?        ?  1974.3090  22.3483          ?        ?      444.3        2.5       ?       ? 
1 1 1   25   16   49 o    187.5    4.8    0.0000   0.0000          ?        ?   351.8254  17.8786          ?        ?      187.5        4.8       ?       ? 
1 1 1   25   16   50 o    194.2    4.6    0.0000   0.0000          ?        ?   377.3663  17.8786          ?        ?      194.2        4.6       ?       ? 
1 1 1   25   16   51 o    173.7    5.1    0.0000   0.0000          ?        ?   302.0207  17.8786          ?        ?      173.7        5.1       ?       ? 
1 1 1   25   16   52 o     88.4   10.1    0.0000   0.0000          ?        ?    78.5382  17.8786          ?        ?       88.4       10.1       ?       ? 
1 1 1   25   16   53 o    398.8    2.8    0.0000   0.0000          ?        ?  1591.1959  22.3483          ?        ?      398.8        2.8       ?       ? 
1 1 1   25   16   54 o     19.3    9.7    0.0000   0.0000          ?        ?   -59.3825  17.8786          ?        ?       19.3        9.7       ?       ? 
1 1 1   25   16   55 o    117.2    7.9    0.0000   0.0000          ?        ?   137.9207  18.5171          ?        ?      117.2        7.9       ?       ? 
1 1 1   25   16   56 o    530.9    2.8    0.0000   0.0000          ?        ?  2819.7114  29.3720          ?        ?      530.9        2.8       ?       ? 
1 1 1   25   16   57 o     36.8   15.7    0.0000   0.0000          ?        ?     0.0000  20.4327          ?        ?       36.8       15.7       ?       ? 
1 1 1   25   16   58 o    122.5    7.8    0.0000   0.0000          ?        ?   150.6911  19.1556          ?        ?      122.5        7.8       ?       ? 
1 1 1   25   16   59 o    114.7    8.1    0.0000   0.0000          ?        ?   132.1740  18.5171          ?        ?      114.7        8.1       ?       ? 
1 1 1   25   16   60 o    305.8    3.4    0.0000   0.0000          ?        ?   936.0728  21.0712          ?        ?      305.8        3.4       ?       ? 
1 1 1   25   16   61 o    301.9    3.6    0.0000   0.0000          ?        ?   912.4474  21.7097          ?        ?      301.9        3.6       ?       ? 
1 1 1   25   16   62 o    144.4    7.1    0.0000   0.0000          ?        ?   209.4351  20.4327          ?        ?      144.4        7.1       ?       ? 
1 1 1   25   16   63 o     24.7   12.1    0.0000   0.0000          ?        ?   -37.0343  19.7942          ?        ?       24.7       12.1       ?       ? 
1 1 1   25   16   64 o    284.5    3.8    0.0000   0.0000          ?        ?   810.9225  21.7097          ?        ?      284.5        3.8       ?       ? 
1 1 1   25   16   65 o     89.7   10.7    0.0000   0.0000          ?        ?    81.7308  19.1556          ?        ?       89.7       10.7       ?       ? 
1 1 1   25   16   66 o    249.7    4.2    0.0000   0.0000          ?        ?   625.1127  21.0712          ?        ?      249.7        4.2       ?       ? 
1 1 1   25   16   67 o    132.6    7.5    0.0000   0.0000          ?        ?   177.5090  19.7942          ?        ?      132.6        7.5       ?       ? 
1 1 1   25   16   68 o    150.8    6.6    0.0000   0.0000          ?        ?   229.2293  19.7942          ?        ?      150.8        6.6       ?       ? 
1 1 1   25   16   69 o     56.0   15.8    0.0000   0.0000          ?        ?    33.8416  18.5171          ?        ?       56.0       15.8       ?       ? 
1 1 1   25   17    0 o    139.2    7.4  195.3876  20.4327   195.3876  20.4327   195.3876  20.4327      139.2      7.4      139.2        7.4     0.0     0.0 
1 1 1   25   17    1 o    524.2    2.9    0.0000   0.0000          ?        ?  2747.5586  30.0105          ?        ?      524.2        2.9       ?       ? 
1 1 1   25   17    2 o    343.0    3.0    0.0000   0.0000          ?        ?  1176.7954  20.4327          ?        ?      343.0        3.0       ?       ? 
1 1 1   25   17    3 o   1519.2    6.2    0.0000   0.0000          ?        ? 23083.8340 189.0024          ?        ?     1519.2        6.2       ?       ? 
1 1 1   25   17    4 o    924.6    4.0    0.0000   0.0000          ?        ?  8549.8047  74.0685          ?        ?      924.6        4.0       ?       ? 
1 1 1   25   17    5 o    730.0    3.2    0.0000   0.0000          ?        ?  5329.7402  47.2506          ?        ?      730.0        3.2       ?       ? 
1 1 1   25   17    6 o    612.3    2.9    0.0000   0.0000          ?        ?  3749.3992  35.7572          ?        ?      612.3        2.9       ?       ? 
1 1 1   25   17    7 o   1146.5    4.5    0.0000   0.0000          ?        ? 13147.1602 102.8020          ?        ?     1146.5        4.5       ?       ? 
1 1 1   25   17    8 o   1306.7    5.1    0.0000   0.0000          ?        ? 17075.9844 134.0895          ?        ?     1306.7        5.1       ?       ? 
1 1 1   25   17    9 o   1132.6    4.1    0.0000   0.0000          ?        ? 12829.1758  93.8627          ?        ?     1132.6        4.1       ?       ? 
1 1 1   25   17   10 o    323.8    2.2    0.0000   0.0000          ?        ?  1048.4525  14.0475          ?        ?      323.8        2.2       ?       ? 
1 1 1   25   17   11 o    243.3    3.1    0.0000   0.0000          ?        ?   591.9095  15.3245          ?        ?      243.3        3.1       ?       ? 
1 1 1   25   17   12 o    269.3    2.6    0.0000   0.0000          ?        ?   725.3605  14.0475          ?        ?      269.3        2.6       ?       ? 
1 1 1   25   17   13 o    660.0    2.8    0.0000   0.0000          ?        ?  4356.6328  36.3957          ?        ?      660.0        2.8       ?       ? 
1 1 1   25   17   14 o   1074.3    4.0    0.0000   0.0000          ?        ? 11542.5547  84.9234          ?        ?     1074.3        4.0       ?       ? 
1 1 1   25   17   15 o    928.5    3.5    0.0000   0.0000          ?        ?  8621.9580  65.7677          ?        ?      928.5        3.5       ?       ? 
1 1 1   25   17   16 o    298.4    3.0    0.0000   0.0000          ?        ?   890.7377  17.8786          ?        ?      298.4        3.0       ?       ? 
1 1 1   25   17   17 o    528.9    2.8    0.0000   0.0000          ?        ?  2797.3633  29.3720          ?        ?      528.9        2.8       ?       ? 
1 1 1   25   17   18 o    334.4    2.7    0.0000   0.0000          ?        ?  1118.0514  17.8786          ?        ?      334.4        2.7       ?       ? 
1 1 1   25   17   19 o    859.6    3.4    0.0000   0.0000          ?        ?  7389.6113  58.1055          ?        ?      859.6        3.4       ?       ? 
1 1 1   25   17   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   17   21 o    471.4    2.6    0.0000   0.0000          ?        ?  2222.0552  24.9023          ?        ?      471.4        2.6       ?       ? 
1 1 1   25   17   22 o    525.8    2.6    0.0000   0.0000          ?        ?  2764.7986  27.4564          ?        ?      525.8        2.6       ?       ? 
1 1 1   25   17   23 o   1114.6    3.9    0.0000   0.0000          ?        ? 12424.9922  87.4775          ?        ?     1114.6        3.9       ?       ? 
1 1 1   25   17   24 o    130.1    4.9    0.0000   0.0000          ?        ?   169.2082  12.7704          ?        ?      130.1        4.9       ?       ? 
1 1 1   25   17   25 o    871.9    3.3    0.0000   0.0000          ?        ?  7603.5156  56.8284          ?        ?      871.9        3.3       ?       ? 
1 1 1   25   17   26 o    431.1    2.4    0.0000   0.0000          ?        ?  1858.7365  21.0712          ?        ?      431.1        2.4       ?       ? 
1 1 1   25   17   27 o    166.8    4.2    0.0000   0.0000          ?        ?   278.3954  14.0475          ?        ?      166.8        4.2       ?       ? 
1 1 1   25   17   28 o    463.2    2.4    0.0000   0.0000          ?        ?  2145.4326  22.3483          ?        ?      463.2        2.4       ?       ? 
1 1 1   25   17   29 o    716.5    2.9    0.0000   0.0000          ?        ?  5133.7139  42.1424          ?        ?      716.5        2.9       ?       ? 
1 1 1   25   17   30 o    460.2    2.6    0.0000   0.0000          ?        ?  2117.9763  23.6253          ?        ?      460.2        2.6       ?       ? 
1 1 1   25   17   31 o    396.1    2.6    0.0000   0.0000          ?        ?  1569.4862  20.4327          ?        ?      396.1        2.6       ?       ? 
1 1 1   25   17   32 o    539.4    2.6    0.0000   0.0000          ?        ?  2910.3816  28.0950          ?        ?      539.4        2.6       ?       ? 
1 1 1   25   17   33 o    234.2    3.4    0.0000   0.0000          ?        ?   548.4901  15.9630          ?        ?      234.2        3.4       ?       ? 
1 1 1   25   17   34 o     61.7   12.8    0.0000   0.0000          ?        ?    39.5883  15.3245          ?        ?       61.7       12.8       ?       ? 
1 1 1   25   17   35 o    332.0    2.8    0.0000   0.0000          ?        ?  1102.7268  18.5171          ?        ?      332.0        2.8       ?       ? 
1 1 1   25   17   36 o    818.7    3.1    0.0000   0.0000          ?        ?  6704.4771  50.4432          ?        ?      818.7        3.1       ?       ? 
1 1 1   25   17   37 o    125.0    6.1    0.0000   0.0000          ?        ?   156.4378  15.3245          ?        ?      125.0        6.1       ?       ? 
1 1 1   25   17   38 o    319.4    2.7    0.0000   0.0000          ?        ?  1020.3576  17.2401          ?        ?      319.4        2.7       ?       ? 
1 1 1   25   17   39 o    205.6    3.9    0.0000   0.0000          ?        ?   422.7013  15.9630          ?        ?      205.6        3.9       ?       ? 
1 1 1   25   17   40 o    510.2    2.6    0.0000   0.0000          ?        ?  2603.2527  26.8179          ?        ?      510.2        2.6       ?       ? 
1 1 1   25   17   41 o    331.7    2.7    0.0000   0.0000          ?        ?  1100.8113  17.8786          ?        ?      331.7        2.7       ?       ? 
1 1 1   25   17   42 o    280.5    3.0    0.0000   0.0000          ?        ?   787.2972  16.6016          ?        ?      280.5        3.0       ?       ? 
1 1 1   25   17   43 o    160.3    4.8    0.0000   0.0000          ?        ?   257.3242  15.3245          ?        ?      160.3        4.8       ?       ? 
1 1 1   25   17   44 o    248.9    3.5    0.0000   0.0000          ?        ?   620.0045  17.2401          ?        ?      248.9        3.5       ?       ? 
1 1 1   25   17   45 o     22.0   10.8    0.0000   0.0000          ?        ?   -31.2876  15.9630          ?        ?       22.0       10.8       ?       ? 
1 1 1   25   17   46 o     68.0   12.2    0.0000   0.0000          ?        ?    47.8891  15.9630          ?        ?       68.0       12.2       ?       ? 
1 1 1   25   17   47 o     26.4   12.4    0.0000   0.0000          ?        ?   -17.2401  16.6016          ?        ?       26.4       12.4       ?       ? 
1 1 1   25   17   48 o    262.9    3.4    0.0000   0.0000          ?        ?   691.5189  17.8786          ?        ?      262.9        3.4       ?       ? 
1 1 1   25   17   49 o     19.3    9.7    0.0000   0.0000          ?        ?   -54.2743  17.2401          ?        ?       19.3        9.7       ?       ? 
1 1 1   25   17   50 o    359.6    2.8    0.0000   0.0000          ?        ?  1293.6449  20.4327          ?        ?      359.6        2.8       ?       ? 
1 1 1   25   17   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   17   52 f    172.7    5.5    0.0000   0.0000          ?        ?   298.8281  19.1556          ?        ?      172.7        5.5       ?       ? 
1 1 1   25   17   53 o    211.1    4.4    0.0000   0.0000          ?        ?   446.3266  18.5171          ?        ?      211.1        4.4       ?       ? 
1 1 1   25   17   54 o    393.0    2.9    0.0000   0.0000          ?        ?  1545.2223  22.9868          ?        ?      393.0        2.9       ?       ? 
1 1 1   25   17   55 o    163.8    5.8    0.0000   0.0000          ?        ?   268.8176  19.1556          ?        ?      163.8        5.8       ?       ? 
1 1 1   25   17   56 o    202.0    4.9    0.0000   0.0000          ?        ?   408.6538  19.7942          ?        ?      202.0        4.9       ?       ? 
1 1 1   25   17   57 o    416.5    2.9    0.0000   0.0000          ?        ?  1735.5017  24.2638          ?        ?      416.5        2.9       ?       ? 
1 1 1   25   17   58 o    324.3    3.2    0.0000   0.0000          ?        ?  1052.2837  21.0712          ?        ?      324.3        3.2       ?       ? 
1 1 1   25   17   59 o    144.9    6.8    0.0000   0.0000          ?        ?   210.7121  19.7942          ?        ?      144.9        6.8       ?       ? 
1 1 1   25   17   60 o    187.7    5.1    0.0000   0.0000          ?        ?   353.1024  19.1556          ?        ?      187.7        5.1       ?       ? 
1 1 1   25   17   61 o     29.4   13.6    0.0000   0.0000          ?        ?   -15.9630  19.1556          ?        ?       29.4       13.6       ?       ? 
1 1 1   25   17   62 o    408.1    3.0    0.0000   0.0000          ?        ?  1667.1801  24.2638          ?        ?      408.1        3.0       ?       ? 
1 1 1   25   17   63 o     73.0   14.1    0.0000   0.0000          ?        ?    56.1899  19.7942          ?        ?       73.0       14.1       ?       ? 
1 1 1   25   17   64 o    240.0    4.3    0.0000   0.0000          ?        ?   577.2236  20.4327          ?        ?      240.0        4.3       ?       ? 
1 1 1   25   17   65 o     50.4   17.0    0.0000   0.0000          ?        ?    24.9023  20.4327          ?        ?       50.4       17.0       ?       ? 
1 1 1   25   17   66 o     24.4   11.9    0.0000   0.0000          ?        ?   -35.1187  19.1556          ?        ?       24.4       11.9       ?       ? 
1 1 1   25   17   67 o    181.8    5.4    0.0000   0.0000          ?        ?   332.0312  19.7942          ?        ?      181.8        5.4       ?       ? 
1 1 1   25   17   68 o     81.1   12.2    0.0000   0.0000          ?        ?    67.6833  19.7942          ?        ?       81.1       12.2       ?       ? 
1 1 1   25   17   69 o     52.6   16.4    0.0000   0.0000          ?        ?    29.3720  19.1556          ?        ?       52.6       16.4       ?       ? 
1 1 1   25   18    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   18    1 o    459.2    2.7    0.0000   0.0000          ?        ?  2108.3984  24.9023          ?        ?      459.2        2.7       ?       ? 
1 1 1   25   18    2 o    778.7    3.5    0.0000   0.0000          ?        ?  6064.6782  54.2743          ?        ?      778.7        3.5       ?       ? 
1 1 1   25   18    3 o    814.5    3.7    0.0000   0.0000          ?        ?  6634.8779  60.6596          ?        ?      814.5        3.7       ?       ? 
1 1 1   25   18    4 o   1322.6    5.3    0.0000   0.0000          ?        ? 17494.2168 139.1977          ?        ?     1322.6        5.3       ?       ? 
1 1 1   25   18    5 o    685.2    3.4    0.0000   0.0000          ?        ?  4695.0493  46.6121          ?        ?      685.2        3.4       ?       ? 
1 1 1   25   18    6 o    374.2    2.7    0.0000   0.0000          ?        ?  1400.2780  20.4327          ?        ?      374.2        2.7       ?       ? 
1 1 1   25   18    7 o    913.0    3.7    0.0000   0.0000          ?        ?  8337.1768  67.0448          ?        ?      913.0        3.7       ?       ? 
1 1 1   25   18    8 o    587.1    2.9    0.0000   0.0000          ?        ?  3446.7397  34.4802          ?        ?      587.1        2.9       ?       ? 
1 1 1   25   18    9 o   1026.7    4.1    0.0000   0.0000          ?        ? 10541.9922  84.2849          ?        ?     1026.7        4.1       ?       ? 
1 1 1   25   18   10 o    691.1    2.8    0.0000   0.0000          ?        ?  4776.1416  38.3113          ?        ?      691.1        2.8       ?       ? 
1 1 1   25   18   11 o    809.1    3.2    0.0000   0.0000          ?        ?  6546.1235  51.7203          ?        ?      809.1        3.2       ?       ? 
1 1 1   25   18   12 o    231.6    2.9    0.0000   0.0000          ?        ?   536.3582  13.4090          ?        ?      231.6        2.9       ?       ? 
1 1 1   25   18   13 o    784.0    3.1    0.0000   0.0000          ?        ?  6147.0479  49.1662          ?        ?      784.0        3.1       ?       ? 
1 1 1   25   18   14 o   1424.9    4.9    0.0000   0.0000          ?        ? 20308.1797 139.1977          ?        ?     1424.9        4.9       ?       ? 
1 1 1   25   18   15 o    878.4    3.3    0.0000   0.0000          ?        ?  7717.1724  58.1055          ?        ?      878.4        3.3       ?       ? 
1 1 1   25   18   16 o    916.6    3.4    0.0000   0.0000          ?        ?  8402.3066  63.2136          ?        ?      916.6        3.4       ?       ? 
1 1 1   25   18   17 o   1127.5    4.0    0.0000   0.0000          ?        ? 12713.6035  91.3086          ?        ?     1127.5        4.0       ?       ? 
1 1 1   25   18   18 o   1146.5    4.1    0.0000   0.0000          ?        ? 13147.1602  94.5012          ?        ?     1146.5        4.1       ?       ? 
1 1 1   25   18   19 o    376.7    2.5    0.0000   0.0000          ?        ?  1419.4336  18.5171          ?        ?      376.7        2.5       ?       ? 
1 1 1   25   18   20 o    108.4    5.6    0.0000   0.0000          ?        ?   117.4880  12.1319          ?        ?      108.4        5.6       ?       ? 
1 1 1   25   18   21 o    929.3    3.5    0.0000   0.0000          ?        ?  8636.6436  64.4907          ?        ?      929.3        3.5       ?       ? 
1 1 1   25   18   22 o    520.5    2.5    0.0000   0.0000          ?        ?  2709.2471  25.5409          ?        ?      520.5        2.5       ?       ? 
1 1 1   25   18   23 o    617.7    2.7    0.0000   0.0000          ?        ?  3816.4438  33.2031          ?        ?      617.7        2.7       ?       ? 
1 1 1   25   18   24 o    445.3    2.4    0.0000   0.0000          ?        ?  1983.2482  21.7097          ?        ?      445.3        2.4       ?       ? 
1 1 1   25   18   25 o    306.7    2.6    0.0000   0.0000          ?        ?   940.5424  15.9630          ?        ?      306.7        2.6       ?       ? 
1 1 1   25   18   26 o    176.9    3.6    0.0000   0.0000          ?        ?   312.8756  12.7704          ?        ?      176.9        3.6       ?       ? 
1 1 1   25   18   27 o    411.3    2.4    0.0000   0.0000          ?        ?  1691.4437  19.7942          ?        ?      411.3        2.4       ?       ? 
1 1 1   25   18   28 o    579.6    2.5    0.0000   0.0000          ?        ?  3359.2622  29.3720          ?        ?      579.6        2.5       ?       ? 
1 1 1   25   18   29 o    190.3    3.9    0.0000   0.0000          ?        ?   362.0418  14.6860          ?        ?      190.3        3.9       ?       ? 
1 1 1   25   18   30 o     92.4    8.6    0.0000   0.0000          ?        ?    85.5619  15.9630          ?        ?       92.4        8.6       ?       ? 
1 1 1   25   18   31 o    655.4    2.9    0.0000   0.0000          ?        ?  4295.9736  37.6728          ?        ?      655.4        2.9       ?       ? 
1 1 1   25   18   32 o    829.3    3.2    0.0000   0.0000          ?        ?  6879.4321  53.6358          ?        ?      829.3        3.2       ?       ? 
1 1 1   25   18   33 o    110.1    6.7    0.0000   0.0000          ?        ?   121.3191  14.6860          ?        ?      110.1        6.7       ?       ? 
1 1 1   25   18   34 o    238.8    3.2    0.0000   0.0000          ?        ?   570.1998  15.3245          ?        ?      238.8        3.2       ?       ? 
1 1 1   25   18   35 o    730.1    3.0    0.0000   0.0000          ?        ?  5331.6558  43.4195          ?        ?      730.1        3.0       ?       ? 
1 1 1   25   18   36 o    367.9    2.6    0.0000   0.0000          ?        ?  1353.6659  19.1556          ?        ?      367.9        2.6       ?       ? 
1 1 1   25   18   37 o    308.3    2.8    0.0000   0.0000          ?        ?   950.7587  17.2401          ?        ?      308.3        2.8       ?       ? 
1 1 1   25   18   38 o    403.8    2.5    0.0000   0.0000          ?        ?  1630.7842  19.7942          ?        ?      403.8        2.5       ?       ? 
1 1 1   25   18   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   18   40 o    297.1    3.0    0.0000   0.0000          ?        ?   883.0754  17.8786          ?        ?      297.1        3.0       ?       ? 
1 1 1   25   18   41 o    262.7    3.2    0.0000   0.0000          ?        ?   690.2419  16.6016          ?        ?      262.7        3.2       ?       ? 
1 1 1   25   18   42 o    393.5    2.6    0.0000   0.0000          ?        ?  1549.0535  20.4327          ?        ?      393.5        2.6       ?       ? 
1 1 1   25   18   43 o     51.1   14.8    0.0000   0.0000          ?        ?    26.8179  15.9630          ?        ?       51.1       14.8       ?       ? 
1 1 1   25   18   44 o    316.6    2.9    0.0000   0.0000          ?        ?  1002.4789  18.5171          ?        ?      316.6        2.9       ?       ? 
1 1 1   25   18   45 o    180.4    4.6    0.0000   0.0000          ?        ?   325.6460  16.6016          ?        ?      180.4        4.6       ?       ? 
1 1 1   25   18   46 o     21.5   10.6    0.0000   0.0000          ?        ?   -37.0343  16.6016          ?        ?       21.5       10.6       ?       ? 
1 1 1   25   18   47 o    193.0    4.5    0.0000   0.0000          ?        ?   372.8966  17.2401          ?        ?      193.0        4.5       ?       ? 
1 1 1   25   18   48 o    176.6    5.1    0.0000   0.0000          ?        ?   312.2371  17.8786          ?        ?      176.6        5.1       ?       ? 
1 1 1   25   18   49 o     78.5   10.6    0.0000   0.0000          ?        ?    61.9366  16.6016          ?        ?       78.5       10.6       ?       ? 
1 1 1   25   18   50 f    132.6    6.5    0.0000   0.0000          ?        ?   176.2320  17.2401          ?        ?      132.6        6.5       ?       ? 
1 1 1   25   18   51 o    205.5    4.5    0.0000   0.0000          ?        ?   422.7013  18.5171          ?        ?      205.5        4.5       ?       ? 
1 1 1   25   18   52 o    317.3    3.2    0.0000   0.0000          ?        ?  1007.5872  20.4327          ?        ?      317.3        3.2       ?       ? 
1 1 1   25   18   53 o    279.1    3.5    0.0000   0.0000          ?        ?   779.6349  19.7942          ?        ?      279.1        3.5       ?       ? 
1 1 1   25   18   54 o    397.8    2.8    0.0000   0.0000          ?        ?  1583.5337  22.3483          ?        ?      397.8        2.8       ?       ? 
1 1 1   25   18   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   18   56 o    334.9    3.1    0.0000   0.0000          ?        ?  1122.5210  20.4327          ?        ?      334.9        3.1       ?       ? 
1 1 1   25   18   57 o     40.0   16.1    0.0000   0.0000          ?        ?     7.6623  19.7942          ?        ?       40.0       16.1       ?       ? 
1 1 1   25   18   58 o    240.6    4.1    0.0000   0.0000          ?        ?   579.7776  19.7942          ?        ?      240.6        4.1       ?       ? 
1 1 1   25   18   59 o     44.3   16.4    0.0000   0.0000          ?        ?    15.9630  19.1556          ?        ?       44.3       16.4       ?       ? 
1 1 1   25   18   60 o    208.1    4.8    0.0000   0.0000          ?        ?   434.1947  19.7942          ?        ?      208.1        4.8       ?       ? 
1 1 1   25   18   61 o    131.4    7.3    0.0000   0.0000          ?        ?   173.6779  19.1556          ?        ?      131.4        7.3       ?       ? 
1 1 1   25   18   62 o    359.1    3.3    0.0000   0.0000          ?        ?  1291.0907  23.6253          ?        ?      359.1        3.3       ?       ? 
1 1 1   25   18   63 o     46.8   16.7    0.0000   0.0000          ?        ?    19.7942  19.7942          ?        ?       46.8       16.7       ?       ? 
1 1 1   25   18   64 o    118.0    8.1    0.0000   0.0000          ?        ?   140.4748  19.1556          ?        ?      118.0        8.1       ?       ? 
1 1 1   25   18   65 o    176.1    5.6    0.0000   0.0000          ?        ?   311.5985  19.7942          ?        ?      176.1        5.6       ?       ? 
1 1 1   25   18   66 o    204.4    4.8    0.0000   0.0000          ?        ?   419.5087  19.7942          ?        ?      204.4        4.8       ?       ? 
1 1 1   25   18   67 o    135.7    7.1    0.0000   0.0000          ?        ?   185.8098  19.1556          ?        ?      135.7        7.1       ?       ? 
1 1 1   25   18   68 o     48.4   16.8    0.0000   0.0000          ?        ?    22.9868  19.7942          ?        ?       48.4       16.8       ?       ? 
1 1 1   25   19    0 o   1164.1    7.6 13556.4531 176.2320 13556.4531 176.2320 13556.4531 176.2320     1164.1      7.6     1164.1        7.6     0.0     0.0 
1 1 1   25   19    1 o   2041.4    7.7    0.0000   0.0000          ?        ? 41689.7148 314.7912          ?        ?     2041.4        7.7       ?       ? 
1 1 1   25   19    2 o    718.0    3.6    0.0000   0.0000          ?        ?  5155.4238  52.3588          ?        ?      718.0        3.6       ?       ? 
1 1 1   25   19    3 o    527.9    3.0    0.0000   0.0000          ?        ?  2786.5083  31.9261          ?        ?      527.9        3.0       ?       ? 
1 1 1   25   19    4 o   1008.3    4.3    0.0000   0.0000          ?        ? 10167.8184  86.8389          ?        ?     1008.3        4.3       ?       ? 
1 1 1   25   19    5 o    308.2    2.7    0.0000   0.0000          ?        ?   950.1202  16.6016          ?        ?      308.2        2.7       ?       ? 
1 1 1   25   19    6 o   1217.4    4.6    0.0000   0.0000          ?        ? 14822.6406 112.3798          ?        ?     1217.4        4.6       ?       ? 
1 1 1   25   19    7 o    829.1    3.4    0.0000   0.0000          ?        ?  6874.3237  56.8284          ?        ?      829.1        3.4       ?       ? 
1 1 1   25   19    8 o   1512.0    5.7    0.0000   0.0000          ?        ? 22867.3750 172.4008          ?        ?     1512.0        5.7       ?       ? 
1 1 1   25   19    9 o    599.3    2.8    0.0000   0.0000          ?        ?  3591.6841  33.8416          ?        ?      599.3        2.8       ?       ? 
1 1 1   25   19   10 o    879.9    3.3    0.0000   0.0000          ?        ?  7742.7129  58.7440          ?        ?      879.9        3.3       ?       ? 
1 1 1   25   19   11 o   1174.9    4.2    0.0000   0.0000          ?        ? 13806.1143  98.9709          ?        ?     1174.9        4.2       ?       ? 
1 1 1   25   19   12 o   1445.3    5.1    0.0000   0.0000          ?        ? 20893.7051 146.8600          ?        ?     1445.3        5.1       ?       ? 
1 1 1   25   19   13 o    728.8    2.9    0.0000   0.0000          ?        ?  5311.8613  42.7809          ?        ?      728.8        2.9       ?       ? 
1 1 1   25   19   14 o    469.9    2.4    0.0000   0.0000          ?        ?  2208.0078  22.3483          ?        ?      469.9        2.4       ?       ? 
1 1 1   25   19   15 o    996.9    3.5    0.0000   0.0000          ?        ?  9939.2275  69.5989          ?        ?      996.9        3.5       ?       ? 
1 1 1   25   19   16 o    733.3    3.4    0.0000   0.0000          ?        ?  5378.2676  49.1662          ?        ?      733.3        3.4       ?       ? 
1 1 1   25   19   17 o    585.2    2.9    0.0000   0.0000          ?        ?  3425.0303  34.4802          ?        ?      585.2        2.9       ?       ? 
1 1 1   25   19   18 o    175.8    3.8    0.0000   0.0000          ?        ?   309.0445  13.4090          ?        ?      175.8        3.8       ?       ? 
1 1 1   25   19   19 o    654.3    2.8    0.0000   0.0000          ?        ?  4281.2876  36.3957          ?        ?      654.3        2.8       ?       ? 
1 1 1   25   19   20 o    664.2    2.9    0.0000   0.0000          ?        ?  4411.5459  38.3113          ?        ?      664.2        2.9       ?       ? 
1 1 1   25   19   21 o    375.8    2.5    0.0000   0.0000          ?        ?  1412.4098  18.5171          ?        ?      375.8        2.5       ?       ? 
1 1 1   25   19   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   19   23 o    290.1    3.0    0.0000   0.0000          ?        ?   841.5715  17.2401          ?        ?      290.1        3.0       ?       ? 
1 1 1   25   19   24 o    276.1    3.0    0.0000   0.0000          ?        ?   762.3948  16.6016          ?        ?      276.1        3.0       ?       ? 
1 1 1   25   19   25 o    669.0    2.9    0.0000   0.0000          ?        ?  4476.0366  38.9498          ?        ?      669.0        2.9       ?       ? 
1 1 1   25   19   26 o    528.5    2.5    0.0000   0.0000          ?        ?  2793.5322  26.8179          ?        ?      528.5        2.5       ?       ? 
1 1 1   25   19   27 o    714.8    2.9    0.0000   0.0000          ?        ?  5110.0884  41.5039          ?        ?      714.8        2.9       ?       ? 
1 1 1   25   19   28 o    563.6    2.5    0.0000   0.0000          ?        ?  3177.2837  28.7335          ?        ?      563.6        2.5       ?       ? 
1 1 1   25   19   29 o    538.9    2.6    0.0000   0.0000          ?        ?  2903.9963  28.0950          ?        ?      538.9        2.6       ?       ? 
1 1 1   25   19   30 o    835.9    3.2    0.0000   0.0000          ?        ?  6989.2573  54.2743          ?        ?      835.9        3.2       ?       ? 
1 1 1   25   19   31 o    570.1    2.6    0.0000   0.0000          ?        ?  3250.7136  29.3720          ?        ?      570.1        2.6       ?       ? 
1 1 1   25   19   32 o     98.8    7.1    0.0000   0.0000          ?        ?    97.6938  14.0475          ?        ?       98.8        7.1       ?       ? 
1 1 1   25   19   33 o    680.6    2.8    0.0000   0.0000          ?        ?  4633.1128  37.6728          ?        ?      680.6        2.8       ?       ? 
1 1 1   25   19   34 o    129.3    5.4    0.0000   0.0000          ?        ?   167.2927  14.0475          ?        ?      129.3        5.4       ?       ? 
1 1 1   25   19   35 o    487.3    2.6    0.0000   0.0000          ?        ?  2374.6619  24.9023          ?        ?      487.3        2.6       ?       ? 
1 1 1   25   19   36 o    150.5    5.1    0.0000   0.0000          ?        ?   226.6752  15.3245          ?        ?      150.5        5.1       ?       ? 
1 1 1   25   19   37 o    128.8    5.7    0.0000   0.0000          ?        ?   166.0156  14.6860          ?        ?      128.8        5.7       ?       ? 
1 1 1   25   19   38 o    201.2    3.8    0.0000   0.0000          ?        ?   404.8227  15.3245          ?        ?      201.2        3.8       ?       ? 
1 1 1   25   19   39 o    499.7    2.6    0.0000   0.0000          ?        ?  2497.8967  25.5409          ?        ?      499.7        2.6       ?       ? 
1 1 1   25   19   40 o    206.5    3.7    0.0000   0.0000          ?        ?   426.5325  15.3245          ?        ?      206.5        3.7       ?       ? 
1 1 1   25   19   41 o    363.2    2.5    0.0000   0.0000          ?        ?  1319.1857  18.5171          ?        ?      363.2        2.5       ?       ? 
1 1 1   25   19   42 o    286.1    3.1    0.0000   0.0000          ?        ?   818.5847  17.8786          ?        ?      286.1        3.1       ?       ? 
1 1 1   25   19   43 o    367.0    2.7    0.0000   0.0000          ?        ?  1347.2806  19.7942          ?        ?      367.0        2.7       ?       ? 
1 1 1   25   19   44 o    277.4    3.2    0.0000   0.0000          ?        ?   770.0571  17.8786          ?        ?      277.4        3.2       ?       ? 
1 1 1   25   19   45 o    360.5    2.8    0.0000   0.0000          ?        ?  1300.0300  20.4327          ?        ?      360.5        2.8       ?       ? 
1 1 1   25   19   46 o    535.9    2.6    0.0000   0.0000          ?        ?  2873.3474  28.0950          ?        ?      535.9        2.6       ?       ? 
1 1 1   25   19   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   19   48 o    384.3    2.7    0.0000   0.0000          ?        ?  1477.5391  21.0712          ?        ?      384.3        2.7       ?       ? 
1 1 1   25   19   49 o     79.3   10.5    0.0000   0.0000          ?        ?    63.2136  16.6016          ?        ?       79.3       10.5       ?       ? 
1 1 1   25   19   50 f    123.4    7.0    0.0000   0.0000          ?        ?   152.6067  17.2401          ?        ?      123.4        7.0       ?       ? 
1 1 1   25   19   51 o    152.3    5.9    0.0000   0.0000          ?        ?   232.4219  17.8786          ?        ?      152.3        5.9       ?       ? 
1 1 1   25   19   52 o    341.7    3.0    0.0000   0.0000          ?        ?  1168.4946  20.4327          ?        ?      341.7        3.0       ?       ? 
1 1 1   25   19   53 o    506.6    2.7    0.0000   0.0000          ?        ?  2568.1340  27.4564          ?        ?      506.6        2.7       ?       ? 
1 1 1   25   19   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   19   55 o    167.2    5.3    0.0000   0.0000          ?        ?   280.3110  17.8786          ?        ?      167.2        5.3       ?       ? 
1 1 1   25   19   56 o     22.0   10.9    0.0000   0.0000          ?        ?   -41.5039  17.8786          ?        ?       22.0       10.9       ?       ? 
1 1 1   25   19   57 o     58.2   15.6    0.0000   0.0000          ?        ?    35.7572  18.5171          ?        ?       58.2       15.6       ?       ? 
1 1 1   25   19   58 o     58.7   15.9    0.0000   0.0000          ?        ?    36.3957  19.1556          ?        ?       58.7       15.9       ?       ? 
1 1 1   25   19   59 o    182.0    5.3    0.0000   0.0000          ?        ?   332.0312  19.1556          ?        ?      182.0        5.3       ?       ? 
1 1 1   25   19   60 o     92.3   10.4    0.0000   0.0000          ?        ?    86.2004  19.1556          ?        ?       92.3       10.4       ?       ? 
1 1 1   25   19   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   19   62 o     65.1   15.4    0.0000   0.0000          ?        ?    45.3350  19.7942          ?        ?       65.1       15.4       ?       ? 
1 1 1   25   19   63 o     86.5   11.1    0.0000   0.0000          ?        ?    75.9841  19.1556          ?        ?       86.5       11.1       ?       ? 
1 1 1   25   19   64 o     24.9   12.1    0.0000   0.0000          ?        ?   -32.5646  19.1556          ?        ?       24.9       12.1       ?       ? 
1 1 1   25   19   65 o    141.5    6.8    0.0000   0.0000          ?        ?   201.7728  19.1556          ?        ?      141.5        6.8       ?       ? 
1 1 1   25   19   66 o     28.6   13.4    0.0000   0.0000          ?        ?   -17.8786  19.1556          ?        ?       28.6       13.4       ?       ? 
1 1 1   25   19   67 o     81.5   12.1    0.0000   0.0000          ?        ?    68.3218  19.7942          ?        ?       81.5       12.1       ?       ? 
1 1 1   25   20    0 o    217.8    6.8  475.6986  29.3720   475.6986  29.3720   475.6986  29.3720      217.8      6.8      217.8        6.8     0.0     0.0 
1 1 1   25   20    1 o    257.8    3.5    0.0000   0.0000          ?        ?   664.7010  17.8786          ?        ?      257.8        3.5       ?       ? 
1 1 1   25   20    2 o   1390.3    6.3    0.0000   0.0000          ?        ? 19335.7109 174.9549          ?        ?     1390.3        6.3       ?       ? 
1 1 1   25   20    3 o    518.1    3.0    0.0000   0.0000          ?        ?  2684.3450  31.2876          ?        ?      518.1        3.0       ?       ? 
1 1 1   25   20    4 o    475.9    3.0    0.0000   0.0000          ?        ?  2264.8362  28.7335          ?        ?      475.9        3.0       ?       ? 
1 1 1   25   20    5 f    447.7    2.9    0.0000   0.0000          ?        ?  2004.3193  25.5409          ?        ?      447.7        2.9       ?       ? 
1 1 1   25   20    6 o   1167.6    4.5    0.0000   0.0000          ?        ? 13635.6289 104.7175          ?        ?     1167.6        4.5       ?       ? 
1 1 1   25   20    7 o    435.3    2.4    0.0000   0.0000          ?        ?  1895.1321  21.0712          ?        ?      435.3        2.4       ?       ? 
1 1 1   25   20    8 o    199.9    3.0    0.0000   0.0000          ?        ?   399.7145  12.1319          ?        ?      199.9        3.0       ?       ? 
1 1 1   25   20    9 o    440.7    2.6    0.0000   0.0000          ?        ?  1942.3828  22.9868          ?        ?      440.7        2.6       ?       ? 
1 1 1   25   20   10 o    397.0    2.2    0.0000   0.0000          ?        ?  1576.5099  17.2401          ?        ?      397.0        2.2       ?       ? 
1 1 1   25   20   11 o    944.5    3.5    0.0000   0.0000          ?        ?  8922.7012  66.4062          ?        ?      944.5        3.5       ?       ? 
1 1 1   25   20   12 o   1100.0    3.9    0.0000   0.0000          ?        ? 12101.2617  86.8389          ?        ?     1100.0        3.9       ?       ? 
1 1 1   25   20   13 o    564.3    2.7    0.0000   0.0000          ?        ?  3184.9458  30.6490          ?        ?      564.3        2.7       ?       ? 
1 1 1   25   20   14 o    391.7    2.3    0.0000   0.0000          ?        ?  1534.3674  17.8786          ?        ?      391.7        2.3       ?       ? 
1 1 1   25   20   15 o    126.3    4.5    0.0000   0.0000          ?        ?   159.6304  11.4934          ?        ?      126.3        4.5       ?       ? 
1 1 1   25   20   16 o    342.0    2.2    0.0000   0.0000          ?        ?  1169.7716  15.3245          ?        ?      342.0        2.2       ?       ? 
1 1 1   25   20   17 o    631.4    2.6    0.0000   0.0000          ?        ?  3986.9292  33.2031          ?        ?      631.4        2.6       ?       ? 
1 1 1   25   20   18 o    555.5    2.5    0.0000   0.0000          ?        ?  3085.9749  27.4564          ?        ?      555.5        2.5       ?       ? 
1 1 1   25   20   19 o    603.4    2.6    0.0000   0.0000          ?        ?  3640.8503  31.2876          ?        ?      603.4        2.6       ?       ? 
1 1 1   25   20   20 o   1284.3    4.4    0.0000   0.0000          ?        ? 16497.4824 113.0183          ?        ?     1284.3        4.4       ?       ? 
1 1 1   25   20   21 o    414.8    2.4    0.0000   0.0000          ?        ?  1720.8158  19.7942          ?        ?      414.8        2.4       ?       ? 
1 1 1   25   20   22 o    130.3    4.7    0.0000   0.0000          ?        ?   169.8468  12.1319          ?        ?      130.3        4.7       ?       ? 
1 1 1   25   20   23 o    303.3    2.5    0.0000   0.0000          ?        ?   920.1097  15.3245          ?        ?      303.3        2.5       ?       ? 
1 1 1   25   20   24 o    339.2    2.4    0.0000   0.0000          ?        ?  1150.6160  15.9630          ?        ?      339.2        2.4       ?       ? 
1 1 1   25   20   25 o    646.1    2.7    0.0000   0.0000          ?        ?  4174.6543  34.4802          ?        ?      646.1        2.7       ?       ? 
1 1 1   25   20   26 f    332.0    2.5    0.0000   0.0000          ?        ?  1102.0884  16.6016          ?        ?      332.0        2.5       ?       ? 
1 1 1   25   20   27 o    240.2    3.1    0.0000   0.0000          ?        ?   577.2236  14.6860          ?        ?      240.2        3.1       ?       ? 
1 1 1   25   20   28 o    399.6    2.6    0.0000   0.0000          ?        ?  1596.9426  20.4327          ?        ?      399.6        2.6       ?       ? 
1 1 1   25   20   29 o    421.6    2.7    0.0000   0.0000          ?        ?  1777.6442  22.9868          ?        ?      421.6        2.7       ?       ? 
1 1 1   25   20   30 o    545.6    2.7    0.0000   0.0000          ?        ?  2976.7878  29.3720          ?        ?      545.6        2.7       ?       ? 
1 1 1   25   20   31 o    359.6    2.6    0.0000   0.0000          ?        ?  1293.6449  18.5171          ?        ?      359.6        2.6       ?       ? 
1 1 1   25   20   32 o    363.9    2.7    0.0000   0.0000          ?        ?  1324.2938  19.7942          ?        ?      363.9        2.7       ?       ? 
1 1 1   25   20   33 o    155.3    4.7    0.0000   0.0000          ?        ?   241.3612  14.6860          ?        ?      155.3        4.7       ?       ? 
1 1 1   25   20   34 f     19.5    9.7    0.0000   0.0000          ?        ?   -36.3957  14.6860          ?        ?       19.5        9.7       ?       ? 
1 1 1   25   20   35 o    273.6    3.0    0.0000   0.0000          ?        ?   748.9859  16.6016          ?        ?      273.6        3.0       ?       ? 
1 1 1   25   20   36 o    137.4    5.3    0.0000   0.0000          ?        ?   189.0024  14.6860          ?        ?      137.4        5.3       ?       ? 
1 1 1   25   20   37 o    374.7    2.6    0.0000   0.0000          ?        ?  1404.1090  19.1556          ?        ?      374.7        2.6       ?       ? 
1 1 1   25   20   38 o     17.5    8.8    0.0000   0.0000          ?        ?   -44.0580  14.0475          ?        ?       17.5        8.8       ?       ? 
1 1 1   25   20   39 o     95.5    7.7    0.0000   0.0000          ?        ?    91.3086  14.6860          ?        ?       95.5        7.7       ?       ? 
1 1 1   25   20   40 o    164.5    4.7    0.0000   0.0000          ?        ?   270.7332  15.3245          ?        ?      164.5        4.7       ?       ? 
1 1 1   25   20   41 o    269.0    3.2    0.0000   0.0000          ?        ?   724.0836  17.2401          ?        ?      269.0        3.2       ?       ? 
1 1 1   25   20   42 o    543.9    2.6    0.0000   0.0000          ?        ?  2958.9092  28.0950          ?        ?      543.9        2.6       ?       ? 
1 1 1   25   20   43 o    274.0    3.5    0.0000   0.0000          ?        ?   750.9014  19.1556          ?        ?      274.0        3.5       ?       ? 
1 1 1   25   20   44 o    262.4    3.4    0.0000   0.0000          ?        ?   688.9648  17.8786          ?        ?      262.4        3.4       ?       ? 
1 1 1   25   20   45 o    225.4    3.8    0.0000   0.0000          ?        ?   508.2632  17.2401          ?        ?      225.4        3.8       ?       ? 
1 1 1   25   20   46 o    171.5    5.0    0.0000   0.0000          ?        ?   294.3585  17.2401          ?        ?      171.5        5.0       ?       ? 
1 1 1   25   20   47 o    359.7    2.8    0.0000   0.0000          ?        ?  1294.2833  19.7942          ?        ?      359.7        2.8       ?       ? 
1 1 1   25   20   48 o    370.3    2.8    0.0000   0.0000          ?        ?  1372.1830  21.0712          ?        ?      370.3        2.8       ?       ? 
1 1 1   25   20   49 o    328.7    3.1    0.0000   0.0000          ?        ?  1081.0171  20.4327          ?        ?      328.7        3.1       ?       ? 
1 1 1   25   20   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   20   51 o    236.8    4.0    0.0000   0.0000          ?        ?   561.2605  19.1556          ?        ?      236.8        4.0       ?       ? 
1 1 1   25   20   52 o     37.7   15.4    0.0000   0.0000          ?        ?     5.1082  18.5171          ?        ?       37.7       15.4       ?       ? 
1 1 1   25   20   53 o    363.4    3.0    0.0000   0.0000          ?        ?  1321.7397  21.7097          ?        ?      363.4        3.0       ?       ? 
1 1 1   25   20   54 o     52.2   15.4    0.0000   0.0000          ?        ?    28.0950  17.2401          ?        ?       52.2       15.4       ?       ? 
1 1 1   25   20   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   20   56 o    186.5    5.1    0.0000   0.0000          ?        ?   348.6328  19.1556          ?        ?      186.5        5.1       ?       ? 
1 1 1   25   20   57 o     66.4   14.3    0.0000   0.0000          ?        ?    46.6121  18.5171          ?        ?       66.4       14.3       ?       ? 
1 1 1   25   20   58 o    330.3    3.3    0.0000   0.0000          ?        ?  1091.8719  21.7097          ?        ?      330.3        3.3       ?       ? 
1 1 1   25   20   59 o     77.7   12.3    0.0000   0.0000          ?        ?    61.2981  19.1556          ?        ?       77.7       12.3       ?       ? 
1 1 1   25   20   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   20   61 o    277.1    3.8    0.0000   0.0000          ?        ?   769.4186  21.0712          ?        ?      277.1        3.8       ?       ? 
1 1 1   25   20   62 o    102.0   10.0    0.0000   0.0000          ?        ?   105.3561  20.4327          ?        ?      102.0       10.0       ?       ? 
1 1 1   25   20   63 o     65.0   15.4    0.0000   0.0000          ?        ?    45.3350  19.7942          ?        ?       65.0       15.4       ?       ? 
1 1 1   25   20   64 o    104.9    9.7    0.0000   0.0000          ?        ?   111.7413  20.4327          ?        ?      104.9        9.7       ?       ? 
1 1 1   25   20   65 o     92.3   10.4    0.0000   0.0000          ?        ?    86.8389  19.1556          ?        ?       92.3       10.4       ?       ? 
1 1 1   25   20   66 o    124.2    7.5    0.0000   0.0000          ?        ?   155.7993  18.5171          ?        ?      124.2        7.5       ?       ? 
1 1 1   25   20   67 o     22.5   11.2    0.0000   0.0000          ?        ?   -44.6965  19.1556          ?        ?       22.5       11.2       ?       ? 
1 1 1   25   21    0 o    690.2    7.6 4766.5640 104.7175  4766.5640 104.7175  4766.5640 104.7175      690.2      7.6      690.2        7.6     0.0     0.0 
1 1 1   25   21    1 o   1263.9    5.8    0.0000   0.0000          ?        ? 15979.6426 146.2215          ?        ?     1263.9        5.8       ?       ? 
1 1 1   25   21    2 o    741.0    4.4    0.0000   0.0000          ?        ?  5491.2861  64.4907          ?        ?      741.0        4.4       ?       ? 
1 1 1   25   21    3 o   1497.4    6.4    0.0000   0.0000          ?        ? 22429.3496 192.1950          ?        ?     1497.4        6.4       ?       ? 
1 1 1   25   21    4 o    300.4    5.4    0.0000   0.0000          ?        ?   902.8696  32.5646          ?        ?      300.4        5.4       ?       ? 
1 1 1   25   21    5 o    704.8    3.5    0.0000   0.0000          ?        ?  4967.6982  49.1662          ?        ?      704.8        3.5       ?       ? 
1 1 1   25   21    6 o    508.0    2.5    0.0000   0.0000          ?        ?  2580.9045  25.5409          ?        ?      508.0        2.5       ?       ? 
1 1 1   25   21    7 o    620.2    2.7    0.0000   0.0000          ?        ?  3847.0928  33.2031          ?        ?      620.2        2.7       ?       ? 
1 1 1   25   21    8 o    833.8    3.3    0.0000   0.0000          ?        ?  6953.5005  55.5514          ?        ?      833.8        3.3       ?       ? 
1 1 1   25   21    9 f    461.9    2.4    0.0000   0.0000          ?        ?  2133.9395  22.3483          ?        ?      461.9        2.4       ?       ? 
1 1 1   25   21   10 o   1010.2    3.8    0.0000   0.0000          ?        ? 10206.1299  75.9841          ?        ?     1010.2        3.8       ?       ? 
1 1 1   25   21   11 o    498.1    2.4    0.0000   0.0000          ?        ?  2481.2952  23.6253          ?        ?      498.1        2.4       ?       ? 
1 1 1   25   21   12 o    223.7    2.4    0.0000   0.0000          ?        ?   500.6010  10.8549          ?        ?      223.7        2.4       ?       ? 
1 1 1   25   21   13 o    941.2    3.3    0.0000   0.0000          ?        ?  8859.4873  61.9366          ?        ?      941.2        3.3       ?       ? 
1 1 1   25   21   14 o    456.0    2.3    0.0000   0.0000          ?        ?  2079.6650  21.0712          ?        ?      456.0        2.3       ?       ? 
1 1 1   25   21   15 o    188.7    2.9    0.0000   0.0000          ?        ?   356.2951  10.8549          ?        ?      188.7        2.9       ?       ? 
1 1 1   25   21   16 o    460.1    2.3    0.0000   0.0000          ?        ?  2116.6992  21.0712          ?        ?      460.1        2.3       ?       ? 
1 1 1   25   21   17 o    289.4    2.4    0.0000   0.0000          ?        ?   837.7404  14.0475          ?        ?      289.4        2.4       ?       ? 
1 1 1   25   21   18 f    577.5    2.5    0.0000   0.0000          ?        ?  3334.9983  28.7335          ?        ?      577.5        2.5       ?       ? 
1 1 1   25   21   19 o    195.6    3.1    0.0000   0.0000          ?        ?   382.4745  12.1319          ?        ?      195.6        3.1       ?       ? 
1 1 1   25   21   20 o    690.1    2.8    0.0000   0.0000          ?        ?  4763.3711  38.9498          ?        ?      690.1        2.8       ?       ? 
1 1 1   25   21   21 o    496.4    2.4    0.0000   0.0000          ?        ?  2464.6934  23.6253          ?        ?      496.4        2.4       ?       ? 
1 1 1   25   21   22 o    466.4    2.4    0.0000   0.0000          ?        ?  2175.4434  22.3483          ?        ?      466.4        2.4       ?       ? 
1 1 1   25   21   23 o    267.9    2.7    0.0000   0.0000          ?        ?   717.6983  14.6860          ?        ?      267.9        2.7       ?       ? 
1 1 1   25   21   24 o     86.4    7.0    0.0000   0.0000          ?        ?    74.7070  12.1319          ?        ?       86.4        7.0       ?       ? 
1 1 1   25   21   25 o    124.0    4.9    0.0000   0.0000          ?        ?   153.8837  12.1319          ?        ?      124.0        4.9       ?       ? 
1 1 1   25   21   26 o    347.4    2.5    0.0000   0.0000          ?        ?  1206.8059  17.2401          ?        ?      347.4        2.5       ?       ? 
1 1 1   25   21   27 o    578.6    2.5    0.0000   0.0000          ?        ?  3347.7688  29.3720          ?        ?      578.6        2.5       ?       ? 
1 1 1   25   21   28 o    486.0    2.4    0.0000   0.0000          ?        ?  2361.8914  23.6253          ?        ?      486.0        2.4       ?       ? 
1 1 1   25   21   29 o    327.1    2.6    0.0000   0.0000          ?        ?  1070.1622  17.2401          ?        ?      327.1        2.6       ?       ? 
1 1 1   25   21   30 o    507.9    2.6    0.0000   0.0000          ?        ?  2579.6274  26.8179          ?        ?      507.9        2.6       ?       ? 
1 1 1   25   21   31 o    761.3    3.1    0.0000   0.0000          ?        ?  5796.4990  46.6121          ?        ?      761.3        3.1       ?       ? 
1 1 1   25   21   32 o    281.9    2.8    0.0000   0.0000          ?        ?   794.9594  15.9630          ?        ?      281.9        2.8       ?       ? 
1 1 1   25   21   33 o    245.7    3.2    0.0000   0.0000          ?        ?   604.0414  15.9630          ?        ?      245.7        3.2       ?       ? 
1 1 1   25   21   34 o    401.6    2.7    0.0000   0.0000          ?        ?  1613.5442  21.7097          ?        ?      401.6        2.7       ?       ? 
1 1 1   25   21   35 o    260.4    3.1    0.0000   0.0000          ?        ?   678.1099  15.9630          ?        ?      260.4        3.1       ?       ? 
1 1 1   25   21   36 o    465.4    2.5    0.0000   0.0000          ?        ?  2166.5039  23.6253          ?        ?      465.4        2.5       ?       ? 
1 1 1   25   21   37 o    498.9    2.6    0.0000   0.0000          ?        ?  2489.5957  26.1794          ?        ?      498.9        2.6       ?       ? 
1 1 1   25   21   38 o     31.7   13.4    0.0000   0.0000          ?        ?     0.6385  14.6860          ?        ?       31.7       13.4       ?       ? 
1 1 1   25   21   39 o    500.6    2.5    0.0000   0.0000          ?        ?  2506.1973  24.9023          ?        ?      500.6        2.5       ?       ? 
1 1 1   25   21   40 o     52.4   13.4    0.0000   0.0000          ?        ?    28.7335  14.0475          ?        ?       52.4       13.4       ?       ? 
1 1 1   25   21   41 o     25.3   11.9    0.0000   0.0000          ?        ?   -18.5171  15.9630          ?        ?       25.3       11.9       ?       ? 
1 1 1   25   21   42 o    405.3    2.8    0.0000   0.0000          ?        ?  1642.9160  22.3483          ?        ?      405.3        2.8       ?       ? 
1 1 1   25   21   43 o    286.5    3.1    0.0000   0.0000          ?        ?   821.1389  17.8786          ?        ?      286.5        3.1       ?       ? 
1 1 1   25   21   44 o    240.4    3.6    0.0000   0.0000          ?        ?   578.5006  17.2401          ?        ?      240.4        3.6       ?       ? 
1 1 1   25   21   45 o    297.3    3.1    0.0000   0.0000          ?        ?   884.3525  18.5171          ?        ?      297.3        3.1       ?       ? 
1 1 1   25   21   46 o    162.9    4.9    0.0000   0.0000          ?        ?   265.6250  15.9630          ?        ?      162.9        4.9       ?       ? 
1 1 1   25   21   47 o    364.5    2.7    0.0000   0.0000          ?        ?  1329.4020  19.7942          ?        ?      364.5        2.7       ?       ? 
1 1 1   25   21   48 o    316.1    3.1    0.0000   0.0000          ?        ?   999.9249  19.7942          ?        ?      316.1        3.1       ?       ? 
1 1 1   25   21   49 o    308.0    3.1    0.0000   0.0000          ?        ?   949.4816  19.1556          ?        ?      308.0        3.1       ?       ? 
1 1 1   25   21   50 o    329.5    3.2    0.0000   0.0000          ?        ?  1086.1254  21.0712          ?        ?      329.5        3.2       ?       ? 
1 1 1   25   21   51 o    473.5    2.8    0.0000   0.0000          ?        ?  2243.1265  26.8179          ?        ?      473.5        2.8       ?       ? 
1 1 1   25   21   52 o    497.5    2.8    0.0000   0.0000          ?        ?  2476.8254  27.4564          ?        ?      497.5        2.8       ?       ? 
1 1 1   25   21   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   21   54 o    231.4    4.3    0.0000   0.0000          ?        ?   536.3582  19.7942          ?        ?      231.4        4.3       ?       ? 
1 1 1   25   21   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   21   56 o    194.1    4.9    0.0000   0.0000          ?        ?   377.3663  19.1556          ?        ?      194.1        4.9       ?       ? 
1 1 1   25   21   57 o    131.9    7.3    0.0000   0.0000          ?        ?   174.9549  19.1556          ?        ?      131.9        7.3       ?       ? 
1 1 1   25   21   58 o    130.0    7.4    0.0000   0.0000          ?        ?   169.8468  19.1556          ?        ?      130.0        7.4       ?       ? 
1 1 1   25   21   59 o    213.1    4.6    0.0000   0.0000          ?        ?   455.2659  19.7942          ?        ?      213.1        4.6       ?       ? 
1 1 1   25   21   60 o    102.7   10.0    0.0000   0.0000          ?        ?   106.6331  20.4327          ?        ?      102.7       10.0       ?       ? 
1 1 1   25   21   61 o     45.3   16.4    0.0000   0.0000          ?        ?    17.8786  19.1556          ?        ?       45.3       16.4       ?       ? 
1 1 1   25   21   62 o    133.0    7.2    0.0000   0.0000          ?        ?   178.1475  19.1556          ?        ?      133.0        7.2       ?       ? 
1 1 1   25   21   63 o    116.5    8.5    0.0000   0.0000          ?        ?   137.2822  19.7942          ?        ?      116.5        8.5       ?       ? 
1 1 1   25   21   64 o    278.9    3.7    0.0000   0.0000          ?        ?   779.6349  20.4327          ?        ?      278.9        3.7       ?       ? 
1 1 1   25   21   65 o    104.0    9.2    0.0000   0.0000          ?        ?   109.8257  19.1556          ?        ?      104.0        9.2       ?       ? 
1 1 1   25   21   66 o     23.2   11.4    0.0000   0.0000          ?        ?   -37.0343  18.5171          ?        ?       23.2       11.4       ?       ? 
1 1 1   25   22    0 o    367.4    5.0 1351.1118  37.0343  1351.1118  37.0343  1351.1118  37.0343      367.4      5.0      367.4        5.0     0.0     0.0 
1 1 1   25   22    1 o    678.3    3.8    0.0000   0.0000          ?        ?  4601.1865  51.0817          ?        ?      678.3        3.8       ?       ? 
1 1 1   25   22    2 o    405.8    3.2    0.0000   0.0000          ?        ?  1646.7472  26.1794          ?        ?      405.8        3.2       ?       ? 
1 1 1   25   22    3 o    326.6    3.2    0.0000   0.0000          ?        ?  1066.9697  21.0712          ?        ?      326.6        3.2       ?       ? 
1 1 1   25   22    4 o    455.2    3.0    0.0000   0.0000          ?        ?  2072.6414  27.4564          ?        ?      455.2        3.0       ?       ? 
1 1 1   25   22    5 o    593.2    3.2    0.0000   0.0000          ?        ?  3519.5312  38.3113          ?        ?      593.2        3.2       ?       ? 
1 1 1   25   22    6 o    116.6    4.4    0.0000   0.0000          ?        ?   136.0051  10.2163          ?        ?      116.6        4.4       ?       ? 
1 1 1   25   22    7 o    474.7    2.6    0.0000   0.0000          ?        ?  2253.3428  24.9023          ?        ?      474.7        2.6       ?       ? 
1 1 1   25   22    8 o    266.9    2.8    0.0000   0.0000          ?        ?   712.5901  14.6860          ?        ?      266.9        2.8       ?       ? 
1 1 1   25   22    9 o    330.2    2.2    0.0000   0.0000          ?        ?  1090.5950  14.6860          ?        ?      330.2        2.2       ?       ? 
1 1 1   25   22   10 o    424.4    2.4    0.0000   0.0000          ?        ?  1801.2695  20.4327          ?        ?      424.4        2.4       ?       ? 
1 1 1   25   22   11 o    397.6    2.1    0.0000   0.0000          ?        ?  1580.9796  16.6016          ?        ?      397.6        2.1       ?       ? 
1 1 1   25   22   12 o    670.0    2.6    0.0000   0.0000          ?        ?  4489.4453  34.4802          ?        ?      670.0        2.6       ?       ? 
1 1 1   25   22   13 o    831.8    3.1    0.0000   0.0000          ?        ?  6919.0200  51.0817          ?        ?      831.8        3.1       ?       ? 
1 1 1   25   22   14 o    803.8    3.1    0.0000   0.0000          ?        ?  6461.8389  49.1662          ?        ?      803.8        3.1       ?       ? 
1 1 1   25   22   15 o    293.2    2.3    0.0000   0.0000          ?        ?   859.4501  13.4090          ?        ?      293.2        2.3       ?       ? 
1 1 1   25   22   16 o    448.7    2.3    0.0000   0.0000          ?        ?  2013.8972  20.4327          ?        ?      448.7        2.3       ?       ? 
1 1 1   25   22   17 o    765.7    3.0    0.0000   0.0000          ?        ?  5864.1826  45.3350          ?        ?      765.7        3.0       ?       ? 
1 1 1   25   22   18 o    563.8    2.5    0.0000   0.0000          ?        ?  3178.5605  28.0950          ?        ?      563.8        2.5       ?       ? 
1 1 1   25   22   19 f    339.3    2.4    0.0000   0.0000          ?        ?  1151.2545  15.9630          ?        ?      339.3        2.4       ?       ? 
1 1 1   25   22   20 o    472.4    2.4    0.0000   0.0000          ?        ?  2231.6331  22.3483          ?        ?      472.4        2.4       ?       ? 
1 1 1   25   22   21 o    350.8    2.4    0.0000   0.0000          ?        ?  1231.0697  16.6016          ?        ?      350.8        2.4       ?       ? 
1 1 1   25   22   22 o    384.0    2.3    0.0000   0.0000          ?        ?  1474.9850  17.8786          ?        ?      384.0        2.3       ?       ? 
1 1 1   25   22   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   22   24 o    309.0    2.5    0.0000   0.0000          ?        ?   955.2284  15.3245          ?        ?      309.0        2.5       ?       ? 
1 1 1   25   22   25 o    130.5    4.6    0.0000   0.0000          ?        ?   170.4853  12.1319          ?        ?      130.5        4.6       ?       ? 
1 1 1   25   22   26 o    416.6    2.4    0.0000   0.0000          ?        ?  1736.1403  19.7942          ?        ?      416.6        2.4       ?       ? 
1 1 1   25   22   27 o    422.4    2.3    0.0000   0.0000          ?        ?  1784.6680  19.7942          ?        ?      422.4        2.3       ?       ? 
1 1 1   25   22   28 o    152.0    4.4    0.0000   0.0000          ?        ?   231.1448  13.4090          ?        ?      152.0        4.4       ?       ? 
1 1 1   25   22   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   22   30 o    165.5    4.2    0.0000   0.0000          ?        ?   273.9258  14.0475          ?        ?      165.5        4.2       ?       ? 
1 1 1   25   22   31 o    544.4    2.6    0.0000   0.0000          ?        ?  2964.6558  28.0950          ?        ?      544.4        2.6       ?       ? 
1 1 1   25   22   32 o    139.7    5.5    0.0000   0.0000          ?        ?   195.3876  15.3245          ?        ?      139.7        5.5       ?       ? 
1 1 1   25   22   33 o    454.9    2.5    0.0000   0.0000          ?        ?  2069.4487  22.9868          ?        ?      454.9        2.5       ?       ? 
1 1 1   25   22   34 o    381.8    2.6    0.0000   0.0000          ?        ?  1457.7449  19.7942          ?        ?      381.8        2.6       ?       ? 
1 1 1   25   22   35 o    383.8    2.7    0.0000   0.0000          ?        ?  1473.0693  20.4327          ?        ?      383.8        2.7       ?       ? 
1 1 1   25   22   36 o    414.6    2.5    0.0000   0.0000          ?        ?  1719.5387  21.0712          ?        ?      414.6        2.5       ?       ? 
1 1 1   25   22   37 o    176.6    4.5    0.0000   0.0000          ?        ?   312.2371  15.9630          ?        ?      176.6        4.5       ?       ? 
1 1 1   25   22   38 o     44.2   14.8    0.0000   0.0000          ?        ?    18.5171  15.3245          ?        ?       44.2       14.8       ?       ? 
1 1 1   25   22   39 o    279.7    3.2    0.0000   0.0000          ?        ?   782.8275  17.8786          ?        ?      279.7        3.2       ?       ? 
1 1 1   25   22   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   22   41 o    238.3    3.6    0.0000   0.0000          ?        ?   568.2842  17.2401          ?        ?      238.3        3.6       ?       ? 
1 1 1   25   22   42 o    335.5    3.0    0.0000   0.0000          ?        ?  1126.3521  20.4327          ?        ?      335.5        3.0       ?       ? 
1 1 1   25   22   43 o     99.6    8.3    0.0000   0.0000          ?        ?    99.6094  16.6016          ?        ?       99.6        8.3       ?       ? 
1 1 1   25   22   44 o    319.6    3.0    0.0000   0.0000          ?        ?  1021.6346  19.1556          ?        ?      319.6        3.0       ?       ? 
1 1 1   25   22   45 o    455.1    2.6    0.0000   0.0000          ?        ?  2072.0027  23.6253          ?        ?      455.1        2.6       ?       ? 
1 1 1   25   22   46 o    126.4    6.6    0.0000   0.0000          ?        ?   160.2689  16.6016          ?        ?      126.4        6.6       ?       ? 
1 1 1   25   22   47 o    200.9    4.4    0.0000   0.0000          ?        ?   404.1842  17.8786          ?        ?      200.9        4.4       ?       ? 
1 1 1   25   22   48 o    340.2    2.9    0.0000   0.0000          ?        ?  1157.6398  19.7942          ?        ?      340.2        2.9       ?       ? 
1 1 1   25   22   49 o    391.0    2.7    0.0000   0.0000          ?        ?  1529.2593  21.0712          ?        ?      391.0        2.7       ?       ? 
1 1 1   25   22   50 o    567.5    2.8    0.0000   0.0000          ?        ?  3222.6187  31.2876          ?        ?      567.5        2.8       ?       ? 
1 1 1   25   22   51 o     41.6   15.9    0.0000   0.0000          ?        ?    12.1319  18.5171          ?        ?       41.6       15.9       ?       ? 
1 1 1   25   22   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   22   53 o     91.4   10.1    0.0000   0.0000          ?        ?    84.2849  18.5171          ?        ?       91.4       10.1       ?       ? 
1 1 1   25   22   54 o    123.5    7.2    0.0000   0.0000          ?        ?   153.2452  17.8786          ?        ?      123.5        7.2       ?       ? 
1 1 1   25   22   55 o    114.4    7.8    0.0000   0.0000          ?        ?   131.5355  17.8786          ?        ?      114.4        7.8       ?       ? 
1 1 1   25   22   56 o    122.7    7.8    0.0000   0.0000          ?        ?   151.3296  19.1556          ?        ?      122.7        7.8       ?       ? 
1 1 1   25   22   57 o    185.9    5.3    0.0000   0.0000          ?        ?   346.7172  19.7942          ?        ?      185.9        5.3       ?       ? 
1 1 1   25   22   58 o    320.2    3.4    0.0000   0.0000          ?        ?  1026.7428  21.7097          ?        ?      320.2        3.4       ?       ? 
1 1 1   25   22   59 o     38.5   15.9    0.0000   0.0000          ?        ?     5.1082  19.7942          ?        ?       38.5       15.9       ?       ? 
1 1 1   25   22   60 o    222.7    4.6    0.0000   0.0000          ?        ?   497.4084  20.4327          ?        ?      222.7        4.6       ?       ? 
1 1 1   25   22   61 o     53.1   16.4    0.0000   0.0000          ?        ?    29.3720  19.1556          ?        ?       53.1       16.4       ?       ? 
1 1 1   25   22   62 o    245.6    4.3    0.0000   0.0000          ?        ?   604.6799  21.0712          ?        ?      245.6        4.3       ?       ? 
1 1 1   25   22   63 o     70.3   14.6    0.0000   0.0000          ?        ?    52.9973  19.7942          ?        ?       70.3       14.6       ?       ? 
1 1 1   25   22   64 o     36.8   15.3    0.0000   0.0000          ?        ?     4.4697  18.5171          ?        ?       36.8       15.3       ?       ? 
1 1 1   25   22   65 o    100.8    9.5    0.0000   0.0000          ?        ?   103.4405  19.1556          ?        ?      100.8        9.5       ?       ? 
1 1 1   25   23    0 f    381.1    6.8 1453.9137  51.7203  1453.9137  51.7203  1453.9137  51.7203      381.1      6.8      381.1        6.8     0.0     0.0 
1 1 1   25   23    1 o   1033.2    5.2    0.0000   0.0000          ?        ? 10677.3584 106.6331          ?        ?     1033.2        5.2       ?       ? 
1 1 1   25   23    2 o    489.4    3.5    0.0000   0.0000          ?        ?  2395.7332  34.4802          ?        ?      489.4        3.5       ?       ? 
1 1 1   25   23    3 o    732.5    3.7    0.0000   0.0000          ?        ?  5366.1357  54.9129          ?        ?      732.5        3.7       ?       ? 
1 1 1   25   23    4 o    444.9    3.2    0.0000   0.0000          ?        ?  1979.4170  28.7335          ?        ?      444.9        3.2       ?       ? 
1 1 1   25   23    5 o    381.0    2.7    0.0000   0.0000          ?        ?  1451.3596  20.4327          ?        ?      381.0        2.7       ?       ? 
1 1 1   25   23    6 o    515.8    2.7    0.0000   0.0000          ?        ?  2660.7197  27.4564          ?        ?      515.8        2.7       ?       ? 
1 1 1   25   23    7 o    356.6    2.6    0.0000   0.0000          ?        ?  1271.9351  18.5171          ?        ?      356.6        2.6       ?       ? 
1 1 1   25   23    8 o    756.6    3.2    0.0000   0.0000          ?        ?  5725.6235  48.5276          ?        ?      756.6        3.2       ?       ? 
1 1 1   25   23    9 o    275.6    2.2    0.0000   0.0000          ?        ?   759.8408  12.1319          ?        ?      275.6        2.2       ?       ? 
1 1 1   25   23   10 o     42.2   10.0    0.0000   0.0000          ?        ?    18.5171   8.3008          ?        ?       42.2       10.0       ?       ? 
1 1 1   25   23   11 o    263.4    2.1    0.0000   0.0000          ?        ?   694.0730  10.8549          ?        ?      263.4        2.1       ?       ? 
1 1 1   25   23   12 o    729.2    2.8    0.0000   0.0000          ?        ?  5318.2466  41.5039          ?        ?      729.2        2.8       ?       ? 
1 1 1   25   23   13 o    469.3    2.4    0.0000   0.0000          ?        ?  2202.8997  22.3483          ?        ?      469.3        2.4       ?       ? 
1 1 1   25   23   14 o    516.8    2.7    0.0000   0.0000          ?        ?  2671.5745  27.4564          ?        ?      516.8        2.7       ?       ? 
1 1 1   25   23   15 o    266.1    2.3    0.0000   0.0000          ?        ?   708.1205  12.1319          ?        ?      266.1        2.3       ?       ? 
1 1 1   25   23   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   23   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   23   18 o    295.9    2.5    0.0000   0.0000          ?        ?   875.4132  14.6860          ?        ?      295.9        2.5       ?       ? 
1 1 1   25   23   19 o    507.3    2.4    0.0000   0.0000          ?        ?  2573.8806  24.2638          ?        ?      507.3        2.4       ?       ? 
1 1 1   25   23   20 o    212.8    2.9    0.0000   0.0000          ?        ?   452.7119  12.1319          ?        ?      212.8        2.9       ?       ? 
1 1 1   25   23   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   23   22 o    475.3    2.4    0.0000   0.0000          ?        ?  2259.0894  22.9868          ?        ?      475.3        2.4       ?       ? 
1 1 1   25   23   23 o    201.7    3.3    0.0000   0.0000          ?        ?   406.7383  13.4090          ?        ?      201.7        3.3       ?       ? 
1 1 1   25   23   24 o     84.5    7.2    0.0000   0.0000          ?        ?    71.5144  12.1319          ?        ?       84.5        7.2       ?       ? 
1 1 1   25   23   25 o    771.3    3.1    0.0000   0.0000          ?        ?  5950.3833  47.2506          ?        ?      771.3        3.1       ?       ? 
1 1 1   25   23   26 o    199.6    3.5    0.0000   0.0000          ?        ?   398.4375  14.0475          ?        ?      199.6        3.5       ?       ? 
1 1 1   25   23   27 o    141.8    4.5    0.0000   0.0000          ?        ?   201.1343  12.7704          ?        ?      141.8        4.5       ?       ? 
1 1 1   25   23   28 o    567.1    2.5    0.0000   0.0000          ?        ?  3216.2334  28.7335          ?        ?      567.1        2.5       ?       ? 
1 1 1   25   23   29 o    166.6    4.4    0.0000   0.0000          ?        ?   277.7569  14.6860          ?        ?      166.6        4.4       ?       ? 
1 1 1   25   23   30 o    349.7    2.6    0.0000   0.0000          ?        ?  1223.4075  17.8786          ?        ?      349.7        2.6       ?       ? 
1 1 1   25   23   31 o    392.0    2.7    0.0000   0.0000          ?        ?  1536.9215  21.0712          ?        ?      392.0        2.7       ?       ? 
1 1 1   25   23   32 o    729.6    3.2    0.0000   0.0000          ?        ?  5325.2705  46.6121          ?        ?      729.6        3.2       ?       ? 
1 1 1   25   23   33 o    222.7    3.4    0.0000   0.0000          ?        ?   496.1313  15.3245          ?        ?      222.7        3.4       ?       ? 
1 1 1   25   23   34 o    100.4    7.3    0.0000   0.0000          ?        ?   100.8864  14.6860          ?        ?      100.4        7.3       ?       ? 
1 1 1   25   23   35 o    307.7    2.9    0.0000   0.0000          ?        ?   946.9276  17.8786          ?        ?      307.7        2.9       ?       ? 
1 1 1   25   23   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   23   37 o     93.4    8.2    0.0000   0.0000          ?        ?    87.4775  15.3245          ?        ?       93.4        8.2       ?       ? 
1 1 1   25   23   38 o    305.9    2.8    0.0000   0.0000          ?        ?   936.0728  17.2401          ?        ?      305.9        2.8       ?       ? 
1 1 1   25   23   39 o    318.6    2.8    0.0000   0.0000          ?        ?  1015.2494  17.8786          ?        ?      318.6        2.8       ?       ? 
1 1 1   25   23   40 o    289.8    3.1    0.0000   0.0000          ?        ?   840.2945  17.8786          ?        ?      289.8        3.1       ?       ? 
1 1 1   25   23   41 o    137.8    6.0    0.0000   0.0000          ?        ?   190.2794  16.6016          ?        ?      137.8        6.0       ?       ? 
1 1 1   25   23   42 o    337.4    2.9    0.0000   0.0000          ?        ?  1139.1226  19.7942          ?        ?      337.4        2.9       ?       ? 
1 1 1   25   23   43 o    218.6    3.8    0.0000   0.0000          ?        ?   478.2527  16.6016          ?        ?      218.6        3.8       ?       ? 
1 1 1   25   23   44 o    136.4    6.1    0.0000   0.0000          ?        ?   186.4483  16.6016          ?        ?      136.4        6.1       ?       ? 
1 1 1   25   23   45 o    134.3    6.2    0.0000   0.0000          ?        ?   180.7016  16.6016          ?        ?      134.3        6.2       ?       ? 
1 1 1   25   23   46 o    163.0    5.3    0.0000   0.0000          ?        ?   266.2635  17.2401          ?        ?      163.0        5.3       ?       ? 
1 1 1   25   23   47 o    314.5    3.1    0.0000   0.0000          ?        ?   989.7085  19.7942          ?        ?      314.5        3.1       ?       ? 
1 1 1   25   23   48 o     50.0   15.2    0.0000   0.0000          ?        ?    25.5409  16.6016          ?        ?       50.0       15.2       ?       ? 
1 1 1   25   23   49 o    204.8    4.4    0.0000   0.0000          ?        ?   420.1472  17.8786          ?        ?      204.8        4.4       ?       ? 
1 1 1   25   23   50 o    201.7    4.7    0.0000   0.0000          ?        ?   407.3768  19.1556          ?        ?      201.7        4.7       ?       ? 
1 1 1   25   23   51 o    311.7    3.3    0.0000   0.0000          ?        ?   972.4684  20.4327          ?        ?      311.7        3.3       ?       ? 
1 1 1   25   23   52 o    167.4    5.5    0.0000   0.0000          ?        ?   280.9495  18.5171          ?        ?      167.4        5.5       ?       ? 
1 1 1   25   23   53 f    188.9    5.1    0.0000   0.0000          ?        ?   357.5721  19.1556          ?        ?      188.9        5.1       ?       ? 
1 1 1   25   23   54 o    139.5    6.9    0.0000   0.0000          ?        ?   195.3876  19.1556          ?        ?      139.5        6.9       ?       ? 
1 1 1   25   23   55 o    262.2    3.9    0.0000   0.0000          ?        ?   688.3264  20.4327          ?        ?      262.2        3.9       ?       ? 
1 1 1   25   23   56 o    165.8    5.8    0.0000   0.0000          ?        ?   275.8413  19.1556          ?        ?      165.8        5.8       ?       ? 
1 1 1   25   23   57 o    120.5    8.5    0.0000   0.0000          ?        ?   146.2215  20.4327          ?        ?      120.5        8.5       ?       ? 
1 1 1   25   23   58 o     24.6   11.9    0.0000   0.0000          ?        ?   -31.2876  18.5171          ?        ?       24.6       11.9       ?       ? 
1 1 1   25   23   59 o    170.3    6.0    0.0000   0.0000          ?        ?   291.1659  20.4327          ?        ?      170.3        6.0       ?       ? 
1 1 1   25   23   60 o     22.6   11.2    0.0000   0.0000          ?        ?   -48.5276  19.7942          ?        ?       22.6       11.2       ?       ? 
1 1 1   25   23   61 o    217.8    4.5    0.0000   0.0000          ?        ?   475.6986  19.7942          ?        ?      217.8        4.5       ?       ? 
1 1 1   25   23   62 o    105.5    9.4    0.0000   0.0000          ?        ?   113.0183  19.7942          ?        ?      105.5        9.4       ?       ? 
1 1 1   25   23   63 o     96.1    9.6    0.0000   0.0000          ?        ?    93.8627  18.5171          ?        ?       96.1        9.6       ?       ? 
1 1 1   25   23   64 o     25.7   12.4    0.0000   0.0000          ?        ?   -28.7335  19.1556          ?        ?       25.7       12.4       ?       ? 
1 1 1   25   24    0 o    400.2    5.0 1602.6893  40.2269  1602.6893  40.2269  1602.6893  40.2269      400.2      5.0      400.2        5.0     0.0     0.0 
1 1 1   25   24    1 o    258.2    3.8    0.0000   0.0000          ?        ?   666.6166  19.7942          ?        ?      258.2        3.8       ?       ? 
1 1 1   25   24    2 o    255.7    3.7    0.0000   0.0000          ?        ?   653.8461  19.1556          ?        ?      255.7        3.7       ?       ? 
1 1 1   25   24    3 o    549.1    3.2    0.0000   0.0000          ?        ?  3015.0991  35.1187          ?        ?      549.1        3.2       ?       ? 
1 1 1   25   24    4 o    364.7    3.3    0.0000   0.0000          ?        ?  1330.0405  24.2638          ?        ?      364.7        3.3       ?       ? 
1 1 1   25   24    5 o     26.9   12.6    0.0000   0.0000          ?        ?   -15.9630  16.6016          ?        ?       26.9       12.6       ?       ? 
1 1 1   25   24    6 o    266.6    3.2    0.0000   0.0000          ?        ?   710.6746  17.2401          ?        ?      266.6        3.2       ?       ? 
1 1 1   25   24    7 o    786.8    3.2    0.0000   0.0000          ?        ?  6191.7441  51.0817          ?        ?      786.8        3.2       ?       ? 
1 1 1   25   24    8 o    661.2    3.0    0.0000   0.0000          ?        ?  4371.9575  40.2269          ?        ?      661.2        3.0       ?       ? 
1 1 1   25   24    9 f    176.0    3.3    0.0000   0.0000          ?        ?   309.6830  11.4934          ?        ?      176.0        3.3       ?       ? 
1 1 1   25   24   10 o    479.0    2.3    0.0000   0.0000          ?        ?  2294.8467  22.3483          ?        ?      479.0        2.3       ?       ? 
1 1 1   25   24   11 o    131.3    2.9    0.0000   0.0000          ?        ?   172.4008   7.6623          ?        ?      131.3        2.9       ?       ? 
1 1 1   25   24   12 o    286.5    2.2    0.0000   0.0000          ?        ?   821.1389  12.7704          ?        ?      286.5        2.2       ?       ? 
1 1 1   25   24   13 o    182.7    2.6    0.0000   0.0000          ?        ?   333.9468   9.5778          ?        ?      182.7        2.6       ?       ? 
1 1 1   25   24   14 o    153.9    3.3    0.0000   0.0000          ?        ?   236.8915  10.2163          ?        ?      153.9        3.3       ?       ? 
1 1 1   25   24   15 o    689.2    3.0    0.0000   0.0000          ?        ?  4751.2393  40.8654          ?        ?      689.2        3.0       ?       ? 
1 1 1   25   24   16 o    465.3    2.3    0.0000   0.0000          ?        ?  2165.2268  21.7097          ?        ?      465.3        2.3       ?       ? 
1 1 1   25   24   17 o    127.1    4.0    0.0000   0.0000          ?        ?   161.5460  10.2163          ?        ?      127.1        4.0       ?       ? 
1 1 1   25   24   18 o    508.0    2.5    0.0000   0.0000          ?        ?  2580.9045  24.9023          ?        ?      508.0        2.5       ?       ? 
1 1 1   25   24   19 o    478.0    2.3    0.0000   0.0000          ?        ?  2284.6304  21.7097          ?        ?      478.0        2.3       ?       ? 
1 1 1   25   24   20 o    556.2    2.5    0.0000   0.0000          ?        ?  3093.6372  27.4564          ?        ?      556.2        2.5       ?       ? 
1 1 1   25   24   21 o    258.5    2.5    0.0000   0.0000          ?        ?   668.5321  12.7704          ?        ?      258.5        2.5       ?       ? 
1 1 1   25   24   22 o    109.5    5.2    0.0000   0.0000          ?        ?   120.0421  11.4934          ?        ?      109.5        5.2       ?       ? 
1 1 1   25   24   23 o    160.6    4.0    0.0000   0.0000          ?        ?   257.9627  12.7704          ?        ?      160.6        4.0       ?       ? 
1 1 1   25   24   24 o    297.6    2.5    0.0000   0.0000          ?        ?   885.6295  14.6860          ?        ?      297.6        2.5       ?       ? 
1 1 1   25   24   25 o    346.0    2.4    0.0000   0.0000          ?        ?  1197.2280  16.6016          ?        ?      346.0        2.4       ?       ? 
1 1 1   25   24   26 o    384.7    2.5    0.0000   0.0000          ?        ?  1480.0931  19.1556          ?        ?      384.7        2.5       ?       ? 
1 1 1   25   24   27 o    174.5    3.8    0.0000   0.0000          ?        ?   304.5748  13.4090          ?        ?      174.5        3.8       ?       ? 
1 1 1   25   24   28 o     16.5    8.3    0.0000   0.0000          ?        ?   -41.5039  12.7704          ?        ?       16.5        8.3       ?       ? 
1 1 1   25   24   29 o    288.6    2.7    0.0000   0.0000          ?        ?   833.2708  15.3245          ?        ?      288.6        2.7       ?       ? 
1 1 1   25   24   30 o    152.2    4.4    0.0000   0.0000          ?        ?   231.7833  13.4090          ?        ?      152.2        4.4       ?       ? 
1 1 1   25   24   31 o    247.0    3.1    0.0000   0.0000          ?        ?   610.4266  15.3245          ?        ?      247.0        3.1       ?       ? 
1 1 1   25   24   32 o    227.8    3.6    0.0000   0.0000          ?        ?   519.1181  16.6016          ?        ?      227.8        3.6       ?       ? 
1 1 1   25   24   33 o    151.1    4.9    0.0000   0.0000          ?        ?   228.5907  14.6860          ?        ?      151.1        4.9       ?       ? 
1 1 1   25   24   34 o    285.4    2.9    0.0000   0.0000          ?        ?   814.7536  16.6016          ?        ?      285.4        2.9       ?       ? 
1 1 1   25   24   35 o    149.4    5.3    0.0000   0.0000          ?        ?   223.4826  15.9630          ?        ?      149.4        5.3       ?       ? 
1 1 1   25   24   36 o    450.6    2.6    0.0000   0.0000          ?        ?  2031.1373  23.6253          ?        ?      450.6        2.6       ?       ? 
1 1 1   25   24   37 o    354.5    2.9    0.0000   0.0000          ?        ?  1257.2490  20.4327          ?        ?      354.5        2.9       ?       ? 
1 1 1   25   24   38 o    180.7    4.2    0.0000   0.0000          ?        ?   326.9231  15.3245          ?        ?      180.7        4.2       ?       ? 
1 1 1   25   24   39 o     82.9    8.9    0.0000   0.0000          ?        ?    68.9603  14.6860          ?        ?       82.9        8.9       ?       ? 
1 1 1   25   24   40 o    116.5    6.6    0.0000   0.0000          ?        ?   136.0051  15.3245          ?        ?      116.5        6.6       ?       ? 
1 1 1   25   24   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   24   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   24   43 o    163.5    4.7    0.0000   0.0000          ?        ?   267.5406  15.3245          ?        ?      163.5        4.7       ?       ? 
1 1 1   25   24   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   24   45 o    285.5    3.4    0.0000   0.0000          ?        ?   815.3921  19.1556          ?        ?      285.5        3.4       ?       ? 
1 1 1   25   24   46 f     20.1   10.0    0.0000   0.0000          ?        ?   -49.1662  17.2401          ?        ?       20.1       10.0       ?       ? 
1 1 1   25   24   47 o     29.1   13.2    0.0000   0.0000          ?        ?    -9.5778  16.6016          ?        ?       29.1       13.2       ?       ? 
1 1 1   25   24   48 o    189.8    4.7    0.0000   0.0000          ?        ?   360.7647  17.8786          ?        ?      189.8        4.7       ?       ? 
1 1 1   25   24   49 o    238.7    3.7    0.0000   0.0000          ?        ?   570.1998  17.8786          ?        ?      238.7        3.7       ?       ? 
1 1 1   25   24   50 o    169.3    5.3    0.0000   0.0000          ?        ?   287.3347  17.8786          ?        ?      169.3        5.3       ?       ? 
1 1 1   25   24   51 o    137.5    6.3    0.0000   0.0000          ?        ?   189.6409  17.2401          ?        ?      137.5        6.3       ?       ? 
1 1 1   25   24   52 o    337.8    3.1    0.0000   0.0000          ?        ?  1141.6766  21.0712          ?        ?      337.8        3.1       ?       ? 
1 1 1   25   24   53 o    178.8    5.0    0.0000   0.0000          ?        ?   320.5379  17.8786          ?        ?      178.8        5.0       ?       ? 
1 1 1   25   24   54 o     26.4   12.6    0.0000   0.0000          ?        ?   -24.2638  18.5171          ?        ?       26.4       12.6       ?       ? 
1 1 1   25   24   55 o    167.9    5.7    0.0000   0.0000          ?        ?   282.8651  19.1556          ?        ?      167.9        5.7       ?       ? 
1 1 1   25   24   56 o    179.1    5.2    0.0000   0.0000          ?        ?   321.8149  18.5171          ?        ?      179.1        5.2       ?       ? 
1 1 1   25   24   57 o    107.3    8.6    0.0000   0.0000          ?        ?   116.2109  18.5171          ?        ?      107.3        8.6       ?       ? 
1 1 1   25   24   58 o     77.9   12.7    0.0000   0.0000          ?        ?    61.9366  19.7942          ?        ?       77.9       12.7       ?       ? 
1 1 1   25   24   59 o     98.8   10.3    0.0000   0.0000          ?        ?    98.9709  20.4327          ?        ?       98.8       10.3       ?       ? 
1 1 1   25   24   60 o    316.4    3.6    0.0000   0.0000          ?        ?  1003.1175  22.9868          ?        ?      316.4        3.6       ?       ? 
1 1 1   25   24   61 o    147.9    6.7    0.0000   0.0000          ?        ?   220.2900  19.7942          ?        ?      147.9        6.7       ?       ? 
1 1 1   25   24   62 f     90.9   10.5    0.0000   0.0000          ?        ?    84.2849  19.1556          ?        ?       90.9       10.5       ?       ? 
1 1 1   25   24   63 o    224.0    4.4    0.0000   0.0000          ?        ?   503.7936  19.7942          ?        ?      224.0        4.4       ?       ? 
1 1 1   25   25    0 o    870.3    8.1 7578.6133 141.7518  7578.6133 141.7518  7578.6133 141.7518      870.3      8.1      870.3        8.1     0.0     0.0 
1 1 1   25   25    1 o    822.5    5.5 6767.6909  90.6701  6767.6909  90.6701  6767.6909  90.6701      822.5      5.5      822.5        5.5     0.0     0.0 
1 1 1   25   25    2 o    402.2    4.2 1618.6523  33.8416  1618.6523  33.8416  1618.6523  33.8416      402.2      4.2      402.2        4.2     0.0     0.0 
1 1 1   25   25    3 o    275.4    5.0  759.2022  27.4564   759.2022  27.4564   759.2022  27.4564      275.4      5.0      275.4        5.0     0.0     0.0 
1 1 1   25   25    4 o    131.3    9.1  174.9549  23.6253   174.9549  23.6253   174.9549  23.6253      131.3      9.1      131.3        9.1     0.0     0.0 
1 1 1   25   25    5 o    353.7    4.4 1251.5024  31.2876  1251.5024  31.2876  1251.5024  31.2876      353.7      4.4      353.7        4.4     0.0     0.0 
1 1 1   25   25    6 o    437.2    3.9 1911.7338  33.8416  1911.7338  33.8416  1911.7338  33.8416      437.2      3.9      437.2        3.9     0.0     0.0 
1 1 1   25   25    7 o    391.4    3.4 1532.4519  26.8179  1532.4519  26.8179  1532.4519  26.8179      391.4      3.4      391.4        3.4     0.0     0.0 
1 1 1   25   25    8 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   25    9 o    250.9    3.8  630.2208  19.1556   630.2208  19.1556   630.2208  19.1556      250.9      3.8      250.9        3.8     0.0     0.0 
1 1 1   25   25   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   25   11 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   25   12 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   25   13 o    139.1    4.4  194.1106  12.1319   194.1106  12.1319   194.1106  12.1319      139.1      4.4      139.1        4.4     0.0     0.0 
1 1 1   25   25   14 o    756.6    4.9 5726.2617  73.4300  5726.2617  73.4300  5726.2617  73.4300      756.6      4.9      756.6        4.9     0.0     0.0 
1 1 1   25   25   15 f    483.1    3.5 2334.4351  33.8416  2334.4351  33.8416  2334.4351  33.8416      483.1      3.5      483.1        3.5     0.0     0.0 
1 1 1   25   25   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   25   17 o    191.4    4.3  367.1499  16.6016   367.1499  16.6016   367.1499  16.6016      191.4      4.3      191.4        4.3     0.0     0.0 
1 1 1   25   25   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   25   19 o    446.1    3.4 1990.2720  30.0105  1990.2720  30.0105  1990.2720  30.0105      446.1      3.4      446.1        3.4     0.0     0.0 
1 1 1   25   25   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   25   21 o    180.0    5.0  325.0075  17.8786   325.0075  17.8786   325.0075  17.8786      180.0      5.0      180.0        5.0     0.0     0.0 
1 1 1   25   25   22 o     20.0   13.6   -7.6623  15.9630    -7.6623  15.9630    -7.6623  15.9630       20.0     13.6       20.0       13.6     0.0     0.0 
1 1 1   25   25   23 o    553.9    3.7 3068.7349  40.8654  3068.7349  40.8654  3068.7349  40.8654      553.9      3.7      553.9        3.7     0.0     0.0 
1 1 1   25   25   24 o     12.5    9.3  -48.5276  16.6016   -48.5276  16.6016   -48.5276  16.6016       12.5      9.3       12.5        9.3     0.0     0.0 
1 1 1   25   25   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   25   26 o     12.5    9.4  -61.9366  18.5171   -61.9366  18.5171   -61.9366  18.5171       12.5      9.4       12.5        9.4     0.0     0.0 
1 1 1   25   25   27 o    606.8    3.8 3683.6313  46.6121  3683.6313  46.6121  3683.6313  46.6121      606.8      3.8      606.8        3.8     0.0     0.0 
1 1 1   25   25   28 o    358.5    3.5 1285.9825  24.9023  1285.9825  24.9023  1285.9825  24.9023      358.5      3.5      358.5        3.5     0.0     0.0 
1 1 1   25   25   29 o    341.7    3.6 1168.4946  24.2638  1168.4946  24.2638  1168.4946  24.2638      341.7      3.6      341.7        3.6     0.0     0.0 
1 1 1   25   25   30 o    238.9    4.1  571.4769  19.7942   571.4769  19.7942   571.4769  19.7942      238.9      4.1      238.9        4.1     0.0     0.0 
1 1 1   25   25   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   25   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   25   33 o     28.0   18.0    1.9156  22.3483     1.9156  22.3483     1.9156  22.3483       28.0     18.0       28.0       18.0     0.0     0.0 
1 1 1   25   25   34 o     15.5   11.4  -52.3588  21.7097   -52.3588  21.7097   -52.3588  21.7097       15.5     11.4       15.5       11.4     0.0     0.0 
1 1 1   25   25   35 o    239.2    5.1  573.3925  24.2638   573.3925  24.2638   573.3925  24.2638      239.2      5.1      239.2        5.1     0.0     0.0 
1 1 1   25   25   36 o     23.3   15.8   -8.9393  21.0712    -8.9393  21.0712    -8.9393  21.0712       23.3     15.8       23.3       15.8     0.0     0.0 
1 1 1   25   25   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   25   25   38 o    319.2    4.2 1019.7190  26.8179  1019.7190  26.8179  1019.7190  26.8179      319.2      4.2      319.2        4.2     0.0     0.0 
1 1 1   25   25   39 o    232.5    5.1  541.4664  23.6253   541.4664  23.6253   541.4664  23.6253      232.5      5.1      232.5        5.1     0.0     0.0 
1 1 1   25   25   40 o     39.9   20.9   23.6253  21.7097    23.6253  21.7097    23.6253  21.7097       39.9     20.9       39.9       20.9     0.0     0.0 
1 1 1   25   25   41 o    228.4    4.9  522.9492  22.3483   522.9492  22.3483   522.9492  22.3483      228.4      4.9      228.4        4.9     0.0     0.0 
1 1 1   25   25   42 o    231.5    5.0  536.9967  22.9868   536.9967  22.9868   536.9967  22.9868      231.5      5.0      231.5        5.0     0.0     0.0 
1 1 1   25   25   43 o    142.4    7.9  204.9654  22.3483   204.9654  22.3483   204.9654  22.3483      142.4      7.9      142.4        7.9     0.0     0.0 
1 1 1   25   25   44 o     60.6   21.9   49.1662  24.2638    49.1662  24.2638    49.1662  24.2638       60.6     21.9       60.6       21.9     0.0     0.0 
1 1 1   25   25   45 o     14.5   10.8  -83.6463  24.9023   -83.6463  24.9023   -83.6463  24.9023       14.5     10.8       14.5       10.8     0.0     0.0 
1 1 1   25   25   46 o    384.5    3.8 1479.4546  29.3720  1479.4546  29.3720  1479.4546  29.3720      384.5      3.8      384.5        3.8     0.0     0.0 
1 1 1   25   25   47 o    260.3    5.2  678.7485  26.8179   678.7485  26.8179   678.7485  26.8179      260.3      5.2      260.3        5.2     0.0     0.0 
1 1 1   25   25   48 o    255.6    5.1  654.4847  26.1794   654.4847  26.1794   654.4847  26.1794      255.6      5.1      255.6        5.1     0.0     0.0 
1 1 1   25   25   49 o    225.9    5.8  512.0943  26.1794   512.0943  26.1794   512.0943  26.1794      225.9      5.8      225.9        5.8     0.0     0.0 
1 1 1   25   25   50 o     19.3   14.0  -43.4195  26.1794   -43.4195  26.1794   -43.4195  26.1794       19.3     14.0       19.3       14.0     0.0     0.0 
1 1 1   25   25   51 o    371.6    4.2 1382.3993  31.2876  1382.3993  31.2876  1382.3993  31.2876      371.6      4.2      371.6        4.2     0.0     0.0 
1 1 1   25   25   52 o    137.1    8.9  190.9180  24.2638   190.9180  24.2638   190.9180  24.2638      137.1      8.9      137.1        8.9     0.0     0.0 
1 1 1   25   25   53 f     24.5   16.9  -15.9630  26.1794   -15.9630  26.1794   -15.9630  26.1794       24.5     16.9       24.5       16.9     0.0     0.0 
1 1 1   25   25   54 o    131.3    9.8  176.2320  25.5409   176.2320  25.5409   176.2320  25.5409      131.3      9.8      131.3        9.8     0.0     0.0 
1 1 1   25   25   55 o     16.0   11.9  -73.4300  26.1794   -73.4300  26.1794   -73.4300  26.1794       16.0     11.9       16.0       11.9     0.0     0.0 
1 1 1   25   25   56 o    153.6    9.0  239.4456  27.4564   239.4456  27.4564   239.4456  27.4564      153.6      9.0      153.6        9.0     0.0     0.0 
1 1 1   25   25   57 o    253.8    5.4  646.1838  27.4564   646.1838  27.4564   646.1838  27.4564      253.8      5.4      253.8        5.4     0.0     0.0 
1 1 1   25   25   58 o     28.0   18.7   -5.7467  27.4564    -5.7467  27.4564    -5.7467  27.4564       28.0     18.7       28.0       18.7     0.0     0.0 
1 1 1   25   25   59 f    187.4    7.7  354.3795  28.7335   354.3795  28.7335   354.3795  28.7335      187.4      7.7      187.4        7.7     0.0     0.0 
1 1 1   25   25   60 o     32.4   20.6    6.3852  28.0950     6.3852  28.0950     6.3852  28.0950       32.4     20.6       32.4       20.6     0.0     0.0 
1 1 1   25   25   61 o    201.6    7.1  409.9309  28.7335   409.9309  28.7335   409.9309  28.7335      201.6      7.1      201.6        7.1     0.0     0.0 
1 1 1   25   25   62 o     15.4   11.5  -87.4775  27.4564   -87.4775  27.4564   -87.4775  27.4564       15.4     11.5       15.4       11.5     0.0     0.0 
1 1 1   26    0    0 o    132.2    5.1  175.5934  13.4090   175.5934  13.4090   175.5934  13.4090      132.2      5.1      132.2        5.1     0.0     0.0 
1 1 1   26    0    1 o    370.5    2.8 1372.8215  21.0712  1372.8215  21.0712  1372.8215  21.0712      370.5      2.8      370.5        2.8     0.0     0.0 
1 1 1   26    0    2 o     23.9   17.5  -82.3693  43.4195   -82.3693  43.4195   -82.3693  43.4195       23.9     17.5       23.9       17.5     0.0     0.0 
1 1 1   26    0    3 o    555.1    3.5 3082.1440  38.9498  3082.1440  38.9498  3082.1440  38.9498      555.1      3.5      555.1        3.5     0.0     0.0 
1 1 1   26    0    4 o    727.8    4.3 5297.8140  61.9366  5297.8140  61.9366  5297.8140  61.9366      727.8      4.3      727.8        4.3     0.0     0.0 
1 1 1   26    0    5 o    213.9    3.1  457.8200  13.4090   457.8200  13.4090   457.8200  13.4090      213.9      3.1      213.9        3.1     0.0     0.0 
1 1 1   26    0    6 o   1180.5    5.9 13937.6504 138.5592 13937.6504 138.5592 13937.6504 138.5592     1180.5      5.9     1180.5        5.9     0.0     0.0 
1 1 1   26    0    7 o    547.1    3.2 2994.0278  35.1187  2994.0278  35.1187  2994.0278  35.1187      547.1      3.2      547.1        3.2     0.0     0.0 
1 1 1   26    0    8 o    298.6    2.7  892.0147  15.9630   892.0147  15.9630   892.0147  15.9630      298.6      2.7      298.6        2.7     0.0     0.0 
1 1 1   26    0    9 o    236.3    3.1  558.7064  14.6860   558.7064  14.6860   558.7064  14.6860      236.3      3.1      236.3        3.1     0.0     0.0 
1 1 1   26    0   10 o   2212.9   10.2 48979.7148 450.7963 48979.7148 450.7963 48979.7148 450.7963     2212.9     10.2     2212.9       10.2     0.0     0.0 
1 1 1   26    0   11 o    917.4    4.6 8416.3535  84.9234  8416.3535  84.9234  8416.3535  84.9234      917.4      4.6      917.4        4.6     0.0     0.0 
1 1 1   26    0   12 o    231.9    3.3  538.2737  15.3245   538.2737  15.3245   538.2737  15.3245      231.9      3.3      231.9        3.3     0.0     0.0 
1 1 1   26    0   13 o     13.0    9.5  -21.0712  12.1319   -21.0712  12.1319   -21.0712  12.1319       13.0      9.5       13.0        9.5     0.0     0.0 
1 1 1   26    0   14 o   2330.5   10.6 54324.7852 496.1313 54324.7852 496.1313 54324.7852 496.1313     2330.5     10.6     2330.5       10.6     0.0     0.0 
1 1 1   26    0   15 o    381.2    3.0 1453.2753  22.9868  1453.2753  22.9868  1453.2753  22.9868      381.2      3.0      381.2        3.0     0.0     0.0 
1 1 1   26    0   16 o   1937.9    9.4 37560.3945 363.3188 37560.3945 363.3188 37560.3945 363.3188     1937.9      9.4     1937.9        9.4     0.0     0.0 
1 1 1   26    0   17 o    648.4    3.6 4205.3032  47.2506  4205.3032  47.2506  4205.3032  47.2506      648.4      3.6      648.4        3.6     0.0     0.0 
1 1 1   26    0   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    0   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    0   20 o    338.9    3.2 1148.7003  21.7097  1148.7003  21.7097  1148.7003  21.7097      338.9      3.2      338.9        3.2     0.0     0.0 
1 1 1   26    0   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    0   22 o    337.7    3.0 1141.0381  20.4327  1141.0381  20.4327  1141.0381  20.4327      337.7      3.0      337.7        3.0     0.0     0.0 
1 1 1   26    0   23 o   1337.8    6.7 17899.0371 178.1475 17899.0371 178.1475 17899.0371 178.1475     1337.8      6.7     1337.8        6.7     0.0     0.0 
1 1 1   26    0   24 o    867.7    4.5 7529.4468  78.5382  7529.4468  78.5382  7529.4468  78.5382      867.7      4.5      867.7        4.5     0.0     0.0 
1 1 1   26    0   25 o    558.1    3.5 3114.7085  39.5883  3114.7085  39.5883  3114.7085  39.5883      558.1      3.5      558.1        3.5     0.0     0.0 
1 1 1   26    0   26 o    106.4   10.1  116.2109  21.0712   116.2109  21.0712   116.2109  21.0712      106.4     10.1      106.4       10.1     0.0     0.0 
1 1 1   26    0   27 o   1224.0    6.7 14983.5488 163.4615 14983.5488 163.4615 14983.5488 163.4615     1224.0      6.7     1224.0        6.7     0.0     0.0 
1 1 1   26    0   28 o   1072.8    5.8 11510.6289 125.1502 11510.6289 125.1502 11510.6289 125.1502     1072.8      5.8     1072.8        5.8     0.0     0.0 
1 1 1   26    0   29 o   1913.4    9.3 36619.8555 354.3795 36619.8555 354.3795 36619.8555 354.3795     1913.4      9.3     1913.4        9.3     0.0     0.0 
1 1 1   26    0   30 o    482.2    4.4 2326.1343  42.1424  2326.1343  42.1424  2326.1343  42.1424      482.2      4.4      482.2        4.4     0.0     0.0 
1 1 1   26    0   31 o    418.6    4.0 1752.7418  33.2031  1752.7418  33.2031  1752.7418  33.2031      418.6      4.0      418.6        4.0     0.0     0.0 
1 1 1   26    0   32 f    769.4    4.6 5921.0107  70.2374  5921.0107  70.2374  5921.0107  70.2374      769.4      4.6      769.4        4.6     0.0     0.0 
1 1 1   26    0   33 o   1109.0    6.5 12301.7578 144.3059 12301.7578 144.3059 12301.7578 144.3059     1109.0      6.5     1109.0        6.5     0.0     0.0 
1 1 1   26    0   34 o    464.4    3.8 2156.9260  35.1187  2156.9260  35.1187  2156.9260  35.1187      464.4      3.8      464.4        3.8     0.0     0.0 
1 1 1   26    0   35 o    110.9   10.5  126.4273  22.9868   126.4273  22.9868   126.4273  22.9868      110.9     10.5      110.9       10.5     0.0     0.0 
1 1 1   26    0   36 o   1148.7    6.0 13198.8809 137.2822 13198.8809 137.2822 13198.8809 137.2822     1148.7      6.0     1148.7        6.0     0.0     0.0 
1 1 1   26    0   37 o   1923.8    8.9 37025.9531 342.8861 37025.9531 342.8861 37025.9531 342.8861     1923.8      8.9     1923.8        8.9     0.0     0.0 
1 1 1   26    0   38 o    370.6    4.0 1374.0985  30.0105  1374.0985  30.0105  1374.0985  30.0105      370.6      4.0      370.6        4.0     0.0     0.0 
1 1 1   26    0   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    0   40 o    406.9    5.1 1656.9636  41.5039  1656.9636  41.5039  1656.9636  41.5039      406.9      5.1      406.9        5.1     0.0     0.0 
1 1 1   26    0   41 o    463.6    4.1 2149.9023  37.6728  2149.9023  37.6728  2149.9023  37.6728      463.6      4.1      463.6        4.1     0.0     0.0 
1 1 1   26    0   42 o    261.8    5.1  686.4108  26.8179   686.4108  26.8179   686.4108  26.8179      261.8      5.1      261.8        5.1     0.0     0.0 
1 1 1   26    0   43 o    893.4    4.6 7982.7969  83.0078  7982.7969  83.0078  7982.7969  83.0078      893.4      4.6      893.4        4.6     0.0     0.0 
1 1 1   26    0   44 o    280.2    4.6  786.0201  25.5409   786.0201  25.5409   786.0201  25.5409      280.2      4.6      280.2        4.6     0.0     0.0 
1 1 1   26    0   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    0   46 o    684.7    4.3 4689.9414  58.7440  4689.9414  58.7440  4689.9414  58.7440      684.7      4.3      684.7        4.3     0.0     0.0 
1 1 1   26    0   47 o    937.8    5.1 8798.8281  96.4168  8798.8281  96.4168  8798.8281  96.4168      937.8      5.1      937.8        5.1     0.0     0.0 
1 1 1   26    0   48 o    176.8    7.1  314.1526  24.9023   314.1526  24.9023   314.1526  24.9023      176.8      7.1      176.8        7.1     0.0     0.0 
1 1 1   26    0   49 o    106.8   11.3  118.1265  23.6253   118.1265  23.6253   118.1265  23.6253      106.8     11.3      106.8       11.3     0.0     0.0 
1 1 1   26    0   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    0   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    0   52 o    854.1    4.6 7297.6641  77.8996  7297.6641  77.8996  7297.6641  77.8996      854.1      4.6      854.1        4.6     0.0     0.0 
1 1 1   26    0   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    0   54 o    467.3    4.1 2184.3826  38.3113  2184.3826  38.3113  2184.3826  38.3113      467.3      4.1      467.3        4.1     0.0     0.0 
1 1 1   26    0   55 o     22.1   15.9  -45.3350  31.2876   -45.3350  31.2876   -45.3350  31.2876       22.1     15.9       22.1       15.9     0.0     0.0 
1 1 1   26    0   56 o    646.7    4.2 4184.2319  54.9129  4184.2319  54.9129  4184.2319  54.9129      646.7      4.2      646.7        4.2     0.0     0.0 
1 1 1   26    0   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    0   58 o    258.9    6.3  672.3633  32.5646   672.3633  32.5646   672.3633  32.5646      258.9      6.3      258.9        6.3     0.0     0.0 
1 1 1   26    0   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    0   60 o    733.6    4.8 5385.2915  70.8759  5385.2915  70.8759  5385.2915  70.8759      733.6      4.8      733.6        4.8     0.0     0.0 
1 1 1   26    0   61 o     19.3   14.2  -64.4907  30.6490   -64.4907  30.6490   -64.4907  30.6490       19.3     14.2       19.3       14.2     0.0     0.0 
1 1 1   26    0   62 o     20.1   14.9 -104.0790  39.5883  -104.0790  39.5883  -104.0790  39.5883       20.1     14.9       20.1       14.9     0.0     0.0 
1 1 1   26    0   63 o    652.7    4.5 4264.0474  58.7440  4264.0474  58.7440  4264.0474  58.7440      652.7      4.5      652.7        4.5     0.0     0.0 
1 1 1   26    0   64 o    340.0    4.9 1157.6398  33.2031  1157.6398  33.2031  1157.6398  33.2031      340.0      4.9      340.0        4.9     0.0     0.0 
1 1 1   26    0   65 o    273.9    5.6  752.1785  30.6490   752.1785  30.6490   752.1785  30.6490      273.9      5.6      273.9        5.6     0.0     0.0 
1 1 1   26    0   66 o     15.8   11.8  -88.1160  28.0950   -88.1160  28.0950   -88.1160  28.0950       15.8     11.8       15.8       11.8     0.0     0.0 
1 1 1   26    0   67 o    112.6   14.0  133.4510  30.6490   133.4510  30.6490   133.4510  30.6490      112.6     14.0      112.6       14.0     0.0     0.0 
1 1 1   26    0   68 o    459.9    4.0 2116.6992  37.0343  2116.6992  37.0343  2116.6992  37.0343      459.9      4.0      459.9        4.0     0.0     0.0 
1 1 1   26    0   69 o    129.8   11.7  173.6779  30.0105   173.6779  30.0105   173.6779  30.0105      129.8     11.7      129.8       11.7     0.0     0.0 
1 1 1   26    0   70 o    297.4    5.5  886.9065  32.5646   886.9065  32.5646   886.9065  32.5646      297.4      5.5      297.4        5.5     0.0     0.0 
1 1 1   26    0   71 o     78.5   21.7   75.3456  29.3720    75.3456  29.3720    75.3456  29.3720       78.5     21.7       78.5       21.7     0.0     0.0 
1 1 1   26    0   72 o    197.5    7.6  393.3293  30.0105   393.3293  30.0105   393.3293  30.0105      197.5      7.6      197.5        7.6     0.0     0.0 
1 1 1   26    0   73 o     33.7   21.0    9.5778  28.0950     9.5778  28.0950     9.5778  28.0950       33.7     21.0       33.7       21.0     0.0     0.0 
1 1 1   26    0   74 o    226.4    6.6  515.9255  30.0105   515.9255  30.0105   515.9255  30.0105      226.4      6.6      226.4        6.6     0.0     0.0 
1 1 1   26    0   75 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    0   76 o    307.3    4.8  947.5660  29.3720   947.5660  29.3720   947.5660  29.3720      307.3      4.8      307.3        4.8     0.0     0.0 
1 1 1   26    1    0 o    488.7    3.1 2388.7095  30.6490  2388.7095  30.6490  2388.7095  30.6490      488.7      3.1      488.7        3.1     0.0     0.0 
1 1 1   26    1    1 o   1462.7    5.0    0.0000   0.0000          ?        ? 21397.4980 145.5829          ?        ?     1462.7        5.0       ?       ? 
1 1 1   26    1    2 o   1117.1    3.9    0.0000   0.0000          ?        ? 12479.2666  87.4775          ?        ?     1117.1        3.9       ?       ? 
1 1 1   26    1    3 f   1169.5    4.0    0.0000   0.0000          ?        ? 13677.1328  94.5012          ?        ?     1169.5        4.0       ?       ? 
1 1 1   26    1    4 o    802.5    2.9    0.0000   0.0000          ?        ?  6439.4907  47.2506          ?        ?      802.5        2.9       ?       ? 
1 1 1   26    1    5 o   1456.4    4.9    0.0000   0.0000          ?        ? 21213.6035 142.3903          ?        ?     1456.4        4.9       ?       ? 
1 1 1   26    1    6 o    421.8    2.0    0.0000   0.0000          ?        ?  1778.9213  17.2401          ?        ?      421.8        2.0       ?       ? 
1 1 1   26    1    7 o    627.7    2.5    0.0000   0.0000          ?        ?  3940.3169  31.9261          ?        ?      627.7        2.5       ?       ? 
1 1 1   26    1    8 o    482.4    2.2    0.0000   0.0000          ?        ?  2327.4114  21.0712          ?        ?      482.4        2.2       ?       ? 
1 1 1   26    1    9 o   2063.7    6.7    0.0000   0.0000          ?        ? 42594.5000 276.4799          ?        ?     2063.7        6.7       ?       ? 
1 1 1   26    1   10 o   1918.6    6.6    0.0000   0.0000          ?        ? 36815.2422 251.5775          ?        ?     1918.6        6.6       ?       ? 
1 1 1   26    1   11 o    419.8    2.2    0.0000   0.0000          ?        ?  1762.3197  18.5171          ?        ?      419.8        2.2       ?       ? 
1 1 1   26    1   12 o   1061.5    3.8    0.0000   0.0000          ?        ? 11268.6299  81.7308          ?        ?     1061.5        3.8       ?       ? 
1 1 1   26    1   13 o    387.3    2.1    0.0000   0.0000          ?        ?  1499.8872  15.9630          ?        ?      387.3        2.1       ?       ? 
1 1 1   26    1   14 o    130.3    4.2    0.0000   0.0000          ?        ?   169.8468  10.8549          ?        ?      130.3        4.2       ?       ? 
1 1 1   26    1   15 o   1024.0    3.6    0.0000   0.0000          ?        ? 10485.1631  74.0685          ?        ?     1024.0        3.6       ?       ? 
1 1 1   26    1   16 o   1657.8    5.6    0.0000   0.0000          ?        ? 27485.8027 185.1713          ?        ?     1657.8        5.6       ?       ? 
1 1 1   26    1   17 o    472.9    2.2    0.0000   0.0000          ?        ?  2236.7412  21.0712          ?        ?      472.9        2.2       ?       ? 
1 1 1   26    1   18 o   1551.4    5.3    0.0000   0.0000          ?        ? 24070.9883 164.1001          ?        ?     1551.4        5.3       ?       ? 
1 1 1   26    1   19 o    160.8    3.4    0.0000   0.0000          ?        ?   258.6013  10.8549          ?        ?      160.8        3.4       ?       ? 
1 1 1   26    1   20 o    320.1    2.1    0.0000   0.0000          ?        ?  1024.8273  13.4090          ?        ?      320.1        2.1       ?       ? 
1 1 1   26    1   21 o    674.3    2.7    0.0000   0.0000          ?        ?  4547.5513  36.3957          ?        ?      674.3        2.7       ?       ? 
1 1 1   26    1   22 o    481.6    2.3    0.0000   0.0000          ?        ?  2319.1106  21.7097          ?        ?      481.6        2.3       ?       ? 
1 1 1   26    1   23 o    894.5    3.3    0.0000   0.0000          ?        ?  8001.9526  58.7440          ?        ?      894.5        3.3       ?       ? 
1 1 1   26    1   24 o    568.6    2.4    0.0000   0.0000          ?        ?  3233.4734  27.4564          ?        ?      568.6        2.4       ?       ? 
1 1 1   26    1   25 o    351.7    2.2    0.0000   0.0000          ?        ?  1236.8164  15.3245          ?        ?      351.7        2.2       ?       ? 
1 1 1   26    1   26 o    876.2    3.2    0.0000   0.0000          ?        ?  7676.9458  56.1899          ?        ?      876.2        3.2       ?       ? 
1 1 1   26    1   27 o   1107.2    4.2    0.0000   0.0000          ?        ? 12258.9766  93.8627          ?        ?     1107.2        4.2       ?       ? 
1 1 1   26    1   28 o   1014.0    4.0    0.0000   0.0000          ?        ? 10283.3906  81.7308          ?        ?     1014.0        4.0       ?       ? 
1 1 1   26    1   29 o   1008.0    3.7    0.0000   0.0000          ?        ? 10162.0713  75.3456          ?        ?     1008.0        3.7       ?       ? 
1 1 1   26    1   30 o    451.1    2.6    0.0000   0.0000          ?        ?  2034.9685  23.6253          ?        ?      451.1        2.6       ?       ? 
1 1 1   26    1   31 f    210.3    3.8    0.0000   0.0000          ?        ?   442.4955  15.9630          ?        ?      210.3        3.8       ?       ? 
1 1 1   26    1   32 o    823.0    3.4    0.0000   0.0000          ?        ?  6774.0762  55.5514          ?        ?      823.0        3.4       ?       ? 
1 1 1   26    1   33 o    258.4    3.5    0.0000   0.0000          ?        ?   667.8936  17.8786          ?        ?      258.4        3.5       ?       ? 
1 1 1   26    1   34 o    848.6    3.5    0.0000   0.0000          ?        ?  7201.2471  59.3825          ?        ?      848.6        3.5       ?       ? 
1 1 1   26    1   35 o    658.3    2.7    0.0000   0.0000          ?        ?  4333.6465  35.7572          ?        ?      658.3        2.7       ?       ? 
1 1 1   26    1   36 o   1050.5    3.8    0.0000   0.0000          ?        ? 11036.2080  79.8152          ?        ?     1050.5        3.8       ?       ? 
1 1 1   26    1   37 o    115.2    8.0    0.0000   0.0000          ?        ?   132.8125  18.5171          ?        ?      115.2        8.0       ?       ? 
1 1 1   26    1   38 o   1268.6    4.3    0.0000   0.0000          ?        ? 16097.1299 109.8257          ?        ?     1268.6        4.3       ?       ? 
1 1 1   26    1   39 o    614.7    2.6    0.0000   0.0000          ?        ?  3779.4097  32.5646          ?        ?      614.7        2.6       ?       ? 
1 1 1   26    1   40 o    507.9    3.0    0.0000   0.0000          ?        ?  2579.6274  30.0105          ?        ?      507.9        3.0       ?       ? 
1 1 1   26    1   41 o   1320.2    4.6    0.0000   0.0000          ?        ? 17432.9180 120.6806          ?        ?     1320.2        4.6       ?       ? 
1 1 1   26    1   42 o    437.6    2.8    0.0000   0.0000          ?        ?  1915.5648  24.2638          ?        ?      437.6        2.8       ?       ? 
1 1 1   26    1   43 o    353.7    2.9    0.0000   0.0000          ?        ?  1250.8638  20.4327          ?        ?      353.7        2.9       ?       ? 
1 1 1   26    1   44 o    408.1    2.7    0.0000   0.0000          ?        ?  1665.2643  21.7097          ?        ?      408.1        2.7       ?       ? 
1 1 1   26    1   45 o    417.4    2.7    0.0000   0.0000          ?        ?  1742.5255  22.3483          ?        ?      417.4        2.7       ?       ? 
1 1 1   26    1   46 o    408.8    2.7    0.0000   0.0000          ?        ?  1671.6495  22.3483          ?        ?      408.8        2.7       ?       ? 
1 1 1   26    1   47 o    131.7    7.0    0.0000   0.0000          ?        ?   173.6779  18.5171          ?        ?      131.7        7.0       ?       ? 
1 1 1   26    1   48 o    661.3    2.9    0.0000   0.0000          ?        ?  4374.5117  38.3113          ?        ?      661.3        2.9       ?       ? 
1 1 1   26    1   49 o    121.9    7.1    0.0000   0.0000          ?        ?   148.7755  17.2401          ?        ?      121.9        7.1       ?       ? 
1 1 1   26    1   50 o    393.8    2.8    0.0000   0.0000          ?        ?  1550.9690  22.3483          ?        ?      393.8        2.8       ?       ? 
1 1 1   26    1   51 o    152.4    6.1    0.0000   0.0000          ?        ?   232.4219  18.5171          ?        ?      152.4        6.1       ?       ? 
1 1 1   26    1   52 o    367.4    3.0    0.0000   0.0000          ?        ?  1350.4733  22.3483          ?        ?      367.4        3.0       ?       ? 
1 1 1   26    1   53 o    501.4    2.7    0.0000   0.0000          ?        ?  2514.4980  26.8179          ?        ?      501.4        2.7       ?       ? 
1 1 1   26    1   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    1   55 o    475.9    2.8    0.0000   0.0000          ?        ?  2265.4746  26.8179          ?        ?      475.9        2.8       ?       ? 
1 1 1   26    1   56 o    360.4    3.0    0.0000   0.0000          ?        ?  1299.3915  21.7097          ?        ?      360.4        3.0       ?       ? 
1 1 1   26    1   57 o    380.6    2.9    0.0000   0.0000          ?        ?  1448.8055  21.7097          ?        ?      380.6        2.9       ?       ? 
1 1 1   26    1   58 o    188.3    4.9    0.0000   0.0000          ?        ?   355.0180  18.5171          ?        ?      188.3        4.9       ?       ? 
1 1 1   26    1   59 o     97.9   10.1    0.0000   0.0000          ?        ?    96.4168  19.7942          ?        ?       97.9       10.1       ?       ? 
1 1 1   26    1   60 f    154.8    6.4    0.0000   0.0000          ?        ?   240.0841  19.7942          ?        ?      154.8        6.4       ?       ? 
1 1 1   26    1   61 o     37.7   16.0    0.0000   0.0000          ?        ?     0.6385  21.0712          ?        ?       37.7       16.0       ?       ? 
1 1 1   26    1   62 o     66.0   16.1    0.0000   0.0000          ?        ?    45.9736  21.0712          ?        ?       66.0       16.1       ?       ? 
1 1 1   26    1   63 o    263.5    4.2    0.0000   0.0000          ?        ?   695.3500  22.3483          ?        ?      263.5        4.2       ?       ? 
1 1 1   26    1   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    1   65 o     90.0   11.4    0.0000   0.0000          ?        ?    81.7308  20.4327          ?        ?       90.0       11.4       ?       ? 
1 1 1   26    1   66 o    264.0    4.1    0.0000   0.0000          ?        ?   697.9042  21.7097          ?        ?      264.0        4.1       ?       ? 
1 1 1   26    1   67 o    283.5    3.9    0.0000   0.0000          ?        ?   804.5372  22.3483          ?        ?      283.5        3.9       ?       ? 
1 1 1   26    1   68 o    196.3    5.5    0.0000   0.0000          ?        ?   386.3056  21.7097          ?        ?      196.3        5.5       ?       ? 
1 1 1   26    1   69 o    258.7    4.2    0.0000   0.0000          ?        ?   670.4477  21.7097          ?        ?      258.7        4.2       ?       ? 
1 1 1   26    1   70 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    1   71 o     33.4   15.0    0.0000   0.0000          ?        ?    -9.5778  21.0712          ?        ?       33.4       15.0       ?       ? 
1 1 1   26    1   72 o     21.0   10.6    0.0000   0.0000          ?        ?   -58.7440  19.7942          ?        ?       21.0       10.6       ?       ? 
1 1 1   26    1   73 o    179.8    5.9    0.0000   0.0000          ?        ?   325.0075  21.0712          ?        ?      179.8        5.9       ?       ? 
1 1 1   26    1   74 o    101.8    9.7    0.0000   0.0000          ?        ?   105.3561  19.7942          ?        ?      101.8        9.7       ?       ? 
1 1 1   26    1   75 o     80.6   12.7    0.0000   0.0000          ?        ?    67.0448  20.4327          ?        ?       80.6       12.7       ?       ? 
1 1 1   26    2    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    2    1 o   1078.6    4.0    0.0000   0.0000          ?        ? 11634.5020  86.2004          ?        ?     1078.6        4.0       ?       ? 
1 1 1   26    2    2 o   1291.2    4.6    0.0000   0.0000          ?        ? 16671.7988 119.4035          ?        ?     1291.2        4.6       ?       ? 
1 1 1   26    2    3 o    701.7    2.8    0.0000   0.0000          ?        ?  4924.2788  39.5883          ?        ?      701.7        2.8       ?       ? 
1 1 1   26    2    4 o   1207.9    4.3    0.0000   0.0000          ?        ? 14592.1348 102.8020          ?        ?     1207.9        4.3       ?       ? 
1 1 1   26    2    5 o   1072.3    3.8    0.0000   0.0000          ?        ? 11499.1357  82.3693          ?        ?     1072.3        3.8       ?       ? 
1 1 1   26    2    6 o   1589.7    5.5    0.0000   0.0000          ?        ? 25275.2402 175.5934          ?        ?     1589.7        5.5       ?       ? 
1 1 1   26    2    7 o   1389.7    5.0    0.0000   0.0000          ?        ? 19314.6406 139.1977          ?        ?     1389.7        5.0       ?       ? 
1 1 1   26    2    8 o   1601.0    5.7    0.0000   0.0000          ?        ? 25635.3672 183.8942          ?        ?     1601.0        5.7       ?       ? 
1 1 1   26    2    9 o    877.3    3.6    0.0000   0.0000          ?        ?  7696.7397  62.5751          ?        ?      877.3        3.6       ?       ? 
1 1 1   26    2   10 o    518.3    2.3    0.0000   0.0000          ?        ?  2686.8989  24.2638          ?        ?      518.3        2.3       ?       ? 
1 1 1   26    2   11 o   1527.0    5.1    0.0000   0.0000          ?        ? 23318.8105 156.4378          ?        ?     1527.0        5.1       ?       ? 
1 1 1   26    2   12 o    527.7    2.5    0.0000   0.0000          ?        ?  2784.5928  26.1794          ?        ?      527.7        2.5       ?       ? 
1 1 1   26    2   13 o   2780.5    9.1    0.0000   0.0000          ?        ? 77331.3516 506.9862          ?        ?     2780.5        9.1       ?       ? 
1 1 1   26    2   14 o   1837.6    6.0    0.0000   0.0000          ?        ? 33770.7695 220.9285          ?        ?     1837.6        6.0       ?       ? 
1 1 1   26    2   15 o    772.2    2.9    0.0000   0.0000          ?        ?  5962.5146  44.0580          ?        ?      772.2        2.9       ?       ? 
1 1 1   26    2   16 o   1406.6    4.7    0.0000   0.0000          ?        ? 19785.2324 133.4510          ?        ?     1406.6        4.7       ?       ? 
1 1 1   26    2   17 o    701.2    2.7    0.0000   0.0000          ?        ?  4917.2549  37.6728          ?        ?      701.2        2.7       ?       ? 
1 1 1   26    2   18 o    830.5    3.1    0.0000   0.0000          ?        ?  6897.3101  51.0817          ?        ?      830.5        3.1       ?       ? 
1 1 1   26    2   19 o     62.7   13.1    0.0000   0.0000          ?        ?    40.8654  15.9630          ?        ?       62.7       13.1       ?       ? 
1 1 1   26    2   20 o    612.6    2.5    0.0000   0.0000          ?        ?  3753.2300  30.6490          ?        ?      612.6        2.5       ?       ? 
1 1 1   26    2   21 o   1353.2    4.6    0.0000   0.0000          ?        ? 18313.4395 124.5117          ?        ?     1353.2        4.6       ?       ? 
1 1 1   26    2   22 f    118.5    4.6    0.0000   0.0000          ?        ?   140.4748  10.8549          ?        ?      118.5        4.6       ?       ? 
1 1 1   26    2   23 o    695.9    2.8    0.0000   0.0000          ?        ?  4843.1865  38.9498          ?        ?      695.9        2.8       ?       ? 
1 1 1   26    2   24 o    297.4    2.5    0.0000   0.0000          ?        ?   884.3525  14.6860          ?        ?      297.4        2.5       ?       ? 
1 1 1   26    2   25 o    711.9    2.9    0.0000   0.0000          ?        ?  5067.9463  40.8654          ?        ?      711.9        2.9       ?       ? 
1 1 1   26    2   26 o   1323.0    4.6    0.0000   0.0000          ?        ? 17503.7930 120.6806          ?        ?     1323.0        4.6       ?       ? 
1 1 1   26    2   27 f    863.8    3.4    0.0000   0.0000          ?        ?  7461.1250  58.7440          ?        ?      863.8        3.4       ?       ? 
1 1 1   26    2   28 o    827.4    3.4    0.0000   0.0000          ?        ?  6845.5903  56.1899          ?        ?      827.4        3.4       ?       ? 
1 1 1   26    2   29 o   1063.2    4.1    0.0000   0.0000          ?        ? 11304.3867  88.1160          ?        ?     1063.2        4.1       ?       ? 
1 1 1   26    2   30 o    163.2    4.5    0.0000   0.0000          ?        ?   266.2635  14.6860          ?        ?      163.2        4.5       ?       ? 
1 1 1   26    2   31 o    405.7    2.6    0.0000   0.0000          ?        ?  1646.1086  21.0712          ?        ?      405.7        2.6       ?       ? 
1 1 1   26    2   32 f    475.8    2.5    0.0000   0.0000          ?        ?  2264.1978  24.2638          ?        ?      475.8        2.5       ?       ? 
1 1 1   26    2   33 f    471.4    2.6    0.0000   0.0000          ?        ?  2222.6938  24.9023          ?        ?      471.4        2.6       ?       ? 
1 1 1   26    2   34 o    332.4    2.9    0.0000   0.0000          ?        ?  1105.2810  19.1556          ?        ?      332.4        2.9       ?       ? 
1 1 1   26    2   35 o    128.8    6.4    0.0000   0.0000          ?        ?   166.0156  16.6016          ?        ?      128.8        6.4       ?       ? 
1 1 1   26    2   36 o    256.2    3.7    0.0000   0.0000          ?        ?   656.4003  19.1556          ?        ?      256.2        3.7       ?       ? 
1 1 1   26    2   37 o   1124.4    4.2    0.0000   0.0000          ?        ? 12644.6445  94.5012          ?        ?     1124.4        4.2       ?       ? 
1 1 1   26    2   38 f    675.8    3.2    0.0000   0.0000          ?        ?  4567.3452  42.7809          ?        ?      675.8        3.2       ?       ? 
1 1 1   26    2   39 o    825.1    3.4    0.0000   0.0000          ?        ?  6808.5566  56.8284          ?        ?      825.1        3.4       ?       ? 
1 1 1   26    2   40 o    155.7    5.7    0.0000   0.0000          ?        ?   242.6382  17.8786          ?        ?      155.7        5.7       ?       ? 
1 1 1   26    2   41 o    131.7    6.8    0.0000   0.0000          ?        ?   173.6779  17.8786          ?        ?      131.7        6.8       ?       ? 
1 1 1   26    2   42 o    851.3    3.4    0.0000   0.0000          ?        ?  7247.8589  57.4669          ?        ?      851.3        3.4       ?       ? 
1 1 1   26    2   43 o    955.0    3.7    0.0000   0.0000          ?        ?  9122.5586  70.8759          ?        ?      955.0        3.7       ?       ? 
1 1 1   26    2   44 o    446.8    2.7    0.0000   0.0000          ?        ?  1996.6572  24.2638          ?        ?      446.8        2.7       ?       ? 
1 1 1   26    2   45 o    915.7    3.5    0.0000   0.0000          ?        ?  8387.6201  63.8522          ?        ?      915.7        3.5       ?       ? 
1 1 1   26    2   46 o    243.0    3.8    0.0000   0.0000          ?        ?   590.6325  18.5171          ?        ?      243.0        3.8       ?       ? 
1 1 1   26    2   47 o    180.0    5.0    0.0000   0.0000          ?        ?   324.3690  17.8786          ?        ?      180.0        5.0       ?       ? 
1 1 1   26    2   48 o    564.0    2.8    0.0000   0.0000          ?        ?  3181.7532  31.2876          ?        ?      564.0        2.8       ?       ? 
1 1 1   26    2   49 o    276.3    3.4    0.0000   0.0000          ?        ?   763.6719  18.5171          ?        ?      276.3        3.4       ?       ? 
1 1 1   26    2   50 o    587.0    2.7    0.0000   0.0000          ?        ?  3446.7397  31.9261          ?        ?      587.0        2.7       ?       ? 
1 1 1   26    2   51 o    413.3    2.7    0.0000   0.0000          ?        ?  1708.6840  22.3483          ?        ?      413.3        2.7       ?       ? 
1 1 1   26    2   52 o     20.5   10.3    0.0000   0.0000          ?        ?   -50.4432  17.8786          ?        ?       20.5       10.3       ?       ? 
1 1 1   26    2   53 o    174.4    4.9    0.0000   0.0000          ?        ?   304.5748  17.2401          ?        ?      174.4        4.9       ?       ? 
1 1 1   26    2   54 o     80.5   11.5    0.0000   0.0000          ?        ?    65.1292  18.5171          ?        ?       80.5       11.5       ?       ? 
1 1 1   26    2   55 o    734.3    3.0    0.0000   0.0000          ?        ?  5394.2305  43.4195          ?        ?      734.3        3.0       ?       ? 
1 1 1   26    2   56 o    213.7    4.3    0.0000   0.0000          ?        ?   457.1815  18.5171          ?        ?      213.7        4.3       ?       ? 
1 1 1   26    2   57 o     27.0   12.8    0.0000   0.0000          ?        ?   -22.3483  18.5171          ?        ?       27.0       12.8       ?       ? 
1 1 1   26    2   58 o    356.8    3.2    0.0000   0.0000          ?        ?  1273.8506  22.9868          ?        ?      356.8        3.2       ?       ? 
1 1 1   26    2   59 o    288.2    3.7    0.0000   0.0000          ?        ?   831.3552  21.0712          ?        ?      288.2        3.7       ?       ? 
1 1 1   26    2   60 o    463.0    3.0    0.0000   0.0000          ?        ?  2144.7942  27.4564          ?        ?      463.0        3.0       ?       ? 
1 1 1   26    2   61 o    485.3    3.0    0.0000   0.0000          ?        ?  2356.7834  28.7335          ?        ?      485.3        3.0       ?       ? 
1 1 1   26    2   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    2   63 o    125.5    8.4    0.0000   0.0000          ?        ?   158.3534  21.0712          ?        ?      125.5        8.4       ?       ? 
1 1 1   26    2   64 o    173.8    5.9    0.0000   0.0000          ?        ?   302.6593  20.4327          ?        ?      173.8        5.9       ?       ? 
1 1 1   26    2   65 o    364.1    3.2    0.0000   0.0000          ?        ?  1326.8479  23.6253          ?        ?      364.1        3.2       ?       ? 
1 1 1   26    2   66 o     22.0   11.0    0.0000   0.0000          ?        ?   -56.8284  20.4327          ?        ?       22.0       11.0       ?       ? 
1 1 1   26    2   67 o     22.6   11.3    0.0000   0.0000          ?        ?   -56.8284  21.0712          ?        ?       22.6       11.3       ?       ? 
1 1 1   26    2   68 o    283.7    3.8    0.0000   0.0000          ?        ?   805.8143  21.7097          ?        ?      283.7        3.8       ?       ? 
1 1 1   26    2   69 o     60.6   16.8    0.0000   0.0000          ?        ?    38.9498  21.0712          ?        ?       60.6       16.8       ?       ? 
1 1 1   26    2   70 o     53.4   16.7    0.0000   0.0000          ?        ?    29.3720  19.7942          ?        ?       53.4       16.7       ?       ? 
1 1 1   26    2   71 o     88.2   11.6    0.0000   0.0000          ?        ?    79.1767  20.4327          ?        ?       88.2       11.6       ?       ? 
1 1 1   26    2   72 o    108.9    9.4    0.0000   0.0000          ?        ?   120.0421  20.4327          ?        ?      108.9        9.4       ?       ? 
1 1 1   26    2   73 o     94.6   11.1    0.0000   0.0000          ?        ?    91.3086  21.0712          ?        ?       94.6       11.1       ?       ? 
1 1 1   26    2   74 o     71.7   14.3    0.0000   0.0000          ?        ?    54.9129  19.7942          ?        ?       71.7       14.3       ?       ? 
1 1 1   26    2   75 o     35.7   15.5    0.0000   0.0000          ?        ?    -1.2770  20.4327          ?        ?       35.7       15.5       ?       ? 
1 1 1   26    3    0 o    661.2    3.6 4372.5962  47.8891  4372.5962  47.8891  4372.5962  47.8891      661.2      3.6      661.2        3.6     0.0     0.0 
1 1 1   26    3    1 o    428.2    2.1    0.0000   0.0000          ?        ?  1833.8342  17.8786          ?        ?      428.2        2.1       ?       ? 
1 1 1   26    3    2 o    700.4    2.8    0.0000   0.0000          ?        ?  4905.1230  39.5883          ?        ?      700.4        2.8       ?       ? 
1 1 1   26    3    3 o    882.0    3.4    0.0000   0.0000          ?        ?  7780.3862  60.0210          ?        ?      882.0        3.4       ?       ? 
1 1 1   26    3    4 o    681.4    2.8    0.0000   0.0000          ?        ?  4643.3291  37.6728          ?        ?      681.4        2.8       ?       ? 
1 1 1   26    3    5 o    629.1    2.6    0.0000   0.0000          ?        ?  3958.1958  33.2031          ?        ?      629.1        2.6       ?       ? 
1 1 1   26    3    6 o    205.6    2.3    0.0000   0.0000          ?        ?   422.7013   9.5778          ?        ?      205.6        2.3       ?       ? 
1 1 1   26    3    7 f    463.9    2.1    0.0000   0.0000          ?        ?  2151.8179  19.7942          ?        ?      463.9        2.1       ?       ? 
1 1 1   26    3    8 o    800.0    3.0    0.0000   0.0000          ?        ?  6399.9023  48.5276          ?        ?      800.0        3.0       ?       ? 
1 1 1   26    3    9 o    239.2    2.3    0.0000   0.0000          ?        ?   572.1154  10.8549          ?        ?      239.2        2.3       ?       ? 
1 1 1   26    3   10 o    378.6    2.0    0.0000   0.0000          ?        ?  1433.4811  15.3245          ?        ?      378.6        2.0       ?       ? 
1 1 1   26    3   11 o    154.9    4.9    0.0000   0.0000          ?        ?   240.0841  15.3245          ?        ?      154.9        4.9       ?       ? 
1 1 1   26    3   12 o   1179.4    4.1    0.0000   0.0000          ?        ? 13910.8330  95.7782          ?        ?     1179.4        4.1       ?       ? 
1 1 1   26    3   13 o   1088.5    3.8    0.0000   0.0000          ?        ? 11849.0459  82.3693          ?        ?     1088.5        3.8       ?       ? 
1 1 1   26    3   14 o   1028.2    3.6    0.0000   0.0000          ?        ? 10571.3643  74.7070          ?        ?     1028.2        3.6       ?       ? 
1 1 1   26    3   15 o    990.2    3.5    0.0000   0.0000          ?        ?  9805.7764  70.2374          ?        ?      990.2        3.5       ?       ? 
1 1 1   26    3   16 o    935.0    3.3    0.0000   0.0000          ?        ?  8743.2773  62.5751          ?        ?      935.0        3.3       ?       ? 
1 1 1   26    3   17 o    956.9    3.4    0.0000   0.0000          ?        ?  9157.0381  65.1292          ?        ?      956.9        3.4       ?       ? 
1 1 1   26    3   18 o   1163.4    4.0    0.0000   0.0000          ?        ? 13536.6582  93.2242          ?        ?     1163.4        4.0       ?       ? 
1 1 1   26    3   19 o   1198.7    4.1    0.0000   0.0000          ?        ? 14369.9297  98.9709          ?        ?     1198.7        4.1       ?       ? 
1 1 1   26    3   20 o   1782.7    5.9    0.0000   0.0000          ?        ? 31785.6074 209.4351          ?        ?     1782.7        5.9       ?       ? 
1 1 1   26    3   21 o    385.2    2.2    0.0000   0.0000          ?        ?  1483.9242  16.6016          ?        ?      385.2        2.2       ?       ? 
1 1 1   26    3   22 o    470.8    2.4    0.0000   0.0000          ?        ?  2216.3086  22.3483          ?        ?      470.8        2.4       ?       ? 
1 1 1   26    3   23 f    182.2    3.3    0.0000   0.0000          ?        ?   332.0312  12.1319          ?        ?      182.2        3.3       ?       ? 
1 1 1   26    3   24 o   2440.8    8.4    0.0000   0.0000          ?        ? 59591.9453 409.9309          ?        ?     2440.8        8.4       ?       ? 
1 1 1   26    3   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    3   26 o     76.2   10.9    0.0000   0.0000          ?        ?    58.1055  16.6016          ?        ?       76.2       10.9       ?       ? 
1 1 1   26    3   27 o    682.5    3.0    0.0000   0.0000          ?        ?  4658.0151  41.5039          ?        ?      682.5        3.0       ?       ? 
1 1 1   26    3   28 o    877.9    3.9    0.0000   0.0000          ?        ?  7706.9561  67.6833          ?        ?      877.9        3.9       ?       ? 
1 1 1   26    3   29 o    199.3    5.0    0.0000   0.0000          ?        ?   397.1605  19.7942          ?        ?      199.3        5.0       ?       ? 
1 1 1   26    3   30 o   1318.4    5.3    0.0000   0.0000          ?        ? 17383.1113 138.5592          ?        ?     1318.4        5.3       ?       ? 
1 1 1   26    3   31 o   1147.7    4.7    0.0000   0.0000          ?        ? 13173.3398 107.9102          ?        ?     1147.7        4.7       ?       ? 
1 1 1   26    3   32 o    893.5    3.5    0.0000   0.0000          ?        ?  7983.4360  62.5751          ?        ?      893.5        3.5       ?       ? 
1 1 1   26    3   33 o    672.8    3.0    0.0000   0.0000          ?        ?  4526.4800  40.2269          ?        ?      672.8        3.0       ?       ? 
1 1 1   26    3   34 o    841.6    3.5    0.0000   0.0000          ?        ?  7083.7593  59.3825          ?        ?      841.6        3.5       ?       ? 
1 1 1   26    3   35 o    762.2    3.1    0.0000   0.0000          ?        ?  5809.2695  46.6121          ?        ?      762.2        3.1       ?       ? 
1 1 1   26    3   36 o    784.6    3.1    0.0000   0.0000          ?        ?  6157.2642  48.5276          ?        ?      784.6        3.1       ?       ? 
1 1 1   26    3   37 o    244.7    3.5    0.0000   0.0000          ?        ?   598.9333  17.2401          ?        ?      244.7        3.5       ?       ? 
1 1 1   26    3   38 o    194.1    4.1    0.0000   0.0000          ?        ?   376.7278  15.9630          ?        ?      194.1        4.1       ?       ? 
1 1 1   26    3   39 o    731.9    3.0    0.0000   0.0000          ?        ?  5357.8350  44.0580          ?        ?      731.9        3.0       ?       ? 
1 1 1   26    3   40 o    629.1    2.9    0.0000   0.0000          ?        ?  3957.5569  36.3957          ?        ?      629.1        2.9       ?       ? 
1 1 1   26    3   41 f    330.3    2.9    0.0000   0.0000          ?        ?  1091.2334  19.1556          ?        ?      330.3        2.9       ?       ? 
1 1 1   26    3   42 o    415.9    2.6    0.0000   0.0000          ?        ?  1729.7550  21.7097          ?        ?      415.9        2.6       ?       ? 
1 1 1   26    3   43 o    627.4    2.7    0.0000   0.0000          ?        ?  3937.1243  33.8416          ?        ?      627.4        2.7       ?       ? 
1 1 1   26    3   44 o    217.8    3.8    0.0000   0.0000          ?        ?   474.4216  16.6016          ?        ?      217.8        3.8       ?       ? 
1 1 1   26    3   45 o    456.6    2.7    0.0000   0.0000          ?        ?  2085.4116  24.2638          ?        ?      456.6        2.7       ?       ? 
1 1 1   26    3   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    3   47 f    255.2    3.8    0.0000   0.0000          ?        ?   651.2921  19.1556          ?        ?      255.2        3.8       ?       ? 
1 1 1   26    3   48 o    142.6    6.3    0.0000   0.0000          ?        ?   203.6884  17.8786          ?        ?      142.6        6.3       ?       ? 
1 1 1   26    3   49 o    330.1    3.1    0.0000   0.0000          ?        ?  1089.9564  20.4327          ?        ?      330.1        3.1       ?       ? 
1 1 1   26    3   50 o    449.7    2.6    0.0000   0.0000          ?        ?  2022.8364  23.6253          ?        ?      449.7        2.6       ?       ? 
1 1 1   26    3   51 o    337.8    2.9    0.0000   0.0000          ?        ?  1141.6766  19.7942          ?        ?      337.8        2.9       ?       ? 
1 1 1   26    3   52 o    177.2    5.0    0.0000   0.0000          ?        ?   314.1526  17.8786          ?        ?      177.2        5.0       ?       ? 
1 1 1   26    3   53 o    344.8    3.0    0.0000   0.0000          ?        ?  1188.9272  20.4327          ?        ?      344.8        3.0       ?       ? 
1 1 1   26    3   54 o     45.6   15.7    0.0000   0.0000          ?        ?    19.1556  17.2401          ?        ?       45.6       15.7       ?       ? 
1 1 1   26    3   55 o    139.0    6.4    0.0000   0.0000          ?        ?   193.4720  17.8786          ?        ?      139.0        6.4       ?       ? 
1 1 1   26    3   56 o    162.5    5.9    0.0000   0.0000          ?        ?   264.3480  19.1556          ?        ?      162.5        5.9       ?       ? 
1 1 1   26    3   57 f     24.6   11.9    0.0000   0.0000          ?        ?   -31.9261  18.5171          ?        ?       24.6       11.9       ?       ? 
1 1 1   26    3   58 o     31.1   14.1    0.0000   0.0000          ?        ?   -11.4934  19.1556          ?        ?       31.1       14.1       ?       ? 
1 1 1   26    3   59 o    600.8    2.9    0.0000   0.0000          ?        ?  3611.4783  34.4802          ?        ?      600.8        2.9       ?       ? 
1 1 1   26    3   60 o    196.1    5.0    0.0000   0.0000          ?        ?   385.0285  19.7942          ?        ?      196.1        5.0       ?       ? 
1 1 1   26    3   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    3   62 o    686.9    3.3    0.0000   0.0000          ?        ?  4721.2290  44.6965          ?        ?      686.9        3.3       ?       ? 
1 1 1   26    3   63 o    114.6    9.8    0.0000   0.0000          ?        ?   132.1740  22.3483          ?        ?      114.6        9.8       ?       ? 
1 1 1   26    3   64 f    217.2    5.1    0.0000   0.0000          ?        ?   472.5060  22.3483          ?        ?      217.2        5.1       ?       ? 
1 1 1   26    3   65 o     78.6   13.0    0.0000   0.0000          ?        ?    62.5751  20.4327          ?        ?       78.6       13.0       ?       ? 
1 1 1   26    3   66 f    110.8    9.8    0.0000   0.0000          ?        ?   123.8732  21.7097          ?        ?      110.8        9.8       ?       ? 
1 1 1   26    3   67 o    235.4    4.7    0.0000   0.0000          ?        ?   555.5138  22.3483          ?        ?      235.4        4.7       ?       ? 
1 1 1   26    3   68 o    211.9    5.0    0.0000   0.0000          ?        ?   450.1577  21.0712          ?        ?      211.9        5.0       ?       ? 
1 1 1   26    3   69 o     37.5   16.0    0.0000   0.0000          ?        ?     0.6385  21.0712          ?        ?       37.5       16.0       ?       ? 
1 1 1   26    3   70 o    202.8    5.2    0.0000   0.0000          ?        ?   412.4850  21.0712          ?        ?      202.8        5.2       ?       ? 
1 1 1   26    3   71 o    190.6    5.5    0.0000   0.0000          ?        ?   364.5958  21.0712          ?        ?      190.6        5.5       ?       ? 
1 1 1   26    3   72 o    188.2    6.1    0.0000   0.0000          ?        ?   356.2951  22.9868          ?        ?      188.2        6.1       ?       ? 
1 1 1   26    3   73 o     25.4   12.4    0.0000   0.0000          ?        ?   -38.9498  21.0712          ?        ?       25.4       12.4       ?       ? 
1 1 1   26    3   74 o    255.8    4.2    0.0000   0.0000          ?        ?   656.4003  21.7097          ?        ?      255.8        4.2       ?       ? 
1 1 1   26    3   75 o    207.8    5.1    0.0000   0.0000          ?        ?   434.1947  21.0712          ?        ?      207.8        5.1       ?       ? 
1 1 1   26    4    0 o   1281.0    6.2 16411.2832 159.6304 16411.2832 159.6304 16411.2832 159.6304     1281.0      6.2     1281.0        6.2     0.0     0.0 
1 1 1   26    4    1 o    694.1    2.8    0.0000   0.0000          ?        ?  4817.6455  38.3113          ?        ?      694.1        2.8       ?       ? 
1 1 1   26    4    2 o    762.6    3.0    0.0000   0.0000          ?        ?  5815.0166  45.3350          ?        ?      762.6        3.0       ?       ? 
1 1 1   26    4    3 o   1851.2    6.5    0.0000   0.0000          ?        ? 34274.5625 241.9997          ?        ?     1851.2        6.5       ?       ? 
1 1 1   26    4    4 o   1264.5    4.5    0.0000   0.0000          ?        ? 15991.1348 114.2954          ?        ?     1264.5        4.5       ?       ? 
1 1 1   26    4    5 o    639.6    2.6    0.0000   0.0000          ?        ?  4091.0081  33.8416          ?        ?      639.6        2.6       ?       ? 
1 1 1   26    4    6 o    429.0    2.2    0.0000   0.0000          ?        ?  1840.8578  19.1556          ?        ?      429.0        2.2       ?       ? 
1 1 1   26    4    7 o   2134.6    7.3    0.0000   0.0000          ?        ? 45571.9258 310.3215          ?        ?     2134.6        7.3       ?       ? 
1 1 1   26    4    8 o    277.4    2.1    0.0000   0.0000          ?        ?   769.4186  11.4934          ?        ?      277.4        2.1       ?       ? 
1 1 1   26    4    9 f   1337.0    4.6    0.0000   0.0000          ?        ? 17877.3281 123.8732          ?        ?     1337.0        4.6       ?       ? 
1 1 1   26    4   10 o    321.4    2.1    0.0000   0.0000          ?        ?  1033.1281  13.4090          ?        ?      321.4        2.1       ?       ? 
1 1 1   26    4   11 o   1482.8    5.1    0.0000   0.0000          ?        ? 21988.1309 150.6911          ?        ?     1482.8        5.1       ?       ? 
1 1 1   26    4   12 o   1670.9    5.5    0.0000   0.0000          ?        ? 27919.9980 184.5327          ?        ?     1670.9        5.5       ?       ? 
1 1 1   26    4   13 o   1285.2    4.5    0.0000   0.0000          ?        ? 16518.5547 114.9339          ?        ?     1285.2        4.5       ?       ? 
1 1 1   26    4   14 o   1103.0    4.0    0.0000   0.0000          ?        ? 12166.3916  87.4775          ?        ?     1103.0        4.0       ?       ? 
1 1 1   26    4   15 o    110.1    5.8    0.0000   0.0000          ?        ?   121.3191  12.7704          ?        ?      110.1        5.8       ?       ? 
1 1 1   26    4   16 o   1084.9    3.8    0.0000   0.0000          ?        ? 11771.1465  81.7308          ?        ?     1084.9        3.8       ?       ? 
1 1 1   26    4   17 o    904.6    3.2    0.0000   0.0000          ?        ?  8182.6548  58.7440          ?        ?      904.6        3.2       ?       ? 
1 1 1   26    4   18 o   1069.0    3.7    0.0000   0.0000          ?        ? 11428.2607  79.8152          ?        ?     1069.0        3.7       ?       ? 
1 1 1   26    4   19 o   1685.9    5.6    0.0000   0.0000          ?        ? 28424.4297 188.3639          ?        ?     1685.9        5.6       ?       ? 
1 1 1   26    4   20 o    556.0    2.5    0.0000   0.0000          ?        ?  3091.7217  28.0950          ?        ?      556.0        2.5       ?       ? 
1 1 1   26    4   21 o    783.9    3.1    0.0000   0.0000          ?        ?  6145.7705  47.8891          ?        ?      783.9        3.1       ?       ? 
1 1 1   26    4   22 o    442.7    2.4    0.0000   0.0000          ?        ?  1959.6228  21.0712          ?        ?      442.7        2.4       ?       ? 
1 1 1   26    4   23 o   1321.1    4.8    0.0000   0.0000          ?        ? 17455.2656 127.7043          ?        ?     1321.1        4.8       ?       ? 
1 1 1   26    4   24 o    700.9    3.1    0.0000   0.0000          ?        ?  4912.7856  43.4195          ?        ?      700.9        3.1       ?       ? 
1 1 1   26    4   25 o   1509.3    5.8    0.0000   0.0000          ?        ? 22783.7285 175.5934          ?        ?     1509.3        5.8       ?       ? 
1 1 1   26    4   26 o    258.1    3.1    0.0000   0.0000          ?        ?   665.9781  15.9630          ?        ?      258.1        3.1       ?       ? 
1 1 1   26    4   27 o    692.7    2.9    0.0000   0.0000          ?        ?  4798.4902  40.2269          ?        ?      692.7        2.9       ?       ? 
1 1 1   26    4   28 o   1522.5    5.6    0.0000   0.0000          ?        ? 23184.0820 170.4853          ?        ?     1522.5        5.6       ?       ? 
1 1 1   26    4   29 o   1074.9    4.2    0.0000   0.0000          ?        ? 11554.6875  90.6701          ?        ?     1074.9        4.2       ?       ? 
1 1 1   26    4   30 f    685.1    2.9    0.0000   0.0000          ?        ?  4694.4111  39.5883          ?        ?      685.1        2.9       ?       ? 
1 1 1   26    4   31 o    124.5   12.8    0.0000   0.0000          ?        ?   155.1608  31.9261          ?        ?      124.5       12.8       ?       ? 
1 1 1   26    4   32 o     19.8   10.0    0.0000   0.0000          ?        ?   -55.5514  17.8786          ?        ?       19.8       10.0       ?       ? 
1 1 1   26    4   33 o   1371.6    4.8    0.0000   0.0000          ?        ? 18815.3164 131.5355          ?        ?     1371.6        4.8       ?       ? 
1 1 1   26    4   34 f    628.9    2.8    0.0000   0.0000          ?        ?  3955.0032  35.7572          ?        ?      628.9        2.8       ?       ? 
1 1 1   26    4   35 o    991.0    3.8    0.0000   0.0000          ?        ?  9822.3789  75.9841          ?        ?      991.0        3.8       ?       ? 
1 1 1   26    4   36 o    331.0    3.1    0.0000   0.0000          ?        ?  1095.7031  20.4327          ?        ?      331.0        3.1       ?       ? 
1 1 1   26    4   37 o    535.2    2.7    0.0000   0.0000          ?        ?  2864.4080  28.7335          ?        ?      535.2        2.7       ?       ? 
1 1 1   26    4   38 o    327.7    2.8    0.0000   0.0000          ?        ?  1073.9934  18.5171          ?        ?      327.7        2.8       ?       ? 
1 1 1   26    4   39 o    488.5    2.5    0.0000   0.0000          ?        ?  2386.1555  24.9023          ?        ?      488.5        2.5       ?       ? 
1 1 1   26    4   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    4   41 o    337.1    2.7    0.0000   0.0000          ?        ?  1136.5685  18.5171          ?        ?      337.1        2.7       ?       ? 
1 1 1   26    4   42 o    312.5    2.9    0.0000   0.0000          ?        ?   976.9381  17.8786          ?        ?      312.5        2.9       ?       ? 
1 1 1   26    4   43 o    102.0    7.8    0.0000   0.0000          ?        ?   104.0790  15.9630          ?        ?      102.0        7.8       ?       ? 
1 1 1   26    4   44 o    138.6    6.2    0.0000   0.0000          ?        ?   192.1950  17.2401          ?        ?      138.6        6.2       ?       ? 
1 1 1   26    4   45 o    629.4    2.9    0.0000   0.0000          ?        ?  3962.0266  36.3957          ?        ?      629.4        2.9       ?       ? 
1 1 1   26    4   46 o    440.3    2.8    0.0000   0.0000          ?        ?  1938.5518  24.2638          ?        ?      440.3        2.8       ?       ? 
1 1 1   26    4   47 o    723.2    3.0    0.0000   0.0000          ?        ?  5232.0464  42.7809          ?        ?      723.2        3.0       ?       ? 
1 1 1   26    4   48 o    520.8    2.6    0.0000   0.0000          ?        ?  2712.4397  27.4564          ?        ?      520.8        2.6       ?       ? 
1 1 1   26    4   49 o    393.4    2.8    0.0000   0.0000          ?        ?  1547.7764  21.7097          ?        ?      393.4        2.8       ?       ? 
1 1 1   26    4   50 o    229.3    3.9    0.0000   0.0000          ?        ?   526.1418  17.8786          ?        ?      229.3        3.9       ?       ? 
1 1 1   26    4   51 o    345.8    2.9    0.0000   0.0000          ?        ?  1195.9510  19.7942          ?        ?      345.8        2.9       ?       ? 
1 1 1   26    4   52 f    143.3    5.8    0.0000   0.0000          ?        ?   205.6040  16.6016          ?        ?      143.3        5.8       ?       ? 
1 1 1   26    4   53 o    191.5    4.5    0.0000   0.0000          ?        ?   367.1499  17.2401          ?        ?      191.5        4.5       ?       ? 
1 1 1   26    4   54 o    304.8    3.2    0.0000   0.0000          ?        ?   929.6875  19.7942          ?        ?      304.8        3.2       ?       ? 
1 1 1   26    4   55 o    159.5    5.8    0.0000   0.0000          ?        ?   254.7701  18.5171          ?        ?      159.5        5.8       ?       ? 
1 1 1   26    4   56 o    428.3    2.8    0.0000   0.0000          ?        ?  1835.1111  24.2638          ?        ?      428.3        2.8       ?       ? 
1 1 1   26    4   57 o    346.8    3.0    0.0000   0.0000          ?        ?  1202.9747  21.0712          ?        ?      346.8        3.0       ?       ? 
1 1 1   26    4   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    4   59 o    182.6    5.4    0.0000   0.0000          ?        ?   333.9468  19.7942          ?        ?      182.6        5.4       ?       ? 
1 1 1   26    4   60 o    192.8    5.1    0.0000   0.0000          ?        ?   372.2581  19.7942          ?        ?      192.8        5.1       ?       ? 
1 1 1   26    4   61 o    262.4    3.9    0.0000   0.0000          ?        ?   688.9648  20.4327          ?        ?      262.4        3.9       ?       ? 
1 1 1   26    4   62 o    220.6    4.8    0.0000   0.0000          ?        ?   487.1920  21.0712          ?        ?      220.6        4.8       ?       ? 
1 1 1   26    4   63 o    168.9    6.0    0.0000   0.0000          ?        ?   286.0577  20.4327          ?        ?      168.9        6.0       ?       ? 
1 1 1   26    4   64 o     38.2   16.1    0.0000   0.0000          ?        ?     1.9156  21.0712          ?        ?       38.2       16.1       ?       ? 
1 1 1   26    4   65 o    393.8    3.2    0.0000   0.0000          ?        ?  1552.2461  25.5409          ?        ?      393.8        3.2       ?       ? 
1 1 1   26    4   66 o    232.6    4.5    0.0000   0.0000          ?        ?   542.1049  21.0712          ?        ?      232.6        4.5       ?       ? 
1 1 1   26    4   67 o     93.4   10.6    0.0000   0.0000          ?        ?    88.1160  19.7942          ?        ?       93.4       10.6       ?       ? 
1 1 1   26    4   68 f    151.2    7.0    0.0000   0.0000          ?        ?   229.8678  21.0712          ?        ?      151.2        7.0       ?       ? 
1 1 1   26    4   69 o     19.4    9.8    0.0000   0.0000          ?        ?   -67.0448  19.1556          ?        ?       19.4        9.8       ?       ? 
1 1 1   26    4   70 o    119.9    8.3    0.0000   0.0000          ?        ?   144.9444  19.7942          ?        ?      119.9        8.3       ?       ? 
1 1 1   26    4   71 o    102.9    9.9    0.0000   0.0000          ?        ?   107.2716  20.4327          ?        ?      102.9        9.9       ?       ? 
1 1 1   26    4   72 o    195.1    5.4    0.0000   0.0000          ?        ?   382.4745  21.0712          ?        ?      195.1        5.4       ?       ? 
1 1 1   26    4   73 o    134.4    7.8    0.0000   0.0000          ?        ?   182.6172  21.0712          ?        ?      134.4        7.8       ?       ? 
1 1 1   26    4   74 o     46.1   16.4    0.0000   0.0000          ?        ?    19.7942  19.1556          ?        ?       46.1       16.4       ?       ? 
1 1 1   26    4   75 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    5    0 o   1405.0    7.1 19742.4492 198.5802 19742.4492 198.5802 19742.4492 198.5802     1405.0      7.1     1405.0        7.1     0.0     0.0 
1 1 1   26    5    1 o   1192.0    4.3    0.0000   0.0000          ?        ? 14208.3828 103.4405          ?        ?     1192.0        4.3       ?       ? 
1 1 1   26    5    2 o    451.4    2.3    0.0000   0.0000          ?        ?  2037.5226  21.0712          ?        ?      451.4        2.3       ?       ? 
1 1 1   26    5    3 o    788.5    3.1    0.0000   0.0000          ?        ?  6217.2852  49.1662          ?        ?      788.5        3.1       ?       ? 
1 1 1   26    5    4 o    185.9    2.9    0.0000   0.0000          ?        ?   345.4402  10.8549          ?        ?      185.9        2.9       ?       ? 
1 1 1   26    5    5 o   1035.0    3.7    0.0000   0.0000          ?        ? 10712.4766  76.6226          ?        ?     1035.0        3.7       ?       ? 
1 1 1   26    5    6 o   1567.6    5.5    0.0000   0.0000          ?        ? 24576.0586 171.7623          ?        ?     1567.6        5.5       ?       ? 
1 1 1   26    5    7 o   1837.8    6.3    0.0000   0.0000          ?        ? 33779.7070 233.0604          ?        ?     1837.8        6.3       ?       ? 
1 1 1   26    5    8 o    871.3    3.3    0.0000   0.0000          ?        ?  7592.6606  58.1055          ?        ?      871.3        3.3       ?       ? 
1 1 1   26    5    9 o   2120.0    7.2    0.0000   0.0000          ?        ? 44950.0078 305.2133          ?        ?     2120.0        7.2       ?       ? 
1 1 1   26    5   10 o   2450.6    8.1    0.0000   0.0000          ?        ? 60067.0078 397.1605          ?        ?     2450.6        8.1       ?       ? 
1 1 1   26    5   11 o   1345.3    4.8    0.0000   0.0000          ?        ? 18099.5352 128.9814          ?        ?     1345.3        4.8       ?       ? 
1 1 1   26    5   12 o   1829.4    6.3    0.0000   0.0000          ?        ? 33471.3047 230.5063          ?        ?     1829.4        6.3       ?       ? 
1 1 1   26    5   13 o    980.5    3.6    0.0000   0.0000          ?        ?  9613.5811  71.5144          ?        ?      980.5        3.6       ?       ? 
1 1 1   26    5   14 o    266.0    2.3    0.0000   0.0000          ?        ?   707.4820  12.1319          ?        ?      266.0        2.3       ?       ? 
1 1 1   26    5   15 o   1037.9    3.7    0.0000   0.0000          ?        ? 10773.7754  77.2611          ?        ?     1037.9        3.7       ?       ? 
1 1 1   26    5   16 o    544.1    2.6    0.0000   0.0000          ?        ?  2960.8250  28.7335          ?        ?      544.1        2.6       ?       ? 
1 1 1   26    5   17 o   1081.7    3.9    0.0000   0.0000          ?        ? 11701.5469  83.6463          ?        ?     1081.7        3.9       ?       ? 
1 1 1   26    5   18 o    321.7    2.7    0.0000   0.0000          ?        ?  1035.0436  17.2401          ?        ?      321.7        2.7       ?       ? 
1 1 1   26    5   19 o    965.2    3.6    0.0000   0.0000          ?        ?  9317.3076  70.2374          ?        ?      965.2        3.6       ?       ? 
1 1 1   26    5   20 o   1456.6    5.0    0.0000   0.0000          ?        ? 21219.9902 145.5829          ?        ?     1456.6        5.0       ?       ? 
1 1 1   26    5   21 o    536.9    2.5    0.0000   0.0000          ?        ?  2882.9250  26.8179          ?        ?      536.9        2.5       ?       ? 
1 1 1   26    5   22 o    973.9    3.7    0.0000   0.0000          ?        ?  9484.6006  72.1529          ?        ?      973.9        3.7       ?       ? 
1 1 1   26    5   23 o   1525.2    5.9    0.0000   0.0000          ?        ? 23264.5352 179.4246          ?        ?     1525.2        5.9       ?       ? 
1 1 1   26    5   24 o   1803.8    6.5    0.0000   0.0000          ?        ? 32543.5332 233.6989          ?        ?     1803.8        6.5       ?       ? 
1 1 1   26    5   25 o    895.5    3.6    0.0000   0.0000          ?        ?  8019.8315  64.4907          ?        ?      895.5        3.6       ?       ? 
1 1 1   26    5   26 o   1153.9    4.4    0.0000   0.0000          ?        ? 13316.3682 102.1635          ?        ?     1153.9        4.4       ?       ? 
1 1 1   26    5   27 o    176.7    5.4    0.0000   0.0000          ?        ?   312.2371  19.1556          ?        ?      176.7        5.4       ?       ? 
1 1 1   26    5   28 o   1407.1    5.1    0.0000   0.0000          ?        ? 19801.8320 143.0288          ?        ?     1407.1        5.1       ?       ? 
1 1 1   26    5   29 o   1244.4    4.6    0.0000   0.0000          ?        ? 15486.0654 114.9339          ?        ?     1244.4        4.6       ?       ? 
1 1 1   26    5   30 f   1166.2    4.5    0.0000   0.0000          ?        ? 13601.1494 104.0790          ?        ?     1166.2        4.5       ?       ? 
1 1 1   26    5   31 o    539.3    2.9    0.0000   0.0000          ?        ?  2909.1045  31.2876          ?        ?      539.3        2.9       ?       ? 
1 1 1   26    5   32 o    766.0    3.1    0.0000   0.0000          ?        ?  5868.0137  47.2506          ?        ?      766.0        3.1       ?       ? 
1 1 1   26    5   33 o    677.9    2.9    0.0000   0.0000          ?        ?  4596.0786  39.5883          ?        ?      677.9        2.9       ?       ? 
1 1 1   26    5   34 o    530.0    2.7    0.0000   0.0000          ?        ?  2809.4951  28.0950          ?        ?      530.0        2.7       ?       ? 
1 1 1   26    5   35 o    605.6    2.8    0.0000   0.0000          ?        ?  3668.3066  34.4802          ?        ?      605.6        2.8       ?       ? 
1 1 1   26    5   36 o    381.2    2.8    0.0000   0.0000          ?        ?  1453.2753  21.0712          ?        ?      381.2        2.8       ?       ? 
1 1 1   26    5   37 o    211.5    4.1    0.0000   0.0000          ?        ?   447.6036  17.2401          ?        ?      211.5        4.1       ?       ? 
1 1 1   26    5   38 o    414.2    2.6    0.0000   0.0000          ?        ?  1715.7076  21.7097          ?        ?      414.2        2.6       ?       ? 
1 1 1   26    5   39 o    116.6    6.8    0.0000   0.0000          ?        ?   136.0051  15.9630          ?        ?      116.6        6.8       ?       ? 
1 1 1   26    5   40 f    541.6    2.7    0.0000   0.0000          ?        ?  2934.0068  28.7335          ?        ?      541.6        2.7       ?       ? 
1 1 1   26    5   41 o    778.7    3.2    0.0000   0.0000          ?        ?  6064.0400  49.1662          ?        ?      778.7        3.2       ?       ? 
1 1 1   26    5   42 o    314.6    2.9    0.0000   0.0000          ?        ?   989.7085  18.5171          ?        ?      314.6        2.9       ?       ? 
1 1 1   26    5   43 o    669.5    2.9    0.0000   0.0000          ?        ?  4482.4219  38.3113          ?        ?      669.5        2.9       ?       ? 
1 1 1   26    5   44 o    192.6    4.3    0.0000   0.0000          ?        ?   370.9810  16.6016          ?        ?      192.6        4.3       ?       ? 
1 1 1   26    5   45 o     57.5   14.9    0.0000   0.0000          ?        ?    34.4802  17.2401          ?        ?       57.5       14.9       ?       ? 
1 1 1   26    5   46 o    105.0    7.6    0.0000   0.0000          ?        ?   110.4642  15.9630          ?        ?      105.0        7.6       ?       ? 
1 1 1   26    5   47 o    257.3    3.7    0.0000   0.0000          ?        ?   662.1469  19.1556          ?        ?      257.3        3.7       ?       ? 
1 1 1   26    5   48 o     27.2   12.7    0.0000   0.0000          ?        ?   -17.2401  17.2401          ?        ?       27.2       12.7       ?       ? 
1 1 1   26    5   49 o    309.0    3.2    0.0000   0.0000          ?        ?   955.2284  19.7942          ?        ?      309.0        3.2       ?       ? 
1 1 1   26    5   50 f    312.5    3.1    0.0000   0.0000          ?        ?   976.9381  19.1556          ?        ?      312.5        3.1       ?       ? 
1 1 1   26    5   51 o    286.7    3.2    0.0000   0.0000          ?        ?   822.4159  18.5171          ?        ?      286.7        3.2       ?       ? 
1 1 1   26    5   52 o    269.7    3.4    0.0000   0.0000          ?        ?   727.9147  18.5171          ?        ?      269.7        3.4       ?       ? 
1 1 1   26    5   53 o    133.6    6.2    0.0000   0.0000          ?        ?   178.7861  16.6016          ?        ?      133.6        6.2       ?       ? 
1 1 1   26    5   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    5   55 o     25.3   12.2    0.0000   0.0000          ?        ?   -26.1794  17.8786          ?        ?       25.3       12.2       ?       ? 
1 1 1   26    5   56 o    186.8    5.1    0.0000   0.0000          ?        ?   349.2713  19.1556          ?        ?      186.8        5.1       ?       ? 
1 1 1   26    5   57 o    110.8    8.1    0.0000   0.0000          ?        ?   123.2347  17.8786          ?        ?      110.8        8.1       ?       ? 
1 1 1   26    5   58 o    136.4    7.0    0.0000   0.0000          ?        ?   186.4483  19.1556          ?        ?      136.4        7.0       ?       ? 
1 1 1   26    5   59 o     36.6   15.4    0.0000   0.0000          ?        ?     1.9156  19.1556          ?        ?       36.6       15.4       ?       ? 
1 1 1   26    5   60 o    276.7    3.8    0.0000   0.0000          ?        ?   766.2260  21.0712          ?        ?      276.7        3.8       ?       ? 
1 1 1   26    5   61 o     37.1   15.8    0.0000   0.0000          ?        ?     0.6385  20.4327          ?        ?       37.1       15.8       ?       ? 
1 1 1   26    5   62 o     36.8   15.7    0.0000   0.0000          ?        ?     0.0000  20.4327          ?        ?       36.8       15.7       ?       ? 
1 1 1   26    5   63 o    352.9    3.3    0.0000   0.0000          ?        ?  1246.3942  23.6253          ?        ?      352.9        3.3       ?       ? 
1 1 1   26    5   64 o    235.1    4.6    0.0000   0.0000          ?        ?   553.5982  21.7097          ?        ?      235.1        4.6       ?       ? 
1 1 1   26    5   65 o     78.4   14.4    0.0000   0.0000          ?        ?    64.4907  21.7097          ?        ?       78.4       14.4       ?       ? 
1 1 1   26    5   66 o    105.2   10.0    0.0000   0.0000          ?        ?   111.7413  21.0712          ?        ?      105.2       10.0       ?       ? 
1 1 1   26    5   67 o    178.0    5.9    0.0000   0.0000          ?        ?   317.9838  21.0712          ?        ?      178.0        5.9       ?       ? 
1 1 1   26    5   68 f     43.8   16.7    0.0000   0.0000          ?        ?    14.0475  20.4327          ?        ?       43.8       16.7       ?       ? 
1 1 1   26    5   69 o     28.2   13.5    0.0000   0.0000          ?        ?   -29.3720  21.7097          ?        ?       28.2       13.5       ?       ? 
1 1 1   26    5   70 o    211.7    5.1    0.0000   0.0000          ?        ?   449.5192  21.7097          ?        ?      211.7        5.1       ?       ? 
1 1 1   26    5   71 o     60.7   16.4    0.0000   0.0000          ?        ?    39.5883  20.4327          ?        ?       60.7       16.4       ?       ? 
1 1 1   26    5   72 o    123.1    8.6    0.0000   0.0000          ?        ?   153.2452  21.0712          ?        ?      123.1        8.6       ?       ? 
1 1 1   26    5   73 o    210.8    5.2    0.0000   0.0000          ?        ?   446.3266  21.7097          ?        ?      210.8        5.2       ?       ? 
1 1 1   26    5   74 o    179.4    6.2    0.0000   0.0000          ?        ?   324.3690  22.3483          ?        ?      179.4        6.2       ?       ? 
1 1 1   26    6    0 o   1165.3    6.1 13581.9941 141.1133 13581.9941 141.1133 13581.9941 141.1133     1165.3      6.1     1165.3        6.1     0.0     0.0 
1 1 1   26    6    1 o    994.1    3.5    0.0000   0.0000          ?        ?  9883.0381  70.2374          ?        ?      994.1        3.5       ?       ? 
1 1 1   26    6    2 o   1619.5    5.4    0.0000   0.0000          ?        ? 26229.8301 175.5934          ?        ?     1619.5        5.4       ?       ? 
1 1 1   26    6    3 o   1273.5    4.4    0.0000   0.0000          ?        ? 16219.7256 112.3798          ?        ?     1273.5        4.4       ?       ? 
1 1 1   26    6    4 o    772.3    2.9    0.0000   0.0000          ?        ?  5964.4302  44.6965          ?        ?      772.3        2.9       ?       ? 
1 1 1   26    6    5 o   1121.9    4.0    0.0000   0.0000          ?        ? 12587.1768  90.0316          ?        ?     1121.9        4.0       ?       ? 
1 1 1   26    6    6 o   1257.7    4.5    0.0000   0.0000          ?        ? 15819.3730 114.2954          ?        ?     1257.7        4.5       ?       ? 
1 1 1   26    6    7 o   1023.8    3.7    0.0000   0.0000          ?        ? 10481.3320  75.9841          ?        ?     1023.8        3.7       ?       ? 
1 1 1   26    6    8 o    645.5    2.7    0.0000   0.0000          ?        ?  4166.9922  35.1187          ?        ?      645.5        2.7       ?       ? 
1 1 1   26    6    9 o    445.3    2.3    0.0000   0.0000          ?        ?  1983.2482  20.4327          ?        ?      445.3        2.3       ?       ? 
1 1 1   26    6   10 o    855.7    3.3    0.0000   0.0000          ?        ?  7321.9272  56.1899          ?        ?      855.7        3.3       ?       ? 
1 1 1   26    6   11 o    821.7    3.2    0.0000   0.0000          ?        ?  6751.7280  52.3588          ?        ?      821.7        3.2       ?       ? 
1 1 1   26    6   12 o   1718.5    5.9    0.0000   0.0000          ?        ? 29535.4570 203.6884          ?        ?     1718.5        5.9       ?       ? 
1 1 1   26    6   13 o    866.7    3.2    0.0000   0.0000          ?        ?  7512.2070  56.1899          ?        ?      866.7        3.2       ?       ? 
1 1 1   26    6   14 o   1581.4    5.5    0.0000   0.0000          ?        ? 25010.8926 173.6779          ?        ?     1581.4        5.5       ?       ? 
1 1 1   26    6   15 o    299.8    2.3    0.0000   0.0000          ?        ?   899.0385  14.0475          ?        ?      299.8        2.3       ?       ? 
1 1 1   26    6   16 o    399.9    2.4    0.0000   0.0000          ?        ?  1598.8582  19.1556          ?        ?      399.9        2.4       ?       ? 
1 1 1   26    6   17 o   1495.3    5.3    0.0000   0.0000          ?        ? 22362.3047 157.7148          ?        ?     1495.3        5.3       ?       ? 
1 1 1   26    6   18 o   1266.9    4.5    0.0000   0.0000          ?        ? 16051.1572 114.9339          ?        ?     1266.9        4.5       ?       ? 
1 1 1   26    6   19 o    203.7    3.0    0.0000   0.0000          ?        ?   415.0391  12.1319          ?        ?      203.7        3.0       ?       ? 
1 1 1   26    6   20 o   1143.3    4.4    0.0000   0.0000          ?        ? 13073.0918  99.6094          ?        ?     1143.3        4.4       ?       ? 
1 1 1   26    6   21 o    542.2    2.6    0.0000   0.0000          ?        ?  2940.3921  28.7335          ?        ?      542.2        2.6       ?       ? 
1 1 1   26    6   22 o   1336.5    5.0    0.0000   0.0000          ?        ? 17864.5586 133.4510          ?        ?     1336.5        5.0       ?       ? 
1 1 1   26    6   23 o    930.2    3.8    0.0000   0.0000          ?        ?  8653.2451  70.2374          ?        ?      930.2        3.8       ?       ? 
1 1 1   26    6   24 o   1780.1    6.4    0.0000   0.0000          ?        ? 31692.3809 229.2293          ?        ?     1780.1        6.4       ?       ? 
1 1 1   26    6   25 o   1139.4    4.5    0.0000   0.0000          ?        ? 12983.0605 101.5249          ?        ?     1139.4        4.5       ?       ? 
1 1 1   26    6   26 o    891.5    3.7    0.0000   0.0000          ?        ?  7948.3174  65.7677          ?        ?      891.5        3.7       ?       ? 
1 1 1   26    6   27 o    840.7    3.4    0.0000   0.0000          ?        ?  7068.4346  56.8284          ?        ?      840.7        3.4       ?       ? 
1 1 1   26    6   28 o    609.0    2.9    0.0000   0.0000          ?        ?  3708.5334  35.1187          ?        ?      609.0        2.9       ?       ? 
1 1 1   26    6   29 o    543.9    2.8    0.0000   0.0000          ?        ?  2958.2705  30.6490          ?        ?      543.9        2.8       ?       ? 
1 1 1   26    6   30 o   1107.3    4.1    0.0000   0.0000          ?        ? 12262.8076  90.0316          ?        ?     1107.3        4.1       ?       ? 
1 1 1   26    6   31 o    809.0    3.3    0.0000   0.0000          ?        ?  6544.8467  53.6358          ?        ?      809.0        3.3       ?       ? 
1 1 1   26    6   32 o     84.5   10.2    0.0000   0.0000          ?        ?    71.5144  17.2401          ?        ?       84.5       10.2       ?       ? 
1 1 1   26    6   33 o    965.3    3.7    0.0000   0.0000          ?        ?  9319.8613  70.8759          ?        ?      965.3        3.7       ?       ? 
1 1 1   26    6   34 o    892.1    3.5    0.0000   0.0000          ?        ?  7959.8105  62.5751          ?        ?      892.1        3.5       ?       ? 
1 1 1   26    6   35 o    992.2    3.9    0.0000   0.0000          ?        ?  9846.6416  76.6226          ?        ?      992.2        3.9       ?       ? 
1 1 1   26    6   36 o    790.0    3.2    0.0000   0.0000          ?        ?  6242.1875  49.8047          ?        ?      790.0        3.2       ?       ? 
1 1 1   26    6   37 o    215.7    4.0    0.0000   0.0000          ?        ?   465.4823  17.2401          ?        ?      215.7        4.0       ?       ? 
1 1 1   26    6   38 o    333.2    3.1    0.0000   0.0000          ?        ?  1110.3890  20.4327          ?        ?      333.2        3.1       ?       ? 
1 1 1   26    6   39 o    144.7    5.5    0.0000   0.0000          ?        ?   209.4351  15.9630          ?        ?      144.7        5.5       ?       ? 
1 1 1   26    6   40 o    580.5    2.7    0.0000   0.0000          ?        ?  3370.7559  31.2876          ?        ?      580.5        2.7       ?       ? 
1 1 1   26    6   41 o    329.0    2.9    0.0000   0.0000          ?        ?  1082.2942  19.1556          ?        ?      329.0        2.9       ?       ? 
1 1 1   26    6   42 o    285.3    3.2    0.0000   0.0000          ?        ?   814.1151  18.5171          ?        ?      285.3        3.2       ?       ? 
1 1 1   26    6   43 o    158.8    5.4    0.0000   0.0000          ?        ?   252.2160  17.2401          ?        ?      158.8        5.4       ?       ? 
1 1 1   26    6   44 o    504.5    2.6    0.0000   0.0000          ?        ?  2545.1472  26.1794          ?        ?      504.5        2.6       ?       ? 
1 1 1   26    6   45 o    261.0    3.5    0.0000   0.0000          ?        ?   681.3026  18.5171          ?        ?      261.0        3.5       ?       ? 
1 1 1   26    6   46 o    156.9    5.5    0.0000   0.0000          ?        ?   246.4693  17.2401          ?        ?      156.9        5.5       ?       ? 
1 1 1   26    6   47 o     23.3   11.4    0.0000   0.0000          ?        ?   -35.1187  17.8786          ?        ?       23.3       11.4       ?       ? 
1 1 1   26    6   48 o    572.5    2.7    0.0000   0.0000          ?        ?  3278.1702  31.2876          ?        ?      572.5        2.7       ?       ? 
1 1 1   26    6   49 o    385.5    2.8    0.0000   0.0000          ?        ?  1486.4784  21.7097          ?        ?      385.5        2.8       ?       ? 
1 1 1   26    6   50 o    212.7    4.1    0.0000   0.0000          ?        ?   452.7119  17.2401          ?        ?      212.7        4.1       ?       ? 
1 1 1   26    6   51 o    305.1    3.1    0.0000   0.0000          ?        ?   930.9645  19.1556          ?        ?      305.1        3.1       ?       ? 
1 1 1   26    6   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    6   53 o    339.5    3.1    0.0000   0.0000          ?        ?  1153.1700  21.0712          ?        ?      339.5        3.1       ?       ? 
1 1 1   26    6   54 o    164.6    5.4    0.0000   0.0000          ?        ?   271.3717  17.8786          ?        ?      164.6        5.4       ?       ? 
1 1 1   26    6   55 f    145.7    6.4    0.0000   0.0000          ?        ?   212.6277  18.5171          ?        ?      145.7        6.4       ?       ? 
1 1 1   26    6   56 o    295.6    3.5    0.0000   0.0000          ?        ?   874.1360  20.4327          ?        ?      295.6        3.5       ?       ? 
1 1 1   26    6   57 o     25.8   12.5    0.0000   0.0000          ?        ?   -29.3720  19.1556          ?        ?       25.8       12.5       ?       ? 
1 1 1   26    6   58 o    271.2    3.8    0.0000   0.0000          ?        ?   736.2155  20.4327          ?        ?      271.2        3.8       ?       ? 
1 1 1   26    6   59 o    306.5    3.4    0.0000   0.0000          ?        ?   939.9038  21.0712          ?        ?      306.5        3.4       ?       ? 
1 1 1   26    6   60 o    180.5    5.5    0.0000   0.0000          ?        ?   326.2845  19.7942          ?        ?      180.5        5.5       ?       ? 
1 1 1   26    6   61 o     22.0   11.0    0.0000   0.0000          ?        ?   -52.9973  19.7942          ?        ?       22.0       11.0       ?       ? 
1 1 1   26    6   62 o    123.8    8.0    0.0000   0.0000          ?        ?   153.8837  19.7942          ?        ?      123.8        8.0       ?       ? 
1 1 1   26    6   63 o     45.5   16.9    0.0000   0.0000          ?        ?    16.6016  20.4327          ?        ?       45.5       16.9       ?       ? 
1 1 1   26    6   64 o    163.3    6.5    0.0000   0.0000          ?        ?   267.5406  21.0712          ?        ?      163.3        6.5       ?       ? 
1 1 1   26    6   65 o    186.8    5.6    0.0000   0.0000          ?        ?   349.9099  21.0712          ?        ?      186.8        5.6       ?       ? 
1 1 1   26    6   66 o     22.7   11.3    0.0000   0.0000          ?        ?   -52.3588  20.4327          ?        ?       22.7       11.3       ?       ? 
1 1 1   26    6   67 o    401.3    3.2    0.0000   0.0000          ?        ?  1612.2671  25.5409          ?        ?      401.3        3.2       ?       ? 
1 1 1   26    6   68 o    175.4    6.4    0.0000   0.0000          ?        ?   309.0445  22.3483          ?        ?      175.4        6.4       ?       ? 
1 1 1   26    6   69 o    164.9    6.2    0.0000   0.0000          ?        ?   273.2873  20.4327          ?        ?      164.9        6.2       ?       ? 
1 1 1   26    6   70 o    117.9    8.9    0.0000   0.0000          ?        ?   140.4748  21.0712          ?        ?      117.9        8.9       ?       ? 
1 1 1   26    6   71 o    187.8    5.6    0.0000   0.0000          ?        ?   354.3795  21.0712          ?        ?      187.8        5.6       ?       ? 
1 1 1   26    6   72 o     69.3   15.2    0.0000   0.0000          ?        ?    51.7203  20.4327          ?        ?       69.3       15.2       ?       ? 
1 1 1   26    6   73 o     96.9   10.5    0.0000   0.0000          ?        ?    95.7782  20.4327          ?        ?       96.9       10.5       ?       ? 
1 1 1   26    6   74 o     77.8   12.7    0.0000   0.0000          ?        ?    62.5751  19.7942          ?        ?       77.8       12.7       ?       ? 
1 1 1   26    7    0 o   1157.8    5.7 13407.0381 132.8125 13407.0381 132.8125 13407.0381 132.8125     1157.8      5.7     1157.8        5.7     0.0     0.0 
1 1 1   26    7    1 o    845.3    3.2    0.0000   0.0000          ?        ?  7145.6953  53.6358          ?        ?      845.3        3.2       ?       ? 
1 1 1   26    7    2 o   1346.9    4.6    0.0000   0.0000          ?        ? 18142.9531 125.1502          ?        ?     1346.9        4.6       ?       ? 
1 1 1   26    7    3 f   1588.7    5.5    0.0000   0.0000          ?        ? 25243.3125 174.3164          ?        ?     1588.7        5.5       ?       ? 
1 1 1   26    7    4 o   1237.4    4.3    0.0000   0.0000          ?        ? 15312.3877 106.6331          ?        ?     1237.4        4.3       ?       ? 
1 1 1   26    7    5 o   1099.8    3.9    0.0000   0.0000          ?        ? 12096.1543  86.8389          ?        ?     1099.8        3.9       ?       ? 
1 1 1   26    7    6 o   2322.5    7.7    0.0000   0.0000          ?        ? 53948.6914 358.2106          ?        ?     2322.5        7.7       ?       ? 
1 1 1   26    7    7 o   1403.5    5.0    0.0000   0.0000          ?        ? 19700.3086 139.1977          ?        ?     1403.5        5.0       ?       ? 
1 1 1   26    7    8 o    902.8    3.4    0.0000   0.0000          ?        ?  8150.0903  60.6596          ?        ?      902.8        3.4       ?       ? 
1 1 1   26    7    9 f    708.5    2.7    0.0000   0.0000          ?        ?  5019.4185  38.9498          ?        ?      708.5        2.7       ?       ? 
1 1 1   26    7   10 o    309.6    2.1    0.0000   0.0000          ?        ?   958.4210  12.7704          ?        ?      309.6        2.1       ?       ? 
1 1 1   26    7   11 o   1030.3    3.7    0.0000   0.0000          ?        ? 10614.7832  77.2611          ?        ?     1030.3        3.7       ?       ? 
1 1 1   26    7   12 o    294.8    2.3    0.0000   0.0000          ?        ?   869.0280  13.4090          ?        ?      294.8        2.3       ?       ? 
1 1 1   26    7   13 o    720.4    2.9    0.0000   0.0000          ?        ?  5190.5425  41.5039          ?        ?      720.4        2.9       ?       ? 
1 1 1   26    7   14 o   1143.3    4.0    0.0000   0.0000          ?        ? 13073.0918  92.5856          ?        ?     1143.3        4.0       ?       ? 
1 1 1   26    7   15 o    415.0    2.2    0.0000   0.0000          ?        ?  1722.0929  17.8786          ?        ?      415.0        2.2       ?       ? 
1 1 1   26    7   16 o   1604.2    5.6    0.0000   0.0000          ?        ? 25738.8066 179.4246          ?        ?     1604.2        5.6       ?       ? 
1 1 1   26    7   17 f    518.7    2.5    0.0000   0.0000          ?        ?  2690.7300  25.5409          ?        ?      518.7        2.5       ?       ? 
1 1 1   26    7   18 o   1259.8    4.6    0.0000   0.0000          ?        ? 15873.6475 116.2109          ?        ?     1259.8        4.6       ?       ? 
1 1 1   26    7   19 o    385.7    2.2    0.0000   0.0000          ?        ?  1487.7554  17.2401          ?        ?      385.7        2.2       ?       ? 
1 1 1   26    7   20 o    347.2    2.5    0.0000   0.0000          ?        ?  1205.5288  17.2401          ?        ?      347.2        2.5       ?       ? 
1 1 1   26    7   21 o    425.8    2.4    0.0000   0.0000          ?        ?  1812.7628  20.4327          ?        ?      425.8        2.4       ?       ? 
1 1 1   26    7   22 o    113.0    6.2    0.0000   0.0000          ?        ?   127.7043  14.0475          ?        ?      113.0        6.2       ?       ? 
1 1 1   26    7   23 o   1079.7    4.0    0.0000   0.0000          ?        ? 11659.4053  86.2004          ?        ?     1079.7        4.0       ?       ? 
1 1 1   26    7   24 o   1139.8    4.1    0.0000   0.0000          ?        ? 12993.2764  92.5856          ?        ?     1139.8        4.1       ?       ? 
1 1 1   26    7   25 o    507.8    2.6    0.0000   0.0000          ?        ?  2578.9888  26.8179          ?        ?      507.8        2.6       ?       ? 
1 1 1   26    7   26 o    543.2    2.6    0.0000   0.0000          ?        ?  2951.2471  28.0950          ?        ?      543.2        2.6       ?       ? 
1 1 1   26    7   27 o    314.2    2.7    0.0000   0.0000          ?        ?   987.1545  17.2401          ?        ?      314.2        2.7       ?       ? 
1 1 1   26    7   28 o    600.3    2.8    0.0000   0.0000          ?        ?  3603.1775  33.8416          ?        ?      600.3        2.8       ?       ? 
1 1 1   26    7   29 o    459.7    2.4    0.0000   0.0000          ?        ?  2112.8679  22.3483          ?        ?      459.7        2.4       ?       ? 
1 1 1   26    7   30 o    951.2    3.8    0.0000   0.0000          ?        ?  9049.1279  71.5144          ?        ?      951.2        3.8       ?       ? 
1 1 1   26    7   31 o    254.9    3.5    0.0000   0.0000          ?        ?   650.0150  17.8786          ?        ?      254.9        3.5       ?       ? 
1 1 1   26    7   32 o   1114.9    4.0    0.0000   0.0000          ?        ? 12432.0156  89.3930          ?        ?     1114.9        4.0       ?       ? 
1 1 1   26    7   33 o   1054.8    4.1    0.0000   0.0000          ?        ? 11128.1553  86.2004          ?        ?     1054.8        4.1       ?       ? 
1 1 1   26    7   34 o    308.9    2.7    0.0000   0.0000          ?        ?   953.9513  16.6016          ?        ?      308.9        2.7       ?       ? 
1 1 1   26    7   35 o    831.8    3.3    0.0000   0.0000          ?        ?  6919.6587  54.2743          ?        ?      831.8        3.3       ?       ? 
1 1 1   26    7   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    7   37 o    698.6    2.8    0.0000   0.0000          ?        ?  4880.2207  39.5883          ?        ?      698.6        2.8       ?       ? 
1 1 1   26    7   38 o    193.2    4.1    0.0000   0.0000          ?        ?   373.5352  15.9630          ?        ?      193.2        4.1       ?       ? 
1 1 1   26    7   39 o    510.4    2.6    0.0000   0.0000          ?        ?  2605.1682  26.1794          ?        ?      510.4        2.6       ?       ? 
1 1 1   26    7   40 o    405.2    2.7    0.0000   0.0000          ?        ?  1642.2777  21.7097          ?        ?      405.2        2.7       ?       ? 
1 1 1   26    7   41 o    437.0    2.7    0.0000   0.0000          ?        ?  1909.8182  23.6253          ?        ?      437.0        2.7       ?       ? 
1 1 1   26    7   42 o    776.1    3.0    0.0000   0.0000          ?        ?  6025.0898  46.6121          ?        ?      776.1        3.0       ?       ? 
1 1 1   26    7   43 o    224.7    3.8    0.0000   0.0000          ?        ?   505.0706  17.2401          ?        ?      224.7        3.8       ?       ? 
1 1 1   26    7   44 o    509.1    2.6    0.0000   0.0000          ?        ?  2592.3977  26.1794          ?        ?      509.1        2.6       ?       ? 
1 1 1   26    7   45 o    159.4    4.8    0.0000   0.0000          ?        ?   254.1316  15.3245          ?        ?      159.4        4.8       ?       ? 
1 1 1   26    7   46 o    274.3    3.4    0.0000   0.0000          ?        ?   752.8170  18.5171          ?        ?      274.3        3.4       ?       ? 
1 1 1   26    7   47 o     19.0    9.6    0.0000   0.0000          ?        ?   -56.8284  17.2401          ?        ?       19.0        9.6       ?       ? 
1 1 1   26    7   48 o    532.6    2.6    0.0000   0.0000          ?        ?  2836.9514  28.0950          ?        ?      532.6        2.6       ?       ? 
1 1 1   26    7   49 o    238.9    3.6    0.0000   0.0000          ?        ?   570.8383  17.2401          ?        ?      238.9        3.6       ?       ? 
1 1 1   26    7   50 o    461.2    2.7    0.0000   0.0000          ?        ?  2127.5542  24.9023          ?        ?      461.2        2.7       ?       ? 
1 1 1   26    7   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    7   52 o    443.5    2.7    0.0000   0.0000          ?        ?  1967.2852  24.2638          ?        ?      443.5        2.7       ?       ? 
1 1 1   26    7   53 o     20.2   10.2    0.0000   0.0000          ?        ?   -52.3588  17.8786          ?        ?       20.2       10.2       ?       ? 
1 1 1   26    7   54 o    240.6    3.8    0.0000   0.0000          ?        ?   579.1391  18.5171          ?        ?      240.6        3.8       ?       ? 
1 1 1   26    7   55 o    357.7    2.9    0.0000   0.0000          ?        ?  1280.2358  21.0712          ?        ?      357.7        2.9       ?       ? 
1 1 1   26    7   56 o    445.1    2.7    0.0000   0.0000          ?        ?  1981.9711  24.2638          ?        ?      445.1        2.7       ?       ? 
1 1 1   26    7   57 o     51.6   16.2    0.0000   0.0000          ?        ?    26.8179  18.5171          ?        ?       51.6       16.2       ?       ? 
1 1 1   26    7   58 o    137.7    7.0    0.0000   0.0000          ?        ?   190.2794  19.1556          ?        ?      137.7        7.0       ?       ? 
1 1 1   26    7   59 o     39.8   15.7    0.0000   0.0000          ?        ?     8.9393  18.5171          ?        ?       39.8       15.7       ?       ? 
1 1 1   26    7   60 o    250.1    4.1    0.0000   0.0000          ?        ?   626.3897  20.4327          ?        ?      250.1        4.1       ?       ? 
1 1 1   26    7   61 o    239.1    4.1    0.0000   0.0000          ?        ?   572.1154  19.7942          ?        ?      239.1        4.1       ?       ? 
1 1 1   26    7   62 o     21.8   10.9    0.0000   0.0000          ?        ?   -54.2743  19.7942          ?        ?       21.8       10.9       ?       ? 
1 1 1   26    7   63 o    362.2    3.2    0.0000   0.0000          ?        ?  1312.8005  22.9868          ?        ?      362.2        3.2       ?       ? 
1 1 1   26    7   64 o    320.6    3.5    0.0000   0.0000          ?        ?  1028.6583  22.3483          ?        ?      320.6        3.5       ?       ? 
1 1 1   26    7   65 o    109.7    9.6    0.0000   0.0000          ?        ?   121.3191  21.0712          ?        ?      109.7        9.6       ?       ? 
1 1 1   26    7   66 o    339.9    3.5    0.0000   0.0000          ?        ?  1156.3627  23.6253          ?        ?      339.9        3.5       ?       ? 
1 1 1   26    7   67 o     86.5   11.8    0.0000   0.0000          ?        ?    75.9841  20.4327          ?        ?       86.5       11.8       ?       ? 
1 1 1   26    7   68 o     47.9   17.2    0.0000   0.0000          ?        ?    20.4327  21.0712          ?        ?       47.9       17.2       ?       ? 
1 1 1   26    7   69 o    126.5    8.3    0.0000   0.0000          ?        ?   161.5460  21.0712          ?        ?      126.5        8.3       ?       ? 
1 1 1   26    7   70 o     44.0   16.6    0.0000   0.0000          ?        ?    15.3245  19.7942          ?        ?       44.0       16.6       ?       ? 
1 1 1   26    7   71 o    187.5    5.4    0.0000   0.0000          ?        ?   353.1024  20.4327          ?        ?      187.5        5.4       ?       ? 
1 1 1   26    7   72 o     42.3   16.6    0.0000   0.0000          ?        ?    12.1319  20.4327          ?        ?       42.3       16.6       ?       ? 
1 1 1   26    7   73 o    215.5    4.9    0.0000   0.0000          ?        ?   466.7593  21.0712          ?        ?      215.5        4.9       ?       ? 
1 1 1   26    8    0 o    134.6    5.0  181.9787  13.4090   181.9787  13.4090   181.9787  13.4090      134.6      5.0      134.6        5.0     0.0     0.0 
1 1 1   26    8    1 o   1393.6    4.7    0.0000   0.0000          ?        ? 19423.8281 132.1740          ?        ?     1393.6        4.7       ?       ? 
1 1 1   26    8    2 o    823.7    3.1    0.0000   0.0000          ?        ?  6785.5688  51.7203          ?        ?      823.7        3.1       ?       ? 
1 1 1   26    8    3 o   1488.5    5.0    0.0000   0.0000          ?        ? 22159.2539 148.1370          ?        ?     1488.5        5.0       ?       ? 
1 1 1   26    8    4 o   1070.4    3.8    0.0000   0.0000          ?        ? 11457.6318  80.4537          ?        ?     1070.4        3.8       ?       ? 
1 1 1   26    8    5 o   1259.1    4.3    0.0000   0.0000          ?        ? 15853.2148 109.1872          ?        ?     1259.1        4.3       ?       ? 
1 1 1   26    8    6 o   1314.2    4.5    0.0000   0.0000          ?        ? 17271.3711 117.4880          ?        ?     1314.2        4.5       ?       ? 
1 1 1   26    8    7 o   1113.8    3.9    0.0000   0.0000          ?        ? 12407.1133  86.2004          ?        ?     1113.8        3.9       ?       ? 
1 1 1   26    8    8 o    804.8    3.1    0.0000   0.0000          ?        ?  6477.8018  49.1662          ?        ?      804.8        3.1       ?       ? 
1 1 1   26    8    9 o   1481.3    5.1    0.0000   0.0000          ?        ? 21943.4355 150.0526          ?        ?     1481.3        5.1       ?       ? 
1 1 1   26    8   10 o    762.3    3.0    0.0000   0.0000          ?        ?  5810.5469  45.9736          ?        ?      762.3        3.0       ?       ? 
1 1 1   26    8   11 o    170.6    3.2    0.0000   0.0000          ?        ?   291.1659  10.8549          ?        ?      170.6        3.2       ?       ? 
1 1 1   26    8   12 o    171.4    3.4    0.0000   0.0000          ?        ?   293.7199  11.4934          ?        ?      171.4        3.4       ?       ? 
1 1 1   26    8   13 o    886.9    3.5    0.0000   0.0000          ?        ?  7865.9482  61.9366          ?        ?      886.9        3.5       ?       ? 
1 1 1   26    8   14 f    849.1    3.4    0.0000   0.0000          ?        ?  7209.5474  57.4669          ?        ?      849.1        3.4       ?       ? 
1 1 1   26    8   15 o    895.7    3.4    0.0000   0.0000          ?        ?  8022.3857  60.6596          ?        ?      895.7        3.4       ?       ? 
1 1 1   26    8   16 o   1204.0    4.5    0.0000   0.0000          ?        ? 14497.6338 107.2716          ?        ?     1204.0        4.5       ?       ? 
1 1 1   26    8   17 o   1945.9    6.7    0.0000   0.0000          ?        ? 37874.5508 259.2398          ?        ?     1945.9        6.7       ?       ? 
1 1 1   26    8   18 f    449.9    2.6    0.0000   0.0000          ?        ?  2024.1135  22.9868          ?        ?      449.9        2.6       ?       ? 
1 1 1   26    8   19 o     95.2    6.7    0.0000   0.0000          ?        ?    90.6701  12.7704          ?        ?       95.2        6.7       ?       ? 
1 1 1   26    8   20 o   1087.3    4.1    0.0000   0.0000          ?        ? 11822.8662  90.0316          ?        ?     1087.3        4.1       ?       ? 
1 1 1   26    8   21 o    626.6    2.9    0.0000   0.0000          ?        ?  3926.9080  36.3957          ?        ?      626.6        2.9       ?       ? 
1 1 1   26    8   22 o    779.6    3.3    0.0000   0.0000          ?        ?  6078.0874  51.0817          ?        ?      779.6        3.3       ?       ? 
1 1 1   26    8   23 o   2110.3    7.0    0.0000   0.0000          ?        ? 44543.9062 296.2740          ?        ?     2110.3        7.0       ?       ? 
1 1 1   26    8   24 o    854.4    3.3    0.0000   0.0000          ?        ?  7299.5791  56.8284          ?        ?      854.4        3.3       ?       ? 
1 1 1   26    8   25 f    965.5    3.7    0.0000   0.0000          ?        ?  9321.7773  71.5144          ?        ?      965.5        3.7       ?       ? 
1 1 1   26    8   26 o    790.9    3.1    0.0000   0.0000          ?        ?  6254.9575  49.1662          ?        ?      790.9        3.1       ?       ? 
1 1 1   26    8   27 o    193.8    4.3    0.0000   0.0000          ?        ?   375.4507  16.6016          ?        ?      193.8        4.3       ?       ? 
1 1 1   26    8   28 o    254.2    3.1    0.0000   0.0000          ?        ?   646.1838  15.9630          ?        ?      254.2        3.1       ?       ? 
1 1 1   26    8   29 o    613.7    2.8    0.0000   0.0000          ?        ?  3766.0005  33.8416          ?        ?      613.7        2.8       ?       ? 
1 1 1   26    8   30 o    269.3    3.0    0.0000   0.0000          ?        ?   725.3605  15.9630          ?        ?      269.3        3.0       ?       ? 
1 1 1   26    8   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    8   32 o    561.3    2.7    0.0000   0.0000          ?        ?  3150.4656  30.6490          ?        ?      561.3        2.7       ?       ? 
1 1 1   26    8   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    8   34 o    750.5    3.1    0.0000   0.0000          ?        ?  5633.6763  46.6121          ?        ?      750.5        3.1       ?       ? 
1 1 1   26    8   35 o    429.6    2.5    0.0000   0.0000          ?        ?  1845.3275  21.7097          ?        ?      429.6        2.5       ?       ? 
1 1 1   26    8   36 f    591.1    2.8    0.0000   0.0000          ?        ?  3494.6287  33.2031          ?        ?      591.1        2.8       ?       ? 
1 1 1   26    8   37 o    208.7    3.8    0.0000   0.0000          ?        ?   435.4717  15.9630          ?        ?      208.7        3.8       ?       ? 
1 1 1   26    8   38 o    228.4    3.6    0.0000   0.0000          ?        ?   521.6721  16.6016          ?        ?      228.4        3.6       ?       ? 
1 1 1   26    8   39 o    472.0    2.5    0.0000   0.0000          ?        ?  2227.8020  23.6253          ?        ?      472.0        2.5       ?       ? 
1 1 1   26    8   40 o     61.7   12.8    0.0000   0.0000          ?        ?    39.5883  15.3245          ?        ?       61.7       12.8       ?       ? 
1 1 1   26    8   41 o    211.1    4.1    0.0000   0.0000          ?        ?   445.6881  17.2401          ?        ?      211.1        4.1       ?       ? 
1 1 1   26    8   42 o    289.7    3.2    0.0000   0.0000          ?        ?   839.6559  18.5171          ?        ?      289.7        3.2       ?       ? 
1 1 1   26    8   43 o    132.9    6.5    0.0000   0.0000          ?        ?   176.8705  17.2401          ?        ?      132.9        6.5       ?       ? 
1 1 1   26    8   44 o    406.0    2.8    0.0000   0.0000          ?        ?  1648.6630  22.3483          ?        ?      406.0        2.8       ?       ? 
1 1 1   26    8   45 o    555.9    2.7    0.0000   0.0000          ?        ?  3091.0833  30.0105          ?        ?      555.9        2.7       ?       ? 
1 1 1   26    8   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    8   47 o    302.0    3.1    0.0000   0.0000          ?        ?   912.4474  18.5171          ?        ?      302.0        3.1       ?       ? 
1 1 1   26    8   48 o    108.9    7.3    0.0000   0.0000          ?        ?   118.7650  15.9630          ?        ?      108.9        7.3       ?       ? 
1 1 1   26    8   49 o    150.0    6.0    0.0000   0.0000          ?        ?   225.3981  17.8786          ?        ?      150.0        6.0       ?       ? 
1 1 1   26    8   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    8   51 o    461.5    2.8    0.0000   0.0000          ?        ?  2130.1082  25.5409          ?        ?      461.5        2.8       ?       ? 
1 1 1   26    8   52 o    154.8    5.8    0.0000   0.0000          ?        ?   240.0841  17.8786          ?        ?      154.8        5.8       ?       ? 
1 1 1   26    8   53 o    143.0    6.7    0.0000   0.0000          ?        ?   204.9654  19.1556          ?        ?      143.0        6.7       ?       ? 
1 1 1   26    8   54 o    309.2    3.4    0.0000   0.0000          ?        ?   956.5054  21.0712          ?        ?      309.2        3.4       ?       ? 
1 1 1   26    8   55 o    237.5    4.0    0.0000   0.0000          ?        ?   564.4531  19.1556          ?        ?      237.5        4.0       ?       ? 
1 1 1   26    8   56 o    503.9    2.9    0.0000   0.0000          ?        ?  2540.6775  28.7335          ?        ?      503.9        2.9       ?       ? 
1 1 1   26    8   57 o    161.1    5.7    0.0000   0.0000          ?        ?   259.8783  18.5171          ?        ?      161.1        5.7       ?       ? 
1 1 1   26    8   58 o    298.2    3.5    0.0000   0.0000          ?        ?   890.0991  21.0712          ?        ?      298.2        3.5       ?       ? 
1 1 1   26    8   59 o    172.5    5.7    0.0000   0.0000          ?        ?   298.1896  19.7942          ?        ?      172.5        5.7       ?       ? 
1 1 1   26    8   60 f     74.2   13.9    0.0000   0.0000          ?        ?    57.4669  19.7942          ?        ?       74.2       13.9       ?       ? 
1 1 1   26    8   61 o    439.0    2.8    0.0000   0.0000          ?        ?  1928.3353  24.9023          ?        ?      439.0        2.8       ?       ? 
1 1 1   26    8   62 f     81.0   12.2    0.0000   0.0000          ?        ?    66.4062  19.7942          ?        ?       81.0       12.2       ?       ? 
1 1 1   26    8   63 o     20.8   10.5    0.0000   0.0000          ?        ?   -65.7677  20.4327          ?        ?       20.8       10.5       ?       ? 
1 1 1   26    8   64 o    414.4    3.0    0.0000   0.0000          ?        ?  1718.9003  24.9023          ?        ?      414.4        3.0       ?       ? 
1 1 1   26    8   65 o    108.1   10.3    0.0000   0.0000          ?        ?   118.1265  22.3483          ?        ?      108.1       10.3       ?       ? 
1 1 1   26    8   66 o    240.5    4.6    0.0000   0.0000          ?        ?   579.7776  22.3483          ?        ?      240.5        4.6       ?       ? 
1 1 1   26    8   67 o    159.0    7.0    0.0000   0.0000          ?        ?   254.1316  22.3483          ?        ?      159.0        7.0       ?       ? 
1 1 1   26    8   68 o    347.1    3.5    0.0000   0.0000          ?        ?  1206.8059  24.2638          ?        ?      347.1        3.5       ?       ? 
1 1 1   26    8   69 o    229.9    4.9    0.0000   0.0000          ?        ?   529.9730  22.3483          ?        ?      229.9        4.9       ?       ? 
1 1 1   26    8   70 o     30.0   14.0    0.0000   0.0000          ?        ?   -17.8786  20.4327          ?        ?       30.0       14.0       ?       ? 
1 1 1   26    8   71 o    142.9    7.6    0.0000   0.0000          ?        ?   206.2425  21.7097          ?        ?      142.9        7.6       ?       ? 
1 1 1   26    8   72 o     24.1   11.9    0.0000   0.0000          ?        ?   -42.7809  20.4327          ?        ?       24.1       11.9       ?       ? 
1 1 1   26    8   73 o     62.1   16.3    0.0000   0.0000          ?        ?    42.1424  20.4327          ?        ?       62.1       16.3       ?       ? 
1 1 1   26    9    0 o    640.2    4.0 4099.3091  51.0817  4099.3091  51.0817  4099.3091  51.0817      640.2      4.0      640.2        4.0     0.0     0.0 
1 1 1   26    9    1 o   1137.3    3.9    0.0000   0.0000          ?        ? 12934.5322  89.3930          ?        ?     1137.3        3.9       ?       ? 
1 1 1   26    9    2 o    572.5    2.5    0.0000   0.0000          ?        ?  3277.5315  28.0950          ?        ?      572.5        2.5       ?       ? 
1 1 1   26    9    3 o    658.2    2.7    0.0000   0.0000          ?        ?  4333.0078  35.7572          ?        ?      658.2        2.7       ?       ? 
1 1 1   26    9    4 o   1380.9    4.7    0.0000   0.0000          ?        ? 19069.4492 128.9814          ?        ?     1380.9        4.7       ?       ? 
1 1 1   26    9    5 o    971.5    3.7    0.0000   0.0000          ?        ?  9437.9883  72.7915          ?        ?      971.5        3.7       ?       ? 
1 1 1   26    9    6 o   1005.9    3.6    0.0000   0.0000          ?        ? 10118.6523  72.7915          ?        ?     1005.9        3.6       ?       ? 
1 1 1   26    9    7 o    464.8    2.2    0.0000   0.0000          ?        ?  2160.7571  20.4327          ?        ?      464.8        2.2       ?       ? 
1 1 1   26    9    8 o    320.4    2.1    0.0000   0.0000          ?        ?  1026.7428  13.4090          ?        ?      320.4        2.1       ?       ? 
1 1 1   26    9    9 o    910.4    3.3    0.0000   0.0000          ?        ?  8288.6494  60.0210          ?        ?      910.4        3.3       ?       ? 
1 1 1   26    9   10 o   1157.8    4.1    0.0000   0.0000          ?        ? 13406.4004  95.1397          ?        ?     1157.8        4.1       ?       ? 
1 1 1   26    9   11 o   1125.2    4.0    0.0000   0.0000          ?        ? 12662.5225  90.0316          ?        ?     1125.2        4.0       ?       ? 
1 1 1   26    9   12 o    923.3    3.4    0.0000   0.0000          ?        ?  8524.9023  62.5751          ?        ?      923.3        3.4       ?       ? 
1 1 1   26    9   13 o   1041.1    3.8    0.0000   0.0000          ?        ? 10838.9043  79.8152          ?        ?     1041.1        3.8       ?       ? 
1 1 1   26    9   14 o    257.6    2.9    0.0000   0.0000          ?        ?   663.4240  14.6860          ?        ?      257.6        2.9       ?       ? 
1 1 1   26    9   15 o   1696.1    5.9    0.0000   0.0000          ?        ? 28772.4238 198.5802          ?        ?     1696.1        5.9       ?       ? 
1 1 1   26    9   16 o   2156.0    7.7    0.0000   0.0000          ?        ? 46497.1445 332.0312          ?        ?     2156.0        7.7       ?       ? 
1 1 1   26    9   17 o   1459.1    5.0    0.0000   0.0000          ?        ? 21292.7812 145.5829          ?        ?     1459.1        5.0       ?       ? 
1 1 1   26    9   18 o    290.1    2.5    0.0000   0.0000          ?        ?   841.5715  14.6860          ?        ?      290.1        2.5       ?       ? 
1 1 1   26    9   19 o   1133.2    4.5    0.0000   0.0000          ?        ? 12841.9463 102.8020          ?        ?     1133.2        4.5       ?       ? 
1 1 1   26    9   20 o    824.5    3.3    0.0000   0.0000          ?        ?  6798.3394  53.6358          ?        ?      824.5        3.3       ?       ? 
1 1 1   26    9   21 o    307.9    3.1    0.0000   0.0000          ?        ?   948.2046  19.1556          ?        ?      307.9        3.1       ?       ? 
1 1 1   26    9   22 o    647.7    2.8    0.0000   0.0000          ?        ?  4195.0869  35.7572          ?        ?      647.7        2.8       ?       ? 
1 1 1   26    9   23 o   1652.2    5.8    0.0000   0.0000          ?        ? 27301.9062 190.2794          ?        ?     1652.2        5.8       ?       ? 
1 1 1   26    9   24 o   1940.4    6.5    0.0000   0.0000          ?        ? 37658.7266 252.8546          ?        ?     1940.4        6.5       ?       ? 
1 1 1   26    9   25 o    944.3    3.6    0.0000   0.0000          ?        ?  8918.2314  68.3218          ?        ?      944.3        3.6       ?       ? 
1 1 1   26    9   26 o    515.6    2.5    0.0000   0.0000          ?        ?  2658.1655  26.1794          ?        ?      515.6        2.5       ?       ? 
1 1 1   26    9   27 o    505.5    2.7    0.0000   0.0000          ?        ?  2555.3635  26.8179          ?        ?      505.5        2.7       ?       ? 
1 1 1   26    9   28 o   1168.5    4.1    0.0000   0.0000          ?        ? 13654.7852  95.7782          ?        ?     1168.5        4.1       ?       ? 
1 1 1   26    9   29 o    319.2    2.6    0.0000   0.0000          ?        ?  1019.0806  16.6016          ?        ?      319.2        2.6       ?       ? 
1 1 1   26    9   30 o    616.7    2.7    0.0000   0.0000          ?        ?  3803.0347  33.8416          ?        ?      616.7        2.7       ?       ? 
1 1 1   26    9   31 o    360.9    2.7    0.0000   0.0000          ?        ?  1302.5841  19.7942          ?        ?      360.9        2.7       ?       ? 
1 1 1   26    9   32 o    193.3    4.0    0.0000   0.0000          ?        ?   373.5352  15.3245          ?        ?      193.3        4.0       ?       ? 
1 1 1   26    9   33 o    307.6    2.8    0.0000   0.0000          ?        ?   946.2890  17.2401          ?        ?      307.6        2.8       ?       ? 
1 1 1   26    9   34 o    709.7    2.9    0.0000   0.0000          ?        ?  5036.6587  41.5039          ?        ?      709.7        2.9       ?       ? 
1 1 1   26    9   35 o    400.7    2.5    0.0000   0.0000          ?        ?  1605.8818  20.4327          ?        ?      400.7        2.5       ?       ? 
1 1 1   26    9   36 o    401.7    2.5    0.0000   0.0000          ?        ?  1613.5442  20.4327          ?        ?      401.7        2.5       ?       ? 
1 1 1   26    9   37 o    176.9    4.3    0.0000   0.0000          ?        ?   312.8756  15.3245          ?        ?      176.9        4.3       ?       ? 
1 1 1   26    9   38 o     23.7   11.2    0.0000   0.0000          ?        ?   -16.6016  14.0475          ?        ?       23.7       11.2       ?       ? 
1 1 1   26    9   39 o    194.2    3.9    0.0000   0.0000          ?        ?   377.3663  15.3245          ?        ?      194.2        3.9       ?       ? 
1 1 1   26    9   40 o    148.4    5.2    0.0000   0.0000          ?        ?   220.2900  15.3245          ?        ?      148.4        5.2       ?       ? 
1 1 1   26    9   41 o    113.8    7.0    0.0000   0.0000          ?        ?   129.6199  15.9630          ?        ?      113.8        7.0       ?       ? 
1 1 1   26    9   42 o    264.6    3.4    0.0000   0.0000          ?        ?   700.4582  17.8786          ?        ?      264.6        3.4       ?       ? 
1 1 1   26    9   43 o    205.4    4.2    0.0000   0.0000          ?        ?   422.0628  17.2401          ?        ?      205.4        4.2       ?       ? 
1 1 1   26    9   44 o    341.1    2.8    0.0000   0.0000          ?        ?  1164.0249  19.1556          ?        ?      341.1        2.8       ?       ? 
1 1 1   26    9   45 o    114.6    7.2    0.0000   0.0000          ?        ?   131.5355  16.6016          ?        ?      114.6        7.2       ?       ? 
1 1 1   26    9   46 o    270.2    3.4    0.0000   0.0000          ?        ?   730.4688  18.5171          ?        ?      270.2        3.4       ?       ? 
1 1 1   26    9   47 o    411.8    2.6    0.0000   0.0000          ?        ?  1695.9135  21.7097          ?        ?      411.8        2.6       ?       ? 
1 1 1   26    9   48 o     22.3   10.9    0.0000   0.0000          ?        ?   -30.0105  15.9630          ?        ?       22.3       10.9       ?       ? 
1 1 1   26    9   49 o    330.1    3.0    0.0000   0.0000          ?        ?  1089.9564  19.7942          ?        ?      330.1        3.0       ?       ? 
1 1 1   26    9   50 o    471.8    2.7    0.0000   0.0000          ?        ?  2226.5249  25.5409          ?        ?      471.8        2.7       ?       ? 
1 1 1   26    9   51 o     87.0    9.5    0.0000   0.0000          ?        ?    75.9841  16.6016          ?        ?       87.0        9.5       ?       ? 
1 1 1   26    9   52 o    332.5    3.0    0.0000   0.0000          ?        ?  1105.9194  19.7942          ?        ?      332.5        3.0       ?       ? 
1 1 1   26    9   53 o    246.1    3.9    0.0000   0.0000          ?        ?   605.9570  19.1556          ?        ?      246.1        3.9       ?       ? 
1 1 1   26    9   54 o     47.9   15.7    0.0000   0.0000          ?        ?    22.3483  17.2401          ?        ?       47.9       15.7       ?       ? 
1 1 1   26    9   55 o    345.8    2.8    0.0000   0.0000          ?        ?  1195.9510  19.1556          ?        ?      345.8        2.8       ?       ? 
1 1 1   26    9   56 o    140.5    6.4    0.0000   0.0000          ?        ?   197.9417  17.8786          ?        ?      140.5        6.4       ?       ? 
1 1 1   26    9   57 f    362.1    3.0    0.0000   0.0000          ?        ?  1312.1620  21.7097          ?        ?      362.1        3.0       ?       ? 
1 1 1   26    9   58 o    251.9    3.9    0.0000   0.0000          ?        ?   635.3290  19.7942          ?        ?      251.9        3.9       ?       ? 
1 1 1   26    9   59 o    356.9    3.0    0.0000   0.0000          ?        ?  1274.4893  21.7097          ?        ?      356.9        3.0       ?       ? 
1 1 1   26    9   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26    9   61 o    103.6    9.2    0.0000   0.0000          ?        ?   107.9102  19.1556          ?        ?      103.6        9.2       ?       ? 
1 1 1   26    9   62 o    218.4    4.5    0.0000   0.0000          ?        ?   477.6142  19.7942          ?        ?      218.4        4.5       ?       ? 
1 1 1   26    9   63 o     54.1   16.7    0.0000   0.0000          ?        ?    30.0105  19.7942          ?        ?       54.1       16.7       ?       ? 
1 1 1   26    9   64 o     25.8   12.5    0.0000   0.0000          ?        ?   -35.1187  20.4327          ?        ?       25.8       12.5       ?       ? 
1 1 1   26    9   65 o     57.8   16.7    0.0000   0.0000          ?        ?    35.1187  20.4327          ?        ?       57.8       16.7       ?       ? 
1 1 1   26    9   66 f    170.8    6.5    0.0000   0.0000          ?        ?   293.0815  22.3483          ?        ?      170.8        6.5       ?       ? 
1 1 1   26    9   67 o    103.2   10.8    0.0000   0.0000          ?        ?   107.9102  22.3483          ?        ?      103.2       10.8       ?       ? 
1 1 1   26    9   68 o    139.9    7.8    0.0000   0.0000          ?        ?   197.3032  21.7097          ?        ?      139.9        7.8       ?       ? 
1 1 1   26    9   69 o     31.8   14.6    0.0000   0.0000          ?        ?   -14.0475  21.0712          ?        ?       31.8       14.6       ?       ? 
1 1 1   26    9   70 o     47.8   17.0    0.0000   0.0000          ?        ?    21.0712  20.4327          ?        ?       47.8       17.0       ?       ? 
1 1 1   26    9   71 o     60.5   16.8    0.0000   0.0000          ?        ?    39.5883  21.0712          ?        ?       60.5       16.8       ?       ? 
1 1 1   26    9   72 o     39.1   16.0    0.0000   0.0000          ?        ?     7.0237  19.7942          ?        ?       39.1       16.0       ?       ? 
1 1 1   26   10    0 o    550.7    3.5 3032.9778  38.9498  3032.9778  38.9498  3032.9778  38.9498      550.7      3.5      550.7        3.5     0.0     0.0 
1 1 1   26   10    1 o   1531.0    5.1    0.0000   0.0000          ?        ? 23442.6816 157.0763          ?        ?     1531.0        5.1       ?       ? 
1 1 1   26   10    2 o   1354.5    4.7    0.0000   0.0000          ?        ? 18348.5586 127.0658          ?        ?     1354.5        4.7       ?       ? 
1 1 1   26   10    3 o   1281.8    4.5    0.0000   0.0000          ?        ? 16430.4375 114.2954          ?        ?     1281.8        4.5       ?       ? 
1 1 1   26   10    4 o    778.5    3.0    0.0000   0.0000          ?        ?  6060.2085  45.9736          ?        ?      778.5        3.0       ?       ? 
1 1 1   26   10    5 o    473.9    2.3    0.0000   0.0000          ?        ?  2245.6807  21.7097          ?        ?      473.9        2.3       ?       ? 
1 1 1   26   10    6 o    665.4    2.7    0.0000   0.0000          ?        ?  4428.1475  36.3957          ?        ?      665.4        2.7       ?       ? 
1 1 1   26   10    7 o     66.4    9.1    0.0000   0.0000          ?        ?    44.0580  12.1319          ?        ?       66.4        9.1       ?       ? 
1 1 1   26   10    8 o   1639.5    5.6    0.0000   0.0000          ?        ? 26883.6738 183.2557          ?        ?     1639.5        5.6       ?       ? 
1 1 1   26   10    9 o    319.5    2.4    0.0000   0.0000          ?        ?  1020.9960  15.3245          ?        ?      319.5        2.4       ?       ? 
1 1 1   26   10   10 o    531.3    2.8    0.0000   0.0000          ?        ?  2822.9041  29.3720          ?        ?      531.3        2.8       ?       ? 
1 1 1   26   10   11 o   2217.5    7.4    0.0000   0.0000          ?        ? 49184.6836 326.9231          ?        ?     2217.5        7.4       ?       ? 
1 1 1   26   10   12 o    795.2    3.1    0.0000   0.0000          ?        ?  6323.9185  48.5276          ?        ?      795.2        3.1       ?       ? 
1 1 1   26   10   13 o    748.6    3.0    0.0000   0.0000          ?        ?  5604.3042  44.6965          ?        ?      748.6        3.0       ?       ? 
1 1 1   26   10   14 o    685.3    3.3    0.0000   0.0000          ?        ?  4696.3267  44.6965          ?        ?      685.3        3.3       ?       ? 
1 1 1   26   10   15 o   2699.5   10.0    0.0000   0.0000          ?        ? 72904.4844 541.4664          ?        ?     2699.5       10.0       ?       ? 
1 1 1   26   10   16 o    734.2    3.1    0.0000   0.0000          ?        ?  5390.3994  45.9736          ?        ?      734.2        3.1       ?       ? 
1 1 1   26   10   17 f    690.7    3.1    0.0000   0.0000          ?        ?  4771.0337  42.7809          ?        ?      690.7        3.1       ?       ? 
1 1 1   26   10   18 o    667.9    3.0    0.0000   0.0000          ?        ?  4461.3506  40.2269          ?        ?      667.9        3.0       ?       ? 
1 1 1   26   10   19 o    839.9    3.3    0.0000   0.0000          ?        ?  7054.3872  54.9129          ?        ?      839.9        3.3       ?       ? 
1 1 1   26   10   20 o    855.7    3.3    0.0000   0.0000          ?        ?  7323.2046  56.8284          ?        ?      855.7        3.3       ?       ? 
1 1 1   26   10   21 o   1441.8    5.2    0.0000   0.0000          ?        ? 20792.1797 149.4141          ?        ?     1441.8        5.2       ?       ? 
1 1 1   26   10   22 o   1255.8    4.6    0.0000   0.0000          ?        ? 15770.8447 114.9339          ?        ?     1255.8        4.6       ?       ? 
1 1 1   26   10   23 o    432.7    2.8    0.0000   0.0000          ?        ?  1872.1455  24.2638          ?        ?      432.7        2.8       ?       ? 
1 1 1   26   10   24 o    959.4    3.6    0.0000   0.0000          ?        ?  9204.9277  68.3218          ?        ?      959.4        3.6       ?       ? 
1 1 1   26   10   25 o   1750.2    6.0    0.0000   0.0000          ?        ? 30640.0996 211.3506          ?        ?     1750.2        6.0       ?       ? 
1 1 1   26   10   26 o     44.5   14.4    0.0000   0.0000          ?        ?    19.1556  14.6860          ?        ?       44.5       14.4       ?       ? 
1 1 1   26   10   27 o    219.6    4.2    0.0000   0.0000          ?        ?   482.0838  18.5171          ?        ?      219.6        4.2       ?       ? 
1 1 1   26   10   28 o    503.8    2.6    0.0000   0.0000          ?        ?  2538.7620  26.1794          ?        ?      503.8        2.6       ?       ? 
1 1 1   26   10   29 o    795.4    3.2    0.0000   0.0000          ?        ?  6327.7495  51.0817          ?        ?      795.4        3.2       ?       ? 
1 1 1   26   10   30 o    448.4    2.6    0.0000   0.0000          ?        ?  2010.7046  22.9868          ?        ?      448.4        2.6       ?       ? 
1 1 1   26   10   31 o    659.2    2.9    0.0000   0.0000          ?        ?  4345.7778  38.3113          ?        ?      659.2        2.9       ?       ? 
1 1 1   26   10   32 o    762.5    3.0    0.0000   0.0000          ?        ?  5815.0166  45.3350          ?        ?      762.5        3.0       ?       ? 
1 1 1   26   10   33 o    627.4    2.7    0.0000   0.0000          ?        ?  3937.1243  33.8416          ?        ?      627.4        2.7       ?       ? 
1 1 1   26   10   34 o    603.7    2.8    0.0000   0.0000          ?        ?  3644.6814  33.2031          ?        ?      603.7        2.8       ?       ? 
1 1 1   26   10   35 o    302.1    2.9    0.0000   0.0000          ?        ?   912.4474  17.2401          ?        ?      302.1        2.9       ?       ? 
1 1 1   26   10   36 o    579.5    2.6    0.0000   0.0000          ?        ?  3357.9854  30.6490          ?        ?      579.5        2.6       ?       ? 
1 1 1   26   10   37 o    275.4    3.0    0.0000   0.0000          ?        ?   758.5637  16.6016          ?        ?      275.4        3.0       ?       ? 
1 1 1   26   10   38 o    523.5    2.5    0.0000   0.0000          ?        ?  2740.5349  26.1794          ?        ?      523.5        2.5       ?       ? 
1 1 1   26   10   39 o    334.0    2.9    0.0000   0.0000          ?        ?  1115.4973  19.1556          ?        ?      334.0        2.9       ?       ? 
1 1 1   26   10   40 o    446.0    2.5    0.0000   0.0000          ?        ?  1988.9949  22.3483          ?        ?      446.0        2.5       ?       ? 
1 1 1   26   10   41 o    217.2    3.8    0.0000   0.0000          ?        ?   471.8675  16.6016          ?        ?      217.2        3.8       ?       ? 
1 1 1   26   10   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   10   43 o    157.1    4.9    0.0000   0.0000          ?        ?   247.1079  15.3245          ?        ?      157.1        4.9       ?       ? 
1 1 1   26   10   44 o    258.5    3.5    0.0000   0.0000          ?        ?   668.5321  17.8786          ?        ?      258.5        3.5       ?       ? 
1 1 1   26   10   45 o    430.1    2.5    0.0000   0.0000          ?        ?  1850.4355  21.7097          ?        ?      430.1        2.5       ?       ? 
1 1 1   26   10   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   10   47 o    177.7    4.5    0.0000   0.0000          ?        ?   316.0682  15.9630          ?        ?      177.7        4.5       ?       ? 
1 1 1   26   10   48 o    122.4    6.8    0.0000   0.0000          ?        ?   150.0526  16.6016          ?        ?      122.4        6.8       ?       ? 
1 1 1   26   10   49 o    351.3    3.0    0.0000   0.0000          ?        ?  1234.2623  21.0712          ?        ?      351.3        3.0       ?       ? 
1 1 1   26   10   50 o    243.8    3.7    0.0000   0.0000          ?        ?   594.4636  17.8786          ?        ?      243.8        3.7       ?       ? 
1 1 1   26   10   51 o    298.0    3.2    0.0000   0.0000          ?        ?   888.1836  19.1556          ?        ?      298.0        3.2       ?       ? 
1 1 1   26   10   52 o    503.1    2.7    0.0000   0.0000          ?        ?  2532.3767  27.4564          ?        ?      503.1        2.7       ?       ? 
1 1 1   26   10   53 o    100.9    8.5    0.0000   0.0000          ?        ?   102.1635  17.2401          ?        ?      100.9        8.5       ?       ? 
1 1 1   26   10   54 o     24.0   11.6    0.0000   0.0000          ?        ?   -28.7335  17.2401          ?        ?       24.0       11.6       ?       ? 
1 1 1   26   10   55 f     19.5    9.8    0.0000   0.0000          ?        ?   -52.9973  17.2401          ?        ?       19.5        9.8       ?       ? 
1 1 1   26   10   56 o    294.2    3.4    0.0000   0.0000          ?        ?   865.8354  19.7942          ?        ?      294.2        3.4       ?       ? 
1 1 1   26   10   57 o    285.6    3.5    0.0000   0.0000          ?        ?   816.0306  19.7942          ?        ?      285.6        3.5       ?       ? 
1 1 1   26   10   58 o     25.3   12.2    0.0000   0.0000          ?        ?   -28.7335  18.5171          ?        ?       25.3       12.2       ?       ? 
1 1 1   26   10   59 o    149.3    6.6    0.0000   0.0000          ?        ?   223.4826  19.7942          ?        ?      149.3        6.6       ?       ? 
1 1 1   26   10   60 o    255.3    4.0    0.0000   0.0000          ?        ?   652.5691  20.4327          ?        ?      255.3        4.0       ?       ? 
1 1 1   26   10   61 o     47.1   16.7    0.0000   0.0000          ?        ?    19.7942  19.7942          ?        ?       47.1       16.7       ?       ? 
1 1 1   26   10   62 o    107.1    9.2    0.0000   0.0000          ?        ?   115.5724  19.7942          ?        ?      107.1        9.2       ?       ? 
1 1 1   26   10   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   10   64 o    114.0    9.2    0.0000   0.0000          ?        ?   130.8969  21.0712          ?        ?      114.0        9.2       ?       ? 
1 1 1   26   10   65 o    192.6    5.5    0.0000   0.0000          ?        ?   372.2581  21.0712          ?        ?      192.6        5.5       ?       ? 
1 1 1   26   10   66 o    181.0    5.8    0.0000   0.0000          ?        ?   328.8386  21.0712          ?        ?      181.0        5.8       ?       ? 
1 1 1   26   10   67 o     38.3   16.1    0.0000   0.0000          ?        ?     2.5541  21.0712          ?        ?       38.3       16.1       ?       ? 
1 1 1   26   10   68 o     87.0   12.5    0.0000   0.0000          ?        ?    77.2611  21.7097          ?        ?       87.0       12.5       ?       ? 
1 1 1   26   10   69 o    196.4    5.5    0.0000   0.0000          ?        ?   387.5826  21.7097          ?        ?      196.4        5.5       ?       ? 
1 1 1   26   10   70 o    127.2    8.0    0.0000   0.0000          ?        ?   163.4615  20.4327          ?        ?      127.2        8.0       ?       ? 
1 1 1   26   10   71 o    115.0    8.6    0.0000   0.0000          ?        ?   134.0895  19.7942          ?        ?      115.0        8.6       ?       ? 
1 1 1   26   10   72 o     50.3   17.0    0.0000   0.0000          ?        ?    25.5409  20.4327          ?        ?       50.3       17.0       ?       ? 
1 1 1   26   11    0 o     81.9    9.2   69.5989  14.6860    69.5989  14.6860    69.5989  14.6860       81.9      9.2       81.9        9.2     0.0     0.0 
1 1 1   26   11    1 o    510.1    2.6    0.0000   0.0000          ?        ?  2601.9756  26.1794          ?        ?      510.1        2.6       ?       ? 
1 1 1   26   11    2 o    940.7    3.6    0.0000   0.0000          ?        ?  8849.9102  68.3218          ?        ?      940.7        3.6       ?       ? 
1 1 1   26   11    3 f    881.1    3.4    0.0000   0.0000          ?        ?  7763.7847  60.0210          ?        ?      881.1        3.4       ?       ? 
1 1 1   26   11    4 o    284.8    2.7    0.0000   0.0000          ?        ?   810.9225  15.3245          ?        ?      284.8        2.7       ?       ? 
1 1 1   26   11    5 o    860.5    3.3    0.0000   0.0000          ?        ?  7404.2964  57.4669          ?        ?      860.5        3.3       ?       ? 
1 1 1   26   11    6 o   1799.2    6.0    0.0000   0.0000          ?        ? 32374.9609 214.5433          ?        ?     1799.2        6.0       ?       ? 
1 1 1   26   11    7 o    932.9    3.5    0.0000   0.0000          ?        ?  8704.3262  65.1292          ?        ?      932.9        3.5       ?       ? 
1 1 1   26   11    8 f   1584.4    5.5    0.0000   0.0000          ?        ? 25105.3945 174.3164          ?        ?     1584.4        5.5       ?       ? 
1 1 1   26   11    9 o    240.0    2.3    0.0000   0.0000          ?        ?   575.9465  10.8549          ?        ?      240.0        2.3       ?       ? 
1 1 1   26   11   10 o    499.2    2.4    0.0000   0.0000          ?        ?  2492.1499  24.2638          ?        ?      499.2        2.4       ?       ? 
1 1 1   26   11   11 o     16.4    8.3    0.0000   0.0000          ?        ?   -46.6121  13.4090          ?        ?       16.4        8.3       ?       ? 
1 1 1   26   11   12 o    397.0    2.3    0.0000   0.0000          ?        ?  1576.5099  18.5171          ?        ?      397.0        2.3       ?       ? 
1 1 1   26   11   13 o    338.4    2.5    0.0000   0.0000          ?        ?  1144.8693  17.2401          ?        ?      338.4        2.5       ?       ? 
1 1 1   26   11   14 o   1040.1    4.1    0.0000   0.0000          ?        ? 10819.7490  86.2004          ?        ?     1040.1        4.1       ?       ? 
1 1 1   26   11   15 o   1127.0    4.3    0.0000   0.0000          ?        ? 12702.7490  97.6938          ?        ?     1127.0        4.3       ?       ? 
1 1 1   26   11   16 f    881.8    3.6    0.0000   0.0000          ?        ?  7776.5552  63.8522          ?        ?      881.8        3.6       ?       ? 
1 1 1   26   11   17 o    640.2    2.7    0.0000   0.0000          ?        ?  4098.6704  34.4802          ?        ?      640.2        2.7       ?       ? 
1 1 1   26   11   18 o   1410.1    5.1    0.0000   0.0000          ?        ? 19885.4785 143.0288          ?        ?     1410.1        5.1       ?       ? 
1 1 1   26   11   19 o    439.9    2.8    0.0000   0.0000          ?        ?  1935.3591  24.2638          ?        ?      439.9        2.8       ?       ? 
1 1 1   26   11   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   11   21 o    559.5    3.0    0.0000   0.0000          ?        ?  3130.0332  33.2031          ?        ?      559.5        3.0       ?       ? 
1 1 1   26   11   22 o   1716.6    6.0    0.0000   0.0000          ?        ? 29471.6055 204.3269          ?        ?     1716.6        6.0       ?       ? 
1 1 1   26   11   23 o    684.4    2.9    0.0000   0.0000          ?        ?  4684.8330  39.5883          ?        ?      684.4        2.9       ?       ? 
1 1 1   26   11   24 o    940.2    3.5    0.0000   0.0000          ?        ?  8840.9707  66.4062          ?        ?      940.2        3.5       ?       ? 
1 1 1   26   11   25 o   1690.7    6.0    0.0000   0.0000          ?        ? 28590.4453 203.6884          ?        ?     1690.7        6.0       ?       ? 
1 1 1   26   11   26 o    380.5    2.7    0.0000   0.0000          ?        ?  1448.1671  20.4327          ?        ?      380.5        2.7       ?       ? 
1 1 1   26   11   27 o    236.4    3.4    0.0000   0.0000          ?        ?   558.7064  15.9630          ?        ?      236.4        3.4       ?       ? 
1 1 1   26   11   28 o    128.3    7.5    0.0000   0.0000          ?        ?   164.7386  19.1556          ?        ?      128.3        7.5       ?       ? 
1 1 1   26   11   29 o    684.4    3.0    0.0000   0.0000          ?        ?  4684.8330  40.8654          ?        ?      684.4        3.0       ?       ? 
1 1 1   26   11   30 o    339.0    2.8    0.0000   0.0000          ?        ?  1149.3389  19.1556          ?        ?      339.0        2.8       ?       ? 
1 1 1   26   11   31 o    618.8    2.8    0.0000   0.0000          ?        ?  3829.2144  34.4802          ?        ?      618.8        2.8       ?       ? 
1 1 1   26   11   32 o     48.1   15.0    0.0000   0.0000          ?        ?    22.9868  15.9630          ?        ?       48.1       15.0       ?       ? 
1 1 1   26   11   33 o    521.1    2.5    0.0000   0.0000          ?        ?  2715.6323  26.1794          ?        ?      521.1        2.5       ?       ? 
1 1 1   26   11   34 o    280.3    3.1    0.0000   0.0000          ?        ?   786.0201  17.2401          ?        ?      280.3        3.1       ?       ? 
1 1 1   26   11   35 o    203.9    3.6    0.0000   0.0000          ?        ?   415.6776  14.6860          ?        ?      203.9        3.6       ?       ? 
1 1 1   26   11   36 o     54.8   13.9    0.0000   0.0000          ?        ?    31.2876  15.3245          ?        ?       54.8       13.9       ?       ? 
1 1 1   26   11   37 o    771.2    3.2    0.0000   0.0000          ?        ?  5947.8291  49.1662          ?        ?      771.2        3.2       ?       ? 
1 1 1   26   11   38 o    229.5    3.6    0.0000   0.0000          ?        ?   526.7803  16.6016          ?        ?      229.5        3.6       ?       ? 
1 1 1   26   11   39 o     22.9   11.0    0.0000   0.0000          ?        ?   -21.7097  14.6860          ?        ?       22.9       11.0       ?       ? 
1 1 1   26   11   40 o    271.9    3.1    0.0000   0.0000          ?        ?   739.4081  16.6016          ?        ?      271.9        3.1       ?       ? 
1 1 1   26   11   41 o    116.0    6.6    0.0000   0.0000          ?        ?   134.7281  15.3245          ?        ?      116.0        6.6       ?       ? 
1 1 1   26   11   42 o    200.8    4.0    0.0000   0.0000          ?        ?   403.5457  15.9630          ?        ?      200.8        4.0       ?       ? 
1 1 1   26   11   43 o    270.0    3.2    0.0000   0.0000          ?        ?   729.1917  17.2401          ?        ?      270.0        3.2       ?       ? 
1 1 1   26   11   44 f    363.3    2.8    0.0000   0.0000          ?        ?  1319.8242  20.4327          ?        ?      363.3        2.8       ?       ? 
1 1 1   26   11   45 o     23.5   11.4    0.0000   0.0000          ?        ?   -28.0950  16.6016          ?        ?       23.5       11.4       ?       ? 
1 1 1   26   11   46 o    283.8    3.4    0.0000   0.0000          ?        ?   805.8143  19.1556          ?        ?      283.8        3.4       ?       ? 
1 1 1   26   11   47 o    418.5    2.7    0.0000   0.0000          ?        ?  1751.4647  22.9868          ?        ?      418.5        2.7       ?       ? 
1 1 1   26   11   48 o     91.0    9.1    0.0000   0.0000          ?        ?    83.0078  16.6016          ?        ?       91.0        9.1       ?       ? 
1 1 1   26   11   49 o     61.0   14.4    0.0000   0.0000          ?        ?    38.9498  17.2401          ?        ?       61.0       14.4       ?       ? 
1 1 1   26   11   50 o     36.0   14.8    0.0000   0.0000          ?        ?     3.8311  17.2401          ?        ?       36.0       14.8       ?       ? 
1 1 1   26   11   51 o    483.9    2.6    0.0000   0.0000          ?        ?  2342.7358  25.5409          ?        ?      483.9        2.6       ?       ? 
1 1 1   26   11   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   11   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   11   54 o     84.7   10.2    0.0000   0.0000          ?        ?    72.1529  17.2401          ?        ?       84.7       10.2       ?       ? 
1 1 1   26   11   55 o    150.4    5.9    0.0000   0.0000          ?        ?   226.6752  17.8786          ?        ?      150.4        5.9       ?       ? 
1 1 1   26   11   56 o    117.0    7.6    0.0000   0.0000          ?        ?   137.2822  17.8786          ?        ?      117.0        7.6       ?       ? 
1 1 1   26   11   57 o     45.7   16.2    0.0000   0.0000          ?        ?    18.5171  18.5171          ?        ?       45.7       16.2       ?       ? 
1 1 1   26   11   58 o    317.2    3.3    0.0000   0.0000          ?        ?  1006.9486  21.0712          ?        ?      317.2        3.3       ?       ? 
1 1 1   26   11   59 o    106.6    9.3    0.0000   0.0000          ?        ?   114.2954  19.7942          ?        ?      106.6        9.3       ?       ? 
1 1 1   26   11   60 f    116.3    8.2    0.0000   0.0000          ?        ?   136.0051  19.1556          ?        ?      116.3        8.2       ?       ? 
1 1 1   26   11   61 o     21.0   10.6    0.0000   0.0000          ?        ?   -59.3825  19.7942          ?        ?       21.0       10.6       ?       ? 
1 1 1   26   11   62 o    369.7    3.0    0.0000   0.0000          ?        ?  1367.7133  22.3483          ?        ?      369.7        3.0       ?       ? 
1 1 1   26   11   63 o     20.8   10.5    0.0000   0.0000          ?        ?   -60.6596  19.7942          ?        ?       20.8       10.5       ?       ? 
1 1 1   26   11   64 o    340.1    3.3    0.0000   0.0000          ?        ?  1157.6398  22.3483          ?        ?      340.1        3.3       ?       ? 
1 1 1   26   11   65 o     29.4   13.8    0.0000   0.0000          ?        ?   -22.3483  21.0712          ?        ?       29.4       13.8       ?       ? 
1 1 1   26   11   66 o    330.6    3.6    0.0000   0.0000          ?        ?  1094.4260  23.6253          ?        ?      330.6        3.6       ?       ? 
1 1 1   26   11   67 o    174.6    6.4    0.0000   0.0000          ?        ?   306.4904  22.3483          ?        ?      174.6        6.4       ?       ? 
1 1 1   26   11   68 o    215.3    5.2    0.0000   0.0000          ?        ?   465.4823  22.3483          ?        ?      215.3        5.2       ?       ? 
1 1 1   26   11   69 o     70.0   14.6    0.0000   0.0000          ?        ?    52.3588  19.7942          ?        ?       70.0       14.6       ?       ? 
1 1 1   26   11   70 o    149.5    6.8    0.0000   0.0000          ?        ?   225.3981  20.4327          ?        ?      149.5        6.8       ?       ? 
1 1 1   26   11   71 o     59.9   16.5    0.0000   0.0000          ?        ?    38.9498  20.4327          ?        ?       59.9       16.5       ?       ? 
1 1 1   26   12    0 o    300.8    6.7  906.0621  40.2269   906.0621  40.2269   906.0621  40.2269      300.8      6.7      300.8        6.7     0.0     0.0 
1 1 1   26   12    1 f   1744.8    6.5    0.0000   0.0000          ?        ? 30447.2637 226.6752          ?        ?     1744.8        6.5       ?       ? 
1 1 1   26   12    2 o    126.3    3.5    0.0000   0.0000          ?        ?   159.6304   8.9393          ?        ?      126.3        3.5       ?       ? 
1 1 1   26   12    3 o    474.8    2.5    0.0000   0.0000          ?        ?  2253.9814  23.6253          ?        ?      474.8        2.5       ?       ? 
1 1 1   26   12    4 o   1508.9    5.5    0.0000   0.0000          ?        ? 22770.3203 167.2927          ?        ?     1508.9        5.5       ?       ? 
1 1 1   26   12    5 o   1466.6    5.2    0.0000   0.0000          ?        ? 21511.7930 152.6067          ?        ?     1466.6        5.2       ?       ? 
1 1 1   26   12    6 o    445.6    2.4    0.0000   0.0000          ?        ?  1985.8022  21.7097          ?        ?      445.6        2.4       ?       ? 
1 1 1   26   12    7 o    648.2    2.8    0.0000   0.0000          ?        ?  4202.1108  36.3957          ?        ?      648.2        2.8       ?       ? 
1 1 1   26   12    8 o   1641.7    6.1    0.0000   0.0000          ?        ? 26955.1914 200.4958          ?        ?     1641.7        6.1       ?       ? 
1 1 1   26   12    9 o    714.4    3.1    0.0000   0.0000          ?        ?  5104.3418  44.0580          ?        ?      714.4        3.1       ?       ? 
1 1 1   26   12   10 o   1182.5    4.6    0.0000   0.0000          ?        ? 13983.6240 108.5487          ?        ?     1182.5        4.6       ?       ? 
1 1 1   26   12   11 o    247.5    2.5    0.0000   0.0000          ?        ?   612.3422  12.1319          ?        ?      247.5        2.5       ?       ? 
1 1 1   26   12   12 o   1507.7    5.7    0.0000   0.0000          ?        ? 22736.4785 171.1238          ?        ?     1507.7        5.7       ?       ? 
1 1 1   26   12   13 o    512.1    2.5    0.0000   0.0000          ?        ?  2622.4084  25.5409          ?        ?      512.1        2.5       ?       ? 
1 1 1   26   12   14 o   1388.3    5.2    0.0000   0.0000          ?        ? 19276.3281 145.5829          ?        ?     1388.3        5.2       ?       ? 
1 1 1   26   12   15 o   1703.2    6.4    0.0000   0.0000          ?        ? 29015.0625 217.0974          ?        ?     1703.2        6.4       ?       ? 
1 1 1   26   12   16 o   1538.0    5.4    0.0000   0.0000          ?        ? 23659.1426 165.3771          ?        ?     1538.0        5.4       ?       ? 
1 1 1   26   12   17 o    688.7    3.1    0.0000   0.0000          ?        ?  4743.5771  42.1424          ?        ?      688.7        3.1       ?       ? 
1 1 1   26   12   18 o    257.3    3.1    0.0000   0.0000          ?        ?   662.1469  15.9630          ?        ?      257.3        3.1       ?       ? 
1 1 1   26   12   19 o   1382.3    5.2    0.0000   0.0000          ?        ? 19109.0371 142.3903          ?        ?     1382.3        5.2       ?       ? 
1 1 1   26   12   20 o   1084.4    4.0    0.0000   0.0000          ?        ? 11759.6523  86.8389          ?        ?     1084.4        4.0       ?       ? 
1 1 1   26   12   21 o    561.3    2.8    0.0000   0.0000          ?        ?  3150.4656  31.2876          ?        ?      561.3        2.8       ?       ? 
1 1 1   26   12   22 f    472.5    2.6    0.0000   0.0000          ?        ?  2232.2717  24.2638          ?        ?      472.5        2.6       ?       ? 
1 1 1   26   12   23 o   1472.0    5.1    0.0000   0.0000          ?        ? 21670.1465 149.4141          ?        ?     1472.0        5.1       ?       ? 
1 1 1   26   12   24 o    899.8    3.7    0.0000   0.0000          ?        ?  8096.4541  66.4062          ?        ?      899.8        3.7       ?       ? 
1 1 1   26   12   25 o    472.5    2.6    0.0000   0.0000          ?        ?  2232.9102  24.2638          ?        ?      472.5        2.6       ?       ? 
1 1 1   26   12   26 o   1012.7    3.7    0.0000   0.0000          ?        ? 10255.9336  75.3456          ?        ?     1012.7        3.7       ?       ? 
1 1 1   26   12   27 o    541.8    2.5    0.0000   0.0000          ?        ?  2935.2839  27.4564          ?        ?      541.8        2.5       ?       ? 
1 1 1   26   12   28 o   1168.1    4.1    0.0000   0.0000          ?        ? 13647.1230  95.7782          ?        ?     1168.1        4.1       ?       ? 
1 1 1   26   12   29 o    275.2    3.1    0.0000   0.0000          ?        ?   757.2866  17.2401          ?        ?      275.2        3.1       ?       ? 
1 1 1   26   12   30 o    567.3    2.7    0.0000   0.0000          ?        ?  3218.7876  30.6490          ?        ?      567.3        2.7       ?       ? 
1 1 1   26   12   31 o    845.2    3.2    0.0000   0.0000          ?        ?  7145.0571  53.6358          ?        ?      845.2        3.2       ?       ? 
1 1 1   26   12   32 o    602.6    2.8    0.0000   0.0000          ?        ?  3631.2725  33.2031          ?        ?      602.6        2.8       ?       ? 
1 1 1   26   12   33 f     41.0   14.4    0.0000   0.0000          ?        ?    14.6860  14.6860          ?        ?       41.0       14.4       ?       ? 
1 1 1   26   12   34 o    378.3    2.9    0.0000   0.0000          ?        ?  1430.9270  21.7097          ?        ?      378.3        2.9       ?       ? 
1 1 1   26   12   35 o    638.5    2.7    0.0000   0.0000          ?        ?  4076.9607  34.4802          ?        ?      638.5        2.7       ?       ? 
1 1 1   26   12   36 o    261.4    3.3    0.0000   0.0000          ?        ?   683.2181  17.2401          ?        ?      261.4        3.3       ?       ? 
1 1 1   26   12   37 o    845.2    3.2    0.0000   0.0000          ?        ?  7145.0571  54.2743          ?        ?      845.2        3.2       ?       ? 
1 1 1   26   12   38 o    355.7    2.6    0.0000   0.0000          ?        ?  1265.5498  18.5171          ?        ?      355.7        2.6       ?       ? 
1 1 1   26   12   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   12   40 f    356.7    2.7    0.0000   0.0000          ?        ?  1272.5736  19.1556          ?        ?      356.7        2.7       ?       ? 
1 1 1   26   12   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   12   42 o    523.3    2.6    0.0000   0.0000          ?        ?  2738.6191  26.8179          ?        ?      523.3        2.6       ?       ? 
1 1 1   26   12   43 o    230.2    3.5    0.0000   0.0000          ?        ?   529.9730  15.9630          ?        ?      230.2        3.5       ?       ? 
1 1 1   26   12   44 o    216.4    3.8    0.0000   0.0000          ?        ?   468.6749  16.6016          ?        ?      216.4        3.8       ?       ? 
1 1 1   26   12   45 o     99.7    8.3    0.0000   0.0000          ?        ?    99.6094  16.6016          ?        ?       99.7        8.3       ?       ? 
1 1 1   26   12   46 o    301.4    3.2    0.0000   0.0000          ?        ?   908.6163  19.1556          ?        ?      301.4        3.2       ?       ? 
1 1 1   26   12   47 o    198.3    4.3    0.0000   0.0000          ?        ?   393.3293  17.2401          ?        ?      198.3        4.3       ?       ? 
1 1 1   26   12   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   12   49 o    256.6    3.6    0.0000   0.0000          ?        ?   658.9543  18.5171          ?        ?      256.6        3.6       ?       ? 
1 1 1   26   12   50 o    117.3    7.3    0.0000   0.0000          ?        ?   137.9207  17.2401          ?        ?      117.3        7.3       ?       ? 
1 1 1   26   12   51 o    337.0    2.8    0.0000   0.0000          ?        ?  1135.9299  19.1556          ?        ?      337.0        2.8       ?       ? 
1 1 1   26   12   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   12   53 o    450.3    2.7    0.0000   0.0000          ?        ?  2028.5833  24.2638          ?        ?      450.3        2.7       ?       ? 
1 1 1   26   12   54 o    164.4    5.4    0.0000   0.0000          ?        ?   270.7332  17.8786          ?        ?      164.4        5.4       ?       ? 
1 1 1   26   12   55 o    373.0    3.0    0.0000   0.0000          ?        ?  1391.9772  22.3483          ?        ?      373.0        3.0       ?       ? 
1 1 1   26   12   56 o    282.4    3.5    0.0000   0.0000          ?        ?   798.1520  19.7942          ?        ?      282.4        3.5       ?       ? 
1 1 1   26   12   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   12   58 o    364.2    3.2    0.0000   0.0000          ?        ?  1327.4865  22.9868          ?        ?      364.2        3.2       ?       ? 
1 1 1   26   12   59 o     67.9   14.5    0.0000   0.0000          ?        ?    48.5276  19.1556          ?        ?       67.9       14.5       ?       ? 
1 1 1   26   12   60 o    396.8    3.0    0.0000   0.0000          ?        ?  1575.2328  23.6253          ?        ?      396.8        3.0       ?       ? 
1 1 1   26   12   61 o     30.1   13.9    0.0000   0.0000          ?        ?   -15.9630  19.7942          ?        ?       30.1       13.9       ?       ? 
1 1 1   26   12   62 o    175.9    5.6    0.0000   0.0000          ?        ?   310.3215  19.7942          ?        ?      175.9        5.6       ?       ? 
1 1 1   26   12   63 o    367.3    3.1    0.0000   0.0000          ?        ?  1350.4733  22.9868          ?        ?      367.3        3.1       ?       ? 
1 1 1   26   12   64 o     38.9   15.9    0.0000   0.0000          ?        ?     5.7467  19.7942          ?        ?       38.9       15.9       ?       ? 
1 1 1   26   12   65 o    243.9    4.4    0.0000   0.0000          ?        ?   596.3792  21.7097          ?        ?      243.9        4.4       ?       ? 
1 1 1   26   12   66 o    234.0    4.5    0.0000   0.0000          ?        ?   549.1286  21.0712          ?        ?      234.0        4.5       ?       ? 
1 1 1   26   12   67 o    132.4    8.0    0.0000   0.0000          ?        ?   176.8705  21.0712          ?        ?      132.4        8.0       ?       ? 
1 1 1   26   12   68 o     29.2   13.7    0.0000   0.0000          ?        ?   -20.4327  20.4327          ?        ?       29.2       13.7       ?       ? 
1 1 1   26   12   69 o    132.9    7.4    0.0000   0.0000          ?        ?   178.1475  19.7942          ?        ?      132.9        7.4       ?       ? 
1 1 1   26   12   70 f    188.7    5.6    0.0000   0.0000          ?        ?   358.2106  21.0712          ?        ?      188.7        5.6       ?       ? 
1 1 1   26   12   71 o    108.2    9.7    0.0000   0.0000          ?        ?   119.4035  21.0712          ?        ?      108.2        9.7       ?       ? 
1 1 1   26   13    0 o    548.8    4.0 3011.9065  43.4195  3011.9065  43.4195  3011.9065  43.4195      548.8      4.0      548.8        4.0     0.0     0.0 
1 1 1   26   13    1 o   1110.0    4.9    0.0000   0.0000          ?        ? 12322.1904 107.9102          ?        ?     1110.0        4.9       ?       ? 
1 1 1   26   13    2 o    668.1    3.1    0.0000   0.0000          ?        ?  4463.9043  41.5039          ?        ?      668.1        3.1       ?       ? 
1 1 1   26   13    3 o    425.1    2.5    0.0000   0.0000          ?        ?  1807.0162  21.0712          ?        ?      425.1        2.5       ?       ? 
1 1 1   26   13    4 o    598.1    2.9    0.0000   0.0000          ?        ?  3576.9983  35.1187          ?        ?      598.1        2.9       ?       ? 
1 1 1   26   13    5 o   1045.5    4.2    0.0000   0.0000          ?        ? 10931.4902  88.7545          ?        ?     1045.5        4.2       ?       ? 
1 1 1   26   13    6 f   1210.4    4.6    0.0000   0.0000          ?        ? 14652.1553 110.4642          ?        ?     1210.4        4.6       ?       ? 
1 1 1   26   13    7 o   1711.2    6.0    0.0000   0.0000          ?        ? 29286.4336 206.8810          ?        ?     1711.2        6.0       ?       ? 
1 1 1   26   13    8 f    634.2    2.8    0.0000   0.0000          ?        ?  4022.6863  35.1187          ?        ?      634.2        2.8       ?       ? 
1 1 1   26   13    9 o    590.5    2.6    0.0000   0.0000          ?        ?  3487.6052  30.6490          ?        ?      590.5        2.6       ?       ? 
1 1 1   26   13   10 o    440.9    2.4    0.0000   0.0000          ?        ?  1943.6598  21.0712          ?        ?      440.9        2.4       ?       ? 
1 1 1   26   13   11 o    777.3    3.2    0.0000   0.0000          ?        ?  6041.6919  49.8047          ?        ?      777.3        3.2       ?       ? 
1 1 1   26   13   12 o   1711.7    6.1    0.0000   0.0000          ?        ? 29303.0352 207.5195          ?        ?     1711.7        6.1       ?       ? 
1 1 1   26   13   13 o    190.9    3.0    0.0000   0.0000          ?        ?   364.5958  11.4934          ?        ?      190.9        3.0       ?       ? 
1 1 1   26   13   14 o    350.9    3.1    0.0000   0.0000          ?        ?  1231.7081  21.7097          ?        ?      350.9        3.1       ?       ? 
1 1 1   26   13   15 o    184.3    3.5    0.0000   0.0000          ?        ?   339.6935  12.7704          ?        ?      184.3        3.5       ?       ? 
1 1 1   26   13   16 o     18.1    9.1    0.0000   0.0000          ?        ?   -54.2743  15.9630          ?        ?       18.1        9.1       ?       ? 
1 1 1   26   13   17 o    884.2    3.6    0.0000   0.0000          ?        ?  7818.6973  63.8522          ?        ?      884.2        3.6       ?       ? 
1 1 1   26   13   18 o   1031.4    3.8    0.0000   0.0000          ?        ? 10637.7705  77.8996          ?        ?     1031.4        3.8       ?       ? 
1 1 1   26   13   19 o   1201.1    4.4    0.0000   0.0000          ?        ? 14428.0352 105.3561          ?        ?     1201.1        4.4       ?       ? 
1 1 1   26   13   20 o   1107.2    4.1    0.0000   0.0000          ?        ? 12260.2539  90.0316          ?        ?     1107.2        4.1       ?       ? 
1 1 1   26   13   21 o    560.1    2.7    0.0000   0.0000          ?        ?  3137.6953  30.6490          ?        ?      560.1        2.7       ?       ? 
1 1 1   26   13   22 o   1127.0    4.1    0.0000   0.0000          ?        ? 12702.7490  91.9471          ?        ?     1127.0        4.1       ?       ? 
1 1 1   26   13   23 o    365.9    2.6    0.0000   0.0000          ?        ?  1338.9799  19.1556          ?        ?      365.9        2.6       ?       ? 
1 1 1   26   13   24 o    815.5    3.2    0.0000   0.0000          ?        ?  6651.4795  51.7203          ?        ?      815.5        3.2       ?       ? 
1 1 1   26   13   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   13   26 o     38.9   15.6    0.0000   0.0000          ?        ?     7.0237  18.5171          ?        ?       38.9       15.6       ?       ? 
1 1 1   26   13   27 o    800.2    3.1    0.0000   0.0000          ?        ?  6403.7334  49.1662          ?        ?      800.2        3.1       ?       ? 
1 1 1   26   13   28 o    698.6    2.9    0.0000   0.0000          ?        ?  4880.2207  40.8654          ?        ?      698.6        2.9       ?       ? 
1 1 1   26   13   29 o    174.1    4.2    0.0000   0.0000          ?        ?   303.2978  14.6860          ?        ?      174.1        4.2       ?       ? 
1 1 1   26   13   30 o    618.3    2.7    0.0000   0.0000          ?        ?  3823.4675  33.8416          ?        ?      618.3        2.7       ?       ? 
1 1 1   26   13   31 f    444.5    2.4    0.0000   0.0000          ?        ?  1976.2245  21.7097          ?        ?      444.5        2.4       ?       ? 
1 1 1   26   13   32 o    187.4    4.3    0.0000   0.0000          ?        ?   351.1869  15.9630          ?        ?      187.4        4.3       ?       ? 
1 1 1   26   13   33 o    651.1    2.7    0.0000   0.0000          ?        ?  4240.4219  35.7572          ?        ?      651.1        2.7       ?       ? 
1 1 1   26   13   34 o    174.7    4.2    0.0000   0.0000          ?        ?   305.2133  14.6860          ?        ?      174.7        4.2       ?       ? 
1 1 1   26   13   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   13   36 o    692.2    2.9    0.0000   0.0000          ?        ?  4792.1050  39.5883          ?        ?      692.2        2.9       ?       ? 
1 1 1   26   13   37 o    463.8    2.5    0.0000   0.0000          ?        ?  2151.1792  23.6253          ?        ?      463.8        2.5       ?       ? 
1 1 1   26   13   38 o    412.6    2.9    0.0000   0.0000          ?        ?  1702.9373  23.6253          ?        ?      412.6        2.9       ?       ? 
1 1 1   26   13   39 o    312.7    3.0    0.0000   0.0000          ?        ?   978.2151  18.5171          ?        ?      312.7        3.0       ?       ? 
1 1 1   26   13   40 o    562.8    2.6    0.0000   0.0000          ?        ?  3168.3445  29.3720          ?        ?      562.8        2.6       ?       ? 
1 1 1   26   13   41 o    299.6    3.0    0.0000   0.0000          ?        ?   897.7615  17.8786          ?        ?      299.6        3.0       ?       ? 
1 1 1   26   13   42 o    286.2    3.0    0.0000   0.0000          ?        ?   819.2233  17.2401          ?        ?      286.2        3.0       ?       ? 
1 1 1   26   13   43 o    231.5    3.6    0.0000   0.0000          ?        ?   536.3582  16.6016          ?        ?      231.5        3.6       ?       ? 
1 1 1   26   13   44 o     70.4   10.9    0.0000   0.0000          ?        ?    49.8047  15.3245          ?        ?       70.4       10.9       ?       ? 
1 1 1   26   13   45 o    113.2    7.1    0.0000   0.0000          ?        ?   128.3428  15.9630          ?        ?      113.2        7.1       ?       ? 
1 1 1   26   13   46 o     66.1   12.5    0.0000   0.0000          ?        ?    45.3350  15.9630          ?        ?       66.1       12.5       ?       ? 
1 1 1   26   13   47 o    737.9    3.0    0.0000   0.0000          ?        ?  5446.5894  44.6965          ?        ?      737.9        3.0       ?       ? 
1 1 1   26   13   48 o    176.3    4.9    0.0000   0.0000          ?        ?   310.9600  17.2401          ?        ?      176.3        4.9       ?       ? 
1 1 1   26   13   49 o    334.4    3.1    0.0000   0.0000          ?        ?  1118.6898  20.4327          ?        ?      334.4        3.1       ?       ? 
1 1 1   26   13   50 o    755.3    3.0    0.0000   0.0000          ?        ?  5707.1064  44.6965          ?        ?      755.3        3.0       ?       ? 
1 1 1   26   13   51 f    342.8    2.9    0.0000   0.0000          ?        ?  1175.5183  19.7942          ?        ?      342.8        2.9       ?       ? 
1 1 1   26   13   52 o    440.1    2.7    0.0000   0.0000          ?        ?  1937.9131  23.6253          ?        ?      440.1        2.7       ?       ? 
1 1 1   26   13   53 o    135.0    6.1    0.0000   0.0000          ?        ?   182.6172  16.6016          ?        ?      135.0        6.1       ?       ? 
1 1 1   26   13   54 o    200.4    4.6    0.0000   0.0000          ?        ?   402.2686  18.5171          ?        ?      200.4        4.6       ?       ? 
1 1 1   26   13   55 o    418.3    2.7    0.0000   0.0000          ?        ?  1750.8264  22.9868          ?        ?      418.3        2.7       ?       ? 
1 1 1   26   13   56 o    253.6    3.9    0.0000   0.0000          ?        ?   643.6298  19.7942          ?        ?      253.6        3.9       ?       ? 
1 1 1   26   13   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   13   58 o    501.5    2.8    0.0000   0.0000          ?        ?  2516.4138  28.0950          ?        ?      501.5        2.8       ?       ? 
1 1 1   26   13   59 o    383.0    3.1    0.0000   0.0000          ?        ?  1467.9612  23.6253          ?        ?      383.0        3.1       ?       ? 
1 1 1   26   13   60 o    309.0    3.4    0.0000   0.0000          ?        ?   955.8669  21.0712          ?        ?      309.0        3.4       ?       ? 
1 1 1   26   13   61 o     23.6   11.6    0.0000   0.0000          ?        ?   -39.5883  19.1556          ?        ?       23.6       11.6       ?       ? 
1 1 1   26   13   62 o    279.1    3.5    0.0000   0.0000          ?        ?   779.6349  19.7942          ?        ?      279.1        3.5       ?       ? 
1 1 1   26   13   63 o     62.9   16.2    0.0000   0.0000          ?        ?    42.1424  20.4327          ?        ?       62.9       16.2       ?       ? 
1 1 1   26   13   64 o     21.4   10.7    0.0000   0.0000          ?        ?   -56.8284  19.7942          ?        ?       21.4       10.7       ?       ? 
1 1 1   26   13   65 o    261.9    4.1    0.0000   0.0000          ?        ?   687.0493  21.7097          ?        ?      261.9        4.1       ?       ? 
1 1 1   26   13   66 f    160.3    6.8    0.0000   0.0000          ?        ?   258.6013  21.7097          ?        ?      160.3        6.8       ?       ? 
1 1 1   26   13   67 o    145.5    7.2    0.0000   0.0000          ?        ?   213.2662  21.0712          ?        ?      145.5        7.2       ?       ? 
1 1 1   26   13   68 o     66.1   16.1    0.0000   0.0000          ?        ?    47.2506  21.0712          ?        ?       66.1       16.1       ?       ? 
1 1 1   26   13   69 o    107.5    9.8    0.0000   0.0000          ?        ?   117.4880  21.0712          ?        ?      107.5        9.8       ?       ? 
1 1 1   26   13   70 o     53.8   16.7    0.0000   0.0000          ?        ?    30.6490  19.7942          ?        ?       53.8       16.7       ?       ? 
1 1 1   26   14    0 o   2076.8   11.1 43147.4609 461.6512 43147.4609 461.6512 43147.4609 461.6512     2076.8     11.1     2076.8       11.1     0.0     0.0 
1 1 1   26   14    1 o   1530.6    6.3    0.0000   0.0000          ?        ? 23432.4668 193.4720          ?        ?     1530.6        6.3       ?       ? 
1 1 1   26   14    2 o    772.3    3.5    0.0000   0.0000          ?        ?  5964.4302  54.2743          ?        ?      772.3        3.5       ?       ? 
1 1 1   26   14    3 o    512.1    2.7    0.0000   0.0000          ?        ?  2623.0469  28.0950          ?        ?      512.1        2.7       ?       ? 
1 1 1   26   14    4 o    190.3    2.7    0.0000   0.0000          ?        ?   362.0418  10.2163          ?        ?      190.3        2.7       ?       ? 
1 1 1   26   14    5 o    998.1    3.8    0.0000   0.0000          ?        ?  9962.2139  75.9841          ?        ?      998.1        3.8       ?       ? 
1 1 1   26   14    6 o   1170.3    4.4    0.0000   0.0000          ?        ? 13697.5654 104.0790          ?        ?     1170.3        4.4       ?       ? 
1 1 1   26   14    7 o    702.7    3.1    0.0000   0.0000          ?        ?  4937.6875  44.0580          ?        ?      702.7        3.1       ?       ? 
1 1 1   26   14    8 o    780.9    3.2    0.0000   0.0000          ?        ?  6098.5200  50.4432          ?        ?      780.9        3.2       ?       ? 
1 1 1   26   14    9 o    197.2    3.4    0.0000   0.0000          ?        ?   388.8597  13.4090          ?        ?      197.2        3.4       ?       ? 
1 1 1   26   14   10 o    819.5    3.4    0.0000   0.0000          ?        ?  6715.9707  54.9129          ?        ?      819.5        3.4       ?       ? 
1 1 1   26   14   11 o   1027.4    4.0    0.0000   0.0000          ?        ? 10557.3164  83.0078          ?        ?     1027.4        4.0       ?       ? 
1 1 1   26   14   12 o   1451.3    5.7    0.0000   0.0000          ?        ? 21064.8281 164.1001          ?        ?     1451.3        5.7       ?       ? 
1 1 1   26   14   13 o    268.4    2.6    0.0000   0.0000          ?        ?   720.2524  14.0475          ?        ?      268.4        2.6       ?       ? 
1 1 1   26   14   14 o   1075.6    4.2    0.0000   0.0000          ?        ? 11570.0117  91.3086          ?        ?     1075.6        4.2       ?       ? 
1 1 1   26   14   15 o    290.8    2.7    0.0000   0.0000          ?        ?   845.4026  15.9630          ?        ?      290.8        2.7       ?       ? 
1 1 1   26   14   16 f    417.9    2.4    0.0000   0.0000          ?        ?  1746.3567  20.4327          ?        ?      417.9        2.4       ?       ? 
1 1 1   26   14   17 o   1260.2    4.6    0.0000   0.0000          ?        ? 15882.5859 114.9339          ?        ?     1260.2        4.6       ?       ? 
1 1 1   26   14   18 f   1128.4    4.0    0.0000   0.0000          ?        ? 12733.3984  91.3086          ?        ?     1128.4        4.0       ?       ? 
1 1 1   26   14   19 o    612.4    2.8    0.0000   0.0000          ?        ?  3750.6763  34.4802          ?        ?      612.4        2.8       ?       ? 
1 1 1   26   14   20 o   1082.1    4.1    0.0000   0.0000          ?        ? 11710.4863  88.1160          ?        ?     1082.1        4.1       ?       ? 
1 1 1   26   14   21 o    407.4    2.7    0.0000   0.0000          ?        ?  1659.5177  21.7097          ?        ?      407.4        2.7       ?       ? 
1 1 1   26   14   22 o    493.9    2.6    0.0000   0.0000          ?        ?  2439.7913  25.5409          ?        ?      493.9        2.6       ?       ? 
1 1 1   26   14   23 o    630.9    2.7    0.0000   0.0000          ?        ?  3981.1824  34.4802          ?        ?      630.9        2.7       ?       ? 
1 1 1   26   14   24 o    914.3    3.4    0.0000   0.0000          ?        ?  8360.1641  61.2981          ?        ?      914.3        3.4       ?       ? 
1 1 1   26   14   25 o    383.5    2.3    0.0000   0.0000          ?        ?  1470.5154  17.8786          ?        ?      383.5        2.3       ?       ? 
1 1 1   26   14   26 o    963.8    3.6    0.0000   0.0000          ?        ?  9291.1279  68.9603          ?        ?      963.8        3.6       ?       ? 
1 1 1   26   14   27 o    660.5    2.8    0.0000   0.0000          ?        ?  4363.0181  36.3957          ?        ?      660.5        2.8       ?       ? 
1 1 1   26   14   28 o    981.9    3.7    0.0000   0.0000          ?        ?  9642.3145  72.1529          ?        ?      981.9        3.7       ?       ? 
1 1 1   26   14   29 o    324.9    2.7    0.0000   0.0000          ?        ?  1055.4763  17.2401          ?        ?      324.9        2.7       ?       ? 
1 1 1   26   14   30 o    721.3    3.0    0.0000   0.0000          ?        ?  5202.6743  43.4195          ?        ?      721.3        3.0       ?       ? 
1 1 1   26   14   31 o    494.2    2.5    0.0000   0.0000          ?        ?  2442.9839  24.9023          ?        ?      494.2        2.5       ?       ? 
1 1 1   26   14   32 o    320.1    3.0    0.0000   0.0000          ?        ?  1024.8273  19.1556          ?        ?      320.1        3.0       ?       ? 
1 1 1   26   14   33 o    890.1    3.3    0.0000   0.0000          ?        ?  7924.6919  58.7440          ?        ?      890.1        3.3       ?       ? 
1 1 1   26   14   34 o    464.4    2.5    0.0000   0.0000          ?        ?  2156.9260  23.6253          ?        ?      464.4        2.5       ?       ? 
1 1 1   26   14   35 o    280.2    3.0    0.0000   0.0000          ?        ?   785.3816  16.6016          ?        ?      280.2        3.0       ?       ? 
1 1 1   26   14   36 o    242.5    3.4    0.0000   0.0000          ?        ?   588.0784  16.6016          ?        ?      242.5        3.4       ?       ? 
1 1 1   26   14   37 o    773.0    3.0    0.0000   0.0000          ?        ?  5975.9238  45.9736          ?        ?      773.0        3.0       ?       ? 
1 1 1   26   14   38 o    499.4    2.6    0.0000   0.0000          ?        ?  2494.7041  26.1794          ?        ?      499.4        2.6       ?       ? 
1 1 1   26   14   39 o     53.1   13.7    0.0000   0.0000          ?        ?    29.3720  14.6860          ?        ?       53.1       13.7       ?       ? 
1 1 1   26   14   40 o    294.1    2.9    0.0000   0.0000          ?        ?   865.1968  17.2401          ?        ?      294.1        2.9       ?       ? 
1 1 1   26   14   41 o     93.4    8.9    0.0000   0.0000          ?        ?    87.4775  16.6016          ?        ?       93.4        8.9       ?       ? 
1 1 1   26   14   42 o    351.7    2.8    0.0000   0.0000          ?        ?  1237.4550  19.7942          ?        ?      351.7        2.8       ?       ? 
1 1 1   26   14   43 o    730.1    3.0    0.0000   0.0000          ?        ?  5332.2939  44.0580          ?        ?      730.1        3.0       ?       ? 
1 1 1   26   14   44 o    348.1    2.8    0.0000   0.0000          ?        ?  1211.9141  19.7942          ?        ?      348.1        2.8       ?       ? 
1 1 1   26   14   45 o    417.0    2.8    0.0000   0.0000          ?        ?  1739.3329  22.9868          ?        ?      417.0        2.8       ?       ? 
1 1 1   26   14   46 o    383.3    2.7    0.0000   0.0000          ?        ?  1469.2383  21.0712          ?        ?      383.3        2.7       ?       ? 
1 1 1   26   14   47 o     29.4   13.3    0.0000   0.0000          ?        ?    -8.9393  16.6016          ?        ?       29.4       13.3       ?       ? 
1 1 1   26   14   48 o    183.9    4.7    0.0000   0.0000          ?        ?   338.4165  17.2401          ?        ?      183.9        4.7       ?       ? 
1 1 1   26   14   49 o    136.0    6.3    0.0000   0.0000          ?        ?   185.1713  17.2401          ?        ?      136.0        6.3       ?       ? 
1 1 1   26   14   50 o     20.1   10.0    0.0000   0.0000          ?        ?   -49.1662  17.2401          ?        ?       20.1       10.0       ?       ? 
1 1 1   26   14   51 o    223.6    4.1    0.0000   0.0000          ?        ?   500.6010  18.5171          ?        ?      223.6        4.1       ?       ? 
1 1 1   26   14   52 o    352.8    3.0    0.0000   0.0000          ?        ?  1245.1172  21.0712          ?        ?      352.8        3.0       ?       ? 
1 1 1   26   14   53 o    363.1    2.9    0.0000   0.0000          ?        ?  1319.1857  21.0712          ?        ?      363.1        2.9       ?       ? 
1 1 1   26   14   54 o    215.9    4.3    0.0000   0.0000          ?        ?   466.7593  18.5171          ?        ?      215.9        4.3       ?       ? 
1 1 1   26   14   55 o    144.5    6.4    0.0000   0.0000          ?        ?   209.4351  18.5171          ?        ?      144.5        6.4       ?       ? 
1 1 1   26   14   56 o     19.1    9.7    0.0000   0.0000          ?        ?   -70.2374  19.1556          ?        ?       19.1        9.7       ?       ? 
1 1 1   26   14   57 f    292.8    3.6    0.0000   0.0000          ?        ?   858.1730  21.0712          ?        ?      292.8        3.6       ?       ? 
1 1 1   26   14   58 o    394.9    3.0    0.0000   0.0000          ?        ?  1560.5469  23.6253          ?        ?      394.9        3.0       ?       ? 
1 1 1   26   14   59 o    171.4    5.6    0.0000   0.0000          ?        ?   294.3585  19.1556          ?        ?      171.4        5.6       ?       ? 
1 1 1   26   14   60 f    124.3    7.5    0.0000   0.0000          ?        ?   155.1608  18.5171          ?        ?      124.3        7.5       ?       ? 
1 1 1   26   14   61 o    103.5    9.6    0.0000   0.0000          ?        ?   107.9102  19.7942          ?        ?      103.5        9.6       ?       ? 
1 1 1   26   14   62 o    138.8    7.1    0.0000   0.0000          ?        ?   193.4720  19.7942          ?        ?      138.8        7.1       ?       ? 
1 1 1   26   14   63 o    150.4    6.6    0.0000   0.0000          ?        ?   227.3137  19.7942          ?        ?      150.4        6.6       ?       ? 
1 1 1   26   14   64 f    143.6    7.1    0.0000   0.0000          ?        ?   207.5195  20.4327          ?        ?      143.6        7.1       ?       ? 
1 1 1   26   14   65 o    252.9    4.0    0.0000   0.0000          ?        ?   641.0757  20.4327          ?        ?      252.9        4.0       ?       ? 
1 1 1   26   14   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   14   67 o    128.2    8.5    0.0000   0.0000          ?        ?   166.0156  21.7097          ?        ?      128.2        8.5       ?       ? 
1 1 1   26   14   68 o     84.3   12.1    0.0000   0.0000          ?        ?    72.7915  20.4327          ?        ?       84.3       12.1       ?       ? 
1 1 1   26   14   69 o     34.1   15.0    0.0000   0.0000          ?        ?    -3.8311  19.7942          ?        ?       34.1       15.0       ?       ? 
1 1 1   26   14   70 o     47.9   16.7    0.0000   0.0000          ?        ?    22.3483  19.7942          ?        ?       47.9       16.7       ?       ? 
1 1 1   26   15    0 o    693.3    5.2 4807.4297  71.5144  4807.4297  71.5144  4807.4297  71.5144      693.3      5.2      693.3        5.2     0.0     0.0 
1 1 1   26   15    1 o    198.3    4.3    0.0000   0.0000          ?        ?   393.3293  17.2401          ?        ?      198.3        4.3       ?       ? 
1 1 1   26   15    2 o    196.7    4.4    0.0000   0.0000          ?        ?   386.9441  17.2401          ?        ?      196.7        4.4       ?       ? 
1 1 1   26   15    3 o   1375.2    5.8    0.0000   0.0000          ?        ? 18914.9258 160.2689          ?        ?     1375.2        5.8       ?       ? 
1 1 1   26   15    4 o    264.5    3.5    0.0000   0.0000          ?        ?   699.8197  18.5171          ?        ?      264.5        3.5       ?       ? 
1 1 1   26   15    5 o   1237.7    5.0    0.0000   0.0000          ?        ? 15320.0498 124.5117          ?        ?     1237.7        5.0       ?       ? 
1 1 1   26   15    6 o   1023.7    4.1    0.0000   0.0000          ?        ? 10481.3320  84.9234          ?        ?     1023.7        4.1       ?       ? 
1 1 1   26   15    7 o    746.1    3.2    0.0000   0.0000          ?        ?  5567.2700  47.2506          ?        ?      746.1        3.2       ?       ? 
1 1 1   26   15    8 f   1777.2    6.0    0.0000   0.0000          ?        ? 31590.2188 212.6277          ?        ?     1777.2        6.0       ?       ? 
1 1 1   26   15    9 f   1027.4    3.9    0.0000   0.0000          ?        ? 10556.6787  80.4537          ?        ?     1027.4        3.9       ?       ? 
1 1 1   26   15   10 o   1126.6    4.4    0.0000   0.0000          ?        ? 12694.4482  99.6094          ?        ?     1126.6        4.4       ?       ? 
1 1 1   26   15   11 o   1599.3    6.0    0.0000   0.0000          ?        ? 25582.3691 191.5565          ?        ?     1599.3        6.0       ?       ? 
1 1 1   26   15   12 o    670.4    2.9    0.0000   0.0000          ?        ?  4494.5537  38.9498          ?        ?      670.4        2.9       ?       ? 
1 1 1   26   15   13 f    973.9    3.9    0.0000   0.0000          ?        ?  9485.8770  75.9841          ?        ?      973.9        3.9       ?       ? 
1 1 1   26   15   14 o   1189.6    4.4    0.0000   0.0000          ?        ? 14152.8320 104.7175          ?        ?     1189.6        4.4       ?       ? 
1 1 1   26   15   15 o   1039.6    4.0    0.0000   0.0000          ?        ? 10808.8945  83.6463          ?        ?     1039.6        4.0       ?       ? 
1 1 1   26   15   16 o    929.1    3.4    0.0000   0.0000          ?        ?  8632.8125  63.8522          ?        ?      929.1        3.4       ?       ? 
1 1 1   26   15   17 o   1180.7    4.2    0.0000   0.0000          ?        ? 13942.1201  98.9709          ?        ?     1180.7        4.2       ?       ? 
1 1 1   26   15   18 f    721.1    2.9    0.0000   0.0000          ?        ?  5200.1201  41.5039          ?        ?      721.1        2.9       ?       ? 
1 1 1   26   15   19 o     92.5    8.3    0.0000   0.0000          ?        ?    85.5619  15.3245          ?        ?       92.5        8.3       ?       ? 
1 1 1   26   15   20 o    625.2    2.7    0.0000   0.0000          ?        ?  3909.0295  33.8416          ?        ?      625.2        2.7       ?       ? 
1 1 1   26   15   21 o   1682.3    5.7    0.0000   0.0000          ?        ? 28310.1348 192.8335          ?        ?     1682.3        5.7       ?       ? 
1 1 1   26   15   22 o   1554.1    5.2    0.0000   0.0000          ?        ? 24159.1055 160.9075          ?        ?     1554.1        5.2       ?       ? 
1 1 1   26   15   23 o    272.7    2.9    0.0000   0.0000          ?        ?   743.8777  15.9630          ?        ?      272.7        2.9       ?       ? 
1 1 1   26   15   24 o    421.3    2.3    0.0000   0.0000          ?        ?  1775.0901  19.7942          ?        ?      421.3        2.3       ?       ? 
1 1 1   26   15   25 o    741.4    3.0    0.0000   0.0000          ?        ?  5497.6714  44.6965          ?        ?      741.4        3.0       ?       ? 
1 1 1   26   15   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   15   27 o    613.8    2.7    0.0000   0.0000          ?        ?  3767.9160  32.5646          ?        ?      613.8        2.7       ?       ? 
1 1 1   26   15   28 o   1150.4    4.1    0.0000   0.0000          ?        ? 13237.1924  94.5012          ?        ?     1150.4        4.1       ?       ? 
1 1 1   26   15   29 o    339.1    2.6    0.0000   0.0000          ?        ?  1149.9775  17.8786          ?        ?      339.1        2.6       ?       ? 
1 1 1   26   15   30 o   1192.2    4.2    0.0000   0.0000          ?        ? 14217.9609 100.8864          ?        ?     1192.2        4.2       ?       ? 
1 1 1   26   15   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   15   32 o    356.4    2.6    0.0000   0.0000          ?        ?  1270.6581  18.5171          ?        ?      356.4        2.6       ?       ? 
1 1 1   26   15   33 o    413.3    2.5    0.0000   0.0000          ?        ?  1708.0454  21.0712          ?        ?      413.3        2.5       ?       ? 
1 1 1   26   15   34 o    211.4    3.6    0.0000   0.0000          ?        ?   446.9651  15.3245          ?        ?      211.4        3.6       ?       ? 
1 1 1   26   15   35 o    320.2    2.8    0.0000   0.0000          ?        ?  1025.4658  17.8786          ?        ?      320.2        2.8       ?       ? 
1 1 1   26   15   36 o    370.0    2.6    0.0000   0.0000          ?        ?  1368.9904  19.1556          ?        ?      370.0        2.6       ?       ? 
1 1 1   26   15   37 o     84.9    9.0    0.0000   0.0000          ?        ?    72.1529  15.3245          ?        ?       84.9        9.0       ?       ? 
1 1 1   26   15   38 o    432.7    2.6    0.0000   0.0000          ?        ?  1872.7838  22.3483          ?        ?      432.7        2.6       ?       ? 
1 1 1   26   15   39 o     26.8   12.3    0.0000   0.0000          ?        ?   -12.1319  15.3245          ?        ?       26.8       12.3       ?       ? 
1 1 1   26   15   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   15   41 o    450.6    2.6    0.0000   0.0000          ?        ?  2031.1373  22.9868          ?        ?      450.6        2.6       ?       ? 
1 1 1   26   15   42 o    233.9    3.5    0.0000   0.0000          ?        ?   547.2130  16.6016          ?        ?      233.9        3.5       ?       ? 
1 1 1   26   15   43 o    619.3    2.8    0.0000   0.0000          ?        ?  3836.2378  34.4802          ?        ?      619.3        2.8       ?       ? 
1 1 1   26   15   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   15   45 o    370.7    2.6    0.0000   0.0000          ?        ?  1374.7371  19.1556          ?        ?      370.7        2.6       ?       ? 
1 1 1   26   15   46 f    380.9    2.7    0.0000   0.0000          ?        ?  1451.3596  20.4327          ?        ?      380.9        2.7       ?       ? 
1 1 1   26   15   47 o    362.4    2.7    0.0000   0.0000          ?        ?  1313.4390  19.7942          ?        ?      362.4        2.7       ?       ? 
1 1 1   26   15   48 o    211.6    4.1    0.0000   0.0000          ?        ?   448.2422  17.2401          ?        ?      211.6        4.1       ?       ? 
1 1 1   26   15   49 o    141.7    6.3    0.0000   0.0000          ?        ?   201.1343  17.8786          ?        ?      141.7        6.3       ?       ? 
1 1 1   26   15   50 o    377.2    2.9    0.0000   0.0000          ?        ?  1423.2646  21.7097          ?        ?      377.2        2.9       ?       ? 
1 1 1   26   15   51 o    211.9    4.2    0.0000   0.0000          ?        ?   449.5192  17.8786          ?        ?      211.9        4.2       ?       ? 
1 1 1   26   15   52 o    433.3    2.7    0.0000   0.0000          ?        ?  1877.8921  23.6253          ?        ?      433.3        2.7       ?       ? 
1 1 1   26   15   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   15   54 o    128.4    7.0    0.0000   0.0000          ?        ?   165.3771  17.8786          ?        ?      128.4        7.0       ?       ? 
1 1 1   26   15   55 o    412.3    2.7    0.0000   0.0000          ?        ?  1701.0216  22.3483          ?        ?      412.3        2.7       ?       ? 
1 1 1   26   15   56 o     37.6   15.4    0.0000   0.0000          ?        ?     5.1082  18.5171          ?        ?       37.6       15.4       ?       ? 
1 1 1   26   15   57 o    180.6    5.5    0.0000   0.0000          ?        ?   326.9231  19.7942          ?        ?      180.6        5.5       ?       ? 
1 1 1   26   15   58 f    321.4    3.2    0.0000   0.0000          ?        ?  1033.7665  20.4327          ?        ?      321.4        3.2       ?       ? 
1 1 1   26   15   59 o     65.9   15.3    0.0000   0.0000          ?        ?    45.9736  19.7942          ?        ?       65.9       15.3       ?       ? 
1 1 1   26   15   60 o    159.1    6.2    0.0000   0.0000          ?        ?   254.1316  19.7942          ?        ?      159.1        6.2       ?       ? 
1 1 1   26   15   61 o     31.2   14.2    0.0000   0.0000          ?        ?   -10.8549  19.1556          ?        ?       31.2       14.2       ?       ? 
1 1 1   26   15   62 o    102.4   10.0    0.0000   0.0000          ?        ?   105.9946  20.4327          ?        ?      102.4       10.0       ?       ? 
1 1 1   26   15   63 o    151.5    6.5    0.0000   0.0000          ?        ?   230.5063  19.7942          ?        ?      151.5        6.5       ?       ? 
1 1 1   26   15   64 o    156.2    6.3    0.0000   0.0000          ?        ?   245.1923  19.7942          ?        ?      156.2        6.3       ?       ? 
1 1 1   26   15   65 o     74.2   13.9    0.0000   0.0000          ?        ?    58.1055  19.7942          ?        ?       74.2       13.9       ?       ? 
1 1 1   26   15   66 f     24.6   12.0    0.0000   0.0000          ?        ?   -37.0343  19.7942          ?        ?       24.6       12.0       ?       ? 
1 1 1   26   15   67 o     69.5   14.7    0.0000   0.0000          ?        ?    51.7203  19.7942          ?        ?       69.5       14.7       ?       ? 
1 1 1   26   15   68 o     38.1   15.9    0.0000   0.0000          ?        ?     3.8311  20.4327          ?        ?       38.1       15.9       ?       ? 
1 1 1   26   15   69 o    144.1    7.5    0.0000   0.0000          ?        ?   210.0736  21.7097          ?        ?      144.1        7.5       ?       ? 
1 1 1   26   16    0 o    629.9    4.6 3968.4119  58.1055  3968.4119  58.1055  3968.4119  58.1055      629.9      4.6      629.9        4.6     0.0     0.0 
1 1 1   26   16    1 o    974.0    4.3    0.0000   0.0000          ?        ?  9488.4316  83.6463          ?        ?      974.0        4.3       ?       ? 
1 1 1   26   16    2 o   1370.1    5.7    0.0000   0.0000          ?        ? 18773.8125 156.4378          ?        ?     1370.1        5.7       ?       ? 
1 1 1   26   16    3 o   1006.3    4.3    0.0000   0.0000          ?        ? 10128.2295  86.8389          ?        ?     1006.3        4.3       ?       ? 
1 1 1   26   16    4 o   1268.9    5.2    0.0000   0.0000          ?        ? 16103.5156 131.5355          ?        ?     1268.9        5.2       ?       ? 
1 1 1   26   16    5 o   1317.3    5.0    0.0000   0.0000          ?        ? 17356.2949 132.1740          ?        ?     1317.3        5.0       ?       ? 
1 1 1   26   16    6 o    390.3    2.9    0.0000   0.0000          ?        ?  1523.5127  22.3483          ?        ?      390.3        2.9       ?       ? 
1 1 1   26   16    7 o   1521.3    5.7    0.0000   0.0000          ?        ? 23148.3242 173.6779          ?        ?     1521.3        5.7       ?       ? 
1 1 1   26   16    8 o   1172.6    4.7    0.0000   0.0000          ?        ? 13750.5635 109.8257          ?        ?     1172.6        4.7       ?       ? 
1 1 1   26   16    9 o    954.6    3.7    0.0000   0.0000          ?        ?  9114.2578  70.8759          ?        ?      954.6        3.7       ?       ? 
1 1 1   26   16   10 o    807.0    3.3    0.0000   0.0000          ?        ?  6512.2822  52.9973          ?        ?      807.0        3.3       ?       ? 
1 1 1   26   16   11 o    284.7    2.4    0.0000   0.0000          ?        ?   810.2839  13.4090          ?        ?      284.7        2.4       ?       ? 
1 1 1   26   16   12 o   1071.5    3.9    0.0000   0.0000          ?        ? 11481.2568  83.6463          ?        ?     1071.5        3.9       ?       ? 
1 1 1   26   16   13 o    695.1    2.8    0.0000   0.0000          ?        ?  4832.3315  38.9498          ?        ?      695.1        2.8       ?       ? 
1 1 1   26   16   14 o    340.7    2.4    0.0000   0.0000          ?        ?  1160.8323  16.6016          ?        ?      340.7        2.4       ?       ? 
1 1 1   26   16   15 o    821.1    3.3    0.0000   0.0000          ?        ?  6742.1499  54.2743          ?        ?      821.1        3.3       ?       ? 
1 1 1   26   16   16 o    436.7    2.4    0.0000   0.0000          ?        ?  1907.2642  21.0712          ?        ?      436.7        2.4       ?       ? 
1 1 1   26   16   17 o   1021.9    3.8    0.0000   0.0000          ?        ? 10443.6592  77.8996          ?        ?     1021.9        3.8       ?       ? 
1 1 1   26   16   18 o   1201.7    4.3    0.0000   0.0000          ?        ? 14442.0820 104.0790          ?        ?     1201.7        4.3       ?       ? 
1 1 1   26   16   19 o   1084.9    3.9    0.0000   0.0000          ?        ? 11771.7842  83.6463          ?        ?     1084.9        3.9       ?       ? 
1 1 1   26   16   20 f    278.3    2.8    0.0000   0.0000          ?        ?   774.5267  15.3245          ?        ?      278.3        2.8       ?       ? 
1 1 1   26   16   21 o    564.9    2.7    0.0000   0.0000          ?        ?  3191.3311  30.0105          ?        ?      564.9        2.7       ?       ? 
1 1 1   26   16   22 o    702.9    2.8    0.0000   0.0000          ?        ?  4941.5190  39.5883          ?        ?      702.9        2.8       ?       ? 
1 1 1   26   16   23 o    796.3    3.0    0.0000   0.0000          ?        ?  6341.1582  48.5276          ?        ?      796.3        3.0       ?       ? 
1 1 1   26   16   24 o    758.5    3.0    0.0000   0.0000          ?        ?  5753.0801  45.3350          ?        ?      758.5        3.0       ?       ? 
1 1 1   26   16   25 o    468.2    2.7    0.0000   0.0000          ?        ?  2192.0447  24.9023          ?        ?      468.2        2.7       ?       ? 
1 1 1   26   16   26 o    590.3    2.6    0.0000   0.0000          ?        ?  3484.4126  30.6490          ?        ?      590.3        2.6       ?       ? 
1 1 1   26   16   27 o    670.3    2.8    0.0000   0.0000          ?        ?  4493.9150  37.6728          ?        ?      670.3        2.8       ?       ? 
1 1 1   26   16   28 o    963.7    3.6    0.0000   0.0000          ?        ?  9287.9355  68.9603          ?        ?      963.7        3.6       ?       ? 
1 1 1   26   16   29 o    290.1    2.8    0.0000   0.0000          ?        ?   841.5715  15.9630          ?        ?      290.1        2.8       ?       ? 
1 1 1   26   16   30 o    253.7    3.0    0.0000   0.0000          ?        ?   643.6298  15.3245          ?        ?      253.7        3.0       ?       ? 
1 1 1   26   16   31 o    474.0    2.6    0.0000   0.0000          ?        ?  2246.9575  24.2638          ?        ?      474.0        2.6       ?       ? 
1 1 1   26   16   32 o    758.2    3.0    0.0000   0.0000          ?        ?  5749.8872  45.3350          ?        ?      758.2        3.0       ?       ? 
1 1 1   26   16   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   16   34 o    153.7    4.8    0.0000   0.0000          ?        ?   236.2530  14.6860          ?        ?      153.7        4.8       ?       ? 
1 1 1   26   16   35 o    243.8    3.5    0.0000   0.0000          ?        ?   594.4636  17.2401          ?        ?      243.8        3.5       ?       ? 
1 1 1   26   16   36 o    291.6    2.8    0.0000   0.0000          ?        ?   850.5108  16.6016          ?        ?      291.6        2.8       ?       ? 
1 1 1   26   16   37 o    771.8    3.1    0.0000   0.0000          ?        ?  5958.0449  47.2506          ?        ?      771.8        3.1       ?       ? 
1 1 1   26   16   38 o    379.2    2.7    0.0000   0.0000          ?        ?  1438.5892  20.4327          ?        ?      379.2        2.7       ?       ? 
1 1 1   26   16   39 f    648.3    2.8    0.0000   0.0000          ?        ?  4203.3877  35.7572          ?        ?      648.3        2.8       ?       ? 
1 1 1   26   16   40 o    179.9    4.4    0.0000   0.0000          ?        ?   323.7305  15.9630          ?        ?      179.9        4.4       ?       ? 
1 1 1   26   16   41 o     39.5   14.9    0.0000   0.0000          ?        ?    11.4934  15.9630          ?        ?       39.5       14.9       ?       ? 
1 1 1   26   16   42 o    180.0    4.6    0.0000   0.0000          ?        ?   324.3690  16.6016          ?        ?      180.0        4.6       ?       ? 
1 1 1   26   16   43 o    407.2    2.6    0.0000   0.0000          ?        ?  1658.8792  21.0712          ?        ?      407.2        2.6       ?       ? 
1 1 1   26   16   44 o     18.6    9.4    0.0000   0.0000          ?        ?   -50.4432  15.9630          ?        ?       18.6        9.4       ?       ? 
1 1 1   26   16   45 o    392.6    2.7    0.0000   0.0000          ?        ?  1541.3911  21.0712          ?        ?      392.6        2.7       ?       ? 
1 1 1   26   16   46 o    122.4    6.5    0.0000   0.0000          ?        ?   150.0526  15.9630          ?        ?      122.4        6.5       ?       ? 
1 1 1   26   16   47 o    345.0    3.0    0.0000   0.0000          ?        ?  1190.8428  20.4327          ?        ?      345.0        3.0       ?       ? 
1 1 1   26   16   48 o    108.8    7.3    0.0000   0.0000          ?        ?   118.7650  15.9630          ?        ?      108.8        7.3       ?       ? 
1 1 1   26   16   49 f    136.2    6.3    0.0000   0.0000          ?        ?   185.8098  17.2401          ?        ?      136.2        6.3       ?       ? 
1 1 1   26   16   50 o    334.0    2.9    0.0000   0.0000          ?        ?  1116.1359  19.1556          ?        ?      334.0        2.9       ?       ? 
1 1 1   26   16   51 o    249.3    3.8    0.0000   0.0000          ?        ?   621.9200  19.1556          ?        ?      249.3        3.8       ?       ? 
1 1 1   26   16   52 o    229.8    4.0    0.0000   0.0000          ?        ?   528.6959  18.5171          ?        ?      229.8        4.0       ?       ? 
1 1 1   26   16   53 o     76.8   11.2    0.0000   0.0000          ?        ?    59.3825  17.2401          ?        ?       76.8       11.2       ?       ? 
1 1 1   26   16   54 o    279.8    3.7    0.0000   0.0000          ?        ?   783.4660  20.4327          ?        ?      279.8        3.7       ?       ? 
1 1 1   26   16   55 o    146.7    6.3    0.0000   0.0000          ?        ?   215.8203  18.5171          ?        ?      146.7        6.3       ?       ? 
1 1 1   26   16   56 o    261.4    3.9    0.0000   0.0000          ?        ?   683.8566  20.4327          ?        ?      261.4        3.9       ?       ? 
1 1 1   26   16   57 o    270.1    3.9    0.0000   0.0000          ?        ?   730.4688  21.0712          ?        ?      270.1        3.9       ?       ? 
1 1 1   26   16   58 o    171.4    5.6    0.0000   0.0000          ?        ?   294.3585  19.1556          ?        ?      171.4        5.6       ?       ? 
1 1 1   26   16   59 o    100.3    9.9    0.0000   0.0000          ?        ?   101.5249  19.7942          ?        ?      100.3        9.9       ?       ? 
1 1 1   26   16   60 o    322.7    3.4    0.0000   0.0000          ?        ?  1042.7058  21.7097          ?        ?      322.7        3.4       ?       ? 
1 1 1   26   16   61 o    144.8    6.8    0.0000   0.0000          ?        ?   210.7121  19.7942          ?        ?      144.8        6.8       ?       ? 
1 1 1   26   16   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   16   63 o    218.7    4.7    0.0000   0.0000          ?        ?   479.5297  20.4327          ?        ?      218.7        4.7       ?       ? 
1 1 1   26   16   64 o     28.7   13.5    0.0000   0.0000          ?        ?   -22.3483  20.4327          ?        ?       28.7       13.5       ?       ? 
1 1 1   26   16   65 o    105.1    9.4    0.0000   0.0000          ?        ?   111.7413  19.7942          ?        ?      105.1        9.4       ?       ? 
1 1 1   26   16   66 o     25.5   12.4    0.0000   0.0000          ?        ?   -32.5646  19.7942          ?        ?       25.5       12.4       ?       ? 
1 1 1   26   16   67 o    210.7    4.8    0.0000   0.0000          ?        ?   445.6881  20.4327          ?        ?      210.7        4.8       ?       ? 
1 1 1   26   16   68 o    181.3    5.8    0.0000   0.0000          ?        ?   330.7542  21.0712          ?        ?      181.3        5.8       ?       ? 
1 1 1   26   16   69 f    170.0    5.8    0.0000   0.0000          ?        ?   291.1659  19.7942          ?        ?      170.0        5.8       ?       ? 
1 1 1   26   17    0 o   1411.6    8.4 19932.0918 237.5300 19932.0918 237.5300 19932.0918 237.5300     1411.6      8.4     1411.6        8.4     0.0     0.0 
1 1 1   26   17    1 o    391.0    4.1    0.0000   0.0000          ?        ?  1529.2593  31.9261          ?        ?      391.0        4.1       ?       ? 
1 1 1   26   17    2 o   1265.0    5.4    0.0000   0.0000          ?        ? 16004.5449 137.2822          ?        ?     1265.0        5.4       ?       ? 
1 1 1   26   17    3 o    268.5    3.0    0.0000   0.0000          ?        ?   720.8909  15.9630          ?        ?      268.5        3.0       ?       ? 
1 1 1   26   17    4 o    622.0    3.1    0.0000   0.0000          ?        ?  3869.4412  38.9498          ?        ?      622.0        3.1       ?       ? 
1 1 1   26   17    5 o    973.2    4.3    0.0000   0.0000          ?        ?  9471.8301  83.6463          ?        ?      973.2        4.3       ?       ? 
1 1 1   26   17    6 o    449.4    2.8    0.0000   0.0000          ?        ?  2019.6438  24.9023          ?        ?      449.4        2.8       ?       ? 
1 1 1   26   17    7 o    636.3    3.0    0.0000   0.0000          ?        ?  4049.5042  37.6728          ?        ?      636.3        3.0       ?       ? 
1 1 1   26   17    8 o    915.3    3.8    0.0000   0.0000          ?        ?  8379.3193  68.9603          ?        ?      915.3        3.8       ?       ? 
1 1 1   26   17    9 o    525.6    2.7    0.0000   0.0000          ?        ?  2762.8831  28.7335          ?        ?      525.6        2.7       ?       ? 
1 1 1   26   17   10 f    575.7    2.6    0.0000   0.0000          ?        ?  3314.5657  29.3720          ?        ?      575.7        2.6       ?       ? 
1 1 1   26   17   11 o   1465.3    5.4    0.0000   0.0000          ?        ? 21476.0352 157.0763          ?        ?     1465.3        5.4       ?       ? 
1 1 1   26   17   12 o    801.5    3.2    0.0000   0.0000          ?        ?  6424.1660  51.7203          ?        ?      801.5        3.2       ?       ? 
1 1 1   26   17   13 o   1029.7    3.9    0.0000   0.0000          ?        ? 10603.2900  79.8152          ?        ?     1029.7        3.9       ?       ? 
1 1 1   26   17   14 o    370.3    2.3    0.0000   0.0000          ?        ?  1371.5444  17.2401          ?        ?      370.3        2.3       ?       ? 
1 1 1   26   17   15 f    528.1    2.5    0.0000   0.0000          ?        ?  2789.0625  26.8179          ?        ?      528.1        2.5       ?       ? 
1 1 1   26   17   16 o    414.3    2.5    0.0000   0.0000          ?        ?  1716.3461  20.4327          ?        ?      414.3        2.5       ?       ? 
1 1 1   26   17   17 o   1125.8    4.2    0.0000   0.0000          ?        ? 12675.9307  94.5012          ?        ?     1125.8        4.2       ?       ? 
1 1 1   26   17   18 o    526.3    2.5    0.0000   0.0000          ?        ?  2769.9067  26.8179          ?        ?      526.3        2.5       ?       ? 
1 1 1   26   17   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   17   20 o    916.8    3.4    0.0000   0.0000          ?        ?  8406.1377  62.5751          ?        ?      916.8        3.4       ?       ? 
1 1 1   26   17   21 o    240.8    2.8    0.0000   0.0000          ?        ?   579.7776  13.4090          ?        ?      240.8        2.8       ?       ? 
1 1 1   26   17   22 o    895.0    3.4    0.0000   0.0000          ?        ?  8011.5308  60.6596          ?        ?      895.0        3.4       ?       ? 
1 1 1   26   17   23 o    253.9    2.9    0.0000   0.0000          ?        ?   644.9069  14.6860          ?        ?      253.9        2.9       ?       ? 
1 1 1   26   17   24 o    533.0    2.5    0.0000   0.0000          ?        ?  2840.7827  26.8179          ?        ?      533.0        2.5       ?       ? 
1 1 1   26   17   25 o    335.6    2.5    0.0000   0.0000          ?        ?  1126.3521  16.6016          ?        ?      335.6        2.5       ?       ? 
1 1 1   26   17   26 o    356.4    2.4    0.0000   0.0000          ?        ?  1270.6581  17.2401          ?        ?      356.4        2.4       ?       ? 
1 1 1   26   17   27 o    422.4    2.4    0.0000   0.0000          ?        ?  1784.6680  20.4327          ?        ?      422.4        2.4       ?       ? 
1 1 1   26   17   28 o    178.3    4.1    0.0000   0.0000          ?        ?   317.9838  14.6860          ?        ?      178.3        4.1       ?       ? 
1 1 1   26   17   29 o    177.6    4.0    0.0000   0.0000          ?        ?   315.4297  14.0475          ?        ?      177.6        4.0       ?       ? 
1 1 1   26   17   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   17   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   17   32 o    685.5    2.9    0.0000   0.0000          ?        ?  4700.1577  39.5883          ?        ?      685.5        2.9       ?       ? 
1 1 1   26   17   33 o    435.5    2.6    0.0000   0.0000          ?        ?  1897.0479  22.9868          ?        ?      435.5        2.6       ?       ? 
1 1 1   26   17   34 o    485.4    2.5    0.0000   0.0000          ?        ?  2356.7834  24.2638          ?        ?      485.4        2.5       ?       ? 
1 1 1   26   17   35 o    503.9    2.6    0.0000   0.0000          ?        ?  2540.0391  26.1794          ?        ?      503.9        2.6       ?       ? 
1 1 1   26   17   36 o    151.4    5.1    0.0000   0.0000          ?        ?   229.2293  15.3245          ?        ?      151.4        5.1       ?       ? 
1 1 1   26   17   37 o    736.7    3.1    0.0000   0.0000          ?        ?  5428.0723  45.3350          ?        ?      736.7        3.1       ?       ? 
1 1 1   26   17   38 o    235.8    3.2    0.0000   0.0000          ?        ?   556.1523  15.3245          ?        ?      235.8        3.2       ?       ? 
1 1 1   26   17   39 o    127.8    6.2    0.0000   0.0000          ?        ?   163.4615  15.9630          ?        ?      127.8        6.2       ?       ? 
1 1 1   26   17   40 o    279.5    3.1    0.0000   0.0000          ?        ?   781.5505  17.2401          ?        ?      279.5        3.1       ?       ? 
1 1 1   26   17   41 o    293.7    3.0    0.0000   0.0000          ?        ?   862.6428  17.8786          ?        ?      293.7        3.0       ?       ? 
1 1 1   26   17   42 o     51.1   14.8    0.0000   0.0000          ?        ?    26.8179  15.9630          ?        ?       51.1       14.8       ?       ? 
1 1 1   26   17   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   17   44 o    434.9    2.6    0.0000   0.0000          ?        ?  1891.9395  22.9868          ?        ?      434.9        2.6       ?       ? 
1 1 1   26   17   45 o    106.2    7.8    0.0000   0.0000          ?        ?   113.0183  16.6016          ?        ?      106.2        7.8       ?       ? 
1 1 1   26   17   46 o     75.6   11.0    0.0000   0.0000          ?        ?    57.4669  16.6016          ?        ?       75.6       11.0       ?       ? 
1 1 1   26   17   47 o    390.6    2.7    0.0000   0.0000          ?        ?  1526.0667  21.0712          ?        ?      390.6        2.7       ?       ? 
1 1 1   26   17   48 f    243.5    3.5    0.0000   0.0000          ?        ?   593.1866  17.2401          ?        ?      243.5        3.5       ?       ? 
1 1 1   26   17   49 o    163.5    5.1    0.0000   0.0000          ?        ?   267.5406  16.6016          ?        ?      163.5        5.1       ?       ? 
1 1 1   26   17   50 f    147.4    5.8    0.0000   0.0000          ?        ?   217.7359  17.2401          ?        ?      147.4        5.8       ?       ? 
1 1 1   26   17   51 o    329.9    3.1    0.0000   0.0000          ?        ?  1088.6793  20.4327          ?        ?      329.9        3.1       ?       ? 
1 1 1   26   17   52 o    180.9    4.9    0.0000   0.0000          ?        ?   327.5616  17.8786          ?        ?      180.9        4.9       ?       ? 
1 1 1   26   17   53 o     20.3   10.2    0.0000   0.0000          ?        ?   -56.1899  18.5171          ?        ?       20.3       10.2       ?       ? 
1 1 1   26   17   54 o     28.0   13.1    0.0000   0.0000          ?        ?   -16.6016  17.8786          ?        ?       28.0       13.1       ?       ? 
1 1 1   26   17   55 o    381.0    2.8    0.0000   0.0000          ?        ?  1452.6367  21.7097          ?        ?      381.0        2.8       ?       ? 
1 1 1   26   17   56 o     23.9   11.7    0.0000   0.0000          ?        ?   -38.3113  19.1556          ?        ?       23.9       11.7       ?       ? 
1 1 1   26   17   57 o     39.7   15.7    0.0000   0.0000          ?        ?     8.9393  18.5171          ?        ?       39.7       15.7       ?       ? 
1 1 1   26   17   58 o     28.3   13.3    0.0000   0.0000          ?        ?   -19.7942  19.1556          ?        ?       28.3       13.3       ?       ? 
1 1 1   26   17   59 o    248.4    4.2    0.0000   0.0000          ?        ?   618.0889  21.0712          ?        ?      248.4        4.2       ?       ? 
1 1 1   26   17   60 f    266.0    3.8    0.0000   0.0000          ?        ?   708.7590  20.4327          ?        ?      266.0        3.8       ?       ? 
1 1 1   26   17   61 o    116.7    8.5    0.0000   0.0000          ?        ?   137.2822  19.7942          ?        ?      116.7        8.5       ?       ? 
1 1 1   26   17   62 o    233.1    4.5    0.0000   0.0000          ?        ?   544.6590  21.0712          ?        ?      233.1        4.5       ?       ? 
1 1 1   26   17   63 o     59.9   15.8    0.0000   0.0000          ?        ?    38.3113  19.1556          ?        ?       59.9       15.8       ?       ? 
1 1 1   26   17   64 o    184.1    5.4    0.0000   0.0000          ?        ?   340.3320  19.7942          ?        ?      184.1        5.4       ?       ? 
1 1 1   26   17   65 o     89.2   11.5    0.0000   0.0000          ?        ?    81.0922  20.4327          ?        ?       89.2       11.5       ?       ? 
1 1 1   26   17   66 o    276.5    3.9    0.0000   0.0000          ?        ?   766.2260  21.7097          ?        ?      276.5        3.9       ?       ? 
1 1 1   26   17   67 o     51.1   16.8    0.0000   0.0000          ?        ?    26.8179  19.7942          ?        ?       51.1       16.8       ?       ? 
1 1 1   26   17   68 o     56.4   16.1    0.0000   0.0000          ?        ?    34.4802  19.1556          ?        ?       56.4       16.1       ?       ? 
1 1 1   26   18    0 o    880.8    5.1 7758.6763  90.0316  7758.6763  90.0316  7758.6763  90.0316      880.8      5.1      880.8        5.1     0.0     0.0 
1 1 1   26   18    1 o    392.4    2.6    0.0000   0.0000          ?        ?  1539.4757  20.4327          ?        ?      392.4        2.6       ?       ? 
1 1 1   26   18    2 o   1368.7    5.2    0.0000   0.0000          ?        ? 18736.7773 142.3903          ?        ?     1368.7        5.2       ?       ? 
1 1 1   26   18    3 o    380.1    2.7    0.0000   0.0000          ?        ?  1444.9745  20.4327          ?        ?      380.1        2.7       ?       ? 
1 1 1   26   18    4 o    916.8    4.1    0.0000   0.0000          ?        ?  8406.1377  75.3456          ?        ?      916.8        4.1       ?       ? 
1 1 1   26   18    5 o    999.6    4.4    0.0000   0.0000          ?        ?  9994.1406  88.1160          ?        ?      999.6        4.4       ?       ? 
1 1 1   26   18    6 o   1230.1    5.0    0.0000   0.0000          ?        ? 15134.2393 122.5962          ?        ?     1230.1        5.0       ?       ? 
1 1 1   26   18    7 o    921.2    3.7    0.0000   0.0000          ?        ?  8486.5908  68.3218          ?        ?      921.2        3.7       ?       ? 
1 1 1   26   18    8 o   1719.6    6.4    0.0000   0.0000          ?        ? 29578.8750 219.6514          ?        ?     1719.6        6.4       ?       ? 
1 1 1   26   18    9 o    563.9    2.7    0.0000   0.0000          ?        ?  3180.4763  30.6490          ?        ?      563.9        2.7       ?       ? 
1 1 1   26   18   10 o    642.6    2.6    0.0000   0.0000          ?        ?  4129.9580  33.2031          ?        ?      642.6        2.6       ?       ? 
1 1 1   26   18   11 o    230.2    2.9    0.0000   0.0000          ?        ?   529.9730  13.4090          ?        ?      230.2        2.9       ?       ? 
1 1 1   26   18   12 o    557.7    2.6    0.0000   0.0000          ?        ?  3110.8774  29.3720          ?        ?      557.7        2.6       ?       ? 
1 1 1   26   18   13 o    205.9    2.8    0.0000   0.0000          ?        ?   423.9784  11.4934          ?        ?      205.9        2.8       ?       ? 
1 1 1   26   18   14 o    515.9    2.6    0.0000   0.0000          ?        ?  2661.9966  26.8179          ?        ?      515.9        2.6       ?       ? 
1 1 1   26   18   15 o    370.2    2.3    0.0000   0.0000          ?        ?  1370.2675  17.2401          ?        ?      370.2        2.3       ?       ? 
1 1 1   26   18   16 o   1195.6    4.2    0.0000   0.0000          ?        ? 14297.1387 100.8864          ?        ?     1195.6        4.2       ?       ? 
1 1 1   26   18   17 o    547.3    2.6    0.0000   0.0000          ?        ?  2995.3049  28.0950          ?        ?      547.3        2.6       ?       ? 
1 1 1   26   18   18 o    820.0    3.2    0.0000   0.0000          ?        ?  6724.9097  52.9973          ?        ?      820.0        3.2       ?       ? 
1 1 1   26   18   19 o    976.2    3.7    0.0000   0.0000          ?        ?  9530.5732  71.5144          ?        ?      976.2        3.7       ?       ? 
1 1 1   26   18   20 o    286.3    2.8    0.0000   0.0000          ?        ?   819.8618  15.9630          ?        ?      286.3        2.8       ?       ? 
1 1 1   26   18   21 o    739.2    3.1    0.0000   0.0000          ?        ?  5465.1069  45.9736          ?        ?      739.2        3.1       ?       ? 
1 1 1   26   18   22 o    624.0    2.8    0.0000   0.0000          ?        ?  3893.7048  34.4802          ?        ?      624.0        2.8       ?       ? 
1 1 1   26   18   23 o    207.9    3.4    0.0000   0.0000          ?        ?   432.2791  14.0475          ?        ?      207.9        3.4       ?       ? 
1 1 1   26   18   24 o    837.1    3.2    0.0000   0.0000          ?        ?  7008.4131  52.9973          ?        ?      837.1        3.2       ?       ? 
1 1 1   26   18   25 o    162.6    3.9    0.0000   0.0000          ?        ?   264.3480  12.7704          ?        ?      162.6        3.9       ?       ? 
1 1 1   26   18   26 o    153.1    4.4    0.0000   0.0000          ?        ?   234.3374  13.4090          ?        ?      153.1        4.4       ?       ? 
1 1 1   26   18   27 o    528.3    2.5    0.0000   0.0000          ?        ?  2791.6167  26.8179          ?        ?      528.3        2.5       ?       ? 
1 1 1   26   18   28 o    853.0    3.2    0.0000   0.0000          ?        ?  7277.8696  54.9129          ?        ?      853.0        3.2       ?       ? 
1 1 1   26   18   29 o    462.2    2.6    0.0000   0.0000          ?        ?  2136.4934  23.6253          ?        ?      462.2        2.6       ?       ? 
1 1 1   26   18   30 o    397.5    2.7    0.0000   0.0000          ?        ?  1580.3411  21.0712          ?        ?      397.5        2.7       ?       ? 
1 1 1   26   18   31 o    115.2    6.4    0.0000   0.0000          ?        ?   132.8125  14.6860          ?        ?      115.2        6.4       ?       ? 
1 1 1   26   18   32 o    172.5    4.3    0.0000   0.0000          ?        ?   297.5511  14.6860          ?        ?      172.5        4.3       ?       ? 
1 1 1   26   18   33 o    156.5    4.9    0.0000   0.0000          ?        ?   245.1923  15.3245          ?        ?      156.5        4.9       ?       ? 
1 1 1   26   18   34 o     17.9    9.0    0.0000   0.0000          ?        ?   -41.5039  14.0475          ?        ?       17.9        9.0       ?       ? 
1 1 1   26   18   35 o     19.1    9.5    0.0000   0.0000          ?        ?   -42.7809  15.3245          ?        ?       19.1        9.5       ?       ? 
1 1 1   26   18   36 o    472.8    2.5    0.0000   0.0000          ?        ?  2235.4644  23.6253          ?        ?      472.8        2.5       ?       ? 
1 1 1   26   18   37 o    277.6    3.1    0.0000   0.0000          ?        ?   770.6956  17.2401          ?        ?      277.6        3.1       ?       ? 
1 1 1   26   18   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   18   39 o    554.5    2.7    0.0000   0.0000          ?        ?  3075.7588  30.0105          ?        ?      554.5        2.7       ?       ? 
1 1 1   26   18   40 o    184.1    4.3    0.0000   0.0000          ?        ?   339.0550  15.9630          ?        ?      184.1        4.3       ?       ? 
1 1 1   26   18   41 o     60.0   13.1    0.0000   0.0000          ?        ?    37.6728  15.3245          ?        ?       60.0       13.1       ?       ? 
1 1 1   26   18   42 o    385.2    2.7    0.0000   0.0000          ?        ?  1483.9242  20.4327          ?        ?      385.2        2.7       ?       ? 
1 1 1   26   18   43 o    332.6    2.9    0.0000   0.0000          ?        ?  1106.5580  19.1556          ?        ?      332.6        2.9       ?       ? 
1 1 1   26   18   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   18   45 o    169.2    4.9    0.0000   0.0000          ?        ?   286.6962  16.6016          ?        ?      169.2        4.9       ?       ? 
1 1 1   26   18   46 o    124.7    6.4    0.0000   0.0000          ?        ?   155.7993  15.9630          ?        ?      124.7        6.4       ?       ? 
1 1 1   26   18   47 o    471.6    2.7    0.0000   0.0000          ?        ?  2224.6094  25.5409          ?        ?      471.6        2.7       ?       ? 
1 1 1   26   18   48 o    314.0    3.1    0.0000   0.0000          ?        ?   986.5159  19.1556          ?        ?      314.0        3.1       ?       ? 
1 1 1   26   18   49 f    186.1    4.6    0.0000   0.0000          ?        ?   346.7172  17.2401          ?        ?      186.1        4.6       ?       ? 
1 1 1   26   18   50 o    178.4    4.7    0.0000   0.0000          ?        ?   318.6223  16.6016          ?        ?      178.4        4.7       ?       ? 
1 1 1   26   18   51 o    356.3    2.9    0.0000   0.0000          ?        ?  1270.0195  20.4327          ?        ?      356.3        2.9       ?       ? 
1 1 1   26   18   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   18   53 o    456.1    2.8    0.0000   0.0000          ?        ?  2080.9419  25.5409          ?        ?      456.1        2.8       ?       ? 
1 1 1   26   18   54 o    300.0    3.4    0.0000   0.0000          ?        ?   900.9540  20.4327          ?        ?      300.0        3.4       ?       ? 
1 1 1   26   18   55 o    369.6    3.0    0.0000   0.0000          ?        ?  1367.0748  22.3483          ?        ?      369.6        3.0       ?       ? 
1 1 1   26   18   56 o    200.9    4.8    0.0000   0.0000          ?        ?   404.1842  19.1556          ?        ?      200.9        4.8       ?       ? 
1 1 1   26   18   57 o    230.4    4.3    0.0000   0.0000          ?        ?   531.8885  19.7942          ?        ?      230.4        4.3       ?       ? 
1 1 1   26   18   58 o     99.7    9.6    0.0000   0.0000          ?        ?   100.2479  19.1556          ?        ?       99.7        9.6       ?       ? 
1 1 1   26   18   59 o    203.2    4.9    0.0000   0.0000          ?        ?   413.7620  19.7942          ?        ?      203.2        4.9       ?       ? 
1 1 1   26   18   60 f    215.3    4.7    0.0000   0.0000          ?        ?   464.8438  20.4327          ?        ?      215.3        4.7       ?       ? 
1 1 1   26   18   61 o     47.7   16.7    0.0000   0.0000          ?        ?    21.0712  19.7942          ?        ?       47.7       16.7       ?       ? 
1 1 1   26   18   62 o    292.7    3.5    0.0000   0.0000          ?        ?   858.1730  20.4327          ?        ?      292.7        3.5       ?       ? 
1 1 1   26   18   63 o    114.7    8.6    0.0000   0.0000          ?        ?   132.8125  19.7942          ?        ?      114.7        8.6       ?       ? 
1 1 1   26   18   64 o     47.2   16.5    0.0000   0.0000          ?        ?    21.0712  19.1556          ?        ?       47.2       16.5       ?       ? 
1 1 1   26   18   65 o    212.4    4.7    0.0000   0.0000          ?        ?   452.7119  19.7942          ?        ?      212.4        4.7       ?       ? 
1 1 1   26   18   66 o    151.5    6.3    0.0000   0.0000          ?        ?   231.1448  19.1556          ?        ?      151.5        6.3       ?       ? 
1 1 1   26   18   67 o     79.2   12.1    0.0000   0.0000          ?        ?    64.4907  19.1556          ?        ?       79.2       12.1       ?       ? 
1 1 1   26   19    0 o    481.1    5.8 2315.9180  56.1899  2315.9180  56.1899  2315.9180  56.1899      481.1      5.8      481.1        5.8     0.0     0.0 
1 1 1   26   19    1 o   1426.5    5.7    0.0000   0.0000          ?        ? 20354.7930 161.5460          ?        ?     1426.5        5.7       ?       ? 
1 1 1   26   19    2 o    182.0    4.2    0.0000   0.0000          ?        ?   331.3927  15.3245          ?        ?      182.0        4.2       ?       ? 
1 1 1   26   19    3 o    845.5    3.8    0.0000   0.0000          ?        ?  7148.8882  64.4907          ?        ?      845.5        3.8       ?       ? 
1 1 1   26   19    4 o    740.5    3.3    0.0000   0.0000          ?        ?  5483.6235  49.1662          ?        ?      740.5        3.3       ?       ? 
1 1 1   26   19    5 o    409.5    2.7    0.0000   0.0000          ?        ?  1676.7578  21.7097          ?        ?      409.5        2.7       ?       ? 
1 1 1   26   19    6 o    850.1    3.7    0.0000   0.0000          ?        ?  7227.4263  63.2136          ?        ?      850.1        3.7       ?       ? 
1 1 1   26   19    7 o    393.3    2.4    0.0000   0.0000          ?        ?  1547.1379  19.1556          ?        ?      393.3        2.4       ?       ? 
1 1 1   26   19    8 o    661.4    3.0    0.0000   0.0000          ?        ?  4374.5117  39.5883          ?        ?      661.4        3.0       ?       ? 
1 1 1   26   19    9 o    788.9    3.4    0.0000   0.0000          ?        ?  6223.6704  54.2743          ?        ?      788.9        3.4       ?       ? 
1 1 1   26   19   10 o    431.6    2.3    0.0000   0.0000          ?        ?  1863.2061  19.7942          ?        ?      431.6        2.3       ?       ? 
1 1 1   26   19   11 o    259.5    3.3    0.0000   0.0000          ?        ?   673.6403  17.2401          ?        ?      259.5        3.3       ?       ? 
1 1 1   26   19   12 o    363.2    2.9    0.0000   0.0000          ?        ?  1319.1857  21.0712          ?        ?      363.2        2.9       ?       ? 
1 1 1   26   19   13 o    437.7    2.4    0.0000   0.0000          ?        ?  1916.2035  21.0712          ?        ?      437.7        2.4       ?       ? 
1 1 1   26   19   14 f    323.0    2.5    0.0000   0.0000          ?        ?  1043.3442  15.9630          ?        ?      323.0        2.5       ?       ? 
1 1 1   26   19   15 o    805.0    3.2    0.0000   0.0000          ?        ?  6480.9946  51.0817          ?        ?      805.0        3.2       ?       ? 
1 1 1   26   19   16 o     24.7   11.1    0.0000   0.0000          ?        ?    -5.7467  11.4934          ?        ?       24.7       11.1       ?       ? 
1 1 1   26   19   17 o    588.2    2.6    0.0000   0.0000          ?        ?  3459.5100  30.6490          ?        ?      588.2        2.6       ?       ? 
1 1 1   26   19   18 o    172.9    4.1    0.0000   0.0000          ?        ?   298.8281  14.0475          ?        ?      172.9        4.1       ?       ? 
1 1 1   26   19   19 o    582.4    2.7    0.0000   0.0000          ?        ?  3391.8269  31.9261          ?        ?      582.4        2.7       ?       ? 
1 1 1   26   19   20 o   1246.1    4.5    0.0000   0.0000          ?        ? 15532.6777 111.7413          ?        ?     1246.1        4.5       ?       ? 
1 1 1   26   19   21 o    606.7    2.7    0.0000   0.0000          ?        ?  3681.7156  32.5646          ?        ?      606.7        2.7       ?       ? 
1 1 1   26   19   22 o    648.0    2.9    0.0000   0.0000          ?        ?  4198.9180  37.6728          ?        ?      648.0        2.9       ?       ? 
1 1 1   26   19   23 o    421.1    2.4    0.0000   0.0000          ?        ?  1773.1747  20.4327          ?        ?      421.1        2.4       ?       ? 
1 1 1   26   19   24 f    706.2    3.0    0.0000   0.0000          ?        ?  4987.4922  42.1424          ?        ?      706.2        3.0       ?       ? 
1 1 1   26   19   25 o    297.4    2.7    0.0000   0.0000          ?        ?   884.3525  15.9630          ?        ?      297.4        2.7       ?       ? 
1 1 1   26   19   26 o    715.1    3.0    0.0000   0.0000          ?        ?  5114.5581  42.7809          ?        ?      715.1        3.0       ?       ? 
1 1 1   26   19   27 o    171.0    4.1    0.0000   0.0000          ?        ?   292.4429  14.0475          ?        ?      171.0        4.1       ?       ? 
1 1 1   26   19   28 o    183.8    3.8    0.0000   0.0000          ?        ?   337.7780  14.0475          ?        ?      183.8        3.8       ?       ? 
1 1 1   26   19   29 o    303.2    2.7    0.0000   0.0000          ?        ?   919.4711  16.6016          ?        ?      303.2        2.7       ?       ? 
1 1 1   26   19   30 o    610.1    2.8    0.0000   0.0000          ?        ?  3722.5811  33.8416          ?        ?      610.1        2.8       ?       ? 
1 1 1   26   19   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   19   32 o    291.5    3.0    0.0000   0.0000          ?        ?   849.8723  17.2401          ?        ?      291.5        3.0       ?       ? 
1 1 1   26   19   33 o     41.5   14.1    0.0000   0.0000          ?        ?    15.9630  14.0475          ?        ?       41.5       14.1       ?       ? 
1 1 1   26   19   34 o     98.1    7.2    0.0000   0.0000          ?        ?    96.4168  14.0475          ?        ?       98.1        7.2       ?       ? 
1 1 1   26   19   35 o     94.8    8.1    0.0000   0.0000          ?        ?    90.0316  15.3245          ?        ?       94.8        8.1       ?       ? 
1 1 1   26   19   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   19   37 o     36.1   14.3    0.0000   0.0000          ?        ?     7.0237  15.3245          ?        ?       36.1       14.3       ?       ? 
1 1 1   26   19   38 o     97.4    7.9    0.0000   0.0000          ?        ?    95.1397  15.3245          ?        ?       97.4        7.9       ?       ? 
1 1 1   26   19   39 o    166.0    4.4    0.0000   0.0000          ?        ?   275.8413  14.6860          ?        ?      166.0        4.4       ?       ? 
1 1 1   26   19   40 o    104.7    7.3    0.0000   0.0000          ?        ?   109.8257  15.3245          ?        ?      104.7        7.3       ?       ? 
1 1 1   26   19   41 o    524.9    2.5    0.0000   0.0000          ?        ?  2755.8594  26.1794          ?        ?      524.9        2.5       ?       ? 
1 1 1   26   19   42 o     83.3   10.0    0.0000   0.0000          ?        ?    69.5989  16.6016          ?        ?       83.3       10.0       ?       ? 
1 1 1   26   19   43 o    634.5    2.8    0.0000   0.0000          ?        ?  4027.1560  35.7572          ?        ?      634.5        2.8       ?       ? 
1 1 1   26   19   44 o    524.7    2.8    0.0000   0.0000          ?        ?  2753.9436  29.3720          ?        ?      524.7        2.8       ?       ? 
1 1 1   26   19   45 o     90.2    8.8    0.0000   0.0000          ?        ?    81.7308  15.9630          ?        ?       90.2        8.8       ?       ? 
1 1 1   26   19   46 o    462.1    2.7    0.0000   0.0000          ?        ?  2136.4934  24.9023          ?        ?      462.1        2.7       ?       ? 
1 1 1   26   19   47 o    125.2    6.6    0.0000   0.0000          ?        ?   157.0763  16.6016          ?        ?      125.2        6.6       ?       ? 
1 1 1   26   19   48 o    294.1    3.1    0.0000   0.0000          ?        ?   865.1968  18.5171          ?        ?      294.1        3.1       ?       ? 
1 1 1   26   19   49 o     25.4   12.2    0.0000   0.0000          ?        ?   -22.9868  17.2401          ?        ?       25.4       12.2       ?       ? 
1 1 1   26   19   50 o    199.0    4.5    0.0000   0.0000          ?        ?   396.5219  17.8786          ?        ?      199.0        4.5       ?       ? 
1 1 1   26   19   51 o    387.5    2.7    0.0000   0.0000          ?        ?  1502.4414  21.0712          ?        ?      387.5        2.7       ?       ? 
1 1 1   26   19   52 o    253.1    3.7    0.0000   0.0000          ?        ?   641.0757  18.5171          ?        ?      253.1        3.7       ?       ? 
1 1 1   26   19   53 o    280.6    3.6    0.0000   0.0000          ?        ?   787.9357  20.4327          ?        ?      280.6        3.6       ?       ? 
1 1 1   26   19   54 o    308.8    3.3    0.0000   0.0000          ?        ?   954.5898  20.4327          ?        ?      308.8        3.3       ?       ? 
1 1 1   26   19   55 o    203.1    4.7    0.0000   0.0000          ?        ?   413.1235  19.1556          ?        ?      203.1        4.7       ?       ? 
1 1 1   26   19   56 o     26.2   12.6    0.0000   0.0000          ?        ?   -24.9023  18.5171          ?        ?       26.2       12.6       ?       ? 
1 1 1   26   19   57 o    348.0    3.0    0.0000   0.0000          ?        ?  1211.9141  21.0712          ?        ?      348.0        3.0       ?       ? 
1 1 1   26   19   58 o    333.7    3.3    0.0000   0.0000          ?        ?  1114.8588  21.7097          ?        ?      333.7        3.3       ?       ? 
1 1 1   26   19   59 o    285.2    3.7    0.0000   0.0000          ?        ?   814.7536  21.0712          ?        ?      285.2        3.7       ?       ? 
1 1 1   26   19   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   19   61 o     51.8   17.0    0.0000   0.0000          ?        ?    26.8179  20.4327          ?        ?       51.8       17.0       ?       ? 
1 1 1   26   19   62 o    134.9    7.1    0.0000   0.0000          ?        ?   183.2557  19.1556          ?        ?      134.9        7.1       ?       ? 
1 1 1   26   19   63 o    278.6    3.7    0.0000   0.0000          ?        ?   777.7194  20.4327          ?        ?      278.6        3.7       ?       ? 
1 1 1   26   19   64 o    226.8    4.4    0.0000   0.0000          ?        ?   515.9255  19.7942          ?        ?      226.8        4.4       ?       ? 
1 1 1   26   19   65 o     36.1   15.4    0.0000   0.0000          ?        ?     0.6385  19.7942          ?        ?       36.1       15.4       ?       ? 
1 1 1   26   19   66 o     32.7   14.5    0.0000   0.0000          ?        ?    -5.7467  19.1556          ?        ?       32.7       14.5       ?       ? 
1 1 1   26   20    0 o    782.6    4.9 6126.6152  77.2611  6126.6152  77.2611  6126.6152  77.2611      782.6      4.9      782.6        4.9     0.0     0.0 
1 1 1   26   20    1 o    703.0    3.4    0.0000   0.0000          ?        ?  4942.7959  47.8891          ?        ?      703.0        3.4       ?       ? 
1 1 1   26   20    2 f    547.0    3.2    0.0000   0.0000          ?        ?  2992.1123  34.4802          ?        ?      547.0        3.2       ?       ? 
1 1 1   26   20    3 o    410.8    2.8    0.0000   0.0000          ?        ?  1687.6125  22.9868          ?        ?      410.8        2.8       ?       ? 
1 1 1   26   20    4 o    423.6    2.5    0.0000   0.0000          ?        ?  1794.2457  21.0712          ?        ?      423.6        2.5       ?       ? 
1 1 1   26   20    5 o    370.8    2.8    0.0000   0.0000          ?        ?  1374.7371  21.0712          ?        ?      370.8        2.8       ?       ? 
1 1 1   26   20    6 o    210.3    2.9    0.0000   0.0000          ?        ?   442.4955  12.1319          ?        ?      210.3        2.9       ?       ? 
1 1 1   26   20    7 o    802.6    3.1    0.0000   0.0000          ?        ?  6442.6831  50.4432          ?        ?      802.6        3.1       ?       ? 
1 1 1   26   20    8 o    512.8    2.6    0.0000   0.0000          ?        ?  2630.0706  26.1794          ?        ?      512.8        2.6       ?       ? 
1 1 1   26   20    9 o    701.5    3.0    0.0000   0.0000          ?        ?  4921.7246  42.7809          ?        ?      701.5        3.0       ?       ? 
1 1 1   26   20   10 o    813.8    3.2    0.0000   0.0000          ?        ?  6622.7461  52.3588          ?        ?      813.8        3.2       ?       ? 
1 1 1   26   20   11 o   1170.8    4.1    0.0000   0.0000          ?        ? 13709.0596  95.1397          ?        ?     1170.8        4.1       ?       ? 
1 1 1   26   20   12 o    871.5    3.3    0.0000   0.0000          ?        ?  7595.2148  56.8284          ?        ?      871.5        3.3       ?       ? 
1 1 1   26   20   13 f    318.4    2.2    0.0000   0.0000          ?        ?  1013.9724  14.0475          ?        ?      318.4        2.2       ?       ? 
1 1 1   26   20   14 f    645.1    2.7    0.0000   0.0000          ?        ?  4161.8838  34.4802          ?        ?      645.1        2.7       ?       ? 
1 1 1   26   20   15 o    207.8    2.8    0.0000   0.0000          ?        ?   431.6406  11.4934          ?        ?      207.8        2.8       ?       ? 
1 1 1   26   20   16 o    969.9    3.6    0.0000   0.0000          ?        ?  9407.9775  69.5989          ?        ?      969.9        3.6       ?       ? 
1 1 1   26   20   17 o    561.7    2.4    0.0000   0.0000          ?        ?  3154.9353  27.4564          ?        ?      561.7        2.4       ?       ? 
1 1 1   26   20   18 o    881.7    3.3    0.0000   0.0000          ?        ?  7775.9165  58.7440          ?        ?      881.7        3.3       ?       ? 
1 1 1   26   20   19 o    340.4    2.5    0.0000   0.0000          ?        ?  1158.9167  17.2401          ?        ?      340.4        2.5       ?       ? 
1 1 1   26   20   20 o    135.1    4.7    0.0000   0.0000          ?        ?   182.6172  12.7704          ?        ?      135.1        4.7       ?       ? 
1 1 1   26   20   21 o    336.9    2.5    0.0000   0.0000          ?        ?  1135.2915  16.6016          ?        ?      336.9        2.5       ?       ? 
1 1 1   26   20   22 o    757.8    3.0    0.0000   0.0000          ?        ?  5743.5020  45.3350          ?        ?      757.8        3.0       ?       ? 
1 1 1   26   20   23 o    225.1    3.0    0.0000   0.0000          ?        ?   506.9862  13.4090          ?        ?      225.1        3.0       ?       ? 
1 1 1   26   20   24 o    119.6    5.1    0.0000   0.0000          ?        ?   143.0288  12.1319          ?        ?      119.6        5.1       ?       ? 
1 1 1   26   20   25 o    102.9    6.5    0.0000   0.0000          ?        ?   105.9946  13.4090          ?        ?      102.9        6.5       ?       ? 
1 1 1   26   20   26 o    292.2    2.6    0.0000   0.0000          ?        ?   853.7034  15.3245          ?        ?      292.2        2.6       ?       ? 
1 1 1   26   20   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   20   28 o    526.1    2.6    0.0000   0.0000          ?        ?  2767.9912  27.4564          ?        ?      526.1        2.6       ?       ? 
1 1 1   26   20   29 o    505.5    2.8    0.0000   0.0000          ?        ?  2556.0020  28.0950          ?        ?      505.5        2.8       ?       ? 
1 1 1   26   20   30 o    398.5    2.7    0.0000   0.0000          ?        ?  1588.0033  21.7097          ?        ?      398.5        2.7       ?       ? 
1 1 1   26   20   31 o    140.6    5.2    0.0000   0.0000          ?        ?   197.9417  14.6860          ?        ?      140.6        5.2       ?       ? 
1 1 1   26   20   32 o    435.7    2.6    0.0000   0.0000          ?        ?  1898.3247  22.9868          ?        ?      435.7        2.6       ?       ? 
1 1 1   26   20   33 o    191.1    3.8    0.0000   0.0000          ?        ?   365.2344  14.6860          ?        ?      191.1        3.8       ?       ? 
1 1 1   26   20   34 o    321.8    2.9    0.0000   0.0000          ?        ?  1035.6820  18.5171          ?        ?      321.8        2.9       ?       ? 
1 1 1   26   20   35 o    171.9    4.6    0.0000   0.0000          ?        ?   295.6355  15.9630          ?        ?      171.9        4.6       ?       ? 
1 1 1   26   20   36 o    482.1    2.6    0.0000   0.0000          ?        ?  2324.8572  25.5409          ?        ?      482.1        2.6       ?       ? 
1 1 1   26   20   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   20   38 o    201.6    4.1    0.0000   0.0000          ?        ?   406.7383  16.6016          ?        ?      201.6        4.1       ?       ? 
1 1 1   26   20   39 o    110.3    7.2    0.0000   0.0000          ?        ?   121.9576  15.9630          ?        ?      110.3        7.2       ?       ? 
1 1 1   26   20   40 o    438.1    2.6    0.0000   0.0000          ?        ?  1920.0347  22.9868          ?        ?      438.1        2.6       ?       ? 
1 1 1   26   20   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   20   42 o    478.4    2.7    0.0000   0.0000          ?        ?  2289.7385  25.5409          ?        ?      478.4        2.7       ?       ? 
1 1 1   26   20   43 o    637.3    2.8    0.0000   0.0000          ?        ?  4062.9131  35.1187          ?        ?      637.3        2.8       ?       ? 
1 1 1   26   20   44 o    215.8    3.8    0.0000   0.0000          ?        ?   466.1208  16.6016          ?        ?      215.8        3.8       ?       ? 
1 1 1   26   20   45 o    304.7    3.1    0.0000   0.0000          ?        ?   929.0490  19.1556          ?        ?      304.7        3.1       ?       ? 
1 1 1   26   20   46 o    224.1    3.8    0.0000   0.0000          ?        ?   502.5165  17.2401          ?        ?      224.1        3.8       ?       ? 
1 1 1   26   20   47 o    114.8    7.2    0.0000   0.0000          ?        ?   132.1740  16.6016          ?        ?      114.8        7.2       ?       ? 
1 1 1   26   20   48 o    143.2    6.0    0.0000   0.0000          ?        ?   205.6040  17.2401          ?        ?      143.2        6.0       ?       ? 
1 1 1   26   20   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   20   50 o     18.6    9.4    0.0000   0.0000          ?        ?   -59.3825  17.2401          ?        ?       18.6        9.4       ?       ? 
1 1 1   26   20   51 o    129.1    6.9    0.0000   0.0000          ?        ?   167.2927  17.8786          ?        ?      129.1        6.9       ?       ? 
1 1 1   26   20   52 o    395.8    2.8    0.0000   0.0000          ?        ?  1567.5706  22.3483          ?        ?      395.8        2.8       ?       ? 
1 1 1   26   20   53 o     97.5    9.5    0.0000   0.0000          ?        ?    95.7782  18.5171          ?        ?       97.5        9.5       ?       ? 
1 1 1   26   20   54 o    140.5    6.4    0.0000   0.0000          ?        ?   197.9417  17.8786          ?        ?      140.5        6.4       ?       ? 
1 1 1   26   20   55 o    215.7    4.3    0.0000   0.0000          ?        ?   466.1208  18.5171          ?        ?      215.7        4.3       ?       ? 
1 1 1   26   20   56 o    174.1    5.7    0.0000   0.0000          ?        ?   303.9363  19.7942          ?        ?      174.1        5.7       ?       ? 
1 1 1   26   20   57 o    245.9    3.9    0.0000   0.0000          ?        ?   605.3185  19.1556          ?        ?      245.9        3.9       ?       ? 
1 1 1   26   20   58 f     22.5   11.2    0.0000   0.0000          ?        ?   -45.3350  19.1556          ?        ?       22.5       11.2       ?       ? 
1 1 1   26   20   59 o    186.1    5.5    0.0000   0.0000          ?        ?   347.3558  20.4327          ?        ?      186.1        5.5       ?       ? 
1 1 1   26   20   60 o    205.6    4.8    0.0000   0.0000          ?        ?   423.9784  19.7942          ?        ?      205.6        4.8       ?       ? 
1 1 1   26   20   61 o     31.9   14.5    0.0000   0.0000          ?        ?   -10.2163  19.7942          ?        ?       31.9       14.5       ?       ? 
1 1 1   26   20   62 o     45.9   16.7    0.0000   0.0000          ?        ?    18.5171  19.7942          ?        ?       45.9       16.7       ?       ? 
1 1 1   26   20   63 o     80.9   12.6    0.0000   0.0000          ?        ?    67.0448  20.4327          ?        ?       80.9       12.6       ?       ? 
1 1 1   26   20   64 f     41.2   16.3    0.0000   0.0000          ?        ?    10.8549  19.7942          ?        ?       41.2       16.3       ?       ? 
1 1 1   26   20   65 o    142.8    6.7    0.0000   0.0000          ?        ?   205.6040  19.1556          ?        ?      142.8        6.7       ?       ? 
1 1 1   26   20   66 o    141.3    7.0    0.0000   0.0000          ?        ?   201.7728  19.7942          ?        ?      141.3        7.0       ?       ? 
1 1 1   26   21    0 f    313.7    4.9  984.6003  30.6490   984.6003  30.6490   984.6003  30.6490      313.7      4.9      313.7        4.9     0.0     0.0 
1 1 1   26   21    1 o     26.6   12.7    0.0000   0.0000          ?        ?   -26.8179  19.1556          ?        ?       26.6       12.7       ?       ? 
1 1 1   26   21    2 o    803.4    3.7    0.0000   0.0000          ?        ?  6456.0918  59.3825          ?        ?      803.4        3.7       ?       ? 
1 1 1   26   21    3 o    645.8    3.4    0.0000   0.0000          ?        ?  4171.4619  43.4195          ?        ?      645.8        3.4       ?       ? 
1 1 1   26   21    4 o    482.3    2.8    0.0000   0.0000          ?        ?  2326.1343  27.4564          ?        ?      482.3        2.8       ?       ? 
1 1 1   26   21    5 f    506.0    2.8    0.0000   0.0000          ?        ?  2560.4717  28.7335          ?        ?      506.0        2.8       ?       ? 
1 1 1   26   21    6 o    514.2    2.7    0.0000   0.0000          ?        ?  2644.1182  28.0950          ?        ?      514.2        2.7       ?       ? 
1 1 1   26   21    7 o    916.3    3.7    0.0000   0.0000          ?        ?  8396.5596  67.0448          ?        ?      916.3        3.7       ?       ? 
1 1 1   26   21    8 o     30.8   10.8    0.0000   0.0000          ?        ?     8.3008   8.3008          ?        ?       30.8       10.8       ?       ? 
1 1 1   26   21    9 f    611.5    2.7    0.0000   0.0000          ?        ?  3739.1824  32.5646          ?        ?      611.5        2.7       ?       ? 
1 1 1   26   21   10 o    408.8    2.5    0.0000   0.0000          ?        ?  1671.0112  20.4327          ?        ?      408.8        2.5       ?       ? 
1 1 1   26   21   11 f    788.4    3.0    0.0000   0.0000          ?        ?  6216.0078  46.6121          ?        ?      788.4        3.0       ?       ? 
1 1 1   26   21   12 o    499.6    2.2    0.0000   0.0000          ?        ?  2495.9810  22.3483          ?        ?      499.6        2.2       ?       ? 
1 1 1   26   21   13 o    177.4    2.7    0.0000   0.0000          ?        ?   314.7912   9.5778          ?        ?      177.4        2.7       ?       ? 
1 1 1   26   21   14 o    845.3    3.2    0.0000   0.0000          ?        ?  7146.3335  54.2743          ?        ?      845.3        3.2       ?       ? 
1 1 1   26   21   15 o    489.1    2.5    0.0000   0.0000          ?        ?  2391.9021  24.2638          ?        ?      489.1        2.5       ?       ? 
1 1 1   26   21   16 o    701.8    2.7    0.0000   0.0000          ?        ?  4926.1943  38.3113          ?        ?      701.8        2.7       ?       ? 
1 1 1   26   21   17 o    567.4    2.5    0.0000   0.0000          ?        ?  3220.0645  28.0950          ?        ?      567.4        2.5       ?       ? 
1 1 1   26   21   18 o    438.7    2.3    0.0000   0.0000          ?        ?  1925.1427  20.4327          ?        ?      438.7        2.3       ?       ? 
1 1 1   26   21   19 o    596.3    2.6    0.0000   0.0000          ?        ?  3556.5654  30.6490          ?        ?      596.3        2.6       ?       ? 
1 1 1   26   21   20 o    387.2    2.4    0.0000   0.0000          ?        ?  1499.2488  18.5171          ?        ?      387.2        2.4       ?       ? 
1 1 1   26   21   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   21   22 o    240.0    2.8    0.0000   0.0000          ?        ?   575.9465  13.4090          ?        ?      240.0        2.8       ?       ? 
1 1 1   26   21   23 f    556.2    2.6    0.0000   0.0000          ?        ?  3093.6372  29.3720          ?        ?      556.2        2.6       ?       ? 
1 1 1   26   21   24 o    507.3    2.5    0.0000   0.0000          ?        ?  2573.8806  25.5409          ?        ?      507.3        2.5       ?       ? 
1 1 1   26   21   25 o    244.5    2.7    0.0000   0.0000          ?        ?   597.6562  13.4090          ?        ?      244.5        2.7       ?       ? 
1 1 1   26   21   26 o    460.6    2.5    0.0000   0.0000          ?        ?  2121.8074  22.9868          ?        ?      460.6        2.5       ?       ? 
1 1 1   26   21   27 o    502.6    2.5    0.0000   0.0000          ?        ?  2526.6301  25.5409          ?        ?      502.6        2.5       ?       ? 
1 1 1   26   21   28 o    389.7    2.5    0.0000   0.0000          ?        ?  1519.0430  19.1556          ?        ?      389.7        2.5       ?       ? 
1 1 1   26   21   29 o    338.7    2.5    0.0000   0.0000          ?        ?  1147.4233  17.2401          ?        ?      338.7        2.5       ?       ? 
1 1 1   26   21   30 o    424.2    2.6    0.0000   0.0000          ?        ?  1799.9924  22.3483          ?        ?      424.2        2.6       ?       ? 
1 1 1   26   21   31 o    387.4    2.6    0.0000   0.0000          ?        ?  1501.1644  19.7942          ?        ?      387.4        2.6       ?       ? 
1 1 1   26   21   32 o    495.1    2.8    0.0000   0.0000          ?        ?  2451.9231  28.0950          ?        ?      495.1        2.8       ?       ? 
1 1 1   26   21   33 o    511.0    2.7    0.0000   0.0000          ?        ?  2612.1919  27.4564          ?        ?      511.0        2.7       ?       ? 
1 1 1   26   21   34 o    679.5    3.1    0.0000   0.0000          ?        ?  4618.4268  41.5039          ?        ?      679.5        3.1       ?       ? 
1 1 1   26   21   35 o    371.8    2.7    0.0000   0.0000          ?        ?  1382.3993  20.4327          ?        ?      371.8        2.7       ?       ? 
1 1 1   26   21   36 o    594.3    2.8    0.0000   0.0000          ?        ?  3532.3018  33.2031          ?        ?      594.3        2.8       ?       ? 
1 1 1   26   21   37 o     19.3    9.6    0.0000   0.0000          ?        ?   -45.9736  15.9630          ?        ?       19.3        9.6       ?       ? 
1 1 1   26   21   38 o    146.6    5.0    0.0000   0.0000          ?        ?   215.1818  14.6860          ?        ?      146.6        5.0       ?       ? 
1 1 1   26   21   39 o    474.6    2.6    0.0000   0.0000          ?        ?  2253.3428  24.2638          ?        ?      474.6        2.6       ?       ? 
1 1 1   26   21   40 o    270.9    3.2    0.0000   0.0000          ?        ?   734.2999  17.2401          ?        ?      270.9        3.2       ?       ? 
1 1 1   26   21   41 o    701.6    3.0    0.0000   0.0000          ?        ?  4923.6401  41.5039          ?        ?      701.6        3.0       ?       ? 
1 1 1   26   21   42 o    220.9    3.9    0.0000   0.0000          ?        ?   488.4691  17.2401          ?        ?      220.9        3.9       ?       ? 
1 1 1   26   21   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   21   44 o    595.6    2.7    0.0000   0.0000          ?        ?  3548.2646  32.5646          ?        ?      595.6        2.7       ?       ? 
1 1 1   26   21   45 o     19.7    9.8    0.0000   0.0000          ?        ?   -43.4195  15.9630          ?        ?       19.7        9.8       ?       ? 
1 1 1   26   21   46 o    274.3    3.4    0.0000   0.0000          ?        ?   752.8170  18.5171          ?        ?      274.3        3.4       ?       ? 
1 1 1   26   21   47 o    219.7    4.1    0.0000   0.0000          ?        ?   483.3608  17.8786          ?        ?      219.7        4.1       ?       ? 
1 1 1   26   21   48 o    121.5    7.1    0.0000   0.0000          ?        ?   148.1370  17.2401          ?        ?      121.5        7.1       ?       ? 
1 1 1   26   21   49 o     20.8   10.4    0.0000   0.0000          ?        ?   -48.5276  17.8786          ?        ?       20.8       10.4       ?       ? 
1 1 1   26   21   50 f     94.6    9.4    0.0000   0.0000          ?        ?    90.0316  17.8786          ?        ?       94.6        9.4       ?       ? 
1 1 1   26   21   51 o     25.3   12.1    0.0000   0.0000          ?        ?   -26.1794  17.8786          ?        ?       25.3       12.1       ?       ? 
1 1 1   26   21   52 o    367.6    3.0    0.0000   0.0000          ?        ?  1352.3888  22.3483          ?        ?      367.6        3.0       ?       ? 
1 1 1   26   21   53 o    213.5    4.3    0.0000   0.0000          ?        ?   456.5430  18.5171          ?        ?      213.5        4.3       ?       ? 
1 1 1   26   21   54 o    116.6    7.9    0.0000   0.0000          ?        ?   136.6436  18.5171          ?        ?      116.6        7.9       ?       ? 
1 1 1   26   21   55 f     65.0   14.6    0.0000   0.0000          ?        ?    44.6965  18.5171          ?        ?       65.0       14.6       ?       ? 
1 1 1   26   21   56 f    185.1    5.3    0.0000   0.0000          ?        ?   343.5246  19.7942          ?        ?      185.1        5.3       ?       ? 
1 1 1   26   21   57 o     29.3   13.7    0.0000   0.0000          ?        ?   -18.5171  19.7942          ?        ?       29.3       13.7       ?       ? 
1 1 1   26   21   58 o    194.0    4.9    0.0000   0.0000          ?        ?   377.3663  19.1556          ?        ?      194.0        4.9       ?       ? 
1 1 1   26   21   59 o    133.8    7.4    0.0000   0.0000          ?        ?   180.0631  19.7942          ?        ?      133.8        7.4       ?       ? 
1 1 1   26   21   60 o     25.1   12.2    0.0000   0.0000          ?        ?   -35.1187  19.7942          ?        ?       25.1       12.2       ?       ? 
1 1 1   26   21   61 o    279.7    3.8    0.0000   0.0000          ?        ?   784.1046  21.0712          ?        ?      279.7        3.8       ?       ? 
1 1 1   26   21   62 o    216.6    4.6    0.0000   0.0000          ?        ?   470.5904  19.7942          ?        ?      216.6        4.6       ?       ? 
1 1 1   26   21   63 o    229.6    4.3    0.0000   0.0000          ?        ?   528.6959  19.7942          ?        ?      229.6        4.3       ?       ? 
1 1 1   26   21   64 o    221.8    4.5    0.0000   0.0000          ?        ?   493.5772  19.7942          ?        ?      221.8        4.5       ?       ? 
1 1 1   26   21   65 o     75.1   12.3    0.0000   0.0000          ?        ?    58.1055  18.5171          ?        ?       75.1       12.3       ?       ? 
1 1 1   26   22    0 o    627.7    4.9 3941.5940  61.9366  3941.5940  61.9366  3941.5940  61.9366      627.7      4.9      627.7        4.9     0.0     0.0 
1 1 1   26   22    1 o    499.7    3.0    0.0000   0.0000          ?        ?  2497.2581  30.0105          ?        ?      499.7        3.0       ?       ? 
1 1 1   26   22    2 o    396.5    2.9    0.0000   0.0000          ?        ?  1572.0403  22.9868          ?        ?      396.5        2.9       ?       ? 
1 1 1   26   22    3 o    251.9    3.4    0.0000   0.0000          ?        ?   634.6905  17.2401          ?        ?      251.9        3.4       ?       ? 
1 1 1   26   22    4 o    390.3    3.0    0.0000   0.0000          ?        ?  1523.5127  23.6253          ?        ?      390.3        3.0       ?       ? 
1 1 1   26   22    5 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   22    6 o    364.6    2.7    0.0000   0.0000          ?        ?  1329.4020  19.7942          ?        ?      364.6        2.7       ?       ? 
1 1 1   26   22    7 o    730.9    3.4    0.0000   0.0000          ?        ?  5343.1489  49.1662          ?        ?      730.9        3.4       ?       ? 
1 1 1   26   22    8 o    457.7    2.3    0.0000   0.0000          ?        ?  2094.9895  21.0712          ?        ?      457.7        2.3       ?       ? 
1 1 1   26   22    9 o    534.1    2.5    0.0000   0.0000          ?        ?  2852.9146  26.8179          ?        ?      534.1        2.5       ?       ? 
1 1 1   26   22   10 o    481.6    2.4    0.0000   0.0000          ?        ?  2319.7490  22.9868          ?        ?      481.6        2.4       ?       ? 
1 1 1   26   22   11 o    542.6    2.4    0.0000   0.0000          ?        ?  2944.8618  25.5409          ?        ?      542.6        2.4       ?       ? 
1 1 1   26   22   12 o    352.8    2.3    0.0000   0.0000          ?        ?  1244.4786  15.9630          ?        ?      352.8        2.3       ?       ? 
1 1 1   26   22   13 o     34.6   11.3    0.0000   0.0000          ?        ?    11.4934   8.9393          ?        ?       34.6       11.3       ?       ? 
1 1 1   26   22   14 o    313.8    2.3    0.0000   0.0000          ?        ?   984.6003  14.6860          ?        ?      313.8        2.3       ?       ? 
1 1 1   26   22   15 o    261.3    2.4    0.0000   0.0000          ?        ?   682.5797  12.7704          ?        ?      261.3        2.4       ?       ? 
1 1 1   26   22   16 f    544.5    2.5    0.0000   0.0000          ?        ?  2965.2944  26.8179          ?        ?      544.5        2.5       ?       ? 
1 1 1   26   22   17 o    737.9    2.9    0.0000   0.0000          ?        ?  5445.9512  42.1424          ?        ?      737.9        2.9       ?       ? 
1 1 1   26   22   18 o    116.3    4.7    0.0000   0.0000          ?        ?   135.3666  10.8549          ?        ?      116.3        4.7       ?       ? 
1 1 1   26   22   19 o    493.5    2.3    0.0000   0.0000          ?        ?  2435.9600  22.9868          ?        ?      493.5        2.3       ?       ? 
1 1 1   26   22   20 o    557.0    2.5    0.0000   0.0000          ?        ?  3103.2151  28.0950          ?        ?      557.0        2.5       ?       ? 
1 1 1   26   22   21 o    717.0    2.8    0.0000   0.0000          ?        ?  5141.3760  40.2269          ?        ?      717.0        2.8       ?       ? 
1 1 1   26   22   22 o    577.4    2.5    0.0000   0.0000          ?        ?  3334.3601  29.3720          ?        ?      577.4        2.5       ?       ? 
1 1 1   26   22   23 o    338.2    2.4    0.0000   0.0000          ?        ?  1144.2307  15.9630          ?        ?      338.2        2.4       ?       ? 
1 1 1   26   22   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   22   25 o    433.9    2.5    0.0000   0.0000          ?        ?  1883.0002  21.7097          ?        ?      433.9        2.5       ?       ? 
1 1 1   26   22   26 o    620.7    2.6    0.0000   0.0000          ?        ?  3852.8396  32.5646          ?        ?      620.7        2.6       ?       ? 
1 1 1   26   22   27 o    493.1    2.5    0.0000   0.0000          ?        ?  2431.4902  24.9023          ?        ?      493.1        2.5       ?       ? 
1 1 1   26   22   28 o    510.1    2.5    0.0000   0.0000          ?        ?  2601.9756  25.5409          ?        ?      510.1        2.5       ?       ? 
1 1 1   26   22   29 o    471.1    2.5    0.0000   0.0000          ?        ?  2220.1399  23.6253          ?        ?      471.1        2.5       ?       ? 
1 1 1   26   22   30 o    402.2    2.7    0.0000   0.0000          ?        ?  1618.0138  21.7097          ?        ?      402.2        2.7       ?       ? 
1 1 1   26   22   31 o    511.5    2.6    0.0000   0.0000          ?        ?  2616.6616  26.8179          ?        ?      511.5        2.6       ?       ? 
1 1 1   26   22   32 o     69.5   10.6    0.0000   0.0000          ?        ?    48.5276  14.6860          ?        ?       69.5       10.6       ?       ? 
1 1 1   26   22   33 o    443.1    2.5    0.0000   0.0000          ?        ?  1964.0925  22.3483          ?        ?      443.1        2.5       ?       ? 
1 1 1   26   22   34 o    537.3    2.7    0.0000   0.0000          ?        ?  2888.0332  29.3720          ?        ?      537.3        2.7       ?       ? 
1 1 1   26   22   35 o    464.6    2.6    0.0000   0.0000          ?        ?  2158.8416  24.2638          ?        ?      464.6        2.6       ?       ? 
1 1 1   26   22   36 o    642.5    2.9    0.0000   0.0000          ?        ?  4128.6807  37.0343          ?        ?      642.5        2.9       ?       ? 
1 1 1   26   22   37 o    265.0    3.5    0.0000   0.0000          ?        ?   702.3738  18.5171          ?        ?      265.0        3.5       ?       ? 
1 1 1   26   22   38 o    521.6    2.8    0.0000   0.0000          ?        ?  2722.0176  29.3720          ?        ?      521.6        2.8       ?       ? 
1 1 1   26   22   39 o    374.8    2.8    0.0000   0.0000          ?        ?  1405.3861  21.0712          ?        ?      374.8        2.8       ?       ? 
1 1 1   26   22   40 o    405.5    2.8    0.0000   0.0000          ?        ?  1644.8318  22.9868          ?        ?      405.5        2.8       ?       ? 
1 1 1   26   22   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   22   42 o    194.5    4.4    0.0000   0.0000          ?        ?   378.6433  17.2401          ?        ?      194.5        4.4       ?       ? 
1 1 1   26   22   43 o     26.5   12.5    0.0000   0.0000          ?        ?   -19.1556  17.2401          ?        ?       26.5       12.5       ?       ? 
1 1 1   26   22   44 o    422.2    2.6    0.0000   0.0000          ?        ?  1783.3909  22.3483          ?        ?      422.2        2.6       ?       ? 
1 1 1   26   22   45 o    276.1    3.4    0.0000   0.0000          ?        ?   763.0333  18.5171          ?        ?      276.1        3.4       ?       ? 
1 1 1   26   22   46 o    276.3    3.2    0.0000   0.0000          ?        ?   763.6719  17.8786          ?        ?      276.3        3.2       ?       ? 
1 1 1   26   22   47 o    234.2    3.8    0.0000   0.0000          ?        ?   549.1286  17.8786          ?        ?      234.2        3.8       ?       ? 
1 1 1   26   22   48 o     75.1   11.5    0.0000   0.0000          ?        ?    56.8284  17.2401          ?        ?       75.1       11.5       ?       ? 
1 1 1   26   22   49 o    211.0    4.4    0.0000   0.0000          ?        ?   445.6881  18.5171          ?        ?      211.0        4.4       ?       ? 
1 1 1   26   22   50 o    249.4    4.0    0.0000   0.0000          ?        ?   622.5586  19.7942          ?        ?      249.4        4.0       ?       ? 
1 1 1   26   22   51 o    254.7    3.8    0.0000   0.0000          ?        ?   649.3765  19.1556          ?        ?      254.7        3.8       ?       ? 
1 1 1   26   22   52 o     19.9   10.0    0.0000   0.0000          ?        ?   -49.8047  17.2401          ?        ?       19.9       10.0       ?       ? 
1 1 1   26   22   53 o     48.0   15.9    0.0000   0.0000          ?        ?    22.3483  17.8786          ?        ?       48.0       15.9       ?       ? 
1 1 1   26   22   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   22   55 o    400.4    2.9    0.0000   0.0000          ?        ?  1604.6049  22.9868          ?        ?      400.4        2.9       ?       ? 
1 1 1   26   22   56 o    120.8    7.9    0.0000   0.0000          ?        ?   146.8600  19.1556          ?        ?      120.8        7.9       ?       ? 
1 1 1   26   22   57 o    110.9    8.4    0.0000   0.0000          ?        ?   123.8732  18.5171          ?        ?      110.9        8.4       ?       ? 
1 1 1   26   22   58 o    123.1    7.8    0.0000   0.0000          ?        ?   152.6067  19.1556          ?        ?      123.1        7.8       ?       ? 
1 1 1   26   22   59 o    193.4    5.1    0.0000   0.0000          ?        ?   375.4507  19.7942          ?        ?      193.4        5.1       ?       ? 
1 1 1   26   22   60 o    270.0    3.9    0.0000   0.0000          ?        ?   730.4688  21.0712          ?        ?      270.0        3.9       ?       ? 
1 1 1   26   22   61 o    123.7    7.7    0.0000   0.0000          ?        ?   154.5222  19.1556          ?        ?      123.7        7.7       ?       ? 
1 1 1   26   22   62 o    157.7    6.3    0.0000   0.0000          ?        ?   250.3005  19.7942          ?        ?      157.7        6.3       ?       ? 
1 1 1   26   22   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   22   64 o    171.7    6.0    0.0000   0.0000          ?        ?   296.9126  20.4327          ?        ?      171.7        6.0       ?       ? 
1 1 1   26   23    0 o    763.3    5.3 5827.7871  81.0922  5827.7871  81.0922  5827.7871  81.0922      763.3      5.3      763.3        5.3     0.0     0.0 
1 1 1   26   23    1 o    391.7    3.3    0.0000   0.0000          ?        ?  1534.3674  26.1794          ?        ?      391.7        3.3       ?       ? 
1 1 1   26   23    2 o    260.4    3.6    0.0000   0.0000          ?        ?   678.1099  18.5171          ?        ?      260.4        3.6       ?       ? 
1 1 1   26   23    3 f    266.4    3.5    0.0000   0.0000          ?        ?   710.0360  18.5171          ?        ?      266.4        3.5       ?       ? 
1 1 1   26   23    4 o    507.2    2.8    0.0000   0.0000          ?        ?  2573.2422  28.7335          ?        ?      507.2        2.8       ?       ? 
1 1 1   26   23    5 o    549.9    3.2    0.0000   0.0000          ?        ?  3024.0386  35.1187          ?        ?      549.9        3.2       ?       ? 
1 1 1   26   23    6 o    362.7    2.6    0.0000   0.0000          ?        ?  1315.3545  19.1556          ?        ?      362.7        2.6       ?       ? 
1 1 1   26   23    7 f    366.4    2.5    0.0000   0.0000          ?        ?  1342.8110  18.5171          ?        ?      366.4        2.5       ?       ? 
1 1 1   26   23    8 o    154.7    3.7    0.0000   0.0000          ?        ?   239.4456  11.4934          ?        ?      154.7        3.7       ?       ? 
1 1 1   26   23    9 o    146.5    2.8    0.0000   0.0000          ?        ?   214.5433   8.3008          ?        ?      146.5        2.8       ?       ? 
1 1 1   26   23   10 o    466.1    2.3    0.0000   0.0000          ?        ?  2172.8889  21.7097          ?        ?      466.1        2.3       ?       ? 
1 1 1   26   23   11 o    623.3    2.7    0.0000   0.0000          ?        ?  3886.0425  33.2031          ?        ?      623.3        2.7       ?       ? 
1 1 1   26   23   12 o    609.1    2.5    0.0000   0.0000          ?        ?  3710.4490  30.0105          ?        ?      609.1        2.5       ?       ? 
1 1 1   26   23   13 o     87.5    4.7    0.0000   0.0000          ?        ?    76.6226   8.3008          ?        ?       87.5        4.7       ?       ? 
1 1 1   26   23   14 f    546.2    2.3    0.0000   0.0000          ?        ?  2983.8115  25.5409          ?        ?      546.2        2.3       ?       ? 
1 1 1   26   23   15 o    613.5    2.5    0.0000   0.0000          ?        ?  3764.0850  31.2876          ?        ?      613.5        2.5       ?       ? 
1 1 1   26   23   16 o    718.8    2.9    0.0000   0.0000          ?        ?  5167.5557  42.1424          ?        ?      718.8        2.9       ?       ? 
1 1 1   26   23   17 o    900.8    3.4    0.0000   0.0000          ?        ?  8116.8867  61.2981          ?        ?      900.8        3.4       ?       ? 
1 1 1   26   23   18 o    376.0    2.3    0.0000   0.0000          ?        ?  1413.6869  17.2401          ?        ?      376.0        2.3       ?       ? 
1 1 1   26   23   19 o    547.3    2.6    0.0000   0.0000          ?        ?  2995.9436  28.7335          ?        ?      547.3        2.6       ?       ? 
1 1 1   26   23   20 o    340.4    2.3    0.0000   0.0000          ?        ?  1158.9167  15.3245          ?        ?      340.4        2.3       ?       ? 
1 1 1   26   23   21 o    189.6    3.2    0.0000   0.0000          ?        ?   359.4877  12.1319          ?        ?      189.6        3.2       ?       ? 
1 1 1   26   23   22 o    702.8    2.8    0.0000   0.0000          ?        ?  4940.2417  39.5883          ?        ?      702.8        2.8       ?       ? 
1 1 1   26   23   23 o    714.6    2.9    0.0000   0.0000          ?        ?  5106.8960  40.8654          ?        ?      714.6        2.9       ?       ? 
1 1 1   26   23   24 o    271.9    2.7    0.0000   0.0000          ?        ?   739.4081  14.6860          ?        ?      271.9        2.7       ?       ? 
1 1 1   26   23   25 o    386.2    2.5    0.0000   0.0000          ?        ?  1491.5865  19.1556          ?        ?      386.2        2.5       ?       ? 
1 1 1   26   23   26 o    514.5    2.5    0.0000   0.0000          ?        ?  2647.3108  26.1794          ?        ?      514.5        2.5       ?       ? 
1 1 1   26   23   27 o    363.8    2.5    0.0000   0.0000          ?        ?  1323.6554  17.8786          ?        ?      363.8        2.5       ?       ? 
1 1 1   26   23   28 o    285.6    2.8    0.0000   0.0000          ?        ?   816.0306  15.9630          ?        ?      285.6        2.8       ?       ? 
1 1 1   26   23   29 o    406.3    2.7    0.0000   0.0000          ?        ?  1651.2169  21.7097          ?        ?      406.3        2.7       ?       ? 
1 1 1   26   23   30 o     19.2    9.5    0.0000   0.0000          ?        ?   -34.4802  14.0475          ?        ?       19.2        9.5       ?       ? 
1 1 1   26   23   31 o    831.9    3.2    0.0000   0.0000          ?        ?  6923.4902  52.9973          ?        ?      831.9        3.2       ?       ? 
1 1 1   26   23   32 o    477.3    2.6    0.0000   0.0000          ?        ?  2278.8835  24.9023          ?        ?      477.3        2.6       ?       ? 
1 1 1   26   23   33 o    186.8    3.8    0.0000   0.0000          ?        ?   349.2713  14.0475          ?        ?      186.8        3.8       ?       ? 
1 1 1   26   23   34 o    277.1    2.9    0.0000   0.0000          ?        ?   768.1415  15.9630          ?        ?      277.1        2.9       ?       ? 
1 1 1   26   23   35 o    481.8    2.7    0.0000   0.0000          ?        ?  2321.6646  25.5409          ?        ?      481.8        2.7       ?       ? 
1 1 1   26   23   36 o     16.9    8.6    0.0000   0.0000          ?        ?   -52.9973  14.6860          ?        ?       16.9        8.6       ?       ? 
1 1 1   26   23   37 o    387.9    2.6    0.0000   0.0000          ?        ?  1504.9955  20.4327          ?        ?      387.9        2.6       ?       ? 
1 1 1   26   23   38 o     26.2   12.1    0.0000   0.0000          ?        ?   -11.4934  14.6860          ?        ?       26.2       12.1       ?       ? 
1 1 1   26   23   39 o    325.1    2.7    0.0000   0.0000          ?        ?  1057.3918  17.8786          ?        ?      325.1        2.7       ?       ? 
1 1 1   26   23   40 f    263.3    3.0    0.0000   0.0000          ?        ?   693.4344  15.9630          ?        ?      263.3        3.0       ?       ? 
1 1 1   26   23   41 f    462.7    2.6    0.0000   0.0000          ?        ?  2141.6016  24.2638          ?        ?      462.7        2.6       ?       ? 
1 1 1   26   23   42 f    104.0    8.0    0.0000   0.0000          ?        ?   108.5487  16.6016          ?        ?      104.0        8.0       ?       ? 
1 1 1   26   23   43 o    356.6    2.8    0.0000   0.0000          ?        ?  1271.9351  19.7942          ?        ?      356.6        2.8       ?       ? 
1 1 1   26   23   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   23   45 f    281.5    3.3    0.0000   0.0000          ?        ?   793.0438  18.5171          ?        ?      281.5        3.3       ?       ? 
1 1 1   26   23   46 o    396.8    2.7    0.0000   0.0000          ?        ?  1575.2328  21.7097          ?        ?      396.8        2.7       ?       ? 
1 1 1   26   23   47 o    271.4    3.4    0.0000   0.0000          ?        ?   736.8539  18.5171          ?        ?      271.4        3.4       ?       ? 
1 1 1   26   23   48 o    358.1    3.0    0.0000   0.0000          ?        ?  1283.4285  21.7097          ?        ?      358.1        3.0       ?       ? 
1 1 1   26   23   49 o     19.2    9.7    0.0000   0.0000          ?        ?   -50.4432  16.6016          ?        ?       19.2        9.7       ?       ? 
1 1 1   26   23   50 o    379.2    2.9    0.0000   0.0000          ?        ?  1438.5892  22.3483          ?        ?      379.2        2.9       ?       ? 
1 1 1   26   23   51 o    133.2    6.9    0.0000   0.0000          ?        ?   178.1475  18.5171          ?        ?      133.2        6.9       ?       ? 
1 1 1   26   23   52 o    246.0    3.9    0.0000   0.0000          ?        ?   605.9570  19.1556          ?        ?      246.0        3.9       ?       ? 
1 1 1   26   23   53 o    126.8    7.3    0.0000   0.0000          ?        ?   161.5460  18.5171          ?        ?      126.8        7.3       ?       ? 
1 1 1   26   23   54 o    387.4    2.9    0.0000   0.0000          ?        ?  1501.8029  22.3483          ?        ?      387.4        2.9       ?       ? 
1 1 1   26   23   55 o    270.3    3.8    0.0000   0.0000          ?        ?   731.7458  20.4327          ?        ?      270.3        3.8       ?       ? 
1 1 1   26   23   56 o    265.2    4.0    0.0000   0.0000          ?        ?   704.2894  21.0712          ?        ?      265.2        4.0       ?       ? 
1 1 1   26   23   57 o    135.4    7.1    0.0000   0.0000          ?        ?   184.5327  19.1556          ?        ?      135.4        7.1       ?       ? 
1 1 1   26   23   58 o    109.9    8.4    0.0000   0.0000          ?        ?   121.9576  18.5171          ?        ?      109.9        8.4       ?       ? 
1 1 1   26   23   59 o    207.7    4.8    0.0000   0.0000          ?        ?   432.9177  19.7942          ?        ?      207.7        4.8       ?       ? 
1 1 1   26   23   60 o    128.8    7.4    0.0000   0.0000          ?        ?   167.2927  19.1556          ?        ?      128.8        7.4       ?       ? 
1 1 1   26   23   61 o    135.7    7.3    0.0000   0.0000          ?        ?   185.8098  19.7942          ?        ?      135.7        7.3       ?       ? 
1 1 1   26   23   62 o     30.5   13.9    0.0000   0.0000          ?        ?   -12.1319  19.1556          ?        ?       30.5       13.9       ?       ? 
1 1 1   26   23   63 o    135.2    7.1    0.0000   0.0000          ?        ?   184.5327  19.1556          ?        ?      135.2        7.1       ?       ? 
1 1 1   26   24    0 o    731.6    5.2 5354.0039  75.9841  5354.0039  75.9841  5354.0039  75.9841      731.6      5.2      731.6        5.2     0.0     0.0 
1 1 1   26   24    1 o    586.6    3.3    0.0000   0.0000          ?        ?  3441.6316  38.9498          ?        ?      586.6        3.3       ?       ? 
1 1 1   26   24    2 o    240.1    3.7    0.0000   0.0000          ?        ?   576.5850  17.8786          ?        ?      240.1        3.7       ?       ? 
1 1 1   26   24    3 f    238.8    3.9    0.0000   0.0000          ?        ?   570.1998  18.5171          ?        ?      238.8        3.9       ?       ? 
1 1 1   26   24    4 o    566.6    3.3    0.0000   0.0000          ?        ?  3210.4866  37.6728          ?        ?      566.6        3.3       ?       ? 
1 1 1   26   24    5 o    448.5    2.8    0.0000   0.0000          ?        ?  2011.3431  25.5409          ?        ?      448.5        2.8       ?       ? 
1 1 1   26   24    6 o    132.3    4.3    0.0000   0.0000          ?        ?   174.9549  11.4934          ?        ?      132.3        4.3       ?       ? 
1 1 1   26   24    7 f    566.9    2.9    0.0000   0.0000          ?        ?  3213.6792  32.5646          ?        ?      566.9        2.9       ?       ? 
1 1 1   26   24    8 o    402.9    2.5    0.0000   0.0000          ?        ?  1623.7605  20.4327          ?        ?      402.9        2.5       ?       ? 
1 1 1   26   24    9 o    285.8    2.5    0.0000   0.0000          ?        ?   816.6692  14.0475          ?        ?      285.8        2.5       ?       ? 
1 1 1   26   24   10 o    362.0    2.3    0.0000   0.0000          ?        ?  1310.8849  16.6016          ?        ?      362.0        2.3       ?       ? 
1 1 1   26   24   11 o    660.7    2.9    0.0000   0.0000          ?        ?  4366.2109  37.6728          ?        ?      660.7        2.9       ?       ? 
1 1 1   26   24   12 f    224.3    2.1    0.0000   0.0000          ?        ?   503.1551   9.5778          ?        ?      224.3        2.1       ?       ? 
1 1 1   26   24   13 o    349.8    2.1    0.0000   0.0000          ?        ?  1223.4075  14.6860          ?        ?      349.8        2.1       ?       ? 
1 1 1   26   24   14 o    283.2    2.3    0.0000   0.0000          ?        ?   801.9832  12.7704          ?        ?      283.2        2.3       ?       ? 
1 1 1   26   24   15 o    779.5    3.1    0.0000   0.0000          ?        ?  6076.8105  47.8891          ?        ?      779.5        3.1       ?       ? 
1 1 1   26   24   16 o    283.3    2.3    0.0000   0.0000          ?        ?   802.6216  12.7704          ?        ?      283.3        2.3       ?       ? 
1 1 1   26   24   17 o    412.3    2.3    0.0000   0.0000          ?        ?  1699.7446  19.1556          ?        ?      412.3        2.3       ?       ? 
1 1 1   26   24   18 o    174.5    3.3    0.0000   0.0000          ?        ?   304.5748  11.4934          ?        ?      174.5        3.3       ?       ? 
1 1 1   26   24   19 o     61.8    9.3    0.0000   0.0000          ?        ?    38.3113  11.4934          ?        ?       61.8        9.3       ?       ? 
1 1 1   26   24   20 o    181.7    3.3    0.0000   0.0000          ?        ?   330.1157  12.1319          ?        ?      181.7        3.3       ?       ? 
1 1 1   26   24   21 o    518.6    2.5    0.0000   0.0000          ?        ?  2689.4531  25.5409          ?        ?      518.6        2.5       ?       ? 
1 1 1   26   24   22 o    371.1    2.3    0.0000   0.0000          ?        ?  1377.2911  17.2401          ?        ?      371.1        2.3       ?       ? 
1 1 1   26   24   23 o    756.3    3.0    0.0000   0.0000          ?        ?  5721.1538  45.3350          ?        ?      756.3        3.0       ?       ? 
1 1 1   26   24   24 o    135.6    4.5    0.0000   0.0000          ?        ?   183.8942  12.1319          ?        ?      135.6        4.5       ?       ? 
1 1 1   26   24   25 o    469.5    2.4    0.0000   0.0000          ?        ?  2204.8152  22.9868          ?        ?      469.5        2.4       ?       ? 
1 1 1   26   24   26 o    583.1    2.7    0.0000   0.0000          ?        ?  3400.7661  31.2876          ?        ?      583.1        2.7       ?       ? 
1 1 1   26   24   27 o    287.6    2.7    0.0000   0.0000          ?        ?   827.5240  15.3245          ?        ?      287.6        2.7       ?       ? 
1 1 1   26   24   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   24   29 o     27.4   12.2    0.0000   0.0000          ?        ?    -5.1082  13.4090          ?        ?       27.4       12.2       ?       ? 
1 1 1   26   24   30 o    341.5    2.4    0.0000   0.0000          ?        ?  1166.5790  16.6016          ?        ?      341.5        2.4       ?       ? 
1 1 1   26   24   31 o    282.1    2.7    0.0000   0.0000          ?        ?   796.2365  15.3245          ?        ?      282.1        2.7       ?       ? 
1 1 1   26   24   32 o     20.6   10.1    0.0000   0.0000          ?        ?   -31.2876  14.6860          ?        ?       20.6       10.1       ?       ? 
1 1 1   26   24   33 o    557.9    2.6    0.0000   0.0000          ?        ?  3113.4314  28.7335          ?        ?      557.9        2.6       ?       ? 
1 1 1   26   24   34 f    105.9    6.9    0.0000   0.0000          ?        ?   112.3798  14.6860          ?        ?      105.9        6.9       ?       ? 
1 1 1   26   24   35 o    457.5    2.7    0.0000   0.0000          ?        ?  2093.7124  24.2638          ?        ?      457.5        2.7       ?       ? 
1 1 1   26   24   36 o    381.8    2.7    0.0000   0.0000          ?        ?  1458.3833  20.4327          ?        ?      381.8        2.7       ?       ? 
1 1 1   26   24   37 o    227.9    3.5    0.0000   0.0000          ?        ?   519.7566  15.9630          ?        ?      227.9        3.5       ?       ? 
1 1 1   26   24   38 o    199.7    3.8    0.0000   0.0000          ?        ?   399.0760  15.3245          ?        ?      199.7        3.8       ?       ? 
1 1 1   26   24   39 o    327.1    2.7    0.0000   0.0000          ?        ?  1070.1622  17.8786          ?        ?      327.1        2.7       ?       ? 
1 1 1   26   24   40 o    160.3    4.8    0.0000   0.0000          ?        ?   257.3242  15.3245          ?        ?      160.3        4.8       ?       ? 
1 1 1   26   24   41 o    136.0    5.6    0.0000   0.0000          ?        ?   185.1713  15.3245          ?        ?      136.0        5.6       ?       ? 
1 1 1   26   24   42 o    181.6    4.6    0.0000   0.0000          ?        ?   330.1157  16.6016          ?        ?      181.6        4.6       ?       ? 
1 1 1   26   24   43 o    119.4    7.0    0.0000   0.0000          ?        ?   143.0288  16.6016          ?        ?      119.4        7.0       ?       ? 
1 1 1   26   24   44 o    318.6    3.0    0.0000   0.0000          ?        ?  1015.8879  19.1556          ?        ?      318.6        3.0       ?       ? 
1 1 1   26   24   45 o    467.2    2.7    0.0000   0.0000          ?        ?  2183.7439  25.5409          ?        ?      467.2        2.7       ?       ? 
1 1 1   26   24   46 o    173.3    5.2    0.0000   0.0000          ?        ?   300.7437  17.8786          ?        ?      173.3        5.2       ?       ? 
1 1 1   26   24   47 o    222.6    4.0    0.0000   0.0000          ?        ?   496.1313  17.8786          ?        ?      222.6        4.0       ?       ? 
1 1 1   26   24   48 o    134.0    6.4    0.0000   0.0000          ?        ?   180.0631  17.2401          ?        ?      134.0        6.4       ?       ? 
1 1 1   26   24   49 o    227.3    4.1    0.0000   0.0000          ?        ?   517.2025  18.5171          ?        ?      227.3        4.1       ?       ? 
1 1 1   26   24   50 o    381.8    2.9    0.0000   0.0000          ?        ?  1458.3833  22.3483          ?        ?      381.8        2.9       ?       ? 
1 1 1   26   24   51 f     64.6   14.2    0.0000   0.0000          ?        ?    44.0580  17.8786          ?        ?       64.6       14.2       ?       ? 
1 1 1   26   24   52 o     84.9   10.9    0.0000   0.0000          ?        ?    72.7915  18.5171          ?        ?       84.9       10.9       ?       ? 
1 1 1   26   24   53 o     35.9   15.3    0.0000   0.0000          ?        ?     0.6385  19.1556          ?        ?       35.9       15.3       ?       ? 
1 1 1   26   24   54 o    294.7    3.5    0.0000   0.0000          ?        ?   869.6664  20.4327          ?        ?      294.7        3.5       ?       ? 
1 1 1   26   24   55 o    188.1    5.3    0.0000   0.0000          ?        ?   355.0180  19.7942          ?        ?      188.1        5.3       ?       ? 
1 1 1   26   24   56 o    119.4    8.0    0.0000   0.0000          ?        ?   143.6674  19.1556          ?        ?      119.4        8.0       ?       ? 
1 1 1   26   24   57 o     56.6   16.5    0.0000   0.0000          ?        ?    33.8416  19.7942          ?        ?       56.6       16.5       ?       ? 
1 1 1   26   24   58 o    190.1    5.2    0.0000   0.0000          ?        ?   362.6803  19.7942          ?        ?      190.1        5.2       ?       ? 
1 1 1   26   24   59 f    240.4    4.4    0.0000   0.0000          ?        ?   579.7776  21.0712          ?        ?      240.4        4.4       ?       ? 
1 1 1   26   24   60 o    236.6    4.6    0.0000   0.0000          ?        ?   561.8990  21.7097          ?        ?      236.6        4.6       ?       ? 
1 1 1   26   24   61 o    259.0    4.1    0.0000   0.0000          ?        ?   673.0018  21.0712          ?        ?      259.0        4.1       ?       ? 
1 1 1   26   24   62 o    128.9    7.4    0.0000   0.0000          ?        ?   167.9312  19.1556          ?        ?      128.9        7.4       ?       ? 
1 1 1   26   25    0 o    258.0    5.3  666.6166  27.4564   666.6166  27.4564   666.6166  27.4564      258.0      5.3      258.0        5.3     0.0     0.0 
1 1 1   26   25    1 o    217.9    4.5    0.0000   0.0000          ?        ?   475.0601  19.7942          ?        ?      217.9        4.5       ?       ? 
1 1 1   26   25    2 o    137.2    6.3    0.0000   0.0000          ?        ?   188.3639  17.2401          ?        ?      137.2        6.3       ?       ? 
1 1 1   26   25    3 o    406.8    3.1    0.0000   0.0000          ?        ?  1655.0481  25.5409          ?        ?      406.8        3.1       ?       ? 
1 1 1   26   25    4 o     28.5   13.1    0.0000   0.0000          ?        ?   -13.4090  17.2401          ?        ?       28.5       13.1       ?       ? 
1 1 1   26   25    5 o    351.0    3.2    0.0000   0.0000          ?        ?  1232.3467  22.3483          ?        ?      351.0        3.2       ?       ? 
1 1 1   26   25    6 o    149.3    4.3    0.0000   0.0000          ?        ?   222.8441  12.7704          ?        ?      149.3        4.3       ?       ? 
1 1 1   26   25    7 o    212.8    2.7    0.0000   0.0000          ?        ?   452.7119  11.4934          ?        ?      212.8        2.7       ?       ? 
1 1 1   26   25    8 o    140.5    3.2    0.0000   0.0000          ?        ?   197.3032   8.9393          ?        ?      140.5        3.2       ?       ? 
1 1 1   26   25    9 o    523.0    2.7    0.0000   0.0000          ?        ?  2736.0652  28.0950          ?        ?      523.0        2.7       ?       ? 
1 1 1   26   25   10 o    460.0    2.6    0.0000   0.0000          ?        ?  2116.0605  23.6253          ?        ?      460.0        2.6       ?       ? 
1 1 1   26   25   11 o    212.6    2.3    0.0000   0.0000          ?        ?   452.0733   9.5778          ?        ?      212.6        2.3       ?       ? 
1 1 1   26   25   12 o    241.4    2.0    0.0000   0.0000          ?        ?   582.9703   9.5778          ?        ?      241.4        2.0       ?       ? 
1 1 1   26   25   13 o    182.6    2.6    0.0000   0.0000          ?        ?   333.3083   9.5778          ?        ?      182.6        2.6       ?       ? 
1 1 1   26   25   14 o    868.0    3.3    0.0000   0.0000          ?        ?  7536.4712  57.4669          ?        ?      868.0        3.3       ?       ? 
1 1 1   26   25   15 o    743.8    2.9    0.0000   0.0000          ?        ?  5534.0669  43.4195          ?        ?      743.8        2.9       ?       ? 
1 1 1   26   25   16 o    681.1    2.8    0.0000   0.0000          ?        ?  4640.1367  38.3113          ?        ?      681.1        2.8       ?       ? 
1 1 1   26   25   17 o    258.4    2.5    0.0000   0.0000          ?        ?   667.8936  12.7704          ?        ?      258.4        2.5       ?       ? 
1 1 1   26   25   18 o    560.0    2.5    0.0000   0.0000          ?        ?  3136.4182  28.0950          ?        ?      560.0        2.5       ?       ? 
1 1 1   26   25   19 o    277.2    2.5    0.0000   0.0000          ?        ?   768.7800  14.0475          ?        ?      277.2        2.5       ?       ? 
1 1 1   26   25   20 o    665.8    2.9    0.0000   0.0000          ?        ?  4433.8945  38.9498          ?        ?      665.8        2.9       ?       ? 
1 1 1   26   25   21 o    546.5    2.6    0.0000   0.0000          ?        ?  2987.0042  28.0950          ?        ?      546.5        2.6       ?       ? 
1 1 1   26   25   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   25   23 f     32.9   13.1    0.0000   0.0000          ?        ?     5.7467  12.7704          ?        ?       32.9       13.1       ?       ? 
1 1 1   26   25   24 o    449.5    2.5    0.0000   0.0000          ?        ?  2020.9209  22.3483          ?        ?      449.5        2.5       ?       ? 
1 1 1   26   25   25 f     48.3   12.9    0.0000   0.0000          ?        ?    24.2638  12.7704          ?        ?       48.3       12.9       ?       ? 
1 1 1   26   25   26 o    427.2    2.5    0.0000   0.0000          ?        ?  1825.5333  21.0712          ?        ?      427.2        2.5       ?       ? 
1 1 1   26   25   27 o    398.4    2.5    0.0000   0.0000          ?        ?  1587.3647  19.7942          ?        ?      398.4        2.5       ?       ? 
1 1 1   26   25   28 o    311.7    2.7    0.0000   0.0000          ?        ?   971.8299  16.6016          ?        ?      311.7        2.7       ?       ? 
1 1 1   26   25   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   25   30 o    149.0    4.7    0.0000   0.0000          ?        ?   222.2055  14.0475          ?        ?      149.0        4.7       ?       ? 
1 1 1   26   25   31 o    488.2    2.7    0.0000   0.0000          ?        ?  2383.6011  26.1794          ?        ?      488.2        2.7       ?       ? 
1 1 1   26   25   32 o    372.7    2.8    0.0000   0.0000          ?        ?  1389.4231  21.0712          ?        ?      372.7        2.8       ?       ? 
1 1 1   26   25   33 o    463.5    2.8    0.0000   0.0000          ?        ?  2148.6252  25.5409          ?        ?      463.5        2.8       ?       ? 
1 1 1   26   25   34 o    641.7    2.9    0.0000   0.0000          ?        ?  4119.1030  37.0343          ?        ?      641.7        2.9       ?       ? 
1 1 1   26   25   35 o    151.5    5.5    0.0000   0.0000          ?        ?   229.8678  16.6016          ?        ?      151.5        5.5       ?       ? 
1 1 1   26   25   36 o     18.9    9.5    0.0000   0.0000          ?        ?   -39.5883  14.6860          ?        ?       18.9        9.5       ?       ? 
1 1 1   26   25   37 o     25.3   11.8    0.0000   0.0000          ?        ?   -14.0475  14.6860          ?        ?       25.3       11.8       ?       ? 
1 1 1   26   25   38 o     33.5   13.7    0.0000   0.0000          ?        ?     3.8311  14.6860          ?        ?       33.5       13.7       ?       ? 
1 1 1   26   25   39 o     28.4   12.9    0.0000   0.0000          ?        ?    -9.5778  15.9630          ?        ?       28.4       12.9       ?       ? 
1 1 1   26   25   40 o    346.8    2.9    0.0000   0.0000          ?        ?  1203.6133  20.4327          ?        ?      346.8        2.9       ?       ? 
1 1 1   26   25   41 o    283.8    3.2    0.0000   0.0000          ?        ?   805.8143  17.8786          ?        ?      283.8        3.2       ?       ? 
1 1 1   26   25   42 o    148.5    5.4    0.0000   0.0000          ?        ?   220.9285  15.9630          ?        ?      148.5        5.4       ?       ? 
1 1 1   26   25   43 o    218.0    4.1    0.0000   0.0000          ?        ?   475.6986  17.8786          ?        ?      218.0        4.1       ?       ? 
1 1 1   26   25   44 o    501.6    2.7    0.0000   0.0000          ?        ?  2517.0522  27.4564          ?        ?      501.6        2.7       ?       ? 
1 1 1   26   25   45 o    182.8    5.1    0.0000   0.0000          ?        ?   334.5853  18.5171          ?        ?      182.8        5.1       ?       ? 
1 1 1   26   25   46 o    218.1    4.1    0.0000   0.0000          ?        ?   476.3371  17.8786          ?        ?      218.1        4.1       ?       ? 
1 1 1   26   25   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   25   48 o     69.5   12.9    0.0000   0.0000          ?        ?    50.4432  17.2401          ?        ?       69.5       12.9       ?       ? 
1 1 1   26   25   49 o    298.2    3.4    0.0000   0.0000          ?        ?   890.0991  20.4327          ?        ?      298.2        3.4       ?       ? 
1 1 1   26   25   50 o    162.8    5.5    0.0000   0.0000          ?        ?   265.6250  17.8786          ?        ?      162.8        5.5       ?       ? 
1 1 1   26   25   51 o    260.6    3.7    0.0000   0.0000          ?        ?   680.0255  19.1556          ?        ?      260.6        3.7       ?       ? 
1 1 1   26   25   52 o     96.5    9.6    0.0000   0.0000          ?        ?    93.8627  18.5171          ?        ?       96.5        9.6       ?       ? 
1 1 1   26   25   53 o    149.6    6.4    0.0000   0.0000          ?        ?   224.7596  19.1556          ?        ?      149.6        6.4       ?       ? 
1 1 1   26   25   54 o    101.8    9.4    0.0000   0.0000          ?        ?   104.7175  19.1556          ?        ?      101.8        9.4       ?       ? 
1 1 1   26   25   55 o    164.8    5.6    0.0000   0.0000          ?        ?   272.6487  18.5171          ?        ?      164.8        5.6       ?       ? 
1 1 1   26   25   56 o    100.5    9.2    0.0000   0.0000          ?        ?   102.1635  18.5171          ?        ?      100.5        9.2       ?       ? 
1 1 1   26   25   57 o    166.9    5.7    0.0000   0.0000          ?        ?   279.6725  19.1556          ?        ?      166.9        5.7       ?       ? 
1 1 1   26   25   58 o     72.5   13.3    0.0000   0.0000          ?        ?    55.5514  18.5171          ?        ?       72.5       13.3       ?       ? 
1 1 1   26   25   59 o    172.4    5.6    0.0000   0.0000          ?        ?   298.8281  19.1556          ?        ?      172.4        5.6       ?       ? 
1 1 1   26   25   60 o     63.0   14.9    0.0000   0.0000          ?        ?    42.7809  18.5171          ?        ?       63.0       14.9       ?       ? 
1 1 1   26   25   61 o     33.8   14.9    0.0000   0.0000          ?        ?    -4.4697  19.7942          ?        ?       33.8       14.9       ?       ? 
1 1 1   26   26    0 o    439.3    6.4 1931.5280  56.1899  1931.5280  56.1899  1931.5280  56.1899      439.3      6.4      439.3        6.4     0.0     0.0 
1 1 1   26   26    1 o    823.8    5.6 6790.0391  92.5856  6790.0391  92.5856  6790.0391  92.5856      823.8      5.6      823.8        5.6     0.0     0.0 
1 1 1   26   26    2 o    310.0    4.9  962.2521  30.6490   962.2521  30.6490   962.2521  30.6490      310.0      4.9      310.0        4.9     0.0     0.0 
1 1 1   26   26    3 o    215.4    6.5  465.4823  28.0950   465.4823  28.0950   465.4823  28.0950      215.4      6.5      215.4        6.5     0.0     0.0 
1 1 1   26   26    4 o    900.5    6.1 8113.6938 109.1872  8113.6938 109.1872  8113.6938 109.1872      900.5      6.1      900.5        6.1     0.0     0.0 
1 1 1   26   26    5 o    213.0    7.7  455.9044  32.5646   455.9044  32.5646   455.9044  32.5646      213.0      7.7      213.0        7.7     0.0     0.0 
1 1 1   26   26    6 o    245.1    6.0  602.1259  29.3720   602.1259  29.3720   602.1259  29.3720      245.1      6.0      245.1        6.0     0.0     0.0 
1 1 1   26   26    7 o     38.4   22.7   17.2401  29.3720    17.2401  29.3720    17.2401  29.3720       38.4     22.7       38.4       22.7     0.0     0.0 
1 1 1   26   26    8 o    571.2    3.7 3263.4841  42.7809  3263.4841  42.7809  3263.4841  42.7809      571.2      3.7      571.2        3.7     0.0     0.0 
1 1 1   26   26    9 o    140.1    5.7  197.3032  15.9630   197.3032  15.9630   197.3032  15.9630      140.1      5.7      140.1        5.7     0.0     0.0 
1 1 1   26   26   10 o    826.3    4.8 6829.6270  78.5382  6829.6270  78.5382  6829.6270  78.5382      826.3      4.8      826.3        4.8     0.0     0.0 
1 1 1   26   26   11 o    158.9    5.4  253.4931  17.2401   253.4931  17.2401   253.4931  17.2401      158.9      5.4      158.9        5.4     0.0     0.0 
1 1 1   26   26   12 f    566.9    3.6 3214.3179  40.8654  3214.3179  40.8654  3214.3179  40.8654      566.9      3.6      566.9        3.6     0.0     0.0 
1 1 1   26   26   13 o    865.2    4.4 7487.3042  76.6226  7487.3042  76.6226  7487.3042  76.6226      865.2      4.4      865.2        4.4     0.0     0.0 
1 1 1   26   26   14 o     93.2    6.6   88.1160  12.1319    88.1160  12.1319    88.1160  12.1319       93.2      6.6       93.2        6.6     0.0     0.0 
1 1 1   26   26   15 o    129.0    7.0  167.9312  17.8786   167.9312  17.8786   167.9312  17.8786      129.0      7.0      129.0        7.0     0.0     0.0 
1 1 1   26   26   16 o    418.9    3.3 1755.2959  27.4564  1755.2959  27.4564  1755.2959  27.4564      418.9      3.3      418.9        3.3     0.0     0.0 
1 1 1   26   26   17 o     10.6    8.0  -49.8047  14.0475   -49.8047  14.0475   -49.8047  14.0475       10.6      8.0       10.6        8.0     0.0     0.0 
1 1 1   26   26   18 o    171.7    4.7  295.6355  15.9630   295.6355  15.9630   295.6355  15.9630      171.7      4.7      171.7        4.7     0.0     0.0 
1 1 1   26   26   19 o    389.1    3.3 1514.5732  25.5409  1514.5732  25.5409  1514.5732  25.5409      389.1      3.3      389.1        3.3     0.0     0.0 
1 1 1   26   26   20 o    299.6    3.9  898.3999  23.6253   898.3999  23.6253   898.3999  23.6253      299.6      3.9      299.6        3.9     0.0     0.0 
1 1 1   26   26   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   26   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   26   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   26   24 o    385.3    3.7 1485.2013  28.7335  1485.2013  28.7335  1485.2013  28.7335      385.3      3.7      385.3        3.7     0.0     0.0 
1 1 1   26   26   25 o    780.4    4.3 6092.7734  66.4062  6092.7734  66.4062  6092.7734  66.4062      780.4      4.3      780.4        4.3     0.0     0.0 
1 1 1   26   26   26 o     84.9   10.4   75.3456  17.2401    75.3456  17.2401    75.3456  17.2401       84.9     10.4       84.9       10.4     0.0     0.0 
1 1 1   26   26   27 o    231.1    4.6  535.0811  21.0712   535.0811  21.0712   535.0811  21.0712      231.1      4.6      231.1        4.6     0.0     0.0 
1 1 1   26   26   28 o     19.3   13.6  -18.5171  19.1556   -18.5171  19.1556   -18.5171  19.1556       19.3     13.6       19.3       13.6     0.0     0.0 
1 1 1   26   26   29 o    516.8    3.6 2671.5745  37.0343  2671.5745  37.0343  2671.5745  37.0343      516.8      3.6      516.8        3.6     0.0     0.0 
1 1 1   26   26   30 o    179.3    5.4  322.4534  19.1556   322.4534  19.1556   322.4534  19.1556      179.3      5.4      179.3        5.4     0.0     0.0 
1 1 1   26   26   31 o    440.9    3.7 1944.9369  32.5646  1944.9369  32.5646  1944.9369  32.5646      440.9      3.7      440.9        3.7     0.0     0.0 
1 1 1   26   26   32 o    224.2    5.0  503.7936  22.3483   503.7936  22.3483   503.7936  22.3483      224.2      5.0      224.2        5.0     0.0     0.0 
1 1 1   26   26   33 o    301.2    4.1  907.9777  24.9023   907.9777  24.9023   907.9777  24.9023      301.2      4.1      301.2        4.1     0.0     0.0 
1 1 1   26   26   34 o    151.4    7.6  231.1448  22.9868   231.1448  22.9868   231.1448  22.9868      151.4      7.6      151.4        7.6     0.0     0.0 
1 1 1   26   26   35 o    694.1    4.3 4820.8384  59.3825  4820.8384  59.3825  4820.8384  59.3825      694.1      4.3      694.1        4.3     0.0     0.0 
1 1 1   26   26   36 o    206.0    5.1  425.2554  21.0712   425.2554  21.0712   425.2554  21.0712      206.0      5.1      206.0        5.1     0.0     0.0 
1 1 1   26   26   37 o    127.0    8.1  163.4615  20.4327   163.4615  20.4327   163.4615  20.4327      127.0      8.1      127.0        8.1     0.0     0.0 
1 1 1   26   26   38 o    127.4    8.6  164.7386  21.7097   164.7386  21.7097   164.7386  21.7097      127.4      8.6      127.4        8.6     0.0     0.0 
1 1 1   26   26   39 o    786.9    4.3 6195.5752  68.3218  6195.5752  68.3218  6195.5752  68.3218      786.9      4.3      786.9        4.3     0.0     0.0 
1 1 1   26   26   40 o     86.3   14.4   79.8152  22.9868    79.8152  22.9868    79.8152  22.9868       86.3     14.4       86.3       14.4     0.0     0.0 
1 1 1   26   26   41 o    292.8    4.3  858.1730  24.9023   858.1730  24.9023   858.1730  24.9023      292.8      4.3      292.8        4.3     0.0     0.0 
1 1 1   26   26   42 o     25.1   16.8   -7.0237  22.9868    -7.0237  22.9868    -7.0237  22.9868       25.1     16.8       25.1       16.8     0.0     0.0 
1 1 1   26   26   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   26   44 o    366.1    4.3 1341.5339  31.2876  1341.5339  31.2876  1341.5339  31.2876      366.1      4.3      366.1        4.3     0.0     0.0 
1 1 1   26   26   45 o    675.1    4.0 4560.3218  54.2743  4560.3218  54.2743  4560.3218  54.2743      675.1      4.0      675.1        4.0     0.0     0.0 
1 1 1   26   26   46 o     22.4   15.5  -14.6860  22.3483   -14.6860  22.3483   -14.6860  22.3483       22.4     15.5       22.4       15.5     0.0     0.0 
1 1 1   26   26   47 o    336.6    4.1 1134.0144  27.4564  1134.0144  27.4564  1134.0144  27.4564      336.6      4.1      336.6        4.1     0.0     0.0 
1 1 1   26   26   48 o     25.3   16.9   -6.3852  22.9868    -6.3852  22.9868    -6.3852  22.9868       25.3     16.9       25.3       16.9     0.0     0.0 
1 1 1   26   26   49 o    350.9    4.3 1232.9854  30.0105  1232.9854  30.0105  1232.9854  30.0105      350.9      4.3      350.9        4.3     0.0     0.0 
1 1 1   26   26   50 o     53.5   23.8   42.1424  26.8179    42.1424  26.8179    42.1424  26.8179       53.5     23.8       53.5       23.8     0.0     0.0 
1 1 1   26   26   51 o     32.8   20.5    8.3008  26.8179     8.3008  26.8179     8.3008  26.8179       32.8     20.5       32.8       20.5     0.0     0.0 
1 1 1   26   26   52 o     22.6   15.8  -22.3483  25.5409   -22.3483  25.5409   -22.3483  25.5409       22.6     15.8       22.6       15.8     0.0     0.0 
1 1 1   26   26   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   26   26   54 o    241.5    5.8  585.5243  28.0950   585.5243  28.0950   585.5243  28.0950      241.5      5.8      241.5        5.8     0.0     0.0 
1 1 1   26   26   55 o     18.2   13.4  -61.2981  28.0950   -61.2981  28.0950   -61.2981  28.0950       18.2     13.4       18.2       13.4     0.0     0.0 
1 1 1   26   26   56 o     18.5   13.6  -51.7203  26.8179   -51.7203  26.8179   -51.7203  26.8179       18.5     13.6       18.5       13.6     0.0     0.0 
1 1 1   26   26   57 o    180.4    7.8  328.8386  28.0950   328.8386  28.0950   328.8386  28.0950      180.4      7.8      180.4        7.8     0.0     0.0 
1 1 1   26   26   58 o    106.1   12.6  118.7650  26.1794   118.7650  26.1794   118.7650  26.1794      106.1     12.6      106.1       12.6     0.0     0.0 
1 1 1   26   26   59 o     35.8   21.3   15.9630  26.1794    15.9630  26.1794    15.9630  26.1794       35.8     21.3       35.8       21.3     0.0     0.0 
1 1 1   26   26   60 o    107.9   12.4  122.5962  26.1794   122.5962  26.1794   122.5962  26.1794      107.9     12.4      107.9       12.4     0.0     0.0 
1 1 1   27    0    0 o   2494.6   16.0 62249.4727 798.7905 62249.4727 798.7905 62249.4727 798.7905     2494.6     16.0     2494.6       16.0     0.0     0.0 
1 1 1   27    0    1 o    719.1    3.9 5171.3867  56.1899  5171.3867  56.1899  5171.3867  56.1899      719.1      3.9      719.1        3.9     0.0     0.0 
1 1 1   27    0    2 o      8.4    6.3  -27.4564   8.3008   -27.4564   8.3008   -27.4564   8.3008        8.4      6.3        8.4        6.3     0.0     0.0 
1 1 1   27    0    3 o    157.7    3.0  249.0234   9.5778   249.0234   9.5778   249.0234   9.5778      157.7      3.0      157.7        3.0     0.0     0.0 
1 1 1   27    0    4 o   1464.7    7.0 21456.2422 205.6040 21456.2422 205.6040 21456.2422 205.6040     1464.7      7.0     1464.7        7.0     0.0     0.0 
1 1 1   27    0    5 o    440.3    3.0 1938.5518  26.1794  1938.5518  26.1794  1938.5518  26.1794      440.3      3.0      440.3        3.0     0.0     0.0 
1 1 1   27    0    6 o   1502.6    7.1 22580.0410 213.2662 22580.0410 213.2662 22580.0410 213.2662     1502.6      7.1     1502.6        7.1     0.0     0.0 
1 1 1   27    0    7 o   2029.0    9.3 41174.4297 378.6433 41174.4297 378.6433 41174.4297 378.6433     2029.0      9.3     2029.0        9.3     0.0     0.0 
1 1 1   27    0    8 o   1101.6    5.9 12136.3799 130.8969 12136.3799 130.8969 12136.3799 130.8969     1101.6      5.9     1101.6        5.9     0.0     0.0 
1 1 1   27    0    9 o    786.6    4.6 6187.9131  72.1529  6187.9131  72.1529  6187.9131  72.1529      786.6      4.6      786.6        4.6     0.0     0.0 
1 1 1   27    0   10 o     14.6   10.8  -45.9736  19.1556   -45.9736  19.1556   -45.9736  19.1556       14.6     10.8       14.6       10.8     0.0     0.0 
1 1 1   27    0   11 o   1602.3    7.6 25676.8711 242.6382 25676.8711 242.6382 25676.8711 242.6382     1602.3      7.6     1602.3        7.6     0.0     0.0 
1 1 1   27    0   12 o   1159.2    5.7 13438.9648 131.5355 13438.9648 131.5355 13438.9648 131.5355     1159.2      5.7     1159.2        5.7     0.0     0.0 
1 1 1   27    0   13 o    308.1    3.1  949.4816  19.1556   949.4816  19.1556   949.4816  19.1556      308.1      3.1      308.1        3.1     0.0     0.0 
1 1 1   27    0   14 o    137.2    5.1  189.0024  14.0475   189.0024  14.0475   189.0024  14.0475      137.2      5.1      137.2        5.1     0.0     0.0 
1 1 1   27    0   15 o    819.9    4.4 6722.9941  72.7915  6722.9941  72.7915  6722.9941  72.7915      819.9      4.4      819.9        4.4     0.0     0.0 
1 1 1   27    0   16 f    638.6    3.8 4078.8760  48.5276  4078.8760  48.5276  4078.8760  48.5276      638.6      3.8      638.6        3.8     0.0     0.0 
1 1 1   27    0   17 o    466.6    3.3 2177.3586  30.6490  2177.3586  30.6490  2177.3586  30.6490      466.6      3.3      466.6        3.3     0.0     0.0 
1 1 1   27    0   18 o   1778.4    8.7 31634.2754 309.0445 31634.2754 309.0445 31634.2754 309.0445     1778.4      8.7     1778.4        8.7     0.0     0.0 
1 1 1   27    0   19 o    262.3    3.5  688.3264  18.5171   688.3264  18.5171   688.3264  18.5171      262.3      3.5      262.3        3.5     0.0     0.0 
1 1 1   27    0   20 o   1030.6    5.5 10621.8076 112.3798 10621.8076 112.3798 10621.8076 112.3798     1030.6      5.5     1030.6        5.5     0.0     0.0 
1 1 1   27    0   21 o    136.2    5.2  186.4483  14.0475   186.4483  14.0475   186.4483  14.0475      136.2      5.2      136.2        5.2     0.0     0.0 
1 1 1   27    0   22 o     31.9   17.8   14.0475  16.6016    14.0475  16.6016    14.0475  16.6016       31.9     17.8       31.9       17.8     0.0     0.0 
1 1 1   27    0   23 o   1023.3    5.1 10473.0312 104.7175 10473.0312 104.7175 10473.0312 104.7175     1023.3      5.1     1023.3        5.1     0.0     0.0 
1 1 1   27    0   24 o    559.5    3.6 3131.3101  40.2269  3131.3101  40.2269  3131.3101  40.2269      559.5      3.6      559.5        3.6     0.0     0.0 
1 1 1   27    0   25 o    147.9    5.8  219.6514  17.2401   219.6514  17.2401   219.6514  17.2401      147.9      5.8      147.9        5.8     0.0     0.0 
1 1 1   27    0   26 o    798.4    4.5 6375.0000  71.5144  6375.0000  71.5144  6375.0000  71.5144      798.4      4.5      798.4        4.5     0.0     0.0 
1 1 1   27    0   27 o     22.6   16.1  -33.2031  28.7335   -33.2031  28.7335   -33.2031  28.7335       22.6     16.1       22.6       16.1     0.0     0.0 
1 1 1   27    0   28 o   1227.3    6.2 15064.6406 152.6067 15064.6406 152.6067 15064.6406 152.6067     1227.3      6.2     1227.3        6.2     0.0     0.0 
1 1 1   27    0   29 o     19.4   14.1  -43.4195  26.1794   -43.4195  26.1794   -43.4195  26.1794       19.4     14.1       19.4       14.1     0.0     0.0 
1 1 1   27    0   30 o   1269.8    6.7 16127.7793 170.4853 16127.7793 170.4853 16127.7793 170.4853     1269.8      6.7     1269.8        6.7     0.0     0.0 
1 1 1   27    0   31 o    195.7    4.9  383.7515  19.1556   383.7515  19.1556   383.7515  19.1556      195.7      4.9      195.7        4.9     0.0     0.0 
1 1 1   27    0   32 o    967.9    5.4 9370.3047 105.3561  9370.3047 105.3561  9370.3047 105.3561      967.9      5.4      967.9        5.4     0.0     0.0 
1 1 1   27    0   33 o    719.3    4.5 5174.5796  65.1292  5174.5796  65.1292  5174.5796  65.1292      719.3      4.5      719.3        4.5     0.0     0.0 
1 1 1   27    0   34 o    330.6    3.9 1093.1490  25.5409  1093.1490  25.5409  1093.1490  25.5409      330.6      3.9      330.6        3.9     0.0     0.0 
1 1 1   27    0   35 o    290.0    4.3  841.5715  24.9023   841.5715  24.9023   841.5715  24.9023      290.0      4.3      290.0        4.3     0.0     0.0 
1 1 1   27    0   36 o     42.6   21.5   26.8179  22.3483    26.8179  22.3483    26.8179  22.3483       42.6     21.5       42.6       21.5     0.0     0.0 
1 1 1   27    0   37 o    564.6    4.0 3188.1384  44.6965  3188.1384  44.6965  3188.1384  44.6965      564.6      4.0      564.6        4.0     0.0     0.0 
1 1 1   27    0   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    0   39 o    454.3    4.1 2064.9790  37.6728  2064.9790  37.6728  2064.9790  37.6728      454.3      4.1      454.3        4.1     0.0     0.0 
1 1 1   27    0   40 o    383.1    4.2 1468.5997  31.9261  1468.5997  31.9261  1468.5997  31.9261      383.1      4.2      383.1        4.2     0.0     0.0 
1 1 1   27    0   41 o    833.1    4.5 6942.0068  75.3456  6942.0068  75.3456  6942.0068  75.3456      833.1      4.5      833.1        4.5     0.0     0.0 
1 1 1   27    0   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    0   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    0   44 o    494.1    3.6 2441.7065  35.1187  2441.7065  35.1187  2441.7065  35.1187      494.1      3.6      494.1        3.6     0.0     0.0 
1 1 1   27    0   45 o    734.2    4.5 5391.6768  65.7677  5391.6768  65.7677  5391.6768  65.7677      734.2      4.5      734.2        4.5     0.0     0.0 
1 1 1   27    0   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    0   47 o    141.0    8.4  201.1343  23.6253   201.1343  23.6253   201.1343  23.6253      141.0      8.4      141.0        8.4     0.0     0.0 
1 1 1   27    0   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    0   49 o    694.2    4.4 4820.8384  60.6596  4820.8384  60.6596  4820.8384  60.6596      694.2      4.4      694.2        4.4     0.0     0.0 
1 1 1   27    0   50 o     46.8   24.0   32.5646  28.0950    32.5646  28.0950    32.5646  28.0950       46.8     24.0       46.8       24.0     0.0     0.0 
1 1 1   27    0   51 o    736.1    4.9 5421.0488  72.7915  5421.0488  72.7915  5421.0488  72.7915      736.1      4.9      736.1        4.9     0.0     0.0 
1 1 1   27    0   52 o    159.7    9.5  257.9627  30.0105   257.9627  30.0105   257.9627  30.0105      159.7      9.5      159.7        9.5     0.0     0.0 
1 1 1   27    0   53 o    571.0    4.4 3261.5684  50.4432  3261.5684  50.4432  3261.5684  50.4432      571.0      4.4      571.0        4.4     0.0     0.0 
1 1 1   27    0   54 o     26.0   17.5   -9.5778  25.5409    -9.5778  25.5409    -9.5778  25.5409       26.0     17.5       26.0       17.5     0.0     0.0 
1 1 1   27    0   55 o     19.2   14.1  -58.7440  29.3720   -58.7440  29.3720   -58.7440  29.3720       19.2     14.1       19.2       14.1     0.0     0.0 
1 1 1   27    0   56 o    572.9    3.8 3283.2783  43.4195  3283.2783  43.4195  3283.2783  43.4195      572.9      3.8      572.9        3.8     0.0     0.0 
1 1 1   27    0   57 o    482.8    4.0 2332.5195  38.9498  2332.5195  38.9498  2332.5195  38.9498      482.8      4.0      482.8        4.0     0.0     0.0 
1 1 1   27    0   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    0   59 o    513.8    3.8 2640.9255  38.9498  2640.9255  38.9498  2640.9255  38.9498      513.8      3.8      513.8        3.8     0.0     0.0 
1 1 1   27    0   60 o    583.6    4.2 3408.4285  49.1662  3408.4285  49.1662  3408.4285  49.1662      583.6      4.2      583.6        4.2     0.0     0.0 
1 1 1   27    0   61 o    215.3    6.4  465.4823  27.4564   465.4823  27.4564   465.4823  27.4564      215.3      6.4      215.3        6.4     0.0     0.0 
1 1 1   27    0   62 o    919.6    4.9 8463.6045  90.0316  8463.6045  90.0316  8463.6045  90.0316      919.6      4.9      919.6        4.9     0.0     0.0 
1 1 1   27    0   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    0   64 o    498.2    3.9 2483.8491  38.9498  2483.8491  38.9498  2483.8491  38.9498      498.2      3.9      498.2        3.9     0.0     0.0 
1 1 1   27    0   65 o    433.4    4.2 1879.8076  36.3957  1879.8076  36.3957  1879.8076  36.3957      433.4      4.2      433.4        4.2     0.0     0.0 
1 1 1   27    0   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    0   67 o     20.3   14.7  -47.2506  28.7335   -47.2506  28.7335   -47.2506  28.7335       20.3     14.7       20.3       14.7     0.0     0.0 
1 1 1   27    0   68 o     21.2   15.3  -45.9736  30.0105   -45.9736  30.0105   -45.9736  30.0105       21.2     15.3       21.2       15.3     0.0     0.0 
1 1 1   27    0   69 o    152.9   10.1  238.1686  30.6490   238.1686  30.6490   238.1686  30.6490      152.9     10.1      152.9       10.1     0.0     0.0 
1 1 1   27    0   70 f     22.6   16.2  -38.9498  30.6490   -38.9498  30.6490   -38.9498  30.6490       22.6     16.2       22.6       16.2     0.0     0.0 
1 1 1   27    0   71 o     22.0   15.9  -42.1424  30.6490   -42.1424  30.6490   -42.1424  30.6490       22.0     15.9       22.0       15.9     0.0     0.0 
1 1 1   27    0   72 o    124.0   12.1  159.6304  29.3720   159.6304  29.3720   159.6304  29.3720      124.0     12.1      124.0       12.1     0.0     0.0 
1 1 1   27    0   73 o    421.9    4.3 1782.7524  36.3957  1782.7524  36.3957  1782.7524  36.3957      421.9      4.3      421.9        4.3     0.0     0.0 
1 1 1   27    0   74 o     16.4   12.3 -105.3561  31.9261  -105.3561  31.9261  -105.3561  31.9261       16.4     12.3       16.4       12.3     0.0     0.0 
1 1 1   27    0   75 o     87.5   19.7   89.3930  30.0105    89.3930  30.0105    89.3930  30.0105       87.5     19.7       87.5       19.7     0.0     0.0 
1 1 1   27    1    0 o    585.5    4.2 3428.8611  49.1662  3428.8611  49.1662  3428.8611  49.1662      585.5      4.2      585.5        4.2     0.0     0.0 
1 1 1   27    1    1 o   2513.1    8.5    0.0000   0.0000          ?        ? 63168.9453 425.8939          ?        ?     2513.1        8.5       ?       ? 
1 1 1   27    1    2 o    960.5    3.7    0.0000   0.0000          ?        ?  9225.3604  70.2374          ?        ?      960.5        3.7       ?       ? 
1 1 1   27    1    3 o    725.7    2.9    0.0000   0.0000          ?        ?  5266.5264  41.5039          ?        ?      725.7        2.9       ?       ? 
1 1 1   27    1    4 o    395.8    2.2    0.0000   0.0000          ?        ?  1566.9320  17.2401          ?        ?      395.8        2.2       ?       ? 
1 1 1   27    1    5 o   2230.8    8.2    0.0000   0.0000          ?        ? 49775.3125 365.2344          ?        ?     2230.8        8.2       ?       ? 
1 1 1   27    1    6 o   1091.1    4.3    0.0000   0.0000          ?        ? 11905.2354  94.5012          ?        ?     1091.1        4.3       ?       ? 
1 1 1   27    1    7 f   1805.3    6.7    0.0000   0.0000          ?        ? 32595.2500 240.7227          ?        ?     1805.3        6.7       ?       ? 
1 1 1   27    1    8 o    684.1    2.7    0.0000   0.0000          ?        ?  4680.3633  37.0343          ?        ?      684.1        2.7       ?       ? 
1 1 1   27    1    9 o   1338.7    4.6    0.0000   0.0000          ?        ? 17923.3027 122.5962          ?        ?     1338.7        4.6       ?       ? 
1 1 1   27    1   10 o   1661.3    5.5    0.0000   0.0000          ?        ? 27600.0977 182.6172          ?        ?     1661.3        5.5       ?       ? 
1 1 1   27    1   11 o   1242.4    4.2    0.0000   0.0000          ?        ? 15436.2607 105.3561          ?        ?     1242.4        4.2       ?       ? 
1 1 1   27    1   12 o   1150.8    4.1    0.0000   0.0000          ?        ? 13243.5781  93.8627          ?        ?     1150.8        4.1       ?       ? 
1 1 1   27    1   13 o    448.3    2.1    0.0000   0.0000          ?        ?  2009.4276  19.1556          ?        ?      448.3        2.1       ?       ? 
1 1 1   27    1   14 o    475.1    2.2    0.0000   0.0000          ?        ?  2257.1738  21.0712          ?        ?      475.1        2.2       ?       ? 
1 1 1   27    1   15 o   1481.9    5.1    0.0000   0.0000          ?        ? 21963.2285 150.0526          ?        ?     1481.9        5.1       ?       ? 
1 1 1   27    1   16 o    323.8    2.3    0.0000   0.0000          ?        ?  1048.4525  14.6860          ?        ?      323.8        2.3       ?       ? 
1 1 1   27    1   17 o    285.8    2.2    0.0000   0.0000          ?        ?   816.6692  12.7704          ?        ?      285.8        2.2       ?       ? 
1 1 1   27    1   18 o   1357.0    4.7    0.0000   0.0000          ?        ? 18415.6035 127.7043          ?        ?     1357.0        4.7       ?       ? 
1 1 1   27    1   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    1   20 o   1309.9    4.6    0.0000   0.0000          ?        ? 17159.6289 120.0421          ?        ?     1309.9        4.6       ?       ? 
1 1 1   27    1   21 o     90.4    6.4    0.0000   0.0000          ?        ?    81.7308  11.4934          ?        ?       90.4        6.4       ?       ? 
1 1 1   27    1   22 o    794.2    3.0    0.0000   0.0000          ?        ?  6307.3164  47.2506          ?        ?      794.2        3.0       ?       ? 
1 1 1   27    1   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    1   24 o   1025.0    3.7    0.0000   0.0000          ?        ? 10507.5117  75.9841          ?        ?     1025.0        3.7       ?       ? 
1 1 1   27    1   25 o    228.4    2.8    0.0000   0.0000          ?        ?   521.6721  12.7704          ?        ?      228.4        2.8       ?       ? 
1 1 1   27    1   26 o    644.8    2.7    0.0000   0.0000          ?        ?  4157.4141  35.1187          ?        ?      644.8        2.7       ?       ? 
1 1 1   27    1   27 o    481.7    2.5    0.0000   0.0000          ?        ?  2320.3875  24.2638          ?        ?      481.7        2.5       ?       ? 
1 1 1   27    1   28 o    927.4    3.6    0.0000   0.0000          ?        ?  8602.1631  67.6833          ?        ?      927.4        3.6       ?       ? 
1 1 1   27    1   29 o    388.3    2.5    0.0000   0.0000          ?        ?  1508.1881  19.1556          ?        ?      388.3        2.5       ?       ? 
1 1 1   27    1   30 o    204.7    3.7    0.0000   0.0000          ?        ?   418.8702  15.3245          ?        ?      204.7        3.7       ?       ? 
1 1 1   27    1   31 o    402.3    2.5    0.0000   0.0000          ?        ?  1618.6523  19.7942          ?        ?      402.3        2.5       ?       ? 
1 1 1   27    1   32 o    135.6    5.4    0.0000   0.0000          ?        ?   183.8942  14.6860          ?        ?      135.6        5.4       ?       ? 
1 1 1   27    1   33 o    301.8    3.1    0.0000   0.0000          ?        ?   911.1703  18.5171          ?        ?      301.8        3.1       ?       ? 
1 1 1   27    1   34 o    545.3    2.7    0.0000   0.0000          ?        ?  2973.5952  29.3720          ?        ?      545.3        2.7       ?       ? 
1 1 1   27    1   35 o    345.9    2.9    0.0000   0.0000          ?        ?  1196.5895  19.7942          ?        ?      345.9        2.9       ?       ? 
1 1 1   27    1   36 o    312.8    3.2    0.0000   0.0000          ?        ?   978.2151  19.7942          ?        ?      312.8        3.2       ?       ? 
1 1 1   27    1   37 o    743.0    3.1    0.0000   0.0000          ?        ?  5521.2964  45.9736          ?        ?      743.0        3.1       ?       ? 
1 1 1   27    1   38 o    799.1    3.3    0.0000   0.0000          ?        ?  6385.8545  52.3588          ?        ?      799.1        3.3       ?       ? 
1 1 1   27    1   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    1   40 o    243.9    3.7    0.0000   0.0000          ?        ?   595.1021  17.8786          ?        ?      243.9        3.7       ?       ? 
1 1 1   27    1   41 o    852.0    3.4    0.0000   0.0000          ?        ?  7260.6294  58.7440          ?        ?      852.0        3.4       ?       ? 
1 1 1   27    1   42 o    163.1    6.3    0.0000   0.0000          ?        ?   266.2635  20.4327          ?        ?      163.1        6.3       ?       ? 
1 1 1   27    1   43 o    119.0    7.0    0.0000   0.0000          ?        ?   141.7518  16.6016          ?        ?      119.0        7.0       ?       ? 
1 1 1   27    1   44 o    573.5    2.8    0.0000   0.0000          ?        ?  3289.0247  32.5646          ?        ?      573.5        2.8       ?       ? 
1 1 1   27    1   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    1   46 o    239.6    3.7    0.0000   0.0000          ?        ?   574.0309  17.8786          ?        ?      239.6        3.7       ?       ? 
1 1 1   27    1   47 o    616.8    2.6    0.0000   0.0000          ?        ?  3804.9504  32.5646          ?        ?      616.8        2.6       ?       ? 
1 1 1   27    1   48 o    253.7    3.8    0.0000   0.0000          ?        ?   643.6298  19.1556          ?        ?      253.7        3.8       ?       ? 
1 1 1   27    1   49 o    506.9    2.8    0.0000   0.0000          ?        ?  2570.0496  28.7335          ?        ?      506.9        2.8       ?       ? 
1 1 1   27    1   50 o    212.3    4.4    0.0000   0.0000          ?        ?   450.7963  18.5171          ?        ?      212.3        4.4       ?       ? 
1 1 1   27    1   51 o    511.0    2.9    0.0000   0.0000          ?        ?  2611.5535  29.3720          ?        ?      511.0        2.9       ?       ? 
1 1 1   27    1   52 o    521.7    2.8    0.0000   0.0000          ?        ?  2722.6562  28.7335          ?        ?      521.7        2.8       ?       ? 
1 1 1   27    1   53 o    346.0    3.0    0.0000   0.0000          ?        ?  1197.2280  21.0712          ?        ?      346.0        3.0       ?       ? 
1 1 1   27    1   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    1   55 f    228.2    4.3    0.0000   0.0000          ?        ?   521.0336  19.7942          ?        ?      228.2        4.3       ?       ? 
1 1 1   27    1   56 o    355.8    3.1    0.0000   0.0000          ?        ?  1266.1884  21.7097          ?        ?      355.8        3.1       ?       ? 
1 1 1   27    1   57 o    315.1    3.2    0.0000   0.0000          ?        ?   993.5397  20.4327          ?        ?      315.1        3.2       ?       ? 
1 1 1   27    1   58 o     22.3   11.1    0.0000   0.0000          ?        ?   -43.4195  18.5171          ?        ?       22.3       11.1       ?       ? 
1 1 1   27    1   59 o     21.3   10.6    0.0000   0.0000          ?        ?   -49.8047  18.5171          ?        ?       21.3       10.6       ?       ? 
1 1 1   27    1   60 o     52.7   16.4    0.0000   0.0000          ?        ?    28.0950  19.1556          ?        ?       52.7       16.4       ?       ? 
1 1 1   27    1   61 f    164.6    6.0    0.0000   0.0000          ?        ?   271.3717  19.7942          ?        ?      164.6        6.0       ?       ? 
1 1 1   27    1   62 o     20.5   10.3    0.0000   0.0000          ?        ?   -68.9603  20.4327          ?        ?       20.5       10.3       ?       ? 
1 1 1   27    1   63 o    367.8    3.1    0.0000   0.0000          ?        ?  1353.6659  22.9868          ?        ?      367.8        3.1       ?       ? 
1 1 1   27    1   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    1   65 o    340.9    3.2    0.0000   0.0000          ?        ?  1163.3864  21.7097          ?        ?      340.9        3.2       ?       ? 
1 1 1   27    1   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    1   67 o    250.1    4.2    0.0000   0.0000          ?        ?   626.3897  21.0712          ?        ?      250.1        4.2       ?       ? 
1 1 1   27    1   68 o    358.8    3.3    0.0000   0.0000          ?        ?  1288.5366  23.6253          ?        ?      358.8        3.3       ?       ? 
1 1 1   27    1   69 f    252.4    4.3    0.0000   0.0000          ?        ?   638.5216  21.7097          ?        ?      252.4        4.3       ?       ? 
1 1 1   27    1   70 o    220.1    4.8    0.0000   0.0000          ?        ?   485.9149  21.0712          ?        ?      220.1        4.8       ?       ? 
1 1 1   27    1   71 o     31.2   14.3    0.0000   0.0000          ?        ?   -14.0475  20.4327          ?        ?       31.2       14.3       ?       ? 
1 1 1   27    1   72 o    187.3    5.5    0.0000   0.0000          ?        ?   352.4639  20.4327          ?        ?      187.3        5.5       ?       ? 
1 1 1   27    1   73 o    154.4    6.6    0.0000   0.0000          ?        ?   240.0841  20.4327          ?        ?      154.4        6.6       ?       ? 
1 1 1   27    1   74 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    1   75 o    132.1    8.0    0.0000   0.0000          ?        ?   176.8705  21.0712          ?        ?      132.1        8.0       ?       ? 
1 1 1   27    2    0 o    724.5    4.3 5249.9248  61.9366  5249.9248  61.9366  5249.9248  61.9366      724.5      4.3      724.5        4.3     0.0     0.0 
1 1 1   27    2    1 o    678.1    2.9    0.0000   0.0000          ?        ?  4597.9941  39.5883          ?        ?      678.1        2.9       ?       ? 
1 1 1   27    2    2 o    625.8    2.8    0.0000   0.0000          ?        ?  3916.6919  34.4802          ?        ?      625.8        2.8       ?       ? 
1 1 1   27    2    3 o    589.5    2.5    0.0000   0.0000          ?        ?  3474.8347  30.0105          ?        ?      589.5        2.5       ?       ? 
1 1 1   27    2    4 o    851.3    3.2    0.0000   0.0000          ?        ?  7247.8589  54.9129          ?        ?      851.3        3.2       ?       ? 
1 1 1   27    2    5 o    309.5    2.0    0.0000   0.0000          ?        ?   957.7824  12.1319          ?        ?      309.5        2.0       ?       ? 
1 1 1   27    2    6 o   1463.9    4.9    0.0000   0.0000          ?        ? 21430.7012 144.3059          ?        ?     1463.9        4.9       ?       ? 
1 1 1   27    2    7 o    924.2    3.4    0.0000   0.0000          ?        ?  8540.8652  61.9366          ?        ?      924.2        3.4       ?       ? 
1 1 1   27    2    8 o    515.1    2.4    0.0000   0.0000          ?        ?  2653.0574  24.2638          ?        ?      515.1        2.4       ?       ? 
1 1 1   27    2    9 o   1442.7    4.8    0.0000   0.0000          ?        ? 20816.4434 139.8362          ?        ?     1442.7        4.8       ?       ? 
1 1 1   27    2   10 o    448.4    2.3    0.0000   0.0000          ?        ?  2010.7046  20.4327          ?        ?      448.4        2.3       ?       ? 
1 1 1   27    2   11 f   1325.7    4.6    0.0000   0.0000          ?        ? 17577.2246 121.3191          ?        ?     1325.7        4.6       ?       ? 
1 1 1   27    2   12 o   1119.4    4.0    0.0000   0.0000          ?        ? 12532.2637  88.7545          ?        ?     1119.4        4.0       ?       ? 
1 1 1   27    2   13 o    914.8    3.4    0.0000   0.0000          ?        ?  8368.4639  61.9366          ?        ?      914.8        3.4       ?       ? 
1 1 1   27    2   14 o   1026.2    3.7    0.0000   0.0000          ?        ? 10531.7754  75.9841          ?        ?     1026.2        3.7       ?       ? 
1 1 1   27    2   15 o   1180.9    4.2    0.0000   0.0000          ?        ? 13946.5889  98.3323          ?        ?     1180.9        4.2       ?       ? 
1 1 1   27    2   16 o    908.4    3.4    0.0000   0.0000          ?        ?  8252.8916  61.2981          ?        ?      908.4        3.4       ?       ? 
1 1 1   27    2   17 o    322.0    2.5    0.0000   0.0000          ?        ?  1036.9591  15.9630          ?        ?      322.0        2.5       ?       ? 
1 1 1   27    2   18 o    864.3    3.3    0.0000   0.0000          ?        ?  7470.0645  56.1899          ?        ?      864.3        3.3       ?       ? 
1 1 1   27    2   19 o    746.3    2.8    0.0000   0.0000          ?        ?  5569.1855  42.1424          ?        ?      746.3        2.8       ?       ? 
1 1 1   27    2   20 o   1525.1    5.1    0.0000   0.0000          ?        ? 23261.9824 155.1608          ?        ?     1525.1        5.1       ?       ? 
1 1 1   27    2   21 o    523.9    2.6    0.0000   0.0000          ?        ?  2745.0044  26.8179          ?        ?      523.9        2.6       ?       ? 
1 1 1   27    2   22 o    830.0    3.1    0.0000   0.0000          ?        ?  6889.6484  51.7203          ?        ?      830.0        3.1       ?       ? 
1 1 1   27    2   23 o   1168.1    4.0    0.0000   0.0000          ?        ? 13646.4844  94.5012          ?        ?     1168.1        4.0       ?       ? 
1 1 1   27    2   24 o    393.8    2.4    0.0000   0.0000          ?        ?  1550.9690  19.1556          ?        ?      393.8        2.4       ?       ? 
1 1 1   27    2   25 o    629.0    2.7    0.0000   0.0000          ?        ?  3956.9187  34.4802          ?        ?      629.0        2.7       ?       ? 
1 1 1   27    2   26 o   1203.3    5.1    0.0000   0.0000          ?        ? 14481.0312 121.9576          ?        ?     1203.3        5.1       ?       ? 
1 1 1   27    2   27 o    150.1    4.9    0.0000   0.0000          ?        ?   225.3981  14.6860          ?        ?      150.1        4.9       ?       ? 
1 1 1   27    2   28 o    758.1    3.5    0.0000   0.0000          ?        ?  5747.3330  52.3588          ?        ?      758.1        3.5       ?       ? 
1 1 1   27    2   29 o    728.7    3.2    0.0000   0.0000          ?        ?  5309.9458  45.9736          ?        ?      728.7        3.2       ?       ? 
1 1 1   27    2   30 o    821.6    3.4    0.0000   0.0000          ?        ?  6750.4502  56.1899          ?        ?      821.6        3.4       ?       ? 
1 1 1   27    2   31 o    754.2    3.4    0.0000   0.0000          ?        ?  5688.5894  51.0817          ?        ?      754.2        3.4       ?       ? 
1 1 1   27    2   32 o    615.7    2.7    0.0000   0.0000          ?        ?  3790.9031  33.8416          ?        ?      615.7        2.7       ?       ? 
1 1 1   27    2   33 o    530.1    2.6    0.0000   0.0000          ?        ?  2810.1338  28.0950          ?        ?      530.1        2.6       ?       ? 
1 1 1   27    2   34 o    518.2    2.5    0.0000   0.0000          ?        ?  2685.6221  26.1794          ?        ?      518.2        2.5       ?       ? 
1 1 1   27    2   35 o    240.5    3.6    0.0000   0.0000          ?        ?   578.5006  17.2401          ?        ?      240.5        3.6       ?       ? 
1 1 1   27    2   36 o    926.9    3.6    0.0000   0.0000          ?        ?  8592.5850  66.4062          ?        ?      926.9        3.6       ?       ? 
1 1 1   27    2   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    2   38 o    725.9    2.9    0.0000   0.0000          ?        ?  5269.7188  42.1424          ?        ?      725.9        2.9       ?       ? 
1 1 1   27    2   39 o    455.2    2.6    0.0000   0.0000          ?        ?  2072.0027  23.6253          ?        ?      455.2        2.6       ?       ? 
1 1 1   27    2   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    2   41 o    212.7    4.1    0.0000   0.0000          ?        ?   452.7119  17.2401          ?        ?      212.7        4.1       ?       ? 
1 1 1   27    2   42 o    700.7    2.9    0.0000   0.0000          ?        ?  4910.2314  40.2269          ?        ?      700.7        2.9       ?       ? 
1 1 1   27    2   43 o    650.0    2.8    0.0000   0.0000          ?        ?  4225.0977  36.3957          ?        ?      650.0        2.8       ?       ? 
1 1 1   27    2   44 o     36.1   14.7    0.0000   0.0000          ?        ?     5.1082  16.6016          ?        ?       36.1       14.7       ?       ? 
1 1 1   27    2   45 o    146.6    5.7    0.0000   0.0000          ?        ?   215.1818  16.6016          ?        ?      146.6        5.7       ?       ? 
1 1 1   27    2   46 f    341.0    2.7    0.0000   0.0000          ?        ?  1162.7479  18.5171          ?        ?      341.0        2.7       ?       ? 
1 1 1   27    2   47 o    437.4    2.6    0.0000   0.0000          ?        ?  1913.6494  22.9868          ?        ?      437.4        2.6       ?       ? 
1 1 1   27    2   48 o    397.6    2.8    0.0000   0.0000          ?        ?  1580.9796  22.3483          ?        ?      397.6        2.8       ?       ? 
1 1 1   27    2   49 o    263.4    3.5    0.0000   0.0000          ?        ?   694.0730  18.5171          ?        ?      263.4        3.5       ?       ? 
1 1 1   27    2   50 o    347.2    3.3    0.0000   0.0000          ?        ?  1206.1674  22.9868          ?        ?      347.2        3.3       ?       ? 
1 1 1   27    2   51 o    357.2    2.9    0.0000   0.0000          ?        ?  1276.4047  21.0712          ?        ?      357.2        2.9       ?       ? 
1 1 1   27    2   52 o    367.4    3.1    0.0000   0.0000          ?        ?  1350.4733  22.9868          ?        ?      367.4        3.1       ?       ? 
1 1 1   27    2   53 o    343.2    3.0    0.0000   0.0000          ?        ?  1178.0724  20.4327          ?        ?      343.2        3.0       ?       ? 
1 1 1   27    2   54 o    463.8    2.8    0.0000   0.0000          ?        ?  2151.8179  26.1794          ?        ?      463.8        2.8       ?       ? 
1 1 1   27    2   55 o     64.8   15.1    0.0000   0.0000          ?        ?    44.0580  19.1556          ?        ?       64.8       15.1       ?       ? 
1 1 1   27    2   56 o     94.3    9.8    0.0000   0.0000          ?        ?    89.3930  18.5171          ?        ?       94.3        9.8       ?       ? 
1 1 1   27    2   57 o    314.8    3.2    0.0000   0.0000          ?        ?   991.6241  20.4327          ?        ?      314.8        3.2       ?       ? 
1 1 1   27    2   58 o    522.5    2.7    0.0000   0.0000          ?        ?  2731.5955  28.0950          ?        ?      522.5        2.7       ?       ? 
1 1 1   27    2   59 o    162.8    6.1    0.0000   0.0000          ?        ?   265.6250  19.7942          ?        ?      162.8        6.1       ?       ? 
1 1 1   27    2   60 o    373.9    3.1    0.0000   0.0000          ?        ?  1399.0010  22.9868          ?        ?      373.9        3.1       ?       ? 
1 1 1   27    2   61 o    108.1    9.2    0.0000   0.0000          ?        ?   117.4880  19.7942          ?        ?      108.1        9.2       ?       ? 
1 1 1   27    2   62 o    797.3    3.2    0.0000   0.0000          ?        ?  6360.3140  51.0817          ?        ?      797.3        3.2       ?       ? 
1 1 1   27    2   63 o    269.8    4.1    0.0000   0.0000          ?        ?   728.5532  22.3483          ?        ?      269.8        4.1       ?       ? 
1 1 1   27    2   64 o    127.8    8.0    0.0000   0.0000          ?        ?   164.1001  20.4327          ?        ?      127.8        8.0       ?       ? 
1 1 1   27    2   65 o    306.0    3.4    0.0000   0.0000          ?        ?   937.3498  21.0712          ?        ?      306.0        3.4       ?       ? 
1 1 1   27    2   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    2   67 f    191.7    5.5    0.0000   0.0000          ?        ?   368.4270  21.0712          ?        ?      191.7        5.5       ?       ? 
1 1 1   27    2   68 o    274.1    4.1    0.0000   0.0000          ?        ?   752.8170  22.3483          ?        ?      274.1        4.1       ?       ? 
1 1 1   27    2   69 o     66.9   15.9    0.0000   0.0000          ?        ?    47.8891  21.0712          ?        ?       66.9       15.9       ?       ? 
1 1 1   27    2   70 o     76.3   13.9    0.0000   0.0000          ?        ?    61.2981  20.4327          ?        ?       76.3       13.9       ?       ? 
1 1 1   27    2   71 o    234.0    4.5    0.0000   0.0000          ?        ?   549.1286  21.0712          ?        ?      234.0        4.5       ?       ? 
1 1 1   27    2   72 o    197.1    5.3    0.0000   0.0000          ?        ?   390.1367  21.0712          ?        ?      197.1        5.3       ?       ? 
1 1 1   27    2   73 o    173.6    5.9    0.0000   0.0000          ?        ?   303.2978  20.4327          ?        ?      173.6        5.9       ?       ? 
1 1 1   27    2   74 o    106.3    9.6    0.0000   0.0000          ?        ?   114.9339  20.4327          ?        ?      106.3        9.6       ?       ? 
1 1 1   27    2   75 o    161.6    5.7    0.0000   0.0000          ?        ?   263.0709  18.5171          ?        ?      161.6        5.7       ?       ? 
1 1 1   27    3    0 o    605.9    3.5 3671.4993  42.7809  3671.4993  42.7809  3671.4993  42.7809      605.9      3.5      605.9        3.5     0.0     0.0 
1 1 1   27    3    1 o    978.2    3.5    0.0000   0.0000          ?        ?  9568.2461  68.9603          ?        ?      978.2        3.5       ?       ? 
1 1 1   27    3    2 o    527.0    2.2    0.0000   0.0000          ?        ?  2777.5691  23.6253          ?        ?      527.0        2.2       ?       ? 
1 1 1   27    3    3 f   1643.8    5.5    0.0000   0.0000          ?        ? 27024.7891 180.0631          ?        ?     1643.8        5.5       ?       ? 
1 1 1   27    3    4 o    863.3    3.1    0.0000   0.0000          ?        ?  7452.8242  54.2743          ?        ?      863.3        3.1       ?       ? 
1 1 1   27    3    5 o    922.5    3.3    0.0000   0.0000          ?        ?  8509.5771  61.2981          ?        ?      922.5        3.3       ?       ? 
1 1 1   27    3    6 o    682.9    2.7    0.0000   0.0000          ?        ?  4663.7622  36.3957          ?        ?      682.9        2.7       ?       ? 
1 1 1   27    3    7 o    570.1    2.5    0.0000   0.0000          ?        ?  3250.7136  28.0950          ?        ?      570.1        2.5       ?       ? 
1 1 1   27    3    8 o    563.9    2.5    0.0000   0.0000          ?        ?  3179.8376  28.0950          ?        ?      563.9        2.5       ?       ? 
1 1 1   27    3    9 f    373.1    2.4    0.0000   0.0000          ?        ?  1391.9772  17.8786          ?        ?      373.1        2.4       ?       ? 
1 1 1   27    3   10 o   1478.0    5.2    0.0000   0.0000          ?        ? 21847.0176 153.2452          ?        ?     1478.0        5.2       ?       ? 
1 1 1   27    3   11 o   2249.6    7.6    0.0000   0.0000          ?        ? 50616.2500 342.8861          ?        ?     2249.6        7.6       ?       ? 
1 1 1   27    3   12 o   2508.6    8.4    0.0000   0.0000          ?        ? 62945.4609 422.7013          ?        ?     2508.6        8.4       ?       ? 
1 1 1   27    3   13 o   1548.9    5.4    0.0000   0.0000          ?        ? 23993.7266 167.2927          ?        ?     1548.9        5.4       ?       ? 
1 1 1   27    3   14 o   1170.9    4.2    0.0000   0.0000          ?        ? 13710.9756  97.6938          ?        ?     1170.9        4.2       ?       ? 
1 1 1   27    3   15 o   2203.3    7.4    0.0000   0.0000          ?        ? 48553.1836 328.2001          ?        ?     2203.3        7.4       ?       ? 
1 1 1   27    3   16 o   1325.9    4.7    0.0000   0.0000          ?        ? 17581.0547 124.5117          ?        ?     1325.9        4.7       ?       ? 
1 1 1   27    3   17 o    962.7    3.5    0.0000   0.0000          ?        ?  9267.5029  67.0448          ?        ?      962.7        3.5       ?       ? 
1 1 1   27    3   18 o   1113.7    4.0    0.0000   0.0000          ?        ? 12404.5596  89.3930          ?        ?     1113.7        4.0       ?       ? 
1 1 1   27    3   19 o    497.2    2.6    0.0000   0.0000          ?        ?  2471.7173  26.1794          ?        ?      497.2        2.6       ?       ? 
1 1 1   27    3   20 o    358.3    2.4    0.0000   0.0000          ?        ?  1284.0670  17.2401          ?        ?      358.3        2.4       ?       ? 
1 1 1   27    3   21 o    162.4    4.1    0.0000   0.0000          ?        ?   263.7094  13.4090          ?        ?      162.4        4.1       ?       ? 
1 1 1   27    3   22 o    733.9    3.0    0.0000   0.0000          ?        ?  5385.9297  44.0580          ?        ?      733.9        3.0       ?       ? 
1 1 1   27    3   23 o    802.6    3.1    0.0000   0.0000          ?        ?  6441.4062  50.4432          ?        ?      802.6        3.1       ?       ? 
1 1 1   27    3   24 o   1162.1    4.3    0.0000   0.0000          ?        ? 13505.3711 100.8864          ?        ?     1162.1        4.3       ?       ? 
1 1 1   27    3   25 f   1172.9    4.7    0.0000   0.0000          ?        ? 13758.2256 110.4642          ?        ?     1172.9        4.7       ?       ? 
1 1 1   27    3   26 f    393.5    2.4    0.0000   0.0000          ?        ?  1548.4149  19.1556          ?        ?      393.5        2.4       ?       ? 
1 1 1   27    3   27 o    475.2    2.6    0.0000   0.0000          ?        ?  2257.8125  24.2638          ?        ?      475.2        2.6       ?       ? 
1 1 1   27    3   28 o   1441.1    5.4    0.0000   0.0000          ?        ? 20770.4688 154.5222          ?        ?     1441.1        5.4       ?       ? 
1 1 1   27    3   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    3   30 o   1187.5    4.4    0.0000   0.0000          ?        ? 14104.3037 104.0790          ?        ?     1187.5        4.4       ?       ? 
1 1 1   27    3   31 o   1746.8    6.5    0.0000   0.0000          ?        ? 30520.6953 227.9522          ?        ?     1746.8        6.5       ?       ? 
1 1 1   27    3   32 o   1350.4    5.0    0.0000   0.0000          ?        ? 18238.7305 135.3666          ?        ?     1350.4        5.0       ?       ? 
1 1 1   27    3   33 o    855.6    3.3    0.0000   0.0000          ?        ?  7321.9272  56.8284          ?        ?      855.6        3.3       ?       ? 
1 1 1   27    3   34 o    760.9    3.1    0.0000   0.0000          ?        ?  5790.1143  47.8891          ?        ?      760.9        3.1       ?       ? 
1 1 1   27    3   35 o    811.8    3.3    0.0000   0.0000          ?        ?  6591.4590  53.6358          ?        ?      811.8        3.3       ?       ? 
1 1 1   27    3   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    3   37 o    506.7    2.6    0.0000   0.0000          ?        ?  2568.1340  26.1794          ?        ?      506.7        2.6       ?       ? 
1 1 1   27    3   38 o    262.2    3.4    0.0000   0.0000          ?        ?   687.6877  17.8786          ?        ?      262.2        3.4       ?       ? 
1 1 1   27    3   39 o    693.0    2.9    0.0000   0.0000          ?        ?  4802.9600  39.5883          ?        ?      693.0        2.9       ?       ? 
1 1 1   27    3   40 o    565.3    2.7    0.0000   0.0000          ?        ?  3196.4392  30.0105          ?        ?      565.3        2.7       ?       ? 
1 1 1   27    3   41 o    484.8    2.7    0.0000   0.0000          ?        ?  2350.3982  26.1794          ?        ?      484.8        2.7       ?       ? 
1 1 1   27    3   42 o    390.7    2.7    0.0000   0.0000          ?        ?  1526.7052  21.0712          ?        ?      390.7        2.7       ?       ? 
1 1 1   27    3   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    3   44 o    544.3    2.6    0.0000   0.0000          ?        ?  2963.3789  28.7335          ?        ?      544.3        2.6       ?       ? 
1 1 1   27    3   45 o    470.3    2.6    0.0000   0.0000          ?        ?  2211.8389  24.2638          ?        ?      470.3        2.6       ?       ? 
1 1 1   27    3   46 o    244.0    3.5    0.0000   0.0000          ?        ?   595.7407  17.2401          ?        ?      244.0        3.5       ?       ? 
1 1 1   27    3   47 o    427.7    2.7    0.0000   0.0000          ?        ?  1830.0031  22.9868          ?        ?      427.7        2.7       ?       ? 
1 1 1   27    3   48 o    418.2    2.7    0.0000   0.0000          ?        ?  1748.9106  22.9868          ?        ?      418.2        2.7       ?       ? 
1 1 1   27    3   49 o    420.0    2.7    0.0000   0.0000          ?        ?  1764.2352  22.9868          ?        ?      420.0        2.7       ?       ? 
1 1 1   27    3   50 o    399.8    2.8    0.0000   0.0000          ?        ?  1598.8582  22.3483          ?        ?      399.8        2.8       ?       ? 
1 1 1   27    3   51 o    501.4    2.9    0.0000   0.0000          ?        ?  2514.4980  28.7335          ?        ?      501.4        2.9       ?       ? 
1 1 1   27    3   52 o    363.9    3.0    0.0000   0.0000          ?        ?  1324.2938  21.7097          ?        ?      363.9        3.0       ?       ? 
1 1 1   27    3   53 o    112.6    7.9    0.0000   0.0000          ?        ?   127.0658  17.8786          ?        ?      112.6        7.9       ?       ? 
1 1 1   27    3   54 o     61.9   15.1    0.0000   0.0000          ?        ?    40.2269  18.5171          ?        ?       61.9       15.1       ?       ? 
1 1 1   27    3   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    3   56 f    346.7    3.0    0.0000   0.0000          ?        ?  1202.3362  21.0712          ?        ?      346.7        3.0       ?       ? 
1 1 1   27    3   57 o    417.0    2.8    0.0000   0.0000          ?        ?  1739.3329  23.6253          ?        ?      417.0        2.8       ?       ? 
1 1 1   27    3   58 o    288.7    3.5    0.0000   0.0000          ?        ?   833.9093  20.4327          ?        ?      288.7        3.5       ?       ? 
1 1 1   27    3   59 o    170.3    6.0    0.0000   0.0000          ?        ?   290.5273  20.4327          ?        ?      170.3        6.0       ?       ? 
1 1 1   27    3   60 o    332.1    3.3    0.0000   0.0000          ?        ?  1103.3654  21.7097          ?        ?      332.1        3.3       ?       ? 
1 1 1   27    3   61 o    428.3    2.9    0.0000   0.0000          ?        ?  1835.7496  24.9023          ?        ?      428.3        2.9       ?       ? 
1 1 1   27    3   62 o    205.4    5.1    0.0000   0.0000          ?        ?   422.7013  21.0712          ?        ?      205.4        5.1       ?       ? 
1 1 1   27    3   63 o     32.6   14.6    0.0000   0.0000          ?        ?    -8.9393  19.7942          ?        ?       32.6       14.6       ?       ? 
1 1 1   27    3   64 f    175.6    5.5    0.0000   0.0000          ?        ?   309.0445  19.1556          ?        ?      175.6        5.5       ?       ? 
1 1 1   27    3   65 o    315.4    3.4    0.0000   0.0000          ?        ?   995.4552  21.7097          ?        ?      315.4        3.4       ?       ? 
1 1 1   27    3   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    3   67 o    183.0    5.8    0.0000   0.0000          ?        ?   335.8624  21.0712          ?        ?      183.0        5.8       ?       ? 
1 1 1   27    3   68 o    227.2    4.6    0.0000   0.0000          ?        ?   517.2025  21.0712          ?        ?      227.2        4.6       ?       ? 
1 1 1   27    3   69 o     24.6   12.1    0.0000   0.0000          ?        ?   -44.0580  21.0712          ?        ?       24.6       12.1       ?       ? 
1 1 1   27    3   70 o     35.8   15.5    0.0000   0.0000          ?        ?    -1.9156  20.4327          ?        ?       35.8       15.5       ?       ? 
1 1 1   27    3   71 o    330.1    3.5    0.0000   0.0000          ?        ?  1091.2334  22.9868          ?        ?      330.1        3.5       ?       ? 
1 1 1   27    3   72 f    188.7    5.2    0.0000   0.0000          ?        ?   357.5721  19.7942          ?        ?      188.7        5.2       ?       ? 
1 1 1   27    3   73 o    126.1    8.1    0.0000   0.0000          ?        ?   160.9075  20.4327          ?        ?      126.1        8.1       ?       ? 
1 1 1   27    3   74 o    120.6    8.2    0.0000   0.0000          ?        ?   147.4985  19.7942          ?        ?      120.6        8.2       ?       ? 
1 1 1   27    4    0 f    535.4    3.3 2866.9622  35.7572  2866.9622  35.7572  2866.9622  35.7572      535.4      3.3      535.4        3.3     0.0     0.0 
1 1 1   27    4    1 o    817.0    3.1    0.0000   0.0000          ?        ?  6674.4668  50.4432          ?        ?      817.0        3.1       ?       ? 
1 1 1   27    4    2 o    607.1    2.6    0.0000   0.0000          ?        ?  3686.1853  31.9261          ?        ?      607.1        2.6       ?       ? 
1 1 1   27    4    3 o   1808.3    6.1    0.0000   0.0000          ?        ? 32703.7988 221.5670          ?        ?     1808.3        6.1       ?       ? 
1 1 1   27    4    4 o   1389.4    4.9    0.0000   0.0000          ?        ? 19305.7012 136.6436          ?        ?     1389.4        4.9       ?       ? 
1 1 1   27    4    5 o   1740.8    6.2    0.0000   0.0000          ?        ? 30308.0684 214.5433          ?        ?     1740.8        6.2       ?       ? 
1 1 1   27    4    6 o    512.7    2.5    0.0000   0.0000          ?        ?  2628.7937  25.5409          ?        ?      512.7        2.5       ?       ? 
1 1 1   27    4    7 o   1598.1    5.7    0.0000   0.0000          ?        ? 25540.8652 182.6172          ?        ?     1598.1        5.7       ?       ? 
1 1 1   27    4    8 o   1376.9    5.0    0.0000   0.0000          ?        ? 18959.6230 137.2822          ?        ?     1376.9        5.0       ?       ? 
1 1 1   27    4    9 o    557.9    2.6    0.0000   0.0000          ?        ?  3112.1543  29.3720          ?        ?      557.9        2.6       ?       ? 
1 1 1   27    4   10 o    486.0    2.5    0.0000   0.0000          ?        ?  2361.8914  24.2638          ?        ?      486.0        2.5       ?       ? 
1 1 1   27    4   11 o   1055.6    4.1    0.0000   0.0000          ?        ? 11142.8408  85.5619          ?        ?     1055.6        4.1       ?       ? 
1 1 1   27    4   12 o   1251.5    4.5    0.0000   0.0000          ?        ? 15662.9355 112.3798          ?        ?     1251.5        4.5       ?       ? 
1 1 1   27    4   13 o    373.3    2.3    0.0000   0.0000          ?        ?  1393.2542  17.2401          ?        ?      373.3        2.3       ?       ? 
1 1 1   27    4   14 o   1450.5    5.1    0.0000   0.0000          ?        ? 21042.4805 147.4985          ?        ?     1450.5        5.1       ?       ? 
1 1 1   27    4   15 o   1332.2    4.6    0.0000   0.0000          ?        ? 17748.3477 123.8732          ?        ?     1332.2        4.6       ?       ? 
1 1 1   27    4   16 o    900.6    3.3    0.0000   0.0000          ?        ?  8111.1406  60.0210          ?        ?      900.6        3.3       ?       ? 
1 1 1   27    4   17 o    366.6    2.1    0.0000   0.0000          ?        ?  1344.0880  15.3245          ?        ?      366.6        2.1       ?       ? 
1 1 1   27    4   18 o   1371.6    4.8    0.0000   0.0000          ?        ? 18814.0391 132.8125          ?        ?     1371.6        4.8       ?       ? 
1 1 1   27    4   19 o   1192.7    4.2    0.0000   0.0000          ?        ? 14226.2617 100.8864          ?        ?     1192.7        4.2       ?       ? 
1 1 1   27    4   20 o    557.1    2.6    0.0000   0.0000          ?        ?  3103.2151  29.3720          ?        ?      557.1        2.6       ?       ? 
1 1 1   27    4   21 o    912.2    3.4    0.0000   0.0000          ?        ?  8321.8525  61.9366          ?        ?      912.2        3.4       ?       ? 
1 1 1   27    4   22 o   1894.2    6.5    0.0000   0.0000          ?        ? 35886.1953 245.1923          ?        ?     1894.2        6.5       ?       ? 
1 1 1   27    4   23 o    598.2    2.7    0.0000   0.0000          ?        ?  3578.9138  32.5646          ?        ?      598.2        2.7       ?       ? 
1 1 1   27    4   24 o   1359.5    4.7    0.0000   0.0000          ?        ? 18484.5625 128.3428          ?        ?     1359.5        4.7       ?       ? 
1 1 1   27    4   25 o    883.7    3.5    0.0000   0.0000          ?        ?  7809.1196  61.2981          ?        ?      883.7        3.5       ?       ? 
1 1 1   27    4   26 o    462.6    2.6    0.0000   0.0000          ?        ?  2139.6860  23.6253          ?        ?      462.6        2.6       ?       ? 
1 1 1   27    4   27 f    716.7    3.1    0.0000   0.0000          ?        ?  5136.9062  44.0580          ?        ?      716.7        3.1       ?       ? 
1 1 1   27    4   28 o    717.5    3.2    0.0000   0.0000          ?        ?  5147.7612  46.6121          ?        ?      717.5        3.2       ?       ? 
1 1 1   27    4   29 f    950.6    3.6    0.0000   0.0000          ?        ?  9037.6357  68.9603          ?        ?      950.6        3.6       ?       ? 
1 1 1   27    4   30 o    431.2    2.7    0.0000   0.0000          ?        ?  1859.3750  22.9868          ?        ?      431.2        2.7       ?       ? 
1 1 1   27    4   31 o   1678.4    6.3    0.0000   0.0000          ?        ? 28176.0449 211.3506          ?        ?     1678.4        6.3       ?       ? 
1 1 1   27    4   32 o   1000.9    3.9    0.0000   0.0000          ?        ? 10018.4043  77.8996          ?        ?     1000.9        3.9       ?       ? 
1 1 1   27    4   33 o    689.2    3.0    0.0000   0.0000          ?        ?  4750.6011  40.8654          ?        ?      689.2        3.0       ?       ? 
1 1 1   27    4   34 o    510.7    2.8    0.0000   0.0000          ?        ?  2608.3608  28.7335          ?        ?      510.7        2.8       ?       ? 
1 1 1   27    4   35 o    779.9    3.2    0.0000   0.0000          ?        ?  6083.1958  49.1662          ?        ?      779.9        3.2       ?       ? 
1 1 1   27    4   36 o    144.9    5.9    0.0000   0.0000          ?        ?   210.0736  17.2401          ?        ?      144.9        5.9       ?       ? 
1 1 1   27    4   37 o    458.7    2.5    0.0000   0.0000          ?        ?  2104.5674  22.9868          ?        ?      458.7        2.5       ?       ? 
1 1 1   27    4   38 o    605.6    2.6    0.0000   0.0000          ?        ?  3667.6685  31.9261          ?        ?      605.6        2.6       ?       ? 
1 1 1   27    4   39 o    483.0    2.6    0.0000   0.0000          ?        ?  2333.1580  24.9023          ?        ?      483.0        2.6       ?       ? 
1 1 1   27    4   40 o    236.9    3.6    0.0000   0.0000          ?        ?   561.2605  17.2401          ?        ?      236.9        3.6       ?       ? 
1 1 1   27    4   41 o    723.0    2.9    0.0000   0.0000          ?        ?  5227.5767  42.1424          ?        ?      723.0        2.9       ?       ? 
1 1 1   27    4   42 o    474.3    2.6    0.0000   0.0000          ?        ?  2249.5117  24.9023          ?        ?      474.3        2.6       ?       ? 
1 1 1   27    4   43 o    174.7    4.8    0.0000   0.0000          ?        ?   305.2133  16.6016          ?        ?      174.7        4.8       ?       ? 
1 1 1   27    4   44 o    512.5    2.6    0.0000   0.0000          ?        ?  2626.8779  26.8179          ?        ?      512.5        2.6       ?       ? 
1 1 1   27    4   45 o    337.7    2.9    0.0000   0.0000          ?        ?  1140.3997  19.7942          ?        ?      337.7        2.9       ?       ? 
1 1 1   27    4   46 o    692.3    2.9    0.0000   0.0000          ?        ?  4793.3818  40.2269          ?        ?      692.3        2.9       ?       ? 
1 1 1   27    4   47 o    453.7    2.7    0.0000   0.0000          ?        ?  2058.5938  24.9023          ?        ?      453.7        2.7       ?       ? 
1 1 1   27    4   48 o    624.0    2.9    0.0000   0.0000          ?        ?  3894.9819  35.7572          ?        ?      624.0        2.9       ?       ? 
1 1 1   27    4   49 o    261.7    3.5    0.0000   0.0000          ?        ?   685.1337  18.5171          ?        ?      261.7        3.5       ?       ? 
1 1 1   27    4   50 o    472.1    2.6    0.0000   0.0000          ?        ?  2229.0791  24.9023          ?        ?      472.1        2.6       ?       ? 
1 1 1   27    4   51 o     28.0   12.9    0.0000   0.0000          ?        ?   -12.7704  16.6016          ?        ?       28.0       12.9       ?       ? 
1 1 1   27    4   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    4   53 o    162.7    5.5    0.0000   0.0000          ?        ?   264.9865  17.8786          ?        ?      162.7        5.5       ?       ? 
1 1 1   27    4   54 o    108.8    8.5    0.0000   0.0000          ?        ?   118.7650  18.5171          ?        ?      108.8        8.5       ?       ? 
1 1 1   27    4   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    4   56 o    153.8    6.0    0.0000   0.0000          ?        ?   236.8915  18.5171          ?        ?      153.8        6.0       ?       ? 
1 1 1   27    4   57 o    401.9    2.9    0.0000   0.0000          ?        ?  1616.0983  23.6253          ?        ?      401.9        2.9       ?       ? 
1 1 1   27    4   58 o    219.4    4.7    0.0000   0.0000          ?        ?   482.0838  20.4327          ?        ?      219.4        4.7       ?       ? 
1 1 1   27    4   59 o    225.6    4.2    0.0000   0.0000          ?        ?   509.5403  19.1556          ?        ?      225.6        4.2       ?       ? 
1 1 1   27    4   60 o    284.0    3.7    0.0000   0.0000          ?        ?   807.0914  21.0712          ?        ?      284.0        3.7       ?       ? 
1 1 1   27    4   61 o    261.8    3.8    0.0000   0.0000          ?        ?   685.7722  19.7942          ?        ?      261.8        3.8       ?       ? 
1 1 1   27    4   62 o    203.7    5.0    0.0000   0.0000          ?        ?   415.6776  20.4327          ?        ?      203.7        5.0       ?       ? 
1 1 1   27    4   63 o    115.2    8.6    0.0000   0.0000          ?        ?   133.4510  19.7942          ?        ?      115.2        8.6       ?       ? 
1 1 1   27    4   64 o     32.8   14.7    0.0000   0.0000          ?        ?    -8.3008  19.7942          ?        ?       32.8       14.7       ?       ? 
1 1 1   27    4   65 o    129.2    7.9    0.0000   0.0000          ?        ?   167.9312  20.4327          ?        ?      129.2        7.9       ?       ? 
1 1 1   27    4   66 o     28.6   13.4    0.0000   0.0000          ?        ?   -18.5171  19.1556          ?        ?       28.6       13.4       ?       ? 
1 1 1   27    4   67 o    113.6    9.3    0.0000   0.0000          ?        ?   130.2584  21.0712          ?        ?      113.6        9.3       ?       ? 
1 1 1   27    4   68 o     23.3   11.6    0.0000   0.0000          ?        ?   -51.7203  21.0712          ?        ?       23.3       11.6       ?       ? 
1 1 1   27    4   69 o     77.9   14.0    0.0000   0.0000          ?        ?    63.8522  21.0712          ?        ?       77.9       14.0       ?       ? 
1 1 1   27    4   70 o    156.3    6.7    0.0000   0.0000          ?        ?   245.8308  21.0712          ?        ?      156.3        6.7       ?       ? 
1 1 1   27    4   71 o    261.5    4.3    0.0000   0.0000          ?        ?   685.7722  22.3483          ?        ?      261.5        4.3       ?       ? 
1 1 1   27    4   72 o     26.3   12.8    0.0000   0.0000          ?        ?   -37.6728  21.7097          ?        ?       26.3       12.8       ?       ? 
1 1 1   27    4   73 o    205.2    5.4    0.0000   0.0000          ?        ?   423.3398  22.3483          ?        ?      205.2        5.4       ?       ? 
1 1 1   27    4   74 o     30.2   14.1    0.0000   0.0000          ?        ?   -18.5171  21.0712          ?        ?       30.2       14.1       ?       ? 
1 1 1   27    5    0 o   1022.0    5.2 10446.2139 105.3561 10446.2139 105.3561 10446.2139 105.3561     1022.0      5.2     1022.0        5.2     0.0     0.0 
1 1 1   27    5    1 o   1352.7    4.6    0.0000   0.0000          ?        ? 18298.7539 125.1502          ?        ?     1352.7        4.6       ?       ? 
1 1 1   27    5    2 o   1252.7    4.4    0.0000   0.0000          ?        ? 15694.2227 110.4642          ?        ?     1252.7        4.4       ?       ? 
1 1 1   27    5    3 o   1255.4    4.4    0.0000   0.0000          ?        ? 15761.2676 109.8257          ?        ?     1255.4        4.4       ?       ? 
1 1 1   27    5    4 o   1799.2    6.1    0.0000   0.0000          ?        ? 32373.6855 219.0129          ?        ?     1799.2        6.1       ?       ? 
1 1 1   27    5    5 o    484.0    2.4    0.0000   0.0000          ?        ?  2342.7358  22.9868          ?        ?      484.0        2.4       ?       ? 
1 1 1   27    5    6 o   1097.3    4.0    0.0000   0.0000          ?        ? 12041.2412  86.8389          ?        ?     1097.3        4.0       ?       ? 
1 1 1   27    5    7 o   1034.0    3.8    0.0000   0.0000          ?        ? 10692.0449  78.5382          ?        ?     1034.0        3.8       ?       ? 
1 1 1   27    5    8 o    605.0    2.5    0.0000   0.0000          ?        ?  3660.6443  30.6490          ?        ?      605.0        2.5       ?       ? 
1 1 1   27    5    9 o    926.2    3.5    0.0000   0.0000          ?        ?  8578.5381  65.1292          ?        ?      926.2        3.5       ?       ? 
1 1 1   27    5   10 o   1376.0    4.9    0.0000   0.0000          ?        ? 18935.9980 134.0895          ?        ?     1376.0        4.9       ?       ? 
1 1 1   27    5   11 o   1114.8    4.4    0.0000   0.0000          ?        ? 12428.8232  97.0553          ?        ?     1114.8        4.4       ?       ? 
1 1 1   27    5   12 o   2312.9    8.0    0.0000   0.0000          ?        ? 53506.8359 370.3425          ?        ?     2312.9        8.0       ?       ? 
1 1 1   27    5   13 o   1328.7    4.7    0.0000   0.0000          ?        ? 17655.7617 125.7888          ?        ?     1328.7        4.7       ?       ? 
1 1 1   27    5   14 o   1382.3    4.9    0.0000   0.0000          ?        ? 19109.0371 134.7281          ?        ?     1382.3        4.9       ?       ? 
1 1 1   27    5   15 o    736.8    3.0    0.0000   0.0000          ?        ?  5428.7109  44.0580          ?        ?      736.8        3.0       ?       ? 
1 1 1   27    5   16 o    739.8    3.0    0.0000   0.0000          ?        ?  5472.7686  44.0580          ?        ?      739.8        3.0       ?       ? 
1 1 1   27    5   17 o   1279.9    4.7    0.0000   0.0000          ?        ? 16381.9111 119.4035          ?        ?     1279.9        4.7       ?       ? 
1 1 1   27    5   18 f    366.6    2.5    0.0000   0.0000          ?        ?  1344.0880  18.5171          ?        ?      366.6        2.5       ?       ? 
1 1 1   27    5   19 o    167.6    4.4    0.0000   0.0000          ?        ?   280.9495  14.6860          ?        ?      167.6        4.4       ?       ? 
1 1 1   27    5   20 o    570.1    2.6    0.0000   0.0000          ?        ?  3250.0752  29.3720          ?        ?      570.1        2.6       ?       ? 
1 1 1   27    5   21 o   1097.1    4.2    0.0000   0.0000          ?        ? 12037.4092  91.3086          ?        ?     1097.1        4.2       ?       ? 
1 1 1   27    5   22 o    233.8    3.0    0.0000   0.0000          ?        ?   546.5745  14.0475          ?        ?      233.8        3.0       ?       ? 
1 1 1   27    5   23 o   1111.6    4.1    0.0000   0.0000          ?        ? 12356.6699  90.6701          ?        ?     1111.6        4.1       ?       ? 
1 1 1   27    5   24 o    212.9    4.8    0.0000   0.0000          ?        ?   453.3503  20.4327          ?        ?      212.9        4.8       ?       ? 
1 1 1   27    5   25 o    245.9    3.5    0.0000   0.0000          ?        ?   604.6799  17.2401          ?        ?      245.9        3.5       ?       ? 
1 1 1   27    5   26 o    894.3    3.6    0.0000   0.0000          ?        ?  7997.4834  63.8522          ?        ?      894.3        3.6       ?       ? 
1 1 1   27    5   27 o    950.5    3.8    0.0000   0.0000          ?        ?  9035.0811  72.1529          ?        ?      950.5        3.8       ?       ? 
1 1 1   27    5   28 o    906.1    3.8    0.0000   0.0000          ?        ?  8211.3877  68.9603          ?        ?      906.1        3.8       ?       ? 
1 1 1   27    5   29 o    310.4    3.6    0.0000   0.0000          ?        ?   963.5291  22.3483          ?        ?      310.4        3.6       ?       ? 
1 1 1   27    5   30 o    488.7    2.7    0.0000   0.0000          ?        ?  2388.0708  26.8179          ?        ?      488.7        2.7       ?       ? 
1 1 1   27    5   31 o    251.2    3.4    0.0000   0.0000          ?        ?   630.8594  17.2401          ?        ?      251.2        3.4       ?       ? 
1 1 1   27    5   32 o   1052.8    4.2    0.0000   0.0000          ?        ? 11086.0117  88.1160          ?        ?     1052.8        4.2       ?       ? 
1 1 1   27    5   33 o    380.3    2.7    0.0000   0.0000          ?        ?  1446.2515  20.4327          ?        ?      380.3        2.7       ?       ? 
1 1 1   27    5   34 f     59.6   15.0    0.0000   0.0000          ?        ?    37.0343  17.8786          ?        ?       59.6       15.0       ?       ? 
1 1 1   27    5   35 o   1018.2    3.8    0.0000   0.0000          ?        ? 10368.9531  76.6226          ?        ?     1018.2        3.8       ?       ? 
1 1 1   27    5   36 o    498.0    2.8    0.0000   0.0000          ?        ?  2480.0181  28.0950          ?        ?      498.0        2.8       ?       ? 
1 1 1   27    5   37 o    672.9    2.9    0.0000   0.0000          ?        ?  4528.3955  39.5883          ?        ?      672.9        2.9       ?       ? 
1 1 1   27    5   38 o    533.3    2.7    0.0000   0.0000          ?        ?  2844.6138  28.7335          ?        ?      533.3        2.7       ?       ? 
1 1 1   27    5   39 f    297.9    3.0    0.0000   0.0000          ?        ?   887.5450  17.8786          ?        ?      297.9        3.0       ?       ? 
1 1 1   27    5   40 o    295.3    3.5    0.0000   0.0000          ?        ?   872.2206  20.4327          ?        ?      295.3        3.5       ?       ? 
1 1 1   27    5   41 o   1031.1    4.0    0.0000   0.0000          ?        ? 10633.9395  82.3693          ?        ?     1031.1        4.0       ?       ? 
1 1 1   27    5   42 o    213.6    4.0    0.0000   0.0000          ?        ?   456.5430  17.2401          ?        ?      213.6        4.0       ?       ? 
1 1 1   27    5   43 o    354.1    2.9    0.0000   0.0000          ?        ?  1254.0564  20.4327          ?        ?      354.1        2.9       ?       ? 
1 1 1   27    5   44 o    663.5    3.0    0.0000   0.0000          ?        ?  4403.8838  39.5883          ?        ?      663.5        3.0       ?       ? 
1 1 1   27    5   45 o    571.4    3.0    0.0000   0.0000          ?        ?  3265.3997  33.8416          ?        ?      571.4        3.0       ?       ? 
1 1 1   27    5   46 o    151.1    6.1    0.0000   0.0000          ?        ?   228.5907  18.5171          ?        ?      151.1        6.1       ?       ? 
1 1 1   27    5   47 o    363.4    2.8    0.0000   0.0000          ?        ?  1321.1012  20.4327          ?        ?      363.4        2.8       ?       ? 
1 1 1   27    5   48 o    396.0    2.8    0.0000   0.0000          ?        ?  1568.2091  22.3483          ?        ?      396.0        2.8       ?       ? 
1 1 1   27    5   49 o    156.5    5.5    0.0000   0.0000          ?        ?   245.1923  17.2401          ?        ?      156.5        5.5       ?       ? 
1 1 1   27    5   50 o    234.1    3.8    0.0000   0.0000          ?        ?   548.4901  17.8786          ?        ?      234.1        3.8       ?       ? 
1 1 1   27    5   51 o     92.7   10.0    0.0000   0.0000          ?        ?    86.2004  18.5171          ?        ?       92.7       10.0       ?       ? 
1 1 1   27    5   52 o    183.2    5.4    0.0000   0.0000          ?        ?   335.8624  19.7942          ?        ?      183.2        5.4       ?       ? 
1 1 1   27    5   53 o     89.1   10.4    0.0000   0.0000          ?        ?    79.8152  18.5171          ?        ?       89.1       10.4       ?       ? 
1 1 1   27    5   54 o    339.6    3.3    0.0000   0.0000          ?        ?  1153.8086  22.3483          ?        ?      339.6        3.3       ?       ? 
1 1 1   27    5   55 o    161.1    5.9    0.0000   0.0000          ?        ?   259.8783  19.1556          ?        ?      161.1        5.9       ?       ? 
1 1 1   27    5   56 o    208.9    4.7    0.0000   0.0000          ?        ?   436.7488  19.7942          ?        ?      208.9        4.7       ?       ? 
1 1 1   27    5   57 o    140.1    6.8    0.0000   0.0000          ?        ?   196.6647  19.1556          ?        ?      140.1        6.8       ?       ? 
1 1 1   27    5   58 o    319.5    3.4    0.0000   0.0000          ?        ?  1021.6346  21.7097          ?        ?      319.5        3.4       ?       ? 
1 1 1   27    5   59 o    373.2    3.0    0.0000   0.0000          ?        ?  1393.8927  22.3483          ?        ?      373.2        3.0       ?       ? 
1 1 1   27    5   60 o    484.8    2.8    0.0000   0.0000          ?        ?  2351.0366  26.8179          ?        ?      484.8        2.8       ?       ? 
1 1 1   27    5   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    5   62 o    226.4    4.7    0.0000   0.0000          ?        ?   513.3714  21.0712          ?        ?      226.4        4.7       ?       ? 
1 1 1   27    5   63 o    219.1    4.7    0.0000   0.0000          ?        ?   480.8068  20.4327          ?        ?      219.1        4.7       ?       ? 
1 1 1   27    5   64 o    393.2    2.9    0.0000   0.0000          ?        ?  1547.1379  22.9868          ?        ?      393.2        2.9       ?       ? 
1 1 1   27    5   65 o     20.6   10.4    0.0000   0.0000          ?        ?   -62.5751  19.7942          ?        ?       20.6       10.4       ?       ? 
1 1 1   27    5   66 o     49.4   17.0    0.0000   0.0000          ?        ?    22.9868  20.4327          ?        ?       49.4       17.0       ?       ? 
1 1 1   27    5   67 o    122.3    8.1    0.0000   0.0000          ?        ?   150.6911  19.7942          ?        ?      122.3        8.1       ?       ? 
1 1 1   27    5   68 o    162.4    6.3    0.0000   0.0000          ?        ?   264.9865  20.4327          ?        ?      162.4        6.3       ?       ? 
1 1 1   27    5   69 o    209.1    4.9    0.0000   0.0000          ?        ?   438.6643  20.4327          ?        ?      209.1        4.9       ?       ? 
1 1 1   27    5   70 o    136.3    7.5    0.0000   0.0000          ?        ?   187.0868  20.4327          ?        ?      136.3        7.5       ?       ? 
1 1 1   27    5   71 o    175.2    5.8    0.0000   0.0000          ?        ?   308.4059  20.4327          ?        ?      175.2        5.8       ?       ? 
1 1 1   27    5   72 o    117.8    8.7    0.0000   0.0000          ?        ?   140.4748  20.4327          ?        ?      117.8        8.7       ?       ? 
1 1 1   27    5   73 o     22.7   11.3    0.0000   0.0000          ?        ?   -47.2506  19.7942          ?        ?       22.7       11.3       ?       ? 
1 1 1   27    5   74 o     45.9   16.7    0.0000   0.0000          ?        ?    19.1556  19.7942          ?        ?       45.9       16.7       ?       ? 
1 1 1   27    6    0 o   1394.0    7.0 19435.3223 194.7491 19435.3223 194.7491 19435.3223 194.7491     1394.0      7.0     1394.0        7.0     0.0     0.0 
1 1 1   27    6    1 o   1153.7    4.2    0.0000   0.0000          ?        ? 13311.8994  97.0553          ?        ?     1153.7        4.2       ?       ? 
1 1 1   27    6    2 o   1220.4    4.4    0.0000   0.0000          ?        ? 14893.5166 107.2716          ?        ?     1220.4        4.4       ?       ? 
1 1 1   27    6    3 f   2121.0    7.1    0.0000   0.0000          ?        ? 44995.3398 300.1052          ?        ?     2121.0        7.1       ?       ? 
1 1 1   27    6    4 o   1073.3    3.9    0.0000   0.0000          ?        ? 11520.2070  83.0078          ?        ?     1073.3        3.9       ?       ? 
1 1 1   27    6    5 o    378.5    2.3    0.0000   0.0000          ?        ?  1432.8425  17.2401          ?        ?      378.5        2.3       ?       ? 
1 1 1   27    6    6 o    130.8    5.1    0.0000   0.0000          ?        ?   171.1238  13.4090          ?        ?      130.8        5.1       ?       ? 
1 1 1   27    6    7 o    887.0    3.4    0.0000   0.0000          ?        ?  7867.8633  60.0210          ?        ?      887.0        3.4       ?       ? 
1 1 1   27    6    8 o    777.6    3.1    0.0000   0.0000          ?        ?  6046.1616  47.8891          ?        ?      777.6        3.1       ?       ? 
1 1 1   27    6    9 o   1598.2    5.6    0.0000   0.0000          ?        ? 25545.9727 177.5090          ?        ?     1598.2        5.6       ?       ? 
1 1 1   27    6   10 o    880.1    3.4    0.0000   0.0000          ?        ?  7745.9058  60.6596          ?        ?      880.1        3.4       ?       ? 
1 1 1   27    6   11 o   1150.9    4.0    0.0000   0.0000          ?        ? 13247.4082  93.2242          ?        ?     1150.9        4.0       ?       ? 
1 1 1   27    6   12 o   1132.1    4.0    0.0000   0.0000          ?        ? 12817.6836  91.3086          ?        ?     1132.1        4.0       ?       ? 
1 1 1   27    6   13 o    196.5    2.6    0.0000   0.0000          ?        ?   386.3056  10.2163          ?        ?      196.5        2.6       ?       ? 
1 1 1   27    6   14 o   1330.8    4.7    0.0000   0.0000          ?        ? 17711.3125 125.7888          ?        ?     1330.8        4.7       ?       ? 
1 1 1   27    6   15 o    395.1    2.2    0.0000   0.0000          ?        ?  1561.1854  17.2401          ?        ?      395.1        2.2       ?       ? 
1 1 1   27    6   16 o   1008.7    3.7    0.0000   0.0000          ?        ? 10176.1191  74.7070          ?        ?     1008.7        3.7       ?       ? 
1 1 1   27    6   17 o    318.2    2.7    0.0000   0.0000          ?        ?  1012.6953  17.2401          ?        ?      318.2        2.7       ?       ? 
1 1 1   27    6   18 o   1168.8    4.1    0.0000   0.0000          ?        ? 13663.0859  96.4168          ?        ?     1168.8        4.1       ?       ? 
1 1 1   27    6   19 o    835.7    3.2    0.0000   0.0000          ?        ?  6984.7881  52.9973          ?        ?      835.7        3.2       ?       ? 
1 1 1   27    6   20 o   1611.9    5.5    0.0000   0.0000          ?        ? 25984.6367 176.8705          ?        ?     1611.9        5.5       ?       ? 
1 1 1   27    6   21 o    367.0    2.4    0.0000   0.0000          ?        ?  1347.2806  17.8786          ?        ?      367.0        2.4       ?       ? 
1 1 1   27    6   22 o   1302.3    4.6    0.0000   0.0000          ?        ? 16960.4102 118.7650          ?        ?     1302.3        4.6       ?       ? 
1 1 1   27    6   23 o    237.4    3.4    0.0000   0.0000          ?        ?   563.8146  15.9630          ?        ?      237.4        3.4       ?       ? 
1 1 1   27    6   24 o    949.1    3.8    0.0000   0.0000          ?        ?  9008.2637  71.5144          ?        ?      949.1        3.8       ?       ? 
1 1 1   27    6   25 o   1081.5    4.0    0.0000   0.0000          ?        ? 11698.3545  87.4775          ?        ?     1081.5        4.0       ?       ? 
1 1 1   27    6   26 o   1164.7    4.2    0.0000   0.0000          ?        ? 13567.3076  98.3323          ?        ?     1164.7        4.2       ?       ? 
1 1 1   27    6   27 o     99.8    8.3    0.0000   0.0000          ?        ?    99.6094  16.6016          ?        ?       99.8        8.3       ?       ? 
1 1 1   27    6   28 o    368.9    2.5    0.0000   0.0000          ?        ?  1360.6896  18.5171          ?        ?      368.9        2.5       ?       ? 
1 1 1   27    6   29 o    988.6    3.8    0.0000   0.0000          ?        ?  9773.8506  75.9841          ?        ?      988.6        3.8       ?       ? 
1 1 1   27    6   30 o    839.0    3.3    0.0000   0.0000          ?        ?  7040.3394  56.1899          ?        ?      839.0        3.3       ?       ? 
1 1 1   27    6   31 o    408.4    2.7    0.0000   0.0000          ?        ?  1667.8186  21.7097          ?        ?      408.4        2.7       ?       ? 
1 1 1   27    6   32 o    957.1    3.7    0.0000   0.0000          ?        ?  9161.5088  70.2374          ?        ?      957.1        3.7       ?       ? 
1 1 1   27    6   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    6   34 o    561.1    2.6    0.0000   0.0000          ?        ?  3148.5503  29.3720          ?        ?      561.1        2.6       ?       ? 
1 1 1   27    6   35 o    518.8    2.6    0.0000   0.0000          ?        ?  2692.0073  26.8179          ?        ?      518.8        2.6       ?       ? 
1 1 1   27    6   36 o    355.1    2.7    0.0000   0.0000          ?        ?  1261.0802  19.1556          ?        ?      355.1        2.7       ?       ? 
1 1 1   27    6   37 o    567.8    2.6    0.0000   0.0000          ?        ?  3224.5342  30.0105          ?        ?      567.8        2.6       ?       ? 
1 1 1   27    6   38 o    215.1    3.7    0.0000   0.0000          ?        ?   462.9282  15.9630          ?        ?      215.1        3.7       ?       ? 
1 1 1   27    6   39 o    604.6    2.7    0.0000   0.0000          ?        ?  3656.1746  33.2031          ?        ?      604.6        2.7       ?       ? 
1 1 1   27    6   40 o    586.8    2.7    0.0000   0.0000          ?        ?  3443.5471  31.9261          ?        ?      586.8        2.7       ?       ? 
1 1 1   27    6   41 o     35.0   14.8    0.0000   0.0000          ?        ?     0.6385  17.8786          ?        ?       35.0       14.8       ?       ? 
1 1 1   27    6   42 o    430.4    2.6    0.0000   0.0000          ?        ?  1852.9899  22.3483          ?        ?      430.4        2.6       ?       ? 
1 1 1   27    6   43 o    588.9    2.7    0.0000   0.0000          ?        ?  3468.4495  31.9261          ?        ?      588.9        2.7       ?       ? 
1 1 1   27    6   44 o     30.2   13.5    0.0000   0.0000          ?        ?    -7.0237  16.6016          ?        ?       30.2       13.5       ?       ? 
1 1 1   27    6   45 o    359.4    2.8    0.0000   0.0000          ?        ?  1291.7292  20.4327          ?        ?      359.4        2.8       ?       ? 
1 1 1   27    6   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    6   47 o    162.3    5.3    0.0000   0.0000          ?        ?   263.7094  17.2401          ?        ?      162.3        5.3       ?       ? 
1 1 1   27    6   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    6   49 o    156.3    5.3    0.0000   0.0000          ?        ?   244.5538  16.6016          ?        ?      156.3        5.3       ?       ? 
1 1 1   27    6   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    6   51 o    712.1    2.9    0.0000   0.0000          ?        ?  5071.7773  41.5039          ?        ?      712.1        2.9       ?       ? 
1 1 1   27    6   52 o    357.9    2.9    0.0000   0.0000          ?        ?  1281.5129  20.4327          ?        ?      357.9        2.9       ?       ? 
1 1 1   27    6   53 o    350.7    3.0    0.0000   0.0000          ?        ?  1230.4312  21.0712          ?        ?      350.7        3.0       ?       ? 
1 1 1   27    6   54 o    326.0    3.1    0.0000   0.0000          ?        ?  1063.1385  20.4327          ?        ?      326.0        3.1       ?       ? 
1 1 1   27    6   55 o    409.5    3.0    0.0000   0.0000          ?        ?  1677.3964  24.2638          ?        ?      409.5        3.0       ?       ? 
1 1 1   27    6   56 o    225.7    4.5    0.0000   0.0000          ?        ?   510.1788  20.4327          ?        ?      225.7        4.5       ?       ? 
1 1 1   27    6   57 o    234.9    4.2    0.0000   0.0000          ?        ?   552.3212  19.7942          ?        ?      234.9        4.2       ?       ? 
1 1 1   27    6   58 o    239.2    4.3    0.0000   0.0000          ?        ?   572.7539  20.4327          ?        ?      239.2        4.3       ?       ? 
1 1 1   27    6   59 o    172.9    5.7    0.0000   0.0000          ?        ?   299.4666  19.7942          ?        ?      172.9        5.7       ?       ? 
1 1 1   27    6   60 f    253.5    3.9    0.0000   0.0000          ?        ?   642.9913  19.7942          ?        ?      253.5        3.9       ?       ? 
1 1 1   27    6   61 o    132.3    7.2    0.0000   0.0000          ?        ?   175.5934  19.1556          ?        ?      132.3        7.2       ?       ? 
1 1 1   27    6   62 o     21.4   10.7    0.0000   0.0000          ?        ?   -52.9973  19.1556          ?        ?       21.4       10.7       ?       ? 
1 1 1   27    6   63 o    225.1    4.4    0.0000   0.0000          ?        ?   507.6247  19.7942          ?        ?      225.1        4.4       ?       ? 
1 1 1   27    6   64 o     45.5   16.7    0.0000   0.0000          ?        ?    17.2401  19.7942          ?        ?       45.5       16.7       ?       ? 
1 1 1   27    6   65 o    212.8    4.8    0.0000   0.0000          ?        ?   453.9889  20.4327          ?        ?      212.8        4.8       ?       ? 
1 1 1   27    6   66 o     83.9   12.2    0.0000   0.0000          ?        ?    71.5144  20.4327          ?        ?       83.9       12.2       ?       ? 
1 1 1   27    6   67 o     55.9   16.9    0.0000   0.0000          ?        ?    32.5646  20.4327          ?        ?       55.9       16.9       ?       ? 
1 1 1   27    6   68 o     62.3   16.2    0.0000   0.0000          ?        ?    41.5039  20.4327          ?        ?       62.3       16.2       ?       ? 
1 1 1   27    6   69 o    180.9    5.8    0.0000   0.0000          ?        ?   328.8386  21.0712          ?        ?      180.9        5.8       ?       ? 
1 1 1   27    6   70 o    281.0    3.9    0.0000   0.0000          ?        ?   791.1283  21.7097          ?        ?      281.0        3.9       ?       ? 
1 1 1   27    6   71 o     48.0   17.2    0.0000   0.0000          ?        ?    21.0712  21.0712          ?        ?       48.0       17.2       ?       ? 
1 1 1   27    6   72 o    165.3    6.4    0.0000   0.0000          ?        ?   275.2028  21.0712          ?        ?      165.3        6.4       ?       ? 
1 1 1   27    6   73 o    136.9    7.5    0.0000   0.0000          ?        ?   189.6409  20.4327          ?        ?      136.9        7.5       ?       ? 
1 1 1   27    7    0 o   1030.9    5.4 10628.8311 111.1028 10628.8311 111.1028 10628.8311 111.1028     1030.9      5.4     1030.9        5.4     0.0     0.0 
1 1 1   27    7    1 o    517.7    2.3    0.0000   0.0000          ?        ?  2679.8752  24.2638          ?        ?      517.7        2.3       ?       ? 
1 1 1   27    7    2 o    606.0    2.7    0.0000   0.0000          ?        ?  3672.7764  32.5646          ?        ?      606.0        2.7       ?       ? 
1 1 1   27    7    3 o   1738.6    6.0    0.0000   0.0000          ?        ? 30231.4453 209.4351          ?        ?     1738.6        6.0       ?       ? 
1 1 1   27    7    4 o   1367.5    4.8    0.0000   0.0000          ?        ? 18701.0215 132.1740          ?        ?     1367.5        4.8       ?       ? 
1 1 1   27    7    5 o   1773.5    6.3    0.0000   0.0000          ?        ? 31458.6816 222.8441          ?        ?     1773.5        6.3       ?       ? 
1 1 1   27    7    6 o   1512.8    5.4    0.0000   0.0000          ?        ? 22886.5312 163.4615          ?        ?     1512.8        5.4       ?       ? 
1 1 1   27    7    7 o   1595.1    5.7    0.0000   0.0000          ?        ? 25447.0020 181.9787          ?        ?     1595.1        5.7       ?       ? 
1 1 1   27    7    8 o    727.5    2.9    0.0000   0.0000          ?        ?  5292.7061  41.5039          ?        ?      727.5        2.9       ?       ? 
1 1 1   27    7    9 o   1048.1    3.8    0.0000   0.0000          ?        ? 10986.4033  79.1767          ?        ?     1048.1        3.8       ?       ? 
1 1 1   27    7   10 o    731.9    2.9    0.0000   0.0000          ?        ?  5357.1963  42.1424          ?        ?      731.9        2.9       ?       ? 
1 1 1   27    7   11 o    231.2    2.3    0.0000   0.0000          ?        ?   534.4426  10.8549          ?        ?      231.2        2.3       ?       ? 
1 1 1   27    7   12 o   1076.2    3.9    0.0000   0.0000          ?        ? 11582.7822  83.0078          ?        ?     1076.2        3.9       ?       ? 
1 1 1   27    7   13 f   1186.1    4.2    0.0000   0.0000          ?        ? 14069.1846  98.9709          ?        ?     1186.1        4.2       ?       ? 
1 1 1   27    7   14 o    265.7    2.4    0.0000   0.0000          ?        ?   706.2049  12.7704          ?        ?      265.7        2.4       ?       ? 
1 1 1   27    7   15 o   1001.0    3.7    0.0000   0.0000          ?        ? 10020.3203  74.7070          ?        ?     1001.0        3.7       ?       ? 
1 1 1   27    7   16 o   1650.6    5.6    0.0000   0.0000          ?        ? 27249.5488 185.8098          ?        ?     1650.6        5.6       ?       ? 
1 1 1   27    7   17 o   1217.2    4.5    0.0000   0.0000          ?        ? 14816.2549 109.1872          ?        ?     1217.2        4.5       ?       ? 
1 1 1   27    7   18 o    723.3    3.0    0.0000   0.0000          ?        ?  5232.0464  43.4195          ?        ?      723.3        3.0       ?       ? 
1 1 1   27    7   19 o   1092.4    4.1    0.0000   0.0000          ?        ? 11935.2461  89.3930          ?        ?     1092.4        4.1       ?       ? 
1 1 1   27    7   20 o    877.2    3.3    0.0000   0.0000          ?        ?  7694.8237  58.1055          ?        ?      877.2        3.3       ?       ? 
1 1 1   27    7   21 o    745.6    3.2    0.0000   0.0000          ?        ?  5558.9692  47.2506          ?        ?      745.6        3.2       ?       ? 
1 1 1   27    7   22 o   1301.5    4.9    0.0000   0.0000          ?        ? 16940.6172 127.0658          ?        ?     1301.5        4.9       ?       ? 
1 1 1   27    7   23 o    218.8    3.6    0.0000   0.0000          ?        ?   478.8912  15.9630          ?        ?      218.8        3.6       ?       ? 
1 1 1   27    7   24 o    266.2    3.7    0.0000   0.0000          ?        ?   708.7590  19.7942          ?        ?      266.2        3.7       ?       ? 
1 1 1   27    7   25 o    886.7    3.6    0.0000   0.0000          ?        ?  7862.7554  63.8522          ?        ?      886.7        3.6       ?       ? 
1 1 1   27    7   26 o    850.7    3.6    0.0000   0.0000          ?        ?  7238.2808  61.9366          ?        ?      850.7        3.6       ?       ? 
1 1 1   27    7   27 o    646.6    3.0    0.0000   0.0000          ?        ?  4181.0396  38.3113          ?        ?      646.6        3.0       ?       ? 
1 1 1   27    7   28 o    197.7    3.9    0.0000   0.0000          ?        ?   390.7752  15.3245          ?        ?      197.7        3.9       ?       ? 
1 1 1   27    7   29 o    906.1    3.5    0.0000   0.0000          ?        ?  8210.1113  63.2136          ?        ?      906.1        3.5       ?       ? 
1 1 1   27    7   30 o    241.0    3.6    0.0000   0.0000          ?        ?   581.0547  17.2401          ?        ?      241.0        3.6       ?       ? 
1 1 1   27    7   31 o    696.1    2.9    0.0000   0.0000          ?        ?  4846.3789  40.8654          ?        ?      696.1        2.9       ?       ? 
1 1 1   27    7   32 o    590.5    3.0    0.0000   0.0000          ?        ?  3486.9666  35.1187          ?        ?      590.5        3.0       ?       ? 
1 1 1   27    7   33 o   1208.7    4.4    0.0000   0.0000          ?        ? 14612.5674 107.2716          ?        ?     1208.7        4.4       ?       ? 
1 1 1   27    7   34 o    144.9    6.4    0.0000   0.0000          ?        ?   210.0736  18.5171          ?        ?      144.9        6.4       ?       ? 
1 1 1   27    7   35 o    226.3    3.5    0.0000   0.0000          ?        ?   512.0943  15.9630          ?        ?      226.3        3.5       ?       ? 
1 1 1   27    7   36 o    812.1    3.1    0.0000   0.0000          ?        ?  6595.2900  50.4432          ?        ?      812.1        3.1       ?       ? 
1 1 1   27    7   37 o     27.5   12.5    0.0000   0.0000          ?        ?    -8.3008  14.6860          ?        ?       27.5       12.5       ?       ? 
1 1 1   27    7   38 o    189.2    4.0    0.0000   0.0000          ?        ?   358.2106  15.3245          ?        ?      189.2        4.0       ?       ? 
1 1 1   27    7   39 o     22.2   10.8    0.0000   0.0000          ?        ?   -30.6490  15.9630          ?        ?       22.2       10.8       ?       ? 
1 1 1   27    7   40 o    265.8    3.4    0.0000   0.0000          ?        ?   706.8434  17.8786          ?        ?      265.8        3.4       ?       ? 
1 1 1   27    7   41 o    375.5    2.8    0.0000   0.0000          ?        ?  1410.4943  21.0712          ?        ?      375.5        2.8       ?       ? 
1 1 1   27    7   42 o    224.7    4.0    0.0000   0.0000          ?        ?   505.0706  17.8786          ?        ?      224.7        4.0       ?       ? 
1 1 1   27    7   43 o    225.4    3.8    0.0000   0.0000          ?        ?   508.2632  17.2401          ?        ?      225.4        3.8       ?       ? 
1 1 1   27    7   44 o    149.0    5.8    0.0000   0.0000          ?        ?   222.2055  17.2401          ?        ?      149.0        5.8       ?       ? 
1 1 1   27    7   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    7   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    7   47 f    263.3    3.5    0.0000   0.0000          ?        ?   693.4344  18.5171          ?        ?      263.3        3.5       ?       ? 
1 1 1   27    7   48 o    146.6    5.7    0.0000   0.0000          ?        ?   215.1818  16.6016          ?        ?      146.6        5.7       ?       ? 
1 1 1   27    7   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    7   50 o    297.7    3.1    0.0000   0.0000          ?        ?   886.2681  18.5171          ?        ?      297.7        3.1       ?       ? 
1 1 1   27    7   51 o    353.8    3.1    0.0000   0.0000          ?        ?  1252.1410  21.7097          ?        ?      353.8        3.1       ?       ? 
1 1 1   27    7   52 o    246.1    3.8    0.0000   0.0000          ?        ?   605.9570  18.5171          ?        ?      246.1        3.8       ?       ? 
1 1 1   27    7   53 o    403.0    2.9    0.0000   0.0000          ?        ?  1625.0376  23.6253          ?        ?      403.0        2.9       ?       ? 
1 1 1   27    7   54 o    209.6    4.7    0.0000   0.0000          ?        ?   439.9414  19.7942          ?        ?      209.6        4.7       ?       ? 
1 1 1   27    7   55 o    252.1    3.8    0.0000   0.0000          ?        ?   635.9675  19.1556          ?        ?      252.1        3.8       ?       ? 
1 1 1   27    7   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    7   57 o    368.6    3.1    0.0000   0.0000          ?        ?  1359.4125  22.9868          ?        ?      368.6        3.1       ?       ? 
1 1 1   27    7   58 o    380.5    3.2    0.0000   0.0000          ?        ?  1448.8055  24.2638          ?        ?      380.5        3.2       ?       ? 
1 1 1   27    7   59 o    183.6    5.6    0.0000   0.0000          ?        ?   337.7780  20.4327          ?        ?      183.6        5.6       ?       ? 
1 1 1   27    7   60 o     72.3   14.6    0.0000   0.0000          ?        ?    54.9129  20.4327          ?        ?       72.3       14.6       ?       ? 
1 1 1   27    7   61 o    408.4    3.0    0.0000   0.0000          ?        ?  1669.0955  24.9023          ?        ?      408.4        3.0       ?       ? 
1 1 1   27    7   62 o     65.5   15.4    0.0000   0.0000          ?        ?    45.3350  19.7942          ?        ?       65.5       15.4       ?       ? 
1 1 1   27    7   63 o    363.9    3.2    0.0000   0.0000          ?        ?  1325.5709  22.9868          ?        ?      363.9        3.2       ?       ? 
1 1 1   27    7   64 o    205.5    5.0    0.0000   0.0000          ?        ?   423.3398  20.4327          ?        ?      205.5        5.0       ?       ? 
1 1 1   27    7   65 o     29.2   13.7    0.0000   0.0000          ?        ?   -21.0712  20.4327          ?        ?       29.2       13.7       ?       ? 
1 1 1   27    7   66 o    163.6    6.2    0.0000   0.0000          ?        ?   268.8176  20.4327          ?        ?      163.6        6.2       ?       ? 
1 1 1   27    7   67 o    137.7    7.4    0.0000   0.0000          ?        ?   190.9180  20.4327          ?        ?      137.7        7.4       ?       ? 
1 1 1   27    7   68 o    322.4    3.6    0.0000   0.0000          ?        ?  1040.7903  22.9868          ?        ?      322.4        3.6       ?       ? 
1 1 1   27    7   69 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    7   70 o     26.6   12.8    0.0000   0.0000          ?        ?   -28.0950  19.7942          ?        ?       26.6       12.8       ?       ? 
1 1 1   27    7   71 o    142.1    7.2    0.0000   0.0000          ?        ?   203.6884  20.4327          ?        ?      142.1        7.2       ?       ? 
1 1 1   27    7   72 o    177.9    5.7    0.0000   0.0000          ?        ?   318.6223  20.4327          ?        ?      177.9        5.7       ?       ? 
1 1 1   27    7   73 o     53.7   16.7    0.0000   0.0000          ?        ?    30.6490  19.7942          ?        ?       53.7       16.7       ?       ? 
1 1 1   27    8    0 o    868.6    4.7 7546.0488  82.3693  7546.0488  82.3693  7546.0488  82.3693      868.6      4.7      868.6        4.7     0.0     0.0 
1 1 1   27    8    1 o    455.3    2.4    0.0000   0.0000          ?        ?  2073.2798  21.7097          ?        ?      455.3        2.4       ?       ? 
1 1 1   27    8    2 o    632.1    2.7    0.0000   0.0000          ?        ?  3995.2300  33.8416          ?        ?      632.1        2.7       ?       ? 
1 1 1   27    8    3 o    628.3    2.8    0.0000   0.0000          ?        ?  3947.9792  35.7572          ?        ?      628.3        2.8       ?       ? 
1 1 1   27    8    4 o   1664.8    5.8    0.0000   0.0000          ?        ? 27719.5020 191.5565          ?        ?     1664.8        5.8       ?       ? 
1 1 1   27    8    5 o    323.4    2.5    0.0000   0.0000          ?        ?  1045.8984  15.9630          ?        ?      323.4        2.5       ?       ? 
1 1 1   27    8    6 o   2222.7    7.4    0.0000   0.0000          ?        ? 49416.4688 327.5616          ?        ?     2222.7        7.4       ?       ? 
1 1 1   27    8    7 o    731.1    3.0    0.0000   0.0000          ?        ?  5345.0645  43.4195          ?        ?      731.1        3.0       ?       ? 
1 1 1   27    8    8 o    788.1    3.0    0.0000   0.0000          ?        ?  6210.8999  47.8891          ?        ?      788.1        3.0       ?       ? 
1 1 1   27    8    9 o    878.2    3.3    0.0000   0.0000          ?        ?  7712.0645  57.4669          ?        ?      878.2        3.3       ?       ? 
1 1 1   27    8   10 o   1250.4    4.4    0.0000   0.0000          ?        ? 15636.7559 109.1872          ?        ?     1250.4        4.4       ?       ? 
1 1 1   27    8   11 o    146.0    3.3    0.0000   0.0000          ?        ?   213.2662   9.5778          ?        ?      146.0        3.3       ?       ? 
1 1 1   27    8   12 o    883.5    3.3    0.0000   0.0000          ?        ?  7806.5654  58.1055          ?        ?      883.5        3.3       ?       ? 
1 1 1   27    8   13 o   1529.7    5.1    0.0000   0.0000          ?        ? 23402.4570 157.0763          ?        ?     1529.7        5.1       ?       ? 
1 1 1   27    8   14 o    475.0    2.3    0.0000   0.0000          ?        ?  2256.5354  21.7097          ?        ?      475.0        2.3       ?       ? 
1 1 1   27    8   15 o   1109.2    4.1    0.0000   0.0000          ?        ? 12304.3115  90.0316          ?        ?     1109.2        4.1       ?       ? 
1 1 1   27    8   16 o    121.2    5.5    0.0000   0.0000          ?        ?   146.8600  13.4090          ?        ?      121.2        5.5       ?       ? 
1 1 1   27    8   17 o     19.6    9.7    0.0000   0.0000          ?        ?   -32.5646  14.0475          ?        ?       19.6        9.7       ?       ? 
1 1 1   27    8   18 o   1496.6    5.0    0.0000   0.0000          ?        ? 22399.3379 149.4141          ?        ?     1496.6        5.0       ?       ? 
1 1 1   27    8   19 o    393.9    2.5    0.0000   0.0000          ?        ?  1551.6075  19.7942          ?        ?      393.9        2.5       ?       ? 
1 1 1   27    8   20 o    979.2    3.8    0.0000   0.0000          ?        ?  9589.9561  74.0685          ?        ?      979.2        3.8       ?       ? 
1 1 1   27    8   21 o   1383.8    5.1    0.0000   0.0000          ?        ? 19152.4570 139.8362          ?        ?     1383.8        5.1       ?       ? 
1 1 1   27    8   22 o    671.3    2.8    0.0000   0.0000          ?        ?  4506.0474  37.6728          ?        ?      671.3        2.8       ?       ? 
1 1 1   27    8   23 o    403.3    2.8    0.0000   0.0000          ?        ?  1626.9531  22.3483          ?        ?      403.3        2.8       ?       ? 
1 1 1   27    8   24 o    537.6    2.6    0.0000   0.0000          ?        ?  2890.5874  27.4564          ?        ?      537.6        2.6       ?       ? 
1 1 1   27    8   25 o    499.8    2.6    0.0000   0.0000          ?        ?  2497.8967  26.1794          ?        ?      499.8        2.6       ?       ? 
1 1 1   27    8   26 o    243.8    3.3    0.0000   0.0000          ?        ?   594.4636  15.9630          ?        ?      243.8        3.3       ?       ? 
1 1 1   27    8   27 o   1020.7    3.8    0.0000   0.0000          ?        ? 10418.7568  77.8996          ?        ?     1020.7        3.8       ?       ? 
1 1 1   27    8   28 f    900.2    3.6    0.0000   0.0000          ?        ?  8104.7554  65.1292          ?        ?      900.2        3.6       ?       ? 
1 1 1   27    8   29 o    714.6    2.9    0.0000   0.0000          ?        ?  5106.8960  42.1424          ?        ?      714.6        2.9       ?       ? 
1 1 1   27    8   30 o    240.2    3.3    0.0000   0.0000          ?        ?   577.2236  15.9630          ?        ?      240.2        3.3       ?       ? 
1 1 1   27    8   31 o    484.3    2.5    0.0000   0.0000          ?        ?  2345.2898  24.2638          ?        ?      484.3        2.5       ?       ? 
1 1 1   27    8   32 o    401.2    2.8    0.0000   0.0000          ?        ?  1609.7130  22.3483          ?        ?      401.2        2.8       ?       ? 
1 1 1   27    8   33 o    669.9    2.9    0.0000   0.0000          ?        ?  4487.5298  38.9498          ?        ?      669.9        2.9       ?       ? 
1 1 1   27    8   34 o    439.8    2.5    0.0000   0.0000          ?        ?  1934.0819  22.3483          ?        ?      439.8        2.5       ?       ? 
1 1 1   27    8   35 o    161.2    4.8    0.0000   0.0000          ?        ?   259.8783  15.3245          ?        ?      161.2        4.8       ?       ? 
1 1 1   27    8   36 o    229.8    3.5    0.0000   0.0000          ?        ?   528.0574  15.9630          ?        ?      229.8        3.5       ?       ? 
1 1 1   27    8   37 o    645.9    2.8    0.0000   0.0000          ?        ?  4172.7388  35.7572          ?        ?      645.9        2.8       ?       ? 
1 1 1   27    8   38 o    194.9    3.9    0.0000   0.0000          ?        ?   379.9204  15.3245          ?        ?      194.9        3.9       ?       ? 
1 1 1   27    8   39 o    127.6    6.0    0.0000   0.0000          ?        ?   162.8230  15.3245          ?        ?      127.6        6.0       ?       ? 
1 1 1   27    8   40 o    621.2    2.8    0.0000   0.0000          ?        ?  3859.8633  35.1187          ?        ?      621.2        2.8       ?       ? 
1 1 1   27    8   41 o    202.7    3.9    0.0000   0.0000          ?        ?   411.2079  15.9630          ?        ?      202.7        3.9       ?       ? 
1 1 1   27    8   42 o    229.2    3.6    0.0000   0.0000          ?        ?   525.5033  16.6016          ?        ?      229.2        3.6       ?       ? 
1 1 1   27    8   43 o    482.5    2.6    0.0000   0.0000          ?        ?  2328.6885  25.5409          ?        ?      482.5        2.6       ?       ? 
1 1 1   27    8   44 o    802.7    3.2    0.0000   0.0000          ?        ?  6445.2373  51.0817          ?        ?      802.7        3.2       ?       ? 
1 1 1   27    8   45 o    575.3    2.6    0.0000   0.0000          ?        ?  3310.7346  30.0105          ?        ?      575.3        2.6       ?       ? 
1 1 1   27    8   46 o    489.6    2.6    0.0000   0.0000          ?        ?  2397.6487  25.5409          ?        ?      489.6        2.6       ?       ? 
1 1 1   27    8   47 o    209.2    4.1    0.0000   0.0000          ?        ?   438.0258  17.2401          ?        ?      209.2        4.1       ?       ? 
1 1 1   27    8   48 o    780.0    3.1    0.0000   0.0000          ?        ?  6086.3882  47.8891          ?        ?      780.0        3.1       ?       ? 
1 1 1   27    8   49 o     28.4   13.0    0.0000   0.0000          ?        ?   -11.4934  16.6016          ?        ?       28.4       13.0       ?       ? 
1 1 1   27    8   50 o    490.1    2.7    0.0000   0.0000          ?        ?  2402.7568  26.8179          ?        ?      490.1        2.7       ?       ? 
1 1 1   27    8   51 o    171.7    5.2    0.0000   0.0000          ?        ?   294.9970  17.8786          ?        ?      171.7        5.2       ?       ? 
1 1 1   27    8   52 o    308.2    3.1    0.0000   0.0000          ?        ?   950.1202  19.1556          ?        ?      308.2        3.1       ?       ? 
1 1 1   27    8   53 o    294.1    3.3    0.0000   0.0000          ?        ?   865.1968  19.1556          ?        ?      294.1        3.3       ?       ? 
1 1 1   27    8   54 o    137.1    6.5    0.0000   0.0000          ?        ?   188.3639  17.8786          ?        ?      137.1        6.5       ?       ? 
1 1 1   27    8   55 o    132.8    6.7    0.0000   0.0000          ?        ?   176.8705  17.8786          ?        ?      132.8        6.7       ?       ? 
1 1 1   27    8   56 o    153.9    6.4    0.0000   0.0000          ?        ?   237.5300  19.7942          ?        ?      153.9        6.4       ?       ? 
1 1 1   27    8   57 o    103.0    9.6    0.0000   0.0000          ?        ?   106.6331  19.7942          ?        ?      103.0        9.6       ?       ? 
1 1 1   27    8   58 f    117.4    8.7    0.0000   0.0000          ?        ?   138.5592  20.4327          ?        ?      117.4        8.7       ?       ? 
1 1 1   27    8   59 f    329.7    3.6    0.0000   0.0000          ?        ?  1088.0408  23.6253          ?        ?      329.7        3.6       ?       ? 
1 1 1   27    8   60 o    115.8    8.5    0.0000   0.0000          ?        ?   134.7281  19.7942          ?        ?      115.8        8.5       ?       ? 
1 1 1   27    8   61 o     79.1   12.1    0.0000   0.0000          ?        ?    63.2136  19.1556          ?        ?       79.1       12.1       ?       ? 
1 1 1   27    8   62 o     21.1   10.5    0.0000   0.0000          ?        ?   -54.9129  19.1556          ?        ?       21.1       10.5       ?       ? 
1 1 1   27    8   63 o    236.4    4.5    0.0000   0.0000          ?        ?   559.9835  21.0712          ?        ?      236.4        4.5       ?       ? 
1 1 1   27    8   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    8   65 o    221.5    4.6    0.0000   0.0000          ?        ?   491.6617  20.4327          ?        ?      221.5        4.6       ?       ? 
1 1 1   27    8   66 o    100.5   10.2    0.0000   0.0000          ?        ?   102.1635  20.4327          ?        ?      100.5       10.2       ?       ? 
1 1 1   27    8   67 o    284.6    3.9    0.0000   0.0000          ?        ?   811.5610  22.3483          ?        ?      284.6        3.9       ?       ? 
1 1 1   27    8   68 o    215.7    4.9    0.0000   0.0000          ?        ?   466.7593  21.0712          ?        ?      215.7        4.9       ?       ? 
1 1 1   27    8   69 o     44.4   16.6    0.0000   0.0000          ?        ?    15.9630  19.7942          ?        ?       44.4       16.6       ?       ? 
1 1 1   27    8   70 o     33.5   15.0    0.0000   0.0000          ?        ?    -8.9393  21.0712          ?        ?       33.5       15.0       ?       ? 
1 1 1   27    8   71 o    190.8    5.5    0.0000   0.0000          ?        ?   365.8729  21.0712          ?        ?      190.8        5.5       ?       ? 
1 1 1   27    8   72 f    230.4    4.6    0.0000   0.0000          ?        ?   533.1656  21.0712          ?        ?      230.4        4.6       ?       ? 
1 1 1   27    9    0 o   1143.0    6.0 13065.4297 136.0051 13065.4297 136.0051 13065.4297 136.0051     1143.0      6.0     1143.0        6.0     0.0     0.0 
1 1 1   27    9    1 o    938.0    3.7    0.0000   0.0000          ?        ?  8799.4668  70.2374          ?        ?      938.0        3.7       ?       ? 
1 1 1   27    9    2 o    195.6    2.9    0.0000   0.0000          ?        ?   382.4745  11.4934          ?        ?      195.6        2.9       ?       ? 
1 1 1   27    9    3 o    843.9    3.3    0.0000   0.0000          ?        ?  7122.7090  55.5514          ?        ?      843.9        3.3       ?       ? 
1 1 1   27    9    4 o    729.6    3.0    0.0000   0.0000          ?        ?  5323.9932  44.0580          ?        ?      729.6        3.0       ?       ? 
1 1 1   27    9    5 o   1377.3    5.1    0.0000   0.0000          ?        ? 18971.7539 141.1133          ?        ?     1377.3        5.1       ?       ? 
1 1 1   27    9    6 o    189.9    3.0    0.0000   0.0000          ?        ?   360.7647  11.4934          ?        ?      189.9        3.0       ?       ? 
1 1 1   27    9    7 o    671.9    2.9    0.0000   0.0000          ?        ?  4514.9863  38.9498          ?        ?      671.9        2.9       ?       ? 
1 1 1   27    9    8 o   1146.0    4.2    0.0000   0.0000          ?        ? 13133.1133  95.1397          ?        ?     1146.0        4.2       ?       ? 
1 1 1   27    9    9 o   1037.4    3.8    0.0000   0.0000          ?        ? 10762.9199  79.1767          ?        ?     1037.4        3.8       ?       ? 
1 1 1   27    9   10 o   1059.5    3.9    0.0000   0.0000          ?        ? 11227.1260  82.3693          ?        ?     1059.5        3.9       ?       ? 
1 1 1   27    9   11 o    904.0    3.5    0.0000   0.0000          ?        ?  8172.4385  63.2136          ?        ?      904.0        3.5       ?       ? 
1 1 1   27    9   12 o    807.6    3.2    0.0000   0.0000          ?        ?  6523.1367  51.0817          ?        ?      807.6        3.2       ?       ? 
1 1 1   27    9   13 o    479.9    2.4    0.0000   0.0000          ?        ?  2303.1477  22.9868          ?        ?      479.9        2.4       ?       ? 
1 1 1   27    9   14 o   1418.8    5.0    0.0000   0.0000          ?        ? 20131.3105 142.3903          ?        ?     1418.8        5.0       ?       ? 
1 1 1   27    9   15 o    221.3    3.2    0.0000   0.0000          ?        ?   489.7461  14.0475          ?        ?      221.3        3.2       ?       ? 
1 1 1   27    9   16 o   1001.5    3.7    0.0000   0.0000          ?        ? 10029.8984  74.0685          ?        ?     1001.5        3.7       ?       ? 
1 1 1   27    9   17 o   1651.5    5.8    0.0000   0.0000          ?        ? 27278.2832 190.2794          ?        ?     1651.5        5.8       ?       ? 
1 1 1   27    9   18 o    677.4    2.8    0.0000   0.0000          ?        ?  4589.0552  37.6728          ?        ?      677.4        2.8       ?       ? 
1 1 1   27    9   19 o    969.1    3.7    0.0000   0.0000          ?        ?  9392.0146  71.5144          ?        ?      969.1        3.7       ?       ? 
1 1 1   27    9   20 o   1579.6    5.6    0.0000   0.0000          ?        ? 24954.0645 176.2320          ?        ?     1579.6        5.6       ?       ? 
1 1 1   27    9   21 o     98.8    6.5    0.0000   0.0000          ?        ?    97.6938  12.7704          ?        ?       98.8        6.5       ?       ? 
1 1 1   27    9   22 f    721.0    3.1    0.0000   0.0000          ?        ?  5198.8433  44.0580          ?        ?      721.0        3.1       ?       ? 
1 1 1   27    9   23 o   1583.1    5.7    0.0000   0.0000          ?        ? 25067.0820 179.4246          ?        ?     1583.1        5.7       ?       ? 
1 1 1   27    9   24 o    611.0    2.8    0.0000   0.0000          ?        ?  3733.4360  34.4802          ?        ?      611.0        2.8       ?       ? 
1 1 1   27    9   25 o    405.2    2.5    0.0000   0.0000          ?        ?  1642.2777  20.4327          ?        ?      405.2        2.5       ?       ? 
1 1 1   27    9   26 o    161.8    4.5    0.0000   0.0000          ?        ?   261.7939  14.6860          ?        ?      161.8        4.5       ?       ? 
1 1 1   27    9   27 o    393.5    2.7    0.0000   0.0000          ?        ?  1548.4149  21.0712          ?        ?      393.5        2.7       ?       ? 
1 1 1   27    9   28 o   1931.1    6.6    0.0000   0.0000          ?        ? 37303.7109 256.6857          ?        ?     1931.1        6.6       ?       ? 
1 1 1   27    9   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    9   30 o    121.7    5.5    0.0000   0.0000          ?        ?   148.1370  13.4090          ?        ?      121.7        5.5       ?       ? 
1 1 1   27    9   31 o   1122.4    4.2    0.0000   0.0000          ?        ? 12599.3086  93.8627          ?        ?     1122.4        4.2       ?       ? 
1 1 1   27    9   32 o    657.8    2.8    0.0000   0.0000          ?        ?  4327.2612  36.3957          ?        ?      657.8        2.8       ?       ? 
1 1 1   27    9   33 o    369.7    2.8    0.0000   0.0000          ?        ?  1367.0748  20.4327          ?        ?      369.7        2.8       ?       ? 
1 1 1   27    9   34 o    473.6    2.4    0.0000   0.0000          ?        ?  2243.1265  22.9868          ?        ?      473.6        2.4       ?       ? 
1 1 1   27    9   35 o    223.0    3.4    0.0000   0.0000          ?        ?   497.4084  15.3245          ?        ?      223.0        3.4       ?       ? 
1 1 1   27    9   36 o    555.6    2.5    0.0000   0.0000          ?        ?  3087.2520  28.0950          ?        ?      555.6        2.5       ?       ? 
1 1 1   27    9   37 o    261.8    3.3    0.0000   0.0000          ?        ?   685.7722  17.2401          ?        ?      261.8        3.3       ?       ? 
1 1 1   27    9   38 o    319.1    2.8    0.0000   0.0000          ?        ?  1018.4420  17.8786          ?        ?      319.1        2.8       ?       ? 
1 1 1   27    9   39 o    413.6    2.5    0.0000   0.0000          ?        ?  1710.5994  20.4327          ?        ?      413.6        2.5       ?       ? 
1 1 1   27    9   40 o    405.1    2.7    0.0000   0.0000          ?        ?  1641.6392  21.7097          ?        ?      405.1        2.7       ?       ? 
1 1 1   27    9   41 o    720.6    3.1    0.0000   0.0000          ?        ?  5193.7349  44.0580          ?        ?      720.6        3.1       ?       ? 
1 1 1   27    9   42 o    196.2    4.2    0.0000   0.0000          ?        ?   385.0285  16.6016          ?        ?      196.2        4.2       ?       ? 
1 1 1   27    9   43 o    161.1    5.3    0.0000   0.0000          ?        ?   259.8783  17.2401          ?        ?      161.1        5.3       ?       ? 
1 1 1   27    9   44 o    758.5    3.1    0.0000   0.0000          ?        ?  5754.3569  46.6121          ?        ?      758.5        3.1       ?       ? 
1 1 1   27    9   45 o    485.4    2.6    0.0000   0.0000          ?        ?  2356.7834  24.9023          ?        ?      485.4        2.6       ?       ? 
1 1 1   27    9   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    9   47 o    288.1    3.1    0.0000   0.0000          ?        ?   830.0781  17.8786          ?        ?      288.1        3.1       ?       ? 
1 1 1   27    9   48 o    512.3    2.6    0.0000   0.0000          ?        ?  2624.9624  26.8179          ?        ?      512.3        2.6       ?       ? 
1 1 1   27    9   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    9   50 o    316.6    3.1    0.0000   0.0000          ?        ?  1002.4789  19.7942          ?        ?      316.6        3.1       ?       ? 
1 1 1   27    9   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    9   52 f    104.0    8.3    0.0000   0.0000          ?        ?   108.5487  17.2401          ?        ?      104.0        8.3       ?       ? 
1 1 1   27    9   53 o    366.1    2.9    0.0000   0.0000          ?        ?  1340.8954  21.0712          ?        ?      366.1        2.9       ?       ? 
1 1 1   27    9   54 o    282.7    3.4    0.0000   0.0000          ?        ?   799.4291  19.1556          ?        ?      282.7        3.4       ?       ? 
1 1 1   27    9   55 o    286.7    3.5    0.0000   0.0000          ?        ?   822.4159  19.7942          ?        ?      286.7        3.5       ?       ? 
1 1 1   27    9   56 o    364.9    3.1    0.0000   0.0000          ?        ?  1331.9562  22.3483          ?        ?      364.9        3.1       ?       ? 
1 1 1   27    9   57 o    243.3    4.1    0.0000   0.0000          ?        ?   592.5481  19.7942          ?        ?      243.3        4.1       ?       ? 
1 1 1   27    9   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27    9   59 o    420.4    3.0    0.0000   0.0000          ?        ?  1768.7050  25.5409          ?        ?      420.4        3.0       ?       ? 
1 1 1   27    9   60 o    257.0    4.1    0.0000   0.0000          ?        ?   661.5084  21.0712          ?        ?      257.0        4.1       ?       ? 
1 1 1   27    9   61 o    151.8    6.5    0.0000   0.0000          ?        ?   231.1448  19.7942          ?        ?      151.8        6.5       ?       ? 
1 1 1   27    9   62 o    142.7    6.7    0.0000   0.0000          ?        ?   204.3269  19.1556          ?        ?      142.7        6.7       ?       ? 
1 1 1   27    9   63 o    185.6    5.3    0.0000   0.0000          ?        ?   345.4402  19.7942          ?        ?      185.6        5.3       ?       ? 
1 1 1   27    9   64 o     54.9   16.6    0.0000   0.0000          ?        ?    31.2876  19.7942          ?        ?       54.9       16.6       ?       ? 
1 1 1   27    9   65 o    380.0    3.1    0.0000   0.0000          ?        ?  1445.6129  23.6253          ?        ?      380.0        3.1       ?       ? 
1 1 1   27    9   66 o     60.9   16.0    0.0000   0.0000          ?        ?    39.5883  19.7942          ?        ?       60.9       16.0       ?       ? 
1 1 1   27    9   67 o    277.0    3.9    0.0000   0.0000          ?        ?   768.7800  21.7097          ?        ?      277.0        3.9       ?       ? 
1 1 1   27    9   68 o    103.2    9.9    0.0000   0.0000          ?        ?   107.9102  20.4327          ?        ?      103.2        9.9       ?       ? 
1 1 1   27    9   69 o    149.6    6.8    0.0000   0.0000          ?        ?   225.3981  20.4327          ?        ?      149.6        6.8       ?       ? 
1 1 1   27    9   70 o     73.4   14.4    0.0000   0.0000          ?        ?    57.4669  20.4327          ?        ?       73.4       14.4       ?       ? 
1 1 1   27    9   71 o     79.5   12.9    0.0000   0.0000          ?        ?    65.1292  20.4327          ?        ?       79.5       12.9       ?       ? 
1 1 1   27    9   72 o     91.0   10.9    0.0000   0.0000          ?        ?    84.9234  19.7942          ?        ?       91.0       10.9       ?       ? 
1 1 1   27   10    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   10    1 o    810.3    3.3    0.0000   0.0000          ?        ?  6565.9180  53.6358          ?        ?      810.3        3.3       ?       ? 
1 1 1   27   10    2 o   1170.6    4.4    0.0000   0.0000          ?        ? 13705.2275 103.4405          ?        ?     1170.6        4.4       ?       ? 
1 1 1   27   10    3 o    797.2    3.5    0.0000   0.0000          ?        ?  6355.2056  55.5514          ?        ?      797.2        3.5       ?       ? 
1 1 1   27   10    4 o   2270.9    8.3    0.0000   0.0000          ?        ? 51586.1641 376.7278          ?        ?     2270.9        8.3       ?       ? 
1 1 1   27   10    5 o   1117.8    4.3    0.0000   0.0000          ?        ? 12495.2295  95.1397          ?        ?     1117.8        4.3       ?       ? 
1 1 1   27   10    6 o    260.0    2.3    0.0000   0.0000          ?        ?   676.1944  12.1319          ?        ?      260.0        2.3       ?       ? 
1 1 1   27   10    7 o   1457.9    5.1    0.0000   0.0000          ?        ? 21257.6621 148.7755          ?        ?     1457.9        5.1       ?       ? 
1 1 1   27   10    8 o    684.6    3.0    0.0000   0.0000          ?        ?  4686.7485  40.8654          ?        ?      684.6        3.0       ?       ? 
1 1 1   27   10    9 o    939.4    3.5    0.0000   0.0000          ?        ?  8825.0068  66.4062          ?        ?      939.4        3.5       ?       ? 
1 1 1   27   10   10 o   1070.1    4.0    0.0000   0.0000          ?        ? 11451.2471  84.9234          ?        ?     1070.1        4.0       ?       ? 
1 1 1   27   10   11 o   1241.1    4.3    0.0000   0.0000          ?        ? 15403.6953 107.9102          ?        ?     1241.1        4.3       ?       ? 
1 1 1   27   10   12 o    174.3    3.1    0.0000   0.0000          ?        ?   303.9363  10.8549          ?        ?      174.3        3.1       ?       ? 
1 1 1   27   10   13 o   1058.9    4.1    0.0000   0.0000          ?        ? 11213.0781  86.2004          ?        ?     1058.9        4.1       ?       ? 
1 1 1   27   10   14 o   2012.8    7.0    0.0000   0.0000          ?        ? 40522.4961 282.8651          ?        ?     2012.8        7.0       ?       ? 
1 1 1   27   10   15 o    377.0    2.5    0.0000   0.0000          ?        ?  1421.3491  18.5171          ?        ?      377.0        2.5       ?       ? 
1 1 1   27   10   16 o    602.8    2.6    0.0000   0.0000          ?        ?  3633.8264  31.9261          ?        ?      602.8        2.6       ?       ? 
1 1 1   27   10   17 o    273.1    3.2    0.0000   0.0000          ?        ?   745.7933  17.2401          ?        ?      273.1        3.2       ?       ? 
1 1 1   27   10   18 o   1036.6    4.0    0.0000   0.0000          ?        ? 10746.9570  83.0078          ?        ?     1036.6        4.0       ?       ? 
1 1 1   27   10   19 o   1219.5    4.4    0.0000   0.0000          ?        ? 14873.0850 107.9102          ?        ?     1219.5        4.4       ?       ? 
1 1 1   27   10   20 o     19.2    9.5    0.0000   0.0000          ?        ?   -30.6490  13.4090          ?        ?       19.2        9.5       ?       ? 
1 1 1   27   10   21 o    892.6    3.5    0.0000   0.0000          ?        ?  7968.7500  61.9366          ?        ?      892.6        3.5       ?       ? 
1 1 1   27   10   22 o    654.9    2.9    0.0000   0.0000          ?        ?  4288.9497  37.6728          ?        ?      654.9        2.9       ?       ? 
1 1 1   27   10   23 o    180.1    4.6    0.0000   0.0000          ?        ?   324.3690  16.6016          ?        ?      180.1        4.6       ?       ? 
1 1 1   27   10   24 o    496.8    2.7    0.0000   0.0000          ?        ?  2468.5247  26.8179          ?        ?      496.8        2.7       ?       ? 
1 1 1   27   10   25 o    337.5    3.0    0.0000   0.0000          ?        ?  1139.1226  20.4327          ?        ?      337.5        3.0       ?       ? 
1 1 1   27   10   26 o    709.1    3.1    0.0000   0.0000          ?        ?  5028.3579  43.4195          ?        ?      709.1        3.1       ?       ? 
1 1 1   27   10   27 o    796.5    3.2    0.0000   0.0000          ?        ?  6344.9893  51.0817          ?        ?      796.5        3.2       ?       ? 
1 1 1   27   10   28 o   1260.6    4.5    0.0000   0.0000          ?        ? 15894.0801 112.3798          ?        ?     1260.6        4.5       ?       ? 
1 1 1   27   10   29 f    940.5    3.5    0.0000   0.0000          ?        ?  8846.0791  66.4062          ?        ?      940.5        3.5       ?       ? 
1 1 1   27   10   30 o    602.7    2.9    0.0000   0.0000          ?        ?  3633.1880  35.1187          ?        ?      602.7        2.9       ?       ? 
1 1 1   27   10   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   10   32 o    548.4    2.7    0.0000   0.0000          ?        ?  3007.4368  30.0105          ?        ?      548.4        2.7       ?       ? 
1 1 1   27   10   33 f    517.3    2.5    0.0000   0.0000          ?        ?  2676.6826  26.1794          ?        ?      517.3        2.5       ?       ? 
1 1 1   27   10   34 o    793.8    3.1    0.0000   0.0000          ?        ?  6302.2085  49.1662          ?        ?      793.8        3.1       ?       ? 
1 1 1   27   10   35 o    353.2    2.6    0.0000   0.0000          ?        ?  1247.6713  18.5171          ?        ?      353.2        2.6       ?       ? 
1 1 1   27   10   36 o     26.7   12.5    0.0000   0.0000          ?        ?   -16.6016  16.6016          ?        ?       26.7       12.5       ?       ? 
1 1 1   27   10   37 o    483.1    2.5    0.0000   0.0000          ?        ?  2333.7966  24.2638          ?        ?      483.1        2.5       ?       ? 
1 1 1   27   10   38 o    442.9    2.6    0.0000   0.0000          ?        ?  1962.1769  22.9868          ?        ?      442.9        2.6       ?       ? 
1 1 1   27   10   39 o    242.6    3.4    0.0000   0.0000          ?        ?   588.7169  16.6016          ?        ?      242.6        3.4       ?       ? 
1 1 1   27   10   40 o    387.2    2.6    0.0000   0.0000          ?        ?  1499.2488  20.4327          ?        ?      387.2        2.6       ?       ? 
1 1 1   27   10   41 o     96.5    8.3    0.0000   0.0000          ?        ?    93.2242  15.9630          ?        ?       96.5        8.3       ?       ? 
1 1 1   27   10   42 o    423.5    2.6    0.0000   0.0000          ?        ?  1793.6072  21.7097          ?        ?      423.5        2.6       ?       ? 
1 1 1   27   10   43 o    612.6    2.6    0.0000   0.0000          ?        ?  3753.2300  31.9261          ?        ?      612.6        2.6       ?       ? 
1 1 1   27   10   44 o    440.2    2.7    0.0000   0.0000          ?        ?  1937.9131  23.6253          ?        ?      440.2        2.7       ?       ? 
1 1 1   27   10   45 o    146.8    5.7    0.0000   0.0000          ?        ?   215.8203  16.6016          ?        ?      146.8        5.7       ?       ? 
1 1 1   27   10   46 o    238.9    3.5    0.0000   0.0000          ?        ?   570.8383  16.6016          ?        ?      238.9        3.5       ?       ? 
1 1 1   27   10   47 o    651.1    2.7    0.0000   0.0000          ?        ?  4239.7837  35.7572          ?        ?      651.1        2.7       ?       ? 
1 1 1   27   10   48 o     25.5   12.2    0.0000   0.0000          ?        ?   -22.9868  17.2401          ?        ?       25.5       12.2       ?       ? 
1 1 1   27   10   49 f    439.3    2.6    0.0000   0.0000          ?        ?  1930.2509  22.9868          ?        ?      439.3        2.6       ?       ? 
1 1 1   27   10   50 o    195.5    4.6    0.0000   0.0000          ?        ?   382.4745  17.8786          ?        ?      195.5        4.6       ?       ? 
1 1 1   27   10   51 o    271.7    3.4    0.0000   0.0000          ?        ?   738.7695  18.5171          ?        ?      271.7        3.4       ?       ? 
1 1 1   27   10   52 o    191.5    4.5    0.0000   0.0000          ?        ?   367.1499  17.2401          ?        ?      191.5        4.5       ?       ? 
1 1 1   27   10   53 o    121.0    7.1    0.0000   0.0000          ?        ?   146.8600  17.2401          ?        ?      121.0        7.1       ?       ? 
1 1 1   27   10   54 o    264.3    3.5    0.0000   0.0000          ?        ?   699.1812  18.5171          ?        ?      264.3        3.5       ?       ? 
1 1 1   27   10   55 o     68.0   14.1    0.0000   0.0000          ?        ?    48.5276  18.5171          ?        ?       68.0       14.1       ?       ? 
1 1 1   27   10   56 o    173.4    5.7    0.0000   0.0000          ?        ?   301.3822  19.7942          ?        ?      173.4        5.7       ?       ? 
1 1 1   27   10   57 o     19.9   10.0    0.0000   0.0000          ?        ?   -59.3825  18.5171          ?        ?       19.9       10.0       ?       ? 
1 1 1   27   10   58 o    374.7    3.1    0.0000   0.0000          ?        ?  1404.7476  22.9868          ?        ?      374.7        3.1       ?       ? 
1 1 1   27   10   59 o    381.9    3.0    0.0000   0.0000          ?        ?  1459.0220  22.9868          ?        ?      381.9        3.0       ?       ? 
1 1 1   27   10   60 o     78.6   12.6    0.0000   0.0000          ?        ?    62.5751  19.7942          ?        ?       78.6       12.6       ?       ? 
1 1 1   27   10   61 o    141.3    7.0    0.0000   0.0000          ?        ?   200.4958  19.7942          ?        ?      141.3        7.0       ?       ? 
1 1 1   27   10   62 o    184.4    5.4    0.0000   0.0000          ?        ?   340.9706  19.7942          ?        ?      184.4        5.4       ?       ? 
1 1 1   27   10   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   10   64 o    215.8    4.6    0.0000   0.0000          ?        ?   466.7593  19.7942          ?        ?      215.8        4.6       ?       ? 
1 1 1   27   10   65 o    218.6    4.7    0.0000   0.0000          ?        ?   478.8912  20.4327          ?        ?      218.6        4.7       ?       ? 
1 1 1   27   10   66 o     87.2   11.7    0.0000   0.0000          ?        ?    77.2611  20.4327          ?        ?       87.2       11.7       ?       ? 
1 1 1   27   10   67 o    373.9    3.2    0.0000   0.0000          ?        ?  1399.6394  24.2638          ?        ?      373.9        3.2       ?       ? 
1 1 1   27   10   68 o     30.8   14.1    0.0000   0.0000          ?        ?   -13.4090  19.7942          ?        ?       30.8       14.1       ?       ? 
1 1 1   27   10   69 o    194.6    5.4    0.0000   0.0000          ?        ?   380.5589  21.0712          ?        ?      194.6        5.4       ?       ? 
1 1 1   27   10   70 o     75.8   14.4    0.0000   0.0000          ?        ?    61.2981  21.0712          ?        ?       75.8       14.4       ?       ? 
1 1 1   27   10   71 o     32.5   14.7    0.0000   0.0000          ?        ?    -9.5778  20.4327          ?        ?       32.5       14.7       ?       ? 
1 1 1   27   11    0 o    524.4    3.5 2750.1128  37.0343  2750.1128  37.0343  2750.1128  37.0343      524.4      3.5      524.4        3.5     0.0     0.0 
1 1 1   27   11    1 o   1057.8    4.1    0.0000   0.0000          ?        ? 11190.0918  87.4775          ?        ?     1057.8        4.1       ?       ? 
1 1 1   27   11    2 o   1051.9    3.8    0.0000   0.0000          ?        ? 11065.5801  80.4537          ?        ?     1051.9        3.8       ?       ? 
1 1 1   27   11    3 o   1621.4    5.4    0.0000   0.0000          ?        ? 26293.0430 174.9549          ?        ?     1621.4        5.4       ?       ? 
1 1 1   27   11    4 o   1043.4    3.7    0.0000   0.0000          ?        ? 10886.7939  77.2611          ?        ?     1043.4        3.7       ?       ? 
1 1 1   27   11    5 o    624.0    2.7    0.0000   0.0000          ?        ?  3893.7048  33.2031          ?        ?      624.0        2.7       ?       ? 
1 1 1   27   11    6 o   1664.9    5.6    0.0000   0.0000          ?        ? 27723.3301 187.0868          ?        ?     1664.9        5.6       ?       ? 
1 1 1   27   11    7 o    278.1    2.5    0.0000   0.0000          ?        ?   773.2497  14.0475          ?        ?      278.1        2.5       ?       ? 
1 1 1   27   11    8 o    978.4    3.8    0.0000   0.0000          ?        ?  9572.7158  73.4300          ?        ?      978.4        3.8       ?       ? 
1 1 1   27   11    9 f    772.2    3.1    0.0000   0.0000          ?        ?  5963.1538  47.2506          ?        ?      772.2        3.1       ?       ? 
1 1 1   27   11   10 o    277.8    2.3    0.0000   0.0000          ?        ?   771.9727  12.7704          ?        ?      277.8        2.3       ?       ? 
1 1 1   27   11   11 o   1129.1    4.3    0.0000   0.0000          ?        ? 12750.6387  97.6938          ?        ?     1129.1        4.3       ?       ? 
1 1 1   27   11   12 o     80.7    6.7    0.0000   0.0000          ?        ?    65.1292  10.8549          ?        ?       80.7        6.7       ?       ? 
1 1 1   27   11   13 o   1117.1    4.1    0.0000   0.0000          ?        ? 12479.9053  90.6701          ?        ?     1117.1        4.1       ?       ? 
1 1 1   27   11   14 o   1345.1    4.8    0.0000   0.0000          ?        ? 18096.3418 129.6199          ?        ?     1345.1        4.8       ?       ? 
1 1 1   27   11   15 o   1021.7    3.9    0.0000   0.0000          ?        ? 10439.8281  79.1767          ?        ?     1021.7        3.9       ?       ? 
1 1 1   27   11   16 o    475.2    2.6    0.0000   0.0000          ?        ?  2257.8125  24.2638          ?        ?      475.2        2.6       ?       ? 
1 1 1   27   11   17 o    889.9    3.6    0.0000   0.0000          ?        ?  7920.2222  63.8522          ?        ?      889.9        3.6       ?       ? 
1 1 1   27   11   18 o    965.6    3.7    0.0000   0.0000          ?        ?  9324.9697  72.1529          ?        ?      965.6        3.7       ?       ? 
1 1 1   27   11   19 o   1448.9    5.2    0.0000   0.0000          ?        ? 20997.1445 151.9681          ?        ?     1448.9        5.2       ?       ? 
1 1 1   27   11   20 o   1069.8    4.2    0.0000   0.0000          ?        ? 11446.1387  90.6701          ?        ?     1069.8        4.2       ?       ? 
1 1 1   27   11   21 o   1776.4    6.4    0.0000   0.0000          ?        ? 31563.4023 228.5907          ?        ?     1776.4        6.4       ?       ? 
1 1 1   27   11   22 o    598.4    3.0    0.0000   0.0000          ?        ?  3580.8291  35.7572          ?        ?      598.4        3.0       ?       ? 
1 1 1   27   11   23 o    582.3    2.8    0.0000   0.0000          ?        ?  3390.5498  32.5646          ?        ?      582.3        2.8       ?       ? 
1 1 1   27   11   24 o   1485.5    5.4    0.0000   0.0000          ?        ? 22070.5000 159.6304          ?        ?     1485.5        5.4       ?       ? 
1 1 1   27   11   25 o    893.8    3.4    0.0000   0.0000          ?        ?  7989.1821  60.6596          ?        ?      893.8        3.4       ?       ? 
1 1 1   27   11   26 f   1373.6    4.8    0.0000   0.0000          ?        ? 18870.2305 131.5355          ?        ?     1373.6        4.8       ?       ? 
1 1 1   27   11   27 o    546.8    2.7    0.0000   0.0000          ?        ?  2989.5583  30.0105          ?        ?      546.8        2.7       ?       ? 
1 1 1   27   11   28 o     17.0    8.6    0.0000   0.0000          ?        ?   -42.7809  13.4090          ?        ?       17.0        8.6       ?       ? 
1 1 1   27   11   29 o   1070.3    3.8    0.0000   0.0000          ?        ? 11457.6318  82.3693          ?        ?     1070.3        3.8       ?       ? 
1 1 1   27   11   30 o    676.7    3.0    0.0000   0.0000          ?        ?  4580.1157  40.8654          ?        ?      676.7        3.0       ?       ? 
1 1 1   27   11   31 o    653.3    2.8    0.0000   0.0000          ?        ?  4267.8789  36.3957          ?        ?      653.3        2.8       ?       ? 
1 1 1   27   11   32 o     90.7    8.4    0.0000   0.0000          ?        ?    82.3693  15.3245          ?        ?       90.7        8.4       ?       ? 
1 1 1   27   11   33 o    165.1    4.4    0.0000   0.0000          ?        ?   272.6487  14.6860          ?        ?      165.1        4.4       ?       ? 
1 1 1   27   11   34 o    291.6    2.8    0.0000   0.0000          ?        ?   850.5108  16.6016          ?        ?      291.6        2.8       ?       ? 
1 1 1   27   11   35 o    687.8    2.8    0.0000   0.0000          ?        ?  4730.8071  38.9498          ?        ?      687.8        2.8       ?       ? 
1 1 1   27   11   36 o    450.1    2.7    0.0000   0.0000          ?        ?  2026.0291  24.2638          ?        ?      450.1        2.7       ?       ? 
1 1 1   27   11   37 o    315.5    2.9    0.0000   0.0000          ?        ?   995.4552  18.5171          ?        ?      315.5        2.9       ?       ? 
1 1 1   27   11   38 o    408.0    2.6    0.0000   0.0000          ?        ?  1665.2643  21.0712          ?        ?      408.0        2.6       ?       ? 
1 1 1   27   11   39 o    176.5    4.3    0.0000   0.0000          ?        ?   311.5985  15.3245          ?        ?      176.5        4.3       ?       ? 
1 1 1   27   11   40 o    631.6    2.8    0.0000   0.0000          ?        ?  3989.4832  35.7572          ?        ?      631.6        2.8       ?       ? 
1 1 1   27   11   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   11   42 o    289.2    3.0    0.0000   0.0000          ?        ?   836.4633  17.2401          ?        ?      289.2        3.0       ?       ? 
1 1 1   27   11   43 o    259.6    3.3    0.0000   0.0000          ?        ?   674.2788  17.2401          ?        ?      259.6        3.3       ?       ? 
1 1 1   27   11   44 o    452.0    2.5    0.0000   0.0000          ?        ?  2043.2692  22.9868          ?        ?      452.0        2.5       ?       ? 
1 1 1   27   11   45 o    183.0    4.7    0.0000   0.0000          ?        ?   335.2238  17.2401          ?        ?      183.0        4.7       ?       ? 
1 1 1   27   11   46 o    547.1    2.6    0.0000   0.0000          ?        ?  2993.3894  28.7335          ?        ?      547.1        2.6       ?       ? 
1 1 1   27   11   47 o    190.2    4.4    0.0000   0.0000          ?        ?   362.0418  16.6016          ?        ?      190.2        4.4       ?       ? 
1 1 1   27   11   48 o    326.1    3.0    0.0000   0.0000          ?        ?  1063.7771  19.7942          ?        ?      326.1        3.0       ?       ? 
1 1 1   27   11   49 o     57.4   14.5    0.0000   0.0000          ?        ?    34.4802  16.6016          ?        ?       57.4       14.5       ?       ? 
1 1 1   27   11   50 o    237.4    3.8    0.0000   0.0000          ?        ?   563.8146  17.8786          ?        ?      237.4        3.8       ?       ? 
1 1 1   27   11   51 o    196.8    4.5    0.0000   0.0000          ?        ?   387.5826  17.8786          ?        ?      196.8        4.5       ?       ? 
1 1 1   27   11   52 o    199.8    4.6    0.0000   0.0000          ?        ?   399.7145  18.5171          ?        ?      199.8        4.6       ?       ? 
1 1 1   27   11   53 o    182.1    4.9    0.0000   0.0000          ?        ?   332.0312  17.8786          ?        ?      182.1        4.9       ?       ? 
1 1 1   27   11   54 o    339.5    3.0    0.0000   0.0000          ?        ?  1153.1700  20.4327          ?        ?      339.5        3.0       ?       ? 
1 1 1   27   11   55 o    157.5    5.7    0.0000   0.0000          ?        ?   248.3849  17.8786          ?        ?      157.5        5.7       ?       ? 
1 1 1   27   11   56 f    288.4    3.5    0.0000   0.0000          ?        ?   832.6321  20.4327          ?        ?      288.4        3.5       ?       ? 
1 1 1   27   11   57 o    283.9    3.7    0.0000   0.0000          ?        ?   806.4528  21.0712          ?        ?      283.9        3.7       ?       ? 
1 1 1   27   11   58 o    324.0    3.5    0.0000   0.0000          ?        ?  1050.3680  22.9868          ?        ?      324.0        3.5       ?       ? 
1 1 1   27   11   59 o    375.4    3.1    0.0000   0.0000          ?        ?  1410.4943  23.6253          ?        ?      375.4        3.1       ?       ? 
1 1 1   27   11   60 o    181.3    5.5    0.0000   0.0000          ?        ?   329.4771  19.7942          ?        ?      181.3        5.5       ?       ? 
1 1 1   27   11   61 o     92.7   11.0    0.0000   0.0000          ?        ?    86.8389  20.4327          ?        ?       92.7       11.0       ?       ? 
1 1 1   27   11   62 o    190.5    5.4    0.0000   0.0000          ?        ?   363.9573  20.4327          ?        ?      190.5        5.4       ?       ? 
1 1 1   27   11   63 f     69.5   14.7    0.0000   0.0000          ?        ?    51.0817  19.7942          ?        ?       69.5       14.7       ?       ? 
1 1 1   27   11   64 o    170.9    6.0    0.0000   0.0000          ?        ?   293.0815  20.4327          ?        ?      170.9        6.0       ?       ? 
1 1 1   27   11   65 o    119.6    8.8    0.0000   0.0000          ?        ?   144.3059  21.0712          ?        ?      119.6        8.8       ?       ? 
1 1 1   27   11   66 o    298.0    3.5    0.0000   0.0000          ?        ?   889.4606  21.0712          ?        ?      298.0        3.5       ?       ? 
1 1 1   27   11   67 o    242.3    4.2    0.0000   0.0000          ?        ?   588.7169  20.4327          ?        ?      242.3        4.2       ?       ? 
1 1 1   27   11   68 o    170.5    6.2    0.0000   0.0000          ?        ?   292.4429  21.0712          ?        ?      170.5        6.2       ?       ? 
1 1 1   27   11   69 o     22.3   11.1    0.0000   0.0000          ?        ?   -49.8047  19.7942          ?        ?       22.3       11.1       ?       ? 
1 1 1   27   11   70 f    133.5    7.7    0.0000   0.0000          ?        ?   180.0631  20.4327          ?        ?      133.5        7.7       ?       ? 
1 1 1   27   11   71 o     29.6   13.8    0.0000   0.0000          ?        ?   -18.5171  20.4327          ?        ?       29.6       13.8       ?       ? 
1 1 1   27   12    0 o    421.9    3.9 1780.8368  32.5646  1780.8368  32.5646  1780.8368  32.5646      421.9      3.9      421.9        3.9     0.0     0.0 
1 1 1   27   12    1 o    828.4    3.7    0.0000   0.0000          ?        ?  6862.8306  61.9366          ?        ?      828.4        3.7       ?       ? 
1 1 1   27   12    2 o    406.0    2.5    0.0000   0.0000          ?        ?  1648.0244  20.4327          ?        ?      406.0        2.5       ?       ? 
1 1 1   27   12    3 o    563.8    3.0    0.0000   0.0000          ?        ?  3178.5605  33.8416          ?        ?      563.8        3.0       ?       ? 
1 1 1   27   12    4 o   1202.2    4.7    0.0000   0.0000          ?        ? 14454.8525 113.0183          ?        ?     1202.2        4.7       ?       ? 
1 1 1   27   12    5 o    232.8    2.6    0.0000   0.0000          ?        ?   542.1049  12.1319          ?        ?      232.8        2.6       ?       ? 
1 1 1   27   12    6 o   1207.5    4.3    0.0000   0.0000          ?        ? 14581.9180 102.8020          ?        ?     1207.5        4.3       ?       ? 
1 1 1   27   12    7 o    789.2    3.2    0.0000   0.0000          ?        ?  6229.4170  49.8047          ?        ?      789.2        3.2       ?       ? 
1 1 1   27   12    8 o    315.3    2.1    0.0000   0.0000          ?        ?   994.1782  13.4090          ?        ?      315.3        2.1       ?       ? 
1 1 1   27   12    9 o    523.2    2.4    0.0000   0.0000          ?        ?  2737.3423  25.5409          ?        ?      523.2        2.4       ?       ? 
1 1 1   27   12   10 o   1507.7    5.3    0.0000   0.0000          ?        ? 22735.8398 159.6304          ?        ?     1507.7        5.3       ?       ? 
1 1 1   27   12   11 o    995.3    3.7    0.0000   0.0000          ?        ?  9907.3018  74.0685          ?        ?      995.3        3.7       ?       ? 
1 1 1   27   12   12 o    638.8    3.1    0.0000   0.0000          ?        ?  4081.4304  39.5883          ?        ?      638.8        3.1       ?       ? 
1 1 1   27   12   13 o   2187.3    8.0    0.0000   0.0000          ?        ? 47857.1953 349.2713          ?        ?     2187.3        8.0       ?       ? 
1 1 1   27   12   14 o   1550.1    5.5    0.0000   0.0000          ?        ? 24030.7617 171.7623          ?        ?     1550.1        5.5       ?       ? 
1 1 1   27   12   15 o    531.6    2.8    0.0000   0.0000          ?        ?  2826.0967  29.3720          ?        ?      531.6        2.8       ?       ? 
1 1 1   27   12   16 o    437.1    2.6    0.0000   0.0000          ?        ?  1910.4568  22.9868          ?        ?      437.1        2.6       ?       ? 
1 1 1   27   12   17 o    884.9    3.4    0.0000   0.0000          ?        ?  7831.4678  60.6596          ?        ?      884.9        3.4       ?       ? 
1 1 1   27   12   18 o   1434.5    5.2    0.0000   0.0000          ?        ? 20581.4688 149.4141          ?        ?     1434.5        5.2       ?       ? 
1 1 1   27   12   19 o    534.8    2.7    0.0000   0.0000          ?        ?  2860.5769  29.3720          ?        ?      534.8        2.7       ?       ? 
1 1 1   27   12   20 f   1074.8    4.1    0.0000   0.0000          ?        ? 11553.4102  88.1160          ?        ?     1074.8        4.1       ?       ? 
1 1 1   27   12   21 o   1479.7    5.2    0.0000   0.0000          ?        ? 21898.7383 155.1608          ?        ?     1479.7        5.2       ?       ? 
1 1 1   27   12   22 o    480.0    2.5    0.0000   0.0000          ?        ?  2304.4246  23.6253          ?        ?      480.0        2.5       ?       ? 
1 1 1   27   12   23 o    349.7    2.6    0.0000   0.0000          ?        ?  1222.7689  18.5171          ?        ?      349.7        2.6       ?       ? 
1 1 1   27   12   24 o    484.5    2.6    0.0000   0.0000          ?        ?  2347.2056  24.9023          ?        ?      484.5        2.6       ?       ? 
1 1 1   27   12   25 o   1002.0    3.8    0.0000   0.0000          ?        ? 10040.7529  76.6226          ?        ?     1002.0        3.8       ?       ? 
1 1 1   27   12   26 o    124.8    7.7    0.0000   0.0000          ?        ?   155.7993  19.1556          ?        ?      124.8        7.7       ?       ? 
1 1 1   27   12   27 o    308.7    2.8    0.0000   0.0000          ?        ?   953.3128  17.2401          ?        ?      308.7        2.8       ?       ? 
1 1 1   27   12   28 o    307.1    3.0    0.0000   0.0000          ?        ?   943.0964  18.5171          ?        ?      307.1        3.0       ?       ? 
1 1 1   27   12   29 o   1413.4    4.9    0.0000   0.0000          ?        ? 19981.8945 139.1977          ?        ?     1413.4        4.9       ?       ? 
1 1 1   27   12   30 o    270.6    3.2    0.0000   0.0000          ?        ?   732.3843  17.2401          ?        ?      270.6        3.2       ?       ? 
1 1 1   27   12   31 o    360.5    2.7    0.0000   0.0000          ?        ?  1299.3915  19.7942          ?        ?      360.5        2.7       ?       ? 
1 1 1   27   12   32 o    781.1    3.2    0.0000   0.0000          ?        ?  6102.3511  50.4432          ?        ?      781.1        3.2       ?       ? 
1 1 1   27   12   33 o    154.3    4.8    0.0000   0.0000          ?        ?   238.1686  14.6860          ?        ?      154.3        4.8       ?       ? 
1 1 1   27   12   34 o    269.9    3.4    0.0000   0.0000          ?        ?   728.5532  18.5171          ?        ?      269.9        3.4       ?       ? 
1 1 1   27   12   35 o    222.9    3.9    0.0000   0.0000          ?        ?   496.7698  17.2401          ?        ?      222.9        3.9       ?       ? 
1 1 1   27   12   36 o    323.6    3.0    0.0000   0.0000          ?        ?  1047.1754  19.1556          ?        ?      323.6        3.0       ?       ? 
1 1 1   27   12   37 o    615.9    2.9    0.0000   0.0000          ?        ?  3793.4568  35.7572          ?        ?      615.9        2.9       ?       ? 
1 1 1   27   12   38 f    485.6    2.6    0.0000   0.0000          ?        ?  2358.0603  25.5409          ?        ?      485.6        2.6       ?       ? 
1 1 1   27   12   39 f    505.5    2.5    0.0000   0.0000          ?        ?  2556.0020  25.5409          ?        ?      505.5        2.5       ?       ? 
1 1 1   27   12   40 o    392.5    2.7    0.0000   0.0000          ?        ?  1540.7527  21.0712          ?        ?      392.5        2.7       ?       ? 
1 1 1   27   12   41 o    608.5    2.7    0.0000   0.0000          ?        ?  3704.0637  33.2031          ?        ?      608.5        2.7       ?       ? 
1 1 1   27   12   42 o    347.8    2.8    0.0000   0.0000          ?        ?  1209.9985  19.1556          ?        ?      347.8        2.8       ?       ? 
1 1 1   27   12   43 o    363.5    2.6    0.0000   0.0000          ?        ?  1321.7397  19.1556          ?        ?      363.5        2.6       ?       ? 
1 1 1   27   12   44 o    111.2    7.2    0.0000   0.0000          ?        ?   123.8732  15.9630          ?        ?      111.2        7.2       ?       ? 
1 1 1   27   12   45 o    359.8    2.7    0.0000   0.0000          ?        ?  1294.9219  19.1556          ?        ?      359.8        2.7       ?       ? 
1 1 1   27   12   46 o    229.5    3.6    0.0000   0.0000          ?        ?   526.7803  16.6016          ?        ?      229.5        3.6       ?       ? 
1 1 1   27   12   47 o    329.1    3.0    0.0000   0.0000          ?        ?  1083.5712  19.7942          ?        ?      329.1        3.0       ?       ? 
1 1 1   27   12   48 o    374.7    2.7    0.0000   0.0000          ?        ?  1404.1090  20.4327          ?        ?      374.7        2.7       ?       ? 
1 1 1   27   12   49 o    403.2    2.7    0.0000   0.0000          ?        ?  1626.3146  21.7097          ?        ?      403.2        2.7       ?       ? 
1 1 1   27   12   50 f    319.4    3.0    0.0000   0.0000          ?        ?  1020.3576  19.1556          ?        ?      319.4        3.0       ?       ? 
1 1 1   27   12   51 o    352.1    2.8    0.0000   0.0000          ?        ?  1240.0090  19.7942          ?        ?      352.1        2.8       ?       ? 
1 1 1   27   12   52 o    118.9    7.3    0.0000   0.0000          ?        ?   141.7518  17.2401          ?        ?      118.9        7.3       ?       ? 
1 1 1   27   12   53 o    154.8    5.4    0.0000   0.0000          ?        ?   240.0841  16.6016          ?        ?      154.8        5.4       ?       ? 
1 1 1   27   12   54 o    224.5    4.1    0.0000   0.0000          ?        ?   504.4321  18.5171          ?        ?      224.5        4.1       ?       ? 
1 1 1   27   12   55 o    522.7    2.7    0.0000   0.0000          ?        ?  2733.5112  28.7335          ?        ?      522.7        2.7       ?       ? 
1 1 1   27   12   56 o     31.7   14.3    0.0000   0.0000          ?        ?    -9.5778  19.1556          ?        ?       31.7       14.3       ?       ? 
1 1 1   27   12   57 o    251.0    4.1    0.0000   0.0000          ?        ?   630.8594  20.4327          ?        ?      251.0        4.1       ?       ? 
1 1 1   27   12   58 o    284.1    3.7    0.0000   0.0000          ?        ?   807.7299  21.0712          ?        ?      284.1        3.7       ?       ? 
1 1 1   27   12   59 o     20.8   10.5    0.0000   0.0000          ?        ?   -70.8759  21.0712          ?        ?       20.8       10.5       ?       ? 
1 1 1   27   12   60 o    155.7    6.8    0.0000   0.0000          ?        ?   243.2767  21.0712          ?        ?      155.7        6.8       ?       ? 
1 1 1   27   12   61 o    398.4    3.2    0.0000   0.0000          ?        ?  1588.6418  25.5409          ?        ?      398.4        3.2       ?       ? 
1 1 1   27   12   62 o     21.2   10.6    0.0000   0.0000          ?        ?   -58.1055  19.7942          ?        ?       21.2       10.6       ?       ? 
1 1 1   27   12   63 o    143.5    6.9    0.0000   0.0000          ?        ?   206.8810  19.7942          ?        ?      143.5        6.9       ?       ? 
1 1 1   27   12   64 o    119.1    8.8    0.0000   0.0000          ?        ?   143.0288  21.0712          ?        ?      119.1        8.8       ?       ? 
1 1 1   27   12   65 f    229.5    4.5    0.0000   0.0000          ?        ?   528.0574  20.4327          ?        ?      229.5        4.5       ?       ? 
1 1 1   27   12   66 o    272.1    3.9    0.0000   0.0000          ?        ?   741.9621  21.0712          ?        ?      272.1        3.9       ?       ? 
1 1 1   27   12   67 o    232.1    4.5    0.0000   0.0000          ?        ?   540.1893  21.0712          ?        ?      232.1        4.5       ?       ? 
1 1 1   27   12   68 o    108.9    8.8    0.0000   0.0000          ?        ?   120.0421  19.1556          ?        ?      108.9        8.8       ?       ? 
1 1 1   27   12   69 o    124.8    8.2    0.0000   0.0000          ?        ?   157.7148  20.4327          ?        ?      124.8        8.2       ?       ? 
1 1 1   27   12   70 o    211.7    4.7    0.0000   0.0000          ?        ?   450.1577  19.7942          ?        ?      211.7        4.7       ?       ? 
1 1 1   27   13    0 o    924.9    5.6 8556.8281 104.0790  8556.8281 104.0790  8556.8281 104.0790      924.9      5.6      924.9        5.6     0.0     0.0 
1 1 1   27   13    1 o    572.8    3.0    0.0000   0.0000          ?        ?  3281.3628  33.8416          ?        ?      572.8        3.0       ?       ? 
1 1 1   27   13    2 o    935.5    3.9    0.0000   0.0000          ?        ?  8751.5771  72.1529          ?        ?      935.5        3.9       ?       ? 
1 1 1   27   13    3 o    734.3    3.1    0.0000   0.0000          ?        ?  5391.6768  45.9736          ?        ?      734.3        3.1       ?       ? 
1 1 1   27   13    4 o    335.2    2.3    0.0000   0.0000          ?        ?  1123.7981  15.3245          ?        ?      335.2        2.3       ?       ? 
1 1 1   27   13    5 o   1090.8    4.2    0.0000   0.0000          ?        ? 11900.1270  90.6701          ?        ?     1090.8        4.2       ?       ? 
1 1 1   27   13    6 o    168.6    3.0    0.0000   0.0000          ?        ?   284.1421  10.2163          ?        ?      168.6        3.0       ?       ? 
1 1 1   27   13    7 o   1666.8    5.9    0.0000   0.0000          ?        ? 27786.5469 197.3032          ?        ?     1666.8        5.9       ?       ? 
1 1 1   27   13    8 o    593.4    2.5    0.0000   0.0000          ?        ?  3521.4468  30.0105          ?        ?      593.4        2.5       ?       ? 
1 1 1   27   13    9 o    394.5    2.2    0.0000   0.0000          ?        ?  1556.0771  17.2401          ?        ?      394.5        2.2       ?       ? 
1 1 1   27   13   10 o    976.2    3.7    0.0000   0.0000          ?        ?  9529.9355  71.5144          ?        ?      976.2        3.7       ?       ? 
1 1 1   27   13   11 o    998.1    3.9    0.0000   0.0000          ?        ?  9963.4912  77.2611          ?        ?      998.1        3.9       ?       ? 
1 1 1   27   13   12 o    492.3    2.6    0.0000   0.0000          ?        ?  2423.1895  25.5409          ?        ?      492.3        2.6       ?       ? 
1 1 1   27   13   13 o    316.5    2.8    0.0000   0.0000          ?        ?  1001.8404  17.8786          ?        ?      316.5        2.8       ?       ? 
1 1 1   27   13   14 o    790.1    3.3    0.0000   0.0000          ?        ?  6242.1875  51.7203          ?        ?      790.1        3.3       ?       ? 
1 1 1   27   13   15 o   1088.2    4.2    0.0000   0.0000          ?        ? 11842.6602  91.9471          ?        ?     1088.2        4.2       ?       ? 
1 1 1   27   13   16 o    781.3    3.3    0.0000   0.0000          ?        ?  6104.9053  51.7203          ?        ?      781.3        3.3       ?       ? 
1 1 1   27   13   17 o    772.1    3.2    0.0000   0.0000          ?        ?  5961.8765  49.1662          ?        ?      772.1        3.2       ?       ? 
1 1 1   27   13   18 o    487.3    2.6    0.0000   0.0000          ?        ?  2374.6619  25.5409          ?        ?      487.3        2.6       ?       ? 
1 1 1   27   13   19 f    281.3    2.7    0.0000   0.0000          ?        ?   791.1283  15.3245          ?        ?      281.3        2.7       ?       ? 
1 1 1   27   13   20 o    624.2    2.8    0.0000   0.0000          ?        ?  3896.8975  35.1187          ?        ?      624.2        2.8       ?       ? 
1 1 1   27   13   21 o    685.3    3.0    0.0000   0.0000          ?        ?  4696.9648  40.8654          ?        ?      685.3        3.0       ?       ? 
1 1 1   27   13   22 o   1199.0    4.4    0.0000   0.0000          ?        ? 14378.2305 104.7175          ?        ?     1199.0        4.4       ?       ? 
1 1 1   27   13   23 o    232.5    3.2    0.0000   0.0000          ?        ?   540.8278  14.6860          ?        ?      232.5        3.2       ?       ? 
1 1 1   27   13   24 o    392.4    2.4    0.0000   0.0000          ?        ?  1540.1141  19.1556          ?        ?      392.4        2.4       ?       ? 
1 1 1   27   13   25 o   1037.5    3.9    0.0000   0.0000          ?        ? 10766.1133  80.4537          ?        ?     1037.5        3.9       ?       ? 
1 1 1   27   13   26 o    645.7    2.9    0.0000   0.0000          ?        ?  4170.1846  37.0343          ?        ?      645.7        2.9       ?       ? 
1 1 1   27   13   27 o    314.8    2.6    0.0000   0.0000          ?        ?   990.9855  16.6016          ?        ?      314.8        2.6       ?       ? 
1 1 1   27   13   28 f    399.0    2.6    0.0000   0.0000          ?        ?  1591.8345  20.4327          ?        ?      399.0        2.6       ?       ? 
1 1 1   27   13   29 o    354.1    2.6    0.0000   0.0000          ?        ?  1254.0564  18.5171          ?        ?      354.1        2.6       ?       ? 
1 1 1   27   13   30 o    171.2    4.5    0.0000   0.0000          ?        ?   293.0815  15.3245          ?        ?      171.2        4.5       ?       ? 
1 1 1   27   13   31 o    475.9    2.5    0.0000   0.0000          ?        ?  2265.4746  24.2638          ?        ?      475.9        2.5       ?       ? 
1 1 1   27   13   32 o    569.8    2.8    0.0000   0.0000          ?        ?  3247.5210  31.9261          ?        ?      569.8        2.8       ?       ? 
1 1 1   27   13   33 o    314.6    3.2    0.0000   0.0000          ?        ?   989.7085  20.4327          ?        ?      314.6        3.2       ?       ? 
1 1 1   27   13   34 o    226.3    3.7    0.0000   0.0000          ?        ?   512.0943  16.6016          ?        ?      226.3        3.7       ?       ? 
1 1 1   27   13   35 o    947.0    3.6    0.0000   0.0000          ?        ?  8969.9521  68.3218          ?        ?      947.0        3.6       ?       ? 
1 1 1   27   13   36 o    379.8    2.8    0.0000   0.0000          ?        ?  1443.0588  21.0712          ?        ?      379.8        2.8       ?       ? 
1 1 1   27   13   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   13   38 o    105.9    7.8    0.0000   0.0000          ?        ?   112.3798  16.6016          ?        ?      105.9        7.8       ?       ? 
1 1 1   27   13   39 o    238.1    3.4    0.0000   0.0000          ?        ?   567.0072  15.9630          ?        ?      238.1        3.4       ?       ? 
1 1 1   27   13   40 o    144.9    5.5    0.0000   0.0000          ?        ?   210.0736  15.9630          ?        ?      144.9        5.5       ?       ? 
1 1 1   27   13   41 o    334.3    2.9    0.0000   0.0000          ?        ?  1118.0514  19.1556          ?        ?      334.3        2.9       ?       ? 
1 1 1   27   13   42 o    427.3    2.6    0.0000   0.0000          ?        ?  1826.1719  22.3483          ?        ?      427.3        2.6       ?       ? 
1 1 1   27   13   43 o    251.4    3.3    0.0000   0.0000          ?        ?   632.1364  16.6016          ?        ?      251.4        3.3       ?       ? 
1 1 1   27   13   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   13   45 o     85.9    9.3    0.0000   0.0000          ?        ?    74.0685  15.9630          ?        ?       85.9        9.3       ?       ? 
1 1 1   27   13   46 o    380.4    2.8    0.0000   0.0000          ?        ?  1447.5286  21.0712          ?        ?      380.4        2.8       ?       ? 
1 1 1   27   13   47 o    314.0    2.9    0.0000   0.0000          ?        ?   986.5159  18.5171          ?        ?      314.0        2.9       ?       ? 
1 1 1   27   13   48 o    353.2    2.9    0.0000   0.0000          ?        ?  1247.6713  20.4327          ?        ?      353.2        2.9       ?       ? 
1 1 1   27   13   49 o    265.9    3.2    0.0000   0.0000          ?        ?   707.4820  17.2401          ?        ?      265.9        3.2       ?       ? 
1 1 1   27   13   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   13   51 o    294.9    3.1    0.0000   0.0000          ?        ?   870.3050  18.5171          ?        ?      294.9        3.1       ?       ? 
1 1 1   27   13   52 o    224.9    4.1    0.0000   0.0000          ?        ?   506.3477  18.5171          ?        ?      224.9        4.1       ?       ? 
1 1 1   27   13   53 o    237.2    4.0    0.0000   0.0000          ?        ?   563.1760  19.1556          ?        ?      237.2        4.0       ?       ? 
1 1 1   27   13   54 o     30.9   13.9    0.0000   0.0000          ?        ?    -8.3008  17.8786          ?        ?       30.9       13.9       ?       ? 
1 1 1   27   13   55 o    145.6    6.4    0.0000   0.0000          ?        ?   212.6277  18.5171          ?        ?      145.6        6.4       ?       ? 
1 1 1   27   13   56 o    312.9    3.3    0.0000   0.0000          ?        ?   979.4921  20.4327          ?        ?      312.9        3.3       ?       ? 
1 1 1   27   13   57 o    410.6    3.0    0.0000   0.0000          ?        ?  1686.9742  24.2638          ?        ?      410.6        3.0       ?       ? 
1 1 1   27   13   58 o    439.2    2.9    0.0000   0.0000          ?        ?  1930.2509  25.5409          ?        ?      439.2        2.9       ?       ? 
1 1 1   27   13   59 o    246.1    4.4    0.0000   0.0000          ?        ?   606.5955  21.7097          ?        ?      246.1        4.4       ?       ? 
1 1 1   27   13   60 o     19.4    9.8    0.0000   0.0000          ?        ?   -67.6833  19.1556          ?        ?       19.4        9.8       ?       ? 
1 1 1   27   13   61 o     96.8   10.2    0.0000   0.0000          ?        ?    94.5012  19.7942          ?        ?       96.8       10.2       ?       ? 
1 1 1   27   13   62 o    114.5    8.9    0.0000   0.0000          ?        ?   132.1740  20.4327          ?        ?      114.5        8.9       ?       ? 
1 1 1   27   13   63 o     21.7   10.9    0.0000   0.0000          ?        ?   -58.7440  20.4327          ?        ?       21.7       10.9       ?       ? 
1 1 1   27   13   64 o    336.8    3.3    0.0000   0.0000          ?        ?  1135.9299  22.3483          ?        ?      336.8        3.3       ?       ? 
1 1 1   27   13   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   13   66 o     24.8   12.1    0.0000   0.0000          ?        ?   -36.3957  19.7942          ?        ?       24.8       12.1       ?       ? 
1 1 1   27   13   67 o    184.9    5.4    0.0000   0.0000          ?        ?   343.5246  19.7942          ?        ?      184.9        5.4       ?       ? 
1 1 1   27   13   68 o    353.3    3.3    0.0000   0.0000          ?        ?  1250.2253  22.9868          ?        ?      353.3        3.3       ?       ? 
1 1 1   27   13   69 o    170.3    5.8    0.0000   0.0000          ?        ?   291.8044  19.7942          ?        ?      170.3        5.8       ?       ? 
1 1 1   27   13   70 o    160.7    6.6    0.0000   0.0000          ?        ?   260.5168  21.0712          ?        ?      160.7        6.6       ?       ? 
1 1 1   27   14    0 o    830.7    4.9 6902.4189  81.0922  6902.4189  81.0922  6902.4189  81.0922      830.7      4.9      830.7        4.9     0.0     0.0 
1 1 1   27   14    1 o   1402.1    5.5    0.0000   0.0000          ?        ? 19663.2734 155.1608          ?        ?     1402.1        5.5       ?       ? 
1 1 1   27   14    2 o    681.6    3.1    0.0000   0.0000          ?        ?  4646.5220  42.1424          ?        ?      681.6        3.1       ?       ? 
1 1 1   27   14    3 o    583.4    2.9    0.0000   0.0000          ?        ?  3403.9587  33.8416          ?        ?      583.4        2.9       ?       ? 
1 1 1   27   14    4 o    585.5    2.8    0.0000   0.0000          ?        ?  3428.2227  32.5646          ?        ?      585.5        2.8       ?       ? 
1 1 1   27   14    5 o    213.2    2.7    0.0000   0.0000          ?        ?   454.6274  11.4934          ?        ?      213.2        2.7       ?       ? 
1 1 1   27   14    6 o    858.0    3.5    0.0000   0.0000          ?        ?  7362.7925  59.3825          ?        ?      858.0        3.5       ?       ? 
1 1 1   27   14    7 o    523.2    2.6    0.0000   0.0000          ?        ?  2737.9807  26.8179          ?        ?      523.2        2.6       ?       ? 
1 1 1   27   14    8 o    304.4    2.3    0.0000   0.0000          ?        ?   926.4949  14.0475          ?        ?      304.4        2.3       ?       ? 
1 1 1   27   14    9 o    484.7    2.6    0.0000   0.0000          ?        ?  2349.7595  24.9023          ?        ?      484.7        2.6       ?       ? 
1 1 1   27   14   10 o    582.8    2.6    0.0000   0.0000          ?        ?  3396.9351  30.6490          ?        ?      582.8        2.6       ?       ? 
1 1 1   27   14   11 o    394.8    2.6    0.0000   0.0000          ?        ?  1558.6313  20.4327          ?        ?      394.8        2.6       ?       ? 
1 1 1   27   14   12 o    247.1    3.0    0.0000   0.0000          ?        ?   610.4266  14.6860          ?        ?      247.1        3.0       ?       ? 
1 1 1   27   14   13 o   1644.5    6.0    0.0000   0.0000          ?        ? 27050.3301 196.6647          ?        ?     1644.5        6.0       ?       ? 
1 1 1   27   14   14 o   1034.2    4.0    0.0000   0.0000          ?        ? 10695.8760  83.0078          ?        ?     1034.2        4.0       ?       ? 
1 1 1   27   14   15 o    257.3    2.6    0.0000   0.0000          ?        ?   662.1469  13.4090          ?        ?      257.3        2.6       ?       ? 
1 1 1   27   14   16 o    971.5    3.7    0.0000   0.0000          ?        ?  9437.9883  71.5144          ?        ?      971.5        3.7       ?       ? 
1 1 1   27   14   17 o   1337.7    4.9    0.0000   0.0000          ?        ? 17898.4004 130.2584          ?        ?     1337.7        4.9       ?       ? 
1 1 1   27   14   18 o    804.4    3.1    0.0000   0.0000          ?        ?  6470.7783  50.4432          ?        ?      804.4        3.1       ?       ? 
1 1 1   27   14   19 o    551.3    2.5    0.0000   0.0000          ?        ?  3039.3630  28.0950          ?        ?      551.3        2.5       ?       ? 
1 1 1   27   14   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   14   21 o    529.2    2.6    0.0000   0.0000          ?        ?  2800.5559  27.4564          ?        ?      529.2        2.6       ?       ? 
1 1 1   27   14   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   14   23 o    914.6    3.4    0.0000   0.0000          ?        ?  8366.5488  62.5751          ?        ?      914.6        3.4       ?       ? 
1 1 1   27   14   24 o    334.6    2.6    0.0000   0.0000          ?        ?  1119.3285  17.2401          ?        ?      334.6        2.6       ?       ? 
1 1 1   27   14   25 o    711.9    3.0    0.0000   0.0000          ?        ?  5067.9463  42.1424          ?        ?      711.9        3.0       ?       ? 
1 1 1   27   14   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   14   27 o    301.6    2.8    0.0000   0.0000          ?        ?   909.8933  16.6016          ?        ?      301.6        2.8       ?       ? 
1 1 1   27   14   28 o    305.2    2.6    0.0000   0.0000          ?        ?   931.6030  15.9630          ?        ?      305.2        2.6       ?       ? 
1 1 1   27   14   29 o    638.1    2.8    0.0000   0.0000          ?        ?  4071.8525  35.7572          ?        ?      638.1        2.8       ?       ? 
1 1 1   27   14   30 o    317.6    2.9    0.0000   0.0000          ?        ?  1008.8642  18.5171          ?        ?      317.6        2.9       ?       ? 
1 1 1   27   14   31 o    411.6    2.7    0.0000   0.0000          ?        ?  1693.9978  22.3483          ?        ?      411.6        2.7       ?       ? 
1 1 1   27   14   32 o    590.7    2.9    0.0000   0.0000          ?        ?  3490.1589  34.4802          ?        ?      590.7        2.9       ?       ? 
1 1 1   27   14   33 o     75.7   10.5    0.0000   0.0000          ?        ?    57.4669  15.9630          ?        ?       75.7       10.5       ?       ? 
1 1 1   27   14   34 o    903.7    3.5    0.0000   0.0000          ?        ?  8167.9683  63.2136          ?        ?      903.7        3.5       ?       ? 
1 1 1   27   14   35 o    535.9    2.7    0.0000   0.0000          ?        ?  2872.7087  28.7335          ?        ?      535.9        2.7       ?       ? 
1 1 1   27   14   36 o    553.2    2.7    0.0000   0.0000          ?        ?  3060.4341  29.3720          ?        ?      553.2        2.7       ?       ? 
1 1 1   27   14   37 o    297.9    3.2    0.0000   0.0000          ?        ?   887.5450  19.1556          ?        ?      297.9        3.2       ?       ? 
1 1 1   27   14   38 o    325.3    2.8    0.0000   0.0000          ?        ?  1058.6688  18.5171          ?        ?      325.3        2.8       ?       ? 
1 1 1   27   14   39 o    549.7    2.7    0.0000   0.0000          ?        ?  3022.1228  30.0105          ?        ?      549.7        2.7       ?       ? 
1 1 1   27   14   40 o     19.7    9.8    0.0000   0.0000          ?        ?   -43.4195  15.9630          ?        ?       19.7        9.8       ?       ? 
1 1 1   27   14   41 f    225.3    3.5    0.0000   0.0000          ?        ?   507.6247  15.9630          ?        ?      225.3        3.5       ?       ? 
1 1 1   27   14   42 o    406.3    2.6    0.0000   0.0000          ?        ?  1651.2169  21.0712          ?        ?      406.3        2.6       ?       ? 
1 1 1   27   14   43 o    301.3    3.1    0.0000   0.0000          ?        ?   907.9777  18.5171          ?        ?      301.3        3.1       ?       ? 
1 1 1   27   14   44 o     47.5   15.0    0.0000   0.0000          ?        ?    22.3483  15.9630          ?        ?       47.5       15.0       ?       ? 
1 1 1   27   14   45 o    368.9    2.9    0.0000   0.0000          ?        ?  1361.3281  21.7097          ?        ?      368.9        2.9       ?       ? 
1 1 1   27   14   46 o    121.9    6.5    0.0000   0.0000          ?        ?   148.7755  15.9630          ?        ?      121.9        6.5       ?       ? 
1 1 1   27   14   47 o    155.7    5.3    0.0000   0.0000          ?        ?   242.6382  16.6016          ?        ?      155.7        5.3       ?       ? 
1 1 1   27   14   48 o     63.4   14.0    0.0000   0.0000          ?        ?    42.1424  17.2401          ?        ?       63.4       14.0       ?       ? 
1 1 1   27   14   49 o    617.6    2.8    0.0000   0.0000          ?        ?  3815.1667  34.4802          ?        ?      617.6        2.8       ?       ? 
1 1 1   27   14   50 o    319.3    3.1    0.0000   0.0000          ?        ?  1020.3576  19.7942          ?        ?      319.3        3.1       ?       ? 
1 1 1   27   14   51 o    242.4    3.8    0.0000   0.0000          ?        ?   588.0784  18.5171          ?        ?      242.4        3.8       ?       ? 
1 1 1   27   14   52 o    151.3    5.7    0.0000   0.0000          ?        ?   229.2293  17.2401          ?        ?      151.3        5.7       ?       ? 
1 1 1   27   14   53 o    245.0    3.8    0.0000   0.0000          ?        ?   600.8488  18.5171          ?        ?      245.0        3.8       ?       ? 
1 1 1   27   14   54 o    257.2    3.7    0.0000   0.0000          ?        ?   662.1469  19.1556          ?        ?      257.2        3.7       ?       ? 
1 1 1   27   14   55 o    133.3    6.9    0.0000   0.0000          ?        ?   178.1475  18.5171          ?        ?      133.3        6.9       ?       ? 
1 1 1   27   14   56 o    127.6    7.5    0.0000   0.0000          ?        ?   163.4615  19.1556          ?        ?      127.6        7.5       ?       ? 
1 1 1   27   14   57 o    517.2    2.8    0.0000   0.0000          ?        ?  2676.0442  29.3720          ?        ?      517.2        2.8       ?       ? 
1 1 1   27   14   58 o    192.1    5.0    0.0000   0.0000          ?        ?   369.7040  19.1556          ?        ?      192.1        5.0       ?       ? 
1 1 1   27   14   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   14   60 o     19.7   10.0    0.0000   0.0000          ?        ?   -70.2374  19.7942          ?        ?       19.7       10.0       ?       ? 
1 1 1   27   14   61 o    171.6    6.1    0.0000   0.0000          ?        ?   295.6355  21.0712          ?        ?      171.6        6.1       ?       ? 
1 1 1   27   14   62 o    157.3    6.5    0.0000   0.0000          ?        ?   248.3849  20.4327          ?        ?      157.3        6.5       ?       ? 
1 1 1   27   14   63 o    152.5    6.7    0.0000   0.0000          ?        ?   233.6989  20.4327          ?        ?      152.5        6.7       ?       ? 
1 1 1   27   14   64 o     94.6   10.5    0.0000   0.0000          ?        ?    90.6701  19.7942          ?        ?       94.6       10.5       ?       ? 
1 1 1   27   14   65 o     29.6   13.8    0.0000   0.0000          ?        ?   -17.2401  19.7942          ?        ?       29.6       13.8       ?       ? 
1 1 1   27   14   66 o     34.0   15.0    0.0000   0.0000          ?        ?    -4.4697  19.7942          ?        ?       34.0       15.0       ?       ? 
1 1 1   27   14   67 o    258.5    4.0    0.0000   0.0000          ?        ?   669.8092  20.4327          ?        ?      258.5        4.0       ?       ? 
1 1 1   27   14   68 o    167.8    6.1    0.0000   0.0000          ?        ?   283.5036  20.4327          ?        ?      167.8        6.1       ?       ? 
1 1 1   27   14   69 o     93.8   10.9    0.0000   0.0000          ?        ?    90.0316  20.4327          ?        ?       93.8       10.9       ?       ? 
1 1 1   27   15    0 o    680.8    4.3 4636.3052  58.7440  4636.3052  58.7440  4636.3052  58.7440      680.8      4.3      680.8        4.3     0.0     0.0 
1 1 1   27   15    1 o   1688.0    6.9    0.0000   0.0000          ?        ? 28502.3262 231.7833          ?        ?     1688.0        6.9       ?       ? 
1 1 1   27   15    2 o   1310.4    5.3    0.0000   0.0000          ?        ? 17174.9551 139.1977          ?        ?     1310.4        5.3       ?       ? 
1 1 1   27   15    3 o   1057.1    4.6    0.0000   0.0000          ?        ? 11176.0439  96.4168          ?        ?     1057.1        4.6       ?       ? 
1 1 1   27   15    4 o    364.6    2.6    0.0000   0.0000          ?        ?  1329.4020  19.1556          ?        ?      364.6        2.6       ?       ? 
1 1 1   27   15    5 o    137.7    3.7    0.0000   0.0000          ?        ?   189.6409  10.2163          ?        ?      137.7        3.7       ?       ? 
1 1 1   27   15    6 o    204.7    2.8    0.0000   0.0000          ?        ?   418.8702  11.4934          ?        ?      204.7        2.8       ?       ? 
1 1 1   27   15    7 o    422.9    2.6    0.0000   0.0000          ?        ?  1788.4991  21.7097          ?        ?      422.9        2.6       ?       ? 
1 1 1   27   15    8 o    375.6    2.3    0.0000   0.0000          ?        ?  1410.4943  17.2401          ?        ?      375.6        2.3       ?       ? 
1 1 1   27   15    9 o    499.7    2.4    0.0000   0.0000          ?        ?  2496.6196  24.2638          ?        ?      499.7        2.4       ?       ? 
1 1 1   27   15   10 o    784.4    3.3    0.0000   0.0000          ?        ?  6153.4331  52.3588          ?        ?      784.4        3.3       ?       ? 
1 1 1   27   15   11 o   1416.7    5.3    0.0000   0.0000          ?        ? 20072.5664 148.7755          ?        ?     1416.7        5.3       ?       ? 
1 1 1   27   15   12 o   1347.7    5.1    0.0000   0.0000          ?        ? 18165.3008 138.5592          ?        ?     1347.7        5.1       ?       ? 
1 1 1   27   15   13 o    340.0    2.5    0.0000   0.0000          ?        ?  1156.3627  17.2401          ?        ?      340.0        2.5       ?       ? 
1 1 1   27   15   14 o     90.0    6.7    0.0000   0.0000          ?        ?    81.0922  12.1319          ?        ?       90.0        6.7       ?       ? 
1 1 1   27   15   15 f    680.8    3.0    0.0000   0.0000          ?        ?  4635.0288  40.2269          ?        ?      680.8        3.0       ?       ? 
1 1 1   27   15   16 o    924.5    3.6    0.0000   0.0000          ?        ?  8547.8887  65.7677          ?        ?      924.5        3.6       ?       ? 
1 1 1   27   15   17 o    992.1    3.8    0.0000   0.0000          ?        ?  9844.0879  74.7070          ?        ?      992.1        3.8       ?       ? 
1 1 1   27   15   18 o    793.1    3.1    0.0000   0.0000          ?        ?  6290.0762  49.1662          ?        ?      793.1        3.1       ?       ? 
1 1 1   27   15   19 f    756.2    3.0    0.0000   0.0000          ?        ?  5719.2383  45.3350          ?        ?      756.2        3.0       ?       ? 
1 1 1   27   15   20 o    702.9    3.0    0.0000   0.0000          ?        ?  4941.5190  41.5039          ?        ?      702.9        3.0       ?       ? 
1 1 1   27   15   21 f    742.0    2.9    0.0000   0.0000          ?        ?  5506.6108  43.4195          ?        ?      742.0        2.9       ?       ? 
1 1 1   27   15   22 o    829.0    3.2    0.0000   0.0000          ?        ?  6873.6855  52.9973          ?        ?      829.0        3.2       ?       ? 
1 1 1   27   15   23 o    329.0    2.5    0.0000   0.0000          ?        ?  1082.2942  16.6016          ?        ?      329.0        2.5       ?       ? 
1 1 1   27   15   24 o    427.0    2.4    0.0000   0.0000          ?        ?  1823.6178  20.4327          ?        ?      427.0        2.4       ?       ? 
1 1 1   27   15   25 o    425.2    2.4    0.0000   0.0000          ?        ?  1808.2933  20.4327          ?        ?      425.2        2.4       ?       ? 
1 1 1   27   15   26 o    476.6    2.5    0.0000   0.0000          ?        ?  2271.2214  23.6253          ?        ?      476.6        2.5       ?       ? 
1 1 1   27   15   27 o    564.6    2.5    0.0000   0.0000          ?        ?  3187.5000  28.7335          ?        ?      564.6        2.5       ?       ? 
1 1 1   27   15   28 o    188.1    4.2    0.0000   0.0000          ?        ?   353.7410  15.9630          ?        ?      188.1        4.2       ?       ? 
1 1 1   27   15   29 o    715.4    3.0    0.0000   0.0000          ?        ?  5118.3892  42.7809          ?        ?      715.4        3.0       ?       ? 
1 1 1   27   15   30 o    148.8    5.6    0.0000   0.0000          ?        ?   221.5670  16.6016          ?        ?      148.8        5.6       ?       ? 
1 1 1   27   15   31 o    503.5    2.6    0.0000   0.0000          ?        ?  2535.5693  26.1794          ?        ?      503.5        2.6       ?       ? 
1 1 1   27   15   32 o     42.2   15.0    0.0000   0.0000          ?        ?    15.3245  15.9630          ?        ?       42.2       15.0       ?       ? 
1 1 1   27   15   33 o    386.7    2.6    0.0000   0.0000          ?        ?  1495.4176  20.4327          ?        ?      386.7        2.6       ?       ? 
1 1 1   27   15   34 o    119.8    6.7    0.0000   0.0000          ?        ?   143.6674  15.9630          ?        ?      119.8        6.7       ?       ? 
1 1 1   27   15   35 o    297.2    3.0    0.0000   0.0000          ?        ?   883.7139  17.8786          ?        ?      297.2        3.0       ?       ? 
1 1 1   27   15   36 o    303.7    2.8    0.0000   0.0000          ?        ?   922.6638  17.2401          ?        ?      303.7        2.8       ?       ? 
1 1 1   27   15   37 o    221.3    3.6    0.0000   0.0000          ?        ?   489.7461  15.9630          ?        ?      221.3        3.6       ?       ? 
1 1 1   27   15   38 o    241.5    3.4    0.0000   0.0000          ?        ?   583.6088  16.6016          ?        ?      241.5        3.4       ?       ? 
1 1 1   27   15   39 o    452.7    2.6    0.0000   0.0000          ?        ?  2049.6545  23.6253          ?        ?      452.7        2.6       ?       ? 
1 1 1   27   15   40 o    254.0    3.3    0.0000   0.0000          ?        ?   645.5453  16.6016          ?        ?      254.0        3.3       ?       ? 
1 1 1   27   15   41 o    361.8    2.7    0.0000   0.0000          ?        ?  1309.6079  19.7942          ?        ?      361.8        2.7       ?       ? 
1 1 1   27   15   42 o    249.3    3.3    0.0000   0.0000          ?        ?   621.9200  16.6016          ?        ?      249.3        3.3       ?       ? 
1 1 1   27   15   43 o    443.8    2.6    0.0000   0.0000          ?        ?  1969.8392  22.9868          ?        ?      443.8        2.6       ?       ? 
1 1 1   27   15   44 o    240.6    3.5    0.0000   0.0000          ?        ?   579.1391  16.6016          ?        ?      240.6        3.5       ?       ? 
1 1 1   27   15   45 o    376.3    2.7    0.0000   0.0000          ?        ?  1416.2410  20.4327          ?        ?      376.3        2.7       ?       ? 
1 1 1   27   15   46 o    191.5    4.5    0.0000   0.0000          ?        ?   367.1499  17.2401          ?        ?      191.5        4.5       ?       ? 
1 1 1   27   15   47 o    245.6    3.6    0.0000   0.0000          ?        ?   603.4030  17.8786          ?        ?      245.6        3.6       ?       ? 
1 1 1   27   15   48 o    202.5    4.3    0.0000   0.0000          ?        ?   410.5694  17.2401          ?        ?      202.5        4.3       ?       ? 
1 1 1   27   15   49 o    549.1    2.6    0.0000   0.0000          ?        ?  3016.3762  28.7335          ?        ?      549.1        2.6       ?       ? 
1 1 1   27   15   50 o    135.2    6.6    0.0000   0.0000          ?        ?   183.2557  17.8786          ?        ?      135.2        6.6       ?       ? 
1 1 1   27   15   51 o    308.9    3.2    0.0000   0.0000          ?        ?   954.5898  19.7942          ?        ?      308.9        3.2       ?       ? 
1 1 1   27   15   52 o    246.6    3.9    0.0000   0.0000          ?        ?   608.5111  19.1556          ?        ?      246.6        3.9       ?       ? 
1 1 1   27   15   53 o    335.6    3.0    0.0000   0.0000          ?        ?  1126.9907  20.4327          ?        ?      335.6        3.0       ?       ? 
1 1 1   27   15   54 o    191.5    4.7    0.0000   0.0000          ?        ?   367.1499  17.8786          ?        ?      191.5        4.7       ?       ? 
1 1 1   27   15   55 o    381.7    2.9    0.0000   0.0000          ?        ?  1457.7449  22.3483          ?        ?      381.7        2.9       ?       ? 
1 1 1   27   15   56 o    332.3    3.2    0.0000   0.0000          ?        ?  1105.2810  21.0712          ?        ?      332.3        3.2       ?       ? 
1 1 1   27   15   57 o    158.4    6.0    0.0000   0.0000          ?        ?   251.5775  19.1556          ?        ?      158.4        6.0       ?       ? 
1 1 1   27   15   58 o     78.2   12.2    0.0000   0.0000          ?        ?    61.9366  19.1556          ?        ?       78.2       12.2       ?       ? 
1 1 1   27   15   59 o    354.3    3.2    0.0000   0.0000          ?        ?  1256.6106  22.9868          ?        ?      354.3        3.2       ?       ? 
1 1 1   27   15   60 o     84.4   12.1    0.0000   0.0000          ?        ?    72.1529  20.4327          ?        ?       84.4       12.1       ?       ? 
1 1 1   27   15   61 o    336.7    3.5    0.0000   0.0000          ?        ?  1135.2915  23.6253          ?        ?      336.7        3.5       ?       ? 
1 1 1   27   15   62 o    197.2    5.5    0.0000   0.0000          ?        ?   390.1367  21.7097          ?        ?      197.2        5.5       ?       ? 
1 1 1   27   15   63 o    142.5    7.4    0.0000   0.0000          ?        ?   204.3269  21.0712          ?        ?      142.5        7.4       ?       ? 
1 1 1   27   15   64 o     85.3   12.0    0.0000   0.0000          ?        ?    74.0685  20.4327          ?        ?       85.3       12.0       ?       ? 
1 1 1   27   15   65 o     72.8   14.1    0.0000   0.0000          ?        ?    56.1899  19.7942          ?        ?       72.8       14.1       ?       ? 
1 1 1   27   15   66 o     23.3   11.5    0.0000   0.0000          ?        ?   -40.8654  19.1556          ?        ?       23.3       11.5       ?       ? 
1 1 1   27   15   67 o    182.1    5.4    0.0000   0.0000          ?        ?   333.3083  19.7942          ?        ?      182.1        5.4       ?       ? 
1 1 1   27   15   68 o    145.4    6.6    0.0000   0.0000          ?        ?   213.2662  19.1556          ?        ?      145.4        6.6       ?       ? 
1 1 1   27   16    0 o   1369.4    8.1 18758.4883 222.2055 18758.4883 222.2055 18758.4883 222.2055     1369.4      8.1     1369.4        8.1     0.0     0.0 
1 1 1   27   16    1 o    446.9    2.9    0.0000   0.0000          ?        ?  1997.2955  25.5409          ?        ?      446.9        2.9       ?       ? 
1 1 1   27   16    2 o   1233.5    5.1    0.0000   0.0000          ?        ? 15217.2471 126.4273          ?        ?     1233.5        5.1       ?       ? 
1 1 1   27   16    3 o    953.2    4.2    0.0000   0.0000          ?        ?  9086.1631  80.4537          ?        ?      953.2        4.2       ?       ? 
1 1 1   27   16    4 o    591.0    3.0    0.0000   0.0000          ?        ?  3493.3516  35.7572          ?        ?      591.0        3.0       ?       ? 
1 1 1   27   16    5 o    104.8    4.3    0.0000   0.0000          ?        ?   109.8257   8.9393          ?        ?      104.8        4.3       ?       ? 
1 1 1   27   16    6 o   1065.9    4.3    0.0000   0.0000          ?        ? 11362.4922  91.9471          ?        ?     1065.9        4.3       ?       ? 
1 1 1   27   16    7 o    229.7    2.8    0.0000   0.0000          ?        ?   527.4188  12.7704          ?        ?      229.7        2.8       ?       ? 
1 1 1   27   16    8 o   1479.2    5.7    0.0000   0.0000          ?        ? 21884.0527 168.5697          ?        ?     1479.2        5.7       ?       ? 
1 1 1   27   16    9 o   1079.8    4.1    0.0000   0.0000          ?        ? 11660.6816  88.7545          ?        ?     1079.8        4.1       ?       ? 
1 1 1   27   16   10 o    512.1    2.5    0.0000   0.0000          ?        ?  2622.4084  25.5409          ?        ?      512.1        2.5       ?       ? 
1 1 1   27   16   11 o    960.0    3.6    0.0000   0.0000          ?        ?  9217.6982  68.3218          ?        ?      960.0        3.6       ?       ? 
1 1 1   27   16   12 o    843.0    3.3    0.0000   0.0000          ?        ?  7106.7456  55.5514          ?        ?      843.0        3.3       ?       ? 
1 1 1   27   16   13 o    362.1    2.4    0.0000   0.0000          ?        ?  1311.5234  17.2401          ?        ?      362.1        2.4       ?       ? 
1 1 1   27   16   14 o    412.0    2.6    0.0000   0.0000          ?        ?  1697.8290  21.0712          ?        ?      412.0        2.6       ?       ? 
1 1 1   27   16   15 o   1446.9    5.3    0.0000   0.0000          ?        ? 20939.6777 151.9681          ?        ?     1446.9        5.3       ?       ? 
1 1 1   27   16   16 o   1346.9    5.0    0.0000   0.0000          ?        ? 18144.2305 136.0051          ?        ?     1346.9        5.0       ?       ? 
1 1 1   27   16   17 o    765.3    3.1    0.0000   0.0000          ?        ?  5857.1587  47.2506          ?        ?      765.3        3.1       ?       ? 
1 1 1   27   16   18 o    553.2    2.5    0.0000   0.0000          ?        ?  3060.4341  28.0950          ?        ?      553.2        2.5       ?       ? 
1 1 1   27   16   19 o    603.0    2.6    0.0000   0.0000          ?        ?  3636.3806  31.9261          ?        ?      603.0        2.6       ?       ? 
1 1 1   27   16   20 o    406.7    2.4    0.0000   0.0000          ?        ?  1653.7710  19.7942          ?        ?      406.7        2.4       ?       ? 
1 1 1   27   16   21 o    336.3    2.5    0.0000   0.0000          ?        ?  1130.8219  16.6016          ?        ?      336.3        2.5       ?       ? 
1 1 1   27   16   22 o    168.6    4.0    0.0000   0.0000          ?        ?   284.1421  13.4090          ?        ?      168.6        4.0       ?       ? 
1 1 1   27   16   23 o    245.4    3.1    0.0000   0.0000          ?        ?   602.1259  15.3245          ?        ?      245.4        3.1       ?       ? 
1 1 1   27   16   24 o   1021.7    3.7    0.0000   0.0000          ?        ? 10440.4668  74.7070          ?        ?     1021.7        3.7       ?       ? 
1 1 1   27   16   25 o    322.5    2.6    0.0000   0.0000          ?        ?  1040.1517  16.6016          ?        ?      322.5        2.6       ?       ? 
1 1 1   27   16   26 o    551.8    2.7    0.0000   0.0000          ?        ?  3045.1096  29.3720          ?        ?      551.8        2.7       ?       ? 
1 1 1   27   16   27 o    441.8    2.5    0.0000   0.0000          ?        ?  1951.9607  22.3483          ?        ?      441.8        2.5       ?       ? 
1 1 1   27   16   28 o    634.3    2.8    0.0000   0.0000          ?        ?  4023.9634  35.7572          ?        ?      634.3        2.8       ?       ? 
1 1 1   27   16   29 o    876.8    3.3    0.0000   0.0000          ?        ?  7689.0771  58.1055          ?        ?      876.8        3.3       ?       ? 
1 1 1   27   16   30 o     38.2   14.3    0.0000   0.0000          ?        ?    10.8549  14.6860          ?        ?       38.2       14.3       ?       ? 
1 1 1   27   16   31 f    386.1    2.7    0.0000   0.0000          ?        ?  1490.9480  21.0712          ?        ?      386.1        2.7       ?       ? 
1 1 1   27   16   32 o    632.6    2.8    0.0000   0.0000          ?        ?  4002.8923  35.1187          ?        ?      632.6        2.8       ?       ? 
1 1 1   27   16   33 o    348.3    2.6    0.0000   0.0000          ?        ?  1213.1910  17.8786          ?        ?      348.3        2.6       ?       ? 
1 1 1   27   16   34 o    252.0    3.2    0.0000   0.0000          ?        ?   635.3290  15.9630          ?        ?      252.0        3.2       ?       ? 
1 1 1   27   16   35 o    454.7    2.6    0.0000   0.0000          ?        ?  2068.1716  23.6253          ?        ?      454.7        2.6       ?       ? 
1 1 1   27   16   36 o    396.4    2.6    0.0000   0.0000          ?        ?  1571.4017  20.4327          ?        ?      396.4        2.6       ?       ? 
1 1 1   27   16   37 o    159.4    4.8    0.0000   0.0000          ?        ?   254.1316  15.3245          ?        ?      159.4        4.8       ?       ? 
1 1 1   27   16   38 o    480.6    2.5    0.0000   0.0000          ?        ?  2310.1711  23.6253          ?        ?      480.6        2.5       ?       ? 
1 1 1   27   16   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   16   40 o    379.1    2.6    0.0000   0.0000          ?        ?  1437.3123  19.7942          ?        ?      379.1        2.6       ?       ? 
1 1 1   27   16   41 o    223.4    3.6    0.0000   0.0000          ?        ?   499.3239  15.9630          ?        ?      223.4        3.6       ?       ? 
1 1 1   27   16   42 o    208.3    3.8    0.0000   0.0000          ?        ?   434.1947  15.9630          ?        ?      208.3        3.8       ?       ? 
1 1 1   27   16   43 o    223.1    3.9    0.0000   0.0000          ?        ?   498.0469  17.2401          ?        ?      223.1        3.9       ?       ? 
1 1 1   27   16   44 o    243.8    3.5    0.0000   0.0000          ?        ?   594.4636  17.2401          ?        ?      243.8        3.5       ?       ? 
1 1 1   27   16   45 o    179.8    4.6    0.0000   0.0000          ?        ?   323.7305  16.6016          ?        ?      179.8        4.6       ?       ? 
1 1 1   27   16   46 o    408.2    2.6    0.0000   0.0000          ?        ?  1666.5415  21.0712          ?        ?      408.2        2.6       ?       ? 
1 1 1   27   16   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   16   48 o    150.4    5.7    0.0000   0.0000          ?        ?   226.6752  17.2401          ?        ?      150.4        5.7       ?       ? 
1 1 1   27   16   49 o    370.5    2.8    0.0000   0.0000          ?        ?  1373.4601  20.4327          ?        ?      370.5        2.8       ?       ? 
1 1 1   27   16   50 o    292.5    3.2    0.0000   0.0000          ?        ?   856.2576  18.5171          ?        ?      292.5        3.2       ?       ? 
1 1 1   27   16   51 o    284.5    3.3    0.0000   0.0000          ?        ?   809.6454  18.5171          ?        ?      284.5        3.3       ?       ? 
1 1 1   27   16   52 o     26.0   12.2    0.0000   0.0000          ?        ?   -18.5171  16.6016          ?        ?       26.0       12.2       ?       ? 
1 1 1   27   16   53 f     30.9   13.9    0.0000   0.0000          ?        ?    -8.3008  17.8786          ?        ?       30.9       13.9       ?       ? 
1 1 1   27   16   54 o    162.2    5.7    0.0000   0.0000          ?        ?   263.7094  18.5171          ?        ?      162.2        5.7       ?       ? 
1 1 1   27   16   55 o    250.1    4.0    0.0000   0.0000          ?        ?   626.3897  19.7942          ?        ?      250.1        4.0       ?       ? 
1 1 1   27   16   56 o    319.1    3.4    0.0000   0.0000          ?        ?  1019.0806  21.7097          ?        ?      319.1        3.4       ?       ? 
1 1 1   27   16   57 o    177.6    5.4    0.0000   0.0000          ?        ?   316.0682  19.1556          ?        ?      177.6        5.4       ?       ? 
1 1 1   27   16   58 o    162.5    6.3    0.0000   0.0000          ?        ?   264.9865  20.4327          ?        ?      162.5        6.3       ?       ? 
1 1 1   27   16   59 o    372.4    3.3    0.0000   0.0000          ?        ?  1388.1460  24.2638          ?        ?      372.4        3.3       ?       ? 
1 1 1   27   16   60 o    115.1    8.9    0.0000   0.0000          ?        ?   133.4510  20.4327          ?        ?      115.1        8.9       ?       ? 
1 1 1   27   16   61 o    398.0    3.2    0.0000   0.0000          ?        ?  1585.4492  25.5409          ?        ?      398.0        3.2       ?       ? 
1 1 1   27   16   62 o    165.9    6.4    0.0000   0.0000          ?        ?   276.4799  21.0712          ?        ?      165.9        6.4       ?       ? 
1 1 1   27   16   63 o     32.1   14.6    0.0000   0.0000          ?        ?   -13.4090  21.0712          ?        ?       32.1       14.6       ?       ? 
1 1 1   27   16   64 o     77.0   13.8    0.0000   0.0000          ?        ?    62.5751  20.4327          ?        ?       77.0       13.8       ?       ? 
1 1 1   27   16   65 o    201.9    5.2    0.0000   0.0000          ?        ?   409.2924  21.0712          ?        ?      201.9        5.2       ?       ? 
1 1 1   27   16   66 o     94.0   10.5    0.0000   0.0000          ?        ?    90.0316  19.7942          ?        ?       94.0       10.5       ?       ? 
1 1 1   27   16   67 o     54.3   16.7    0.0000   0.0000          ?        ?    31.2876  19.7942          ?        ?       54.3       16.7       ?       ? 
1 1 1   27   16   68 o    132.0    7.5    0.0000   0.0000          ?        ?   176.2320  19.7942          ?        ?      132.0        7.5       ?       ? 
1 1 1   27   17    0 o   1286.1    7.7 16546.0117 197.3032 16546.0117 197.3032 16546.0117 197.3032     1286.1      7.7     1286.1        7.7     0.0     0.0 
1 1 1   27   17    1 o    965.0    4.0    0.0000   0.0000          ?        ?  9314.1143  77.8996          ?        ?      965.0        4.0       ?       ? 
1 1 1   27   17    2 o    820.9    3.9    0.0000   0.0000          ?        ?  6739.5957  63.2136          ?        ?      820.9        3.9       ?       ? 
1 1 1   27   17    3 o    695.0    3.4    0.0000   0.0000          ?        ?  4830.4160  47.2506          ?        ?      695.0        3.4       ?       ? 
1 1 1   27   17    4 o    303.7    2.6    0.0000   0.0000          ?        ?   922.6638  15.9630          ?        ?      303.7        2.6       ?       ? 
1 1 1   27   17    5 o    833.4    4.0    0.0000   0.0000          ?        ?  6945.8384  67.0448          ?        ?      833.4        4.0       ?       ? 
1 1 1   27   17    6 f    527.4    2.6    0.0000   0.0000          ?        ?  2781.4001  27.4564          ?        ?      527.4        2.6       ?       ? 
1 1 1   27   17    7 o    685.4    3.0    0.0000   0.0000          ?        ?  4697.6035  40.8654          ?        ?      685.4        3.0       ?       ? 
1 1 1   27   17    8 f    330.7    2.4    0.0000   0.0000          ?        ?  1093.7876  15.9630          ?        ?      330.7        2.4       ?       ? 
1 1 1   27   17    9 o    712.0    3.0    0.0000   0.0000          ?        ?  5069.2231  42.1424          ?        ?      712.0        3.0       ?       ? 
1 1 1   27   17   10 o    436.3    2.3    0.0000   0.0000          ?        ?  1903.4330  20.4327          ?        ?      436.3        2.3       ?       ? 
1 1 1   27   17   11 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   17   12 o   1065.4    3.8    0.0000   0.0000          ?        ? 11352.9141  81.0922          ?        ?     1065.4        3.8       ?       ? 
1 1 1   27   17   13 o    849.1    3.3    0.0000   0.0000          ?        ?  7210.1860  56.1899          ?        ?      849.1        3.3       ?       ? 
1 1 1   27   17   14 o    541.9    2.5    0.0000   0.0000          ?        ?  2936.5610  26.8179          ?        ?      541.9        2.5       ?       ? 
1 1 1   27   17   15 o    106.3    6.9    0.0000   0.0000          ?        ?   113.0183  14.6860          ?        ?      106.3        6.9       ?       ? 
1 1 1   27   17   16 o    632.9    2.8    0.0000   0.0000          ?        ?  4005.4460  35.7572          ?        ?      632.9        2.8       ?       ? 
1 1 1   27   17   17 o    578.1    2.6    0.0000   0.0000          ?        ?  3342.6606  30.0105          ?        ?      578.1        2.6       ?       ? 
1 1 1   27   17   18 o    673.7    2.9    0.0000   0.0000          ?        ?  4538.6118  38.9498          ?        ?      673.7        2.9       ?       ? 
1 1 1   27   17   19 o   1416.4    5.0    0.0000   0.0000          ?        ? 20067.4570 143.0288          ?        ?     1416.4        5.0       ?       ? 
1 1 1   27   17   20 o    888.3    3.3    0.0000   0.0000          ?        ?  7891.4888  58.7440          ?        ?      888.3        3.3       ?       ? 
1 1 1   27   17   21 o    546.9    2.6    0.0000   0.0000          ?        ?  2990.8352  28.0950          ?        ?      546.9        2.6       ?       ? 
1 1 1   27   17   22 o    573.4    2.5    0.0000   0.0000          ?        ?  3288.3865  28.7335          ?        ?      573.4        2.5       ?       ? 
1 1 1   27   17   23 o    832.2    3.1    0.0000   0.0000          ?        ?  6926.6831  51.7203          ?        ?      832.2        3.1       ?       ? 
1 1 1   27   17   24 o    180.1    3.9    0.0000   0.0000          ?        ?   324.3690  14.0475          ?        ?      180.1        3.9       ?       ? 
1 1 1   27   17   25 o     16.2    8.2    0.0000   0.0000          ?        ?   -43.4195  12.7704          ?        ?       16.2        8.2       ?       ? 
1 1 1   27   17   26 o    525.7    2.6    0.0000   0.0000          ?        ?  2764.1602  26.8179          ?        ?      525.7        2.6       ?       ? 
1 1 1   27   17   27 o    333.8    2.7    0.0000   0.0000          ?        ?  1114.2202  17.8786          ?        ?      333.8        2.7       ?       ? 
1 1 1   27   17   28 o    403.1    2.6    0.0000   0.0000          ?        ?  1625.0376  21.0712          ?        ?      403.1        2.6       ?       ? 
1 1 1   27   17   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   17   30 o    397.3    2.7    0.0000   0.0000          ?        ?  1579.0640  21.0712          ?        ?      397.3        2.7       ?       ? 
1 1 1   27   17   31 o    791.9    3.1    0.0000   0.0000          ?        ?  6272.1978  49.1662          ?        ?      791.9        3.1       ?       ? 
1 1 1   27   17   32 o    285.0    2.9    0.0000   0.0000          ?        ?   812.1995  16.6016          ?        ?      285.0        2.9       ?       ? 
1 1 1   27   17   33 f    332.2    2.7    0.0000   0.0000          ?        ?  1104.0039  17.8786          ?        ?      332.2        2.7       ?       ? 
1 1 1   27   17   34 o    374.9    2.6    0.0000   0.0000          ?        ?  1405.3861  19.1556          ?        ?      374.9        2.6       ?       ? 
1 1 1   27   17   35 o    291.4    3.0    0.0000   0.0000          ?        ?   849.2338  17.2401          ?        ?      291.4        3.0       ?       ? 
1 1 1   27   17   36 o    640.9    2.7    0.0000   0.0000          ?        ?  4108.8867  35.1187          ?        ?      640.9        2.7       ?       ? 
1 1 1   27   17   37 o    356.4    2.8    0.0000   0.0000          ?        ?  1270.6581  19.7942          ?        ?      356.4        2.8       ?       ? 
1 1 1   27   17   38 o     27.0   12.4    0.0000   0.0000          ?        ?   -11.4934  15.3245          ?        ?       27.0       12.4       ?       ? 
1 1 1   27   17   39 o    162.5    4.7    0.0000   0.0000          ?        ?   264.3480  15.3245          ?        ?      162.5        4.7       ?       ? 
1 1 1   27   17   40 o    237.8    3.4    0.0000   0.0000          ?        ?   565.7302  15.9630          ?        ?      237.8        3.4       ?       ? 
1 1 1   27   17   41 o    800.2    3.2    0.0000   0.0000          ?        ?  6405.6489  50.4432          ?        ?      800.2        3.2       ?       ? 
1 1 1   27   17   42 o    419.6    2.6    0.0000   0.0000          ?        ?  1761.0426  21.7097          ?        ?      419.6        2.6       ?       ? 
1 1 1   27   17   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   17   44 o    448.9    2.8    0.0000   0.0000          ?        ?  2015.8129  24.9023          ?        ?      448.9        2.8       ?       ? 
1 1 1   27   17   45 o    313.3    2.9    0.0000   0.0000          ?        ?   982.0463  17.8786          ?        ?      313.3        2.9       ?       ? 
1 1 1   27   17   46 o    392.3    2.7    0.0000   0.0000          ?        ?  1539.4757  21.0712          ?        ?      392.3        2.7       ?       ? 
1 1 1   27   17   47 o    223.9    3.7    0.0000   0.0000          ?        ?   501.8780  16.6016          ?        ?      223.9        3.7       ?       ? 
1 1 1   27   17   48 o    370.2    3.0    0.0000   0.0000          ?        ?  1370.9059  22.3483          ?        ?      370.2        3.0       ?       ? 
1 1 1   27   17   49 o    343.1    3.1    0.0000   0.0000          ?        ?  1178.0724  21.0712          ?        ?      343.1        3.1       ?       ? 
1 1 1   27   17   50 o    184.5    4.7    0.0000   0.0000          ?        ?   340.9706  17.2401          ?        ?      184.5        4.7       ?       ? 
1 1 1   27   17   51 o    116.7    7.7    0.0000   0.0000          ?        ?   136.6436  17.8786          ?        ?      116.7        7.7       ?       ? 
1 1 1   27   17   52 o     19.3    9.8    0.0000   0.0000          ?        ?   -63.8522  18.5171          ?        ?       19.3        9.8       ?       ? 
1 1 1   27   17   53 o    325.1    3.1    0.0000   0.0000          ?        ?  1057.3918  20.4327          ?        ?      325.1        3.1       ?       ? 
1 1 1   27   17   54 o    560.3    2.8    0.0000   0.0000          ?        ?  3141.5264  31.9261          ?        ?      560.3        2.8       ?       ? 
1 1 1   27   17   55 o     44.0   16.1    0.0000   0.0000          ?        ?    15.9630  18.5171          ?        ?       44.0       16.1       ?       ? 
1 1 1   27   17   56 o    212.7    4.5    0.0000   0.0000          ?        ?   453.3503  19.1556          ?        ?      212.7        4.5       ?       ? 
1 1 1   27   17   57 o    178.8    5.5    0.0000   0.0000          ?        ?   320.5379  19.7942          ?        ?      178.8        5.5       ?       ? 
1 1 1   27   17   58 o    405.3    2.9    0.0000   0.0000          ?        ?  1644.1932  23.6253          ?        ?      405.3        2.9       ?       ? 
1 1 1   27   17   59 o     84.4   11.7    0.0000   0.0000          ?        ?    72.1529  19.7942          ?        ?       84.4       11.7       ?       ? 
1 1 1   27   17   60 o     25.7   12.4    0.0000   0.0000          ?        ?   -29.3720  19.1556          ?        ?       25.7       12.4       ?       ? 
1 1 1   27   17   61 o    190.4    5.5    0.0000   0.0000          ?        ?   363.9573  21.0712          ?        ?      190.4        5.5       ?       ? 
1 1 1   27   17   62 o    116.6    9.0    0.0000   0.0000          ?        ?   137.2822  21.0712          ?        ?      116.6        9.0       ?       ? 
1 1 1   27   17   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   17   64 o    153.8    6.6    0.0000   0.0000          ?        ?   238.1686  20.4327          ?        ?      153.8        6.6       ?       ? 
1 1 1   27   17   65 o    289.9    3.9    0.0000   0.0000          ?        ?   842.2100  22.3483          ?        ?      289.9        3.9       ?       ? 
1 1 1   27   17   66 o     51.6   16.8    0.0000   0.0000          ?        ?    27.4564  19.7942          ?        ?       51.6       16.8       ?       ? 
1 1 1   27   17   67 o     75.8   12.6    0.0000   0.0000          ?        ?    59.3825  19.1556          ?        ?       75.8       12.6       ?       ? 
1 1 1   27   18    0 o    205.9    6.5  425.2554  26.8179   425.2554  26.8179   425.2554  26.8179      205.9      6.5      205.9        6.5     0.0     0.0 
1 1 1   27   18    1 o    233.4    3.1    0.0000   0.0000          ?        ?   544.6590  14.6860          ?        ?      233.4        3.1       ?       ? 
1 1 1   27   18    2 o   1196.7    4.8    0.0000   0.0000          ?        ? 14324.5938 115.5724          ?        ?     1196.7        4.8       ?       ? 
1 1 1   27   18    3 o    299.9    2.7    0.0000   0.0000          ?        ?   899.6769  15.9630          ?        ?      299.9        2.7       ?       ? 
1 1 1   27   18    4 o     71.9    8.4    0.0000   0.0000          ?        ?    51.7203  12.1319          ?        ?       71.9        8.4       ?       ? 
1 1 1   27   18    5 o   1234.1    5.0    0.0000   0.0000          ?        ? 15231.9336 123.2347          ?        ?     1234.1        5.0       ?       ? 
1 1 1   27   18    6 o    317.0    3.4    0.0000   0.0000          ?        ?  1005.0330  21.7097          ?        ?      317.0        3.4       ?       ? 
1 1 1   27   18    7 o    878.6    3.7    0.0000   0.0000          ?        ?  7720.3647  65.1292          ?        ?      878.6        3.7       ?       ? 
1 1 1   27   18    8 o   1077.6    4.2    0.0000   0.0000          ?        ? 11614.0703  90.0316          ?        ?     1077.6        4.2       ?       ? 
1 1 1   27   18    9 o    419.8    2.6    0.0000   0.0000          ?        ?  1762.3197  21.7097          ?        ?      419.8        2.6       ?       ? 
1 1 1   27   18   10 o    698.2    2.9    0.0000   0.0000          ?        ?  4875.7510  40.2269          ?        ?      698.2        2.9       ?       ? 
1 1 1   27   18   11 o    790.1    3.0    0.0000   0.0000          ?        ?  6242.8262  47.2506          ?        ?      790.1        3.0       ?       ? 
1 1 1   27   18   12 o    845.8    3.2    0.0000   0.0000          ?        ?  7154.6348  54.2743          ?        ?      845.8        3.2       ?       ? 
1 1 1   27   18   13 o    583.8    2.6    0.0000   0.0000          ?        ?  3408.4285  30.0105          ?        ?      583.8        2.6       ?       ? 
1 1 1   27   18   14 o    457.3    2.3    0.0000   0.0000          ?        ?  2091.1584  21.0712          ?        ?      457.3        2.3       ?       ? 
1 1 1   27   18   15 o    669.5    2.8    0.0000   0.0000          ?        ?  4483.0601  37.0343          ?        ?      669.5        2.8       ?       ? 
1 1 1   27   18   16 o    634.1    2.6    0.0000   0.0000          ?        ?  4020.7708  33.2031          ?        ?      634.1        2.6       ?       ? 
1 1 1   27   18   17 o    449.8    2.3    0.0000   0.0000          ?        ?  2023.4750  21.0712          ?        ?      449.8        2.3       ?       ? 
1 1 1   27   18   18 o    734.8    2.9    0.0000   0.0000          ?        ?  5399.3389  42.7809          ?        ?      734.8        2.9       ?       ? 
1 1 1   27   18   19 f    222.7    2.9    0.0000   0.0000          ?        ?   496.1313  12.7704          ?        ?      222.7        2.9       ?       ? 
1 1 1   27   18   20 o    309.5    2.7    0.0000   0.0000          ?        ?   957.7824  16.6016          ?        ?      309.5        2.7       ?       ? 
1 1 1   27   18   21 o    804.8    3.3    0.0000   0.0000          ?        ?  6477.8018  52.3588          ?        ?      804.8        3.3       ?       ? 
1 1 1   27   18   22 o   1184.1    4.2    0.0000   0.0000          ?        ? 14023.8506 100.2479          ?        ?     1184.1        4.2       ?       ? 
1 1 1   27   18   23 o    673.2    2.8    0.0000   0.0000          ?        ?  4532.2266  38.3113          ?        ?      673.2        2.8       ?       ? 
1 1 1   27   18   24 o    200.1    3.4    0.0000   0.0000          ?        ?   400.3531  13.4090          ?        ?      200.1        3.4       ?       ? 
1 1 1   27   18   25 o    131.3    4.9    0.0000   0.0000          ?        ?   172.4008  12.7704          ?        ?      131.3        4.9       ?       ? 
1 1 1   27   18   26 o    451.1    2.5    0.0000   0.0000          ?        ?  2034.9685  22.3483          ?        ?      451.1        2.5       ?       ? 
1 1 1   27   18   27 o    285.0    2.8    0.0000   0.0000          ?        ?   812.1995  15.9630          ?        ?      285.0        2.8       ?       ? 
1 1 1   27   18   28 o    176.0    4.0    0.0000   0.0000          ?        ?   309.6830  14.0475          ?        ?      176.0        4.0       ?       ? 
1 1 1   27   18   29 o    232.0    3.2    0.0000   0.0000          ?        ?   538.2737  14.6860          ?        ?      232.0        3.2       ?       ? 
1 1 1   27   18   30 o    528.6    2.7    0.0000   0.0000          ?        ?  2794.1707  28.0950          ?        ?      528.6        2.7       ?       ? 
1 1 1   27   18   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   18   32 o     51.9   13.4    0.0000   0.0000          ?        ?    28.0950  14.0475          ?        ?       51.9       13.4       ?       ? 
1 1 1   27   18   33 o    526.1    2.5    0.0000   0.0000          ?        ?  2767.9912  26.8179          ?        ?      526.1        2.5       ?       ? 
1 1 1   27   18   34 o    369.3    2.6    0.0000   0.0000          ?        ?  1363.8822  19.1556          ?        ?      369.3        2.6       ?       ? 
1 1 1   27   18   35 o    534.8    2.6    0.0000   0.0000          ?        ?  2860.5769  27.4564          ?        ?      534.8        2.6       ?       ? 
1 1 1   27   18   36 o    319.5    2.8    0.0000   0.0000          ?        ?  1020.9960  17.8786          ?        ?      319.5        2.8       ?       ? 
1 1 1   27   18   37 o    200.2    4.0    0.0000   0.0000          ?        ?   400.9916  15.9630          ?        ?      200.2        4.0       ?       ? 
1 1 1   27   18   38 o    366.4    2.6    0.0000   0.0000          ?        ?  1342.8110  19.1556          ?        ?      366.4        2.6       ?       ? 
1 1 1   27   18   39 o    110.4    6.7    0.0000   0.0000          ?        ?   121.9576  14.6860          ?        ?      110.4        6.7       ?       ? 
1 1 1   27   18   40 f    424.3    2.6    0.0000   0.0000          ?        ?  1800.6310  21.7097          ?        ?      424.3        2.6       ?       ? 
1 1 1   27   18   41 o    403.1    2.6    0.0000   0.0000          ?        ?  1625.6761  21.0712          ?        ?      403.1        2.6       ?       ? 
1 1 1   27   18   42 o    110.6    7.8    0.0000   0.0000          ?        ?   122.5962  17.2401          ?        ?      110.6        7.8       ?       ? 
1 1 1   27   18   43 o    474.0    2.6    0.0000   0.0000          ?        ?  2246.9575  24.2638          ?        ?      474.0        2.6       ?       ? 
1 1 1   27   18   44 o    109.7    7.3    0.0000   0.0000          ?        ?   120.6806  15.9630          ?        ?      109.7        7.3       ?       ? 
1 1 1   27   18   45 o    123.4    6.7    0.0000   0.0000          ?        ?   152.6067  16.6016          ?        ?      123.4        6.7       ?       ? 
1 1 1   27   18   46 o    123.9    6.4    0.0000   0.0000          ?        ?   153.8837  15.9630          ?        ?      123.9        6.4       ?       ? 
1 1 1   27   18   47 o    187.8    4.2    0.0000   0.0000          ?        ?   353.1024  15.9630          ?        ?      187.8        4.2       ?       ? 
1 1 1   27   18   48 o    149.8    5.5    0.0000   0.0000          ?        ?   224.7596  16.6016          ?        ?      149.8        5.5       ?       ? 
1 1 1   27   18   49 o    248.0    3.7    0.0000   0.0000          ?        ?   615.5349  18.5171          ?        ?      248.0        3.7       ?       ? 
1 1 1   27   18   50 o     96.3    8.9    0.0000   0.0000          ?        ?    93.2242  17.2401          ?        ?       96.3        8.9       ?       ? 
1 1 1   27   18   51 o    274.4    3.4    0.0000   0.0000          ?        ?   753.4555  18.5171          ?        ?      274.4        3.4       ?       ? 
1 1 1   27   18   52 o     78.0   11.1    0.0000   0.0000          ?        ?    61.2981  17.2401          ?        ?       78.0       11.1       ?       ? 
1 1 1   27   18   53 o    174.5    5.3    0.0000   0.0000          ?        ?   305.2133  18.5171          ?        ?      174.5        5.3       ?       ? 
1 1 1   27   18   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   18   55 o    112.1    8.5    0.0000   0.0000          ?        ?   126.4273  19.1556          ?        ?      112.1        8.5       ?       ? 
1 1 1   27   18   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   18   57 o    215.1    4.6    0.0000   0.0000          ?        ?   463.5667  19.7942          ?        ?      215.1        4.6       ?       ? 
1 1 1   27   18   58 o    284.6    3.6    0.0000   0.0000          ?        ?   810.9225  20.4327          ?        ?      284.6        3.6       ?       ? 
1 1 1   27   18   59 o    355.8    3.3    0.0000   0.0000          ?        ?  1267.4655  23.6253          ?        ?      355.8        3.3       ?       ? 
1 1 1   27   18   60 o    357.9    3.1    0.0000   0.0000          ?        ?  1282.1515  22.3483          ?        ?      357.9        3.1       ?       ? 
1 1 1   27   18   61 o     38.1   15.9    0.0000   0.0000          ?        ?     3.1926  20.4327          ?        ?       38.1       15.9       ?       ? 
1 1 1   27   18   62 o    161.8    6.3    0.0000   0.0000          ?        ?   263.0709  20.4327          ?        ?      161.8        6.3       ?       ? 
1 1 1   27   18   63 o    144.4    7.1    0.0000   0.0000          ?        ?   210.0736  20.4327          ?        ?      144.4        7.1       ?       ? 
1 1 1   27   18   64 o    161.9    6.1    0.0000   0.0000          ?        ?   263.7094  19.7942          ?        ?      161.9        6.1       ?       ? 
1 1 1   27   18   65 o     42.6   16.2    0.0000   0.0000          ?        ?    14.0475  19.1556          ?        ?       42.6       16.2       ?       ? 
1 1 1   27   18   66 o     67.5   14.6    0.0000   0.0000          ?        ?    49.1662  19.1556          ?        ?       67.5       14.6       ?       ? 
1 1 1   27   19    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   19    1 o    588.1    2.9    0.0000   0.0000          ?        ?  3458.8718  34.4802          ?        ?      588.1        2.9       ?       ? 
1 1 1   27   19    2 o    252.7    3.4    0.0000   0.0000          ?        ?   638.5216  17.2401          ?        ?      252.7        3.4       ?       ? 
1 1 1   27   19    3 o    334.3    2.4    0.0000   0.0000          ?        ?  1117.4128  15.9630          ?        ?      334.3        2.4       ?       ? 
1 1 1   27   19    4 o    571.0    3.0    0.0000   0.0000          ?        ?  3260.9299  34.4802          ?        ?      571.0        3.0       ?       ? 
1 1 1   27   19    5 o    304.6    2.8    0.0000   0.0000          ?        ?   927.7720  17.2401          ?        ?      304.6        2.8       ?       ? 
1 1 1   27   19    6 o    974.4    4.1    0.0000   0.0000          ?        ?  9495.4551  79.8152          ?        ?      974.4        4.1       ?       ? 
1 1 1   27   19    7 o    359.1    2.4    0.0000   0.0000          ?        ?  1289.8137  17.2401          ?        ?      359.1        2.4       ?       ? 
1 1 1   27   19    8 o   1208.5    4.7    0.0000   0.0000          ?        ? 14608.0977 114.2954          ?        ?     1208.5        4.7       ?       ? 
1 1 1   27   19    9 o    724.4    3.1    0.0000   0.0000          ?        ?  5248.6479  44.6965          ?        ?      724.4        3.1       ?       ? 
1 1 1   27   19   10 o    910.4    3.5    0.0000   0.0000          ?        ?  8288.6494  64.4907          ?        ?      910.4        3.5       ?       ? 
1 1 1   27   19   11 o    612.2    2.6    0.0000   0.0000          ?        ?  3748.1218  31.9261          ?        ?      612.2        2.6       ?       ? 
1 1 1   27   19   12 o    693.8    2.7    0.0000   0.0000          ?        ?  4813.8149  37.6728          ?        ?      693.8        2.7       ?       ? 
1 1 1   27   19   13 o    422.0    2.4    0.0000   0.0000          ?        ?  1780.8368  20.4327          ?        ?      422.0        2.4       ?       ? 
1 1 1   27   19   14 o    958.5    3.5    0.0000   0.0000          ?        ?  9188.9648  67.6833          ?        ?      958.5        3.5       ?       ? 
1 1 1   27   19   15 o    493.1    2.3    0.0000   0.0000          ?        ?  2431.4902  22.3483          ?        ?      493.1        2.3       ?       ? 
1 1 1   27   19   16 o    271.4    2.4    0.0000   0.0000          ?        ?   736.8539  12.7704          ?        ?      271.4        2.4       ?       ? 
1 1 1   27   19   17 o    514.0    2.4    0.0000   0.0000          ?        ?  2642.2024  24.9023          ?        ?      514.0        2.4       ?       ? 
1 1 1   27   19   18 o    859.2    3.3    0.0000   0.0000          ?        ?  7382.5869  56.1899          ?        ?      859.2        3.3       ?       ? 
1 1 1   27   19   19 o    765.8    3.0    0.0000   0.0000          ?        ?  5864.8213  46.6121          ?        ?      765.8        3.0       ?       ? 
1 1 1   27   19   20 o    350.2    2.5    0.0000   0.0000          ?        ?  1226.6001  17.2401          ?        ?      350.2        2.5       ?       ? 
1 1 1   27   19   21 o    883.7    3.3    0.0000   0.0000          ?        ?  7809.7578  57.4669          ?        ?      883.7        3.3       ?       ? 
1 1 1   27   19   22 o     23.6   10.9    0.0000   0.0000          ?        ?   -10.2163  12.1319          ?        ?       23.6       10.9       ?       ? 
1 1 1   27   19   23 o    407.4    2.6    0.0000   0.0000          ?        ?  1660.1562  21.0712          ?        ?      407.4        2.6       ?       ? 
1 1 1   27   19   24 o    362.5    2.6    0.0000   0.0000          ?        ?  1314.0775  18.5171          ?        ?      362.5        2.6       ?       ? 
1 1 1   27   19   25 o    831.8    3.3    0.0000   0.0000          ?        ?  6919.6587  54.9129          ?        ?      831.8        3.3       ?       ? 
1 1 1   27   19   26 o    330.7    2.5    0.0000   0.0000          ?        ?  1093.7876  16.6016          ?        ?      330.7        2.5       ?       ? 
1 1 1   27   19   27 o    151.8    4.6    0.0000   0.0000          ?        ?   230.5063  14.0475          ?        ?      151.8        4.6       ?       ? 
1 1 1   27   19   28 o    468.3    2.6    0.0000   0.0000          ?        ?  2193.3218  24.2638          ?        ?      468.3        2.6       ?       ? 
1 1 1   27   19   29 f    197.0    3.7    0.0000   0.0000          ?        ?   388.2211  14.6860          ?        ?      197.0        3.7       ?       ? 
1 1 1   27   19   30 o    754.1    3.1    0.0000   0.0000          ?        ?  5688.5894  46.6121          ?        ?      754.1        3.1       ?       ? 
1 1 1   27   19   31 o    672.9    2.8    0.0000   0.0000          ?        ?  4529.0337  38.3113          ?        ?      672.9        2.8       ?       ? 
1 1 1   27   19   32 o    191.6    3.8    0.0000   0.0000          ?        ?   367.1499  14.6860          ?        ?      191.6        3.8       ?       ? 
1 1 1   27   19   33 o    119.3    6.2    0.0000   0.0000          ?        ?   142.3903  14.6860          ?        ?      119.3        6.2       ?       ? 
1 1 1   27   19   34 o    428.1    2.5    0.0000   0.0000          ?        ?  1833.1957  21.0712          ?        ?      428.1        2.5       ?       ? 
1 1 1   27   19   35 o    519.4    2.6    0.0000   0.0000          ?        ?  2698.3923  26.8179          ?        ?      519.4        2.6       ?       ? 
1 1 1   27   19   36 o     79.8    9.6    0.0000   0.0000          ?        ?    63.8522  15.3245          ?        ?       79.8        9.6       ?       ? 
1 1 1   27   19   37 o    455.9    2.6    0.0000   0.0000          ?        ?  2079.0264  23.6253          ?        ?      455.9        2.6       ?       ? 
1 1 1   27   19   38 o    428.3    2.5    0.0000   0.0000          ?        ?  1834.4725  21.7097          ?        ?      428.3        2.5       ?       ? 
1 1 1   27   19   39 o    169.4    4.5    0.0000   0.0000          ?        ?   287.3347  15.3245          ?        ?      169.4        4.5       ?       ? 
1 1 1   27   19   40 o    154.0    5.0    0.0000   0.0000          ?        ?   237.5300  15.3245          ?        ?      154.0        5.0       ?       ? 
1 1 1   27   19   41 o    629.6    2.8    0.0000   0.0000          ?        ?  3965.2192  35.7572          ?        ?      629.6        2.8       ?       ? 
1 1 1   27   19   42 o    717.0    2.9    0.0000   0.0000          ?        ?  5143.2915  41.5039          ?        ?      717.0        2.9       ?       ? 
1 1 1   27   19   43 o    406.1    2.6    0.0000   0.0000          ?        ?  1649.9398  21.0712          ?        ?      406.1        2.6       ?       ? 
1 1 1   27   19   44 o    175.3    4.6    0.0000   0.0000          ?        ?   307.7674  15.9630          ?        ?      175.3        4.6       ?       ? 
1 1 1   27   19   45 o    143.9    5.3    0.0000   0.0000          ?        ?   207.5195  15.3245          ?        ?      143.9        5.3       ?       ? 
1 1 1   27   19   46 o    151.9    5.5    0.0000   0.0000          ?        ?   231.1448  16.6016          ?        ?      151.9        5.5       ?       ? 
1 1 1   27   19   47 o    118.9    7.0    0.0000   0.0000          ?        ?   141.7518  16.6016          ?        ?      118.9        7.0       ?       ? 
1 1 1   27   19   48 o    384.6    2.7    0.0000   0.0000          ?        ?  1479.4546  21.0712          ?        ?      384.6        2.7       ?       ? 
1 1 1   27   19   49 o    228.6    4.1    0.0000   0.0000          ?        ?   522.9492  18.5171          ?        ?      228.6        4.1       ?       ? 
1 1 1   27   19   50 o    145.4    5.9    0.0000   0.0000          ?        ?   211.9892  17.2401          ?        ?      145.4        5.9       ?       ? 
1 1 1   27   19   51 o    438.3    2.8    0.0000   0.0000          ?        ?  1921.9501  24.2638          ?        ?      438.3        2.8       ?       ? 
1 1 1   27   19   52 o    323.2    3.3    0.0000   0.0000          ?        ?  1045.2599  21.0712          ?        ?      323.2        3.3       ?       ? 
1 1 1   27   19   53 o    280.9    3.5    0.0000   0.0000          ?        ?   789.8513  19.7942          ?        ?      280.9        3.5       ?       ? 
1 1 1   27   19   54 o     55.7   15.5    0.0000   0.0000          ?        ?    32.5646  17.8786          ?        ?       55.7       15.5       ?       ? 
1 1 1   27   19   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   19   56 o    177.5    5.6    0.0000   0.0000          ?        ?   316.0682  19.7942          ?        ?      177.5        5.6       ?       ? 
1 1 1   27   19   57 o    469.7    2.8    0.0000   0.0000          ?        ?  2208.0078  26.1794          ?        ?      469.7        2.8       ?       ? 
1 1 1   27   19   58 o     41.1   16.1    0.0000   0.0000          ?        ?    10.8549  19.1556          ?        ?       41.1       16.1       ?       ? 
1 1 1   27   19   59 o     32.0   14.5    0.0000   0.0000          ?        ?   -10.2163  19.7942          ?        ?       32.0       14.5       ?       ? 
1 1 1   27   19   60 o     83.9   11.8    0.0000   0.0000          ?        ?    71.5144  19.7942          ?        ?       83.9       11.8       ?       ? 
1 1 1   27   19   61 o    278.4    3.7    0.0000   0.0000          ?        ?   776.4423  20.4327          ?        ?      278.4        3.7       ?       ? 
1 1 1   27   19   62 o     29.8   13.9    0.0000   0.0000          ?        ?   -18.5171  20.4327          ?        ?       29.8       13.9       ?       ? 
1 1 1   27   19   63 o     92.2   11.4    0.0000   0.0000          ?        ?    86.8389  21.0712          ?        ?       92.2       11.4       ?       ? 
1 1 1   27   19   64 o    253.9    4.1    0.0000   0.0000          ?        ?   646.8224  21.0712          ?        ?      253.9        4.1       ?       ? 
1 1 1   27   19   65 o     53.9   17.0    0.0000   0.0000          ?        ?    30.6490  20.4327          ?        ?       53.9       17.0       ?       ? 
1 1 1   27   19   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   20    0 o    199.8    4.6  399.7145  18.5171   399.7145  18.5171   399.7145  18.5171      199.8      4.6      199.8        4.6     0.0     0.0 
1 1 1   27   20    1 f    441.7    2.8    0.0000   0.0000          ?        ?  1951.3221  24.9023          ?        ?      441.7        2.8       ?       ? 
1 1 1   27   20    2 o   1200.4    4.9    0.0000   0.0000          ?        ? 14413.3486 118.1265          ?        ?     1200.4        4.9       ?       ? 
1 1 1   27   20    3 o    704.0    3.5    0.0000   0.0000          ?        ?  4956.8433  49.1662          ?        ?      704.0        3.5       ?       ? 
1 1 1   27   20    4 o    475.4    2.6    0.0000   0.0000          ?        ?  2260.3665  24.9023          ?        ?      475.4        2.6       ?       ? 
1 1 1   27   20    5 o    519.3    2.8    0.0000   0.0000          ?        ?  2697.1152  28.7335          ?        ?      519.3        2.8       ?       ? 
1 1 1   27   20    6 o   1148.1    4.8    0.0000   0.0000          ?        ? 13183.5557 109.1872          ?        ?     1148.1        4.8       ?       ? 
1 1 1   27   20    7 o    198.8    2.7    0.0000   0.0000          ?        ?   395.2449  10.8549          ?        ?      198.8        2.7       ?       ? 
1 1 1   27   20    8 o    467.8    2.5    0.0000   0.0000          ?        ?  2188.2136  23.6253          ?        ?      467.8        2.5       ?       ? 
1 1 1   27   20    9 o   1365.1    4.8    0.0000   0.0000          ?        ? 18639.7227 132.1740          ?        ?     1365.1        4.8       ?       ? 
1 1 1   27   20   10 o    420.3    2.5    0.0000   0.0000          ?        ?  1766.7894  21.0712          ?        ?      420.3        2.5       ?       ? 
1 1 1   27   20   11 o    355.6    2.2    0.0000   0.0000          ?        ?  1264.9114  15.3245          ?        ?      355.6        2.2       ?       ? 
1 1 1   27   20   12 f    815.3    3.1    0.0000   0.0000          ?        ?  6648.2866  50.4432          ?        ?      815.3        3.1       ?       ? 
1 1 1   27   20   13 o   1314.1    4.5    0.0000   0.0000          ?        ? 17272.6484 118.1265          ?        ?     1314.1        4.5       ?       ? 
1 1 1   27   20   14 o    322.2    2.5    0.0000   0.0000          ?        ?  1038.2362  15.9630          ?        ?      322.2        2.5       ?       ? 
1 1 1   27   20   15 o    440.7    2.2    0.0000   0.0000          ?        ?  1942.3828  19.7942          ?        ?      440.7        2.2       ?       ? 
1 1 1   27   20   16 o    304.1    2.3    0.0000   0.0000          ?        ?   924.5793  14.0475          ?        ?      304.1        2.3       ?       ? 
1 1 1   27   20   17 o    690.9    2.8    0.0000   0.0000          ?        ?  4773.5874  38.9498          ?        ?      690.9        2.8       ?       ? 
1 1 1   27   20   18 o    587.7    2.7    0.0000   0.0000          ?        ?  3453.7637  31.2876          ?        ?      587.7        2.7       ?       ? 
1 1 1   27   20   19 o   1086.8    3.8    0.0000   0.0000          ?        ? 11813.2881  83.0078          ?        ?     1086.8        3.8       ?       ? 
1 1 1   27   20   20 o    638.3    2.7    0.0000   0.0000          ?        ?  4075.0452  34.4802          ?        ?      638.3        2.7       ?       ? 
1 1 1   27   20   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   20   22 o    250.1    2.8    0.0000   0.0000          ?        ?   625.7512  14.0475          ?        ?      250.1        2.8       ?       ? 
1 1 1   27   20   23 o    223.6    3.0    0.0000   0.0000          ?        ?   499.9625  13.4090          ?        ?      223.6        3.0       ?       ? 
1 1 1   27   20   24 o    530.0    2.4    0.0000   0.0000          ?        ?  2808.8567  25.5409          ?        ?      530.0        2.4       ?       ? 
1 1 1   27   20   25 o    308.2    2.5    0.0000   0.0000          ?        ?   950.1202  15.3245          ?        ?      308.2        2.5       ?       ? 
1 1 1   27   20   26 o    382.5    2.5    0.0000   0.0000          ?        ?  1463.4916  19.1556          ?        ?      382.5        2.5       ?       ? 
1 1 1   27   20   27 o    403.6    2.4    0.0000   0.0000          ?        ?  1628.8687  19.1556          ?        ?      403.6        2.4       ?       ? 
1 1 1   27   20   28 o    321.6    2.7    0.0000   0.0000          ?        ?  1034.4050  17.2401          ?        ?      321.6        2.7       ?       ? 
1 1 1   27   20   29 o    284.1    2.9    0.0000   0.0000          ?        ?   807.0914  16.6016          ?        ?      284.1        2.9       ?       ? 
1 1 1   27   20   30 o    178.5    4.3    0.0000   0.0000          ?        ?   318.6223  15.3245          ?        ?      178.5        4.3       ?       ? 
1 1 1   27   20   31 o     58.0   13.0    0.0000   0.0000          ?        ?    35.1187  14.6860          ?        ?       58.0       13.0       ?       ? 
1 1 1   27   20   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   20   33 o    429.0    2.5    0.0000   0.0000          ?        ?  1840.8578  21.7097          ?        ?      429.0        2.5       ?       ? 
1 1 1   27   20   34 o    536.9    2.6    0.0000   0.0000          ?        ?  2882.9250  27.4564          ?        ?      536.9        2.6       ?       ? 
1 1 1   27   20   35 o    524.8    2.6    0.0000   0.0000          ?        ?  2755.2207  26.8179          ?        ?      524.8        2.6       ?       ? 
1 1 1   27   20   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   20   37 o    517.6    2.5    0.0000   0.0000          ?        ?  2679.8752  26.1794          ?        ?      517.6        2.5       ?       ? 
1 1 1   27   20   38 o    216.4    3.5    0.0000   0.0000          ?        ?   468.6749  15.3245          ?        ?      216.4        3.5       ?       ? 
1 1 1   27   20   39 o    291.5    3.0    0.0000   0.0000          ?        ?   849.8723  17.2401          ?        ?      291.5        3.0       ?       ? 
1 1 1   27   20   40 o    232.5    3.3    0.0000   0.0000          ?        ?   540.8278  15.3245          ?        ?      232.5        3.3       ?       ? 
1 1 1   27   20   41 o    314.6    2.8    0.0000   0.0000          ?        ?   990.3471  17.8786          ?        ?      314.6        2.8       ?       ? 
1 1 1   27   20   42 o    395.9    2.8    0.0000   0.0000          ?        ?  1568.2091  22.3483          ?        ?      395.9        2.8       ?       ? 
1 1 1   27   20   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   20   44 o     22.6   11.0    0.0000   0.0000          ?        ?   -28.7335  15.9630          ?        ?       22.6       11.0       ?       ? 
1 1 1   27   20   45 o    111.7    7.1    0.0000   0.0000          ?        ?   125.1502  15.9630          ?        ?      111.7        7.1       ?       ? 
1 1 1   27   20   46 o    230.5    3.6    0.0000   0.0000          ?        ?   531.8885  16.6016          ?        ?      230.5        3.6       ?       ? 
1 1 1   27   20   47 o     20.6   10.2    0.0000   0.0000          ?        ?   -42.1424  16.6016          ?        ?       20.6       10.2       ?       ? 
1 1 1   27   20   48 o    202.8    4.4    0.0000   0.0000          ?        ?   411.8464  17.8786          ?        ?      202.8        4.4       ?       ? 
1 1 1   27   20   49 o    314.0    3.1    0.0000   0.0000          ?        ?   986.5159  19.1556          ?        ?      314.0        3.1       ?       ? 
1 1 1   27   20   50 o     97.9    8.8    0.0000   0.0000          ?        ?    96.4168  17.2401          ?        ?       97.9        8.8       ?       ? 
1 1 1   27   20   51 o    444.6    2.8    0.0000   0.0000          ?        ?  1978.1399  24.9023          ?        ?      444.6        2.8       ?       ? 
1 1 1   27   20   52 o     31.5   14.1    0.0000   0.0000          ?        ?    -8.3008  18.5171          ?        ?       31.5       14.1       ?       ? 
1 1 1   27   20   53 f    120.4    7.4    0.0000   0.0000          ?        ?   145.5829  17.8786          ?        ?      120.4        7.4       ?       ? 
1 1 1   27   20   54 o     22.9   11.3    0.0000   0.0000          ?        ?   -36.3957  17.8786          ?        ?       22.9       11.3       ?       ? 
1 1 1   27   20   55 o    180.1    5.1    0.0000   0.0000          ?        ?   325.0075  18.5171          ?        ?      180.1        5.1       ?       ? 
1 1 1   27   20   56 o     78.6   11.8    0.0000   0.0000          ?        ?    62.5751  18.5171          ?        ?       78.6       11.8       ?       ? 
1 1 1   27   20   57 f    158.1    6.3    0.0000   0.0000          ?        ?   250.9390  19.7942          ?        ?      158.1        6.3       ?       ? 
1 1 1   27   20   58 o    210.5    4.9    0.0000   0.0000          ?        ?   444.4110  20.4327          ?        ?      210.5        4.9       ?       ? 
1 1 1   27   20   59 o    277.3    3.8    0.0000   0.0000          ?        ?   770.0571  21.0712          ?        ?      277.3        3.8       ?       ? 
1 1 1   27   20   60 o     32.8   14.8    0.0000   0.0000          ?        ?    -9.5778  20.4327          ?        ?       32.8       14.8       ?       ? 
1 1 1   27   20   61 o    324.3    3.5    0.0000   0.0000          ?        ?  1053.5607  22.9868          ?        ?      324.3        3.5       ?       ? 
1 1 1   27   20   62 o     54.1   16.7    0.0000   0.0000          ?        ?    30.6490  19.7942          ?        ?       54.1       16.7       ?       ? 
1 1 1   27   20   63 o    216.3    4.9    0.0000   0.0000          ?        ?   469.9519  21.0712          ?        ?      216.3        4.9       ?       ? 
1 1 1   27   20   64 o     37.1   15.8    0.0000   0.0000          ?        ?     1.9156  20.4327          ?        ?       37.1       15.8       ?       ? 
1 1 1   27   20   65 o     44.9   16.1    0.0000   0.0000          ?        ?    18.5171  18.5171          ?        ?       44.9       16.1       ?       ? 
1 1 1   27   21    0 o    420.5    4.9 1769.3435  41.5039  1769.3435  41.5039  1769.3435  41.5039      420.5      4.9      420.5        4.9     0.0     0.0 
1 1 1   27   21    1 o   1049.4    4.4    0.0000   0.0000          ?        ? 11013.8594  91.3086          ?        ?     1049.4        4.4       ?       ? 
1 1 1   27   21    2 f    998.8    4.4    0.0000   0.0000          ?        ?  9978.1768  88.7545          ?        ?      998.8        4.4       ?       ? 
1 1 1   27   21    3 o    955.0    4.0    0.0000   0.0000          ?        ?  9121.2812  76.6226          ?        ?      955.0        4.0       ?       ? 
1 1 1   27   21    4 o    790.1    3.3    0.0000   0.0000          ?        ?  6243.4644  52.3588          ?        ?      790.1        3.3       ?       ? 
1 1 1   27   21    5 o    426.7    2.5    0.0000   0.0000          ?        ?  1821.0637  21.0712          ?        ?      426.7        2.5       ?       ? 
1 1 1   27   21    6 o    300.1    2.4    0.0000   0.0000          ?        ?   900.9540  14.6860          ?        ?      300.1        2.4       ?       ? 
1 1 1   27   21    7 o    498.7    2.5    0.0000   0.0000          ?        ?  2487.0417  24.9023          ?        ?      498.7        2.5       ?       ? 
1 1 1   27   21    8 o    373.8    2.2    0.0000   0.0000          ?        ?  1397.0853  16.6016          ?        ?      373.8        2.2       ?       ? 
1 1 1   27   21    9 o    616.3    2.7    0.0000   0.0000          ?        ?  3799.2036  33.8416          ?        ?      616.3        2.7       ?       ? 
1 1 1   27   21   10 o    966.1    3.8    0.0000   0.0000          ?        ?  9335.8242  73.4300          ?        ?      966.1        3.8       ?       ? 
1 1 1   27   21   11 o    575.3    2.6    0.0000   0.0000          ?        ?  3310.0962  29.3720          ?        ?      575.3        2.6       ?       ? 
1 1 1   27   21   12 o    728.1    2.8    0.0000   0.0000          ?        ?  5302.2837  40.2269          ?        ?      728.1        2.8       ?       ? 
1 1 1   27   21   13 o    293.9    2.4    0.0000   0.0000          ?        ?   863.9198  14.0475          ?        ?      293.9        2.4       ?       ? 
1 1 1   27   21   14 o    945.7    3.6    0.0000   0.0000          ?        ?  8945.6875  68.9603          ?        ?      945.7        3.6       ?       ? 
1 1 1   27   21   15 o    332.3    2.3    0.0000   0.0000          ?        ?  1104.6425  15.3245          ?        ?      332.3        2.3       ?       ? 
1 1 1   27   21   16 o    523.8    2.4    0.0000   0.0000          ?        ?  2744.3660  25.5409          ?        ?      523.8        2.4       ?       ? 
1 1 1   27   21   17 o    402.5    2.3    0.0000   0.0000          ?        ?  1619.9293  18.5171          ?        ?      402.5        2.3       ?       ? 
1 1 1   27   21   18 o    276.1    2.5    0.0000   0.0000          ?        ?   762.3948  14.0475          ?        ?      276.1        2.5       ?       ? 
1 1 1   27   21   19 o    281.1    2.6    0.0000   0.0000          ?        ?   790.4898  14.6860          ?        ?      281.1        2.6       ?       ? 
1 1 1   27   21   20 o    732.4    2.9    0.0000   0.0000          ?        ?  5365.4971  42.7809          ?        ?      732.4        2.9       ?       ? 
1 1 1   27   21   21 o    533.4    2.5    0.0000   0.0000          ?        ?  2845.2524  26.8179          ?        ?      533.4        2.5       ?       ? 
1 1 1   27   21   22 o    369.6    2.5    0.0000   0.0000          ?        ?  1366.4363  18.5171          ?        ?      369.6        2.5       ?       ? 
1 1 1   27   21   23 o    356.3    2.4    0.0000   0.0000          ?        ?  1269.3810  17.2401          ?        ?      356.3        2.4       ?       ? 
1 1 1   27   21   24 o    428.6    2.4    0.0000   0.0000          ?        ?  1837.0269  20.4327          ?        ?      428.6        2.4       ?       ? 
1 1 1   27   21   25 o    468.0    2.4    0.0000   0.0000          ?        ?  2190.7678  22.3483          ?        ?      468.0        2.4       ?       ? 
1 1 1   27   21   26 o    125.8    5.1    0.0000   0.0000          ?        ?   158.3534  12.7704          ?        ?      125.8        5.1       ?       ? 
1 1 1   27   21   27 o    652.3    2.7    0.0000   0.0000          ?        ?  4256.3848  35.7572          ?        ?      652.3        2.7       ?       ? 
1 1 1   27   21   28 o    542.3    2.5    0.0000   0.0000          ?        ?  2941.0308  26.8179          ?        ?      542.3        2.5       ?       ? 
1 1 1   27   21   29 o    181.8    4.0    0.0000   0.0000          ?        ?   330.7542  14.6860          ?        ?      181.8        4.0       ?       ? 
1 1 1   27   21   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   21   31 o    392.3    2.7    0.0000   0.0000          ?        ?  1539.4757  21.0712          ?        ?      392.3        2.7       ?       ? 
1 1 1   27   21   32 o    577.3    2.7    0.0000   0.0000          ?        ?  3333.7212  31.2876          ?        ?      577.3        2.7       ?       ? 
1 1 1   27   21   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   21   34 o    483.7    2.7    0.0000   0.0000          ?        ?  2340.1816  26.1794          ?        ?      483.7        2.7       ?       ? 
1 1 1   27   21   35 o    813.8    3.2    0.0000   0.0000          ?        ?  6624.6621  52.3588          ?        ?      813.8        3.2       ?       ? 
1 1 1   27   21   36 o    185.6    4.6    0.0000   0.0000          ?        ?   344.8017  17.2401          ?        ?      185.6        4.6       ?       ? 
1 1 1   27   21   37 o    399.6    2.6    0.0000   0.0000          ?        ?  1597.5811  20.4327          ?        ?      399.6        2.6       ?       ? 
1 1 1   27   21   38 o    370.9    2.7    0.0000   0.0000          ?        ?  1376.0142  19.7942          ?        ?      370.9        2.7       ?       ? 
1 1 1   27   21   39 o    324.9    2.8    0.0000   0.0000          ?        ?  1056.1147  18.5171          ?        ?      324.9        2.8       ?       ? 
1 1 1   27   21   40 o    386.0    2.6    0.0000   0.0000          ?        ?  1490.3094  20.4327          ?        ?      386.0        2.6       ?       ? 
1 1 1   27   21   41 o    236.0    3.5    0.0000   0.0000          ?        ?   557.4294  16.6016          ?        ?      236.0        3.5       ?       ? 
1 1 1   27   21   42 o    190.0    4.2    0.0000   0.0000          ?        ?   361.4032  15.9630          ?        ?      190.0        4.2       ?       ? 
1 1 1   27   21   43 o     86.2    9.3    0.0000   0.0000          ?        ?    74.7070  15.9630          ?        ?       86.2        9.3       ?       ? 
1 1 1   27   21   44 o    122.9    6.5    0.0000   0.0000          ?        ?   151.3296  15.9630          ?        ?      122.9        6.5       ?       ? 
1 1 1   27   21   45 o    188.0    4.6    0.0000   0.0000          ?        ?   353.7410  17.2401          ?        ?      188.0        4.6       ?       ? 
1 1 1   27   21   46 o    211.5    4.1    0.0000   0.0000          ?        ?   447.6036  17.2401          ?        ?      211.5        4.1       ?       ? 
1 1 1   27   21   47 o     56.7   14.6    0.0000   0.0000          ?        ?    33.8416  16.6016          ?        ?       56.7       14.6       ?       ? 
1 1 1   27   21   48 o     38.0   15.1    0.0000   0.0000          ?        ?     7.6623  17.2401          ?        ?       38.0       15.1       ?       ? 
1 1 1   27   21   49 o    103.6    8.3    0.0000   0.0000          ?        ?   107.9102  17.2401          ?        ?      103.6        8.3       ?       ? 
1 1 1   27   21   50 o     95.6    9.4    0.0000   0.0000          ?        ?    91.9471  17.8786          ?        ?       95.6        9.4       ?       ? 
1 1 1   27   21   51 o    201.7    4.9    0.0000   0.0000          ?        ?   407.3768  19.7942          ?        ?      201.7        4.9       ?       ? 
1 1 1   27   21   52 o    270.6    3.5    0.0000   0.0000          ?        ?   733.0228  19.1556          ?        ?      270.6        3.5       ?       ? 
1 1 1   27   21   53 o     21.6   10.7    0.0000   0.0000          ?        ?   -43.4195  17.8786          ?        ?       21.6       10.7       ?       ? 
1 1 1   27   21   54 o    192.4    4.8    0.0000   0.0000          ?        ?   370.9810  18.5171          ?        ?      192.4        4.8       ?       ? 
1 1 1   27   21   55 o    368.8    3.0    0.0000   0.0000          ?        ?  1361.3281  22.3483          ?        ?      368.8        3.0       ?       ? 
1 1 1   27   21   56 f    120.8    7.7    0.0000   0.0000          ?        ?   146.8600  18.5171          ?        ?      120.8        7.7       ?       ? 
1 1 1   27   21   57 o    219.9    4.5    0.0000   0.0000          ?        ?   484.6379  19.7942          ?        ?      219.9        4.5       ?       ? 
1 1 1   27   21   58 o     49.4   16.8    0.0000   0.0000          ?        ?    23.6253  19.7942          ?        ?       49.4       16.8       ?       ? 
1 1 1   27   21   59 o     20.9   10.4    0.0000   0.0000          ?        ?   -51.7203  18.5171          ?        ?       20.9       10.4       ?       ? 
1 1 1   27   21   60 o    135.6    6.8    0.0000   0.0000          ?        ?   185.1713  18.5171          ?        ?      135.6        6.8       ?       ? 
1 1 1   27   21   61 o     35.6   15.3    0.0000   0.0000          ?        ?    -0.6385  19.7942          ?        ?       35.6       15.3       ?       ? 
1 1 1   27   21   62 f    157.1    6.1    0.0000   0.0000          ?        ?   248.3849  19.1556          ?        ?      157.1        6.1       ?       ? 
1 1 1   27   21   63 o     82.4   11.6    0.0000   0.0000          ?        ?    69.5989  19.1556          ?        ?       82.4       11.6       ?       ? 
1 1 1   27   21   64 o    116.3    8.5    0.0000   0.0000          ?        ?   137.2822  19.7942          ?        ?      116.3        8.5       ?       ? 
1 1 1   27   22    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   22    1 o    233.8    4.0    0.0000   0.0000          ?        ?   546.5745  18.5171          ?        ?      233.8        4.0       ?       ? 
1 1 1   27   22    2 o    792.1    3.9    0.0000   0.0000          ?        ?  6276.0293  61.2981          ?        ?      792.1        3.9       ?       ? 
1 1 1   27   22    3 o    419.2    2.9    0.0000   0.0000          ?        ?  1757.2115  24.2638          ?        ?      419.2        2.9       ?       ? 
1 1 1   27   22    4 o    548.1    3.0    0.0000   0.0000          ?        ?  3004.2441  32.5646          ?        ?      548.1        3.0       ?       ? 
1 1 1   27   22    5 o    615.6    3.2    0.0000   0.0000          ?        ?  3790.2642  39.5883          ?        ?      615.6        3.2       ?       ? 
1 1 1   27   22    6 o    169.1    4.3    0.0000   0.0000          ?        ?   286.0577  14.6860          ?        ?      169.1        4.3       ?       ? 
1 1 1   27   22    7 o    283.2    2.1    0.0000   0.0000          ?        ?   801.9832  12.1319          ?        ?      283.2        2.1       ?       ? 
1 1 1   27   22    8 o    549.5    2.4    0.0000   0.0000          ?        ?  3019.5688  26.8179          ?        ?      549.5        2.4       ?       ? 
1 1 1   27   22    9 o    321.6    2.2    0.0000   0.0000          ?        ?  1034.4050  14.0475          ?        ?      321.6        2.2       ?       ? 
1 1 1   27   22   10 o    560.9    2.7    0.0000   0.0000          ?        ?  3146.6345  30.0105          ?        ?      560.9        2.7       ?       ? 
1 1 1   27   22   11 o    120.4    4.2    0.0000   0.0000          ?        ?   144.9444  10.2163          ?        ?      120.4        4.2       ?       ? 
1 1 1   27   22   12 o    582.5    2.6    0.0000   0.0000          ?        ?  3393.1040  30.0105          ?        ?      582.5        2.6       ?       ? 
1 1 1   27   22   13 o    405.7    2.1    0.0000   0.0000          ?        ?  1646.1086  17.2401          ?        ?      405.7        2.1       ?       ? 
1 1 1   27   22   14 o    247.4    2.5    0.0000   0.0000          ?        ?   612.3422  12.1319          ?        ?      247.4        2.5       ?       ? 
1 1 1   27   22   15 o    330.9    2.2    0.0000   0.0000          ?        ?  1095.0646  14.6860          ?        ?      330.9        2.2       ?       ? 
1 1 1   27   22   16 o    288.7    2.3    0.0000   0.0000          ?        ?   833.2708  13.4090          ?        ?      288.7        2.3       ?       ? 
1 1 1   27   22   17 o    365.4    2.2    0.0000   0.0000          ?        ?  1335.1488  15.9630          ?        ?      365.4        2.2       ?       ? 
1 1 1   27   22   18 f    525.4    2.5    0.0000   0.0000          ?        ?  2760.9675  26.1794          ?        ?      525.4        2.5       ?       ? 
1 1 1   27   22   19 o    631.2    2.7    0.0000   0.0000          ?        ?  3984.3750  33.8416          ?        ?      631.2        2.7       ?       ? 
1 1 1   27   22   20 o    105.4    5.2    0.0000   0.0000          ?        ?   111.1028  10.8549          ?        ?      105.4        5.2       ?       ? 
1 1 1   27   22   21 o    308.6    2.5    0.0000   0.0000          ?        ?   952.6743  15.3245          ?        ?      308.6        2.5       ?       ? 
1 1 1   27   22   22 o    329.8    2.8    0.0000   0.0000          ?        ?  1088.0408  18.5171          ?        ?      329.8        2.8       ?       ? 
1 1 1   27   22   23 o    221.0    2.9    0.0000   0.0000          ?        ?   488.4691  12.7704          ?        ?      221.0        2.9       ?       ? 
1 1 1   27   22   24 o    113.5    5.3    0.0000   0.0000          ?        ?   128.9814  12.1319          ?        ?      113.5        5.3       ?       ? 
1 1 1   27   22   25 o    198.5    3.2    0.0000   0.0000          ?        ?   393.9678  12.7704          ?        ?      198.5        3.2       ?       ? 
1 1 1   27   22   26 o    171.3    3.9    0.0000   0.0000          ?        ?   293.7199  13.4090          ?        ?      171.3        3.9       ?       ? 
1 1 1   27   22   27 o    199.6    3.4    0.0000   0.0000          ?        ?   398.4375  13.4090          ?        ?      199.6        3.4       ?       ? 
1 1 1   27   22   28 o    388.2    2.4    0.0000   0.0000          ?        ?  1506.9110  18.5171          ?        ?      388.2        2.4       ?       ? 
1 1 1   27   22   29 o    263.5    2.9    0.0000   0.0000          ?        ?   694.7115  15.3245          ?        ?      263.5        2.9       ?       ? 
1 1 1   27   22   30 o    254.2    3.0    0.0000   0.0000          ?        ?   646.1838  15.3245          ?        ?      254.2        3.0       ?       ? 
1 1 1   27   22   31 o    167.2    4.2    0.0000   0.0000          ?        ?   279.6725  14.0475          ?        ?      167.2        4.2       ?       ? 
1 1 1   27   22   32 o    351.8    2.6    0.0000   0.0000          ?        ?  1238.0934  18.5171          ?        ?      351.8        2.6       ?       ? 
1 1 1   27   22   33 o    212.6    3.6    0.0000   0.0000          ?        ?   452.0733  15.3245          ?        ?      212.6        3.6       ?       ? 
1 1 1   27   22   34 o    295.0    2.8    0.0000   0.0000          ?        ?   870.3050  16.6016          ?        ?      295.0        2.8       ?       ? 
1 1 1   27   22   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   22   36 f    219.5    3.6    0.0000   0.0000          ?        ?   482.0838  15.9630          ?        ?      219.5        3.6       ?       ? 
1 1 1   27   22   37 o    167.7    4.9    0.0000   0.0000          ?        ?   281.5880  16.6016          ?        ?      167.7        4.9       ?       ? 
1 1 1   27   22   38 o    293.7    3.0    0.0000   0.0000          ?        ?   862.6428  17.8786          ?        ?      293.7        3.0       ?       ? 
1 1 1   27   22   39 o    193.0    4.0    0.0000   0.0000          ?        ?   372.8966  15.3245          ?        ?      193.0        4.0       ?       ? 
1 1 1   27   22   40 o    464.7    2.6    0.0000   0.0000          ?        ?  2160.1187  24.2638          ?        ?      464.7        2.6       ?       ? 
1 1 1   27   22   41 o    418.8    2.7    0.0000   0.0000          ?        ?  1754.6573  22.3483          ?        ?      418.8        2.7       ?       ? 
1 1 1   27   22   42 o    162.7    5.1    0.0000   0.0000          ?        ?   264.9865  16.6016          ?        ?      162.7        5.1       ?       ? 
1 1 1   27   22   43 o    337.4    2.8    0.0000   0.0000          ?        ?  1139.1226  19.1556          ?        ?      337.4        2.8       ?       ? 
1 1 1   27   22   44 o    127.5    6.3    0.0000   0.0000          ?        ?   162.8230  15.9630          ?        ?      127.5        6.3       ?       ? 
1 1 1   27   22   45 o    264.2    3.3    0.0000   0.0000          ?        ?   698.5427  17.2401          ?        ?      264.2        3.3       ?       ? 
1 1 1   27   22   46 o     43.3   15.3    0.0000   0.0000          ?        ?    16.6016  16.6016          ?        ?       43.3       15.3       ?       ? 
1 1 1   27   22   47 o    147.4    5.6    0.0000   0.0000          ?        ?   217.7359  16.6016          ?        ?      147.4        5.6       ?       ? 
1 1 1   27   22   48 o    300.4    3.2    0.0000   0.0000          ?        ?   902.8696  19.1556          ?        ?      300.4        3.2       ?       ? 
1 1 1   27   22   49 o    141.6    6.1    0.0000   0.0000          ?        ?   201.1343  17.2401          ?        ?      141.6        6.1       ?       ? 
1 1 1   27   22   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   22   51 o    286.2    3.3    0.0000   0.0000          ?        ?   819.8618  19.1556          ?        ?      286.2        3.3       ?       ? 
1 1 1   27   22   52 o    176.2    5.1    0.0000   0.0000          ?        ?   310.9600  17.8786          ?        ?      176.2        5.1       ?       ? 
1 1 1   27   22   53 o    220.4    4.2    0.0000   0.0000          ?        ?   486.5535  18.5171          ?        ?      220.4        4.2       ?       ? 
1 1 1   27   22   54 o    196.8    4.7    0.0000   0.0000          ?        ?   388.2211  18.5171          ?        ?      196.8        4.7       ?       ? 
1 1 1   27   22   55 o     28.8   13.5    0.0000   0.0000          ?        ?   -17.8786  19.1556          ?        ?       28.8       13.5       ?       ? 
1 1 1   27   22   56 o     23.5   11.6    0.0000   0.0000          ?        ?   -40.2269  19.1556          ?        ?       23.5       11.6       ?       ? 
1 1 1   27   22   57 o     20.4   10.3    0.0000   0.0000          ?        ?   -54.9129  18.5171          ?        ?       20.4       10.3       ?       ? 
1 1 1   27   22   58 o     22.0   11.0    0.0000   0.0000          ?        ?   -48.5276  19.1556          ?        ?       22.0       11.0       ?       ? 
1 1 1   27   22   59 o    162.6    5.9    0.0000   0.0000          ?        ?   265.6250  19.1556          ?        ?      162.6        5.9       ?       ? 
1 1 1   27   22   60 o    110.4    8.4    0.0000   0.0000          ?        ?   123.2347  18.5171          ?        ?      110.4        8.4       ?       ? 
1 1 1   27   22   61 o    102.2    9.4    0.0000   0.0000          ?        ?   105.9946  19.1556          ?        ?      102.2        9.4       ?       ? 
1 1 1   27   22   62 o     29.8   13.8    0.0000   0.0000          ?        ?   -15.9630  19.7942          ?        ?       29.8       13.8       ?       ? 
1 1 1   27   22   63 o    307.9    3.6    0.0000   0.0000          ?        ?   950.7587  22.3483          ?        ?      307.9        3.6       ?       ? 
1 1 1   27   23    0 o    581.3    4.6 3380.3337  52.9973  3380.3337  52.9973  3380.3337  52.9973      581.3      4.6      581.3        4.6     0.0     0.0 
1 1 1   27   23    1 o    939.3    4.2    0.0000   0.0000          ?        ?  8824.3691  79.8152          ?        ?      939.3        4.2       ?       ? 
1 1 1   27   23    2 o    751.3    3.7    0.0000   0.0000          ?        ?  5645.1694  55.5514          ?        ?      751.3        3.7       ?       ? 
1 1 1   27   23    3 o    364.9    3.4    0.0000   0.0000          ?        ?  1331.9562  24.9023          ?        ?      364.9        3.4       ?       ? 
1 1 1   27   23    4 o    953.1    4.2    0.0000   0.0000          ?        ?  9086.8008  79.1767          ?        ?      953.1        4.2       ?       ? 
1 1 1   27   23    5 o    835.9    3.6    0.0000   0.0000          ?        ?  6987.9810  60.6596          ?        ?      835.9        3.6       ?       ? 
1 1 1   27   23    6 o    486.1    2.8    0.0000   0.0000          ?        ?  2363.1685  27.4564          ?        ?      486.1        2.8       ?       ? 
1 1 1   27   23    7 o    263.2    3.4    0.0000   0.0000          ?        ?   692.7960  17.8786          ?        ?      263.2        3.4       ?       ? 
1 1 1   27   23    8 o    980.6    3.9    0.0000   0.0000          ?        ?  9618.0518  77.2611          ?        ?      980.6        3.9       ?       ? 
1 1 1   27   23    9 o    210.5    2.4    0.0000   0.0000          ?        ?   443.1340  10.2163          ?        ?      210.5        2.4       ?       ? 
1 1 1   27   23   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   23   11 o    246.0    2.5    0.0000   0.0000          ?        ?   605.3185  12.1319          ?        ?      246.0        2.5       ?       ? 
1 1 1   27   23   12 o    627.3    2.5    0.0000   0.0000          ?        ?  3935.8474  31.9261          ?        ?      627.3        2.5       ?       ? 
1 1 1   27   23   13 o    333.9    2.3    0.0000   0.0000          ?        ?  1114.8588  15.3245          ?        ?      333.9        2.3       ?       ? 
1 1 1   27   23   14 o    354.6    2.2    0.0000   0.0000          ?        ?  1257.2490  15.3245          ?        ?      354.6        2.2       ?       ? 
1 1 1   27   23   15 f    306.0    2.3    0.0000   0.0000          ?        ?   936.7112  14.0475          ?        ?      306.0        2.3       ?       ? 
1 1 1   27   23   16 o     27.5   11.4    0.0000   0.0000          ?        ?     1.9156  10.2163          ?        ?       27.5       11.4       ?       ? 
1 1 1   27   23   17 o    602.6    2.7    0.0000   0.0000          ?        ?  3631.2725  32.5646          ?        ?      602.6        2.7       ?       ? 
1 1 1   27   23   18 o    391.8    2.4    0.0000   0.0000          ?        ?  1535.0060  18.5171          ?        ?      391.8        2.4       ?       ? 
1 1 1   27   23   19 o    641.4    2.7    0.0000   0.0000          ?        ?  4113.9946  34.4802          ?        ?      641.4        2.7       ?       ? 
1 1 1   27   23   20 o    198.0    3.1    0.0000   0.0000          ?        ?   392.0523  12.1319          ?        ?      198.0        3.1       ?       ? 
1 1 1   27   23   21 o    244.4    2.7    0.0000   0.0000          ?        ?   597.6562  13.4090          ?        ?      244.4        2.7       ?       ? 
1 1 1   27   23   22 o    355.5    2.3    0.0000   0.0000          ?        ?  1263.6343  16.6016          ?        ?      355.5        2.3       ?       ? 
1 1 1   27   23   23 o    306.7    2.6    0.0000   0.0000          ?        ?   940.5424  15.9630          ?        ?      306.7        2.6       ?       ? 
1 1 1   27   23   24 o    404.4    2.4    0.0000   0.0000          ?        ?  1635.8925  19.7942          ?        ?      404.4        2.4       ?       ? 
1 1 1   27   23   25 o    584.9    2.6    0.0000   0.0000          ?        ?  3421.1987  30.6490          ?        ?      584.9        2.6       ?       ? 
1 1 1   27   23   26 o    202.0    3.5    0.0000   0.0000          ?        ?   408.0153  14.0475          ?        ?      202.0        3.5       ?       ? 
1 1 1   27   23   27 o    130.0    4.9    0.0000   0.0000          ?        ?   169.2082  12.7704          ?        ?      130.0        4.9       ?       ? 
1 1 1   27   23   28 o    634.1    2.7    0.0000   0.0000          ?        ?  4021.4092  33.8416          ?        ?      634.1        2.7       ?       ? 
1 1 1   27   23   29 o    132.5    5.1    0.0000   0.0000          ?        ?   175.5934  13.4090          ?        ?      132.5        5.1       ?       ? 
1 1 1   27   23   30 o    379.2    2.5    0.0000   0.0000          ?        ?  1438.5892  19.1556          ?        ?      379.2        2.5       ?       ? 
1 1 1   27   23   31 o    459.4    2.5    0.0000   0.0000          ?        ?  2110.9526  22.9868          ?        ?      459.4        2.5       ?       ? 
1 1 1   27   23   32 o     79.4    8.8    0.0000   0.0000          ?        ?    63.2136  14.0475          ?        ?       79.4        8.8       ?       ? 
1 1 1   27   23   33 o    208.6    3.5    0.0000   0.0000          ?        ?   435.4717  14.6860          ?        ?      208.6        3.5       ?       ? 
1 1 1   27   23   34 o    304.9    2.8    0.0000   0.0000          ?        ?   929.6875  17.2401          ?        ?      304.9        2.8       ?       ? 
1 1 1   27   23   35 o    456.2    2.7    0.0000   0.0000          ?        ?  2082.2190  24.2638          ?        ?      456.2        2.7       ?       ? 
1 1 1   27   23   36 o    329.3    2.7    0.0000   0.0000          ?        ?  1084.8481  17.8786          ?        ?      329.3        2.7       ?       ? 
1 1 1   27   23   37 o    355.8    2.8    0.0000   0.0000          ?        ?  1266.1884  19.7942          ?        ?      355.8        2.8       ?       ? 
1 1 1   27   23   38 o     80.9    9.5    0.0000   0.0000          ?        ?    65.7677  15.3245          ?        ?       80.9        9.5       ?       ? 
1 1 1   27   23   39 o    221.7    3.6    0.0000   0.0000          ?        ?   491.6617  15.9630          ?        ?      221.7        3.6       ?       ? 
1 1 1   27   23   40 o    151.1    5.1    0.0000   0.0000          ?        ?   228.5907  15.3245          ?        ?      151.1        5.1       ?       ? 
1 1 1   27   23   41 o    558.9    2.6    0.0000   0.0000          ?        ?  3124.9248  29.3720          ?        ?      558.9        2.6       ?       ? 
1 1 1   27   23   42 o    202.7    4.1    0.0000   0.0000          ?        ?   411.2079  16.6016          ?        ?      202.7        4.1       ?       ? 
1 1 1   27   23   43 o     24.4   11.7    0.0000   0.0000          ?        ?   -24.2638  16.6016          ?        ?       24.4       11.7       ?       ? 
1 1 1   27   23   44 o    253.6    3.5    0.0000   0.0000          ?        ?   643.6298  17.8786          ?        ?      253.6        3.5       ?       ? 
1 1 1   27   23   45 o    244.1    3.8    0.0000   0.0000          ?        ?   596.3792  18.5171          ?        ?      244.1        3.8       ?       ? 
1 1 1   27   23   46 o    252.2    3.7    0.0000   0.0000          ?        ?   636.6060  18.5171          ?        ?      252.2        3.7       ?       ? 
1 1 1   27   23   47 o    278.7    3.4    0.0000   0.0000          ?        ?   777.0808  19.1556          ?        ?      278.7        3.4       ?       ? 
1 1 1   27   23   48 o    407.7    2.9    0.0000   0.0000          ?        ?  1663.3489  23.6253          ?        ?      407.7        2.9       ?       ? 
1 1 1   27   23   49 o     31.4   14.0    0.0000   0.0000          ?        ?    -7.0237  17.8786          ?        ?       31.4       14.0       ?       ? 
1 1 1   27   23   50 o     33.3   14.5    0.0000   0.0000          ?        ?    -2.5541  17.8786          ?        ?       33.3       14.5       ?       ? 
1 1 1   27   23   51 o    337.5    3.2    0.0000   0.0000          ?        ?  1139.7611  21.7097          ?        ?      337.5        3.2       ?       ? 
1 1 1   27   23   52 o     62.1   15.5    0.0000   0.0000          ?        ?    40.8654  19.1556          ?        ?       62.1       15.5       ?       ? 
1 1 1   27   23   53 o     28.8   13.4    0.0000   0.0000          ?        ?   -15.9630  18.5171          ?        ?       28.8       13.4       ?       ? 
1 1 1   27   23   54 o     34.1   14.8    0.0000   0.0000          ?        ?    -1.9156  18.5171          ?        ?       34.1       14.8       ?       ? 
1 1 1   27   23   55 o    131.4    7.3    0.0000   0.0000          ?        ?   173.6779  19.1556          ?        ?      131.4        7.3       ?       ? 
1 1 1   27   23   56 o    115.6    8.0    0.0000   0.0000          ?        ?   134.7281  18.5171          ?        ?      115.6        8.0       ?       ? 
1 1 1   27   23   57 o    303.2    3.5    0.0000   0.0000          ?        ?   920.7482  21.0712          ?        ?      303.2        3.5       ?       ? 
1 1 1   27   23   58 o     28.9   13.4    0.0000   0.0000          ?        ?   -15.3245  18.5171          ?        ?       28.9       13.4       ?       ? 
1 1 1   27   23   59 o     51.2   16.5    0.0000   0.0000          ?        ?    26.8179  19.1556          ?        ?       51.2       16.5       ?       ? 
1 1 1   27   23   60 o    163.9    5.8    0.0000   0.0000          ?        ?   270.0946  19.1556          ?        ?      163.9        5.8       ?       ? 
1 1 1   27   23   61 o     60.0   15.4    0.0000   0.0000          ?        ?    38.9498  18.5171          ?        ?       60.0       15.4       ?       ? 
1 1 1   27   23   62 o    244.2    4.2    0.0000   0.0000          ?        ?   598.2947  20.4327          ?        ?      244.2        4.2       ?       ? 
1 1 1   27   24    0 o     87.9   13.9   81.7308  22.9868    81.7308  22.9868    81.7308  22.9868       87.9     13.9       87.9       13.9     0.0     0.0 
1 1 1   27   24    1 o    434.2    3.2    0.0000   0.0000          ?        ?  1885.5543  28.0950          ?        ?      434.2        3.2       ?       ? 
1 1 1   27   24    2 o    281.8    3.9    0.0000   0.0000          ?        ?   794.3209  21.7097          ?        ?      281.8        3.9       ?       ? 
1 1 1   27   24    3 o    382.2    3.3    0.0000   0.0000          ?        ?  1460.9375  25.5409          ?        ?      382.2        3.3       ?       ? 
1 1 1   27   24    4 o    697.0    3.8    0.0000   0.0000          ?        ?  4859.7881  52.9973          ?        ?      697.0        3.8       ?       ? 
1 1 1   27   24    5 o    433.0    2.9    0.0000   0.0000          ?        ?  1875.3381  25.5409          ?        ?      433.0        2.9       ?       ? 
1 1 1   27   24    6 o     88.9    6.5    0.0000   0.0000          ?        ?    79.1767  11.4934          ?        ?       88.9        6.5       ?       ? 
1 1 1   27   24    7 o    316.5    2.9    0.0000   0.0000          ?        ?  1001.8404  18.5171          ?        ?      316.5        2.9       ?       ? 
1 1 1   27   24    8 o    384.4    2.5    0.0000   0.0000          ?        ?  1478.1776  19.1556          ?        ?      384.4        2.5       ?       ? 
1 1 1   27   24    9 o    494.0    2.8    0.0000   0.0000          ?        ?  2441.0681  28.0950          ?        ?      494.0        2.8       ?       ? 
1 1 1   27   24   10 o    207.3    2.6    0.0000   0.0000          ?        ?   429.7251  10.8549          ?        ?      207.3        2.6       ?       ? 
1 1 1   27   24   11 o    913.0    3.5    0.0000   0.0000          ?        ?  8337.1768  63.8522          ?        ?      913.0        3.5       ?       ? 
1 1 1   27   24   12 o    390.1    2.4    0.0000   0.0000          ?        ?  1521.5970  18.5171          ?        ?      390.1        2.4       ?       ? 
1 1 1   27   24   13 o   1050.7    3.8    0.0000   0.0000          ?        ? 11042.5928  80.4537          ?        ?     1050.7        3.8       ?       ? 
1 1 1   27   24   14 o    659.6    2.7    0.0000   0.0000          ?        ?  4351.5249  35.7572          ?        ?      659.6        2.7       ?       ? 
1 1 1   27   24   15 o    207.9    2.5    0.0000   0.0000          ?        ?   432.2791  10.2163          ?        ?      207.9        2.5       ?       ? 
1 1 1   27   24   16 o    687.2    2.7    0.0000   0.0000          ?        ?  4723.1445  37.6728          ?        ?      687.2        2.7       ?       ? 
1 1 1   27   24   17 o    246.4    3.0    0.0000   0.0000          ?        ?   607.2341  14.6860          ?        ?      246.4        3.0       ?       ? 
1 1 1   27   24   18 o    124.5    4.4    0.0000   0.0000          ?        ?   155.1608  10.8549          ?        ?      124.5        4.4       ?       ? 
1 1 1   27   24   19 o    352.2    2.4    0.0000   0.0000          ?        ?  1240.6476  16.6016          ?        ?      352.2        2.4       ?       ? 
1 1 1   27   24   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   24   21 o    421.3    2.3    0.0000   0.0000          ?        ?  1775.0901  19.7942          ?        ?      421.3        2.3       ?       ? 
1 1 1   27   24   22 f    391.5    2.2    0.0000   0.0000          ?        ?  1533.0905  17.2401          ?        ?      391.5        2.2       ?       ? 
1 1 1   27   24   23 o     95.2    6.0    0.0000   0.0000          ?        ?    90.6701  11.4934          ?        ?       95.2        6.0       ?       ? 
1 1 1   27   24   24 o    134.4    4.5    0.0000   0.0000          ?        ?   180.7016  12.1319          ?        ?      134.4        4.5       ?       ? 
1 1 1   27   24   25 o    295.4    2.5    0.0000   0.0000          ?        ?   872.8591  14.6860          ?        ?      295.4        2.5       ?       ? 
1 1 1   27   24   26 o    251.1    2.9    0.0000   0.0000          ?        ?   630.8594  14.6860          ?        ?      251.1        2.9       ?       ? 
1 1 1   27   24   27 o    309.9    2.7    0.0000   0.0000          ?        ?   960.3365  16.6016          ?        ?      309.9        2.7       ?       ? 
1 1 1   27   24   28 o    416.8    2.5    0.0000   0.0000          ?        ?  1737.4174  20.4327          ?        ?      416.8        2.5       ?       ? 
1 1 1   27   24   29 o     81.4    7.8    0.0000   0.0000          ?        ?    66.4062  12.7704          ?        ?       81.4        7.8       ?       ? 
1 1 1   27   24   30 o     90.7    7.4    0.0000   0.0000          ?        ?    82.3693  13.4090          ?        ?       90.7        7.4       ?       ? 
1 1 1   27   24   31 o    394.6    2.5    0.0000   0.0000          ?        ?  1557.3542  19.7942          ?        ?      394.6        2.5       ?       ? 
1 1 1   27   24   32 o    229.6    3.3    0.0000   0.0000          ?        ?   527.4188  15.3245          ?        ?      229.6        3.3       ?       ? 
1 1 1   27   24   33 o     33.5   13.3    0.0000   0.0000          ?        ?     5.7467  13.4090          ?        ?       33.5       13.3       ?       ? 
1 1 1   27   24   34 o    200.8    3.7    0.0000   0.0000          ?        ?   403.5457  14.6860          ?        ?      200.8        3.7       ?       ? 
1 1 1   27   24   35 o    151.7    5.3    0.0000   0.0000          ?        ?   230.5063  15.9630          ?        ?      151.7        5.3       ?       ? 
1 1 1   27   24   36 o    203.2    3.8    0.0000   0.0000          ?        ?   413.1235  15.3245          ?        ?      203.2        3.8       ?       ? 
1 1 1   27   24   37 o     65.1   12.2    0.0000   0.0000          ?        ?    44.0580  15.3245          ?        ?       65.1       12.2       ?       ? 
1 1 1   27   24   38 o    411.8    2.6    0.0000   0.0000          ?        ?  1696.5520  21.0712          ?        ?      411.8        2.6       ?       ? 
1 1 1   27   24   39 o    219.2    3.6    0.0000   0.0000          ?        ?   480.8068  15.9630          ?        ?      219.2        3.6       ?       ? 
1 1 1   27   24   40 o     97.4    8.2    0.0000   0.0000          ?        ?    95.1397  15.9630          ?        ?       97.4        8.2       ?       ? 
1 1 1   27   24   41 o     55.1   14.3    0.0000   0.0000          ?        ?    31.9261  15.9630          ?        ?       55.1       14.3       ?       ? 
1 1 1   27   24   42 o    268.3    3.3    0.0000   0.0000          ?        ?   720.2524  17.8786          ?        ?      268.3        3.3       ?       ? 
1 1 1   27   24   43 o    419.0    2.7    0.0000   0.0000          ?        ?  1756.5730  22.9868          ?        ?      419.0        2.7       ?       ? 
1 1 1   27   24   44 o    135.0    6.4    0.0000   0.0000          ?        ?   182.6172  17.2401          ?        ?      135.0        6.4       ?       ? 
1 1 1   27   24   45 o     81.2   11.0    0.0000   0.0000          ?        ?    66.4062  17.8786          ?        ?       81.2       11.0       ?       ? 
1 1 1   27   24   46 o    531.5    2.8    0.0000   0.0000          ?        ?  2826.7354  29.3720          ?        ?      531.5        2.8       ?       ? 
1 1 1   27   24   47 o    175.6    5.1    0.0000   0.0000          ?        ?   309.0445  17.8786          ?        ?      175.6        5.1       ?       ? 
1 1 1   27   24   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   24   49 o    326.6    3.0    0.0000   0.0000          ?        ?  1067.6082  19.7942          ?        ?      326.6        3.0       ?       ? 
1 1 1   27   24   50 o    287.0    3.6    0.0000   0.0000          ?        ?   824.3315  20.4327          ?        ?      287.0        3.6       ?       ? 
1 1 1   27   24   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   24   52 o    301.7    3.5    0.0000   0.0000          ?        ?   911.1703  21.0712          ?        ?      301.7        3.5       ?       ? 
1 1 1   27   24   53 o    297.4    3.5    0.0000   0.0000          ?        ?   885.6295  21.0712          ?        ?      297.4        3.5       ?       ? 
1 1 1   27   24   54 o    207.7    4.8    0.0000   0.0000          ?        ?   432.2791  19.7942          ?        ?      207.7        4.8       ?       ? 
1 1 1   27   24   55 o     69.1   13.9    0.0000   0.0000          ?        ?    50.4432  18.5171          ?        ?       69.1       13.9       ?       ? 
1 1 1   27   24   56 o     88.0   10.5    0.0000   0.0000          ?        ?    78.5382  18.5171          ?        ?       88.0       10.5       ?       ? 
1 1 1   27   24   57 o    121.2    7.9    0.0000   0.0000          ?        ?   148.1370  19.1556          ?        ?      121.2        7.9       ?       ? 
1 1 1   27   24   58 o    146.9    6.3    0.0000   0.0000          ?        ?   217.0974  18.5171          ?        ?      146.9        6.3       ?       ? 
1 1 1   27   24   59 o     32.8   14.5    0.0000   0.0000          ?        ?    -4.4697  18.5171          ?        ?       32.8       14.5       ?       ? 
1 1 1   27   24   60 o    198.8    5.1    0.0000   0.0000          ?        ?   397.1605  20.4327          ?        ?      198.8        5.1       ?       ? 
1 1 1   27   24   61 o    184.0    5.2    0.0000   0.0000          ?        ?   340.3320  19.1556          ?        ?      184.0        5.2       ?       ? 
1 1 1   27   25    0 o    465.7    5.3 2170.3350  49.8047  2170.3350  49.8047  2170.3350  49.8047      465.7      5.3      465.7        5.3     0.0     0.0 
1 1 1   27   25    1 o    883.0    4.3    0.0000   0.0000          ?        ?  7799.5415  76.6226          ?        ?      883.0        4.3       ?       ? 
1 1 1   27   25    2 o    861.1    4.4    0.0000   0.0000          ?        ?  7418.3447  75.3456          ?        ?      861.1        4.4       ?       ? 
1 1 1   27   25    3 o   1330.8    5.9    0.0000   0.0000          ?        ? 17721.5293 157.0763          ?        ?     1330.8        5.9       ?       ? 
1 1 1   27   25    4 o    479.9    3.8    0.0000   0.0000          ?        ?  2303.7859  36.3957          ?        ?      479.9        3.8       ?       ? 
1 1 1   27   25    5 o    547.3    3.4    0.0000   0.0000          ?        ?  2996.5820  37.6728          ?        ?      547.3        3.4       ?       ? 
1 1 1   27   25    6 o    866.7    4.0    0.0000   0.0000          ?        ?  7513.4839  69.5989          ?        ?      866.7        4.0       ?       ? 
1 1 1   27   25    7 o    640.4    3.3    0.0000   0.0000          ?        ?  4101.8633  42.1424          ?        ?      640.4        3.3       ?       ? 
1 1 1   27   25    8 o    530.8    2.7    0.0000   0.0000          ?        ?  2818.4343  28.7335          ?        ?      530.8        2.7       ?       ? 
1 1 1   27   25    9 o    753.5    3.4    0.0000   0.0000          ?        ?  5678.3726  51.7203          ?        ?      753.5        3.4       ?       ? 
1 1 1   27   25   10 o    240.6    2.8    0.0000   0.0000          ?        ?   579.1391  13.4090          ?        ?      240.6        2.8       ?       ? 
1 1 1   27   25   11 o    347.0    2.2    0.0000   0.0000          ?        ?  1204.2518  15.3245          ?        ?      347.0        2.2       ?       ? 
1 1 1   27   25   12 o    151.4    3.2    0.0000   0.0000          ?        ?   229.2293   9.5778          ?        ?      151.4        3.2       ?       ? 
1 1 1   27   25   13 o    172.3    2.6    0.0000   0.0000          ?        ?   296.9126   8.9393          ?        ?      172.3        2.6       ?       ? 
1 1 1   27   25   14 o     72.8    5.7    0.0000   0.0000          ?        ?    52.9973   8.3008          ?        ?       72.8        5.7       ?       ? 
1 1 1   27   25   15 o    547.8    2.4    0.0000   0.0000          ?        ?  3001.0518  26.8179          ?        ?      547.8        2.4       ?       ? 
1 1 1   27   25   16 o    448.4    2.4    0.0000   0.0000          ?        ?  2010.7046  21.7097          ?        ?      448.4        2.4       ?       ? 
1 1 1   27   25   17 o    665.8    2.8    0.0000   0.0000          ?        ?  4433.2554  37.0343          ?        ?      665.8        2.8       ?       ? 
1 1 1   27   25   18 o    220.6    2.6    0.0000   0.0000          ?        ?   486.5535  11.4934          ?        ?      220.6        2.6       ?       ? 
1 1 1   27   25   19 o    753.2    3.0    0.0000   0.0000          ?        ?  5674.5420  45.3350          ?        ?      753.2        3.0       ?       ? 
1 1 1   27   25   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   25   21 o    189.2    3.4    0.0000   0.0000          ?        ?   358.2106  12.7704          ?        ?      189.2        3.4       ?       ? 
1 1 1   27   25   22 o     16.3    8.2    0.0000   0.0000          ?        ?   -37.6728  12.1319          ?        ?       16.3        8.2       ?       ? 
1 1 1   27   25   23 o    170.0    3.6    0.0000   0.0000          ?        ?   289.2503  12.1319          ?        ?      170.0        3.6       ?       ? 
1 1 1   27   25   24 o     21.9   10.4    0.0000   0.0000          ?        ?   -14.6860  12.1319          ?        ?       21.9       10.4       ?       ? 
1 1 1   27   25   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   25   26 o     32.5   13.0    0.0000   0.0000          ?        ?     5.1082  12.7704          ?        ?       32.5       13.0       ?       ? 
1 1 1   27   25   27 o    258.5    2.8    0.0000   0.0000          ?        ?   668.5321  14.6860          ?        ?      258.5        2.8       ?       ? 
1 1 1   27   25   28 o    448.6    2.6    0.0000   0.0000          ?        ?  2013.2587  22.9868          ?        ?      448.6        2.6       ?       ? 
1 1 1   27   25   29 o    292.6    2.7    0.0000   0.0000          ?        ?   856.2576  15.9630          ?        ?      292.6        2.7       ?       ? 
1 1 1   27   25   30 o    536.6    2.7    0.0000   0.0000          ?        ?  2880.3711  28.7335          ?        ?      536.6        2.7       ?       ? 
1 1 1   27   25   31 o    213.3    3.3    0.0000   0.0000          ?        ?   455.2659  14.0475          ?        ?      213.3        3.3       ?       ? 
1 1 1   27   25   32 o    473.6    2.6    0.0000   0.0000          ?        ?  2243.1265  24.9023          ?        ?      473.6        2.6       ?       ? 
1 1 1   27   25   33 o    311.3    2.9    0.0000   0.0000          ?        ?   969.2759  17.8786          ?        ?      311.3        2.9       ?       ? 
1 1 1   27   25   34 o    396.7    2.7    0.0000   0.0000          ?        ?  1573.9558  21.0712          ?        ?      396.7        2.7       ?       ? 
1 1 1   27   25   35 o    121.6    6.6    0.0000   0.0000          ?        ?   148.1370  15.9630          ?        ?      121.6        6.6       ?       ? 
1 1 1   27   25   36 f    346.4    2.8    0.0000   0.0000          ?        ?  1200.4207  19.1556          ?        ?      346.4        2.8       ?       ? 
1 1 1   27   25   37 o    125.7    6.3    0.0000   0.0000          ?        ?   158.3534  15.9630          ?        ?      125.7        6.3       ?       ? 
1 1 1   27   25   38 o     17.2    8.7    0.0000   0.0000          ?        ?   -50.4432  14.6860          ?        ?       17.2        8.7       ?       ? 
1 1 1   27   25   39 o     83.2   10.4    0.0000   0.0000          ?        ?    69.5989  17.2401          ?        ?       83.2       10.4       ?       ? 
1 1 1   27   25   40 o    319.9    2.9    0.0000   0.0000          ?        ?  1023.5502  18.5171          ?        ?      319.9        2.9       ?       ? 
1 1 1   27   25   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   25   42 o    140.8    5.9    0.0000   0.0000          ?        ?   198.5802  16.6016          ?        ?      140.8        5.9       ?       ? 
1 1 1   27   25   43 f    351.2    2.8    0.0000   0.0000          ?        ?  1234.2623  19.7942          ?        ?      351.2        2.8       ?       ? 
1 1 1   27   25   44 f    302.6    3.2    0.0000   0.0000          ?        ?   916.2786  19.1556          ?        ?      302.6        3.2       ?       ? 
1 1 1   27   25   45 o    155.0    5.6    0.0000   0.0000          ?        ?   240.7227  17.2401          ?        ?      155.0        5.6       ?       ? 
1 1 1   27   25   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   25   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   25   48 o    205.4    4.4    0.0000   0.0000          ?        ?   422.7013  17.8786          ?        ?      205.4        4.4       ?       ? 
1 1 1   27   25   49 o     83.8   10.7    0.0000   0.0000          ?        ?    70.8759  17.8786          ?        ?       83.8       10.7       ?       ? 
1 1 1   27   25   50 o    113.8    7.6    0.0000   0.0000          ?        ?   130.2584  17.2401          ?        ?      113.8        7.6       ?       ? 
1 1 1   27   25   51 o    305.8    3.3    0.0000   0.0000          ?        ?   936.0728  20.4327          ?        ?      305.8        3.3       ?       ? 
1 1 1   27   25   52 o     92.3   10.4    0.0000   0.0000          ?        ?    86.2004  19.1556          ?        ?       92.3       10.4       ?       ? 
1 1 1   27   25   53 o    166.7    5.7    0.0000   0.0000          ?        ?   279.0340  19.1556          ?        ?      166.7        5.7       ?       ? 
1 1 1   27   25   54 o    237.7    4.2    0.0000   0.0000          ?        ?   566.3687  19.7942          ?        ?      237.7        4.2       ?       ? 
1 1 1   27   25   55 o    293.9    3.5    0.0000   0.0000          ?        ?   865.1968  20.4327          ?        ?      293.9        3.5       ?       ? 
1 1 1   27   25   56 o     61.8   15.1    0.0000   0.0000          ?        ?    40.8654  18.5171          ?        ?       61.8       15.1       ?       ? 
1 1 1   27   25   57 o    141.6    6.5    0.0000   0.0000          ?        ?   201.7728  18.5171          ?        ?      141.6        6.5       ?       ? 
1 1 1   27   25   58 o     23.2   11.4    0.0000   0.0000          ?        ?   -37.6728  18.5171          ?        ?       23.2       11.4       ?       ? 
1 1 1   27   25   59 o    108.3    8.3    0.0000   0.0000          ?        ?   118.7650  17.8786          ?        ?      108.3        8.3       ?       ? 
1 1 1   27   25   60 o     35.2   15.0    0.0000   0.0000          ?        ?     1.2770  18.5171          ?        ?       35.2       15.0       ?       ? 
1 1 1   27   26    0 o    307.9    6.3  949.4816  38.9498   949.4816  38.9498   949.4816  38.9498      307.9      6.3      307.9        6.3     0.0     0.0 
1 1 1   27   26    1 o    816.7    4.2    0.0000   0.0000          ?        ?  6673.1895  68.9603          ?        ?      816.7        4.2       ?       ? 
1 1 1   27   26    2 o    230.3    4.2    0.0000   0.0000          ?        ?   530.6115  19.1556          ?        ?      230.3        4.2       ?       ? 
1 1 1   27   26    3 o    224.7    4.7    0.0000   0.0000          ?        ?   505.0706  21.0712          ?        ?      224.7        4.7       ?       ? 
1 1 1   27   26    4 o    235.1    4.5    0.0000   0.0000          ?        ?   552.9597  21.0712          ?        ?      235.1        4.5       ?       ? 
1 1 1   27   26    5 f    191.2    5.0    0.0000   0.0000          ?        ?   365.8729  19.1556          ?        ?      191.2        5.0       ?       ? 
1 1 1   27   26    6 o    614.0    3.5    0.0000   0.0000          ?        ?  3771.1086  42.7809          ?        ?      614.0        3.5       ?       ? 
1 1 1   27   26    7 o    706.0    3.5    0.0000   0.0000          ?        ?  4986.2153  49.8047          ?        ?      706.0        3.5       ?       ? 
1 1 1   27   26    8 o    407.8    2.4    0.0000   0.0000          ?        ?  1663.3489  19.7942          ?        ?      407.8        2.4       ?       ? 
1 1 1   27   26    9 f     43.1   12.1    0.0000   0.0000          ?        ?    19.1556  10.8549          ?        ?       43.1       12.1       ?       ? 
1 1 1   27   26   10 f    423.8    2.5    0.0000   0.0000          ?        ?  1796.1613  21.0712          ?        ?      423.8        2.5       ?       ? 
1 1 1   27   26   11 o    341.9    2.4    0.0000   0.0000          ?        ?  1169.1332  16.6016          ?        ?      341.9        2.4       ?       ? 
1 1 1   27   26   12 o    568.5    2.5    0.0000   0.0000          ?        ?  3232.1965  28.7335          ?        ?      568.5        2.5       ?       ? 
1 1 1   27   26   13 o    296.8    1.9    0.0000   0.0000          ?        ?   881.1599  11.4934          ?        ?      296.8        1.9       ?       ? 
1 1 1   27   26   14 o    221.7    2.2    0.0000   0.0000          ?        ?   491.6617   9.5778          ?        ?      221.7        2.2       ?       ? 
1 1 1   27   26   15 o    397.3    2.2    0.0000   0.0000          ?        ?  1579.0640  17.2401          ?        ?      397.3        2.2       ?       ? 
1 1 1   27   26   16 o    371.5    2.3    0.0000   0.0000          ?        ?  1380.4838  17.2401          ?        ?      371.5        2.3       ?       ? 
1 1 1   27   26   17 o    633.8    2.6    0.0000   0.0000          ?        ?  4018.2166  33.2031          ?        ?      633.8        2.6       ?       ? 
1 1 1   27   26   18 o    404.8    2.3    0.0000   0.0000          ?        ?  1639.0851  18.5171          ?        ?      404.8        2.3       ?       ? 
1 1 1   27   26   19 o    555.9    2.5    0.0000   0.0000          ?        ?  3091.0833  28.0950          ?        ?      555.9        2.5       ?       ? 
1 1 1   27   26   20 f    497.8    2.4    0.0000   0.0000          ?        ?  2478.7410  24.2638          ?        ?      497.8        2.4       ?       ? 
1 1 1   27   26   21 o    545.8    2.5    0.0000   0.0000          ?        ?  2979.9805  26.8179          ?        ?      545.8        2.5       ?       ? 
1 1 1   27   26   22 o    223.3    2.9    0.0000   0.0000          ?        ?   498.6854  12.7704          ?        ?      223.3        2.9       ?       ? 
1 1 1   27   26   23 o    639.0    2.6    0.0000   0.0000          ?        ?  4083.9841  33.8416          ?        ?      639.0        2.6       ?       ? 
1 1 1   27   26   24 o    463.6    2.3    0.0000   0.0000          ?        ?  2149.2639  21.7097          ?        ?      463.6        2.3       ?       ? 
1 1 1   27   26   25 o    218.9    3.2    0.0000   0.0000          ?        ?   479.5297  14.0475          ?        ?      218.9        3.2       ?       ? 
1 1 1   27   26   26 o    183.9    3.6    0.0000   0.0000          ?        ?   338.4165  13.4090          ?        ?      183.9        3.6       ?       ? 
1 1 1   27   26   27 f    354.8    2.5    0.0000   0.0000          ?        ?  1259.1647  17.8786          ?        ?      354.8        2.5       ?       ? 
1 1 1   27   26   28 o    370.2    2.5    0.0000   0.0000          ?        ?  1370.9059  18.5171          ?        ?      370.2        2.5       ?       ? 
1 1 1   27   26   29 f    190.9    3.7    0.0000   0.0000          ?        ?   364.5958  14.0475          ?        ?      190.9        3.7       ?       ? 
1 1 1   27   26   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   26   31 o    219.5    3.2    0.0000   0.0000          ?        ?   482.0838  14.0475          ?        ?      219.5        3.2       ?       ? 
1 1 1   27   26   32 o    446.7    2.6    0.0000   0.0000          ?        ?  1996.0187  23.6253          ?        ?      446.7        2.6       ?       ? 
1 1 1   27   26   33 o    281.7    2.8    0.0000   0.0000          ?        ?   793.6824  15.9630          ?        ?      281.7        2.8       ?       ? 
1 1 1   27   26   34 o    503.6    2.5    0.0000   0.0000          ?        ?  2536.8464  25.5409          ?        ?      503.6        2.5       ?       ? 
1 1 1   27   26   35 o    500.7    2.6    0.0000   0.0000          ?        ?  2507.4746  26.1794          ?        ?      500.7        2.6       ?       ? 
1 1 1   27   26   36 o    594.5    2.7    0.0000   0.0000          ?        ?  3535.4944  31.9261          ?        ?      594.5        2.7       ?       ? 
1 1 1   27   26   37 o    193.0    4.1    0.0000   0.0000          ?        ?   372.8966  15.9630          ?        ?      193.0        4.1       ?       ? 
1 1 1   27   26   38 o    271.3    3.2    0.0000   0.0000          ?        ?   736.2155  17.2401          ?        ?      271.3        3.2       ?       ? 
1 1 1   27   26   39 o    444.1    2.6    0.0000   0.0000          ?        ?  1973.0319  22.9868          ?        ?      444.1        2.6       ?       ? 
1 1 1   27   26   40 o    327.9    2.8    0.0000   0.0000          ?        ?  1075.9089  18.5171          ?        ?      327.9        2.8       ?       ? 
1 1 1   27   26   41 o    241.2    3.6    0.0000   0.0000          ?        ?   582.3317  17.2401          ?        ?      241.2        3.6       ?       ? 
1 1 1   27   26   42 o    383.6    2.7    0.0000   0.0000          ?        ?  1472.4309  21.0712          ?        ?      383.6        2.7       ?       ? 
1 1 1   27   26   43 o    285.3    3.2    0.0000   0.0000          ?        ?   814.7536  18.5171          ?        ?      285.3        3.2       ?       ? 
1 1 1   27   26   44 o    251.0    3.7    0.0000   0.0000          ?        ?   630.8594  18.5171          ?        ?      251.0        3.7       ?       ? 
1 1 1   27   26   45 o    322.4    3.1    0.0000   0.0000          ?        ?  1040.1517  19.7942          ?        ?      322.4        3.1       ?       ? 
1 1 1   27   26   46 o    118.8    7.3    0.0000   0.0000          ?        ?   141.7518  17.2401          ?        ?      118.8        7.3       ?       ? 
1 1 1   27   26   47 o    191.5    4.5    0.0000   0.0000          ?        ?   367.1499  17.2401          ?        ?      191.5        4.5       ?       ? 
1 1 1   27   26   48 o     24.2   11.7    0.0000   0.0000          ?        ?   -30.6490  17.8786          ?        ?       24.2       11.7       ?       ? 
1 1 1   27   26   49 f     74.0   12.1    0.0000   0.0000          ?        ?    55.5514  17.8786          ?        ?       74.0       12.1       ?       ? 
1 1 1   27   26   50 o    278.0    3.4    0.0000   0.0000          ?        ?   773.8882  19.1556          ?        ?      278.0        3.4       ?       ? 
1 1 1   27   26   51 o    178.4    5.2    0.0000   0.0000          ?        ?   319.2608  18.5171          ?        ?      178.4        5.2       ?       ? 
1 1 1   27   26   52 o    147.3    5.9    0.0000   0.0000          ?        ?   217.7359  17.2401          ?        ?      147.3        5.9       ?       ? 
1 1 1   27   26   53 o    438.6    2.8    0.0000   0.0000          ?        ?  1925.7812  24.9023          ?        ?      438.6        2.8       ?       ? 
1 1 1   27   26   54 o    176.6    5.2    0.0000   0.0000          ?        ?   312.8756  18.5171          ?        ?      176.6        5.2       ?       ? 
1 1 1   27   26   55 o    154.1    6.2    0.0000   0.0000          ?        ?   238.8071  19.1556          ?        ?      154.1        6.2       ?       ? 
1 1 1   27   26   56 o     29.9   13.7    0.0000   0.0000          ?        ?   -12.1319  18.5171          ?        ?       29.9       13.7       ?       ? 
1 1 1   27   26   57 o    121.4    7.6    0.0000   0.0000          ?        ?   148.7755  18.5171          ?        ?      121.4        7.6       ?       ? 
1 1 1   27   26   58 o     40.6   15.6    0.0000   0.0000          ?        ?    12.1319  17.8786          ?        ?       40.6       15.6       ?       ? 
1 1 1   27   26   59 o     31.3   14.0    0.0000   0.0000          ?        ?    -6.3852  17.8786          ?        ?       31.3       14.0       ?       ? 
1 1 1   27   27    0 f    193.6   11.1  378.6433  42.7809   378.6433  42.7809   378.6433  42.7809      193.6     11.1      193.6       11.1     0.0     0.0 
1 1 1   27   27    1 o    163.8    8.6  270.7332  28.0950   270.7332  28.0950   270.7332  28.0950      163.8      8.6      163.8        8.6     0.0     0.0 
1 1 1   27   27    2 o    235.1    6.8  554.2368  31.9261   554.2368  31.9261   554.2368  31.9261      235.1      6.8      235.1        6.8     0.0     0.0 
1 1 1   27   27    3 o    539.1    5.0 2908.4661  54.2743  2908.4661  54.2743  2908.4661  54.2743      539.1      5.0      539.1        5.0     0.0     0.0 
1 1 1   27   27    4 o    193.0    7.1  374.1737  27.4564   374.1737  27.4564   374.1737  27.4564      193.0      7.1      193.0        7.1     0.0     0.0 
1 1 1   27   27    5 o     57.2   23.4   45.9736  26.1794    45.9736  26.1794    45.9736  26.1794       57.2     23.4       57.2       23.4     0.0     0.0 
1 1 1   27   27    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   27    7 o    188.2    7.8  356.2951  29.3720   356.2951  29.3720   356.2951  29.3720      188.2      7.8      188.2        7.8     0.0     0.0 
1 1 1   27   27    8 o    405.8    3.5 1647.3857  28.0950  1647.3857  28.0950  1647.3857  28.0950      405.8      3.5      405.8        3.5     0.0     0.0 
1 1 1   27   27    9 o    294.8    3.5  869.6664  20.4327   869.6664  20.4327   869.6664  20.4327      294.8      3.5      294.8        3.5     0.0     0.0 
1 1 1   27   27   10 o    209.2    3.8  438.0258  15.9630   438.0258  15.9630   438.0258  15.9630      209.2      3.8      209.2        3.8     0.0     0.0 
1 1 1   27   27   11 o    150.0    5.6  226.0367  16.6016   226.0367  16.6016   226.0367  16.6016      150.0      5.6      150.0        5.6     0.0     0.0 
1 1 1   27   27   12 o     14.4   10.7  -63.2136  21.7097   -63.2136  21.7097   -63.2136  21.7097       14.4     10.7       14.4       10.7     0.0     0.0 
1 1 1   27   27   13 o     34.9   14.6   17.2401  10.2163    17.2401  10.2163    17.2401  10.2163       34.9     14.6       34.9       14.6     0.0     0.0 
1 1 1   27   27   14 o    505.0    3.4 2550.8938  34.4802  2550.8938  34.4802  2550.8938  34.4802      505.0      3.4      505.0        3.4     0.0     0.0 
1 1 1   27   27   15 o     76.4    8.5   60.6596  12.7704    60.6596  12.7704    60.6596  12.7704       76.4      8.5       76.4        8.5     0.0     0.0 
1 1 1   27   27   16 o    325.5    3.2 1059.9459  21.0712  1059.9459  21.0712  1059.9459  21.0712      325.5      3.2      325.5        3.2     0.0     0.0 
1 1 1   27   27   17 o    240.8    3.6  580.4161  17.2401   580.4161  17.2401   580.4161  17.2401      240.8      3.6      240.8        3.6     0.0     0.0 
1 1 1   27   27   18 o    163.1    4.7  266.9020  15.3245   266.9020  15.3245   266.9020  15.3245      163.1      4.7      163.1        4.7     0.0     0.0 
1 1 1   27   27   19 o    138.7    5.8  193.4720  15.9630   193.4720  15.9630   193.4720  15.9630      138.7      5.8      138.7        5.8     0.0     0.0 
1 1 1   27   27   20 o     13.1    9.7  -40.2269  15.9630   -40.2269  15.9630   -40.2269  15.9630       13.1      9.7       13.1        9.7     0.0     0.0 
1 1 1   27   27   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   27   22 o    328.9    3.3 1082.2942  21.7097  1082.2942  21.7097  1082.2942  21.7097      328.9      3.3      328.9        3.3     0.0     0.0 
1 1 1   27   27   23 o    326.1    3.8 1064.4155  24.9023  1064.4155  24.9023  1064.4155  24.9023      326.1      3.8      326.1        3.8     0.0     0.0 
1 1 1   27   27   24 o     46.1   18.1   29.3720  15.9630    29.3720  15.9630    29.3720  15.9630       46.1     18.1       46.1       18.1     0.0     0.0 
1 1 1   27   27   25 f    238.1    4.0  567.6458  19.1556   567.6458  19.1556   567.6458  19.1556      238.1      4.0      238.1        4.0     0.0     0.0 
1 1 1   27   27   26 o    128.4    7.3  166.6541  18.5171   166.6541  18.5171   166.6541  18.5171      128.4      7.3      128.4        7.3     0.0     0.0 
1 1 1   27   27   27 o    134.7    7.4  183.2557  19.7942   183.2557  19.7942   183.2557  19.7942      134.7      7.4      134.7        7.4     0.0     0.0 
1 1 1   27   27   28 o    334.9    3.6 1122.5210  24.2638  1122.5210  24.2638  1122.5210  24.2638      334.9      3.6      334.9        3.6     0.0     0.0 
1 1 1   27   27   29 o     87.9   10.0   80.4537  17.2401    80.4537  17.2401    80.4537  17.2401       87.9     10.0       87.9       10.0     0.0     0.0 
1 1 1   27   27   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   27   31 o     14.8   10.9  -44.0580  19.1556   -44.0580  19.1556   -44.0580  19.1556       14.8     10.9       14.8       10.9     0.0     0.0 
1 1 1   27   27   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   27   33 o    386.7    3.7 1496.6947  28.7335  1496.6947  28.7335  1496.6947  28.7335      386.7      3.7      386.7        3.7     0.0     0.0 
1 1 1   27   27   34 o    615.1    3.9 3785.1560  48.5276  3785.1560  48.5276  3785.1560  48.5276      615.1      3.9      615.1        3.9     0.0     0.0 
1 1 1   27   27   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   27   36 o    299.0    4.2  895.2073  24.9023   895.2073  24.9023   895.2073  24.9023      299.0      4.2      299.0        4.2     0.0     0.0 
1 1 1   27   27   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   27   38 o    172.0    6.9  297.5511  23.6253   297.5511  23.6253   297.5511  23.6253      172.0      6.9      172.0        6.9     0.0     0.0 
1 1 1   27   27   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   27   40 o    609.8    4.0 3720.6655  48.5276  3720.6655  48.5276  3720.6655  48.5276      609.8      4.0      609.8        4.0     0.0     0.0 
1 1 1   27   27   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   27   42 o    112.8   10.4  130.8969  22.9868   130.8969  22.9868   130.8969  22.9868      112.8     10.4      112.8       10.4     0.0     0.0 
1 1 1   27   27   43 o    363.1    4.2 1319.8242  30.6490  1319.8242  30.6490  1319.8242  30.6490      363.1      4.2      363.1        4.2     0.0     0.0 
1 1 1   27   27   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   27   27   45 o     54.1   22.2   41.5039  23.6253    41.5039  23.6253    41.5039  23.6253       54.1     22.2       54.1       22.2     0.0     0.0 
1 1 1   27   27   46 o    138.6    8.6  194.7491  23.6253   194.7491  23.6253   194.7491  23.6253      138.6      8.6      138.6        8.6     0.0     0.0 
1 1 1   27   27   47 o     18.6   13.5  -37.6728  23.6253   -37.6728  23.6253   -37.6728  23.6253       18.6     13.5       18.6       13.5     0.0     0.0 
1 1 1   27   27   48 o     60.8   22.7   50.4432  25.5409    50.4432  25.5409    50.4432  25.5409       60.8     22.7       60.8       22.7     0.0     0.0 
1 1 1   27   27   49 o    273.6    5.0  750.2629  27.4564   750.2629  27.4564   750.2629  27.4564      273.6      5.0      273.6        5.0     0.0     0.0 
1 1 1   27   27   50 o    241.6    5.4  585.5243  26.1794   585.5243  26.1794   585.5243  26.1794      241.6      5.4      241.6        5.4     0.0     0.0 
1 1 1   27   27   51 o     20.3   14.7  -41.5039  27.4564   -41.5039  27.4564   -41.5039  27.4564       20.3     14.7       20.3       14.7     0.0     0.0 
1 1 1   27   27   52 o    218.8    6.1  480.8068  26.8179   480.8068  26.8179   480.8068  26.8179      218.8      6.1      218.8        6.1     0.0     0.0 
1 1 1   27   27   53 o    217.0    6.2  473.1445  26.8179   473.1445  26.8179   473.1445  26.8179      217.0      6.2      217.0        6.2     0.0     0.0 
1 1 1   27   27   54 o     93.7   14.4   93.2242  25.5409    93.2242  25.5409    93.2242  25.5409       93.7     14.4       93.7       14.4     0.0     0.0 
1 1 1   27   27   55 o    180.9    7.4  330.1157  26.8179   330.1157  26.8179   330.1157  26.8179      180.9      7.4      180.9        7.4     0.0     0.0 
1 1 1   27   27   56 o     74.3   20.9   68.3218  26.8179    68.3218  26.8179    68.3218  26.8179       74.3     20.9       74.3       20.9     0.0     0.0 
1 1 1   27   27   57 o     24.9   17.0  -10.8549  24.9023   -10.8549  24.9023   -10.8549  24.9023       24.9     17.0       24.9       17.0     0.0     0.0 
1 1 1   27   27   58 o    155.9    8.7  247.1079  26.8179   247.1079  26.8179   247.1079  26.8179      155.9      8.7      155.9        8.7     0.0     0.0 
1 1 1   28    0    0 o    922.0    8.2 8503.1924 151.9681  8503.1924 151.9681  8503.1924 151.9681      922.0      8.2      922.0        8.2     0.0     0.0 
1 1 1   28    0    1 o   1485.8    8.7 22081.3555 258.6013 22081.3555 258.6013 22081.3555 258.6013     1485.8      8.7     1485.8        8.7     0.0     0.0 
1 1 1   28    0    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    0    3 f    238.8    3.7  570.8383  17.8786   570.8383  17.8786   570.8383  17.8786      238.8      3.7      238.8        3.7     0.0     0.0 
1 1 1   28    0    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    0    5 o    611.1    3.9 3735.3516  47.8891  3735.3516  47.8891  3735.3516  47.8891      611.1      3.9      611.1        3.9     0.0     0.0 
1 1 1   28    0    6 o   1475.5    7.3 21774.2266 215.8203 21774.2266 215.8203 21774.2266 215.8203     1475.5      7.3     1475.5        7.3     0.0     0.0 
1 1 1   28    0    7 o     11.6    8.7  -40.2269  14.0475   -40.2269  14.0475   -40.2269  14.0475       11.6      8.7       11.6        8.7     0.0     0.0 
1 1 1   28    0    8 o   1993.4    9.6 39746.0586 384.3900 39746.0586 384.3900 39746.0586 384.3900     1993.4      9.6     1993.4        9.6     0.0     0.0 
1 1 1   28    0    9 o    119.4    6.2  143.6674  14.6860   143.6674  14.6860   143.6674  14.6860      119.4      6.2      119.4        6.2     0.0     0.0 
1 1 1   28    0   10 o    810.0    4.3 6562.0864  70.2374  6562.0864  70.2374  6562.0864  70.2374      810.0      4.3      810.0        4.3     0.0     0.0 
1 1 1   28    0   11 o    902.6    4.6 8147.5361  83.6463  8147.5361  83.6463  8147.5361  83.6463      902.6      4.6      902.6        4.6     0.0     0.0 
1 1 1   28    0   12 o    165.9    4.0  275.8413  13.4090   275.8413  13.4090   275.8413  13.4090      165.9      4.0      165.9        4.0     0.0     0.0 
1 1 1   28    0   13 o   1169.9    5.7 13687.3506 133.4510 13687.3506 133.4510 13687.3506 133.4510     1169.9      5.7     1169.9        5.7     0.0     0.0 
1 1 1   28    0   14 o    512.4    3.2 2626.2393  33.2031  2626.2393  33.2031  2626.2393  33.2031      512.4      3.2      512.4        3.2     0.0     0.0 
1 1 1   28    0   15 o    838.8    4.5 7037.1465  74.7070  7037.1465  74.7070  7037.1465  74.7070      838.8      4.5      838.8        4.5     0.0     0.0 
1 1 1   28    0   16 o     62.7   14.0   44.6965  15.3245    44.6965  15.3245    44.6965  15.3245       62.7     14.0       62.7       14.0     0.0     0.0 
1 1 1   28    0   17 o    463.6    3.2 2149.9023  29.3720  2149.9023  29.3720  2149.9023  29.3720      463.6      3.2      463.6        3.2     0.0     0.0 
1 1 1   28    0   18 o   2167.2   10.0 46977.3125 434.1947 46977.3125 434.1947 46977.3125 434.1947     2167.2     10.0     2167.2       10.0     0.0     0.0 
1 1 1   28    0   19 o    624.1    3.6 3894.9819  45.3350  3894.9819  45.3350  3894.9819  45.3350      624.1      3.6      624.1        3.6     0.0     0.0 
1 1 1   28    0   20 f   2817.9   13.9 79441.0312 784.7431 79441.0312 784.7431 79441.0312 784.7431     2817.9     13.9     2817.9       13.9     0.0     0.0 
1 1 1   28    0   21 f    311.8    3.4  972.4684  21.0712   972.4684  21.0712   972.4684  21.0712      311.8      3.4      311.8        3.4     0.0     0.0 
1 1 1   28    0   22 o    293.0    3.6  858.8116  21.0712   858.8116  21.0712   858.8116  21.0712      293.0      3.6      293.0        3.6     0.0     0.0 
1 1 1   28    0   23 o    594.4    3.5 3533.5789  42.1424  3533.5789  42.1424  3533.5789  42.1424      594.4      3.5      594.4        3.5     0.0     0.0 
1 1 1   28    0   24 f    822.7    4.5 6769.6060  74.7070  6769.6060  74.7070  6769.6060  74.7070      822.7      4.5      822.7        4.5     0.0     0.0 
1 1 1   28    0   25 o    411.5    3.6 1693.3594  29.3720  1693.3594  29.3720  1693.3594  29.3720      411.5      3.6      411.5        3.6     0.0     0.0 
1 1 1   28    0   26 o    188.0    6.0  354.3795  22.3483   354.3795  22.3483   354.3795  22.3483      188.0      6.0      188.0        6.0     0.0     0.0 
1 1 1   28    0   27 o    570.2    4.0 3251.3523  45.9736  3251.3523  45.9736  3251.3523  45.9736      570.2      4.0      570.2        4.0     0.0     0.0 
1 1 1   28    0   28 f   1535.4    7.6 23579.3262 234.3374 23579.3262 234.3374 23579.3262 234.3374     1535.4      7.6     1535.4        7.6     0.0     0.0 
1 1 1   28    0   29 o   1263.7    6.1 15971.9795 155.1608 15971.9795 155.1608 15971.9795 155.1608     1263.7      6.1     1263.7        6.1     0.0     0.0 
1 1 1   28    0   30 o    614.3    4.3 3774.9399  52.9973  3774.9399  52.9973  3774.9399  52.9973      614.3      4.3      614.3        4.3     0.0     0.0 
1 1 1   28    0   31 o    128.1    8.0  166.0156  20.4327   166.0156  20.4327   166.0156  20.4327      128.1      8.0      128.1        8.0     0.0     0.0 
1 1 1   28    0   32 o    627.3    4.1 3935.8474  51.7203  3935.8474  51.7203  3935.8474  51.7203      627.3      4.1      627.3        4.1     0.0     0.0 
1 1 1   28    0   33 o    133.5    7.7  180.0631  20.4327   180.0631  20.4327   180.0631  20.4327      133.5      7.7      133.5        7.7     0.0     0.0 
1 1 1   28    0   34 o    583.9    3.8 3410.3438  44.6965  3410.3438  44.6965  3410.3438  44.6965      583.9      3.8      583.9        3.8     0.0     0.0 
1 1 1   28    0   35 o    499.7    3.5 2497.8967  35.1187  2497.8967  35.1187  2497.8967  35.1187      499.7      3.5      499.7        3.5     0.0     0.0 
1 1 1   28    0   36 o    486.3    3.6 2365.0840  35.1187  2365.0840  35.1187  2365.0840  35.1187      486.3      3.6      486.3        3.6     0.0     0.0 
1 1 1   28    0   37 o    383.9    3.8 1474.3464  29.3720  1474.3464  29.3720  1474.3464  29.3720      383.9      3.8      383.9        3.8     0.0     0.0 
1 1 1   28    0   38 o    377.1    4.5 1422.6262  33.8416  1422.6262  33.8416  1422.6262  33.8416      377.1      4.5      377.1        4.5     0.0     0.0 
1 1 1   28    0   39 o    505.1    3.8 2552.1709  38.3113  2552.1709  38.3113  2552.1709  38.3113      505.1      3.8      505.1        3.8     0.0     0.0 
1 1 1   28    0   40 o    136.0    9.5  187.7254  25.5409   187.7254  25.5409   187.7254  25.5409      136.0      9.5      136.0        9.5     0.0     0.0 
1 1 1   28    0   41 o    197.8    8.3  393.3293  32.5646   393.3293  32.5646   393.3293  32.5646      197.8      8.3      197.8        8.3     0.0     0.0 
1 1 1   28    0   42 o   1288.8    7.3 16618.1641 187.0868 16618.1641 187.0868 16618.1641 187.0868     1288.8      7.3     1288.8        7.3     0.0     0.0 
1 1 1   28    0   43 o    458.9    4.2 2106.4829  38.9498  2106.4829  38.9498  2106.4829  38.9498      458.9      4.2      458.9        4.2     0.0     0.0 
1 1 1   28    0   44 o     27.9   18.6   -5.7467  26.8179    -5.7467  26.8179    -5.7467  26.8179       27.9     18.6       27.9       18.6     0.0     0.0 
1 1 1   28    0   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    0   46 o    494.1    3.7 2441.7065  37.0343  2441.7065  37.0343  2441.7065  37.0343      494.1      3.7      494.1        3.7     0.0     0.0 
1 1 1   28    0   47 o    551.6    3.6 3043.1941  40.2269  3043.1941  40.2269  3043.1941  40.2269      551.6      3.6      551.6        3.6     0.0     0.0 
1 1 1   28    0   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    0   49 o    221.7    6.1  492.9387  26.8179   492.9387  26.8179   492.9387  26.8179      221.7      6.1      221.7        6.1     0.0     0.0 
1 1 1   28    0   50 o    333.5    4.1 1112.9432  27.4564  1112.9432  27.4564  1112.9432  27.4564      333.5      4.1      333.5        4.1     0.0     0.0 
1 1 1   28    0   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    0   52 o    415.6    3.7 1727.8396  30.6490  1727.8396  30.6490  1727.8396  30.6490      415.6      3.7      415.6        3.7     0.0     0.0 
1 1 1   28    0   53 o     18.9   13.7  -41.5039  24.9023   -41.5039  24.9023   -41.5039  24.9023       18.9     13.7       18.9       13.7     0.0     0.0 
1 1 1   28    0   54 o     53.5   23.5   41.5039  26.1794    41.5039  26.1794    41.5039  26.1794       53.5     23.5       53.5       23.5     0.0     0.0 
1 1 1   28    0   55 o    235.8    5.4  557.4294  25.5409   557.4294  25.5409   557.4294  25.5409      235.8      5.4      235.8        5.4     0.0     0.0 
1 1 1   28    0   56 o    155.1    8.7  243.2767  26.8179   243.2767  26.8179   243.2767  26.8179      155.1      8.7      155.1        8.7     0.0     0.0 
1 1 1   28    0   57 o    705.0    4.3 4972.8062  60.0210  4972.8062  60.0210  4972.8062  60.0210      705.0      4.3      705.0        4.3     0.0     0.0 
1 1 1   28    0   58 o    128.6   10.6  169.2082  26.8179   169.2082  26.8179   169.2082  26.8179      128.6     10.6      128.6       10.6     0.0     0.0 
1 1 1   28    0   59 o     14.6   11.0 -100.8864  27.4564  -100.8864  27.4564  -100.8864  27.4564       14.6     11.0       14.6       11.0     0.0     0.0 
1 1 1   28    0   60 o     20.2   14.6  -45.3350  28.0950   -45.3350  28.0950   -45.3350  28.0950       20.2     14.6       20.2       14.6     0.0     0.0 
1 1 1   28    0   61 o    205.4    6.7  423.9784  27.4564   423.9784  27.4564   423.9784  27.4564      205.4      6.7      205.4        6.7     0.0     0.0 
1 1 1   28    0   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    0   63 o    493.9    4.3 2441.0681  42.7809  2441.0681  42.7809  2441.0681  42.7809      493.9      4.3      493.9        4.3     0.0     0.0 
1 1 1   28    0   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    0   65 o     32.3   20.6    4.4697  28.7335     4.4697  28.7335     4.4697  28.7335       32.3     20.6       32.3       20.6     0.0     0.0 
1 1 1   28    0   66 o     32.5   20.7    5.1082  28.7335     5.1082  28.7335     5.1082  28.7335       32.5     20.7       32.5       20.7     0.0     0.0 
1 1 1   28    0   67 o    201.2    7.2  407.3768  28.7335   407.3768  28.7335   407.3768  28.7335      201.2      7.2      201.2        7.2     0.0     0.0 
1 1 1   28    0   68 o    288.8    5.4  836.4633  31.2876   836.4633  31.2876   836.4633  31.2876      288.8      5.4      288.8        5.4     0.0     0.0 
1 1 1   28    0   69 o     54.2   24.9   44.0580  29.3720    44.0580  29.3720    44.0580  29.3720       54.2     24.9       54.2       24.9     0.0     0.0 
1 1 1   28    0   70 o    248.6    6.3  620.6430  31.2876   620.6430  31.2876   620.6430  31.2876      248.6      6.3      248.6        6.3     0.0     0.0 
1 1 1   28    0   71 o     19.8   14.5  -58.7440  30.6490   -58.7440  30.6490   -58.7440  30.6490       19.8     14.5       19.8       14.5     0.0     0.0 
1 1 1   28    0   72 o    130.0   11.2  174.3164  28.7335   174.3164  28.7335   174.3164  28.7335      130.0     11.2      130.0       11.2     0.0     0.0 
1 1 1   28    0   73 o    105.5   14.5  116.2109  30.0105   116.2109  30.0105   116.2109  30.0105      105.5     14.5      105.5       14.5     0.0     0.0 
1 1 1   28    0   74 o    236.5    6.4  562.5375  30.0105   562.5375  30.0105   562.5375  30.0105      236.5      6.4      236.5        6.4     0.0     0.0 
1 1 1   28    0   75 o     23.4   16.5  -26.8179  28.7335   -26.8179  28.7335   -26.8179  28.7335       23.4     16.5       23.4       16.5     0.0     0.0 
1 1 1   28    1    0 o   1026.3    5.5 10534.3301 112.3798 10534.3301 112.3798 10534.3301 112.3798     1026.3      5.5     1026.3        5.5     0.0     0.0 
1 1 1   28    1    1 o   1681.3    5.9    0.0000   0.0000          ?        ? 28271.8242 198.5802          ?        ?     1681.3        5.9       ?       ? 
1 1 1   28    1    2 o    715.3    3.0    0.0000   0.0000          ?        ?  5117.1123  42.7809          ?        ?      715.3        3.0       ?       ? 
1 1 1   28    1    3 f   1111.9    4.0    0.0000   0.0000          ?        ? 12363.6943  89.3930          ?        ?     1111.9        4.0       ?       ? 
1 1 1   28    1    4 o   1415.0    4.9    0.0000   0.0000          ?        ? 20023.3984 138.5592          ?        ?     1415.0        4.9       ?       ? 
1 1 1   28    1    5 o    355.9    2.2    0.0000   0.0000          ?        ?  1266.8269  15.9630          ?        ?      355.9        2.2       ?       ? 
1 1 1   28    1    6 o   2038.7    6.8    0.0000   0.0000          ?        ? 41569.6719 277.1184          ?        ?     2038.7        6.8       ?       ? 
1 1 1   28    1    7 o   1197.6    4.2    0.0000   0.0000          ?        ? 14343.1113 101.5249          ?        ?     1197.6        4.2       ?       ? 
1 1 1   28    1    8 o   1461.6    5.0    0.0000   0.0000          ?        ? 21364.9336 146.8600          ?        ?     1461.6        5.0       ?       ? 
1 1 1   28    1    9 o   1633.9    5.6    0.0000   0.0000          ?        ? 26699.7812 181.9787          ?        ?     1633.9        5.6       ?       ? 
1 1 1   28    1   10 o   1469.4    5.0    0.0000   0.0000          ?        ? 21592.8848 148.1370          ?        ?     1469.4        5.0       ?       ? 
1 1 1   28    1   11 o    760.6    2.9    0.0000   0.0000          ?        ?  5785.0059  44.0580          ?        ?      760.6        2.9       ?       ? 
1 1 1   28    1   12 o   1345.7    4.7    0.0000   0.0000          ?        ? 18109.1133 125.1502          ?        ?     1345.7        4.7       ?       ? 
1 1 1   28    1   13 o   1679.5    5.6    0.0000   0.0000          ?        ? 28209.2461 186.4483          ?        ?     1679.5        5.6       ?       ? 
1 1 1   28    1   14 o    651.6    2.6    0.0000   0.0000          ?        ?  4246.1689  34.4802          ?        ?      651.6        2.6       ?       ? 
1 1 1   28    1   15 o    559.7    2.5    0.0000   0.0000          ?        ?  3132.5872  27.4564          ?        ?      559.7        2.5       ?       ? 
1 1 1   28    1   16 o    269.3    2.4    0.0000   0.0000          ?        ?   725.3605  12.7704          ?        ?      269.3        2.4       ?       ? 
1 1 1   28    1   17 o    548.7    2.5    0.0000   0.0000          ?        ?  3010.6294  27.4564          ?        ?      548.7        2.5       ?       ? 
1 1 1   28    1   18 o    265.7    2.4    0.0000   0.0000          ?        ?   706.2049  12.7704          ?        ?      265.7        2.4       ?       ? 
1 1 1   28    1   19 o    794.8    3.0    0.0000   0.0000          ?        ?  6316.8945  47.2506          ?        ?      794.8        3.0       ?       ? 
1 1 1   28    1   20 o   1260.2    4.4    0.0000   0.0000          ?        ? 15882.5859 111.7413          ?        ?     1260.2        4.4       ?       ? 
1 1 1   28    1   21 o    985.4    3.5    0.0000   0.0000          ?        ?  9709.9980  68.9603          ?        ?      985.4        3.5       ?       ? 
1 1 1   28    1   22 o    956.1    3.4    0.0000   0.0000          ?        ?  9141.7139  65.7677          ?        ?      956.1        3.4       ?       ? 
1 1 1   28    1   23 o    979.6    3.7    0.0000   0.0000          ?        ?  9596.3418  72.1529          ?        ?      979.6        3.7       ?       ? 
1 1 1   28    1   24 o    767.9    3.0    0.0000   0.0000          ?        ?  5897.3857  45.9736          ?        ?      767.9        3.0       ?       ? 
1 1 1   28    1   25 o    502.9    2.3    0.0000   0.0000          ?        ?  2529.1841  23.6253          ?        ?      502.9        2.3       ?       ? 
1 1 1   28    1   26 o    586.5    2.6    0.0000   0.0000          ?        ?  3440.3545  30.6490          ?        ?      586.5        2.6       ?       ? 
1 1 1   28    1   27 o   1352.4    5.0    0.0000   0.0000          ?        ? 18293.0059 134.7281          ?        ?     1352.4        5.0       ?       ? 
1 1 1   28    1   28 o    129.6    5.2    0.0000   0.0000          ?        ?   167.9312  13.4090          ?        ?      129.6        5.2       ?       ? 
1 1 1   28    1   29 o    897.2    3.8    0.0000   0.0000          ?        ?  8050.4810  68.3218          ?        ?      897.2        3.8       ?       ? 
1 1 1   28    1   30 o    511.6    2.8    0.0000   0.0000          ?        ?  2617.9387  28.7335          ?        ?      511.6        2.8       ?       ? 
1 1 1   28    1   31 o    424.5    2.6    0.0000   0.0000          ?        ?  1801.9081  21.7097          ?        ?      424.5        2.6       ?       ? 
1 1 1   28    1   32 o    850.1    3.6    0.0000   0.0000          ?        ?  7228.0649  60.6596          ?        ?      850.1        3.6       ?       ? 
1 1 1   28    1   33 o    442.6    2.6    0.0000   0.0000          ?        ?  1958.9843  22.9868          ?        ?      442.6        2.6       ?       ? 
1 1 1   28    1   34 o    928.7    3.5    0.0000   0.0000          ?        ?  8626.4268  65.7677          ?        ?      928.7        3.5       ?       ? 
1 1 1   28    1   35 o    242.6    3.6    0.0000   0.0000          ?        ?   588.7169  17.2401          ?        ?      242.6        3.6       ?       ? 
1 1 1   28    1   36 o    407.4    2.7    0.0000   0.0000          ?        ?  1660.1562  22.3483          ?        ?      407.4        2.7       ?       ? 
1 1 1   28    1   37 o    171.9    4.6    0.0000   0.0000          ?        ?   295.6355  15.9630          ?        ?      171.9        4.6       ?       ? 
1 1 1   28    1   38 o    465.3    2.7    0.0000   0.0000          ?        ?  2165.2268  24.9023          ?        ?      465.3        2.7       ?       ? 
1 1 1   28    1   39 o    879.0    3.5    0.0000   0.0000          ?        ?  7727.3882  60.6596          ?        ?      879.0        3.5       ?       ? 
1 1 1   28    1   40 o    112.4    8.2    0.0000   0.0000          ?        ?   126.4273  18.5171          ?        ?      112.4        8.2       ?       ? 
1 1 1   28    1   41 o    333.4    3.2    0.0000   0.0000          ?        ?  1111.6661  21.0712          ?        ?      333.4        3.2       ?       ? 
1 1 1   28    1   42 o    150.1    6.0    0.0000   0.0000          ?        ?   225.3981  17.8786          ?        ?      150.1        6.0       ?       ? 
1 1 1   28    1   43 o    827.9    3.4    0.0000   0.0000          ?        ?  6855.1680  56.8284          ?        ?      827.9        3.4       ?       ? 
1 1 1   28    1   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    1   45 o     65.5   13.6    0.0000   0.0000          ?        ?    44.6965  17.2401          ?        ?       65.5       13.6       ?       ? 
1 1 1   28    1   46 o    548.2    2.7    0.0000   0.0000          ?        ?  3006.1597  29.3720          ?        ?      548.2        2.7       ?       ? 
1 1 1   28    1   47 o    169.3    5.3    0.0000   0.0000          ?        ?   286.6962  17.8786          ?        ?      169.3        5.3       ?       ? 
1 1 1   28    1   48 o    357.0    2.9    0.0000   0.0000          ?        ?  1275.1277  20.4327          ?        ?      357.0        2.9       ?       ? 
1 1 1   28    1   49 o    490.7    2.6    0.0000   0.0000          ?        ?  2408.5037  25.5409          ?        ?      490.7        2.6       ?       ? 
1 1 1   28    1   50 o    377.6    3.1    0.0000   0.0000          ?        ?  1426.4573  23.6253          ?        ?      377.6        3.1       ?       ? 
1 1 1   28    1   51 o    514.0    2.7    0.0000   0.0000          ?        ?  2642.8411  27.4564          ?        ?      514.0        2.7       ?       ? 
1 1 1   28    1   52 o    361.9    3.0    0.0000   0.0000          ?        ?  1310.2463  21.7097          ?        ?      361.9        3.0       ?       ? 
1 1 1   28    1   53 o    369.3    3.0    0.0000   0.0000          ?        ?  1364.5208  22.3483          ?        ?      369.3        3.0       ?       ? 
1 1 1   28    1   54 o    166.4    5.4    0.0000   0.0000          ?        ?   277.1184  17.8786          ?        ?      166.4        5.4       ?       ? 
1 1 1   28    1   55 o    787.0    3.0    0.0000   0.0000          ?        ?  6196.8525  47.8891          ?        ?      787.0        3.0       ?       ? 
1 1 1   28    1   56 o    408.4    2.8    0.0000   0.0000          ?        ?  1668.4569  22.9868          ?        ?      408.4        2.8       ?       ? 
1 1 1   28    1   57 o    314.2    3.3    0.0000   0.0000          ?        ?   987.7929  20.4327          ?        ?      314.2        3.3       ?       ? 
1 1 1   28    1   58 o    261.4    3.7    0.0000   0.0000          ?        ?   683.8566  19.1556          ?        ?      261.4        3.7       ?       ? 
1 1 1   28    1   59 o    215.3    4.7    0.0000   0.0000          ?        ?   464.2052  20.4327          ?        ?      215.3        4.7       ?       ? 
1 1 1   28    1   60 o    346.6    3.2    0.0000   0.0000          ?        ?  1202.3362  22.3483          ?        ?      346.6        3.2       ?       ? 
1 1 1   28    1   61 o    106.9    9.9    0.0000   0.0000          ?        ?   114.9339  21.0712          ?        ?      106.9        9.9       ?       ? 
1 1 1   28    1   62 o    292.1    3.6    0.0000   0.0000          ?        ?   853.7034  21.0712          ?        ?      292.1        3.6       ?       ? 
1 1 1   28    1   63 o     43.6   16.7    0.0000   0.0000          ?        ?    13.4090  20.4327          ?        ?       43.6       16.7       ?       ? 
1 1 1   28    1   64 o    315.1    3.4    0.0000   0.0000          ?        ?   993.5397  21.7097          ?        ?      315.1        3.4       ?       ? 
1 1 1   28    1   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    1   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    1   67 o    369.0    3.1    0.0000   0.0000          ?        ?  1362.6051  22.9868          ?        ?      369.0        3.1       ?       ? 
1 1 1   28    1   68 o     45.7   17.3    0.0000   0.0000          ?        ?    15.9630  21.7097          ?        ?       45.7       17.3       ?       ? 
1 1 1   28    1   69 o     20.6   10.4    0.0000   0.0000          ?        ?   -67.0448  20.4327          ?        ?       20.6       10.4       ?       ? 
1 1 1   28    1   70 o     81.5   12.5    0.0000   0.0000          ?        ?    67.6833  20.4327          ?        ?       81.5       12.5       ?       ? 
1 1 1   28    1   71 o    286.3    3.7    0.0000   0.0000          ?        ?   821.1389  21.0712          ?        ?      286.3        3.7       ?       ? 
1 1 1   28    1   72 o     21.1   10.6    0.0000   0.0000          ?        ?   -62.5751  20.4327          ?        ?       21.1       10.6       ?       ? 
1 1 1   28    1   73 o    234.6    4.6    0.0000   0.0000          ?        ?   552.3212  21.7097          ?        ?      234.6        4.6       ?       ? 
1 1 1   28    1   74 o     83.7   12.2    0.0000   0.0000          ?        ?    72.1529  20.4327          ?        ?       83.7       12.2       ?       ? 
1 1 1   28    2    0 o     35.4   17.1   18.5171  14.0475    18.5171  14.0475    18.5171  14.0475       35.4     17.1       35.4       17.1     0.0     0.0 
1 1 1   28    2    1 o    279.6    2.5    0.0000   0.0000          ?        ?   781.5505  14.0475          ?        ?      279.6        2.5       ?       ? 
1 1 1   28    2    2 o   1059.7    3.8    0.0000   0.0000          ?        ? 11230.9570  80.4537          ?        ?     1059.7        3.8       ?       ? 
1 1 1   28    2    3 f    544.0    2.3    0.0000   0.0000          ?        ?  2958.9092  25.5409          ?        ?      544.0        2.3       ?       ? 
1 1 1   28    2    4 o    995.5    3.7    0.0000   0.0000          ?        ?  9909.8555  72.7915          ?        ?      995.5        3.7       ?       ? 
1 1 1   28    2    5 o    821.7    3.2    0.0000   0.0000          ?        ?  6751.7280  52.3588          ?        ?      821.7        3.2       ?       ? 
1 1 1   28    2    6 o    452.0    2.3    0.0000   0.0000          ?        ?  2042.6306  20.4327          ?        ?      452.0        2.3       ?       ? 
1 1 1   28    2    7 o   1096.7    4.0    0.0000   0.0000          ?        ? 12027.8320  86.8389          ?        ?     1096.7        4.0       ?       ? 
1 1 1   28    2    8 o   1483.6    5.1    0.0000   0.0000          ?        ? 22013.0332 151.3296          ?        ?     1483.6        5.1       ?       ? 
1 1 1   28    2    9 o    812.1    3.2    0.0000   0.0000          ?        ?  6595.9282  51.7203          ?        ?      812.1        3.2       ?       ? 
1 1 1   28    2   10 o   1928.9    6.6    0.0000   0.0000          ?        ? 37212.4023 254.1316          ?        ?     1928.9        6.6       ?       ? 
1 1 1   28    2   11 o    872.6    3.3    0.0000   0.0000          ?        ?  7614.3706  58.1055          ?        ?      872.6        3.3       ?       ? 
1 1 1   28    2   12 o    393.4    2.4    0.0000   0.0000          ?        ?  1547.7764  18.5171          ?        ?      393.4        2.4       ?       ? 
1 1 1   28    2   13 o    601.8    2.7    0.0000   0.0000          ?        ?  3621.6948  31.9261          ?        ?      601.8        2.7       ?       ? 
1 1 1   28    2   14 o    587.8    2.6    0.0000   0.0000          ?        ?  3455.0403  30.6490          ?        ?      587.8        2.6       ?       ? 
1 1 1   28    2   15 o    941.1    3.5    0.0000   0.0000          ?        ?  8856.2949  66.4062          ?        ?      941.1        3.5       ?       ? 
1 1 1   28    2   16 o    881.9    3.4    0.0000   0.0000          ?        ?  7777.8315  59.3825          ?        ?      881.9        3.4       ?       ? 
1 1 1   28    2   17 f   1192.8    4.4    0.0000   0.0000          ?        ? 14229.4541 104.7175          ?        ?     1192.8        4.4       ?       ? 
1 1 1   28    2   18 o    863.6    3.5    0.0000   0.0000          ?        ?  7459.2095  60.0210          ?        ?      863.6        3.5       ?       ? 
1 1 1   28    2   19 o   1053.1    3.9    0.0000   0.0000          ?        ? 11089.8438  81.7308          ?        ?     1053.1        3.9       ?       ? 
1 1 1   28    2   20 o    703.1    2.9    0.0000   0.0000          ?        ?  4944.0728  40.2269          ?        ?      703.1        2.9       ?       ? 
1 1 1   28    2   21 o    662.0    2.7    0.0000   0.0000          ?        ?  4382.1738  35.7572          ?        ?      662.0        2.7       ?       ? 
1 1 1   28    2   22 o    582.9    2.7    0.0000   0.0000          ?        ?  3397.5735  31.2876          ?        ?      582.9        2.7       ?       ? 
1 1 1   28    2   23 o   1329.8    4.6    0.0000   0.0000          ?        ? 17685.1328 122.5962          ?        ?     1329.8        4.6       ?       ? 
1 1 1   28    2   24 o   2057.6    7.2    0.0000   0.0000          ?        ? 42348.0312 296.2740          ?        ?     2057.6        7.2       ?       ? 
1 1 1   28    2   25 o    792.8    3.1    0.0000   0.0000          ?        ?  6284.9683  49.1662          ?        ?      792.8        3.1       ?       ? 
1 1 1   28    2   26 o    973.1    3.9    0.0000   0.0000          ?        ?  9469.9141  75.3456          ?        ?      973.1        3.9       ?       ? 
1 1 1   28    2   27 f    640.2    3.0    0.0000   0.0000          ?        ?  4099.3091  38.3113          ?        ?      640.2        3.0       ?       ? 
1 1 1   28    2   28 o    527.9    2.6    0.0000   0.0000          ?        ?  2786.5083  27.4564          ?        ?      527.9        2.6       ?       ? 
1 1 1   28    2   29 o    430.1    2.4    0.0000   0.0000          ?        ?  1849.7972  21.0712          ?        ?      430.1        2.4       ?       ? 
1 1 1   28    2   30 o    648.2    3.1    0.0000   0.0000          ?        ?  4202.1108  39.5883          ?        ?      648.2        3.1       ?       ? 
1 1 1   28    2   31 o    856.8    3.4    0.0000   0.0000          ?        ?  7341.7222  57.4669          ?        ?      856.8        3.4       ?       ? 
1 1 1   28    2   32 f    245.2    3.3    0.0000   0.0000          ?        ?   601.4874  15.9630          ?        ?      245.2        3.3       ?       ? 
1 1 1   28    2   33 o    241.0    3.4    0.0000   0.0000          ?        ?   581.0547  16.6016          ?        ?      241.0        3.4       ?       ? 
1 1 1   28    2   34 o    155.5    5.3    0.0000   0.0000          ?        ?   241.9997  16.6016          ?        ?      155.5        5.3       ?       ? 
1 1 1   28    2   35 o    491.9    2.5    0.0000   0.0000          ?        ?  2419.9971  24.2638          ?        ?      491.9        2.5       ?       ? 
1 1 1   28    2   36 o    828.0    3.3    0.0000   0.0000          ?        ?  6856.4453  54.2743          ?        ?      828.0        3.3       ?       ? 
1 1 1   28    2   37 o    588.9    2.8    0.0000   0.0000          ?        ?  3468.4495  32.5646          ?        ?      588.9        2.8       ?       ? 
1 1 1   28    2   38 o    580.1    2.8    0.0000   0.0000          ?        ?  3365.6472  32.5646          ?        ?      580.1        2.8       ?       ? 
1 1 1   28    2   39 o    830.7    3.2    0.0000   0.0000          ?        ?  6902.4189  53.6358          ?        ?      830.7        3.2       ?       ? 
1 1 1   28    2   40 o    686.7    3.0    0.0000   0.0000          ?        ?  4716.7593  41.5039          ?        ?      686.7        3.0       ?       ? 
1 1 1   28    2   41 o    598.8    2.8    0.0000   0.0000          ?        ?  3586.5762  33.8416          ?        ?      598.8        2.8       ?       ? 
1 1 1   28    2   42 o    323.0    3.1    0.0000   0.0000          ?        ?  1043.3442  19.7942          ?        ?      323.0        3.1       ?       ? 
1 1 1   28    2   43 o    346.1    2.9    0.0000   0.0000          ?        ?  1197.8666  19.7942          ?        ?      346.1        2.9       ?       ? 
1 1 1   28    2   44 o    310.6    3.1    0.0000   0.0000          ?        ?   964.8062  19.1556          ?        ?      310.6        3.1       ?       ? 
1 1 1   28    2   45 o     55.6   15.5    0.0000   0.0000          ?        ?    31.9261  17.8786          ?        ?       55.6       15.5       ?       ? 
1 1 1   28    2   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    2   47 o    491.8    2.7    0.0000   0.0000          ?        ?  2419.3584  26.1794          ?        ?      491.8        2.7       ?       ? 
1 1 1   28    2   48 o    150.1    5.7    0.0000   0.0000          ?        ?   225.3981  17.2401          ?        ?      150.1        5.7       ?       ? 
1 1 1   28    2   49 f     86.3    9.2    0.0000   0.0000          ?        ?    74.7070  15.9630          ?        ?       86.3        9.2       ?       ? 
1 1 1   28    2   50 o    228.9    3.9    0.0000   0.0000          ?        ?   524.2263  17.8786          ?        ?      228.9        3.9       ?       ? 
1 1 1   28    2   51 o    461.9    2.7    0.0000   0.0000          ?        ?  2133.9395  24.9023          ?        ?      461.9        2.7       ?       ? 
1 1 1   28    2   52 o    262.4    3.6    0.0000   0.0000          ?        ?   688.9648  19.1556          ?        ?      262.4        3.6       ?       ? 
1 1 1   28    2   53 o     68.3   13.1    0.0000   0.0000          ?        ?    48.5276  17.2401          ?        ?       68.3       13.1       ?       ? 
1 1 1   28    2   54 o     29.8   13.6    0.0000   0.0000          ?        ?   -11.4934  17.8786          ?        ?       29.8       13.6       ?       ? 
1 1 1   28    2   55 o    453.2    2.7    0.0000   0.0000          ?        ?  2054.7625  24.9023          ?        ?      453.2        2.7       ?       ? 
1 1 1   28    2   56 o    436.8    2.7    0.0000   0.0000          ?        ?  1908.5411  23.6253          ?        ?      436.8        2.7       ?       ? 
1 1 1   28    2   57 o     21.1   10.6    0.0000   0.0000          ?        ?   -54.9129  19.1556          ?        ?       21.1       10.6       ?       ? 
1 1 1   28    2   58 o    258.6    4.0    0.0000   0.0000          ?        ?   669.1707  20.4327          ?        ?      258.6        4.0       ?       ? 
1 1 1   28    2   59 o    381.0    3.0    0.0000   0.0000          ?        ?  1452.6367  22.9868          ?        ?      381.0        3.0       ?       ? 
1 1 1   28    2   60 o    343.9    3.2    0.0000   0.0000          ?        ?  1183.1805  21.7097          ?        ?      343.9        3.2       ?       ? 
1 1 1   28    2   61 o    555.5    2.9    0.0000   0.0000          ?        ?  3087.2520  31.9261          ?        ?      555.5        2.9       ?       ? 
1 1 1   28    2   62 o    417.2    2.9    0.0000   0.0000          ?        ?  1741.2485  24.2638          ?        ?      417.2        2.9       ?       ? 
1 1 1   28    2   63 o     59.8   15.8    0.0000   0.0000          ?        ?    37.6728  19.1556          ?        ?       59.8       15.8       ?       ? 
1 1 1   28    2   64 o    127.3    7.8    0.0000   0.0000          ?        ?   162.8230  19.7942          ?        ?      127.3        7.8       ?       ? 
1 1 1   28    2   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    2   66 o    418.8    3.0    0.0000   0.0000          ?        ?  1755.2959  24.9023          ?        ?      418.8        3.0       ?       ? 
1 1 1   28    2   67 o    156.7    6.5    0.0000   0.0000          ?        ?   246.4693  20.4327          ?        ?      156.7        6.5       ?       ? 
1 1 1   28    2   68 o    109.1    9.1    0.0000   0.0000          ?        ?   120.0421  19.7942          ?        ?      109.1        9.1       ?       ? 
1 1 1   28    2   69 o    186.5    5.8    0.0000   0.0000          ?        ?   349.2713  21.7097          ?        ?      186.5        5.8       ?       ? 
1 1 1   28    2   70 o     27.9   13.3    0.0000   0.0000          ?        ?   -25.5409  20.4327          ?        ?       27.9       13.3       ?       ? 
1 1 1   28    2   71 o    187.2    5.5    0.0000   0.0000          ?        ?   351.8254  20.4327          ?        ?      187.2        5.5       ?       ? 
1 1 1   28    2   72 o     22.5   11.2    0.0000   0.0000          ?        ?   -56.8284  21.0712          ?        ?       22.5       11.2       ?       ? 
1 1 1   28    2   73 o     88.6   11.5    0.0000   0.0000          ?        ?    80.4537  20.4327          ?        ?       88.6       11.5       ?       ? 
1 1 1   28    2   74 o    165.4    6.2    0.0000   0.0000          ?        ?   275.8413  20.4327          ?        ?      165.4        6.2       ?       ? 
1 1 1   28    3    0 o    294.1    3.3  865.1968  19.1556   865.1968  19.1556   865.1968  19.1556      294.1      3.3      294.1        3.3     0.0     0.0 
1 1 1   28    3    1 o    532.8    2.5    0.0000   0.0000          ?        ?  2838.8672  26.8179          ?        ?      532.8        2.5       ?       ? 
1 1 1   28    3    2 o    683.7    2.9    0.0000   0.0000          ?        ?  4674.6167  39.5883          ?        ?      683.7        2.9       ?       ? 
1 1 1   28    3    3 o    727.1    3.0    0.0000   0.0000          ?        ?  5287.5977  44.0580          ?        ?      727.1        3.0       ?       ? 
1 1 1   28    3    4 o    489.8    2.4    0.0000   0.0000          ?        ?  2398.9258  23.6253          ?        ?      489.8        2.4       ?       ? 
1 1 1   28    3    5 o   1447.0    5.2    0.0000   0.0000          ?        ? 20939.0391 151.3296          ?        ?     1447.0        5.2       ?       ? 
1 1 1   28    3    6 o    741.1    3.0    0.0000   0.0000          ?        ?  5491.9243  44.6965          ?        ?      741.1        3.0       ?       ? 
1 1 1   28    3    7 o    187.7    2.6    0.0000   0.0000          ?        ?   352.4639   9.5778          ?        ?      187.7        2.6       ?       ? 
1 1 1   28    3    8 o     18.6    8.8    0.0000   0.0000          ?        ?   -11.4934   8.9393          ?        ?       18.6        8.8       ?       ? 
1 1 1   28    3    9 o   1465.2    5.3    0.0000   0.0000          ?        ? 21470.2891 154.5222          ?        ?     1465.2        5.3       ?       ? 
1 1 1   28    3   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    3   11 o   1094.3    4.1    0.0000   0.0000          ?        ? 11974.8350  88.7545          ?        ?     1094.3        4.1       ?       ? 
1 1 1   28    3   12 f   1362.9    4.8    0.0000   0.0000          ?        ? 18577.7871 132.1740          ?        ?     1362.9        4.8       ?       ? 
1 1 1   28    3   13 o   1581.8    5.5    0.0000   0.0000          ?        ? 25022.3867 174.3164          ?        ?     1581.8        5.5       ?       ? 
1 1 1   28    3   14 o   1523.0    5.5    0.0000   0.0000          ?        ? 23197.4902 167.2927          ?        ?     1523.0        5.5       ?       ? 
1 1 1   28    3   15 o    832.9    3.2    0.0000   0.0000          ?        ?  6937.5376  53.6358          ?        ?      832.9        3.2       ?       ? 
1 1 1   28    3   16 o    424.8    2.4    0.0000   0.0000          ?        ?  1804.4622  20.4327          ?        ?      424.8        2.4       ?       ? 
1 1 1   28    3   17 o    404.5    2.4    0.0000   0.0000          ?        ?  1635.8925  19.1556          ?        ?      404.5        2.4       ?       ? 
1 1 1   28    3   18 o   1061.6    3.8    0.0000   0.0000          ?        ? 11270.5449  81.7308          ?        ?     1061.6        3.8       ?       ? 
1 1 1   28    3   19 o    595.7    2.6    0.0000   0.0000          ?        ?  3548.2646  30.6490          ?        ?      595.7        2.6       ?       ? 
1 1 1   28    3   20 o   1279.9    4.6    0.0000   0.0000          ?        ? 16381.9111 117.4880          ?        ?     1279.9        4.6       ?       ? 
1 1 1   28    3   21 o    871.3    3.3    0.0000   0.0000          ?        ?  7592.0220  56.8284          ?        ?      871.3        3.3       ?       ? 
1 1 1   28    3   22 o    685.7    2.8    0.0000   0.0000          ?        ?  4701.4346  38.3113          ?        ?      685.7        2.8       ?       ? 
1 1 1   28    3   23 o    500.2    2.4    0.0000   0.0000          ?        ?  2502.3662  24.2638          ?        ?      500.2        2.4       ?       ? 
1 1 1   28    3   24 o   1332.5    5.0    0.0000   0.0000          ?        ? 17757.9258 132.8125          ?        ?     1332.5        5.0       ?       ? 
1 1 1   28    3   25 o    846.0    3.5    0.0000   0.0000          ?        ?  7157.1890  58.7440          ?        ?      846.0        3.5       ?       ? 
1 1 1   28    3   26 o    855.9    3.3    0.0000   0.0000          ?        ?  7326.3975  56.1899          ?        ?      855.9        3.3       ?       ? 
1 1 1   28    3   27 o    846.9    3.3    0.0000   0.0000          ?        ?  7173.1523  55.5514          ?        ?      846.9        3.3       ?       ? 
1 1 1   28    3   28 o    398.0    2.6    0.0000   0.0000          ?        ?  1584.1722  21.0712          ?        ?      398.0        2.6       ?       ? 
1 1 1   28    3   29 o   1061.5    4.1    0.0000   0.0000          ?        ? 11269.9062  86.2004          ?        ?     1061.5        4.1       ?       ? 
1 1 1   28    3   30 o    278.6    2.9    0.0000   0.0000          ?        ?   776.4423  15.9630          ?        ?      278.6        2.9       ?       ? 
1 1 1   28    3   31 o    391.6    2.9    0.0000   0.0000          ?        ?  1533.7289  22.9868          ?        ?      391.6        2.9       ?       ? 
1 1 1   28    3   32 o    278.9    3.7    0.0000   0.0000          ?        ?   777.7194  20.4327          ?        ?      278.9        3.7       ?       ? 
1 1 1   28    3   33 o    932.0    3.6    0.0000   0.0000          ?        ?  8687.0869  67.0448          ?        ?      932.0        3.6       ?       ? 
1 1 1   28    3   34 o    373.8    2.6    0.0000   0.0000          ?        ?  1397.0853  19.7942          ?        ?      373.8        2.6       ?       ? 
1 1 1   28    3   35 o    346.7    2.9    0.0000   0.0000          ?        ?  1202.3362  19.7942          ?        ?      346.7        2.9       ?       ? 
1 1 1   28    3   36 o    679.7    2.8    0.0000   0.0000          ?        ?  4620.3423  38.3113          ?        ?      679.7        2.8       ?       ? 
1 1 1   28    3   37 o    422.7    2.6    0.0000   0.0000          ?        ?  1787.2220  22.3483          ?        ?      422.7        2.6       ?       ? 
1 1 1   28    3   38 o    319.7    3.0    0.0000   0.0000          ?        ?  1022.2732  19.1556          ?        ?      319.7        3.0       ?       ? 
1 1 1   28    3   39 f    801.4    3.2    0.0000   0.0000          ?        ?  6423.5273  51.7203          ?        ?      801.4        3.2       ?       ? 
1 1 1   28    3   40 o    407.0    2.7    0.0000   0.0000          ?        ?  1656.3251  21.7097          ?        ?      407.0        2.7       ?       ? 
1 1 1   28    3   41 o    564.8    2.8    0.0000   0.0000          ?        ?  3190.6926  31.9261          ?        ?      564.8        2.8       ?       ? 
1 1 1   28    3   42 o    230.7    4.0    0.0000   0.0000          ?        ?   532.5270  18.5171          ?        ?      230.7        4.0       ?       ? 
1 1 1   28    3   43 o    227.2    3.8    0.0000   0.0000          ?        ?   516.5640  17.2401          ?        ?      227.2        3.8       ?       ? 
1 1 1   28    3   44 o    555.5    2.7    0.0000   0.0000          ?        ?  3085.9749  30.0105          ?        ?      555.5        2.7       ?       ? 
1 1 1   28    3   45 o    226.5    4.1    0.0000   0.0000          ?        ?   513.3714  18.5171          ?        ?      226.5        4.1       ?       ? 
1 1 1   28    3   46 o    623.3    2.9    0.0000   0.0000          ?        ?  3886.0425  36.3957          ?        ?      623.3        2.9       ?       ? 
1 1 1   28    3   47 o    660.0    2.9    0.0000   0.0000          ?        ?  4356.6328  37.6728          ?        ?      660.0        2.9       ?       ? 
1 1 1   28    3   48 o    115.4    7.2    0.0000   0.0000          ?        ?   133.4510  16.6016          ?        ?      115.4        7.2       ?       ? 
1 1 1   28    3   49 o    264.0    3.4    0.0000   0.0000          ?        ?   697.2656  17.8786          ?        ?      264.0        3.4       ?       ? 
1 1 1   28    3   50 o    156.1    5.5    0.0000   0.0000          ?        ?   243.9153  17.2401          ?        ?      156.1        5.5       ?       ? 
1 1 1   28    3   51 o     60.0   14.5    0.0000   0.0000          ?        ?    37.6728  17.2401          ?        ?       60.0       14.5       ?       ? 
1 1 1   28    3   52 o    359.3    3.0    0.0000   0.0000          ?        ?  1291.7292  21.7097          ?        ?      359.3        3.0       ?       ? 
1 1 1   28    3   53 o    189.3    4.7    0.0000   0.0000          ?        ?   358.8492  17.8786          ?        ?      189.3        4.7       ?       ? 
1 1 1   28    3   54 o    144.6    6.0    0.0000   0.0000          ?        ?   209.4351  17.2401          ?        ?      144.6        6.0       ?       ? 
1 1 1   28    3   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    3   56 o    521.6    2.6    0.0000   0.0000          ?        ?  2721.3792  27.4564          ?        ?      521.6        2.6       ?       ? 
1 1 1   28    3   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    3   58 o    235.4    4.2    0.0000   0.0000          ?        ?   554.8753  19.7942          ?        ?      235.4        4.2       ?       ? 
1 1 1   28    3   59 o    593.3    2.8    0.0000   0.0000          ?        ?  3521.4468  33.2031          ?        ?      593.3        2.8       ?       ? 
1 1 1   28    3   60 o     92.5   10.3    0.0000   0.0000          ?        ?    86.2004  19.1556          ?        ?       92.5       10.3       ?       ? 
1 1 1   28    3   61 o    203.1    4.9    0.0000   0.0000          ?        ?   413.1235  19.7942          ?        ?      203.1        4.9       ?       ? 
1 1 1   28    3   62 o    340.0    3.2    0.0000   0.0000          ?        ?  1157.0012  21.7097          ?        ?      340.0        3.2       ?       ? 
1 1 1   28    3   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    3   64 o    340.3    3.4    0.0000   0.0000          ?        ?  1158.9167  22.9868          ?        ?      340.3        3.4       ?       ? 
1 1 1   28    3   65 o    242.8    4.3    0.0000   0.0000          ?        ?   590.6325  21.0712          ?        ?      242.8        4.3       ?       ? 
1 1 1   28    3   66 o     21.2   10.7    0.0000   0.0000          ?        ?   -62.5751  20.4327          ?        ?       21.2       10.7       ?       ? 
1 1 1   28    3   67 o    174.3    6.4    0.0000   0.0000          ?        ?   305.2133  22.3483          ?        ?      174.3        6.4       ?       ? 
1 1 1   28    3   68 o     27.6   13.3    0.0000   0.0000          ?        ?   -29.3720  21.0712          ?        ?       27.6       13.3       ?       ? 
1 1 1   28    3   69 o     97.2   10.8    0.0000   0.0000          ?        ?    95.7782  21.0712          ?        ?       97.2       10.8       ?       ? 
1 1 1   28    3   70 o     90.2   12.4    0.0000   0.0000          ?        ?    83.0078  22.3483          ?        ?       90.2       12.4       ?       ? 
1 1 1   28    3   71 o     36.5   15.8    0.0000   0.0000          ?        ?    -1.2770  21.0712          ?        ?       36.5       15.8       ?       ? 
1 1 1   28    3   72 o     91.1   11.9    0.0000   0.0000          ?        ?    84.9234  21.7097          ?        ?       91.1       11.9       ?       ? 
1 1 1   28    3   73 f    126.9    9.1    0.0000   0.0000          ?        ?   163.4615  22.9868          ?        ?      126.9        9.1       ?       ? 
1 1 1   28    3   74 o    150.2    7.0    0.0000   0.0000          ?        ?   227.9522  21.0712          ?        ?      150.2        7.0       ?       ? 
1 1 1   28    4    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    4    1 o    323.7    2.1    0.0000   0.0000          ?        ?  1047.8141  13.4090          ?        ?      323.7        2.1       ?       ? 
1 1 1   28    4    2 o    310.8    2.2    0.0000   0.0000          ?        ?   966.0833  13.4090          ?        ?      310.8        2.2       ?       ? 
1 1 1   28    4    3 o    441.7    2.3    0.0000   0.0000          ?        ?  1950.6836  20.4327          ?        ?      441.7        2.3       ?       ? 
1 1 1   28    4    4 o    610.8    2.5    0.0000   0.0000          ?        ?  3730.8818  30.6490          ?        ?      610.8        2.5       ?       ? 
1 1 1   28    4    5 o    639.5    2.6    0.0000   0.0000          ?        ?  4089.0928  33.2031          ?        ?      639.5        2.6       ?       ? 
1 1 1   28    4    6 o    423.1    2.2    0.0000   0.0000          ?        ?  1790.4146  18.5171          ?        ?      423.1        2.2       ?       ? 
1 1 1   28    4    7 o    461.3    2.3    0.0000   0.0000          ?        ?  2128.1924  21.0712          ?        ?      461.3        2.3       ?       ? 
1 1 1   28    4    8 o   1298.0    4.5    0.0000   0.0000          ?        ? 16849.9473 116.8494          ?        ?     1298.0        4.5       ?       ? 
1 1 1   28    4    9 o   1121.0    4.0    0.0000   0.0000          ?        ? 12568.0215  88.7545          ?        ?     1121.0        4.0       ?       ? 
1 1 1   28    4   10 o   1340.1    4.7    0.0000   0.0000          ?        ? 17960.9746 125.1502          ?        ?     1340.1        4.7       ?       ? 
1 1 1   28    4   11 o   1501.8    5.2    0.0000   0.0000          ?        ? 22555.1367 155.1608          ?        ?     1501.8        5.2       ?       ? 
1 1 1   28    4   12 o    369.0    2.3    0.0000   0.0000          ?        ?  1361.9667  17.2401          ?        ?      369.0        2.3       ?       ? 
1 1 1   28    4   13 o    699.8    2.9    0.0000   0.0000          ?        ?  4896.8223  40.2269          ?        ?      699.8        2.9       ?       ? 
1 1 1   28    4   14 o    837.0    3.4    0.0000   0.0000          ?        ?  7006.4980  56.1899          ?        ?      837.0        3.4       ?       ? 
1 1 1   28    4   15 o    242.9    2.8    0.0000   0.0000          ?        ?   589.9940  13.4090          ?        ?      242.9        2.8       ?       ? 
1 1 1   28    4   16 o    548.5    2.7    0.0000   0.0000          ?        ?  3008.0754  30.0105          ?        ?      548.5        2.7       ?       ? 
1 1 1   28    4   17 o    453.8    2.5    0.0000   0.0000          ?        ?  2059.2322  22.3483          ?        ?      453.8        2.5       ?       ? 
1 1 1   28    4   18 o   1526.6    5.4    0.0000   0.0000          ?        ? 23307.9551 166.0156          ?        ?     1526.6        5.4       ?       ? 
1 1 1   28    4   19 o    883.4    3.6    0.0000   0.0000          ?        ?  7804.6504  63.2136          ?        ?      883.4        3.6       ?       ? 
1 1 1   28    4   20 o    963.7    3.8    0.0000   0.0000          ?        ?  9288.5742  72.7915          ?        ?      963.7        3.8       ?       ? 
1 1 1   28    4   21 o    221.3    3.3    0.0000   0.0000          ?        ?   489.7461  14.6860          ?        ?      221.3        3.3       ?       ? 
1 1 1   28    4   22 o    340.7    2.9    0.0000   0.0000          ?        ?  1160.8323  19.7942          ?        ?      340.7        2.9       ?       ? 
1 1 1   28    4   23 o    515.0    2.7    0.0000   0.0000          ?        ?  2652.4187  28.0950          ?        ?      515.0        2.7       ?       ? 
1 1 1   28    4   24 o   1546.6    5.8    0.0000   0.0000          ?        ? 23924.7656 179.4246          ?        ?     1546.6        5.8       ?       ? 
1 1 1   28    4   25 o   1083.1    5.0    0.0000   0.0000          ?        ? 11733.4736 107.2716          ?        ?     1083.1        5.0       ?       ? 
1 1 1   28    4   26 o    144.0    4.9    0.0000   0.0000          ?        ?   207.5195  14.0475          ?        ?      144.0        4.9       ?       ? 
1 1 1   28    4   27 o   1366.3    5.2    0.0000   0.0000          ?        ? 18671.6484 142.3903          ?        ?     1366.3        5.2       ?       ? 
1 1 1   28    4   28 o    548.2    2.8    0.0000   0.0000          ?        ?  3005.5215  30.6490          ?        ?      548.2        2.8       ?       ? 
1 1 1   28    4   29 o    607.0    3.2    0.0000   0.0000          ?        ?  3684.2698  38.3113          ?        ?      607.0        3.2       ?       ? 
1 1 1   28    4   30 o    954.8    3.8    0.0000   0.0000          ?        ?  9117.4502  73.4300          ?        ?      954.8        3.8       ?       ? 
1 1 1   28    4   31 o     21.8   10.9    0.0000   0.0000          ?        ?   -54.9129  19.7942          ?        ?       21.8       10.9       ?       ? 
1 1 1   28    4   32 o    443.5    2.7    0.0000   0.0000          ?        ?  1967.2852  23.6253          ?        ?      443.5        2.7       ?       ? 
1 1 1   28    4   33 o   1226.2    4.5    0.0000   0.0000          ?        ? 15037.1846 109.8257          ?        ?     1226.2        4.5       ?       ? 
1 1 1   28    4   34 o    352.0    3.2    0.0000   0.0000          ?        ?  1239.3705  22.3483          ?        ?      352.0        3.2       ?       ? 
1 1 1   28    4   35 o    483.9    2.8    0.0000   0.0000          ?        ?  2341.4590  26.8179          ?        ?      483.9        2.8       ?       ? 
1 1 1   28    4   36 o    239.0    3.7    0.0000   0.0000          ?        ?   571.4769  17.8786          ?        ?      239.0        3.7       ?       ? 
1 1 1   28    4   37 o    452.6    2.8    0.0000   0.0000          ?        ?  2049.0159  24.9023          ?        ?      452.6        2.8       ?       ? 
1 1 1   28    4   38 o    567.1    2.8    0.0000   0.0000          ?        ?  3216.2334  31.2876          ?        ?      567.1        2.8       ?       ? 
1 1 1   28    4   39 o    639.7    3.0    0.0000   0.0000          ?        ?  4092.2852  38.3113          ?        ?      639.7        3.0       ?       ? 
1 1 1   28    4   40 o    643.0    2.9    0.0000   0.0000          ?        ?  4135.7046  37.6728          ?        ?      643.0        2.9       ?       ? 
1 1 1   28    4   41 o    360.1    3.0    0.0000   0.0000          ?        ?  1296.8374  21.7097          ?        ?      360.1        3.0       ?       ? 
1 1 1   28    4   42 f    528.8    2.8    0.0000   0.0000          ?        ?  2796.7246  30.0105          ?        ?      528.8        2.8       ?       ? 
1 1 1   28    4   43 o     99.7    9.0    0.0000   0.0000          ?        ?    99.6094  17.8786          ?        ?       99.7        9.0       ?       ? 
1 1 1   28    4   44 o    263.4    3.6    0.0000   0.0000          ?        ?   694.0730  19.1556          ?        ?      263.4        3.6       ?       ? 
1 1 1   28    4   45 o    315.5    3.2    0.0000   0.0000          ?        ?   995.4552  20.4327          ?        ?      315.5        3.2       ?       ? 
1 1 1   28    4   46 o    360.9    3.0    0.0000   0.0000          ?        ?  1302.5841  21.7097          ?        ?      360.9        3.0       ?       ? 
1 1 1   28    4   47 o    297.4    3.2    0.0000   0.0000          ?        ?   884.9910  19.1556          ?        ?      297.4        3.2       ?       ? 
1 1 1   28    4   48 o    190.2    4.7    0.0000   0.0000          ?        ?   362.0418  17.8786          ?        ?      190.2        4.7       ?       ? 
1 1 1   28    4   49 o    303.0    3.3    0.0000   0.0000          ?        ?   918.1941  19.7942          ?        ?      303.0        3.3       ?       ? 
1 1 1   28    4   50 o    325.3    3.0    0.0000   0.0000          ?        ?  1058.6688  19.7942          ?        ?      325.3        3.0       ?       ? 
1 1 1   28    4   51 o    277.2    3.6    0.0000   0.0000          ?        ?   768.7800  19.7942          ?        ?      277.2        3.6       ?       ? 
1 1 1   28    4   52 o    292.3    3.3    0.0000   0.0000          ?        ?   854.9804  19.1556          ?        ?      292.3        3.3       ?       ? 
1 1 1   28    4   53 o    219.2    4.4    0.0000   0.0000          ?        ?   480.8068  19.1556          ?        ?      219.2        4.4       ?       ? 
1 1 1   28    4   54 f    304.0    3.3    0.0000   0.0000          ?        ?   924.5793  19.7942          ?        ?      304.0        3.3       ?       ? 
1 1 1   28    4   55 o    235.7    3.9    0.0000   0.0000          ?        ?   556.1523  18.5171          ?        ?      235.7        3.9       ?       ? 
1 1 1   28    4   56 o    257.3    3.7    0.0000   0.0000          ?        ?   662.7855  19.1556          ?        ?      257.3        3.7       ?       ? 
1 1 1   28    4   57 o    114.8    8.1    0.0000   0.0000          ?        ?   132.1740  18.5171          ?        ?      114.8        8.1       ?       ? 
1 1 1   28    4   58 o    139.1    6.7    0.0000   0.0000          ?        ?   194.1106  18.5171          ?        ?      139.1        6.7       ?       ? 
1 1 1   28    4   59 o    557.7    2.7    0.0000   0.0000          ?        ?  3112.1543  30.0105          ?        ?      557.7        2.7       ?       ? 
1 1 1   28    4   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    4   61 o    303.5    3.5    0.0000   0.0000          ?        ?   922.0252  21.0712          ?        ?      303.5        3.5       ?       ? 
1 1 1   28    4   62 o     19.2    9.7    0.0000   0.0000          ?        ?   -69.5989  19.1556          ?        ?       19.2        9.7       ?       ? 
1 1 1   28    4   63 o    102.9    9.3    0.0000   0.0000          ?        ?   106.6331  19.1556          ?        ?      102.9        9.3       ?       ? 
1 1 1   28    4   64 o    183.6    5.4    0.0000   0.0000          ?        ?   337.7780  19.7942          ?        ?      183.6        5.4       ?       ? 
1 1 1   28    4   65 o     98.0   10.4    0.0000   0.0000          ?        ?    97.0553  20.4327          ?        ?       98.0       10.4       ?       ? 
1 1 1   28    4   66 o     30.7   14.2    0.0000   0.0000          ?        ?   -15.9630  20.4327          ?        ?       30.7       14.2       ?       ? 
1 1 1   28    4   67 o    270.5    3.8    0.0000   0.0000          ?        ?   733.0228  20.4327          ?        ?      270.5        3.8       ?       ? 
1 1 1   28    4   68 o     31.7   14.5    0.0000   0.0000          ?        ?   -12.7704  20.4327          ?        ?       31.7       14.5       ?       ? 
1 1 1   28    4   69 o    127.6    8.0    0.0000   0.0000          ?        ?   164.1001  20.4327          ?        ?      127.6        8.0       ?       ? 
1 1 1   28    4   70 o    115.2    8.9    0.0000   0.0000          ?        ?   134.0895  20.4327          ?        ?      115.2        8.9       ?       ? 
1 1 1   28    4   71 o     45.0   16.6    0.0000   0.0000          ?        ?    17.2401  19.7942          ?        ?       45.0       16.6       ?       ? 
1 1 1   28    4   72 o    229.6    4.7    0.0000   0.0000          ?        ?   529.3344  21.7097          ?        ?      229.6        4.7       ?       ? 
1 1 1   28    4   73 o    105.9   10.0    0.0000   0.0000          ?        ?   114.2954  21.0712          ?        ?      105.9       10.0       ?       ? 
1 1 1   28    5    0 o   1553.9    7.4 24149.5273 231.1448 24149.5273 231.1448 24149.5273 231.1448     1553.9      7.4     1553.9        7.4     0.0     0.0 
1 1 1   28    5    1 o   1926.3    6.3    0.0000   0.0000          ?        ? 37110.8750 243.9153          ?        ?     1926.3        6.3       ?       ? 
1 1 1   28    5    2 o   1547.6    5.4    0.0000   0.0000          ?        ? 23952.8613 167.9312          ?        ?     1547.6        5.4       ?       ? 
1 1 1   28    5    3 o   1181.2    4.2    0.0000   0.0000          ?        ? 13952.9746  98.9709          ?        ?     1181.2        4.2       ?       ? 
1 1 1   28    5    4 o   1861.2    6.1    0.0000   0.0000          ?        ? 34644.2695 227.9522          ?        ?     1861.2        6.1       ?       ? 
1 1 1   28    5    5 o    849.7    3.2    0.0000   0.0000          ?        ?  7219.7637  53.6358          ?        ?      849.7        3.2       ?       ? 
1 1 1   28    5    6 o   1459.6    4.9    0.0000   0.0000          ?        ? 21306.1895 143.6674          ?        ?     1459.6        4.9       ?       ? 
1 1 1   28    5    7 o   1513.2    5.1    0.0000   0.0000          ?        ? 22901.2168 153.8837          ?        ?     1513.2        5.1       ?       ? 
1 1 1   28    5    8 o    572.8    2.6    0.0000   0.0000          ?        ?  3280.7241  29.3720          ?        ?      572.8        2.6       ?       ? 
1 1 1   28    5    9 o   1385.3    4.8    0.0000   0.0000          ?        ? 19192.6836 133.4510          ?        ?     1385.3        4.8       ?       ? 
1 1 1   28    5   10 o    834.8    3.2    0.0000   0.0000          ?        ?  6969.4634  52.9973          ?        ?      834.8        3.2       ?       ? 
1 1 1   28    5   11 o    737.7    3.0    0.0000   0.0000          ?        ?  5442.1196  44.0580          ?        ?      737.7        3.0       ?       ? 
1 1 1   28    5   12 o    974.2    3.6    0.0000   0.0000          ?        ?  9491.6240  69.5989          ?        ?      974.2        3.6       ?       ? 
1 1 1   28    5   13 o    794.5    3.1    0.0000   0.0000          ?        ?  6313.0635  49.8047          ?        ?      794.5        3.1       ?       ? 
1 1 1   28    5   14 o    946.0    3.6    0.0000   0.0000          ?        ?  8948.8809  68.9603          ?        ?      946.0        3.6       ?       ? 
1 1 1   28    5   15 f    276.8    2.5    0.0000   0.0000          ?        ?   766.2260  14.0475          ?        ?      276.8        2.5       ?       ? 
1 1 1   28    5   16 o    806.9    3.2    0.0000   0.0000          ?        ?  6511.6436  51.7203          ?        ?      806.9        3.2       ?       ? 
1 1 1   28    5   17 o    976.5    3.7    0.0000   0.0000          ?        ?  9535.6816  71.5144          ?        ?      976.5        3.7       ?       ? 
1 1 1   28    5   18 o    963.9    3.6    0.0000   0.0000          ?        ?  9292.4053  70.2374          ?        ?      963.9        3.6       ?       ? 
1 1 1   28    5   19 o   1020.1    3.8    0.0000   0.0000          ?        ? 10405.9863  77.2611          ?        ?     1020.1        3.8       ?       ? 
1 1 1   28    5   20 o   1043.2    3.9    0.0000   0.0000          ?        ? 10882.9629  80.4537          ?        ?     1043.2        3.9       ?       ? 
1 1 1   28    5   21 o    960.4    3.7    0.0000   0.0000          ?        ?  9223.4453  71.5144          ?        ?      960.4        3.7       ?       ? 
1 1 1   28    5   22 o    301.5    2.4    0.0000   0.0000          ?        ?   909.2548  14.6860          ?        ?      301.5        2.4       ?       ? 
1 1 1   28    5   23 o    301.6    2.8    0.0000   0.0000          ?        ?   909.8933  16.6016          ?        ?      301.6        2.8       ?       ? 
1 1 1   28    5   24 f    207.0    3.9    0.0000   0.0000          ?        ?   428.4480  15.9630          ?        ?      207.0        3.9       ?       ? 
1 1 1   28    5   25 o   1045.3    4.1    0.0000   0.0000          ?        ? 10928.2979  86.2004          ?        ?     1045.3        4.1       ?       ? 
1 1 1   28    5   26 o    440.9    2.6    0.0000   0.0000          ?        ?  1944.2983  22.9868          ?        ?      440.9        2.6       ?       ? 
1 1 1   28    5   27 o    270.6    3.3    0.0000   0.0000          ?        ?   732.3843  17.8786          ?        ?      270.6        3.3       ?       ? 
1 1 1   28    5   28 o   1727.8    6.1    0.0000   0.0000          ?        ? 29859.1855 210.7121          ?        ?     1727.8        6.1       ?       ? 
1 1 1   28    5   29 o    822.2    3.4    0.0000   0.0000          ?        ?  6760.6675  55.5514          ?        ?      822.2        3.4       ?       ? 
1 1 1   28    5   30 f    351.6    2.6    0.0000   0.0000          ?        ?  1236.1779  18.5171          ?        ?      351.6        2.6       ?       ? 
1 1 1   28    5   31 o    588.9    2.8    0.0000   0.0000          ?        ?  3468.4495  32.5646          ?        ?      588.9        2.8       ?       ? 
1 1 1   28    5   32 o    871.6    3.5    0.0000   0.0000          ?        ?  7597.7690  60.6596          ?        ?      871.6        3.5       ?       ? 
1 1 1   28    5   33 o    917.4    3.7    0.0000   0.0000          ?        ?  8416.9922  67.0448          ?        ?      917.4        3.7       ?       ? 
1 1 1   28    5   34 o    430.8    2.7    0.0000   0.0000          ?        ?  1856.1825  23.6253          ?        ?      430.8        2.7       ?       ? 
1 1 1   28    5   35 o    599.3    2.7    0.0000   0.0000          ?        ?  3592.3225  31.9261          ?        ?      599.3        2.7       ?       ? 
1 1 1   28    5   36 o    599.5    2.7    0.0000   0.0000          ?        ?  3594.2383  31.9261          ?        ?      599.5        2.7       ?       ? 
1 1 1   28    5   37 o    341.3    3.0    0.0000   0.0000          ?        ?  1164.6635  20.4327          ?        ?      341.3        3.0       ?       ? 
1 1 1   28    5   38 o    378.9    2.8    0.0000   0.0000          ?        ?  1436.0352  21.0712          ?        ?      378.9        2.8       ?       ? 
1 1 1   28    5   39 o    126.0    6.6    0.0000   0.0000          ?        ?   158.9919  16.6016          ?        ?      126.0        6.6       ?       ? 
1 1 1   28    5   40 o    210.2    3.8    0.0000   0.0000          ?        ?   441.8569  15.9630          ?        ?      210.2        3.8       ?       ? 
1 1 1   28    5   41 o    300.9    3.1    0.0000   0.0000          ?        ?   905.4237  18.5171          ?        ?      300.9        3.1       ?       ? 
1 1 1   28    5   42 o    313.0    2.9    0.0000   0.0000          ?        ?   980.1307  17.8786          ?        ?      313.0        2.9       ?       ? 
1 1 1   28    5   43 o    386.3    2.6    0.0000   0.0000          ?        ?  1492.8635  20.4327          ?        ?      386.3        2.6       ?       ? 
1 1 1   28    5   44 o    102.9    8.1    0.0000   0.0000          ?        ?   105.9946  16.6016          ?        ?      102.9        8.1       ?       ? 
1 1 1   28    5   45 f    355.3    3.0    0.0000   0.0000          ?        ?  1262.3572  21.0712          ?        ?      355.3        3.0       ?       ? 
1 1 1   28    5   46 o    232.8    3.7    0.0000   0.0000          ?        ?   542.1049  17.2401          ?        ?      232.8        3.7       ?       ? 
1 1 1   28    5   47 o    245.6    3.6    0.0000   0.0000          ?        ?   603.4030  17.8786          ?        ?      245.6        3.6       ?       ? 
1 1 1   28    5   48 o    240.7    3.7    0.0000   0.0000          ?        ?   579.7776  17.8786          ?        ?      240.7        3.7       ?       ? 
1 1 1   28    5   49 o     25.3   12.1    0.0000   0.0000          ?        ?   -23.6253  17.2401          ?        ?       25.3       12.1       ?       ? 
1 1 1   28    5   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    5   51 o    224.0    3.8    0.0000   0.0000          ?        ?   501.8780  17.2401          ?        ?      224.0        3.8       ?       ? 
1 1 1   28    5   52 o    237.6    3.8    0.0000   0.0000          ?        ?   565.0916  17.8786          ?        ?      237.6        3.8       ?       ? 
1 1 1   28    5   53 o    173.1    5.2    0.0000   0.0000          ?        ?   300.1052  17.8786          ?        ?      173.1        5.2       ?       ? 
1 1 1   28    5   54 o    328.2    3.0    0.0000   0.0000          ?        ?  1077.8246  19.7942          ?        ?      328.2        3.0       ?       ? 
1 1 1   28    5   55 o     61.9   14.7    0.0000   0.0000          ?        ?    40.2269  17.8786          ?        ?       61.9       14.7       ?       ? 
1 1 1   28    5   56 o    143.9    6.4    0.0000   0.0000          ?        ?   207.5195  18.5171          ?        ?      143.9        6.4       ?       ? 
1 1 1   28    5   57 o    248.0    4.0    0.0000   0.0000          ?        ?   615.5349  19.7942          ?        ?      248.0        4.0       ?       ? 
1 1 1   28    5   58 o    111.6    8.6    0.0000   0.0000          ?        ?   125.1502  19.1556          ?        ?      111.6        8.6       ?       ? 
1 1 1   28    5   59 o    318.8    3.3    0.0000   0.0000          ?        ?  1017.1650  21.0712          ?        ?      318.8        3.3       ?       ? 
1 1 1   28    5   60 o    258.4    3.8    0.0000   0.0000          ?        ?   668.5321  19.7942          ?        ?      258.4        3.8       ?       ? 
1 1 1   28    5   61 o     51.7   16.5    0.0000   0.0000          ?        ?    26.8179  19.1556          ?        ?       51.7       16.5       ?       ? 
1 1 1   28    5   62 o     94.2   10.2    0.0000   0.0000          ?        ?    89.3930  19.1556          ?        ?       94.2       10.2       ?       ? 
1 1 1   28    5   63 o    187.9    5.4    0.0000   0.0000          ?        ?   353.7410  20.4327          ?        ?      187.9        5.4       ?       ? 
1 1 1   28    5   64 o    298.4    3.6    0.0000   0.0000          ?        ?   891.3762  21.7097          ?        ?      298.4        3.6       ?       ? 
1 1 1   28    5   65 o    196.6    5.4    0.0000   0.0000          ?        ?   387.5826  21.0712          ?        ?      196.6        5.4       ?       ? 
1 1 1   28    5   66 o    132.4    7.7    0.0000   0.0000          ?        ?   176.2320  20.4327          ?        ?      132.4        7.7       ?       ? 
1 1 1   28    5   67 o     89.8   11.4    0.0000   0.0000          ?        ?    81.7308  20.4327          ?        ?       89.8       11.4       ?       ? 
1 1 1   28    5   68 o     95.5   11.0    0.0000   0.0000          ?        ?    92.5856  21.0712          ?        ?       95.5       11.0       ?       ? 
1 1 1   28    5   69 o     62.7   16.2    0.0000   0.0000          ?        ?    42.1424  20.4327          ?        ?       62.7       16.2       ?       ? 
1 1 1   28    5   70 f    135.0    7.6    0.0000   0.0000          ?        ?   183.8942  20.4327          ?        ?      135.0        7.6       ?       ? 
1 1 1   28    5   71 f     64.2   16.4    0.0000   0.0000          ?        ?    44.6965  21.0712          ?        ?       64.2       16.4       ?       ? 
1 1 1   28    5   72 o     39.4   16.0    0.0000   0.0000          ?        ?     7.6623  19.7942          ?        ?       39.4       16.0       ?       ? 
1 1 1   28    5   73 o     25.2   12.3    0.0000   0.0000          ?        ?   -33.8416  19.7942          ?        ?       25.2       12.3       ?       ? 
1 1 1   28    6    0 o    273.5    3.2  748.3474  17.2401   748.3474  17.2401   748.3474  17.2401      273.5      3.2      273.5        3.2     0.0     0.0 
1 1 1   28    6    1 o    964.6    3.5    0.0000   0.0000          ?        ?  9305.8145  67.6833          ?        ?      964.6        3.5       ?       ? 
1 1 1   28    6    2 o    461.9    2.3    0.0000   0.0000          ?        ?  2133.3008  21.0712          ?        ?      461.9        2.3       ?       ? 
1 1 1   28    6    3 o   1291.9    4.6    0.0000   0.0000          ?        ? 16691.5938 118.1265          ?        ?     1291.9        4.6       ?       ? 
1 1 1   28    6    4 o   1376.0    4.8    0.0000   0.0000          ?        ? 18935.9980 132.1740          ?        ?     1376.0        4.8       ?       ? 
1 1 1   28    6    5 o   1455.4    5.0    0.0000   0.0000          ?        ? 21184.8711 146.2215          ?        ?     1455.4        5.0       ?       ? 
1 1 1   28    6    6 o   1270.6    4.5    0.0000   0.0000          ?        ? 16145.0195 113.6568          ?        ?     1270.6        4.5       ?       ? 
1 1 1   28    6    7 o   2045.3    6.9    0.0000   0.0000          ?        ? 41838.4922 280.9495          ?        ?     2045.3        6.9       ?       ? 
1 1 1   28    6    8 o    422.5    2.3    0.0000   0.0000          ?        ?  1785.3065  19.7942          ?        ?      422.5        2.3       ?       ? 
1 1 1   28    6    9 f    578.1    2.5    0.0000   0.0000          ?        ?  3342.0225  28.7335          ?        ?      578.1        2.5       ?       ? 
1 1 1   28    6   10 o   1073.0    3.8    0.0000   0.0000          ?        ? 11513.8213  81.7308          ?        ?     1073.0        3.8       ?       ? 
1 1 1   28    6   11 o    406.5    2.2    0.0000   0.0000          ?        ?  1652.4939  17.8786          ?        ?      406.5        2.2       ?       ? 
1 1 1   28    6   12 o   1006.1    3.6    0.0000   0.0000          ?        ? 10122.4834  72.7915          ?        ?     1006.1        3.6       ?       ? 
1 1 1   28    6   13 f    973.3    3.6    0.0000   0.0000          ?        ?  9473.7451  70.8759          ?        ?      973.3        3.6       ?       ? 
1 1 1   28    6   14 o   1423.9    5.3    0.0000   0.0000          ?        ? 20276.8926 151.3296          ?        ?     1423.9        5.3       ?       ? 
1 1 1   28    6   15 o    600.2    2.7    0.0000   0.0000          ?        ?  3602.5391  32.5646          ?        ?      600.2        2.7       ?       ? 
1 1 1   28    6   16 o   1050.1    4.0    0.0000   0.0000          ?        ? 11027.9072  83.6463          ?        ?     1050.1        4.0       ?       ? 
1 1 1   28    6   17 o   1786.1    6.0    0.0000   0.0000          ?        ? 31908.2031 215.1818          ?        ?     1786.1        6.0       ?       ? 
1 1 1   28    6   18 o    701.9    3.1    0.0000   0.0000          ?        ?  4926.8325  44.0580          ?        ?      701.9        3.1       ?       ? 
1 1 1   28    6   19 o    596.6    2.8    0.0000   0.0000          ?        ?  3559.1196  33.2031          ?        ?      596.6        2.8       ?       ? 
1 1 1   28    6   20 o   1479.3    5.6    0.0000   0.0000          ?        ? 21887.2441 166.0156          ?        ?     1479.3        5.6       ?       ? 
1 1 1   28    6   21 o    753.4    3.1    0.0000   0.0000          ?        ?  5677.0957  47.2506          ?        ?      753.4        3.1       ?       ? 
1 1 1   28    6   22 o   1130.9    4.5    0.0000   0.0000          ?        ? 12789.5879 101.5249          ?        ?     1130.9        4.5       ?       ? 
1 1 1   28    6   23 o    326.2    3.0    0.0000   0.0000          ?        ?  1064.4155  19.7942          ?        ?      326.2        3.0       ?       ? 
1 1 1   28    6   24 o     42.0   14.4    0.0000   0.0000          ?        ?    15.9630  14.6860          ?        ?       42.0       14.4       ?       ? 
1 1 1   28    6   25 o   1158.2    4.2    0.0000   0.0000          ?        ? 13415.9785  98.3323          ?        ?     1158.2        4.2       ?       ? 
1 1 1   28    6   26 f    420.1    2.7    0.0000   0.0000          ?        ?  1764.8738  22.9868          ?        ?      420.1        2.7       ?       ? 
1 1 1   28    6   27 o    890.7    3.5    0.0000   0.0000          ?        ?  7933.6313  63.2136          ?        ?      890.7        3.5       ?       ? 
1 1 1   28    6   28 o    264.1    2.9    0.0000   0.0000          ?        ?   697.2656  15.3245          ?        ?      264.1        2.9       ?       ? 
1 1 1   28    6   29 f    439.6    2.9    0.0000   0.0000          ?        ?  1932.8051  25.5409          ?        ?      439.6        2.9       ?       ? 
1 1 1   28    6   30 o    582.3    2.6    0.0000   0.0000          ?        ?  3390.5498  30.0105          ?        ?      582.3        2.6       ?       ? 
1 1 1   28    6   31 o    287.9    3.0    0.0000   0.0000          ?        ?   828.8011  17.2401          ?        ?      287.9        3.0       ?       ? 
1 1 1   28    6   32 o    460.0    2.6    0.0000   0.0000          ?        ?  2116.0605  23.6253          ?        ?      460.0        2.6       ?       ? 
1 1 1   28    6   33 o    670.9    3.0    0.0000   0.0000          ?        ?  4500.9390  39.5883          ?        ?      670.9        3.0       ?       ? 
1 1 1   28    6   34 o    480.8    2.7    0.0000   0.0000          ?        ?  2311.4482  25.5409          ?        ?      480.8        2.7       ?       ? 
1 1 1   28    6   35 o    318.4    3.1    0.0000   0.0000          ?        ?  1013.9724  19.7942          ?        ?      318.4        3.1       ?       ? 
1 1 1   28    6   36 o    743.6    3.1    0.0000   0.0000          ?        ?  5529.5972  45.9736          ?        ?      743.6        3.1       ?       ? 
1 1 1   28    6   37 f    715.3    2.9    0.0000   0.0000          ?        ?  5117.1123  41.5039          ?        ?      715.3        2.9       ?       ? 
1 1 1   28    6   38 o    275.4    3.4    0.0000   0.0000          ?        ?   758.5637  18.5171          ?        ?      275.4        3.4       ?       ? 
1 1 1   28    6   39 o    677.7    3.0    0.0000   0.0000          ?        ?  4594.1631  40.8654          ?        ?      677.7        3.0       ?       ? 
1 1 1   28    6   40 o    953.9    3.5    0.0000   0.0000          ?        ?  9102.1260  67.0448          ?        ?      953.9        3.5       ?       ? 
1 1 1   28    6   41 o    262.1    3.4    0.0000   0.0000          ?        ?   687.0493  17.8786          ?        ?      262.1        3.4       ?       ? 
1 1 1   28    6   42 o    580.0    2.8    0.0000   0.0000          ?        ?  3364.3706  32.5646          ?        ?      580.0        2.8       ?       ? 
1 1 1   28    6   43 o    106.8    7.8    0.0000   0.0000          ?        ?   114.2954  16.6016          ?        ?      106.8        7.8       ?       ? 
1 1 1   28    6   44 o    559.4    2.7    0.0000   0.0000          ?        ?  3130.0332  30.6490          ?        ?      559.4        2.7       ?       ? 
1 1 1   28    6   45 o    202.4    4.4    0.0000   0.0000          ?        ?   409.9309  17.8786          ?        ?      202.4        4.4       ?       ? 
1 1 1   28    6   46 o     71.3   11.6    0.0000   0.0000          ?        ?    51.0817  16.6016          ?        ?       71.3       11.6       ?       ? 
1 1 1   28    6   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    6   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    6   49 o    268.8    3.4    0.0000   0.0000          ?        ?   722.8065  18.5171          ?        ?      268.8        3.4       ?       ? 
1 1 1   28    6   50 o    250.5    3.7    0.0000   0.0000          ?        ?   627.6667  18.5171          ?        ?      250.5        3.7       ?       ? 
1 1 1   28    6   51 o    530.1    2.7    0.0000   0.0000          ?        ?  2810.7722  28.7335          ?        ?      530.1        2.7       ?       ? 
1 1 1   28    6   52 f     26.6   12.5    0.0000   0.0000          ?        ?   -19.1556  17.2401          ?        ?       26.6       12.5       ?       ? 
1 1 1   28    6   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    6   54 o    198.2    4.7    0.0000   0.0000          ?        ?   393.3293  18.5171          ?        ?      198.2        4.7       ?       ? 
1 1 1   28    6   55 o    273.0    3.6    0.0000   0.0000          ?        ?   745.7933  19.7942          ?        ?      273.0        3.6       ?       ? 
1 1 1   28    6   56 o    160.1    5.8    0.0000   0.0000          ?        ?   256.6857  18.5171          ?        ?      160.1        5.8       ?       ? 
1 1 1   28    6   57 o    518.3    2.9    0.0000   0.0000          ?        ?  2688.1760  30.0105          ?        ?      518.3        2.9       ?       ? 
1 1 1   28    6   58 o    148.2    6.5    0.0000   0.0000          ?        ?   220.2900  19.1556          ?        ?      148.2        6.5       ?       ? 
1 1 1   28    6   59 o     42.5   16.4    0.0000   0.0000          ?        ?    12.1319  19.7942          ?        ?       42.5       16.4       ?       ? 
1 1 1   28    6   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    6   61 o    125.5    8.4    0.0000   0.0000          ?        ?   158.3534  21.0712          ?        ?      125.5        8.4       ?       ? 
1 1 1   28    6   62 o    581.5    2.9    0.0000   0.0000          ?        ?  3384.1646  33.8416          ?        ?      581.5        2.9       ?       ? 
1 1 1   28    6   63 o     19.8   10.1    0.0000   0.0000          ?        ?   -74.0685  20.4327          ?        ?       19.8       10.1       ?       ? 
1 1 1   28    6   64 o    272.7    4.1    0.0000   0.0000          ?        ?   744.5162  22.3483          ?        ?      272.7        4.1       ?       ? 
1 1 1   28    6   65 o     85.8   11.9    0.0000   0.0000          ?        ?    74.7070  20.4327          ?        ?       85.8       11.9       ?       ? 
1 1 1   28    6   66 f     93.9   11.2    0.0000   0.0000          ?        ?    89.3930  21.0712          ?        ?       93.9       11.2       ?       ? 
1 1 1   28    6   67 o    152.5    6.5    0.0000   0.0000          ?        ?   233.6989  19.7942          ?        ?      152.5        6.5       ?       ? 
1 1 1   28    6   68 f    160.8    6.4    0.0000   0.0000          ?        ?   259.8783  20.4327          ?        ?      160.8        6.4       ?       ? 
1 1 1   28    6   69 o     58.1   17.0    0.0000   0.0000          ?        ?    35.7572  21.0712          ?        ?       58.1       17.0       ?       ? 
1 1 1   28    6   70 o    205.9    5.3    0.0000   0.0000          ?        ?   425.8939  21.7097          ?        ?      205.9        5.3       ?       ? 
1 1 1   28    6   71 o     35.5   15.4    0.0000   0.0000          ?        ?    -1.9156  20.4327          ?        ?       35.5       15.4       ?       ? 
1 1 1   28    6   72 o    257.4    4.1    0.0000   0.0000          ?        ?   664.7010  21.0712          ?        ?      257.4        4.1       ?       ? 
1 1 1   28    7    0 o   1646.7    7.8 27119.9277 257.3242 27119.9277 257.3242 27119.9277 257.3242     1646.7      7.8     1646.7        7.8     0.0     0.0 
1 1 1   28    7    1 o   1322.7    4.7    0.0000   0.0000          ?        ? 17495.4922 123.2347          ?        ?     1322.7        4.7       ?       ? 
1 1 1   28    7    2 o    983.6    3.6    0.0000   0.0000          ?        ?  9675.5186  70.2374          ?        ?      983.6        3.6       ?       ? 
1 1 1   28    7    3 o   1032.5    3.8    0.0000   0.0000          ?        ? 10662.0342  77.8996          ?        ?     1032.5        3.8       ?       ? 
1 1 1   28    7    4 o   1222.3    4.3    0.0000   0.0000          ?        ? 14941.4062 104.0790          ?        ?     1222.3        4.3       ?       ? 
1 1 1   28    7    5 o   1117.9    3.9    0.0000   0.0000          ?        ? 12497.7842  88.1160          ?        ?     1117.9        3.9       ?       ? 
1 1 1   28    7    6 o   1138.8    4.1    0.0000   0.0000          ?        ? 12969.6514  93.2242          ?        ?     1138.8        4.1       ?       ? 
1 1 1   28    7    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    7    8 o    869.0    3.2    0.0000   0.0000          ?        ?  7552.4341  55.5514          ?        ?      869.0        3.2       ?       ? 
1 1 1   28    7    9 o    108.4    4.1    0.0000   0.0000          ?        ?   117.4880   8.9393          ?        ?      108.4        4.1       ?       ? 
1 1 1   28    7   10 o   1441.1    5.0    0.0000   0.0000          ?        ? 20768.5547 143.0288          ?        ?     1441.1        5.0       ?       ? 
1 1 1   28    7   11 o    726.0    2.8    0.0000   0.0000          ?        ?  5271.6343  40.8654          ?        ?      726.0        2.8       ?       ? 
1 1 1   28    7   12 o    951.8    3.5    0.0000   0.0000          ?        ?  9059.3447  67.0448          ?        ?      951.8        3.5       ?       ? 
1 1 1   28    7   13 o    941.3    3.7    0.0000   0.0000          ?        ?  8861.4033  69.5989          ?        ?      941.3        3.7       ?       ? 
1 1 1   28    7   14 o   1056.1    3.7    0.0000   0.0000          ?        ? 11154.9727  78.5382          ?        ?     1056.1        3.7       ?       ? 
1 1 1   28    7   15 o   1659.8    5.8    0.0000   0.0000          ?        ? 27554.1230 190.9180          ?        ?     1659.8        5.8       ?       ? 
1 1 1   28    7   16 o    754.0    3.1    0.0000   0.0000          ?        ?  5684.7578  47.2506          ?        ?      754.0        3.1       ?       ? 
1 1 1   28    7   17 o    167.2    4.6    0.0000   0.0000          ?        ?   279.6725  15.3245          ?        ?      167.2        4.6       ?       ? 
1 1 1   28    7   18 o    914.5    3.6    0.0000   0.0000          ?        ?  8362.7178  65.1292          ?        ?      914.5        3.6       ?       ? 
1 1 1   28    7   19 o   1555.5    5.3    0.0000   0.0000          ?        ? 24199.9688 165.3771          ?        ?     1555.5        5.3       ?       ? 
1 1 1   28    7   20 o    176.3    3.4    0.0000   0.0000          ?        ?   310.9600  12.1319          ?        ?      176.3        3.4       ?       ? 
1 1 1   28    7   21 o   1065.8    3.9    0.0000   0.0000          ?        ? 11359.9385  83.6463          ?        ?     1065.8        3.9       ?       ? 
1 1 1   28    7   22 o    742.0    3.2    0.0000   0.0000          ?        ?  5506.6108  47.8891          ?        ?      742.0        3.2       ?       ? 
1 1 1   28    7   23 o   1345.0    4.9    0.0000   0.0000          ?        ? 18093.7871 130.8969          ?        ?     1345.0        4.9       ?       ? 
1 1 1   28    7   24 o   1075.9    4.1    0.0000   0.0000          ?        ? 11577.6738  87.4775          ?        ?     1075.9        4.1       ?       ? 
1 1 1   28    7   25 o   1021.1    3.9    0.0000   0.0000          ?        ? 10426.4199  79.8152          ?        ?     1021.1        3.9       ?       ? 
1 1 1   28    7   26 o   1643.1    6.0    0.0000   0.0000          ?        ? 27005.6328 198.5802          ?        ?     1643.1        6.0       ?       ? 
1 1 1   28    7   27 o    357.0    2.8    0.0000   0.0000          ?        ?  1274.4893  19.7942          ?        ?      357.0        2.8       ?       ? 
1 1 1   28    7   28 o    759.1    3.1    0.0000   0.0000          ?        ?  5763.2959  46.6121          ?        ?      759.1        3.1       ?       ? 
1 1 1   28    7   29 o    252.4    3.4    0.0000   0.0000          ?        ?   637.2446  17.2401          ?        ?      252.4        3.4       ?       ? 
1 1 1   28    7   30 o   1163.0    4.4    0.0000   0.0000          ?        ? 13527.0811 102.8020          ?        ?     1163.0        4.4       ?       ? 
1 1 1   28    7   31 o    825.2    3.4    0.0000   0.0000          ?        ?  6811.1099  56.8284          ?        ?      825.2        3.4       ?       ? 
1 1 1   28    7   32 o    826.6    3.3    0.0000   0.0000          ?        ?  6832.8198  54.9129          ?        ?      826.6        3.3       ?       ? 
1 1 1   28    7   33 o    884.3    3.6    0.0000   0.0000          ?        ?  7821.2515  63.2136          ?        ?      884.3        3.6       ?       ? 
1 1 1   28    7   34 o    978.5    3.8    0.0000   0.0000          ?        ?  9577.1855  73.4300          ?        ?      978.5        3.8       ?       ? 
1 1 1   28    7   35 o    758.0    3.1    0.0000   0.0000          ?        ?  5746.0562  46.6121          ?        ?      758.0        3.1       ?       ? 
1 1 1   28    7   36 o    233.9    3.7    0.0000   0.0000          ?        ?   547.2130  17.2401          ?        ?      233.9        3.7       ?       ? 
1 1 1   28    7   37 o    246.7    3.5    0.0000   0.0000          ?        ?   608.5111  17.2401          ?        ?      246.7        3.5       ?       ? 
1 1 1   28    7   38 o    207.6    3.8    0.0000   0.0000          ?        ?   431.0021  15.9630          ?        ?      207.6        3.8       ?       ? 
1 1 1   28    7   39 o    457.8    2.6    0.0000   0.0000          ?        ?  2096.2664  23.6253          ?        ?      457.8        2.6       ?       ? 
1 1 1   28    7   40 o    453.1    2.7    0.0000   0.0000          ?        ?  2052.8469  24.2638          ?        ?      453.1        2.7       ?       ? 
1 1 1   28    7   41 o    327.7    3.0    0.0000   0.0000          ?        ?  1073.9934  19.7942          ?        ?      327.7        3.0       ?       ? 
1 1 1   28    7   42 o    450.1    2.6    0.0000   0.0000          ?        ?  2026.0291  23.6253          ?        ?      450.1        2.6       ?       ? 
1 1 1   28    7   43 o     19.9    9.9    0.0000   0.0000          ?        ?   -38.3113  15.3245          ?        ?       19.9        9.9       ?       ? 
1 1 1   28    7   44 o    377.2    2.7    0.0000   0.0000          ?        ?  1423.2646  20.4327          ?        ?      377.2        2.7       ?       ? 
1 1 1   28    7   45 o     20.1   10.1    0.0000   0.0000          ?        ?   -49.1662  17.2401          ?        ?       20.1       10.1       ?       ? 
1 1 1   28    7   46 o    522.3    2.8    0.0000   0.0000          ?        ?  2729.0415  29.3720          ?        ?      522.3        2.8       ?       ? 
1 1 1   28    7   47 o    308.7    3.2    0.0000   0.0000          ?        ?   953.3128  19.7942          ?        ?      308.7        3.2       ?       ? 
1 1 1   28    7   48 o    193.7    4.8    0.0000   0.0000          ?        ?   375.4507  18.5171          ?        ?      193.7        4.8       ?       ? 
1 1 1   28    7   49 o    654.4    2.9    0.0000   0.0000          ?        ?  4283.2031  38.3113          ?        ?      654.4        2.9       ?       ? 
1 1 1   28    7   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    7   51 o     19.3    9.7    0.0000   0.0000          ?        ?   -49.8047  16.6016          ?        ?       19.3        9.7       ?       ? 
1 1 1   28    7   52 o     25.6   12.2    0.0000   0.0000          ?        ?   -22.3483  17.2401          ?        ?       25.6       12.2       ?       ? 
1 1 1   28    7   53 o    337.9    2.9    0.0000   0.0000          ?        ?  1142.3152  19.7942          ?        ?      337.9        2.9       ?       ? 
1 1 1   28    7   54 o     21.6   10.7    0.0000   0.0000          ?        ?   -44.0580  17.8786          ?        ?       21.6       10.7       ?       ? 
1 1 1   28    7   55 o    677.5    2.8    0.0000   0.0000          ?        ?  4592.2476  37.6728          ?        ?      677.5        2.8       ?       ? 
1 1 1   28    7   56 o    141.9    6.5    0.0000   0.0000          ?        ?   201.7728  18.5171          ?        ?      141.9        6.5       ?       ? 
1 1 1   28    7   57 o    254.1    3.9    0.0000   0.0000          ?        ?   646.1838  19.7942          ?        ?      254.1        3.9       ?       ? 
1 1 1   28    7   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    7   59 o    448.7    2.7    0.0000   0.0000          ?        ?  2013.8972  24.2638          ?        ?      448.7        2.7       ?       ? 
1 1 1   28    7   60 o    152.5    6.3    0.0000   0.0000          ?        ?   233.0604  19.1556          ?        ?      152.5        6.3       ?       ? 
1 1 1   28    7   61 o    143.8    6.9    0.0000   0.0000          ?        ?   207.5195  19.7942          ?        ?      143.8        6.9       ?       ? 
1 1 1   28    7   62 o     28.1   13.2    0.0000   0.0000          ?        ?   -20.4327  19.1556          ?        ?       28.1       13.2       ?       ? 
1 1 1   28    7   63 o     50.7   16.5    0.0000   0.0000          ?        ?    25.5409  19.1556          ?        ?       50.7       16.5       ?       ? 
1 1 1   28    7   64 o     30.3   13.9    0.0000   0.0000          ?        ?   -13.4090  19.1556          ?        ?       30.3       13.9       ?       ? 
1 1 1   28    7   65 o    103.4    9.9    0.0000   0.0000          ?        ?   107.9102  20.4327          ?        ?      103.4        9.9       ?       ? 
1 1 1   28    7   66 o     32.1   14.6    0.0000   0.0000          ?        ?   -11.4934  20.4327          ?        ?       32.1       14.6       ?       ? 
1 1 1   28    7   67 o    134.4    7.6    0.0000   0.0000          ?        ?   181.9787  20.4327          ?        ?      134.4        7.6       ?       ? 
1 1 1   28    7   68 o    122.2    8.4    0.0000   0.0000          ?        ?   150.6911  20.4327          ?        ?      122.2        8.4       ?       ? 
1 1 1   28    7   69 o    215.5    4.7    0.0000   0.0000          ?        ?   466.1208  20.4327          ?        ?      215.5        4.7       ?       ? 
1 1 1   28    7   70 o    159.9    6.4    0.0000   0.0000          ?        ?   257.3242  20.4327          ?        ?      159.9        6.4       ?       ? 
1 1 1   28    7   71 o    111.0    9.2    0.0000   0.0000          ?        ?   125.1502  20.4327          ?        ?      111.0        9.2       ?       ? 
1 1 1   28    7   72 o     31.2   14.2    0.0000   0.0000          ?        ?   -11.4934  19.7942          ?        ?       31.2       14.2       ?       ? 
1 1 1   28    8    0 o    313.9    3.3  985.8774  20.4327   985.8774  20.4327   985.8774  20.4327      313.9      3.3      313.9        3.3     0.0     0.0 
1 1 1   28    8    1 o   1413.9    4.9    0.0000   0.0000          ?        ? 19992.7520 139.1977          ?        ?     1413.9        4.9       ?       ? 
1 1 1   28    8    2 o   1291.2    4.5    0.0000   0.0000          ?        ? 16673.0762 116.8494          ?        ?     1291.2        4.5       ?       ? 
1 1 1   28    8    3 o   1301.5    4.4    0.0000   0.0000          ?        ? 16940.6172 115.5724          ?        ?     1301.5        4.4       ?       ? 
1 1 1   28    8    4 o    987.7    3.6    0.0000   0.0000          ?        ?  9755.9717  71.5144          ?        ?      987.7        3.6       ?       ? 
1 1 1   28    8    5 o   1587.6    5.3    0.0000   0.0000          ?        ? 25208.1953 169.2082          ?        ?     1587.6        5.3       ?       ? 
1 1 1   28    8    6 o    809.7    3.1    0.0000   0.0000          ?        ?  6555.7012  50.4432          ?        ?      809.7        3.1       ?       ? 
1 1 1   28    8    7 o    591.2    2.5    0.0000   0.0000          ?        ?  3495.2676  29.3720          ?        ?      591.2        2.5       ?       ? 
1 1 1   28    8    8 o   1306.4    4.8    0.0000   0.0000          ?        ? 17067.6836 124.5117          ?        ?     1306.4        4.8       ?       ? 
1 1 1   28    8    9 o    539.8    2.4    0.0000   0.0000          ?        ?  2913.5742  26.1794          ?        ?      539.8        2.4       ?       ? 
1 1 1   28    8   10 o   1183.0    4.3    0.0000   0.0000          ?        ? 13995.1172 102.8020          ?        ?     1183.0        4.3       ?       ? 
1 1 1   28    8   11 o   1304.8    4.6    0.0000   0.0000          ?        ? 17026.1797 118.7650          ?        ?     1304.8        4.6       ?       ? 
1 1 1   28    8   12 o    976.3    3.6    0.0000   0.0000          ?        ?  9533.1279  70.2374          ?        ?      976.3        3.6       ?       ? 
1 1 1   28    8   13 o    116.6    6.6    0.0000   0.0000          ?        ?   136.0051  15.3245          ?        ?      116.6        6.6       ?       ? 
1 1 1   28    8   14 o    616.8    3.0    0.0000   0.0000          ?        ?  3804.9504  36.3957          ?        ?      616.8        3.0       ?       ? 
1 1 1   28    8   15 f    321.2    2.5    0.0000   0.0000          ?        ?  1031.8510  15.9630          ?        ?      321.2        2.5       ?       ? 
1 1 1   28    8   16 o   1072.8    4.0    0.0000   0.0000          ?        ? 11510.6289  84.9234          ?        ?     1072.8        4.0       ?       ? 
1 1 1   28    8   17 o    115.5    7.7    0.0000   0.0000          ?        ?   133.4510  17.8786          ?        ?      115.5        7.7       ?       ? 
1 1 1   28    8   18 o    623.5    2.9    0.0000   0.0000          ?        ?  3887.3196  35.7572          ?        ?      623.5        2.9       ?       ? 
1 1 1   28    8   19 o    969.9    3.8    0.0000   0.0000          ?        ?  9407.3398  74.0685          ?        ?      969.9        3.8       ?       ? 
1 1 1   28    8   20 o    663.7    2.7    0.0000   0.0000          ?        ?  4405.1606  36.3957          ?        ?      663.7        2.7       ?       ? 
1 1 1   28    8   21 o    713.9    3.0    0.0000   0.0000          ?        ?  5097.3179  42.7809          ?        ?      713.9        3.0       ?       ? 
1 1 1   28    8   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    8   23 o    925.0    3.5    0.0000   0.0000          ?        ?  8556.8281  63.8522          ?        ?      925.0        3.5       ?       ? 
1 1 1   28    8   24 o    456.4    2.5    0.0000   0.0000          ?        ?  2082.8577  22.9868          ?        ?      456.4        2.5       ?       ? 
1 1 1   28    8   25 o    661.6    2.8    0.0000   0.0000          ?        ?  4377.7041  37.6728          ?        ?      661.6        2.8       ?       ? 
1 1 1   28    8   26 o   1170.0    4.4    0.0000   0.0000          ?        ? 13690.5430 102.8020          ?        ?     1170.0        4.4       ?       ? 
1 1 1   28    8   27 o    437.0    2.6    0.0000   0.0000          ?        ?  1909.8182  22.9868          ?        ?      437.0        2.6       ?       ? 
1 1 1   28    8   28 o    466.8    2.7    0.0000   0.0000          ?        ?  2179.2742  24.9023          ?        ?      466.8        2.7       ?       ? 
1 1 1   28    8   29 o    430.7    2.8    0.0000   0.0000          ?        ?  1855.5439  24.2638          ?        ?      430.7        2.8       ?       ? 
1 1 1   28    8   30 o    753.7    3.3    0.0000   0.0000          ?        ?  5680.9268  49.1662          ?        ?      753.7        3.3       ?       ? 
1 1 1   28    8   31 o   1107.7    4.1    0.0000   0.0000          ?        ? 12273.0244  90.0316          ?        ?     1107.7        4.1       ?       ? 
1 1 1   28    8   32 o    669.7    3.1    0.0000   0.0000          ?        ?  4485.6143  40.8654          ?        ?      669.7        3.1       ?       ? 
1 1 1   28    8   33 o    852.6    3.3    0.0000   0.0000          ?        ?  7269.5688  56.8284          ?        ?      852.6        3.3       ?       ? 
1 1 1   28    8   34 o    206.4    3.7    0.0000   0.0000          ?        ?   425.8939  15.3245          ?        ?      206.4        3.7       ?       ? 
1 1 1   28    8   35 o    871.2    3.2    0.0000   0.0000          ?        ?  7591.3838  56.1899          ?        ?      871.2        3.2       ?       ? 
1 1 1   28    8   36 o    496.1    2.5    0.0000   0.0000          ?        ?  2461.5010  24.9023          ?        ?      496.1        2.5       ?       ? 
1 1 1   28    8   37 o    115.2    6.7    0.0000   0.0000          ?        ?   132.8125  15.3245          ?        ?      115.2        6.7       ?       ? 
1 1 1   28    8   38 o    453.2    2.6    0.0000   0.0000          ?        ?  2054.1243  23.6253          ?        ?      453.2        2.6       ?       ? 
1 1 1   28    8   39 o    393.7    2.6    0.0000   0.0000          ?        ?  1550.3306  20.4327          ?        ?      393.7        2.6       ?       ? 
1 1 1   28    8   40 o     30.2   13.5    0.0000   0.0000          ?        ?    -7.0237  16.6016          ?        ?       30.2       13.5       ?       ? 
1 1 1   28    8   41 o    158.6    5.0    0.0000   0.0000          ?        ?   251.5775  15.9630          ?        ?      158.6        5.0       ?       ? 
1 1 1   28    8   42 o    391.8    2.8    0.0000   0.0000          ?        ?  1535.0060  21.7097          ?        ?      391.8        2.8       ?       ? 
1 1 1   28    8   43 o    270.2    3.2    0.0000   0.0000          ?        ?   730.4688  17.2401          ?        ?      270.2        3.2       ?       ? 
1 1 1   28    8   44 o     32.3   14.1    0.0000   0.0000          ?        ?    -3.8311  17.2401          ?        ?       32.3       14.1       ?       ? 
1 1 1   28    8   45 o    179.0    4.6    0.0000   0.0000          ?        ?   320.5379  16.6016          ?        ?      179.0        4.6       ?       ? 
1 1 1   28    8   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    8   47 o    475.6    2.7    0.0000   0.0000          ?        ?  2262.9207  25.5409          ?        ?      475.6        2.7       ?       ? 
1 1 1   28    8   48 o    415.3    2.7    0.0000   0.0000          ?        ?  1725.2855  22.3483          ?        ?      415.3        2.7       ?       ? 
1 1 1   28    8   49 o    171.9    4.8    0.0000   0.0000          ?        ?   295.6355  16.6016          ?        ?      171.9        4.8       ?       ? 
1 1 1   28    8   50 o    109.1    7.9    0.0000   0.0000          ?        ?   119.4035  17.2401          ?        ?      109.1        7.9       ?       ? 
1 1 1   28    8   51 o    385.7    2.9    0.0000   0.0000          ?        ?  1488.3939  22.3483          ?        ?      385.7        2.9       ?       ? 
1 1 1   28    8   52 o    297.3    3.2    0.0000   0.0000          ?        ?   884.3525  19.1556          ?        ?      297.3        3.2       ?       ? 
1 1 1   28    8   53 o     19.5    9.8    0.0000   0.0000          ?        ?   -52.9973  17.2401          ?        ?       19.5        9.8       ?       ? 
1 1 1   28    8   54 o    297.7    3.2    0.0000   0.0000          ?        ?   886.9065  19.1556          ?        ?      297.7        3.2       ?       ? 
1 1 1   28    8   55 f     20.8   10.4    0.0000   0.0000          ?        ?   -52.9973  18.5171          ?        ?       20.8       10.4       ?       ? 
1 1 1   28    8   56 o    265.0    3.7    0.0000   0.0000          ?        ?   703.0123  19.7942          ?        ?      265.0        3.7       ?       ? 
1 1 1   28    8   57 o    173.5    5.3    0.0000   0.0000          ?        ?   301.3822  18.5171          ?        ?      173.5        5.3       ?       ? 
1 1 1   28    8   58 o    364.2    3.0    0.0000   0.0000          ?        ?  1326.8479  21.7097          ?        ?      364.2        3.0       ?       ? 
1 1 1   28    8   59 o     52.7   16.4    0.0000   0.0000          ?        ?    28.0950  19.1556          ?        ?       52.7       16.4       ?       ? 
1 1 1   28    8   60 o    179.0    5.3    0.0000   0.0000          ?        ?   321.1764  19.1556          ?        ?      179.0        5.3       ?       ? 
1 1 1   28    8   61 o    274.5    3.7    0.0000   0.0000          ?        ?   754.0941  20.4327          ?        ?      274.5        3.7       ?       ? 
1 1 1   28    8   62 f     30.5   14.0    0.0000   0.0000          ?        ?   -14.6860  19.7942          ?        ?       30.5       14.0       ?       ? 
1 1 1   28    8   63 o     36.5   15.4    0.0000   0.0000          ?        ?     1.9156  19.1556          ?        ?       36.5       15.4       ?       ? 
1 1 1   28    8   64 o    112.0    8.5    0.0000   0.0000          ?        ?   126.4273  19.1556          ?        ?      112.0        8.5       ?       ? 
1 1 1   28    8   65 o    255.2    4.1    0.0000   0.0000          ?        ?   652.5691  21.0712          ?        ?      255.2        4.1       ?       ? 
1 1 1   28    8   66 o     67.5   15.0    0.0000   0.0000          ?        ?    48.5276  19.7942          ?        ?       67.5       15.0       ?       ? 
1 1 1   28    8   67 f     87.9   11.6    0.0000   0.0000          ?        ?    78.5382  20.4327          ?        ?       87.9       11.6       ?       ? 
1 1 1   28    8   68 o    174.8    5.8    0.0000   0.0000          ?        ?   307.1289  20.4327          ?        ?      174.8        5.8       ?       ? 
1 1 1   28    8   69 o     70.5   14.5    0.0000   0.0000          ?        ?    52.9973  19.7942          ?        ?       70.5       14.5       ?       ? 
1 1 1   28    8   70 o     22.2   11.1    0.0000   0.0000          ?        ?   -50.4432  19.7942          ?        ?       22.2       11.1       ?       ? 
1 1 1   28    8   71 o     93.9   10.5    0.0000   0.0000          ?        ?    90.0316  19.7942          ?        ?       93.9       10.5       ?       ? 
1 1 1   28    8   72 o     19.0    9.7    0.0000   0.0000          ?        ?   -69.5989  19.1556          ?        ?       19.0        9.7       ?       ? 
1 1 1   28    9    0 o   1577.7    7.4 24894.6816 234.3374 24894.6816 234.3374 24894.6816 234.3374     1577.7      7.4     1577.7        7.4     0.0     0.0 
1 1 1   28    9    1 o    735.3    3.2    0.0000   0.0000          ?        ?  5406.3628  46.6121          ?        ?      735.3        3.2       ?       ? 
1 1 1   28    9    2 o   1632.7    5.5    0.0000   0.0000          ?        ? 26659.5566 178.1475          ?        ?     1632.7        5.5       ?       ? 
1 1 1   28    9    3 o   1065.8    3.9    0.0000   0.0000          ?        ? 11359.2998  82.3693          ?        ?     1065.8        3.9       ?       ? 
1 1 1   28    9    4 o   1477.3    5.1    0.0000   0.0000          ?        ? 21825.9453 150.6911          ?        ?     1477.3        5.1       ?       ? 
1 1 1   28    9    5 o    800.1    3.1    0.0000   0.0000          ?        ?  6401.8179  49.1662          ?        ?      800.1        3.1       ?       ? 
1 1 1   28    9    6 o    889.6    3.4    0.0000   0.0000          ?        ?  7914.4756  60.6596          ?        ?      889.6        3.4       ?       ? 
1 1 1   28    9    7 o    445.2    2.4    0.0000   0.0000          ?        ?  1981.9711  21.7097          ?        ?      445.2        2.4       ?       ? 
1 1 1   28    9    8 o    506.5    2.3    0.0000   0.0000          ?        ?  2565.5798  23.6253          ?        ?      506.5        2.3       ?       ? 
1 1 1   28    9    9 o    946.8    3.6    0.0000   0.0000          ?        ?  8965.4824  68.3218          ?        ?      946.8        3.6       ?       ? 
1 1 1   28    9   10 o    912.3    3.4    0.0000   0.0000          ?        ?  8322.4912  61.9366          ?        ?      912.3        3.4       ?       ? 
1 1 1   28    9   11 o   1694.0    5.6    0.0000   0.0000          ?        ? 28702.1855 190.2794          ?        ?     1694.0        5.6       ?       ? 
1 1 1   28    9   12 o   1552.4    5.2    0.0000   0.0000          ?        ? 24103.5527 161.5460          ?        ?     1552.4        5.2       ?       ? 
1 1 1   28    9   13 o    975.9    3.7    0.0000   0.0000          ?        ?  9524.1885  72.1529          ?        ?      975.9        3.7       ?       ? 
1 1 1   28    9   14 o   1943.1    7.0    0.0000   0.0000          ?        ? 37764.0820 271.3717          ?        ?     1943.1        7.0       ?       ? 
1 1 1   28    9   15 o   1354.3    4.6    0.0000   0.0000          ?        ? 18344.0879 124.5117          ?        ?     1354.3        4.6       ?       ? 
1 1 1   28    9   16 o   1035.5    3.8    0.0000   0.0000          ?        ? 10722.6943  78.5382          ?        ?     1035.5        3.8       ?       ? 
1 1 1   28    9   17 o    419.3    2.4    0.0000   0.0000          ?        ?  1758.4885  20.4327          ?        ?      419.3        2.4       ?       ? 
1 1 1   28    9   18 o    835.7    3.5    0.0000   0.0000          ?        ?  6984.1499  58.1055          ?        ?      835.7        3.5       ?       ? 
1 1 1   28    9   19 o    929.5    3.6    0.0000   0.0000          ?        ?  8641.1133  67.0448          ?        ?      929.5        3.6       ?       ? 
1 1 1   28    9   20 o    583.8    2.8    0.0000   0.0000          ?        ?  3408.4285  33.2031          ?        ?      583.8        2.8       ?       ? 
1 1 1   28    9   21 o   1004.0    3.7    0.0000   0.0000          ?        ? 10080.9795  74.7070          ?        ?     1004.0        3.7       ?       ? 
1 1 1   28    9   22 f    691.8    3.0    0.0000   0.0000          ?        ?  4786.3579  40.8654          ?        ?      691.8        3.0       ?       ? 
1 1 1   28    9   23 o    283.9    2.9    0.0000   0.0000          ?        ?   805.8143  16.6016          ?        ?      283.9        2.9       ?       ? 
1 1 1   28    9   24 o   1072.9    3.8    0.0000   0.0000          ?        ? 11513.1836  82.3693          ?        ?     1072.9        3.8       ?       ? 
1 1 1   28    9   25 o    410.2    2.6    0.0000   0.0000          ?        ?  1682.5045  21.7097          ?        ?      410.2        2.6       ?       ? 
1 1 1   28    9   26 o    473.4    2.6    0.0000   0.0000          ?        ?  2241.2109  24.2638          ?        ?      473.4        2.6       ?       ? 
1 1 1   28    9   27 o    322.2    2.8    0.0000   0.0000          ?        ?  1038.2362  17.8786          ?        ?      322.2        2.8       ?       ? 
1 1 1   28    9   28 o    991.7    3.8    0.0000   0.0000          ?        ?  9835.1484  74.7070          ?        ?      991.7        3.8       ?       ? 
1 1 1   28    9   29 o    372.4    3.1    0.0000   0.0000          ?        ?  1386.8689  22.9868          ?        ?      372.4        3.1       ?       ? 
1 1 1   28    9   30 f    138.2    5.3    0.0000   0.0000          ?        ?   190.9180  14.6860          ?        ?      138.2        5.3       ?       ? 
1 1 1   28    9   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    9   32 o    747.5    2.9    0.0000   0.0000          ?        ?  5588.3413  44.0580          ?        ?      747.5        2.9       ?       ? 
1 1 1   28    9   33 o    416.0    2.5    0.0000   0.0000          ?        ?  1731.0322  21.0712          ?        ?      416.0        2.5       ?       ? 
1 1 1   28    9   34 o    301.0    2.9    0.0000   0.0000          ?        ?   906.0621  17.2401          ?        ?      301.0        2.9       ?       ? 
1 1 1   28    9   35 o    622.8    2.6    0.0000   0.0000          ?        ?  3879.0188  32.5646          ?        ?      622.8        2.6       ?       ? 
1 1 1   28    9   36 o    662.3    2.8    0.0000   0.0000          ?        ?  4387.2817  37.0343          ?        ?      662.3        2.8       ?       ? 
1 1 1   28    9   37 o    430.5    2.4    0.0000   0.0000          ?        ?  1853.6282  21.0712          ?        ?      430.5        2.4       ?       ? 
1 1 1   28    9   38 o    416.5    2.5    0.0000   0.0000          ?        ?  1734.8633  20.4327          ?        ?      416.5        2.5       ?       ? 
1 1 1   28    9   39 o    441.7    2.5    0.0000   0.0000          ?        ?  1951.3221  22.3483          ?        ?      441.7        2.5       ?       ? 
1 1 1   28    9   40 o    482.9    2.6    0.0000   0.0000          ?        ?  2332.5195  24.9023          ?        ?      482.9        2.6       ?       ? 
1 1 1   28    9   41 o    286.1    3.0    0.0000   0.0000          ?        ?   818.5847  17.2401          ?        ?      286.1        3.0       ?       ? 
1 1 1   28    9   42 o    418.1    2.6    0.0000   0.0000          ?        ?  1748.2721  21.7097          ?        ?      418.1        2.6       ?       ? 
1 1 1   28    9   43 o    267.3    3.2    0.0000   0.0000          ?        ?   714.5057  17.2401          ?        ?      267.3        3.2       ?       ? 
1 1 1   28    9   44 o    184.1    4.5    0.0000   0.0000          ?        ?   339.0550  16.6016          ?        ?      184.1        4.5       ?       ? 
1 1 1   28    9   45 o    114.9    6.9    0.0000   0.0000          ?        ?   132.1740  15.9630          ?        ?      114.9        6.9       ?       ? 
1 1 1   28    9   46 o    175.0    4.7    0.0000   0.0000          ?        ?   306.4904  16.6016          ?        ?      175.0        4.7       ?       ? 
1 1 1   28    9   47 o    414.2    2.8    0.0000   0.0000          ?        ?  1716.3461  22.9868          ?        ?      414.2        2.8       ?       ? 
1 1 1   28    9   48 o    122.1    7.1    0.0000   0.0000          ?        ?   149.4141  17.2401          ?        ?      122.1        7.1       ?       ? 
1 1 1   28    9   49 o     40.1   15.6    0.0000   0.0000          ?        ?    10.2163  17.8786          ?        ?       40.1       15.6       ?       ? 
1 1 1   28    9   50 o     73.9   11.7    0.0000   0.0000          ?        ?    54.9129  17.2401          ?        ?       73.9       11.7       ?       ? 
1 1 1   28    9   51 f    350.4    3.0    0.0000   0.0000          ?        ?  1228.5156  21.0712          ?        ?      350.4        3.0       ?       ? 
1 1 1   28    9   52 o    118.4    7.3    0.0000   0.0000          ?        ?   140.4748  17.2401          ?        ?      118.4        7.3       ?       ? 
1 1 1   28    9   53 o    171.4    5.2    0.0000   0.0000          ?        ?   294.3585  17.8786          ?        ?      171.4        5.2       ?       ? 
1 1 1   28    9   54 o    361.5    2.9    0.0000   0.0000          ?        ?  1307.6923  21.0712          ?        ?      361.5        2.9       ?       ? 
1 1 1   28    9   55 o    216.4    4.1    0.0000   0.0000          ?        ?   468.6749  17.8786          ?        ?      216.4        4.1       ?       ? 
1 1 1   28    9   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28    9   57 f    174.6    5.3    0.0000   0.0000          ?        ?   305.2133  18.5171          ?        ?      174.6        5.3       ?       ? 
1 1 1   28    9   58 o    158.6    5.8    0.0000   0.0000          ?        ?   252.2160  18.5171          ?        ?      158.6        5.8       ?       ? 
1 1 1   28    9   59 o     77.5   11.9    0.0000   0.0000          ?        ?    60.6596  18.5171          ?        ?       77.5       11.9       ?       ? 
1 1 1   28    9   60 o    238.1    4.2    0.0000   0.0000          ?        ?   567.6458  19.7942          ?        ?      238.1        4.2       ?       ? 
1 1 1   28    9   61 o    530.8    2.8    0.0000   0.0000          ?        ?  2819.7114  29.3720          ?        ?      530.8        2.8       ?       ? 
1 1 1   28    9   62 o     59.7   16.2    0.0000   0.0000          ?        ?    37.6728  19.7942          ?        ?       59.7       16.2       ?       ? 
1 1 1   28    9   63 o     43.9   16.5    0.0000   0.0000          ?        ?    14.6860  19.7942          ?        ?       43.9       16.5       ?       ? 
1 1 1   28    9   64 o     24.8   12.1    0.0000   0.0000          ?        ?   -36.3957  19.7942          ?        ?       24.8       12.1       ?       ? 
1 1 1   28    9   65 o    250.9    4.2    0.0000   0.0000          ?        ?   630.8594  21.0712          ?        ?      250.9        4.2       ?       ? 
1 1 1   28    9   66 o     71.9   14.7    0.0000   0.0000          ?        ?    54.9129  20.4327          ?        ?       71.9       14.7       ?       ? 
1 1 1   28    9   67 o    170.4    6.0    0.0000   0.0000          ?        ?   291.8044  20.4327          ?        ?      170.4        6.0       ?       ? 
1 1 1   28    9   68 o     47.5   16.7    0.0000   0.0000          ?        ?    21.0712  19.7942          ?        ?       47.5       16.7       ?       ? 
1 1 1   28    9   69 o     37.3   15.8    0.0000   0.0000          ?        ?     1.9156  20.4327          ?        ?       37.3       15.8       ?       ? 
1 1 1   28    9   70 o     26.7   12.8    0.0000   0.0000          ?        ?   -27.4564  19.7942          ?        ?       26.7       12.8       ?       ? 
1 1 1   28    9   71 o    167.4    5.9    0.0000   0.0000          ?        ?   282.2266  19.7942          ?        ?      167.4        5.9       ?       ? 
1 1 1   28   10    0 f    943.8    4.8 8908.6533  90.0316  8908.6533  90.0316  8908.6533  90.0316      943.8      4.8      943.8        4.8     0.0     0.0 
1 1 1   28   10    1 o    960.2    3.5    0.0000   0.0000          ?        ?  9219.6143  67.0448          ?        ?      960.2        3.5       ?       ? 
1 1 1   28   10    2 o    175.6    2.4    0.0000   0.0000          ?        ?   308.4059   8.3008          ?        ?      175.6        2.4       ?       ? 
1 1 1   28   10    3 o    510.7    2.4    0.0000   0.0000          ?        ?  2608.3608  24.9023          ?        ?      510.7        2.4       ?       ? 
1 1 1   28   10    4 o    963.2    3.5    0.0000   0.0000          ?        ?  9278.9961  67.6833          ?        ?      963.2        3.5       ?       ? 
1 1 1   28   10    5 o   2059.0    6.7    0.0000   0.0000          ?        ? 42405.5000 277.7569          ?        ?     2059.0        6.7       ?       ? 
1 1 1   28   10    6 o    728.2    2.9    0.0000   0.0000          ?        ?  5302.2837  42.7809          ?        ?      728.2        2.9       ?       ? 
1 1 1   28   10    7 o   1043.9    3.8    0.0000   0.0000          ?        ? 10898.9258  79.1767          ?        ?     1043.9        3.8       ?       ? 
1 1 1   28   10    8 o    672.4    2.8    0.0000   0.0000          ?        ?  4522.0103  37.6728          ?        ?      672.4        2.8       ?       ? 
1 1 1   28   10    9 o   1004.4    3.7    0.0000   0.0000          ?        ? 10089.2803  74.7070          ?        ?     1004.4        3.7       ?       ? 
1 1 1   28   10   10 o    505.5    2.5    0.0000   0.0000          ?        ?  2555.3635  25.5409          ?        ?      505.5        2.5       ?       ? 
1 1 1   28   10   11 o    942.0    3.5    0.0000   0.0000          ?        ?  8873.5352  65.7677          ?        ?      942.0        3.5       ?       ? 
1 1 1   28   10   12 o    889.0    3.4    0.0000   0.0000          ?        ?  7902.9819  60.0210          ?        ?      889.0        3.4       ?       ? 
1 1 1   28   10   13 o    560.1    2.6    0.0000   0.0000          ?        ?  3137.0566  29.3720          ?        ?      560.1        2.6       ?       ? 
1 1 1   28   10   14 o    315.0    4.0    0.0000   0.0000          ?        ?   992.2626  24.9023          ?        ?      315.0        4.0       ?       ? 
1 1 1   28   10   15 o    588.4    2.9    0.0000   0.0000          ?        ?  3462.7026  33.8416          ?        ?      588.4        2.9       ?       ? 
1 1 1   28   10   16 o    541.7    2.7    0.0000   0.0000          ?        ?  2934.0068  28.7335          ?        ?      541.7        2.7       ?       ? 
1 1 1   28   10   17 o    699.9    2.9    0.0000   0.0000          ?        ?  4899.3765  40.2269          ?        ?      699.9        2.9       ?       ? 
1 1 1   28   10   18 o    670.1    3.1    0.0000   0.0000          ?        ?  4490.0840  41.5039          ?        ?      670.1        3.1       ?       ? 
1 1 1   28   10   19 o   1779.8    6.4    0.0000   0.0000          ?        ? 31685.9961 229.2293          ?        ?     1779.8        6.4       ?       ? 
1 1 1   28   10   20 o    643.9    2.8    0.0000   0.0000          ?        ?  4146.5596  36.3957          ?        ?      643.9        2.8       ?       ? 
1 1 1   28   10   21 o   1179.7    4.3    0.0000   0.0000          ?        ? 13919.1318 101.5249          ?        ?     1179.7        4.3       ?       ? 
1 1 1   28   10   22 o    471.0    2.5    0.0000   0.0000          ?        ?  2218.2241  23.6253          ?        ?      471.0        2.5       ?       ? 
1 1 1   28   10   23 o    510.3    2.6    0.0000   0.0000          ?        ?  2604.5298  26.1794          ?        ?      510.3        2.6       ?       ? 
1 1 1   28   10   24 o    632.9    2.7    0.0000   0.0000          ?        ?  4006.0850  34.4802          ?        ?      632.9        2.7       ?       ? 
1 1 1   28   10   25 o    398.2    2.5    0.0000   0.0000          ?        ?  1585.4492  19.7942          ?        ?      398.2        2.5       ?       ? 
1 1 1   28   10   26 o    731.8    3.0    0.0000   0.0000          ?        ?  5355.9194  44.0580          ?        ?      731.8        3.0       ?       ? 
1 1 1   28   10   27 o    243.8    3.0    0.0000   0.0000          ?        ?   594.4636  14.6860          ?        ?      243.8        3.0       ?       ? 
1 1 1   28   10   28 o    530.8    2.6    0.0000   0.0000          ?        ?  2817.1575  27.4564          ?        ?      530.8        2.6       ?       ? 
1 1 1   28   10   29 o    942.0    3.6    0.0000   0.0000          ?        ?  8875.4502  67.6833          ?        ?      942.0        3.6       ?       ? 
1 1 1   28   10   30 o    292.7    2.8    0.0000   0.0000          ?        ?   856.8960  16.6016          ?        ?      292.7        2.8       ?       ? 
1 1 1   28   10   31 o    758.4    3.0    0.0000   0.0000          ?        ?  5753.0801  45.3350          ?        ?      758.4        3.0       ?       ? 
1 1 1   28   10   32 o    125.6    6.1    0.0000   0.0000          ?        ?   157.7148  15.3245          ?        ?      125.6        6.1       ?       ? 
1 1 1   28   10   33 o    598.2    2.7    0.0000   0.0000          ?        ?  3578.2754  31.9261          ?        ?      598.2        2.7       ?       ? 
1 1 1   28   10   34 o    114.1    6.4    0.0000   0.0000          ?        ?   130.2584  14.6860          ?        ?      114.1        6.4       ?       ? 
1 1 1   28   10   35 o    452.3    2.4    0.0000   0.0000          ?        ?  2045.8232  21.7097          ?        ?      452.3        2.4       ?       ? 
1 1 1   28   10   36 o    108.3    6.8    0.0000   0.0000          ?        ?   117.4880  14.6860          ?        ?      108.3        6.8       ?       ? 
1 1 1   28   10   37 o     86.0    8.5    0.0000   0.0000          ?        ?    74.0685  14.6860          ?        ?       86.0        8.5       ?       ? 
1 1 1   28   10   38 o     21.1   10.3    0.0000   0.0000          ?        ?   -28.7335  14.6860          ?        ?       21.1       10.3       ?       ? 
1 1 1   28   10   39 f    133.2    6.0    0.0000   0.0000          ?        ?   177.5090  15.9630          ?        ?      133.2        6.0       ?       ? 
1 1 1   28   10   40 o    316.9    3.0    0.0000   0.0000          ?        ?  1004.3945  19.1556          ?        ?      316.9        3.0       ?       ? 
1 1 1   28   10   41 o    276.2    3.1    0.0000   0.0000          ?        ?   763.0333  17.2401          ?        ?      276.2        3.1       ?       ? 
1 1 1   28   10   42 o    497.4    2.6    0.0000   0.0000          ?        ?  2474.2712  25.5409          ?        ?      497.4        2.6       ?       ? 
1 1 1   28   10   43 o    353.3    2.8    0.0000   0.0000          ?        ?  1248.3098  19.7942          ?        ?      353.3        2.8       ?       ? 
1 1 1   28   10   44 o    185.6    4.5    0.0000   0.0000          ?        ?   344.8017  16.6016          ?        ?      185.6        4.5       ?       ? 
1 1 1   28   10   45 o    394.7    2.6    0.0000   0.0000          ?        ?  1557.9928  20.4327          ?        ?      394.7        2.6       ?       ? 
1 1 1   28   10   46 o    353.9    2.8    0.0000   0.0000          ?        ?  1252.7794  19.7942          ?        ?      353.9        2.8       ?       ? 
1 1 1   28   10   47 f    273.0    3.3    0.0000   0.0000          ?        ?   745.7933  17.8786          ?        ?      273.0        3.3       ?       ? 
1 1 1   28   10   48 o    121.6    7.1    0.0000   0.0000          ?        ?   148.1370  17.2401          ?        ?      121.6        7.1       ?       ? 
1 1 1   28   10   49 o    231.9    4.0    0.0000   0.0000          ?        ?   538.2737  18.5171          ?        ?      231.9        4.0       ?       ? 
1 1 1   28   10   50 o    224.1    3.8    0.0000   0.0000          ?        ?   502.5165  17.2401          ?        ?      224.1        3.8       ?       ? 
1 1 1   28   10   51 f    297.9    3.2    0.0000   0.0000          ?        ?   888.1836  19.1556          ?        ?      297.9        3.2       ?       ? 
1 1 1   28   10   52 o    168.1    5.5    0.0000   0.0000          ?        ?   282.8651  18.5171          ?        ?      168.1        5.5       ?       ? 
1 1 1   28   10   53 o    200.3    4.5    0.0000   0.0000          ?        ?   401.6301  17.8786          ?        ?      200.3        4.5       ?       ? 
1 1 1   28   10   54 o    163.8    5.7    0.0000   0.0000          ?        ?   268.8176  18.5171          ?        ?      163.8        5.7       ?       ? 
1 1 1   28   10   55 o    242.8    3.8    0.0000   0.0000          ?        ?   589.9940  18.5171          ?        ?      242.8        3.8       ?       ? 
1 1 1   28   10   56 o     27.9   13.1    0.0000   0.0000          ?        ?   -19.1556  18.5171          ?        ?       27.9       13.1       ?       ? 
1 1 1   28   10   57 o    197.2    4.7    0.0000   0.0000          ?        ?   389.4982  18.5171          ?        ?      197.2        4.7       ?       ? 
1 1 1   28   10   58 o    158.6    5.8    0.0000   0.0000          ?        ?   252.2160  18.5171          ?        ?      158.6        5.8       ?       ? 
1 1 1   28   10   59 o    111.0    8.9    0.0000   0.0000          ?        ?   123.8732  19.7942          ?        ?      111.0        8.9       ?       ? 
1 1 1   28   10   60 o    211.8    4.8    0.0000   0.0000          ?        ?   449.5192  20.4327          ?        ?      211.8        4.8       ?       ? 
1 1 1   28   10   61 o    281.2    3.7    0.0000   0.0000          ?        ?   791.7668  21.0712          ?        ?      281.2        3.7       ?       ? 
1 1 1   28   10   62 o    116.0    8.5    0.0000   0.0000          ?        ?   135.3666  19.7942          ?        ?      116.0        8.5       ?       ? 
1 1 1   28   10   63 o    185.9    5.5    0.0000   0.0000          ?        ?   346.7172  20.4327          ?        ?      185.9        5.5       ?       ? 
1 1 1   28   10   64 o    199.2    5.1    0.0000   0.0000          ?        ?   397.7990  20.4327          ?        ?      199.2        5.1       ?       ? 
1 1 1   28   10   65 o    338.8    3.4    0.0000   0.0000          ?        ?  1149.3389  22.9868          ?        ?      338.8        3.4       ?       ? 
1 1 1   28   10   66 o    137.5    7.2    0.0000   0.0000          ?        ?   190.2794  19.7942          ?        ?      137.5        7.2       ?       ? 
1 1 1   28   10   67 o    174.7    5.5    0.0000   0.0000          ?        ?   306.4904  19.1556          ?        ?      174.7        5.5       ?       ? 
1 1 1   28   10   68 o     75.6   14.0    0.0000   0.0000          ?        ?    60.6596  20.4327          ?        ?       75.6       14.0       ?       ? 
1 1 1   28   10   69 o    216.9    4.9    0.0000   0.0000          ?        ?   472.5060  21.0712          ?        ?      216.9        4.9       ?       ? 
1 1 1   28   10   70 o    145.3    7.3    0.0000   0.0000          ?        ?   213.2662  21.0712          ?        ?      145.3        7.3       ?       ? 
1 1 1   28   10   71 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   11    0 f    524.7    3.6 2753.9436  37.6728  2753.9436  37.6728  2753.9436  37.6728      524.7      3.6      524.7        3.6     0.0     0.0 
1 1 1   28   11    1 o    734.7    3.0    0.0000   0.0000          ?        ?  5397.4233  44.6965          ?        ?      734.7        3.0       ?       ? 
1 1 1   28   11    2 o    297.9    2.1    0.0000   0.0000          ?        ?   887.5450  12.7704          ?        ?      297.9        2.1       ?       ? 
1 1 1   28   11    3 o    212.2    3.0    0.0000   0.0000          ?        ?   450.1577  12.7704          ?        ?      212.2        3.0       ?       ? 
1 1 1   28   11    4 o    925.3    3.5    0.0000   0.0000          ?        ?  8562.5752  64.4907          ?        ?      925.3        3.5       ?       ? 
1 1 1   28   11    5 o    869.2    3.4    0.0000   0.0000          ?        ?  7556.2651  59.3825          ?        ?      869.2        3.4       ?       ? 
1 1 1   28   11    6 o   1606.2    5.7    0.0000   0.0000          ?        ? 25803.9355 183.8942          ?        ?     1606.2        5.7       ?       ? 
1 1 1   28   11    7 o    558.0    2.9    0.0000   0.0000          ?        ?  3114.0701  31.9261          ?        ?      558.0        2.9       ?       ? 
1 1 1   28   11    8 o   1512.1    5.3    0.0000   0.0000          ?        ? 22868.0137 160.2689          ?        ?     1512.1        5.3       ?       ? 
1 1 1   28   11    9 o    938.0    3.5    0.0000   0.0000          ?        ?  8798.8281  66.4062          ?        ?      938.0        3.5       ?       ? 
1 1 1   28   11   10 o    472.2    2.4    0.0000   0.0000          ?        ?  2229.7175  22.9868          ?        ?      472.2        2.4       ?       ? 
1 1 1   28   11   11 o    369.6    2.5    0.0000   0.0000          ?        ?  1365.7977  18.5171          ?        ?      369.6        2.5       ?       ? 
1 1 1   28   11   12 o   1417.1    5.0    0.0000   0.0000          ?        ? 20084.0586 141.7518          ?        ?     1417.1        5.0       ?       ? 
1 1 1   28   11   13 o    291.0    2.5    0.0000   0.0000          ?        ?   846.6797  14.6860          ?        ?      291.0        2.5       ?       ? 
1 1 1   28   11   14 o    716.2    2.9    0.0000   0.0000          ?        ?  5129.8828  42.1424          ?        ?      716.2        2.9       ?       ? 
1 1 1   28   11   15 o   2072.3    7.2    0.0000   0.0000          ?        ? 42955.9023 298.8281          ?        ?     2072.3        7.2       ?       ? 
1 1 1   28   11   16 o    380.9    2.4    0.0000   0.0000          ?        ?  1450.7211  18.5171          ?        ?      380.9        2.4       ?       ? 
1 1 1   28   11   17 o    835.6    3.3    0.0000   0.0000          ?        ?  6982.8726  54.9129          ?        ?      835.6        3.3       ?       ? 
1 1 1   28   11   18 o    842.0    3.5    0.0000   0.0000          ?        ?  7090.7827  58.7440          ?        ?      842.0        3.5       ?       ? 
1 1 1   28   11   19 o    251.5    3.4    0.0000   0.0000          ?        ?   632.7749  17.2401          ?        ?      251.5        3.4       ?       ? 
1 1 1   28   11   20 o    473.1    2.6    0.0000   0.0000          ?        ?  2238.6570  24.9023          ?        ?      473.1        2.6       ?       ? 
1 1 1   28   11   21 o    572.1    2.8    0.0000   0.0000          ?        ?  3273.0618  31.9261          ?        ?      572.1        2.8       ?       ? 
1 1 1   28   11   22 o    705.1    2.9    0.0000   0.0000          ?        ?  4972.1680  40.2269          ?        ?      705.1        2.9       ?       ? 
1 1 1   28   11   23 o    947.2    3.6    0.0000   0.0000          ?        ?  8973.1445  68.9603          ?        ?      947.2        3.6       ?       ? 
1 1 1   28   11   24 o    138.8    5.7    0.0000   0.0000          ?        ?   192.8335  15.9630          ?        ?      138.8        5.7       ?       ? 
1 1 1   28   11   25 o    320.4    2.8    0.0000   0.0000          ?        ?  1026.7428  17.8786          ?        ?      320.4        2.8       ?       ? 
1 1 1   28   11   26 f    703.5    3.1    0.0000   0.0000          ?        ?  4949.8198  43.4195          ?        ?      703.5        3.1       ?       ? 
1 1 1   28   11   27 o    511.6    2.6    0.0000   0.0000          ?        ?  2617.9387  26.8179          ?        ?      511.6        2.6       ?       ? 
1 1 1   28   11   28 o    394.9    2.7    0.0000   0.0000          ?        ?  1559.2698  21.0712          ?        ?      394.9        2.7       ?       ? 
1 1 1   28   11   29 o    310.2    2.9    0.0000   0.0000          ?        ?   962.2521  17.8786          ?        ?      310.2        2.9       ?       ? 
1 1 1   28   11   30 o    817.3    3.2    0.0000   0.0000          ?        ?  6680.2129  51.7203          ?        ?      817.3        3.2       ?       ? 
1 1 1   28   11   31 o    706.2    3.0    0.0000   0.0000          ?        ?  4988.1309  42.7809          ?        ?      706.2        3.0       ?       ? 
1 1 1   28   11   32 o    712.8    3.0    0.0000   0.0000          ?        ?  5081.3550  43.4195          ?        ?      712.8        3.0       ?       ? 
1 1 1   28   11   33 o    224.9    3.7    0.0000   0.0000          ?        ?   505.7091  16.6016          ?        ?      224.9        3.7       ?       ? 
1 1 1   28   11   34 o    721.2    3.0    0.0000   0.0000          ?        ?  5201.3970  42.7809          ?        ?      721.2        3.0       ?       ? 
1 1 1   28   11   35 o    236.9    3.4    0.0000   0.0000          ?        ?   561.2605  15.9630          ?        ?      236.9        3.4       ?       ? 
1 1 1   28   11   36 o    633.2    2.7    0.0000   0.0000          ?        ?  4009.9158  34.4802          ?        ?      633.2        2.7       ?       ? 
1 1 1   28   11   37 o    856.9    3.3    0.0000   0.0000          ?        ?  7344.2754  56.1899          ?        ?      856.9        3.3       ?       ? 
1 1 1   28   11   38 o    373.7    2.5    0.0000   0.0000          ?        ?  1396.4468  18.5171          ?        ?      373.7        2.5       ?       ? 
1 1 1   28   11   39 o    714.5    2.9    0.0000   0.0000          ?        ?  5105.6187  40.8654          ?        ?      714.5        2.9       ?       ? 
1 1 1   28   11   40 o    304.3    2.9    0.0000   0.0000          ?        ?   926.4949  17.8786          ?        ?      304.3        2.9       ?       ? 
1 1 1   28   11   41 o    486.8    2.6    0.0000   0.0000          ?        ?  2370.1924  25.5409          ?        ?      486.8        2.6       ?       ? 
1 1 1   28   11   42 o    207.1    4.0    0.0000   0.0000          ?        ?   429.0865  16.6016          ?        ?      207.1        4.0       ?       ? 
1 1 1   28   11   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   11   44 o    246.6    3.4    0.0000   0.0000          ?        ?   608.5111  16.6016          ?        ?      246.6        3.4       ?       ? 
1 1 1   28   11   45 o    313.7    2.8    0.0000   0.0000          ?        ?   984.6003  17.8786          ?        ?      313.7        2.8       ?       ? 
1 1 1   28   11   46 o    291.8    3.2    0.0000   0.0000          ?        ?   851.7878  18.5171          ?        ?      291.8        3.2       ?       ? 
1 1 1   28   11   47 o     21.9   10.8    0.0000   0.0000          ?        ?   -35.1187  16.6016          ?        ?       21.9       10.8       ?       ? 
1 1 1   28   11   48 o    379.6    2.9    0.0000   0.0000          ?        ?  1441.7819  21.7097          ?        ?      379.6        2.9       ?       ? 
1 1 1   28   11   49 o    128.7    6.4    0.0000   0.0000          ?        ?   166.0156  16.6016          ?        ?      128.7        6.4       ?       ? 
1 1 1   28   11   50 o    266.6    3.5    0.0000   0.0000          ?        ?   711.3131  18.5171          ?        ?      266.6        3.5       ?       ? 
1 1 1   28   11   51 o    204.6    4.2    0.0000   0.0000          ?        ?   418.8702  17.2401          ?        ?      204.6        4.2       ?       ? 
1 1 1   28   11   52 o    327.2    2.9    0.0000   0.0000          ?        ?  1070.8008  19.1556          ?        ?      327.2        2.9       ?       ? 
1 1 1   28   11   53 o    124.1    6.9    0.0000   0.0000          ?        ?   154.5222  17.2401          ?        ?      124.1        6.9       ?       ? 
1 1 1   28   11   54 o     96.6    9.3    0.0000   0.0000          ?        ?    93.8627  17.8786          ?        ?       96.6        9.3       ?       ? 
1 1 1   28   11   55 o    203.1    4.4    0.0000   0.0000          ?        ?   413.1235  17.8786          ?        ?      203.1        4.4       ?       ? 
1 1 1   28   11   56 o    106.4    8.4    0.0000   0.0000          ?        ?   113.6568  17.8786          ?        ?      106.4        8.4       ?       ? 
1 1 1   28   11   57 o     99.5    9.3    0.0000   0.0000          ?        ?    99.6094  18.5171          ?        ?       99.5        9.3       ?       ? 
1 1 1   28   11   58 o    328.1    3.2    0.0000   0.0000          ?        ?  1077.1859  21.0712          ?        ?      328.1        3.2       ?       ? 
1 1 1   28   11   59 o    196.5    4.9    0.0000   0.0000          ?        ?   386.9441  19.1556          ?        ?      196.5        4.9       ?       ? 
1 1 1   28   11   60 o     32.7   14.5    0.0000   0.0000          ?        ?    -7.0237  19.1556          ?        ?       32.7       14.5       ?       ? 
1 1 1   28   11   61 o    330.8    3.3    0.0000   0.0000          ?        ?  1095.0646  21.7097          ?        ?      330.8        3.3       ?       ? 
1 1 1   28   11   62 f     24.8   12.1    0.0000   0.0000          ?        ?   -36.3957  19.7942          ?        ?       24.8       12.1       ?       ? 
1 1 1   28   11   63 f    187.3    5.5    0.0000   0.0000          ?        ?   351.8254  20.4327          ?        ?      187.3        5.5       ?       ? 
1 1 1   28   11   64 o     71.0   15.3    0.0000   0.0000          ?        ?    53.6358  21.0712          ?        ?       71.0       15.3       ?       ? 
1 1 1   28   11   65 o    232.0    4.4    0.0000   0.0000          ?        ?   539.5508  20.4327          ?        ?      232.0        4.4       ?       ? 
1 1 1   28   11   66 o    137.0    7.2    0.0000   0.0000          ?        ?   189.0024  19.7942          ?        ?      137.0        7.2       ?       ? 
1 1 1   28   11   67 o     25.2   12.3    0.0000   0.0000          ?        ?   -34.4802  19.7942          ?        ?       25.2       12.3       ?       ? 
1 1 1   28   11   68 f     27.8   13.3    0.0000   0.0000          ?        ?   -28.0950  21.0712          ?        ?       27.8       13.3       ?       ? 
1 1 1   28   11   69 o    209.9    4.9    0.0000   0.0000          ?        ?   442.4955  20.4327          ?        ?      209.9        4.9       ?       ? 
1 1 1   28   11   70 o    123.0    7.8    0.0000   0.0000          ?        ?   153.2452  19.1556          ?        ?      123.0        7.8       ?       ? 
1 1 1   28   12    0 o    907.4    5.3 8235.6523  95.7782  8235.6523  95.7782  8235.6523  95.7782      907.4      5.3      907.4        5.3     0.0     0.0 
1 1 1   28   12    1 o    875.2    3.6    0.0000   0.0000          ?        ?  7660.9829  63.8522          ?        ?      875.2        3.6       ?       ? 
1 1 1   28   12    2 o    463.7    2.8    0.0000   0.0000          ?        ?  2150.5408  25.5409          ?        ?      463.7        2.8       ?       ? 
1 1 1   28   12    3 o    289.3    2.3    0.0000   0.0000          ?        ?   837.1019  13.4090          ?        ?      289.3        2.3       ?       ? 
1 1 1   28   12    4 o    567.3    2.5    0.0000   0.0000          ?        ?  3218.1489  28.7335          ?        ?      567.3        2.5       ?       ? 
1 1 1   28   12    5 o    763.9    3.1    0.0000   0.0000          ?        ?  5835.4492  46.6121          ?        ?      763.9        3.1       ?       ? 
1 1 1   28   12    6 o    658.7    2.8    0.0000   0.0000          ?        ?  4338.7544  37.0343          ?        ?      658.7        2.8       ?       ? 
1 1 1   28   12    7 o    302.8    2.2    0.0000   0.0000          ?        ?   916.9171  13.4090          ?        ?      302.8        2.2       ?       ? 
1 1 1   28   12    8 o    590.3    2.5    0.0000   0.0000          ?        ?  3484.4126  30.0105          ?        ?      590.3        2.5       ?       ? 
1 1 1   28   12    9 o    429.0    2.3    0.0000   0.0000          ?        ?  1840.8578  19.7942          ?        ?      429.0        2.3       ?       ? 
1 1 1   28   12   10 o    769.0    3.0    0.0000   0.0000          ?        ?  5913.9873  46.6121          ?        ?      769.0        3.0       ?       ? 
1 1 1   28   12   11 o   1090.7    4.1    0.0000   0.0000          ?        ? 11897.5742  89.3930          ?        ?     1090.7        4.1       ?       ? 
1 1 1   28   12   12 o    778.9    3.1    0.0000   0.0000          ?        ?  6067.8711  48.5276          ?        ?      778.9        3.1       ?       ? 
1 1 1   28   12   13 f    555.0    2.7    0.0000   0.0000          ?        ?  3080.2283  30.0105          ?        ?      555.0        2.7       ?       ? 
1 1 1   28   12   14 o   1204.8    4.5    0.0000   0.0000          ?        ? 14518.0654 107.2716          ?        ?     1204.8        4.5       ?       ? 
1 1 1   28   12   15 o   1053.1    3.9    0.0000   0.0000          ?        ? 11091.1211  82.3693          ?        ?     1053.1        3.9       ?       ? 
1 1 1   28   12   16 o   1248.3    4.9    0.0000   0.0000          ?        ? 15585.6738 121.3191          ?        ?     1248.3        4.9       ?       ? 
1 1 1   28   12   17 o    494.5    2.5    0.0000   0.0000          ?        ?  2445.5378  24.9023          ?        ?      494.5        2.5       ?       ? 
1 1 1   28   12   18 o   1080.0    4.1    0.0000   0.0000          ?        ? 11664.5137  89.3930          ?        ?     1080.0        4.1       ?       ? 
1 1 1   28   12   19 o   1166.0    4.3    0.0000   0.0000          ?        ? 13596.6787  99.6094          ?        ?     1166.0        4.3       ?       ? 
1 1 1   28   12   20 f    627.6    2.8    0.0000   0.0000          ?        ?  3939.0400  35.1187          ?        ?      627.6        2.8       ?       ? 
1 1 1   28   12   21 o    625.3    2.8    0.0000   0.0000          ?        ?  3909.6677  34.4802          ?        ?      625.3        2.8       ?       ? 
1 1 1   28   12   22 o     77.4    8.7    0.0000   0.0000          ?        ?    60.0210  13.4090          ?        ?       77.4        8.7       ?       ? 
1 1 1   28   12   23 f    827.6    3.2    0.0000   0.0000          ?        ?  6849.4214  52.9973          ?        ?      827.6        3.2       ?       ? 
1 1 1   28   12   24 o    783.0    3.1    0.0000   0.0000          ?        ?  6131.7231  47.8891          ?        ?      783.0        3.1       ?       ? 
1 1 1   28   12   25 o    542.6    2.6    0.0000   0.0000          ?        ?  2944.2231  28.7335          ?        ?      542.6        2.6       ?       ? 
1 1 1   28   12   26 o   1507.5    5.2    0.0000   0.0000          ?        ? 22732.6465 156.4378          ?        ?     1507.5        5.2       ?       ? 
1 1 1   28   12   27 o    418.5    2.5    0.0000   0.0000          ?        ?  1751.4647  21.0712          ?        ?      418.5        2.5       ?       ? 
1 1 1   28   12   28 o    287.7    2.8    0.0000   0.0000          ?        ?   827.5240  15.9630          ?        ?      287.7        2.8       ?       ? 
1 1 1   28   12   29 o    466.7    2.5    0.0000   0.0000          ?        ?  2178.6360  22.9868          ?        ?      466.7        2.5       ?       ? 
1 1 1   28   12   30 o     39.1   14.6    0.0000   0.0000          ?        ?    11.4934  15.3245          ?        ?       39.1       14.6       ?       ? 
1 1 1   28   12   31 o    501.0    2.5    0.0000   0.0000          ?        ?  2510.6670  25.5409          ?        ?      501.0        2.5       ?       ? 
1 1 1   28   12   32 o    200.1    4.1    0.0000   0.0000          ?        ?   400.3531  16.6016          ?        ?      200.1        4.1       ?       ? 
1 1 1   28   12   33 o    264.4    3.3    0.0000   0.0000          ?        ?   699.1812  17.2401          ?        ?      264.4        3.3       ?       ? 
1 1 1   28   12   34 o    616.5    2.7    0.0000   0.0000          ?        ?  3801.1191  33.8416          ?        ?      616.5        2.7       ?       ? 
1 1 1   28   12   35 o    529.8    2.7    0.0000   0.0000          ?        ?  2806.9412  28.0950          ?        ?      529.8        2.7       ?       ? 
1 1 1   28   12   36 o    264.6    3.0    0.0000   0.0000          ?        ?   700.4582  15.9630          ?        ?      264.6        3.0       ?       ? 
1 1 1   28   12   37 o    289.0    3.0    0.0000   0.0000          ?        ?   835.1863  17.2401          ?        ?      289.0        3.0       ?       ? 
1 1 1   28   12   38 o    150.9    5.5    0.0000   0.0000          ?        ?   227.9522  16.6016          ?        ?      150.9        5.5       ?       ? 
1 1 1   28   12   39 o    899.2    3.4    0.0000   0.0000          ?        ?  8088.1533  60.6596          ?        ?      899.2        3.4       ?       ? 
1 1 1   28   12   40 o    303.0    2.8    0.0000   0.0000          ?        ?   918.1941  17.2401          ?        ?      303.0        2.8       ?       ? 
1 1 1   28   12   41 o    242.5    3.4    0.0000   0.0000          ?        ?   588.0784  16.6016          ?        ?      242.5        3.4       ?       ? 
1 1 1   28   12   42 o    431.2    2.7    0.0000   0.0000          ?        ?  1859.3750  22.9868          ?        ?      431.2        2.7       ?       ? 
1 1 1   28   12   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   12   44 o    655.6    2.8    0.0000   0.0000          ?        ?  4299.8047  36.3957          ?        ?      655.6        2.8       ?       ? 
1 1 1   28   12   45 o    327.0    2.9    0.0000   0.0000          ?        ?  1069.5237  19.1556          ?        ?      327.0        2.9       ?       ? 
1 1 1   28   12   46 o    179.5    4.6    0.0000   0.0000          ?        ?   322.4534  16.6016          ?        ?      179.5        4.6       ?       ? 
1 1 1   28   12   47 o    277.0    3.2    0.0000   0.0000          ?        ?   767.5030  17.8786          ?        ?      277.0        3.2       ?       ? 
1 1 1   28   12   48 o    401.1    2.9    0.0000   0.0000          ?        ?  1609.7130  22.9868          ?        ?      401.1        2.9       ?       ? 
1 1 1   28   12   49 o    123.4    7.2    0.0000   0.0000          ?        ?   152.6067  17.8786          ?        ?      123.4        7.2       ?       ? 
1 1 1   28   12   50 o    321.4    3.3    0.0000   0.0000          ?        ?  1033.7665  21.0712          ?        ?      321.4        3.3       ?       ? 
1 1 1   28   12   51 f    162.5    5.5    0.0000   0.0000          ?        ?   264.3480  17.8786          ?        ?      162.5        5.5       ?       ? 
1 1 1   28   12   52 o     24.6   11.9    0.0000   0.0000          ?        ?   -28.7335  17.8786          ?        ?       24.6       11.9       ?       ? 
1 1 1   28   12   53 o    147.2    6.1    0.0000   0.0000          ?        ?   217.0974  17.8786          ?        ?      147.2        6.1       ?       ? 
1 1 1   28   12   54 o    404.1    2.9    0.0000   0.0000          ?        ?  1633.9768  23.6253          ?        ?      404.1        2.9       ?       ? 
1 1 1   28   12   55 o     58.8   15.5    0.0000   0.0000          ?        ?    36.3957  18.5171          ?        ?       58.8       15.5       ?       ? 
1 1 1   28   12   56 o    356.3    3.1    0.0000   0.0000          ?        ?  1270.6581  22.3483          ?        ?      356.3        3.1       ?       ? 
1 1 1   28   12   57 o    202.6    4.9    0.0000   0.0000          ?        ?   411.2079  19.7942          ?        ?      202.6        4.9       ?       ? 
1 1 1   28   12   58 o    547.7    2.8    0.0000   0.0000          ?        ?  3001.6902  30.6490          ?        ?      547.7        2.8       ?       ? 
1 1 1   28   12   59 o     96.5    9.9    0.0000   0.0000          ?        ?    93.8627  19.1556          ?        ?       96.5        9.9       ?       ? 
1 1 1   28   12   60 o     75.7   14.0    0.0000   0.0000          ?        ?    60.0210  20.4327          ?        ?       75.7       14.0       ?       ? 
1 1 1   28   12   61 o     27.7   13.1    0.0000   0.0000          ?        ?   -21.7097  19.1556          ?        ?       27.7       13.1       ?       ? 
1 1 1   28   12   62 o    129.5    7.6    0.0000   0.0000          ?        ?   168.5697  19.7942          ?        ?      129.5        7.6       ?       ? 
1 1 1   28   12   63 o     28.3   13.3    0.0000   0.0000          ?        ?   -21.7097  19.7942          ?        ?       28.3       13.3       ?       ? 
1 1 1   28   12   64 o    233.7    4.4    0.0000   0.0000          ?        ?   547.2130  20.4327          ?        ?      233.7        4.4       ?       ? 
1 1 1   28   12   65 o     80.3   12.7    0.0000   0.0000          ?        ?    65.7677  20.4327          ?        ?       80.3       12.7       ?       ? 
1 1 1   28   12   66 o     36.2   15.5    0.0000   0.0000          ?        ?     0.6385  19.7942          ?        ?       36.2       15.5       ?       ? 
1 1 1   28   12   67 o    111.5    8.9    0.0000   0.0000          ?        ?   125.7888  19.7942          ?        ?      111.5        8.9       ?       ? 
1 1 1   28   12   68 o     39.5   16.0    0.0000   0.0000          ?        ?     7.6623  19.7942          ?        ?       39.5       16.0       ?       ? 
1 1 1   28   12   69 f     94.2   10.5    0.0000   0.0000          ?        ?    90.6701  19.7942          ?        ?       94.2       10.5       ?       ? 
1 1 1   28   12   70 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   13    0 o    837.1    5.7 7009.6909  95.1397  7009.6909  95.1397  7009.6909  95.1397      837.1      5.7      837.1        5.7     0.0     0.0 
1 1 1   28   13    1 o    244.1    3.1    0.0000   0.0000          ?        ?   595.7407  15.3245          ?        ?      244.1        3.1       ?       ? 
1 1 1   28   13    2 o    701.0    3.3    0.0000   0.0000          ?        ?  4914.7012  45.9736          ?        ?      701.0        3.3       ?       ? 
1 1 1   28   13    3 o     16.2    8.0    0.0000   0.0000          ?        ?   -18.5171   8.9393          ?        ?       16.2        8.0       ?       ? 
1 1 1   28   13    4 o    497.5    2.6    0.0000   0.0000          ?        ?  2475.5483  26.1794          ?        ?      497.5        2.6       ?       ? 
1 1 1   28   13    5 o   1286.5    4.8    0.0000   0.0000          ?        ? 16553.6738 124.5117          ?        ?     1286.5        4.8       ?       ? 
1 1 1   28   13    6 o    515.8    2.5    0.0000   0.0000          ?        ?  2660.7197  26.1794          ?        ?      515.8        2.5       ?       ? 
1 1 1   28   13    7 o    608.3    2.8    0.0000   0.0000          ?        ?  3700.2329  33.8416          ?        ?      608.3        2.8       ?       ? 
1 1 1   28   13    8 o    646.2    2.7    0.0000   0.0000          ?        ?  4175.2930  34.4802          ?        ?      646.2        2.7       ?       ? 
1 1 1   28   13    9 o    546.1    2.5    0.0000   0.0000          ?        ?  2981.8960  27.4564          ?        ?      546.1        2.5       ?       ? 
1 1 1   28   13   10 o    611.6    2.8    0.0000   0.0000          ?        ?  3740.4597  33.8416          ?        ?      611.6        2.8       ?       ? 
1 1 1   28   13   11 o   1658.1    5.8    0.0000   0.0000          ?        ? 27497.2949 192.1950          ?        ?     1658.1        5.8       ?       ? 
1 1 1   28   13   12 o    751.7    3.1    0.0000   0.0000          ?        ?  5651.5547  45.9736          ?        ?      751.7        3.1       ?       ? 
1 1 1   28   13   13 o    787.8    3.1    0.0000   0.0000          ?        ?  6206.4302  49.1662          ?        ?      787.8        3.1       ?       ? 
1 1 1   28   13   14 o    501.7    2.7    0.0000   0.0000          ?        ?  2517.0522  27.4564          ?        ?      501.7        2.7       ?       ? 
1 1 1   28   13   15 f    731.1    3.1    0.0000   0.0000          ?        ?  5345.0645  45.9736          ?        ?      731.1        3.1       ?       ? 
1 1 1   28   13   16 o   1182.8    4.5    0.0000   0.0000          ?        ? 13991.9248 106.6331          ?        ?     1182.8        4.5       ?       ? 
1 1 1   28   13   17 o    958.7    3.9    0.0000   0.0000          ?        ?  9192.1572  75.3456          ?        ?      958.7        3.9       ?       ? 
1 1 1   28   13   18 o    568.1    2.6    0.0000   0.0000          ?        ?  3227.0884  29.3720          ?        ?      568.1        2.6       ?       ? 
1 1 1   28   13   19 o     28.3   13.0    0.0000   0.0000          ?        ?   -14.0475  17.2401          ?        ?       28.3       13.0       ?       ? 
1 1 1   28   13   20 o    527.8    2.5    0.0000   0.0000          ?        ?  2785.8699  26.8179          ?        ?      527.8        2.5       ?       ? 
1 1 1   28   13   21 o    569.4    2.6    0.0000   0.0000          ?        ?  3242.4128  29.3720          ?        ?      569.4        2.6       ?       ? 
1 1 1   28   13   22 o    813.6    3.1    0.0000   0.0000          ?        ?  6620.1924  51.0817          ?        ?      813.6        3.1       ?       ? 
1 1 1   28   13   23 f    104.2    6.1    0.0000   0.0000          ?        ?   108.5487  12.7704          ?        ?      104.2        6.1       ?       ? 
1 1 1   28   13   24 o    804.9    3.2    0.0000   0.0000          ?        ?  6479.7173  51.0817          ?        ?      804.9        3.2       ?       ? 
1 1 1   28   13   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   13   26 o    226.4    3.9    0.0000   0.0000          ?        ?   512.7329  17.8786          ?        ?      226.4        3.9       ?       ? 
1 1 1   28   13   27 o    658.0    2.8    0.0000   0.0000          ?        ?  4329.8149  37.0343          ?        ?      658.0        2.8       ?       ? 
1 1 1   28   13   28 o    545.2    2.5    0.0000   0.0000          ?        ?  2972.9568  27.4564          ?        ?      545.2        2.5       ?       ? 
1 1 1   28   13   29 o    850.6    3.2    0.0000   0.0000          ?        ?  7236.3657  54.2743          ?        ?      850.6        3.2       ?       ? 
1 1 1   28   13   30 o    591.9    2.8    0.0000   0.0000          ?        ?  3503.5684  32.5646          ?        ?      591.9        2.8       ?       ? 
1 1 1   28   13   31 o    269.8    3.0    0.0000   0.0000          ?        ?   727.9147  15.9630          ?        ?      269.8        3.0       ?       ? 
1 1 1   28   13   32 o    282.6    2.8    0.0000   0.0000          ?        ?   798.7905  15.9630          ?        ?      282.6        2.8       ?       ? 
1 1 1   28   13   33 o    937.1    3.4    0.0000   0.0000          ?        ?  8783.5029  63.8522          ?        ?      937.1        3.4       ?       ? 
1 1 1   28   13   34 o    230.2    3.3    0.0000   0.0000          ?        ?   529.9730  15.3245          ?        ?      230.2        3.3       ?       ? 
1 1 1   28   13   35 o    422.4    2.6    0.0000   0.0000          ?        ?  1784.6680  22.3483          ?        ?      422.4        2.6       ?       ? 
1 1 1   28   13   36 o    774.5    3.1    0.0000   0.0000          ?        ?  5999.5488  47.2506          ?        ?      774.5        3.1       ?       ? 
1 1 1   28   13   37 o    788.1    3.1    0.0000   0.0000          ?        ?  6212.1772  48.5276          ?        ?      788.1        3.1       ?       ? 
1 1 1   28   13   38 o    741.1    2.9    0.0000   0.0000          ?        ?  5493.2017  43.4195          ?        ?      741.1        2.9       ?       ? 
1 1 1   28   13   39 o    280.4    3.6    0.0000   0.0000          ?        ?   786.6586  20.4327          ?        ?      280.4        3.6       ?       ? 
1 1 1   28   13   40 o    610.4    2.7    0.0000   0.0000          ?        ?  3726.4121  33.2031          ?        ?      610.4        2.7       ?       ? 
1 1 1   28   13   41 o    255.2    3.4    0.0000   0.0000          ?        ?   651.2921  17.2401          ?        ?      255.2        3.4       ?       ? 
1 1 1   28   13   42 o    417.8    2.6    0.0000   0.0000          ?        ?  1745.7181  21.7097          ?        ?      417.8        2.6       ?       ? 
1 1 1   28   13   43 o     89.6    8.9    0.0000   0.0000          ?        ?    80.4537  15.9630          ?        ?       89.6        8.9       ?       ? 
1 1 1   28   13   44 o    471.3    2.7    0.0000   0.0000          ?        ?  2222.0552  25.5409          ?        ?      471.3        2.7       ?       ? 
1 1 1   28   13   45 o    396.8    2.7    0.0000   0.0000          ?        ?  1574.5944  21.0712          ?        ?      396.8        2.7       ?       ? 
1 1 1   28   13   46 o    311.6    2.9    0.0000   0.0000          ?        ?   971.1914  17.8786          ?        ?      311.6        2.9       ?       ? 
1 1 1   28   13   47 f     22.1   10.9    0.0000   0.0000          ?        ?   -37.6728  17.2401          ?        ?       22.1       10.9       ?       ? 
1 1 1   28   13   48 o    621.5    2.7    0.0000   0.0000          ?        ?  3864.3330  33.2031          ?        ?      621.5        2.7       ?       ? 
1 1 1   28   13   49 o    178.6    5.0    0.0000   0.0000          ?        ?   319.2608  17.8786          ?        ?      178.6        5.0       ?       ? 
1 1 1   28   13   50 o     58.8   14.7    0.0000   0.0000          ?        ?    36.3957  17.2401          ?        ?       58.8       14.7       ?       ? 
1 1 1   28   13   51 o    186.6    5.0    0.0000   0.0000          ?        ?   348.6328  18.5171          ?        ?      186.6        5.0       ?       ? 
1 1 1   28   13   52 f    294.0    3.5    0.0000   0.0000          ?        ?   865.1968  20.4327          ?        ?      294.0        3.5       ?       ? 
1 1 1   28   13   53 o    362.6    3.1    0.0000   0.0000          ?        ?  1315.3545  22.3483          ?        ?      362.6        3.1       ?       ? 
1 1 1   28   13   54 o    468.4    2.8    0.0000   0.0000          ?        ?  2194.5989  26.1794          ?        ?      468.4        2.8       ?       ? 
1 1 1   28   13   55 f     84.6   10.9    0.0000   0.0000          ?        ?    72.1529  18.5171          ?        ?       84.6       10.9       ?       ? 
1 1 1   28   13   56 o     75.8   12.6    0.0000   0.0000          ?        ?    58.1055  19.1556          ?        ?       75.8       12.6       ?       ? 
1 1 1   28   13   57 o    279.1    3.8    0.0000   0.0000          ?        ?   779.6349  21.0712          ?        ?      279.1        3.8       ?       ? 
1 1 1   28   13   58 o     61.2   16.4    0.0000   0.0000          ?        ?    39.5883  20.4327          ?        ?       61.2       16.4       ?       ? 
1 1 1   28   13   59 o    201.9    4.9    0.0000   0.0000          ?        ?   408.6538  19.7942          ?        ?      201.9        4.9       ?       ? 
1 1 1   28   13   60 o    251.5    3.9    0.0000   0.0000          ?        ?   633.4135  19.7942          ?        ?      251.5        3.9       ?       ? 
1 1 1   28   13   61 o    152.4    6.3    0.0000   0.0000          ?        ?   233.0604  19.1556          ?        ?      152.4        6.3       ?       ? 
1 1 1   28   13   62 o    206.3    5.0    0.0000   0.0000          ?        ?   426.5325  20.4327          ?        ?      206.3        5.0       ?       ? 
1 1 1   28   13   63 o    194.0    5.3    0.0000   0.0000          ?        ?   377.3663  20.4327          ?        ?      194.0        5.3       ?       ? 
1 1 1   28   13   64 o    133.0    7.2    0.0000   0.0000          ?        ?   178.1475  19.1556          ?        ?      133.0        7.2       ?       ? 
1 1 1   28   13   65 o    147.3    6.7    0.0000   0.0000          ?        ?   218.3744  19.7942          ?        ?      147.3        6.7       ?       ? 
1 1 1   28   13   66 o     68.9   13.9    0.0000   0.0000          ?        ?    50.4432  18.5171          ?        ?       68.9       13.9       ?       ? 
1 1 1   28   13   67 o    125.4    7.9    0.0000   0.0000          ?        ?   158.9919  19.7942          ?        ?      125.4        7.9       ?       ? 
1 1 1   28   13   68 o     55.7   16.6    0.0000   0.0000          ?        ?    33.2031  19.7942          ?        ?       55.7       16.6       ?       ? 
1 1 1   28   13   69 f    166.1    5.8    0.0000   0.0000          ?        ?   277.7569  19.1556          ?        ?      166.1        5.8       ?       ? 
1 1 1   28   14    0 o    438.8    4.0 1926.4198  35.1187  1926.4198  35.1187  1926.4198  35.1187      438.8      4.0      438.8        4.0     0.0     0.0 
1 1 1   28   14    1 o    271.2    2.9    0.0000   0.0000          ?        ?   735.5769  15.9630          ?        ?      271.2        2.9       ?       ? 
1 1 1   28   14    2 o   1019.5    4.4    0.0000   0.0000          ?        ? 10395.7705  88.7545          ?        ?     1019.5        4.4       ?       ? 
1 1 1   28   14    3 o    565.6    2.9    0.0000   0.0000          ?        ?  3199.6318  32.5646          ?        ?      565.6        2.9       ?       ? 
1 1 1   28   14    4 o    592.1    2.9    0.0000   0.0000          ?        ?  3505.4836  34.4802          ?        ?      592.1        2.9       ?       ? 
1 1 1   28   14    5 o    663.0    2.9    0.0000   0.0000          ?        ?  4396.2212  38.3113          ?        ?      663.0        2.9       ?       ? 
1 1 1   28   14    6 f    116.1    4.4    0.0000   0.0000          ?        ?   134.7281  10.2163          ?        ?      116.1        4.4       ?       ? 
1 1 1   28   14    7 o   1167.8    4.5    0.0000   0.0000          ?        ? 13639.4609 104.0790          ?        ?     1167.8        4.5       ?       ? 
1 1 1   28   14    8 o    451.9    2.3    0.0000   0.0000          ?        ?  2041.9921  21.0712          ?        ?      451.9        2.3       ?       ? 
1 1 1   28   14    9 o    759.8    3.1    0.0000   0.0000          ?        ?  5773.5127  47.2506          ?        ?      759.8        3.1       ?       ? 
1 1 1   28   14   10 o    630.3    2.7    0.0000   0.0000          ?        ?  3973.5200  33.8416          ?        ?      630.3        2.7       ?       ? 
1 1 1   28   14   11 o    268.8    2.6    0.0000   0.0000          ?        ?   722.8065  14.0475          ?        ?      268.8        2.6       ?       ? 
1 1 1   28   14   12 o   1017.4    4.1    0.0000   0.0000          ?        ? 10351.7119  83.0078          ?        ?     1017.4        4.1       ?       ? 
1 1 1   28   14   13 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   14   14 o    766.0    3.2    0.0000   0.0000          ?        ?  5867.3755  49.1662          ?        ?      766.0        3.2       ?       ? 
1 1 1   28   14   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   14   16 o    805.4    3.3    0.0000   0.0000          ?        ?  6486.7412  52.3588          ?        ?      805.4        3.3       ?       ? 
1 1 1   28   14   17 o    357.1    2.5    0.0000   0.0000          ?        ?  1275.1277  17.8786          ?        ?      357.1        2.5       ?       ? 
1 1 1   28   14   18 o    473.7    2.6    0.0000   0.0000          ?        ?  2243.7649  24.2638          ?        ?      473.7        2.6       ?       ? 
1 1 1   28   14   19 o    706.5    2.9    0.0000   0.0000          ?        ?  4991.9619  40.8654          ?        ?      706.5        2.9       ?       ? 
1 1 1   28   14   20 o    974.8    3.6    0.0000   0.0000          ?        ?  9504.3945  69.5989          ?        ?      974.8        3.6       ?       ? 
1 1 1   28   14   21 o    318.3    2.7    0.0000   0.0000          ?        ?  1013.3338  17.2401          ?        ?      318.3        2.7       ?       ? 
1 1 1   28   14   22 o    540.4    2.5    0.0000   0.0000          ?        ?  2920.5979  26.8179          ?        ?      540.4        2.5       ?       ? 
1 1 1   28   14   23 o    827.3    3.2    0.0000   0.0000          ?        ?  6844.9517  52.3588          ?        ?      827.3        3.2       ?       ? 
1 1 1   28   14   24 o    323.8    2.6    0.0000   0.0000          ?        ?  1048.4525  16.6016          ?        ?      323.8        2.6       ?       ? 
1 1 1   28   14   25 o    592.1    2.6    0.0000   0.0000          ?        ?  3506.1221  30.6490          ?        ?      592.1        2.6       ?       ? 
1 1 1   28   14   26 f    817.0    3.0    0.0000   0.0000          ?        ?  6676.3818  49.8047          ?        ?      817.0        3.0       ?       ? 
1 1 1   28   14   27 o    688.0    2.9    0.0000   0.0000          ?        ?  4734.6377  39.5883          ?        ?      688.0        2.9       ?       ? 
1 1 1   28   14   28 o    322.0    2.6    0.0000   0.0000          ?        ?  1036.9591  16.6016          ?        ?      322.0        2.6       ?       ? 
1 1 1   28   14   29 o    174.5    4.4    0.0000   0.0000          ?        ?   304.5748  15.3245          ?        ?      174.5        4.4       ?       ? 
1 1 1   28   14   30 o    687.4    3.0    0.0000   0.0000          ?        ?  4726.3369  41.5039          ?        ?      687.4        3.0       ?       ? 
1 1 1   28   14   31 o    193.9    3.6    0.0000   0.0000          ?        ?   376.0892  14.0475          ?        ?      193.9        3.6       ?       ? 
1 1 1   28   14   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   14   33 o    209.7    3.5    0.0000   0.0000          ?        ?   439.9414  14.6860          ?        ?      209.7        3.5       ?       ? 
1 1 1   28   14   34 o    495.6    2.6    0.0000   0.0000          ?        ?  2457.0312  25.5409          ?        ?      495.6        2.6       ?       ? 
1 1 1   28   14   35 o    276.9    3.0    0.0000   0.0000          ?        ?   766.8644  16.6016          ?        ?      276.9        3.0       ?       ? 
1 1 1   28   14   36 o    353.4    2.7    0.0000   0.0000          ?        ?  1248.9484  19.1556          ?        ?      353.4        2.7       ?       ? 
1 1 1   28   14   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   14   38 f    207.9    3.8    0.0000   0.0000          ?        ?   432.2791  15.9630          ?        ?      207.9        3.8       ?       ? 
1 1 1   28   14   39 o    711.6    2.9    0.0000   0.0000          ?        ?  5064.7534  40.8654          ?        ?      711.6        2.9       ?       ? 
1 1 1   28   14   40 o    380.7    2.6    0.0000   0.0000          ?        ?  1449.4441  19.7942          ?        ?      380.7        2.6       ?       ? 
1 1 1   28   14   41 o    247.7    3.6    0.0000   0.0000          ?        ?   613.6193  17.8786          ?        ?      247.7        3.6       ?       ? 
1 1 1   28   14   42 o    480.1    2.7    0.0000   0.0000          ?        ?  2305.7017  25.5409          ?        ?      480.1        2.7       ?       ? 
1 1 1   28   14   43 o    179.5    4.6    0.0000   0.0000          ?        ?   322.4534  16.6016          ?        ?      179.5        4.6       ?       ? 
1 1 1   28   14   44 o    135.8    5.9    0.0000   0.0000          ?        ?   184.5327  15.9630          ?        ?      135.8        5.9       ?       ? 
1 1 1   28   14   45 o    357.7    2.9    0.0000   0.0000          ?        ?  1279.5973  20.4327          ?        ?      357.7        2.9       ?       ? 
1 1 1   28   14   46 o     83.6    9.9    0.0000   0.0000          ?        ?    70.2374  16.6016          ?        ?       83.6        9.9       ?       ? 
1 1 1   28   14   47 f    341.5    2.8    0.0000   0.0000          ?        ?  1166.5790  19.1556          ?        ?      341.5        2.8       ?       ? 
1 1 1   28   14   48 o    359.1    2.8    0.0000   0.0000          ?        ?  1289.8137  20.4327          ?        ?      359.1        2.8       ?       ? 
1 1 1   28   14   49 o     83.2   10.4    0.0000   0.0000          ?        ?    69.5989  17.2401          ?        ?       83.2       10.4       ?       ? 
1 1 1   28   14   50 o    226.5    4.4    0.0000   0.0000          ?        ?   513.3714  19.7942          ?        ?      226.5        4.4       ?       ? 
1 1 1   28   14   51 o    233.8    4.1    0.0000   0.0000          ?        ?   547.2130  19.1556          ?        ?      233.8        4.1       ?       ? 
1 1 1   28   14   52 o    111.4    8.0    0.0000   0.0000          ?        ?   124.5117  17.8786          ?        ?      111.4        8.0       ?       ? 
1 1 1   28   14   53 o    223.5    4.1    0.0000   0.0000          ?        ?   499.9625  18.5171          ?        ?      223.5        4.1       ?       ? 
1 1 1   28   14   54 o    230.1    4.2    0.0000   0.0000          ?        ?   529.9730  19.1556          ?        ?      230.1        4.2       ?       ? 
1 1 1   28   14   55 o    504.2    2.8    0.0000   0.0000          ?        ?  2543.8701  28.7335          ?        ?      504.2        2.8       ?       ? 
1 1 1   28   14   56 o     27.3   12.9    0.0000   0.0000          ?        ?   -21.0712  18.5171          ?        ?       27.3       12.9       ?       ? 
1 1 1   28   14   57 o     53.1   16.4    0.0000   0.0000          ?        ?    28.7335  19.1556          ?        ?       53.1       16.4       ?       ? 
1 1 1   28   14   58 o     65.5   15.0    0.0000   0.0000          ?        ?    45.3350  19.1556          ?        ?       65.5       15.0       ?       ? 
1 1 1   28   14   59 o    123.2    7.8    0.0000   0.0000          ?        ?   152.6067  19.1556          ?        ?      123.2        7.8       ?       ? 
1 1 1   28   14   60 o    331.6    3.4    0.0000   0.0000          ?        ?  1100.8113  22.3483          ?        ?      331.6        3.4       ?       ? 
1 1 1   28   14   61 o     27.5   13.1    0.0000   0.0000          ?        ?   -24.9023  19.7942          ?        ?       27.5       13.1       ?       ? 
1 1 1   28   14   62 o    268.5    3.9    0.0000   0.0000          ?        ?   722.1680  21.0712          ?        ?      268.5        3.9       ?       ? 
1 1 1   28   14   63 o    129.4    7.4    0.0000   0.0000          ?        ?   168.5697  19.1556          ?        ?      129.4        7.4       ?       ? 
1 1 1   28   14   64 o    125.8    7.9    0.0000   0.0000          ?        ?   159.6304  19.7942          ?        ?      125.8        7.9       ?       ? 
1 1 1   28   14   65 o     73.3   13.6    0.0000   0.0000          ?        ?    56.8284  19.1556          ?        ?       73.3       13.6       ?       ? 
1 1 1   28   14   66 o    126.8    7.6    0.0000   0.0000          ?        ?   162.1845  19.1556          ?        ?      126.8        7.6       ?       ? 
1 1 1   28   14   67 o     46.2   16.4    0.0000   0.0000          ?        ?    19.7942  19.1556          ?        ?       46.2       16.4       ?       ? 
1 1 1   28   14   68 o     37.6   15.6    0.0000   0.0000          ?        ?     5.1082  19.1556          ?        ?       37.6       15.6       ?       ? 
1 1 1   28   15    0 o    284.2    4.4  808.3683  24.9023   808.3683  24.9023   808.3683  24.9023      284.2      4.4      284.2        4.4     0.0     0.0 
1 1 1   28   15    1 o    285.8    3.0    0.0000   0.0000          ?        ?   816.6692  17.2401          ?        ?      285.8        3.0       ?       ? 
1 1 1   28   15    2 o    842.1    3.7    0.0000   0.0000          ?        ?  7091.4209  62.5751          ?        ?      842.1        3.7       ?       ? 
1 1 1   28   15    3 o    607.1    3.0    0.0000   0.0000          ?        ?  3686.1853  37.0343          ?        ?      607.1        3.0       ?       ? 
1 1 1   28   15    4 f    648.8    3.0    0.0000   0.0000          ?        ?  4209.1348  38.9498          ?        ?      648.8        3.0       ?       ? 
1 1 1   28   15    5 o    428.2    2.5    0.0000   0.0000          ?        ?  1833.8342  21.0712          ?        ?      428.2        2.5       ?       ? 
1 1 1   28   15    6 o    866.2    3.5    0.0000   0.0000          ?        ?  7503.2676  60.0210          ?        ?      866.2        3.5       ?       ? 
1 1 1   28   15    7 o    506.8    2.7    0.0000   0.0000          ?        ?  2568.1340  27.4564          ?        ?      506.8        2.7       ?       ? 
1 1 1   28   15    8 o    140.2    3.9    0.0000   0.0000          ?        ?   196.6647  10.8549          ?        ?      140.2        3.9       ?       ? 
1 1 1   28   15    9 o    757.2    3.0    0.0000   0.0000          ?        ?  5734.5625  45.9736          ?        ?      757.2        3.0       ?       ? 
1 1 1   28   15   10 o    503.6    2.3    0.0000   0.0000          ?        ?  2536.2080  23.6253          ?        ?      503.6        2.3       ?       ? 
1 1 1   28   15   11 o    225.7    3.0    0.0000   0.0000          ?        ?   509.5403  13.4090          ?        ?      225.7        3.0       ?       ? 
1 1 1   28   15   12 o    620.3    3.0    0.0000   0.0000          ?        ?  3847.7312  37.6728          ?        ?      620.3        3.0       ?       ? 
1 1 1   28   15   13 o    329.8    2.2    0.0000   0.0000          ?        ?  1087.4023  14.6860          ?        ?      329.8        2.2       ?       ? 
1 1 1   28   15   14 f    298.1    2.5    0.0000   0.0000          ?        ?   888.8221  14.6860          ?        ?      298.1        2.5       ?       ? 
1 1 1   28   15   15 o    411.9    2.4    0.0000   0.0000          ?        ?  1696.5520  19.7942          ?        ?      411.9        2.4       ?       ? 
1 1 1   28   15   16 o    462.1    2.4    0.0000   0.0000          ?        ?  2135.8547  22.3483          ?        ?      462.1        2.4       ?       ? 
1 1 1   28   15   17 o    667.3    2.9    0.0000   0.0000          ?        ?  4453.6885  38.9498          ?        ?      667.3        2.9       ?       ? 
1 1 1   28   15   18 o    112.4    6.0    0.0000   0.0000          ?        ?   126.4273  13.4090          ?        ?      112.4        6.0       ?       ? 
1 1 1   28   15   19 o     18.2    9.1    0.0000   0.0000          ?        ?   -39.5883  14.0475          ?        ?       18.2        9.1       ?       ? 
1 1 1   28   15   20 o    116.1    5.5    0.0000   0.0000          ?        ?   134.7281  12.7704          ?        ?      116.1        5.5       ?       ? 
1 1 1   28   15   21 o    746.1    2.9    0.0000   0.0000          ?        ?  5567.2700  43.4195          ?        ?      746.1        2.9       ?       ? 
1 1 1   28   15   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   15   23 o    183.4    3.5    0.0000   0.0000          ?        ?   336.5009  12.7704          ?        ?      183.4        3.5       ?       ? 
1 1 1   28   15   24 o    369.3    2.4    0.0000   0.0000          ?        ?  1363.8822  17.8786          ?        ?      369.3        2.4       ?       ? 
1 1 1   28   15   25 o    861.3    3.3    0.0000   0.0000          ?        ?  7419.6211  56.1899          ?        ?      861.3        3.3       ?       ? 
1 1 1   28   15   26 o    204.0    3.4    0.0000   0.0000          ?        ?   416.3161  14.0475          ?        ?      204.0        3.4       ?       ? 
1 1 1   28   15   27 o    568.3    2.8    0.0000   0.0000          ?        ?  3229.6423  31.2876          ?        ?      568.3        2.8       ?       ? 
1 1 1   28   15   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   15   29 o    403.2    2.6    0.0000   0.0000          ?        ?  1625.6761  21.0712          ?        ?      403.2        2.6       ?       ? 
1 1 1   28   15   30 o     74.0    9.1    0.0000   0.0000          ?        ?    54.9129  13.4090          ?        ?       74.0        9.1       ?       ? 
1 1 1   28   15   31 o    720.8    2.8    0.0000   0.0000          ?        ?  5196.2891  40.8654          ?        ?      720.8        2.8       ?       ? 
1 1 1   28   15   32 o    579.1    2.8    0.0000   0.0000          ?        ?  3354.1541  32.5646          ?        ?      579.1        2.8       ?       ? 
1 1 1   28   15   33 o    513.1    2.5    0.0000   0.0000          ?        ?  2632.6245  25.5409          ?        ?      513.1        2.5       ?       ? 
1 1 1   28   15   34 o    503.9    2.7    0.0000   0.0000          ?        ?  2540.0391  26.8179          ?        ?      503.9        2.7       ?       ? 
1 1 1   28   15   35 o    300.3    2.9    0.0000   0.0000          ?        ?   902.2311  17.2401          ?        ?      300.3        2.9       ?       ? 
1 1 1   28   15   36 f    418.6    2.5    0.0000   0.0000          ?        ?  1752.7418  21.0712          ?        ?      418.6        2.5       ?       ? 
1 1 1   28   15   37 f    311.3    2.9    0.0000   0.0000          ?        ?   969.2759  17.8786          ?        ?      311.3        2.9       ?       ? 
1 1 1   28   15   38 o     31.0   13.7    0.0000   0.0000          ?        ?    -5.1082  16.6016          ?        ?       31.0       13.7       ?       ? 
1 1 1   28   15   39 o    473.0    2.5    0.0000   0.0000          ?        ?  2237.3796  23.6253          ?        ?      473.0        2.5       ?       ? 
1 1 1   28   15   40 o    508.7    2.6    0.0000   0.0000          ?        ?  2587.9280  26.1794          ?        ?      508.7        2.6       ?       ? 
1 1 1   28   15   41 o    648.0    2.8    0.0000   0.0000          ?        ?  4200.1953  35.7572          ?        ?      648.0        2.8       ?       ? 
1 1 1   28   15   42 o    424.1    2.6    0.0000   0.0000          ?        ?  1799.3539  21.7097          ?        ?      424.1        2.6       ?       ? 
1 1 1   28   15   43 f    165.4    5.0    0.0000   0.0000          ?        ?   273.9258  16.6016          ?        ?      165.4        5.0       ?       ? 
1 1 1   28   15   44 o    431.6    2.7    0.0000   0.0000          ?        ?  1863.2061  22.9868          ?        ?      431.6        2.7       ?       ? 
1 1 1   28   15   45 o    192.9    4.3    0.0000   0.0000          ?        ?   372.2581  16.6016          ?        ?      192.9        4.3       ?       ? 
1 1 1   28   15   46 o    495.5    2.6    0.0000   0.0000          ?        ?  2456.3928  26.1794          ?        ?      495.5        2.6       ?       ? 
1 1 1   28   15   47 o    295.0    3.1    0.0000   0.0000          ?        ?   870.9435  18.5171          ?        ?      295.0        3.1       ?       ? 
1 1 1   28   15   48 o     73.9   11.2    0.0000   0.0000          ?        ?    54.9129  16.6016          ?        ?       73.9       11.2       ?       ? 
1 1 1   28   15   49 o    319.4    3.3    0.0000   0.0000          ?        ?  1020.9960  21.0712          ?        ?      319.4        3.3       ?       ? 
1 1 1   28   15   50 o    556.0    2.7    0.0000   0.0000          ?        ?  3092.3601  30.0105          ?        ?      556.0        2.7       ?       ? 
1 1 1   28   15   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   15   52 o     44.4   16.4    0.0000   0.0000          ?        ?    15.9630  19.1556          ?        ?       44.4       16.4       ?       ? 
1 1 1   28   15   53 o     79.6   11.6    0.0000   0.0000          ?        ?    63.8522  18.5171          ?        ?       79.6       11.6       ?       ? 
1 1 1   28   15   54 o    217.4    4.6    0.0000   0.0000          ?        ?   473.1445  19.7942          ?        ?      217.4        4.6       ?       ? 
1 1 1   28   15   55 o    172.1    5.8    0.0000   0.0000          ?        ?   296.9126  19.7942          ?        ?      172.1        5.8       ?       ? 
1 1 1   28   15   56 o     46.6   15.9    0.0000   0.0000          ?        ?    20.4327  17.8786          ?        ?       46.6       15.9       ?       ? 
1 1 1   28   15   57 o    237.7    4.0    0.0000   0.0000          ?        ?   565.7302  19.1556          ?        ?      237.7        4.0       ?       ? 
1 1 1   28   15   58 o    290.8    3.5    0.0000   0.0000          ?        ?   846.6797  20.4327          ?        ?      290.8        3.5       ?       ? 
1 1 1   28   15   59 f    260.1    4.1    0.0000   0.0000          ?        ?   677.4714  21.0712          ?        ?      260.1        4.1       ?       ? 
1 1 1   28   15   60 o     55.4   16.6    0.0000   0.0000          ?        ?    31.9261  19.7942          ?        ?       55.4       16.6       ?       ? 
1 1 1   28   15   61 o    217.1    4.6    0.0000   0.0000          ?        ?   472.5060  19.7942          ?        ?      217.1        4.6       ?       ? 
1 1 1   28   15   62 o     39.8   16.1    0.0000   0.0000          ?        ?     7.6623  19.7942          ?        ?       39.8       16.1       ?       ? 
1 1 1   28   15   63 o    124.6    7.7    0.0000   0.0000          ?        ?   156.4378  19.1556          ?        ?      124.6        7.7       ?       ? 
1 1 1   28   15   64 o    125.8    7.9    0.0000   0.0000          ?        ?   159.6304  19.7942          ?        ?      125.8        7.9       ?       ? 
1 1 1   28   15   65 o     27.7   13.2    0.0000   0.0000          ?        ?   -23.6253  19.7942          ?        ?       27.7       13.2       ?       ? 
1 1 1   28   15   66 o     44.5   16.8    0.0000   0.0000          ?        ?    15.9630  20.4327          ?        ?       44.5       16.8       ?       ? 
1 1 1   28   15   67 o     51.4   16.5    0.0000   0.0000          ?        ?    27.4564  19.1556          ?        ?       51.4       16.5       ?       ? 
1 1 1   28   15   68 o    158.6    6.0    0.0000   0.0000          ?        ?   253.4931  19.1556          ?        ?      158.6        6.0       ?       ? 
1 1 1   28   16    0 o     95.2    9.2   93.2242  17.2401    93.2242  17.2401    93.2242  17.2401       95.2      9.2       95.2        9.2     0.0     0.0 
1 1 1   28   16    1 o    239.2    2.9    0.0000   0.0000          ?        ?   572.1154  14.0475          ?        ?      239.2        2.9       ?       ? 
1 1 1   28   16    2 o    846.6    3.9    0.0000   0.0000          ?        ?  7167.4053  65.7677          ?        ?      846.6        3.9       ?       ? 
1 1 1   28   16    3 o    599.6    3.2    0.0000   0.0000          ?        ?  3594.8767  38.9498          ?        ?      599.6        3.2       ?       ? 
1 1 1   28   16    4 o    555.3    2.9    0.0000   0.0000          ?        ?  3084.0596  32.5646          ?        ?      555.3        2.9       ?       ? 
1 1 1   28   16    5 o    498.4    2.8    0.0000   0.0000          ?        ?  2483.8491  27.4564          ?        ?      498.4        2.8       ?       ? 
1 1 1   28   16    6 o    629.5    2.9    0.0000   0.0000          ?        ?  3962.6650  36.3957          ?        ?      629.5        2.9       ?       ? 
1 1 1   28   16    7 o    357.6    2.5    0.0000   0.0000          ?        ?  1278.9589  17.8786          ?        ?      357.6        2.5       ?       ? 
1 1 1   28   16    8 o    507.4    2.6    0.0000   0.0000          ?        ?  2574.5193  26.8179          ?        ?      507.4        2.6       ?       ? 
1 1 1   28   16    9 o    428.4    2.2    0.0000   0.0000          ?        ?  1835.1111  19.1556          ?        ?      428.4        2.2       ?       ? 
1 1 1   28   16   10 o     17.4    8.4    0.0000   0.0000          ?        ?   -14.6860   8.9393          ?        ?       17.4        8.4       ?       ? 
1 1 1   28   16   11 o    750.3    3.1    0.0000   0.0000          ?        ?  5629.8452  46.6121          ?        ?      750.3        3.1       ?       ? 
1 1 1   28   16   12 o    849.5    3.3    0.0000   0.0000          ?        ?  7217.8486  55.5514          ?        ?      849.5        3.3       ?       ? 
1 1 1   28   16   13 o    720.3    2.9    0.0000   0.0000          ?        ?  5188.6265  42.1424          ?        ?      720.3        2.9       ?       ? 
1 1 1   28   16   14 o    383.1    2.7    0.0000   0.0000          ?        ?  1467.9612  20.4327          ?        ?      383.1        2.7       ?       ? 
1 1 1   28   16   15 o    439.3    2.6    0.0000   0.0000          ?        ?  1930.2509  22.9868          ?        ?      439.3        2.6       ?       ? 
1 1 1   28   16   16 o    544.1    2.6    0.0000   0.0000          ?        ?  2960.1863  28.7335          ?        ?      544.1        2.6       ?       ? 
1 1 1   28   16   17 o    268.5    2.6    0.0000   0.0000          ?        ?   720.8909  14.0475          ?        ?      268.5        2.6       ?       ? 
1 1 1   28   16   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   16   19 o    504.1    2.6    0.0000   0.0000          ?        ?  2541.3162  26.1794          ?        ?      504.1        2.6       ?       ? 
1 1 1   28   16   20 o    414.8    2.4    0.0000   0.0000          ?        ?  1720.8158  19.7942          ?        ?      414.8        2.4       ?       ? 
1 1 1   28   16   21 o    366.5    2.4    0.0000   0.0000          ?        ?  1343.4495  17.2401          ?        ?      366.5        2.4       ?       ? 
1 1 1   28   16   22 o    673.8    2.7    0.0000   0.0000          ?        ?  4541.1660  37.0343          ?        ?      673.8        2.7       ?       ? 
1 1 1   28   16   23 o    330.2    2.4    0.0000   0.0000          ?        ?  1090.5950  15.9630          ?        ?      330.2        2.4       ?       ? 
1 1 1   28   16   24 o    237.2    3.0    0.0000   0.0000          ?        ?   562.5375  14.0475          ?        ?      237.2        3.0       ?       ? 
1 1 1   28   16   25 o    563.1    2.5    0.0000   0.0000          ?        ?  3171.5371  28.0950          ?        ?      563.1        2.5       ?       ? 
1 1 1   28   16   26 o    293.8    2.6    0.0000   0.0000          ?        ?   863.2812  15.3245          ?        ?      293.8        2.6       ?       ? 
1 1 1   28   16   27 o    473.7    2.5    0.0000   0.0000          ?        ?  2244.4036  23.6253          ?        ?      473.7        2.5       ?       ? 
1 1 1   28   16   28 o    234.6    3.0    0.0000   0.0000          ?        ?   550.4056  14.0475          ?        ?      234.6        3.0       ?       ? 
1 1 1   28   16   29 f    346.5    2.8    0.0000   0.0000          ?        ?  1201.0592  19.1556          ?        ?      346.5        2.8       ?       ? 
1 1 1   28   16   30 o    596.4    2.7    0.0000   0.0000          ?        ?  3557.2039  31.9261          ?        ?      596.4        2.7       ?       ? 
1 1 1   28   16   31 o    607.6    2.7    0.0000   0.0000          ?        ?  3691.9321  32.5646          ?        ?      607.6        2.7       ?       ? 
1 1 1   28   16   32 o    470.9    2.6    0.0000   0.0000          ?        ?  2218.2241  24.2638          ?        ?      470.9        2.6       ?       ? 
1 1 1   28   16   33 o    426.9    2.5    0.0000   0.0000          ?        ?  1822.9792  21.0712          ?        ?      426.9        2.5       ?       ? 
1 1 1   28   16   34 o    243.8    3.1    0.0000   0.0000          ?        ?   594.4636  15.3245          ?        ?      243.8        3.1       ?       ? 
1 1 1   28   16   35 o    120.3    7.4    0.0000   0.0000          ?        ?   144.9444  17.8786          ?        ?      120.3        7.4       ?       ? 
1 1 1   28   16   36 o    903.3    3.4    0.0000   0.0000          ?        ?  8161.5830  60.6596          ?        ?      903.3        3.4       ?       ? 
1 1 1   28   16   37 f    328.5    2.7    0.0000   0.0000          ?        ?  1079.1016  17.8786          ?        ?      328.5        2.7       ?       ? 
1 1 1   28   16   38 o    245.0    3.3    0.0000   0.0000          ?        ?   600.2103  15.9630          ?        ?      245.0        3.3       ?       ? 
1 1 1   28   16   39 o    458.5    2.5    0.0000   0.0000          ?        ?  2102.6516  22.9868          ?        ?      458.5        2.5       ?       ? 
1 1 1   28   16   40 o    180.9    4.6    0.0000   0.0000          ?        ?   327.5616  16.6016          ?        ?      180.9        4.6       ?       ? 
1 1 1   28   16   41 o    154.1    5.0    0.0000   0.0000          ?        ?   237.5300  15.3245          ?        ?      154.1        5.0       ?       ? 
1 1 1   28   16   42 o    178.1    4.3    0.0000   0.0000          ?        ?   317.3452  15.3245          ?        ?      178.1        4.3       ?       ? 
1 1 1   28   16   43 o    301.5    3.0    0.0000   0.0000          ?        ?   909.2548  17.8786          ?        ?      301.5        3.0       ?       ? 
1 1 1   28   16   44 o    443.0    2.6    0.0000   0.0000          ?        ?  1962.8154  22.9868          ?        ?      443.0        2.6       ?       ? 
1 1 1   28   16   45 o    256.6    3.4    0.0000   0.0000          ?        ?   658.9543  17.2401          ?        ?      256.6        3.4       ?       ? 
1 1 1   28   16   46 o    105.9    7.5    0.0000   0.0000          ?        ?   112.3798  15.9630          ?        ?      105.9        7.5       ?       ? 
1 1 1   28   16   47 o    421.3    2.7    0.0000   0.0000          ?        ?  1775.7286  22.3483          ?        ?      421.3        2.7       ?       ? 
1 1 1   28   16   48 o    304.0    3.0    0.0000   0.0000          ?        ?   924.5793  18.5171          ?        ?      304.0        3.0       ?       ? 
1 1 1   28   16   49 o    349.6    2.8    0.0000   0.0000          ?        ?  1222.7689  19.7942          ?        ?      349.6        2.8       ?       ? 
1 1 1   28   16   50 o    200.0    4.3    0.0000   0.0000          ?        ?   400.3531  17.2401          ?        ?      200.0        4.3       ?       ? 
1 1 1   28   16   51 o    219.6    4.2    0.0000   0.0000          ?        ?   482.7224  18.5171          ?        ?      219.6        4.2       ?       ? 
1 1 1   28   16   52 o    221.0    4.2    0.0000   0.0000          ?        ?   489.1075  18.5171          ?        ?      221.0        4.2       ?       ? 
1 1 1   28   16   53 o    217.1    4.6    0.0000   0.0000          ?        ?   471.8675  19.7942          ?        ?      217.1        4.6       ?       ? 
1 1 1   28   16   54 o    387.6    3.0    0.0000   0.0000          ?        ?  1503.0798  22.9868          ?        ?      387.6        3.0       ?       ? 
1 1 1   28   16   55 o    101.4    9.1    0.0000   0.0000          ?        ?   103.4405  18.5171          ?        ?      101.4        9.1       ?       ? 
1 1 1   28   16   56 o    190.1    5.0    0.0000   0.0000          ?        ?   362.0418  19.1556          ?        ?      190.1        5.0       ?       ? 
1 1 1   28   16   57 o    180.6    5.1    0.0000   0.0000          ?        ?   326.9231  18.5171          ?        ?      180.6        5.1       ?       ? 
1 1 1   28   16   58 o    272.8    3.7    0.0000   0.0000          ?        ?   745.1547  20.4327          ?        ?      272.8        3.7       ?       ? 
1 1 1   28   16   59 o    213.9    4.5    0.0000   0.0000          ?        ?   458.4586  19.1556          ?        ?      213.9        4.5       ?       ? 
1 1 1   28   16   60 o    268.6    3.8    0.0000   0.0000          ?        ?   722.8065  20.4327          ?        ?      268.6        3.8       ?       ? 
1 1 1   28   16   61 o    113.6    8.7    0.0000   0.0000          ?        ?   130.2584  19.7942          ?        ?      113.6        8.7       ?       ? 
1 1 1   28   16   62 o    106.4    9.0    0.0000   0.0000          ?        ?   114.2954  19.1556          ?        ?      106.4        9.0       ?       ? 
1 1 1   28   16   63 o    215.7    4.6    0.0000   0.0000          ?        ?   466.7593  19.7942          ?        ?      215.7        4.6       ?       ? 
1 1 1   28   16   64 o    307.7    3.4    0.0000   0.0000          ?        ?   948.2046  21.0712          ?        ?      307.7        3.4       ?       ? 
1 1 1   28   16   65 o    287.8    3.7    0.0000   0.0000          ?        ?   830.0781  21.0712          ?        ?      287.8        3.7       ?       ? 
1 1 1   28   16   66 o     88.3   11.2    0.0000   0.0000          ?        ?    79.8152  19.7942          ?        ?       88.3       11.2       ?       ? 
1 1 1   28   16   67 o    191.6    5.2    0.0000   0.0000          ?        ?   369.0655  19.7942          ?        ?      191.6        5.2       ?       ? 
1 1 1   28   17    0 o    748.5    4.8 5603.6655  72.1529  5603.6655  72.1529  5603.6655  72.1529      748.5      4.8      748.5        4.8     0.0     0.0 
1 1 1   28   17    1 o    519.2    2.7    0.0000   0.0000          ?        ?  2695.8384  28.0950          ?        ?      519.2        2.7       ?       ? 
1 1 1   28   17    2 o   1180.3    4.8    0.0000   0.0000          ?        ? 13933.1807 112.3798          ?        ?     1180.3        4.8       ?       ? 
1 1 1   28   17    3 o   1204.9    4.8    0.0000   0.0000          ?        ? 14519.9814 116.8494          ?        ?     1204.9        4.8       ?       ? 
1 1 1   28   17    4 o    294.9    2.7    0.0000   0.0000          ?        ?   869.6664  15.9630          ?        ?      294.9        2.7       ?       ? 
1 1 1   28   17    5 o    353.3    2.6    0.0000   0.0000          ?        ?  1248.3098  18.5171          ?        ?      353.3        2.6       ?       ? 
1 1 1   28   17    6 o    769.8    3.4    0.0000   0.0000          ?        ?  5926.1191  52.3588          ?        ?      769.8        3.4       ?       ? 
1 1 1   28   17    7 o    830.1    3.4    0.0000   0.0000          ?        ?  6890.9253  56.8284          ?        ?      830.1        3.4       ?       ? 
1 1 1   28   17    8 o    412.7    2.4    0.0000   0.0000          ?        ?  1702.9373  19.7942          ?        ?      412.7        2.4       ?       ? 
1 1 1   28   17    9 o    690.3    3.0    0.0000   0.0000          ?        ?  4765.9258  41.5039          ?        ?      690.3        3.0       ?       ? 
1 1 1   28   17   10 o    417.5    2.2    0.0000   0.0000          ?        ?  1743.1641  18.5171          ?        ?      417.5        2.2       ?       ? 
1 1 1   28   17   11 o    914.3    3.5    0.0000   0.0000          ?        ?  8360.8027  63.8522          ?        ?      914.3        3.5       ?       ? 
1 1 1   28   17   12 o    757.7    3.0    0.0000   0.0000          ?        ?  5742.2251  45.3350          ?        ?      757.7        3.0       ?       ? 
1 1 1   28   17   13 o    640.7    2.7    0.0000   0.0000          ?        ?  4105.6938  35.1187          ?        ?      640.7        2.7       ?       ? 
1 1 1   28   17   14 o    644.0    2.7    0.0000   0.0000          ?        ?  4147.8364  34.4802          ?        ?      644.0        2.7       ?       ? 
1 1 1   28   17   15 o   1138.5    4.1    0.0000   0.0000          ?        ? 12965.1816  93.8627          ?        ?     1138.5        4.1       ?       ? 
1 1 1   28   17   16 o    396.1    2.4    0.0000   0.0000          ?        ?  1568.8477  19.1556          ?        ?      396.1        2.4       ?       ? 
1 1 1   28   17   17 o    694.2    2.8    0.0000   0.0000          ?        ?  4819.5610  38.9498          ?        ?      694.2        2.8       ?       ? 
1 1 1   28   17   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   17   19 o    389.2    2.5    0.0000   0.0000          ?        ?  1515.2118  19.1556          ?        ?      389.2        2.5       ?       ? 
1 1 1   28   17   20 o    383.7    2.4    0.0000   0.0000          ?        ?  1472.4309  18.5171          ?        ?      383.7        2.4       ?       ? 
1 1 1   28   17   21 o    293.6    2.6    0.0000   0.0000          ?        ?   862.0042  15.3245          ?        ?      293.6        2.6       ?       ? 
1 1 1   28   17   22 o    298.7    2.6    0.0000   0.0000          ?        ?   892.0147  15.3245          ?        ?      298.7        2.6       ?       ? 
1 1 1   28   17   23 o    342.0    2.5    0.0000   0.0000          ?        ?  1169.7716  17.2401          ?        ?      342.0        2.5       ?       ? 
1 1 1   28   17   24 o    593.9    2.5    0.0000   0.0000          ?        ?  3527.1936  30.0105          ?        ?      593.9        2.5       ?       ? 
1 1 1   28   17   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   17   26 o    567.1    2.6    0.0000   0.0000          ?        ?  3216.8718  29.3720          ?        ?      567.1        2.6       ?       ? 
1 1 1   28   17   27 o    821.6    3.1    0.0000   0.0000          ?        ?  6751.7280  50.4432          ?        ?      821.6        3.1       ?       ? 
1 1 1   28   17   28 o    500.6    2.5    0.0000   0.0000          ?        ?  2506.1973  24.9023          ?        ?      500.6        2.5       ?       ? 
1 1 1   28   17   29 o    519.7    2.6    0.0000   0.0000          ?        ?  2700.9465  26.8179          ?        ?      519.7        2.6       ?       ? 
1 1 1   28   17   30 f    175.4    4.2    0.0000   0.0000          ?        ?   307.7674  14.6860          ?        ?      175.4        4.2       ?       ? 
1 1 1   28   17   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   17   32 o    219.4    3.6    0.0000   0.0000          ?        ?   481.4453  15.9630          ?        ?      219.4        3.6       ?       ? 
1 1 1   28   17   33 o    675.6    2.9    0.0000   0.0000          ?        ?  4564.7915  38.9498          ?        ?      675.6        2.9       ?       ? 
1 1 1   28   17   34 o    298.3    2.9    0.0000   0.0000          ?        ?   890.0991  17.2401          ?        ?      298.3        2.9       ?       ? 
1 1 1   28   17   35 o    748.8    3.1    0.0000   0.0000          ?        ?  5608.7739  45.9736          ?        ?      748.8        3.1       ?       ? 
1 1 1   28   17   36 o    272.9    3.3    0.0000   0.0000          ?        ?   745.1547  17.8786          ?        ?      272.9        3.3       ?       ? 
1 1 1   28   17   37 o    523.8    2.7    0.0000   0.0000          ?        ?  2744.3660  28.0950          ?        ?      523.8        2.7       ?       ? 
1 1 1   28   17   38 o     66.7   11.0    0.0000   0.0000          ?        ?    44.6965  14.6860          ?        ?       66.7       11.0       ?       ? 
1 1 1   28   17   39 o    183.6    4.3    0.0000   0.0000          ?        ?   337.1394  15.9630          ?        ?      183.6        4.3       ?       ? 
1 1 1   28   17   40 o    411.9    2.6    0.0000   0.0000          ?        ?  1697.1904  21.7097          ?        ?      411.9        2.6       ?       ? 
1 1 1   28   17   41 o    351.4    2.7    0.0000   0.0000          ?        ?  1234.9008  19.1556          ?        ?      351.4        2.7       ?       ? 
1 1 1   28   17   42 f     21.4   10.6    0.0000   0.0000          ?        ?   -37.6728  16.6016          ?        ?       21.4       10.6       ?       ? 
1 1 1   28   17   43 o    469.1    2.6    0.0000   0.0000          ?        ?  2200.9841  24.2638          ?        ?      469.1        2.6       ?       ? 
1 1 1   28   17   44 o    302.3    3.1    0.0000   0.0000          ?        ?   914.3630  18.5171          ?        ?      302.3        3.1       ?       ? 
1 1 1   28   17   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   17   46 o    136.9    6.1    0.0000   0.0000          ?        ?   187.7254  16.6016          ?        ?      136.9        6.1       ?       ? 
1 1 1   28   17   47 o    267.0    3.5    0.0000   0.0000          ?        ?   713.2286  18.5171          ?        ?      267.0        3.5       ?       ? 
1 1 1   28   17   48 o    243.6    3.7    0.0000   0.0000          ?        ?   593.8251  17.8786          ?        ?      243.6        3.7       ?       ? 
1 1 1   28   17   49 o    171.8    5.0    0.0000   0.0000          ?        ?   295.6355  17.2401          ?        ?      171.8        5.0       ?       ? 
1 1 1   28   17   50 o    153.4    5.6    0.0000   0.0000          ?        ?   235.6145  17.2401          ?        ?      153.4        5.6       ?       ? 
1 1 1   28   17   51 o    143.0    6.5    0.0000   0.0000          ?        ?   204.9654  18.5171          ?        ?      143.0        6.5       ?       ? 
1 1 1   28   17   52 o    439.2    2.8    0.0000   0.0000          ?        ?  1930.2509  24.9023          ?        ?      439.2        2.8       ?       ? 
1 1 1   28   17   53 o     41.6   16.1    0.0000   0.0000          ?        ?    11.4934  19.1556          ?        ?       41.6       16.1       ?       ? 
1 1 1   28   17   54 o    194.7    4.9    0.0000   0.0000          ?        ?   379.9204  19.1556          ?        ?      194.7        4.9       ?       ? 
1 1 1   28   17   55 o    238.9    4.1    0.0000   0.0000          ?        ?   571.4769  19.7942          ?        ?      238.9        4.1       ?       ? 
1 1 1   28   17   56 o     62.6   15.0    0.0000   0.0000          ?        ?    41.5039  18.5171          ?        ?       62.6       15.0       ?       ? 
1 1 1   28   17   57 o     49.5   16.2    0.0000   0.0000          ?        ?    24.2638  18.5171          ?        ?       49.5       16.2       ?       ? 
1 1 1   28   17   58 o     92.7   10.3    0.0000   0.0000          ?        ?    86.8389  19.1556          ?        ?       92.7       10.3       ?       ? 
1 1 1   28   17   59 f    178.2    5.4    0.0000   0.0000          ?        ?   318.6223  19.1556          ?        ?      178.2        5.4       ?       ? 
1 1 1   28   17   60 o    109.9    9.0    0.0000   0.0000          ?        ?   121.9576  19.7942          ?        ?      109.9        9.0       ?       ? 
1 1 1   28   17   61 o    314.7    3.3    0.0000   0.0000          ?        ?   991.6241  21.0712          ?        ?      314.7        3.3       ?       ? 
1 1 1   28   17   62 o    218.2    4.7    0.0000   0.0000          ?        ?   477.6142  20.4327          ?        ?      218.2        4.7       ?       ? 
1 1 1   28   17   63 o     91.1   10.5    0.0000   0.0000          ?        ?    84.2849  19.1556          ?        ?       91.1       10.5       ?       ? 
1 1 1   28   17   64 o    167.5    5.9    0.0000   0.0000          ?        ?   282.2266  19.7942          ?        ?      167.5        5.9       ?       ? 
1 1 1   28   17   65 f     22.5   11.2    0.0000   0.0000          ?        ?   -44.6965  19.1556          ?        ?       22.5       11.2       ?       ? 
1 1 1   28   17   66 o     34.6   15.0    0.0000   0.0000          ?        ?    -1.2770  19.1556          ?        ?       34.6       15.0       ?       ? 
1 1 1   28   18    0 o    334.9    3.7 1121.8824  24.9023  1121.8824  24.9023  1121.8824  24.9023      334.9      3.7      334.9        3.7     0.0     0.0 
1 1 1   28   18    1 o    679.9    3.2    0.0000   0.0000          ?        ?  4622.8965  44.0580          ?        ?      679.9        3.2       ?       ? 
1 1 1   28   18    2 f    265.0    2.8    0.0000   0.0000          ?        ?   702.3738  14.6860          ?        ?      265.0        2.8       ?       ? 
1 1 1   28   18    3 o    451.0    2.6    0.0000   0.0000          ?        ?  2034.3300  23.6253          ?        ?      451.0        2.6       ?       ? 
1 1 1   28   18    4 o    314.4    2.6    0.0000   0.0000          ?        ?   988.4315  16.6016          ?        ?      314.4        2.6       ?       ? 
1 1 1   28   18    5 o    322.9    2.6    0.0000   0.0000          ?        ?  1042.7058  16.6016          ?        ?      322.9        2.6       ?       ? 
1 1 1   28   18    6 o    296.8    3.0    0.0000   0.0000          ?        ?   881.1599  17.8786          ?        ?      296.8        3.0       ?       ? 
1 1 1   28   18    7 f    399.8    2.7    0.0000   0.0000          ?        ?  1598.8582  21.7097          ?        ?      399.8        2.7       ?       ? 
1 1 1   28   18    8 o    298.3    2.9    0.0000   0.0000          ?        ?   890.0991  17.2401          ?        ?      298.3        2.9       ?       ? 
1 1 1   28   18    9 o    755.9    3.3    0.0000   0.0000          ?        ?  5714.7686  49.1662          ?        ?      755.9        3.3       ?       ? 
1 1 1   28   18   10 o    179.7    3.4    0.0000   0.0000          ?        ?   323.0919  12.1319          ?        ?      179.7        3.4       ?       ? 
1 1 1   28   18   11 o     87.5    4.7    0.0000   0.0000          ?        ?    76.6226   8.3008          ?        ?       87.5        4.7       ?       ? 
1 1 1   28   18   12 o    744.7    3.0    0.0000   0.0000          ?        ?  5546.1987  44.0580          ?        ?      744.7        3.0       ?       ? 
1 1 1   28   18   13 o    749.3    2.9    0.0000   0.0000          ?        ?  5615.1592  42.7809          ?        ?      749.3        2.9       ?       ? 
1 1 1   28   18   14 o    440.3    2.5    0.0000   0.0000          ?        ?  1938.5518  21.7097          ?        ?      440.3        2.5       ?       ? 
1 1 1   28   18   15 o    299.3    2.6    0.0000   0.0000          ?        ?   895.8459  15.3245          ?        ?      299.3        2.6       ?       ? 
1 1 1   28   18   16 o    547.9    2.4    0.0000   0.0000          ?        ?  3002.3289  26.8179          ?        ?      547.9        2.4       ?       ? 
1 1 1   28   18   17 o    381.6    2.3    0.0000   0.0000          ?        ?  1456.4679  17.2401          ?        ?      381.6        2.3       ?       ? 
1 1 1   28   18   18 o    376.3    2.3    0.0000   0.0000          ?        ?  1416.2410  17.2401          ?        ?      376.3        2.3       ?       ? 
1 1 1   28   18   19 o    149.9    3.8    0.0000   0.0000          ?        ?   224.7596  11.4934          ?        ?      149.9        3.8       ?       ? 
1 1 1   28   18   20 o    650.2    2.8    0.0000   0.0000          ?        ?  4228.2905  37.0343          ?        ?      650.2        2.8       ?       ? 
1 1 1   28   18   21 o    392.2    2.4    0.0000   0.0000          ?        ?  1538.1986  19.1556          ?        ?      392.2        2.4       ?       ? 
1 1 1   28   18   22 o    197.3    3.4    0.0000   0.0000          ?        ?   389.4982  13.4090          ?        ?      197.3        3.4       ?       ? 
1 1 1   28   18   23 o    790.9    3.1    0.0000   0.0000          ?        ?  6256.2349  49.8047          ?        ?      790.9        3.1       ?       ? 
1 1 1   28   18   24 o    129.8    4.9    0.0000   0.0000          ?        ?   168.5697  12.7704          ?        ?      129.8        4.9       ?       ? 
1 1 1   28   18   25 o    934.3    3.3    0.0000   0.0000          ?        ?  8730.5068  62.5751          ?        ?      934.3        3.3       ?       ? 
1 1 1   28   18   26 o    521.1    2.5    0.0000   0.0000          ?        ?  2716.2710  26.1794          ?        ?      521.1        2.5       ?       ? 
1 1 1   28   18   27 o    444.1    2.4    0.0000   0.0000          ?        ?  1972.3933  21.7097          ?        ?      444.1        2.4       ?       ? 
1 1 1   28   18   28 o    454.5    2.5    0.0000   0.0000          ?        ?  2065.6174  22.3483          ?        ?      454.5        2.5       ?       ? 
1 1 1   28   18   29 o    128.8    5.2    0.0000   0.0000          ?        ?   166.0156  13.4090          ?        ?      128.8        5.2       ?       ? 
1 1 1   28   18   30 o    323.6    2.7    0.0000   0.0000          ?        ?  1047.1754  17.2401          ?        ?      323.6        2.7       ?       ? 
1 1 1   28   18   31 o    144.7    4.9    0.0000   0.0000          ?        ?   209.4351  14.0475          ?        ?      144.7        4.9       ?       ? 
1 1 1   28   18   32 f    403.5    2.5    0.0000   0.0000          ?        ?  1628.2301  20.4327          ?        ?      403.5        2.5       ?       ? 
1 1 1   28   18   33 o    297.3    2.9    0.0000   0.0000          ?        ?   884.3525  17.2401          ?        ?      297.3        2.9       ?       ? 
1 1 1   28   18   34 o    538.7    2.5    0.0000   0.0000          ?        ?  2902.7192  26.8179          ?        ?      538.7        2.5       ?       ? 
1 1 1   28   18   35 o    251.9    3.3    0.0000   0.0000          ?        ?   634.6905  16.6016          ?        ?      251.9        3.3       ?       ? 
1 1 1   28   18   36 f    917.0    3.4    0.0000   0.0000          ?        ?  8411.8838  61.9366          ?        ?      917.0        3.4       ?       ? 
1 1 1   28   18   37 o    428.0    2.7    0.0000   0.0000          ?        ?  1832.5571  22.9868          ?        ?      428.0        2.7       ?       ? 
1 1 1   28   18   38 o    245.2    3.3    0.0000   0.0000          ?        ?   601.4874  15.9630          ?        ?      245.2        3.3       ?       ? 
1 1 1   28   18   39 o    332.0    2.7    0.0000   0.0000          ?        ?  1102.7268  17.8786          ?        ?      332.0        2.7       ?       ? 
1 1 1   28   18   40 o    442.6    2.5    0.0000   0.0000          ?        ?  1959.6228  22.3483          ?        ?      442.6        2.5       ?       ? 
1 1 1   28   18   41 o    513.2    2.7    0.0000   0.0000          ?        ?  2634.5403  28.0950          ?        ?      513.2        2.7       ?       ? 
1 1 1   28   18   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   18   43 o    246.4    3.5    0.0000   0.0000          ?        ?   607.2341  17.2401          ?        ?      246.4        3.5       ?       ? 
1 1 1   28   18   44 o    247.0    3.4    0.0000   0.0000          ?        ?   610.4266  16.6016          ?        ?      247.0        3.4       ?       ? 
1 1 1   28   18   45 o    111.1    7.5    0.0000   0.0000          ?        ?   123.8732  16.6016          ?        ?      111.1        7.5       ?       ? 
1 1 1   28   18   46 o    254.5    3.6    0.0000   0.0000          ?        ?   648.0994  18.5171          ?        ?      254.5        3.6       ?       ? 
1 1 1   28   18   47 o    541.5    2.7    0.0000   0.0000          ?        ?  2933.3684  28.7335          ?        ?      541.5        2.7       ?       ? 
1 1 1   28   18   48 o    410.9    2.7    0.0000   0.0000          ?        ?  1688.8896  22.3483          ?        ?      410.9        2.7       ?       ? 
1 1 1   28   18   49 o    243.8    3.8    0.0000   0.0000          ?        ?   595.1021  18.5171          ?        ?      243.8        3.8       ?       ? 
1 1 1   28   18   50 o    178.7    4.8    0.0000   0.0000          ?        ?   319.8993  17.2401          ?        ?      178.7        4.8       ?       ? 
1 1 1   28   18   51 o    240.8    4.0    0.0000   0.0000          ?        ?   580.4161  19.1556          ?        ?      240.8        4.0       ?       ? 
1 1 1   28   18   52 o    141.8    6.5    0.0000   0.0000          ?        ?   201.7728  18.5171          ?        ?      141.8        6.5       ?       ? 
1 1 1   28   18   53 o     37.9   15.5    0.0000   0.0000          ?        ?     5.7467  18.5171          ?        ?       37.9       15.5       ?       ? 
1 1 1   28   18   54 o    119.0    8.0    0.0000   0.0000          ?        ?   142.3903  19.1556          ?        ?      119.0        8.0       ?       ? 
1 1 1   28   18   55 o     24.1   11.8    0.0000   0.0000          ?        ?   -33.8416  18.5171          ?        ?       24.1       11.8       ?       ? 
1 1 1   28   18   56 o    115.4    8.3    0.0000   0.0000          ?        ?   134.0895  19.1556          ?        ?      115.4        8.3       ?       ? 
1 1 1   28   18   57 f    190.5    5.4    0.0000   0.0000          ?        ?   363.9573  20.4327          ?        ?      190.5        5.4       ?       ? 
1 1 1   28   18   58 o    174.4    5.9    0.0000   0.0000          ?        ?   305.2133  20.4327          ?        ?      174.4        5.9       ?       ? 
1 1 1   28   18   59 o    115.6    8.3    0.0000   0.0000          ?        ?   134.7281  19.1556          ?        ?      115.6        8.3       ?       ? 
1 1 1   28   18   60 o    193.4    5.4    0.0000   0.0000          ?        ?   375.4507  21.0712          ?        ?      193.4        5.4       ?       ? 
1 1 1   28   18   61 o     27.0   12.9    0.0000   0.0000          ?        ?   -24.2638  19.1556          ?        ?       27.0       12.9       ?       ? 
1 1 1   28   18   62 o    177.6    5.4    0.0000   0.0000          ?        ?   316.7067  19.1556          ?        ?      177.6        5.4       ?       ? 
1 1 1   28   18   63 o    105.7    8.8    0.0000   0.0000          ?        ?   113.0183  18.5171          ?        ?      105.7        8.8       ?       ? 
1 1 1   28   18   64 o     97.1    9.5    0.0000   0.0000          ?        ?    95.7782  18.5171          ?        ?       97.1        9.5       ?       ? 
1 1 1   28   18   65 o    117.0    7.9    0.0000   0.0000          ?        ?   138.5592  18.5171          ?        ?      117.0        7.9       ?       ? 
1 1 1   28   18   66 o    157.8    6.1    0.0000   0.0000          ?        ?   250.9390  19.1556          ?        ?      157.8        6.1       ?       ? 
1 1 1   28   19    0 o    284.6    3.5  810.2839  19.7942   810.2839  19.7942   810.2839  19.7942      284.6      3.5      284.6        3.5     0.0     0.0 
1 1 1   28   19    1 o    481.4    2.7    0.0000   0.0000          ?        ?  2317.1948  26.1794          ?        ?      481.4        2.7       ?       ? 
1 1 1   28   19    2 o    493.1    2.6    0.0000   0.0000          ?        ?  2432.1289  25.5409          ?        ?      493.1        2.6       ?       ? 
1 1 1   28   19    3 o    454.3    2.5    0.0000   0.0000          ?        ?  2064.3403  22.9868          ?        ?      454.3        2.5       ?       ? 
1 1 1   28   19    4 o    580.8    2.9    0.0000   0.0000          ?        ?  3373.3096  33.2031          ?        ?      580.8        2.9       ?       ? 
1 1 1   28   19    5 o    418.2    3.2    0.0000   0.0000          ?        ?  1748.9106  26.8179          ?        ?      418.2        3.2       ?       ? 
1 1 1   28   19    6 o   1427.5    5.6    0.0000   0.0000          ?        ? 20384.8027 160.9075          ?        ?     1427.5        5.6       ?       ? 
1 1 1   28   19    7 o    763.6    3.3    0.0000   0.0000          ?        ?  5830.9795  49.8047          ?        ?      763.6        3.3       ?       ? 
1 1 1   28   19    8 o    828.6    3.4    0.0000   0.0000          ?        ?  6866.0234  55.5514          ?        ?      828.6        3.4       ?       ? 
1 1 1   28   19    9 o    552.3    2.8    0.0000   0.0000          ?        ?  3050.8562  30.6490          ?        ?      552.3        2.8       ?       ? 
1 1 1   28   19   10 o    113.3    4.5    0.0000   0.0000          ?        ?   128.3428  10.2163          ?        ?      113.3        4.5       ?       ? 
1 1 1   28   19   11 o    608.0    2.5    0.0000   0.0000          ?        ?  3696.4019  30.6490          ?        ?      608.0        2.5       ?       ? 
1 1 1   28   19   12 o    430.2    2.2    0.0000   0.0000          ?        ?  1850.4355  19.1556          ?        ?      430.2        2.2       ?       ? 
1 1 1   28   19   13 o    410.9    2.3    0.0000   0.0000          ?        ?  1688.8896  18.5171          ?        ?      410.9        2.3       ?       ? 
1 1 1   28   19   14 o    388.7    2.2    0.0000   0.0000          ?        ?  1510.7422  17.2401          ?        ?      388.7        2.2       ?       ? 
1 1 1   28   19   15 o    983.6    3.6    0.0000   0.0000          ?        ?  9676.7949  70.8759          ?        ?      983.6        3.6       ?       ? 
1 1 1   28   19   16 o    497.2    2.4    0.0000   0.0000          ?        ?  2472.3557  23.6253          ?        ?      497.2        2.4       ?       ? 
1 1 1   28   19   17 f    127.6    4.3    0.0000   0.0000          ?        ?   162.8230  10.8549          ?        ?      127.6        4.3       ?       ? 
1 1 1   28   19   18 o     33.1   12.3    0.0000   0.0000          ?        ?     8.3008  10.8549          ?        ?       33.1       12.3       ?       ? 
1 1 1   28   19   19 o    230.3    2.8    0.0000   0.0000          ?        ?   530.6115  12.7704          ?        ?      230.3        2.8       ?       ? 
1 1 1   28   19   20 o    447.8    2.4    0.0000   0.0000          ?        ?  2005.5964  21.0712          ?        ?      447.8        2.4       ?       ? 
1 1 1   28   19   21 o    761.5    3.0    0.0000   0.0000          ?        ?  5800.3306  45.3350          ?        ?      761.5        3.0       ?       ? 
1 1 1   28   19   22 o    222.9    3.0    0.0000   0.0000          ?        ?   496.7698  13.4090          ?        ?      222.9        3.0       ?       ? 
1 1 1   28   19   23 o    507.3    2.6    0.0000   0.0000          ?        ?  2573.8806  26.1794          ?        ?      507.3        2.6       ?       ? 
1 1 1   28   19   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   19   25 o     38.6   13.7    0.0000   0.0000          ?        ?    12.7704  13.4090          ?        ?       38.6       13.7       ?       ? 
1 1 1   28   19   26 o    797.9    3.2    0.0000   0.0000          ?        ?  6367.9761  50.4432          ?        ?      797.9        3.2       ?       ? 
1 1 1   28   19   27 o    554.9    2.6    0.0000   0.0000          ?        ?  3079.5898  28.7335          ?        ?      554.9        2.6       ?       ? 
1 1 1   28   19   28 o    559.4    2.6    0.0000   0.0000          ?        ?  3129.3945  28.7335          ?        ?      559.4        2.6       ?       ? 
1 1 1   28   19   29 o    289.1    2.7    0.0000   0.0000          ?        ?   835.8248  15.3245          ?        ?      289.1        2.7       ?       ? 
1 1 1   28   19   30 o    371.1    2.5    0.0000   0.0000          ?        ?  1377.2911  18.5171          ?        ?      371.1        2.5       ?       ? 
1 1 1   28   19   31 o    375.5    2.6    0.0000   0.0000          ?        ?  1410.4943  19.1556          ?        ?      375.5        2.6       ?       ? 
1 1 1   28   19   32 o    147.9    5.0    0.0000   0.0000          ?        ?   219.0129  14.6860          ?        ?      147.9        5.0       ?       ? 
1 1 1   28   19   33 o    657.1    2.8    0.0000   0.0000          ?        ?  4318.9604  37.0343          ?        ?      657.1        2.8       ?       ? 
1 1 1   28   19   34 o    248.3    3.3    0.0000   0.0000          ?        ?   616.8119  16.6016          ?        ?      248.3        3.3       ?       ? 
1 1 1   28   19   35 o    313.2    2.8    0.0000   0.0000          ?        ?   981.4077  17.2401          ?        ?      313.2        2.8       ?       ? 
1 1 1   28   19   36 o    393.7    2.6    0.0000   0.0000          ?        ?  1550.3306  20.4327          ?        ?      393.7        2.6       ?       ? 
1 1 1   28   19   37 o    124.5    6.2    0.0000   0.0000          ?        ?   155.1608  15.3245          ?        ?      124.5        6.2       ?       ? 
1 1 1   28   19   38 o    604.6    2.6    0.0000   0.0000          ?        ?  3656.8135  31.9261          ?        ?      604.6        2.6       ?       ? 
1 1 1   28   19   39 o    344.2    2.8    0.0000   0.0000          ?        ?  1185.0962  19.1556          ?        ?      344.2        2.8       ?       ? 
1 1 1   28   19   40 o    178.8    4.5    0.0000   0.0000          ?        ?   319.8993  15.9630          ?        ?      178.8        4.5       ?       ? 
1 1 1   28   19   41 o    218.9    3.6    0.0000   0.0000          ?        ?   479.5297  15.9630          ?        ?      218.9        3.6       ?       ? 
1 1 1   28   19   42 o    270.2    3.1    0.0000   0.0000          ?        ?   730.4688  16.6016          ?        ?      270.2        3.1       ?       ? 
1 1 1   28   19   43 o    459.7    2.6    0.0000   0.0000          ?        ?  2113.5066  23.6253          ?        ?      459.7        2.6       ?       ? 
1 1 1   28   19   44 o    230.1    3.7    0.0000   0.0000          ?        ?   529.9730  17.2401          ?        ?      230.1        3.7       ?       ? 
1 1 1   28   19   45 o    140.6    5.9    0.0000   0.0000          ?        ?   197.9417  16.6016          ?        ?      140.6        5.9       ?       ? 
1 1 1   28   19   46 o     76.4   11.3    0.0000   0.0000          ?        ?    58.7440  17.2401          ?        ?       76.4       11.3       ?       ? 
1 1 1   28   19   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   19   48 o     93.3    8.9    0.0000   0.0000          ?        ?    87.4775  16.6016          ?        ?       93.3        8.9       ?       ? 
1 1 1   28   19   49 o     25.1   11.9    0.0000   0.0000          ?        ?   -19.1556  15.9630          ?        ?       25.1       11.9       ?       ? 
1 1 1   28   19   50 o    369.9    2.8    0.0000   0.0000          ?        ?  1368.9904  21.0712          ?        ?      369.9        2.8       ?       ? 
1 1 1   28   19   51 o    153.5    5.8    0.0000   0.0000          ?        ?   236.2530  17.8786          ?        ?      153.5        5.8       ?       ? 
1 1 1   28   19   52 o    181.5    4.9    0.0000   0.0000          ?        ?   330.1157  17.8786          ?        ?      181.5        4.9       ?       ? 
1 1 1   28   19   53 o    340.0    3.1    0.0000   0.0000          ?        ?  1157.0012  21.0712          ?        ?      340.0        3.1       ?       ? 
1 1 1   28   19   54 o    124.0    7.7    0.0000   0.0000          ?        ?   154.5222  19.1556          ?        ?      124.0        7.7       ?       ? 
1 1 1   28   19   55 o    209.8    4.9    0.0000   0.0000          ?        ?   441.2184  20.4327          ?        ?      209.8        4.9       ?       ? 
1 1 1   28   19   56 o     96.1   10.3    0.0000   0.0000          ?        ?    93.2242  19.7942          ?        ?       96.1       10.3       ?       ? 
1 1 1   28   19   57 o    124.9    7.9    0.0000   0.0000          ?        ?   157.0763  19.7942          ?        ?      124.9        7.9       ?       ? 
1 1 1   28   19   58 o    125.4    7.6    0.0000   0.0000          ?        ?   158.3534  19.1556          ?        ?      125.4        7.6       ?       ? 
1 1 1   28   19   59 o     96.6    9.9    0.0000   0.0000          ?        ?    94.5012  19.1556          ?        ?       96.6        9.9       ?       ? 
1 1 1   28   19   60 o    161.8    6.1    0.0000   0.0000          ?        ?   263.0709  19.7942          ?        ?      161.8        6.1       ?       ? 
1 1 1   28   19   61 o    227.7    4.5    0.0000   0.0000          ?        ?   519.7566  20.4327          ?        ?      227.7        4.5       ?       ? 
1 1 1   28   19   62 o    235.5    4.3    0.0000   0.0000          ?        ?   556.1523  20.4327          ?        ?      235.5        4.3       ?       ? 
1 1 1   28   19   63 o    176.4    5.6    0.0000   0.0000          ?        ?   312.8756  19.7942          ?        ?      176.4        5.6       ?       ? 
1 1 1   28   19   64 o    113.3    8.7    0.0000   0.0000          ?        ?   130.2584  19.7942          ?        ?      113.3        8.7       ?       ? 
1 1 1   28   19   65 o     22.5   11.1    0.0000   0.0000          ?        ?   -40.8654  18.5171          ?        ?       22.5       11.1       ?       ? 
1 1 1   28   20    0 o    103.6    6.2  108.5487  12.7704   108.5487  12.7704   108.5487  12.7704      103.6      6.2      103.6        6.2     0.0     0.0 
1 1 1   28   20    1 f    363.2    2.6    0.0000   0.0000          ?        ?  1319.1857  19.1556          ?        ?      363.2        2.6       ?       ? 
1 1 1   28   20    2 o    831.9    3.7    0.0000   0.0000          ?        ?  6921.5742  61.9366          ?        ?      831.9        3.7       ?       ? 
1 1 1   28   20    3 o    379.4    2.7    0.0000   0.0000          ?        ?  1439.2277  20.4327          ?        ?      379.4        2.7       ?       ? 
1 1 1   28   20    4 o    546.7    3.0    0.0000   0.0000          ?        ?  2989.5583  32.5646          ?        ?      546.7        3.0       ?       ? 
1 1 1   28   20    5 o    142.7    4.0    0.0000   0.0000          ?        ?   203.6884  11.4934          ?        ?      142.7        4.0       ?       ? 
1 1 1   28   20    6 o    207.3    4.5    0.0000   0.0000          ?        ?   429.7251  18.5171          ?        ?      207.3        4.5       ?       ? 
1 1 1   28   20    7 o     72.8    6.1    0.0000   0.0000          ?        ?    52.9973   8.9393          ?        ?       72.8        6.1       ?       ? 
1 1 1   28   20    8 f    451.3    2.5    0.0000   0.0000          ?        ?  2036.8840  22.9868          ?        ?      451.3        2.5       ?       ? 
1 1 1   28   20    9 o    317.2    2.5    0.0000   0.0000          ?        ?  1006.3101  15.9630          ?        ?      317.2        2.5       ?       ? 
1 1 1   28   20   10 o    490.0    2.4    0.0000   0.0000          ?        ?  2401.4800  23.6253          ?        ?      490.0        2.4       ?       ? 
1 1 1   28   20   11 o    459.3    2.4    0.0000   0.0000          ?        ?  2109.6753  21.7097          ?        ?      459.3        2.4       ?       ? 
1 1 1   28   20   12 o    645.1    2.7    0.0000   0.0000          ?        ?  4162.5225  35.1187          ?        ?      645.1        2.7       ?       ? 
1 1 1   28   20   13 o    153.7    3.1    0.0000   0.0000          ?        ?   236.2530   9.5778          ?        ?      153.7        3.1       ?       ? 
1 1 1   28   20   14 o    285.5    2.2    0.0000   0.0000          ?        ?   815.3921  12.7704          ?        ?      285.5        2.2       ?       ? 
1 1 1   28   20   15 o    296.6    2.3    0.0000   0.0000          ?        ?   879.8828  13.4090          ?        ?      296.6        2.3       ?       ? 
1 1 1   28   20   16 o     30.4   11.8    0.0000   0.0000          ?        ?     5.7467  10.2163          ?        ?       30.4       11.8       ?       ? 
1 1 1   28   20   17 o    629.1    2.7    0.0000   0.0000          ?        ?  3958.1958  34.4802          ?        ?      629.1        2.7       ?       ? 
1 1 1   28   20   18 o    391.4    2.3    0.0000   0.0000          ?        ?  1532.4519  17.8786          ?        ?      391.4        2.3       ?       ? 
1 1 1   28   20   19 o    275.2    2.6    0.0000   0.0000          ?        ?   757.2866  14.0475          ?        ?      275.2        2.6       ?       ? 
1 1 1   28   20   20 f    649.6    2.9    0.0000   0.0000          ?        ?  4220.6279  37.0343          ?        ?      649.6        2.9       ?       ? 
1 1 1   28   20   21 o    288.2    2.4    0.0000   0.0000          ?        ?   830.7167  14.0475          ?        ?      288.2        2.4       ?       ? 
1 1 1   28   20   22 o    782.0    3.0    0.0000   0.0000          ?        ?  6117.0371  47.2506          ?        ?      782.0        3.0       ?       ? 
1 1 1   28   20   23 o    495.4    2.4    0.0000   0.0000          ?        ?  2454.4771  24.2638          ?        ?      495.4        2.4       ?       ? 
1 1 1   28   20   24 o    351.9    2.4    0.0000   0.0000          ?        ?  1238.7319  16.6016          ?        ?      351.9        2.4       ?       ? 
1 1 1   28   20   25 o    230.3    3.0    0.0000   0.0000          ?        ?   530.6115  14.0475          ?        ?      230.3        3.0       ?       ? 
1 1 1   28   20   26 o    432.1    2.4    0.0000   0.0000          ?        ?  1867.0372  20.4327          ?        ?      432.1        2.4       ?       ? 
1 1 1   28   20   27 o    488.2    2.5    0.0000   0.0000          ?        ?  2383.6011  24.2638          ?        ?      488.2        2.5       ?       ? 
1 1 1   28   20   28 o    284.0    2.7    0.0000   0.0000          ?        ?   806.4528  15.3245          ?        ?      284.0        2.7       ?       ? 
1 1 1   28   20   29 o    187.4    3.7    0.0000   0.0000          ?        ?   351.1869  14.0475          ?        ?      187.4        3.7       ?       ? 
1 1 1   28   20   30 o    556.0    2.6    0.0000   0.0000          ?        ?  3092.3601  29.3720          ?        ?      556.0        2.6       ?       ? 
1 1 1   28   20   31 o    180.2    4.3    0.0000   0.0000          ?        ?   325.0075  15.3245          ?        ?      180.2        4.3       ?       ? 
1 1 1   28   20   32 o    354.8    2.6    0.0000   0.0000          ?        ?  1259.1647  18.5171          ?        ?      354.8        2.6       ?       ? 
1 1 1   28   20   33 o    208.5    3.8    0.0000   0.0000          ?        ?   434.8332  15.9630          ?        ?      208.5        3.8       ?       ? 
1 1 1   28   20   34 o    518.9    2.5    0.0000   0.0000          ?        ?  2693.2842  26.1794          ?        ?      518.9        2.5       ?       ? 
1 1 1   28   20   35 o    300.4    3.0    0.0000   0.0000          ?        ?   902.8696  17.8786          ?        ?      300.4        3.0       ?       ? 
1 1 1   28   20   36 o    310.6    2.9    0.0000   0.0000          ?        ?   964.8062  17.8786          ?        ?      310.6        2.9       ?       ? 
1 1 1   28   20   37 o    274.0    2.9    0.0000   0.0000          ?        ?   750.9014  15.9630          ?        ?      274.0        2.9       ?       ? 
1 1 1   28   20   38 o    262.6    3.2    0.0000   0.0000          ?        ?   689.6033  16.6016          ?        ?      262.6        3.2       ?       ? 
1 1 1   28   20   39 o    300.9    2.9    0.0000   0.0000          ?        ?   905.4237  17.2401          ?        ?      300.9        2.9       ?       ? 
1 1 1   28   20   40 o    274.0    3.0    0.0000   0.0000          ?        ?   750.9014  16.6016          ?        ?      274.0        3.0       ?       ? 
1 1 1   28   20   41 o    188.2    4.2    0.0000   0.0000          ?        ?   354.3795  15.9630          ?        ?      188.2        4.2       ?       ? 
1 1 1   28   20   42 o    387.2    2.6    0.0000   0.0000          ?        ?  1499.8872  20.4327          ?        ?      387.2        2.6       ?       ? 
1 1 1   28   20   43 o    415.5    2.6    0.0000   0.0000          ?        ?  1727.2010  21.7097          ?        ?      415.5        2.6       ?       ? 
1 1 1   28   20   44 o    123.1    6.7    0.0000   0.0000          ?        ?   151.9681  16.6016          ?        ?      123.1        6.7       ?       ? 
1 1 1   28   20   45 o    101.5    7.9    0.0000   0.0000          ?        ?   103.4405  15.9630          ?        ?      101.5        7.9       ?       ? 
1 1 1   28   20   46 o    307.7    3.1    0.0000   0.0000          ?        ?   947.5660  19.1556          ?        ?      307.7        3.1       ?       ? 
1 1 1   28   20   47 o    209.5    4.1    0.0000   0.0000          ?        ?   439.3029  17.2401          ?        ?      209.5        4.1       ?       ? 
1 1 1   28   20   48 o    253.5    3.7    0.0000   0.0000          ?        ?   642.9913  18.5171          ?        ?      253.5        3.7       ?       ? 
1 1 1   28   20   49 o    278.2    3.3    0.0000   0.0000          ?        ?   774.5267  18.5171          ?        ?      278.2        3.3       ?       ? 
1 1 1   28   20   50 o    222.2    4.2    0.0000   0.0000          ?        ?   494.2158  18.5171          ?        ?      222.2        4.2       ?       ? 
1 1 1   28   20   51 o    277.0    3.6    0.0000   0.0000          ?        ?   768.1415  19.7942          ?        ?      277.0        3.6       ?       ? 
1 1 1   28   20   52 o    329.4    3.2    0.0000   0.0000          ?        ?  1086.1254  21.0712          ?        ?      329.4        3.2       ?       ? 
1 1 1   28   20   53 o     58.7   15.9    0.0000   0.0000          ?        ?    36.3957  19.1556          ?        ?       58.7       15.9       ?       ? 
1 1 1   28   20   54 o    185.3    5.3    0.0000   0.0000          ?        ?   344.1632  19.7942          ?        ?      185.3        5.3       ?       ? 
1 1 1   28   20   55 o    227.1    4.5    0.0000   0.0000          ?        ?   516.5640  20.4327          ?        ?      227.1        4.5       ?       ? 
1 1 1   28   20   56 f     21.8   10.9    0.0000   0.0000          ?        ?   -53.6358  19.7942          ?        ?       21.8       10.9       ?       ? 
1 1 1   28   20   57 o    188.4    5.6    0.0000   0.0000          ?        ?   356.2951  21.0712          ?        ?      188.4        5.6       ?       ? 
1 1 1   28   20   58 o    192.1    5.2    0.0000   0.0000          ?        ?   370.3425  19.7942          ?        ?      192.1        5.2       ?       ? 
1 1 1   28   20   59 o     88.7   10.8    0.0000   0.0000          ?        ?    79.8152  19.1556          ?        ?       88.7       10.8       ?       ? 
1 1 1   28   20   60 o    164.7    6.0    0.0000   0.0000          ?        ?   272.6487  19.7942          ?        ?      164.7        6.0       ?       ? 
1 1 1   28   20   61 o     61.6   15.9    0.0000   0.0000          ?        ?    40.8654  19.7942          ?        ?       61.6       15.9       ?       ? 
1 1 1   28   20   62 o     45.0   16.4    0.0000   0.0000          ?        ?    17.8786  19.1556          ?        ?       45.0       16.4       ?       ? 
1 1 1   28   20   63 o    236.3    4.2    0.0000   0.0000          ?        ?   559.9835  19.7942          ?        ?      236.3        4.2       ?       ? 
1 1 1   28   20   64 o     74.2   13.4    0.0000   0.0000          ?        ?    58.7440  19.1556          ?        ?       74.2       13.4       ?       ? 
1 1 1   28   21    0 o    353.0    4.3 1247.0327  30.0105  1247.0327  30.0105  1247.0327  30.0105      353.0      4.3      353.0        4.3     0.0     0.0 
1 1 1   28   21    1 o    325.6    2.9    0.0000   0.0000          ?        ?  1060.5845  19.1556          ?        ?      325.6        2.9       ?       ? 
1 1 1   28   21    2 o    122.4    8.1    0.0000   0.0000          ?        ?   150.0526  19.7942          ?        ?      122.4        8.1       ?       ? 
1 1 1   28   21    3 o    274.1    2.4    0.0000   0.0000          ?        ?   751.5399  13.4090          ?        ?      274.1        2.4       ?       ? 
1 1 1   28   21    4 o    452.2    2.5    0.0000   0.0000          ?        ?  2045.1847  22.3483          ?        ?      452.2        2.5       ?       ? 
1 1 1   28   21    5 o    698.3    3.2    0.0000   0.0000          ?        ?  4876.3896  45.3350          ?        ?      698.3        3.2       ?       ? 
1 1 1   28   21    6 o    426.2    2.5    0.0000   0.0000          ?        ?  1816.5940  21.7097          ?        ?      426.2        2.5       ?       ? 
1 1 1   28   21    7 o    329.4    2.6    0.0000   0.0000          ?        ?  1084.8481  17.2401          ?        ?      329.4        2.6       ?       ? 
1 1 1   28   21    8 o    125.6    3.3    0.0000   0.0000          ?        ?   157.7148   8.3008          ?        ?      125.6        3.3       ?       ? 
1 1 1   28   21    9 o    261.7    2.7    0.0000   0.0000          ?        ?   685.1337  14.0475          ?        ?      261.7        2.7       ?       ? 
1 1 1   28   21   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   21   11 o    156.8    3.5    0.0000   0.0000          ?        ?   245.8308  10.8549          ?        ?      156.8        3.5       ?       ? 
1 1 1   28   21   12 o    423.6    2.2    0.0000   0.0000          ?        ?  1794.2457  18.5171          ?        ?      423.6        2.2       ?       ? 
1 1 1   28   21   13 o    871.4    3.2    0.0000   0.0000          ?        ?  7594.5762  54.9129          ?        ?      871.4        3.2       ?       ? 
1 1 1   28   21   14 o     67.3    7.1    0.0000   0.0000          ?        ?    45.3350   9.5778          ?        ?       67.3        7.1       ?       ? 
1 1 1   28   21   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   21   16 o    242.9    2.5    0.0000   0.0000          ?        ?   589.9940  12.1319          ?        ?      242.9        2.5       ?       ? 
1 1 1   28   21   17 o    353.9    2.3    0.0000   0.0000          ?        ?  1252.7794  16.6016          ?        ?      353.9        2.3       ?       ? 
1 1 1   28   21   18 o    555.1    2.6    0.0000   0.0000          ?        ?  3082.1440  28.7335          ?        ?      555.1        2.6       ?       ? 
1 1 1   28   21   19 o    520.6    2.4    0.0000   0.0000          ?        ?  2710.5244  24.9023          ?        ?      520.6        2.4       ?       ? 
1 1 1   28   21   20 o    375.5    2.3    0.0000   0.0000          ?        ?  1409.8557  17.2401          ?        ?      375.5        2.3       ?       ? 
1 1 1   28   21   21 o    384.1    2.2    0.0000   0.0000          ?        ?  1475.6235  17.2401          ?        ?      384.1        2.2       ?       ? 
1 1 1   28   21   22 o    106.6    5.4    0.0000   0.0000          ?        ?   113.6568  11.4934          ?        ?      106.6        5.4       ?       ? 
1 1 1   28   21   23 o    406.8    2.4    0.0000   0.0000          ?        ?  1655.0481  19.1556          ?        ?      406.8        2.4       ?       ? 
1 1 1   28   21   24 o    166.4    3.6    0.0000   0.0000          ?        ?   277.1184  12.1319          ?        ?      166.4        3.6       ?       ? 
1 1 1   28   21   25 o    225.8    3.1    0.0000   0.0000          ?        ?   510.1788  14.0475          ?        ?      225.8        3.1       ?       ? 
1 1 1   28   21   26 o    726.3    3.0    0.0000   0.0000          ?        ?  5276.7427  43.4195          ?        ?      726.3        3.0       ?       ? 
1 1 1   28   21   27 o    299.8    2.9    0.0000   0.0000          ?        ?   899.0385  17.2401          ?        ?      299.8        2.9       ?       ? 
1 1 1   28   21   28 o    342.2    2.5    0.0000   0.0000          ?        ?  1171.0486  17.2401          ?        ?      342.2        2.5       ?       ? 
1 1 1   28   21   29 o     69.6    9.6    0.0000   0.0000          ?        ?    48.5276  13.4090          ?        ?       69.6        9.6       ?       ? 
1 1 1   28   21   30 o    423.1    2.5    0.0000   0.0000          ?        ?  1790.4146  21.0712          ?        ?      423.1        2.5       ?       ? 
1 1 1   28   21   31 o    609.4    2.8    0.0000   0.0000          ?        ?  3714.2803  33.8416          ?        ?      609.4        2.8       ?       ? 
1 1 1   28   21   32 o    414.2    2.5    0.0000   0.0000          ?        ?  1715.7076  21.0712          ?        ?      414.2        2.5       ?       ? 
1 1 1   28   21   33 o    245.9    3.4    0.0000   0.0000          ?        ?   604.6799  16.6016          ?        ?      245.9        3.4       ?       ? 
1 1 1   28   21   34 o    733.3    3.1    0.0000   0.0000          ?        ?  5378.9062  45.3350          ?        ?      733.3        3.1       ?       ? 
1 1 1   28   21   35 o    233.7    3.6    0.0000   0.0000          ?        ?   546.5745  16.6016          ?        ?      233.7        3.6       ?       ? 
1 1 1   28   21   36 f    100.6    7.6    0.0000   0.0000          ?        ?   101.5249  15.3245          ?        ?      100.6        7.6       ?       ? 
1 1 1   28   21   37 o    343.6    2.7    0.0000   0.0000          ?        ?  1181.2650  18.5171          ?        ?      343.6        2.7       ?       ? 
1 1 1   28   21   38 o    134.8    5.9    0.0000   0.0000          ?        ?   181.9787  15.9630          ?        ?      134.8        5.9       ?       ? 
1 1 1   28   21   39 o    164.3    4.7    0.0000   0.0000          ?        ?   270.0946  15.3245          ?        ?      164.3        4.7       ?       ? 
1 1 1   28   21   40 o    271.4    3.1    0.0000   0.0000          ?        ?   736.8539  16.6016          ?        ?      271.4        3.1       ?       ? 
1 1 1   28   21   41 o     29.7   13.2    0.0000   0.0000          ?        ?    -6.3852  15.9630          ?        ?       29.7       13.2       ?       ? 
1 1 1   28   21   42 o     21.2   10.4    0.0000   0.0000          ?        ?   -35.1187  15.9630          ?        ?       21.2       10.4       ?       ? 
1 1 1   28   21   43 o    213.4    3.9    0.0000   0.0000          ?        ?   455.9044  16.6016          ?        ?      213.4        3.9       ?       ? 
1 1 1   28   21   44 o     88.4    9.0    0.0000   0.0000          ?        ?    78.5382  15.9630          ?        ?       88.4        9.0       ?       ? 
1 1 1   28   21   45 f    170.7    4.9    0.0000   0.0000          ?        ?   291.8044  16.6016          ?        ?      170.7        4.9       ?       ? 
1 1 1   28   21   46 o     76.4   10.9    0.0000   0.0000          ?        ?    58.7440  16.6016          ?        ?       76.4       10.9       ?       ? 
1 1 1   28   21   47 o    198.8    4.5    0.0000   0.0000          ?        ?   395.8834  17.8786          ?        ?      198.8        4.5       ?       ? 
1 1 1   28   21   48 o    237.2    3.9    0.0000   0.0000          ?        ?   563.1760  18.5171          ?        ?      237.2        3.9       ?       ? 
1 1 1   28   21   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   21   50 o    254.0    4.0    0.0000   0.0000          ?        ?   646.1838  20.4327          ?        ?      254.0        4.0       ?       ? 
1 1 1   28   21   51 o     21.5   10.7    0.0000   0.0000          ?        ?   -44.0580  17.8786          ?        ?       21.5       10.7       ?       ? 
1 1 1   28   21   52 o    287.3    3.4    0.0000   0.0000          ?        ?   826.2469  19.7942          ?        ?      287.3        3.4       ?       ? 
1 1 1   28   21   53 o    274.1    3.6    0.0000   0.0000          ?        ?   752.1785  19.7942          ?        ?      274.1        3.6       ?       ? 
1 1 1   28   21   54 o    226.1    4.4    0.0000   0.0000          ?        ?   512.0943  19.7942          ?        ?      226.1        4.4       ?       ? 
1 1 1   28   21   55 o    138.3    6.9    0.0000   0.0000          ?        ?   192.1950  19.1556          ?        ?      138.3        6.9       ?       ? 
1 1 1   28   21   56 o    280.2    3.6    0.0000   0.0000          ?        ?   786.0201  20.4327          ?        ?      280.2        3.6       ?       ? 
1 1 1   28   21   57 o     98.9   10.0    0.0000   0.0000          ?        ?    98.9709  19.7942          ?        ?       98.9       10.0       ?       ? 
1 1 1   28   21   58 o    138.2    7.2    0.0000   0.0000          ?        ?   192.1950  19.7942          ?        ?      138.2        7.2       ?       ? 
1 1 1   28   21   59 o     60.8   15.2    0.0000   0.0000          ?        ?    39.5883  18.5171          ?        ?       60.8       15.2       ?       ? 
1 1 1   28   21   60 o    186.8    5.5    0.0000   0.0000          ?        ?   350.5484  20.4327          ?        ?      186.8        5.5       ?       ? 
1 1 1   28   21   61 o     87.4   11.0    0.0000   0.0000          ?        ?    77.8996  19.1556          ?        ?       87.4       11.0       ?       ? 
1 1 1   28   21   62 f    155.2    6.2    0.0000   0.0000          ?        ?   242.6382  19.1556          ?        ?      155.2        6.2       ?       ? 
1 1 1   28   21   63 o    101.6   10.1    0.0000   0.0000          ?        ?   105.3561  20.4327          ?        ?      101.6       10.1       ?       ? 
1 1 1   28   22    0 o    560.0    4.0 3136.4182  45.3350  3136.4182  45.3350  3136.4182  45.3350      560.0      4.0      560.0        4.0     0.0     0.0 
1 1 1   28   22    1 o    307.0    3.1    0.0000   0.0000          ?        ?   942.4579  19.1556          ?        ?      307.0        3.1       ?       ? 
1 1 1   28   22    2 o    441.0    3.1    0.0000   0.0000          ?        ?  1944.9369  27.4564          ?        ?      441.0        3.1       ?       ? 
1 1 1   28   22    3 o   1057.2    4.7    0.0000   0.0000          ?        ? 11179.8750  98.3323          ?        ?     1057.2        4.7       ?       ? 
1 1 1   28   22    4 o    500.6    3.1    0.0000   0.0000          ?        ?  2506.1973  30.6490          ?        ?      500.6        3.1       ?       ? 
1 1 1   28   22    5 o    424.1    2.7    0.0000   0.0000          ?        ?  1798.7155  22.9868          ?        ?      424.1        2.7       ?       ? 
1 1 1   28   22    6 o    436.1    2.5    0.0000   0.0000          ?        ?  1902.1559  21.7097          ?        ?      436.1        2.5       ?       ? 
1 1 1   28   22    7 o    700.5    3.1    0.0000   0.0000          ?        ?  4907.6772  44.0580          ?        ?      700.5        3.1       ?       ? 
1 1 1   28   22    8 o    373.2    2.3    0.0000   0.0000          ?        ?  1393.2542  17.2401          ?        ?      373.2        2.3       ?       ? 
1 1 1   28   22    9 o    402.3    2.3    0.0000   0.0000          ?        ?  1618.6523  18.5171          ?        ?      402.3        2.3       ?       ? 
1 1 1   28   22   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   22   11 o    280.3    2.4    0.0000   0.0000          ?        ?   786.0201  13.4090          ?        ?      280.3        2.4       ?       ? 
1 1 1   28   22   12 o    584.4    2.6    0.0000   0.0000          ?        ?  3416.0908  30.6490          ?        ?      584.4        2.6       ?       ? 
1 1 1   28   22   13 o    429.2    2.2    0.0000   0.0000          ?        ?  1842.1349  19.1556          ?        ?      429.2        2.2       ?       ? 
1 1 1   28   22   14 o    393.3    2.3    0.0000   0.0000          ?        ?  1547.1379  17.8786          ?        ?      393.3        2.3       ?       ? 
1 1 1   28   22   15 o    421.1    2.3    0.0000   0.0000          ?        ?  1773.8130  19.1556          ?        ?      421.1        2.3       ?       ? 
1 1 1   28   22   16 o    384.5    2.2    0.0000   0.0000          ?        ?  1478.8162  17.2401          ?        ?      384.5        2.2       ?       ? 
1 1 1   28   22   17 o     62.9    8.6    0.0000   0.0000          ?        ?    39.5883  10.8549          ?        ?       62.9        8.6       ?       ? 
1 1 1   28   22   18 o    629.2    2.6    0.0000   0.0000          ?        ?  3959.4724  32.5646          ?        ?      629.2        2.6       ?       ? 
1 1 1   28   22   19 o    123.5    4.4    0.0000   0.0000          ?        ?   152.6067  10.8549          ?        ?      123.5        4.4       ?       ? 
1 1 1   28   22   20 o    377.9    2.2    0.0000   0.0000          ?        ?  1428.3728  16.6016          ?        ?      377.9        2.2       ?       ? 
1 1 1   28   22   21 o    220.3    3.0    0.0000   0.0000          ?        ?   485.2764  13.4090          ?        ?      220.3        3.0       ?       ? 
1 1 1   28   22   22 o   1134.2    4.0    0.0000   0.0000          ?        ? 12868.7646  90.6701          ?        ?     1134.2        4.0       ?       ? 
1 1 1   28   22   23 f     77.8    7.4    0.0000   0.0000          ?        ?    60.6596  11.4934          ?        ?       77.8        7.4       ?       ? 
1 1 1   28   22   24 o    440.0    2.3    0.0000   0.0000          ?        ?  1936.6360  20.4327          ?        ?      440.0        2.3       ?       ? 
1 1 1   28   22   25 o    546.0    2.5    0.0000   0.0000          ?        ?  2981.8960  27.4564          ?        ?      546.0        2.5       ?       ? 
1 1 1   28   22   26 f    151.8    4.2    0.0000   0.0000          ?        ?   230.5063  12.7704          ?        ?      151.8        4.2       ?       ? 
1 1 1   28   22   27 o    370.7    2.4    0.0000   0.0000          ?        ?  1374.0985  17.8786          ?        ?      370.7        2.4       ?       ? 
1 1 1   28   22   28 o    271.5    2.7    0.0000   0.0000          ?        ?   737.4925  14.6860          ?        ?      271.5        2.7       ?       ? 
1 1 1   28   22   29 o    443.9    2.4    0.0000   0.0000          ?        ?  1970.4778  21.7097          ?        ?      443.9        2.4       ?       ? 
1 1 1   28   22   30 o    288.4    2.8    0.0000   0.0000          ?        ?   831.9937  15.9630          ?        ?      288.4        2.8       ?       ? 
1 1 1   28   22   31 o    268.9    3.1    0.0000   0.0000          ?        ?   723.4450  16.6016          ?        ?      268.9        3.1       ?       ? 
1 1 1   28   22   32 o    101.0    6.6    0.0000   0.0000          ?        ?   102.1635  13.4090          ?        ?      101.0        6.6       ?       ? 
1 1 1   28   22   33 o    285.3    2.9    0.0000   0.0000          ?        ?   814.1151  16.6016          ?        ?      285.3        2.9       ?       ? 
1 1 1   28   22   34 o    102.5    7.2    0.0000   0.0000          ?        ?   105.3561  14.6860          ?        ?      102.5        7.2       ?       ? 
1 1 1   28   22   35 o    246.2    3.2    0.0000   0.0000          ?        ?   606.5955  15.9630          ?        ?      246.2        3.2       ?       ? 
1 1 1   28   22   36 o     91.3    8.4    0.0000   0.0000          ?        ?    83.6463  15.3245          ?        ?       91.3        8.4       ?       ? 
1 1 1   28   22   37 o    389.6    2.7    0.0000   0.0000          ?        ?  1518.4044  21.0712          ?        ?      389.6        2.7       ?       ? 
1 1 1   28   22   38 o    404.5    2.7    0.0000   0.0000          ?        ?  1636.5309  21.7097          ?        ?      404.5        2.7       ?       ? 
1 1 1   28   22   39 o    186.3    4.3    0.0000   0.0000          ?        ?   347.3558  15.9630          ?        ?      186.3        4.3       ?       ? 
1 1 1   28   22   40 o    194.7    4.4    0.0000   0.0000          ?        ?   379.2819  17.2401          ?        ?      194.7        4.4       ?       ? 
1 1 1   28   22   41 o    185.2    4.7    0.0000   0.0000          ?        ?   343.5246  17.2401          ?        ?      185.2        4.7       ?       ? 
1 1 1   28   22   42 o    324.8    2.9    0.0000   0.0000          ?        ?  1055.4763  19.1556          ?        ?      324.8        2.9       ?       ? 
1 1 1   28   22   43 o     52.5   14.7    0.0000   0.0000          ?        ?    28.7335  15.9630          ?        ?       52.5       14.7       ?       ? 
1 1 1   28   22   44 o    269.6    3.3    0.0000   0.0000          ?        ?   727.2761  17.8786          ?        ?      269.6        3.3       ?       ? 
1 1 1   28   22   45 o    203.9    4.4    0.0000   0.0000          ?        ?   416.3161  17.8786          ?        ?      203.9        4.4       ?       ? 
1 1 1   28   22   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   22   47 o    291.2    3.5    0.0000   0.0000          ?        ?   848.5952  20.4327          ?        ?      291.2        3.5       ?       ? 
1 1 1   28   22   48 o    139.6    6.2    0.0000   0.0000          ?        ?   195.3876  17.2401          ?        ?      139.6        6.2       ?       ? 
1 1 1   28   22   49 o    187.2    4.9    0.0000   0.0000          ?        ?   351.1869  18.5171          ?        ?      187.2        4.9       ?       ? 
1 1 1   28   22   50 f    213.2    4.0    0.0000   0.0000          ?        ?   455.2659  17.2401          ?        ?      213.2        4.0       ?       ? 
1 1 1   28   22   51 o    106.3    8.1    0.0000   0.0000          ?        ?   113.6568  17.2401          ?        ?      106.3        8.1       ?       ? 
1 1 1   28   22   52 o     42.3   16.0    0.0000   0.0000          ?        ?    13.4090  18.5171          ?        ?       42.3       16.0       ?       ? 
1 1 1   28   22   53 o     76.1   12.6    0.0000   0.0000          ?        ?    58.7440  19.1556          ?        ?       76.1       12.6       ?       ? 
1 1 1   28   22   54 o    195.0    5.1    0.0000   0.0000          ?        ?   381.1974  19.7942          ?        ?      195.0        5.1       ?       ? 
1 1 1   28   22   55 o    279.8    3.8    0.0000   0.0000          ?        ?   784.1046  21.0712          ?        ?      279.8        3.8       ?       ? 
1 1 1   28   22   56 o    125.1    7.9    0.0000   0.0000          ?        ?   157.7148  19.7942          ?        ?      125.1        7.9       ?       ? 
1 1 1   28   22   57 o    115.8    8.8    0.0000   0.0000          ?        ?   135.3666  20.4327          ?        ?      115.8        8.8       ?       ? 
1 1 1   28   22   58 o     72.8   14.1    0.0000   0.0000          ?        ?    56.1899  19.7942          ?        ?       72.8       14.1       ?       ? 
1 1 1   28   22   59 o     88.1   11.2    0.0000   0.0000          ?        ?    79.1767  19.7942          ?        ?       88.1       11.2       ?       ? 
1 1 1   28   22   60 o    151.0    6.8    0.0000   0.0000          ?        ?   229.8678  20.4327          ?        ?      151.0        6.8       ?       ? 
1 1 1   28   22   61 o     32.7   14.6    0.0000   0.0000          ?        ?    -7.6623  19.7942          ?        ?       32.7       14.6       ?       ? 
1 1 1   28   22   62 o    137.6    7.4    0.0000   0.0000          ?        ?   191.5565  20.4327          ?        ?      137.6        7.4       ?       ? 
1 1 1   28   23    0 o     16.7   12.3  -58.7440  24.9023   -58.7440  24.9023   -58.7440  24.9023       16.7     12.3       16.7       12.3     0.0     0.0 
1 1 1   28   23    1 o     58.0   14.4    0.0000   0.0000          ?        ?    35.1187  16.6016          ?        ?       58.0       14.4       ?       ? 
1 1 1   28   23    2 o    402.8    3.2    0.0000   0.0000          ?        ?  1622.4835  25.5409          ?        ?      402.8        3.2       ?       ? 
1 1 1   28   23    3 o     61.3   11.9    0.0000   0.0000          ?        ?    38.9498  14.0475          ?        ?       61.3       11.9       ?       ? 
1 1 1   28   23    4 o    120.8    8.5    0.0000   0.0000          ?        ?   146.2215  20.4327          ?        ?      120.8        8.5       ?       ? 
1 1 1   28   23    5 o    419.0    2.8    0.0000   0.0000          ?        ?  1755.9344  23.6253          ?        ?      419.0        2.8       ?       ? 
1 1 1   28   23    6 o    224.7    3.3    0.0000   0.0000          ?        ?   505.0706  14.6860          ?        ?      224.7        3.3       ?       ? 
1 1 1   28   23    7 o    246.3    3.2    0.0000   0.0000          ?        ?   606.5955  15.9630          ?        ?      246.3        3.2       ?       ? 
1 1 1   28   23    8 o    732.8    3.2    0.0000   0.0000          ?        ?  5370.6055  46.6121          ?        ?      732.8        3.2       ?       ? 
1 1 1   28   23    9 o    900.7    3.5    0.0000   0.0000          ?        ?  8114.9717  62.5751          ?        ?      900.7        3.5       ?       ? 
1 1 1   28   23   10 o    564.6    2.6    0.0000   0.0000          ?        ?  3188.1384  29.3720          ?        ?      564.6        2.6       ?       ? 
1 1 1   28   23   11 o    308.5    2.3    0.0000   0.0000          ?        ?   952.0358  14.0475          ?        ?      308.5        2.3       ?       ? 
1 1 1   28   23   12 o    246.0    2.5    0.0000   0.0000          ?        ?   605.3185  12.1319          ?        ?      246.0        2.5       ?       ? 
1 1 1   28   23   13 o    205.3    2.3    0.0000   0.0000          ?        ?   421.4243   9.5778          ?        ?      205.3        2.3       ?       ? 
1 1 1   28   23   14 o    312.0    2.1    0.0000   0.0000          ?        ?   973.7455  13.4090          ?        ?      312.0        2.1       ?       ? 
1 1 1   28   23   15 o    267.0    2.3    0.0000   0.0000          ?        ?   713.2286  12.1319          ?        ?      267.0        2.3       ?       ? 
1 1 1   28   23   16 o    381.9    2.3    0.0000   0.0000          ?        ?  1459.0220  17.2401          ?        ?      381.9        2.3       ?       ? 
1 1 1   28   23   17 o    735.3    2.9    0.0000   0.0000          ?        ?  5407.6396  42.1424          ?        ?      735.3        2.9       ?       ? 
1 1 1   28   23   18 o    408.1    2.4    0.0000   0.0000          ?        ?  1665.9028  19.7942          ?        ?      408.1        2.4       ?       ? 
1 1 1   28   23   19 o     73.6    7.4    0.0000   0.0000          ?        ?    54.2743  10.8549          ?        ?       73.6        7.4       ?       ? 
1 1 1   28   23   20 o    334.0    2.5    0.0000   0.0000          ?        ?  1115.4973  16.6016          ?        ?      334.0        2.5       ?       ? 
1 1 1   28   23   21 o    436.9    2.5    0.0000   0.0000          ?        ?  1909.1797  21.7097          ?        ?      436.9        2.5       ?       ? 
1 1 1   28   23   22 o    408.0    2.4    0.0000   0.0000          ?        ?  1664.6260  19.7942          ?        ?      408.0        2.4       ?       ? 
1 1 1   28   23   23 o    222.7    3.0    0.0000   0.0000          ?        ?   496.1313  13.4090          ?        ?      222.7        3.0       ?       ? 
1 1 1   28   23   24 o    300.6    2.7    0.0000   0.0000          ?        ?   903.5081  15.9630          ?        ?      300.6        2.7       ?       ? 
1 1 1   28   23   25 o    473.6    2.5    0.0000   0.0000          ?        ?  2243.7649  23.6253          ?        ?      473.6        2.5       ?       ? 
1 1 1   28   23   26 o    390.6    2.5    0.0000   0.0000          ?        ?  1526.0667  19.1556          ?        ?      390.6        2.5       ?       ? 
1 1 1   28   23   27 o    217.6    3.4    0.0000   0.0000          ?        ?   473.7830  14.6860          ?        ?      217.6        3.4       ?       ? 
1 1 1   28   23   28 o    177.2    4.0    0.0000   0.0000          ?        ?   314.1526  14.0475          ?        ?      177.2        4.0       ?       ? 
1 1 1   28   23   29 o    853.6    3.4    0.0000   0.0000          ?        ?  7290.0010  58.1055          ?        ?      853.6        3.4       ?       ? 
1 1 1   28   23   30 o    312.6    2.7    0.0000   0.0000          ?        ?   977.5767  16.6016          ?        ?      312.6        2.7       ?       ? 
1 1 1   28   23   31 o     98.4    6.5    0.0000   0.0000          ?        ?    97.0553  12.7704          ?        ?       98.4        6.5       ?       ? 
1 1 1   28   23   32 o    118.2    5.7    0.0000   0.0000          ?        ?   139.8362  13.4090          ?        ?      118.2        5.7       ?       ? 
1 1 1   28   23   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   23   34 o    407.3    2.5    0.0000   0.0000          ?        ?  1659.5177  20.4327          ?        ?      407.3        2.5       ?       ? 
1 1 1   28   23   35 o    221.2    3.3    0.0000   0.0000          ?        ?   489.7461  14.6860          ?        ?      221.2        3.3       ?       ? 
1 1 1   28   23   36 o    491.5    2.5    0.0000   0.0000          ?        ?  2416.8044  24.9023          ?        ?      491.5        2.5       ?       ? 
1 1 1   28   23   37 o    249.7    3.3    0.0000   0.0000          ?        ?   623.8356  16.6016          ?        ?      249.7        3.3       ?       ? 
1 1 1   28   23   38 o    326.5    2.9    0.0000   0.0000          ?        ?  1066.3312  19.1556          ?        ?      326.5        2.9       ?       ? 
1 1 1   28   23   39 o    363.8    2.6    0.0000   0.0000          ?        ?  1323.6554  19.1556          ?        ?      363.8        2.6       ?       ? 
1 1 1   28   23   40 o    154.8    5.4    0.0000   0.0000          ?        ?   240.0841  16.6016          ?        ?      154.8        5.4       ?       ? 
1 1 1   28   23   41 o    331.5    2.9    0.0000   0.0000          ?        ?  1099.5342  19.1556          ?        ?      331.5        2.9       ?       ? 
1 1 1   28   23   42 o     88.0    9.8    0.0000   0.0000          ?        ?    77.8996  17.2401          ?        ?       88.0        9.8       ?       ? 
1 1 1   28   23   43 o    259.0    3.5    0.0000   0.0000          ?        ?   671.0862  17.8786          ?        ?      259.0        3.5       ?       ? 
1 1 1   28   23   44 o    266.1    3.4    0.0000   0.0000          ?        ?   708.7590  17.8786          ?        ?      266.1        3.4       ?       ? 
1 1 1   28   23   45 o    567.0    2.9    0.0000   0.0000          ?        ?  3216.2334  32.5646          ?        ?      567.0        2.9       ?       ? 
1 1 1   28   23   46 f    144.5    6.2    0.0000   0.0000          ?        ?   209.4351  17.8786          ?        ?      144.5        6.2       ?       ? 
1 1 1   28   23   47 o    376.0    3.0    0.0000   0.0000          ?        ?  1414.9640  22.3483          ?        ?      376.0        3.0       ?       ? 
1 1 1   28   23   48 o    366.7    3.0    0.0000   0.0000          ?        ?  1345.3650  22.3483          ?        ?      366.7        3.0       ?       ? 
1 1 1   28   23   49 o    364.2    3.1    0.0000   0.0000          ?        ?  1327.4865  22.3483          ?        ?      364.2        3.1       ?       ? 
1 1 1   28   23   50 f     64.1   14.7    0.0000   0.0000          ?        ?    43.4195  18.5171          ?        ?       64.1       14.7       ?       ? 
1 1 1   28   23   51 o    147.0    6.7    0.0000   0.0000          ?        ?   217.0974  19.7942          ?        ?      147.0        6.7       ?       ? 
1 1 1   28   23   52 o    222.5    4.4    0.0000   0.0000          ?        ?   496.1313  19.7942          ?        ?      222.5        4.4       ?       ? 
1 1 1   28   23   53 o    117.6    8.4    0.0000   0.0000          ?        ?   139.1977  19.7942          ?        ?      117.6        8.4       ?       ? 
1 1 1   28   23   54 o    300.4    3.7    0.0000   0.0000          ?        ?   903.5081  22.3483          ?        ?      300.4        3.7       ?       ? 
1 1 1   28   23   55 o    174.1    6.0    0.0000   0.0000          ?        ?   304.5748  21.0712          ?        ?      174.1        6.0       ?       ? 
1 1 1   28   23   56 o    197.0    5.3    0.0000   0.0000          ?        ?   389.4982  21.0712          ?        ?      197.0        5.3       ?       ? 
1 1 1   28   23   57 o    168.4    5.9    0.0000   0.0000          ?        ?   284.7806  19.7942          ?        ?      168.4        5.9       ?       ? 
1 1 1   28   23   58 o    122.6    8.6    0.0000   0.0000          ?        ?   151.9681  21.0712          ?        ?      122.6        8.6       ?       ? 
1 1 1   28   23   59 o    149.4    6.4    0.0000   0.0000          ?        ?   224.7596  19.1556          ?        ?      149.4        6.4       ?       ? 
1 1 1   28   23   60 o    150.8    6.8    0.0000   0.0000          ?        ?   229.2293  20.4327          ?        ?      150.8        6.8       ?       ? 
1 1 1   28   23   61 o    124.5    8.2    0.0000   0.0000          ?        ?   157.0763  20.4327          ?        ?      124.5        8.2       ?       ? 
1 1 1   28   24    0 o     51.7   23.2   38.9498  25.5409    38.9498  25.5409    38.9498  25.5409       51.7     23.2       51.7       23.2     0.0     0.0 
1 1 1   28   24    1 o    446.4    3.4    0.0000   0.0000          ?        ?  1992.8260  30.0105          ?        ?      446.4        3.4       ?       ? 
1 1 1   28   24    2 o    559.0    3.4    0.0000   0.0000          ?        ?  3125.5635  38.3113          ?        ?      559.0        3.4       ?       ? 
1 1 1   28   24    3 o    571.4    3.5    0.0000   0.0000          ?        ?  3265.3997  39.5883          ?        ?      571.4        3.5       ?       ? 
1 1 1   28   24    4 f    524.0    3.4    0.0000   0.0000          ?        ?  2746.2815  35.1187          ?        ?      524.0        3.4       ?       ? 
1 1 1   28   24    5 o    343.4    3.3    0.0000   0.0000          ?        ?  1179.3494  22.9868          ?        ?      343.4        3.3       ?       ? 
1 1 1   28   24    6 o    221.0    3.2    0.0000   0.0000          ?        ?   488.4691  14.0475          ?        ?      221.0        3.2       ?       ? 
1 1 1   28   24    7 o    359.0    2.8    0.0000   0.0000          ?        ?  1289.1752  20.4327          ?        ?      359.0        2.8       ?       ? 
1 1 1   28   24    8 o    655.4    3.0    0.0000   0.0000          ?        ?  4295.9736  39.5883          ?        ?      655.4        3.0       ?       ? 
1 1 1   28   24    9 o    107.8    5.3    0.0000   0.0000          ?        ?   116.2109  11.4934          ?        ?      107.8        5.3       ?       ? 
1 1 1   28   24   10 o    719.2    2.9    0.0000   0.0000          ?        ?  5173.3022  41.5039          ?        ?      719.2        2.9       ?       ? 
1 1 1   28   24   11 f     99.8    4.5    0.0000   0.0000          ?        ?    99.6094   8.9393          ?        ?       99.8        4.5       ?       ? 
1 1 1   28   24   12 o    468.0    2.5    0.0000   0.0000          ?        ?  2190.7678  23.6253          ?        ?      468.0        2.5       ?       ? 
1 1 1   28   24   13 o     97.8    3.9    0.0000   0.0000          ?        ?    95.7782   7.6623          ?        ?       97.8        3.9       ?       ? 
1 1 1   28   24   14 o    322.7    2.1    0.0000   0.0000          ?        ?  1041.4288  13.4090          ?        ?      322.7        2.1       ?       ? 
1 1 1   28   24   15 o    304.3    2.3    0.0000   0.0000          ?        ?   925.8564  14.0475          ?        ?      304.3        2.3       ?       ? 
1 1 1   28   24   16 o    303.0    2.4    0.0000   0.0000          ?        ?   918.1941  14.6860          ?        ?      303.0        2.4       ?       ? 
1 1 1   28   24   17 o     66.3    7.7    0.0000   0.0000          ?        ?    44.0580  10.2163          ?        ?       66.3        7.7       ?       ? 
1 1 1   28   24   18 o    529.2    2.5    0.0000   0.0000          ?        ?  2801.1943  26.8179          ?        ?      529.2        2.5       ?       ? 
1 1 1   28   24   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   24   20 f    547.1    2.6    0.0000   0.0000          ?        ?  2994.0278  28.0950          ?        ?      547.1        2.6       ?       ? 
1 1 1   28   24   21 o    172.1    3.3    0.0000   0.0000          ?        ?   296.2740  11.4934          ?        ?      172.1        3.3       ?       ? 
1 1 1   28   24   22 o    416.2    2.4    0.0000   0.0000          ?        ?  1732.3091  19.7942          ?        ?      416.2        2.4       ?       ? 
1 1 1   28   24   23 o    457.5    2.4    0.0000   0.0000          ?        ?  2093.0737  21.7097          ?        ?      457.5        2.4       ?       ? 
1 1 1   28   24   24 o    432.9    2.4    0.0000   0.0000          ?        ?  1874.6996  20.4327          ?        ?      432.9        2.4       ?       ? 
1 1 1   28   24   25 o    185.8    3.6    0.0000   0.0000          ?        ?   345.4402  13.4090          ?        ?      185.8        3.6       ?       ? 
1 1 1   28   24   26 o    346.8    2.5    0.0000   0.0000          ?        ?  1202.9747  17.2401          ?        ?      346.8        2.5       ?       ? 
1 1 1   28   24   27 o    190.6    3.5    0.0000   0.0000          ?        ?   363.3188  13.4090          ?        ?      190.6        3.5       ?       ? 
1 1 1   28   24   28 o    101.3    6.6    0.0000   0.0000          ?        ?   102.8020  13.4090          ?        ?      101.3        6.6       ?       ? 
1 1 1   28   24   29 o     22.3   10.7    0.0000   0.0000          ?        ?   -18.5171  13.4090          ?        ?       22.3       10.7       ?       ? 
1 1 1   28   24   30 o    516.9    2.5    0.0000   0.0000          ?        ?  2672.2129  26.1794          ?        ?      516.9        2.5       ?       ? 
1 1 1   28   24   31 o     87.4    7.7    0.0000   0.0000          ?        ?    76.6226  13.4090          ?        ?       87.4        7.7       ?       ? 
1 1 1   28   24   32 f     79.3   10.1    0.0000   0.0000          ?        ?    63.2136  15.9630          ?        ?       79.3       10.1       ?       ? 
1 1 1   28   24   33 o     35.9   14.1    0.0000   0.0000          ?        ?     7.6623  14.6860          ?        ?       35.9       14.1       ?       ? 
1 1 1   28   24   34 o    226.5    3.4    0.0000   0.0000          ?        ?   513.3714  15.3245          ?        ?      226.5        3.4       ?       ? 
1 1 1   28   24   35 o    300.7    2.9    0.0000   0.0000          ?        ?   904.7851  17.2401          ?        ?      300.7        2.9       ?       ? 
1 1 1   28   24   36 o    183.2    4.4    0.0000   0.0000          ?        ?   335.8624  15.9630          ?        ?      183.2        4.4       ?       ? 
1 1 1   28   24   37 o    296.4    3.1    0.0000   0.0000          ?        ?   879.2443  18.5171          ?        ?      296.4        3.1       ?       ? 
1 1 1   28   24   38 o     25.4   11.9    0.0000   0.0000          ?        ?   -15.9630  15.3245          ?        ?       25.4       11.9       ?       ? 
1 1 1   28   24   39 o    549.2    2.7    0.0000   0.0000          ?        ?  3017.0146  30.0105          ?        ?      549.2        2.7       ?       ? 
1 1 1   28   24   40 o    578.0    2.9    0.0000   0.0000          ?        ?  3342.0225  33.2031          ?        ?      578.0        2.9       ?       ? 
1 1 1   28   24   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   24   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   24   43 o    495.4    2.8    0.0000   0.0000          ?        ?  2455.1157  27.4564          ?        ?      495.4        2.8       ?       ? 
1 1 1   28   24   44 o    274.4    3.5    0.0000   0.0000          ?        ?   753.4555  19.1556          ?        ?      274.4        3.5       ?       ? 
1 1 1   28   24   45 o     66.2   13.5    0.0000   0.0000          ?        ?    45.9736  17.2401          ?        ?       66.2       13.5       ?       ? 
1 1 1   28   24   46 o     82.0   10.1    0.0000   0.0000          ?        ?    67.6833  16.6016          ?        ?       82.0       10.1       ?       ? 
1 1 1   28   24   47 o    234.1    4.0    0.0000   0.0000          ?        ?   548.4901  18.5171          ?        ?      234.1        4.0       ?       ? 
1 1 1   28   24   48 o    428.5    2.8    0.0000   0.0000          ?        ?  1837.0269  24.2638          ?        ?      428.5        2.8       ?       ? 
1 1 1   28   24   49 o    289.3    3.6    0.0000   0.0000          ?        ?   837.7404  21.0712          ?        ?      289.3        3.6       ?       ? 
1 1 1   28   24   50 o    300.7    3.5    0.0000   0.0000          ?        ?   905.4237  21.0712          ?        ?      300.7        3.5       ?       ? 
1 1 1   28   24   51 f     39.4   16.2    0.0000   0.0000          ?        ?     5.7467  20.4327          ?        ?       39.4       16.2       ?       ? 
1 1 1   28   24   52 o    376.3    3.1    0.0000   0.0000          ?        ?  1417.5181  23.6253          ?        ?      376.3        3.1       ?       ? 
1 1 1   28   24   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   24   54 o    264.5    4.0    0.0000   0.0000          ?        ?   701.0967  21.0712          ?        ?      264.5        4.0       ?       ? 
1 1 1   28   24   55 o    150.8    6.8    0.0000   0.0000          ?        ?   228.5907  20.4327          ?        ?      150.8        6.8       ?       ? 
1 1 1   28   24   56 o    236.0    4.5    0.0000   0.0000          ?        ?   558.7064  21.0712          ?        ?      236.0        4.5       ?       ? 
1 1 1   28   24   57 o    105.0    9.4    0.0000   0.0000          ?        ?   111.7413  19.7942          ?        ?      105.0        9.4       ?       ? 
1 1 1   28   24   58 o     91.7   10.4    0.0000   0.0000          ?        ?    85.5619  19.1556          ?        ?       91.7       10.4       ?       ? 
1 1 1   28   24   59 o     51.2   16.8    0.0000   0.0000          ?        ?    26.8179  19.7942          ?        ?       51.2       16.8       ?       ? 
1 1 1   28   24   60 o     99.5    9.9    0.0000   0.0000          ?        ?   100.8864  19.7942          ?        ?       99.5        9.9       ?       ? 
1 1 1   28   25    0 o    992.0    6.4 9845.3652 127.0658  9845.3652 127.0658  9845.3652 127.0658      992.0      6.4      992.0        6.4     0.0     0.0 
1 1 1   28   25    1 o    351.4    3.6    0.0000   0.0000          ?        ?  1234.9008  25.5409          ?        ?      351.4        3.6       ?       ? 
1 1 1   28   25    2 o     24.2   11.8    0.0000   0.0000          ?        ?   -33.8416  18.5171          ?        ?       24.2       11.8       ?       ? 
1 1 1   28   25    3 o    355.4    3.3    0.0000   0.0000          ?        ?  1263.6343  23.6253          ?        ?      355.4        3.3       ?       ? 
1 1 1   28   25    4 o    804.8    3.8    0.0000   0.0000          ?        ?  6478.4404  61.9366          ?        ?      804.8        3.8       ?       ? 
1 1 1   28   25    5 o    752.2    3.7    0.0000   0.0000          ?        ?  5660.4941  56.1899          ?        ?      752.2        3.7       ?       ? 
1 1 1   28   25    6 o    317.2    3.6    0.0000   0.0000          ?        ?  1006.3101  22.9868          ?        ?      317.2        3.6       ?       ? 
1 1 1   28   25    7 o    573.9    2.8    0.0000   0.0000          ?        ?  3294.1333  32.5646          ?        ?      573.9        2.8       ?       ? 
1 1 1   28   25    8 o    149.7    3.6    0.0000   0.0000          ?        ?   224.1211  10.8549          ?        ?      149.7        3.6       ?       ? 
1 1 1   28   25    9 o    313.1    2.5    0.0000   0.0000          ?        ?   980.7693  15.9630          ?        ?      313.1        2.5       ?       ? 
1 1 1   28   25   10 o    338.7    2.5    0.0000   0.0000          ?        ?  1147.4233  16.6016          ?        ?      338.7        2.5       ?       ? 
1 1 1   28   25   11 o    123.0    3.4    0.0000   0.0000          ?        ?   151.3296   8.3008          ?        ?      123.0        3.4       ?       ? 
1 1 1   28   25   12 o    146.5    3.3    0.0000   0.0000          ?        ?   214.5433   9.5778          ?        ?      146.5        3.3       ?       ? 
1 1 1   28   25   13 o    152.7    2.5    0.0000   0.0000          ?        ?   233.0604   7.6623          ?        ?      152.7        2.5       ?       ? 
1 1 1   28   25   14 o    254.7    2.1    0.0000   0.0000          ?        ?   648.7380  10.8549          ?        ?      254.7        2.1       ?       ? 
1 1 1   28   25   15 o    798.0    3.0    0.0000   0.0000          ?        ?  6369.8916  47.8891          ?        ?      798.0        3.0       ?       ? 
1 1 1   28   25   16 o    333.0    2.4    0.0000   0.0000          ?        ?  1109.1121  15.9630          ?        ?      333.0        2.4       ?       ? 
1 1 1   28   25   17 o    421.5    2.3    0.0000   0.0000          ?        ?  1777.0056  19.1556          ?        ?      421.5        2.3       ?       ? 
1 1 1   28   25   18 o    305.3    2.4    0.0000   0.0000          ?        ?   932.2416  14.6860          ?        ?      305.3        2.4       ?       ? 
1 1 1   28   25   19 o    267.9    2.6    0.0000   0.0000          ?        ?   717.6983  14.0475          ?        ?      267.9        2.6       ?       ? 
1 1 1   28   25   20 o    637.5    2.8    0.0000   0.0000          ?        ?  4064.8286  35.1187          ?        ?      637.5        2.8       ?       ? 
1 1 1   28   25   21 o    482.1    2.5    0.0000   0.0000          ?        ?  2324.8572  24.2638          ?        ?      482.1        2.5       ?       ? 
1 1 1   28   25   22 o    479.1    2.5    0.0000   0.0000          ?        ?  2295.4854  23.6253          ?        ?      479.1        2.5       ?       ? 
1 1 1   28   25   23 o    579.3    2.6    0.0000   0.0000          ?        ?  3356.7083  30.6490          ?        ?      579.3        2.6       ?       ? 
1 1 1   28   25   24 o    751.5    3.1    0.0000   0.0000          ?        ?  5649.6392  46.6121          ?        ?      751.5        3.1       ?       ? 
1 1 1   28   25   25 o    331.8    2.6    0.0000   0.0000          ?        ?  1101.4498  17.2401          ?        ?      331.8        2.6       ?       ? 
1 1 1   28   25   26 o    298.4    2.8    0.0000   0.0000          ?        ?   890.7377  16.6016          ?        ?      298.4        2.8       ?       ? 
1 1 1   28   25   27 o    123.7    5.7    0.0000   0.0000          ?        ?   153.2452  14.0475          ?        ?      123.7        5.7       ?       ? 
1 1 1   28   25   28 o    278.6    3.0    0.0000   0.0000          ?        ?   776.4423  16.6016          ?        ?      278.6        3.0       ?       ? 
1 1 1   28   25   29 o    393.9    2.7    0.0000   0.0000          ?        ?  1552.2461  21.0712          ?        ?      393.9        2.7       ?       ? 
1 1 1   28   25   30 o    356.2    2.7    0.0000   0.0000          ?        ?  1269.3810  19.1556          ?        ?      356.2        2.7       ?       ? 
1 1 1   28   25   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   25   32 o    134.6    5.5    0.0000   0.0000          ?        ?   181.3401  14.6860          ?        ?      134.6        5.5       ?       ? 
1 1 1   28   25   33 o    799.4    3.4    0.0000   0.0000          ?        ?  6393.5171  53.6358          ?        ?      799.4        3.4       ?       ? 
1 1 1   28   25   34 o    411.8    2.6    0.0000   0.0000          ?        ?  1696.5520  21.0712          ?        ?      411.8        2.6       ?       ? 
1 1 1   28   25   35 o    352.6    2.9    0.0000   0.0000          ?        ?  1243.8401  20.4327          ?        ?      352.6        2.9       ?       ? 
1 1 1   28   25   36 o    218.0    3.7    0.0000   0.0000          ?        ?   475.6986  15.9630          ?        ?      218.0        3.7       ?       ? 
1 1 1   28   25   37 o    370.5    2.8    0.0000   0.0000          ?        ?  1373.4601  21.0712          ?        ?      370.5        2.8       ?       ? 
1 1 1   28   25   38 o    250.7    3.6    0.0000   0.0000          ?        ?   628.9438  17.8786          ?        ?      250.7        3.6       ?       ? 
1 1 1   28   25   39 o    149.8    5.5    0.0000   0.0000          ?        ?   224.7596  16.6016          ?        ?      149.8        5.5       ?       ? 
1 1 1   28   25   40 o    246.2    3.6    0.0000   0.0000          ?        ?   606.5955  17.8786          ?        ?      246.2        3.6       ?       ? 
1 1 1   28   25   41 o    229.7    3.9    0.0000   0.0000          ?        ?   528.0574  17.8786          ?        ?      229.7        3.9       ?       ? 
1 1 1   28   25   42 o    225.8    4.0    0.0000   0.0000          ?        ?   510.1788  17.8786          ?        ?      225.8        4.0       ?       ? 
1 1 1   28   25   43 o    186.8    4.6    0.0000   0.0000          ?        ?   349.2713  17.2401          ?        ?      186.8        4.6       ?       ? 
1 1 1   28   25   44 o     51.7   15.5    0.0000   0.0000          ?        ?    27.4564  17.2401          ?        ?       51.7       15.5       ?       ? 
1 1 1   28   25   45 f    111.6    7.7    0.0000   0.0000          ?        ?   125.1502  17.2401          ?        ?      111.6        7.7       ?       ? 
1 1 1   28   25   46 o    298.8    3.3    0.0000   0.0000          ?        ?   893.2917  19.7942          ?        ?      298.8        3.3       ?       ? 
1 1 1   28   25   47 o    144.9    5.9    0.0000   0.0000          ?        ?   210.7121  17.2401          ?        ?      144.9        5.9       ?       ? 
1 1 1   28   25   48 o    242.2    4.0    0.0000   0.0000          ?        ?   587.4399  19.1556          ?        ?      242.2        4.0       ?       ? 
1 1 1   28   25   49 o     59.6   14.6    0.0000   0.0000          ?        ?    37.6728  17.2401          ?        ?       59.6       14.6       ?       ? 
1 1 1   28   25   50 o    192.6    4.8    0.0000   0.0000          ?        ?   371.6196  18.5171          ?        ?      192.6        4.8       ?       ? 
1 1 1   28   25   51 o    319.4    3.3    0.0000   0.0000          ?        ?  1021.6346  21.0712          ?        ?      319.4        3.3       ?       ? 
1 1 1   28   25   52 o     20.5   10.3    0.0000   0.0000          ?        ?   -49.8047  17.8786          ?        ?       20.5       10.3       ?       ? 
1 1 1   28   25   53 o     35.5   15.0    0.0000   0.0000          ?        ?     1.2770  18.5171          ?        ?       35.5       15.0       ?       ? 
1 1 1   28   25   54 o    172.5    5.6    0.0000   0.0000          ?        ?   298.8281  19.1556          ?        ?      172.5        5.6       ?       ? 
1 1 1   28   25   55 o    140.9    7.0    0.0000   0.0000          ?        ?   199.8573  19.7942          ?        ?      140.9        7.0       ?       ? 
1 1 1   28   25   56 o    221.4    4.5    0.0000   0.0000          ?        ?   491.6617  19.7942          ?        ?      221.4        4.5       ?       ? 
1 1 1   28   25   57 o     95.8    9.7    0.0000   0.0000          ?        ?    93.2242  18.5171          ?        ?       95.8        9.7       ?       ? 
1 1 1   28   25   58 o     67.0   15.1    0.0000   0.0000          ?        ?    48.5276  19.7942          ?        ?       67.0       15.1       ?       ? 
1 1 1   28   25   59 o     22.3   11.1    0.0000   0.0000          ?        ?   -42.1424  18.5171          ?        ?       22.3       11.1       ?       ? 
1 1 1   28   26    0 o    141.4    8.9  202.4114  24.9023   202.4114  24.9023   202.4114  24.9023      141.4      8.9      141.4        8.9     0.0     0.0 
1 1 1   28   26    1 o    459.7    3.2    0.0000   0.0000          ?        ?  2113.5066  29.3720          ?        ?      459.7        3.2       ?       ? 
1 1 1   28   26    2 o    152.2    5.9    0.0000   0.0000          ?        ?   231.7833  17.8786          ?        ?      152.2        5.9       ?       ? 
1 1 1   28   26    3 o    227.2    4.2    0.0000   0.0000          ?        ?   516.5640  19.1556          ?        ?      227.2        4.2       ?       ? 
1 1 1   28   26    4 o     21.4   10.6    0.0000   0.0000          ?        ?   -41.5039  17.2401          ?        ?       21.4       10.6       ?       ? 
1 1 1   28   26    5 o    131.2    6.8    0.0000   0.0000          ?        ?   172.4008  17.8786          ?        ?      131.2        6.8       ?       ? 
1 1 1   28   26    6 o    555.5    3.3    0.0000   0.0000          ?        ?  3086.6135  37.0343          ?        ?      555.5        3.3       ?       ? 
1 1 1   28   26    7 o    812.0    3.7    0.0000   0.0000          ?        ?  6596.5669  60.6596          ?        ?      812.0        3.7       ?       ? 
1 1 1   28   26    8 o    871.4    3.7    0.0000   0.0000          ?        ?  7596.4917  63.8522          ?        ?      871.4        3.7       ?       ? 
1 1 1   28   26    9 o    623.7    2.8    0.0000   0.0000          ?        ?  3891.1509  34.4802          ?        ?      623.7        2.8       ?       ? 
1 1 1   28   26   10 o    103.8    5.2    0.0000   0.0000          ?        ?   107.9102  10.8549          ?        ?      103.8        5.2       ?       ? 
1 1 1   28   26   11 o    382.2    2.5    0.0000   0.0000          ?        ?  1460.9375  19.1556          ?        ?      382.2        2.5       ?       ? 
1 1 1   28   26   12 o    406.4    2.4    0.0000   0.0000          ?        ?  1651.8555  19.1556          ?        ?      406.4        2.4       ?       ? 
1 1 1   28   26   13 o    398.4    2.2    0.0000   0.0000          ?        ?  1587.3647  17.8786          ?        ?      398.4        2.2       ?       ? 
1 1 1   28   26   14 o    770.7    3.0    0.0000   0.0000          ?        ?  5941.4438  45.9736          ?        ?      770.7        3.0       ?       ? 
1 1 1   28   26   15 o    440.1    2.4    0.0000   0.0000          ?        ?  1937.2745  21.0712          ?        ?      440.1        2.4       ?       ? 
1 1 1   28   26   16 o    375.8    2.1    0.0000   0.0000          ?        ?  1412.4098  15.9630          ?        ?      375.8        2.1       ?       ? 
1 1 1   28   26   17 o    305.0    2.4    0.0000   0.0000          ?        ?   930.3260  14.6860          ?        ?      305.0        2.4       ?       ? 
1 1 1   28   26   18 o     70.1    7.3    0.0000   0.0000          ?        ?    49.1662  10.2163          ?        ?       70.1        7.3       ?       ? 
1 1 1   28   26   19 o    178.8    3.2    0.0000   0.0000          ?        ?   319.8993  11.4934          ?        ?      178.8        3.2       ?       ? 
1 1 1   28   26   20 o    474.4    2.4    0.0000   0.0000          ?        ?  2251.4272  22.9868          ?        ?      474.4        2.4       ?       ? 
1 1 1   28   26   21 o    389.8    2.5    0.0000   0.0000          ?        ?  1519.6815  19.1556          ?        ?      389.8        2.5       ?       ? 
1 1 1   28   26   22 o    453.7    2.4    0.0000   0.0000          ?        ?  2059.2322  21.7097          ?        ?      453.7        2.4       ?       ? 
1 1 1   28   26   23 o    685.7    2.8    0.0000   0.0000          ?        ?  4703.3501  38.3113          ?        ?      685.7        2.8       ?       ? 
1 1 1   28   26   24 o    257.5    2.9    0.0000   0.0000          ?        ?   663.4240  14.6860          ?        ?      257.5        2.9       ?       ? 
1 1 1   28   26   25 o    464.7    2.5    0.0000   0.0000          ?        ?  2160.1187  22.9868          ?        ?      464.7        2.5       ?       ? 
1 1 1   28   26   26 o    371.8    2.5    0.0000   0.0000          ?        ?  1383.0378  18.5171          ?        ?      371.8        2.5       ?       ? 
1 1 1   28   26   27 o    429.5    2.5    0.0000   0.0000          ?        ?  1845.3275  21.7097          ?        ?      429.5        2.5       ?       ? 
1 1 1   28   26   28 o    602.8    2.6    0.0000   0.0000          ?        ?  3635.1035  31.9261          ?        ?      602.8        2.6       ?       ? 
1 1 1   28   26   29 f    168.3    4.2    0.0000   0.0000          ?        ?   283.5036  14.0475          ?        ?      168.3        4.2       ?       ? 
1 1 1   28   26   30 o    153.2    4.2    0.0000   0.0000          ?        ?   234.9760  12.7704          ?        ?      153.2        4.2       ?       ? 
1 1 1   28   26   31 o    411.4    2.5    0.0000   0.0000          ?        ?  1692.7208  20.4327          ?        ?      411.4        2.5       ?       ? 
1 1 1   28   26   32 f    179.7    4.3    0.0000   0.0000          ?        ?   323.0919  15.3245          ?        ?      179.7        4.3       ?       ? 
1 1 1   28   26   33 o    206.8    3.9    0.0000   0.0000          ?        ?   427.8095  15.9630          ?        ?      206.8        3.9       ?       ? 
1 1 1   28   26   34 o     25.3   11.9    0.0000   0.0000          ?        ?   -18.5171  15.9630          ?        ?       25.3       11.9       ?       ? 
1 1 1   28   26   35 o    470.1    2.8    0.0000   0.0000          ?        ?  2210.5620  26.1794          ?        ?      470.1        2.8       ?       ? 
1 1 1   28   26   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   26   37 o     26.0   12.0    0.0000   0.0000          ?        ?   -12.1319  14.6860          ?        ?       26.0       12.0       ?       ? 
1 1 1   28   26   38 o    182.1    4.6    0.0000   0.0000          ?        ?   332.0312  16.6016          ?        ?      182.1        4.6       ?       ? 
1 1 1   28   26   39 o     91.2    9.1    0.0000   0.0000          ?        ?    83.6463  16.6016          ?        ?       91.2        9.1       ?       ? 
1 1 1   28   26   40 o    228.0    3.8    0.0000   0.0000          ?        ?   520.3951  17.2401          ?        ?      228.0        3.8       ?       ? 
1 1 1   28   26   41 o    233.0    3.8    0.0000   0.0000          ?        ?   543.3819  17.8786          ?        ?      233.0        3.8       ?       ? 
1 1 1   28   26   42 f    193.5    4.3    0.0000   0.0000          ?        ?   374.8122  16.6016          ?        ?      193.5        4.3       ?       ? 
1 1 1   28   26   43 o     30.6   13.6    0.0000   0.0000          ?        ?    -5.7467  16.6016          ?        ?       30.6       13.6       ?       ? 
1 1 1   28   26   44 f    171.4    4.7    0.0000   0.0000          ?        ?   294.3585  15.9630          ?        ?      171.4        4.7       ?       ? 
1 1 1   28   26   45 o    229.0    3.9    0.0000   0.0000          ?        ?   524.8647  17.8786          ?        ?      229.0        3.9       ?       ? 
1 1 1   28   26   46 o    212.3    4.1    0.0000   0.0000          ?        ?   451.4348  17.2401          ?        ?      212.3        4.1       ?       ? 
1 1 1   28   26   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   26   48 o     52.0   15.5    0.0000   0.0000          ?        ?    28.0950  17.2401          ?        ?       52.0       15.5       ?       ? 
1 1 1   28   26   49 o     85.3   10.1    0.0000   0.0000          ?        ?    73.4300  17.2401          ?        ?       85.3       10.1       ?       ? 
1 1 1   28   26   50 f     70.2   13.2    0.0000   0.0000          ?        ?    51.7203  17.8786          ?        ?       70.2       13.2       ?       ? 
1 1 1   28   26   51 o     76.5   11.7    0.0000   0.0000          ?        ?    59.3825  17.8786          ?        ?       76.5       11.7       ?       ? 
1 1 1   28   26   52 o    239.8    4.0    0.0000   0.0000          ?        ?   575.9465  19.1556          ?        ?      239.8        4.0       ?       ? 
1 1 1   28   26   53 o    178.3    5.4    0.0000   0.0000          ?        ?   319.2608  19.1556          ?        ?      178.3        5.4       ?       ? 
1 1 1   28   26   54 o    432.7    2.9    0.0000   0.0000          ?        ?  1874.6996  24.9023          ?        ?      432.7        2.9       ?       ? 
1 1 1   28   26   55 o    192.4    5.1    0.0000   0.0000          ?        ?   371.6196  19.7942          ?        ?      192.4        5.1       ?       ? 
1 1 1   28   26   56 o    166.4    5.8    0.0000   0.0000          ?        ?   278.3954  19.1556          ?        ?      166.4        5.8       ?       ? 
1 1 1   28   26   57 o     31.2   14.1    0.0000   0.0000          ?        ?    -8.3008  18.5171          ?        ?       31.2       14.1       ?       ? 
1 1 1   28   26   58 o    221.7    4.5    0.0000   0.0000          ?        ?   493.5772  19.7942          ?        ?      221.7        4.5       ?       ? 
1 1 1   28   27    0 o    317.2    4.8 1006.9486  30.6490  1006.9486  30.6490  1006.9486  30.6490      317.2      4.8      317.2        4.8     0.0     0.0 
1 1 1   28   27    1 o    258.3    3.8    0.0000   0.0000          ?        ?   667.2551  19.7942          ?        ?      258.3        3.8       ?       ? 
1 1 1   28   27    2 o    559.2    3.4    0.0000   0.0000          ?        ?  3127.4788  37.6728          ?        ?      559.2        3.4       ?       ? 
1 1 1   28   27    3 o    161.5    5.5    0.0000   0.0000          ?        ?   261.1554  17.8786          ?        ?      161.5        5.5       ?       ? 
1 1 1   28   27    4 o    355.2    3.3    0.0000   0.0000          ?        ?  1261.7188  23.6253          ?        ?      355.2        3.3       ?       ? 
1 1 1   28   27    5 o    105.6    8.5    0.0000   0.0000          ?        ?   111.7413  17.8786          ?        ?      105.6        8.5       ?       ? 
1 1 1   28   27    6 o    390.9    3.3    0.0000   0.0000          ?        ?  1528.6207  25.5409          ?        ?      390.9        3.3       ?       ? 
1 1 1   28   27    7 o    708.8    3.7    0.0000   0.0000          ?        ?  5026.4424  52.3588          ?        ?      708.8        3.7       ?       ? 
1 1 1   28   27    8 o    205.8    5.3    0.0000   0.0000          ?        ?   423.9784  21.7097          ?        ?      205.8        5.3       ?       ? 
1 1 1   28   27    9 o    530.0    2.7    0.0000   0.0000          ?        ?  2809.4951  28.7335          ?        ?      530.0        2.7       ?       ? 
1 1 1   28   27   10 o    497.1    2.6    0.0000   0.0000          ?        ?  2471.7173  26.1794          ?        ?      497.1        2.6       ?       ? 
1 1 1   28   27   11 o    279.8    2.5    0.0000   0.0000          ?        ?   782.8275  14.0475          ?        ?      279.8        2.5       ?       ? 
1 1 1   28   27   12 o    371.4    2.5    0.0000   0.0000          ?        ?  1379.8452  18.5171          ?        ?      371.4        2.5       ?       ? 
1 1 1   28   27   13 f    448.2    2.6    0.0000   0.0000          ?        ?  2009.4276  22.9868          ?        ?      448.2        2.6       ?       ? 
1 1 1   28   27   14 o     90.0    4.6    0.0000   0.0000          ?        ?    81.0922   8.3008          ?        ?       90.0        4.6       ?       ? 
1 1 1   28   27   15 o    592.6    2.5    0.0000   0.0000          ?        ?  3511.8689  29.3720          ?        ?      592.6        2.5       ?       ? 
1 1 1   28   27   16 o     25.0   10.5    0.0000   0.0000          ?        ?     0.6385   8.9393          ?        ?       25.0       10.5       ?       ? 
1 1 1   28   27   17 o    191.1    2.7    0.0000   0.0000          ?        ?   365.2344  10.2163          ?        ?      191.1        2.7       ?       ? 
1 1 1   28   27   18 o    129.3    3.7    0.0000   0.0000          ?        ?   167.2927   9.5778          ?        ?      129.3        3.7       ?       ? 
1 1 1   28   27   19 o    392.4    2.3    0.0000   0.0000          ?        ?  1540.1141  17.8786          ?        ?      392.4        2.3       ?       ? 
1 1 1   28   27   20 o    270.2    2.4    0.0000   0.0000          ?        ?   730.4688  12.7704          ?        ?      270.2        2.4       ?       ? 
1 1 1   28   27   21 o    576.2    2.6    0.0000   0.0000          ?        ?  3320.3125  30.0105          ?        ?      576.2        2.6       ?       ? 
1 1 1   28   27   22 o    495.6    2.4    0.0000   0.0000          ?        ?  2456.3928  24.2638          ?        ?      495.6        2.4       ?       ? 
1 1 1   28   27   23 o    383.1    2.3    0.0000   0.0000          ?        ?  1467.9612  17.8786          ?        ?      383.1        2.3       ?       ? 
1 1 1   28   27   24 o    153.7    3.9    0.0000   0.0000          ?        ?   236.2530  12.1319          ?        ?      153.7        3.9       ?       ? 
1 1 1   28   27   25 o    200.7    3.3    0.0000   0.0000          ?        ?   402.9071  13.4090          ?        ?      200.7        3.3       ?       ? 
1 1 1   28   27   26 o    247.4    2.8    0.0000   0.0000          ?        ?   612.3422  14.0475          ?        ?      247.4        2.8       ?       ? 
1 1 1   28   27   27 o    163.5    3.9    0.0000   0.0000          ?        ?   267.5406  12.7704          ?        ?      163.5        3.9       ?       ? 
1 1 1   28   27   28 o    317.3    2.6    0.0000   0.0000          ?        ?  1006.9486  16.6016          ?        ?      317.3        2.6       ?       ? 
1 1 1   28   27   29 o    502.5    2.5    0.0000   0.0000          ?        ?  2525.3530  24.9023          ?        ?      502.5        2.5       ?       ? 
1 1 1   28   27   30 o    354.5    2.5    0.0000   0.0000          ?        ?  1257.2490  17.8786          ?        ?      354.5        2.5       ?       ? 
1 1 1   28   27   31 o    291.9    2.6    0.0000   0.0000          ?        ?   852.4264  15.3245          ?        ?      291.9        2.6       ?       ? 
1 1 1   28   27   32 o    441.8    2.6    0.0000   0.0000          ?        ?  1952.5990  22.9868          ?        ?      441.8        2.6       ?       ? 
1 1 1   28   27   33 o    577.7    2.7    0.0000   0.0000          ?        ?  3338.1909  30.6490          ?        ?      577.7        2.7       ?       ? 
1 1 1   28   27   34 o     22.0   10.7    0.0000   0.0000          ?        ?   -28.0950  15.3245          ?        ?       22.0       10.7       ?       ? 
1 1 1   28   27   35 o    279.9    3.1    0.0000   0.0000          ?        ?   784.1046  17.2401          ?        ?      279.9        3.1       ?       ? 
1 1 1   28   27   36 o    289.7    3.0    0.0000   0.0000          ?        ?   839.6559  17.2401          ?        ?      289.7        3.0       ?       ? 
1 1 1   28   27   37 o    169.0    4.5    0.0000   0.0000          ?        ?   286.0577  15.3245          ?        ?      169.0        4.5       ?       ? 
1 1 1   28   27   38 o    202.7    4.3    0.0000   0.0000          ?        ?   411.2079  17.2401          ?        ?      202.7        4.3       ?       ? 
1 1 1   28   27   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   27   40 o    371.1    2.7    0.0000   0.0000          ?        ?  1377.9297  19.7942          ?        ?      371.1        2.7       ?       ? 
1 1 1   28   27   41 o    306.0    3.1    0.0000   0.0000          ?        ?   936.7112  19.1556          ?        ?      306.0        3.1       ?       ? 
1 1 1   28   27   42 o    177.8    4.7    0.0000   0.0000          ?        ?   316.7067  16.6016          ?        ?      177.8        4.7       ?       ? 
1 1 1   28   27   43 o    270.6    3.3    0.0000   0.0000          ?        ?   733.0228  17.8786          ?        ?      270.6        3.3       ?       ? 
1 1 1   28   27   44 o    263.6    3.4    0.0000   0.0000          ?        ?   695.3500  17.8786          ?        ?      263.6        3.4       ?       ? 
1 1 1   28   27   45 o    280.6    3.4    0.0000   0.0000          ?        ?   787.9357  19.1556          ?        ?      280.6        3.4       ?       ? 
1 1 1   28   27   46 o    245.1    3.8    0.0000   0.0000          ?        ?   601.4874  18.5171          ?        ?      245.1        3.8       ?       ? 
1 1 1   28   27   47 o    192.3    4.3    0.0000   0.0000          ?        ?   370.3425  16.6016          ?        ?      192.3        4.3       ?       ? 
1 1 1   28   27   48 o     98.1    8.8    0.0000   0.0000          ?        ?    97.0553  17.2401          ?        ?       98.1        8.8       ?       ? 
1 1 1   28   27   49 o    288.3    3.4    0.0000   0.0000          ?        ?   831.9937  19.7942          ?        ?      288.3        3.4       ?       ? 
1 1 1   28   27   50 o    149.4    6.2    0.0000   0.0000          ?        ?   224.1211  18.5171          ?        ?      149.4        6.2       ?       ? 
1 1 1   28   27   51 f    169.0    5.3    0.0000   0.0000          ?        ?   286.6962  17.8786          ?        ?      169.0        5.3       ?       ? 
1 1 1   28   27   52 o    334.9    3.2    0.0000   0.0000          ?        ?  1123.1595  21.7097          ?        ?      334.9        3.2       ?       ? 
1 1 1   28   27   53 o    299.6    3.4    0.0000   0.0000          ?        ?   899.0385  20.4327          ?        ?      299.6        3.4       ?       ? 
1 1 1   28   27   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   27   55 o    173.3    5.5    0.0000   0.0000          ?        ?   302.0207  19.1556          ?        ?      173.3        5.5       ?       ? 
1 1 1   28   27   56 o    131.7    7.0    0.0000   0.0000          ?        ?   174.9549  18.5171          ?        ?      131.7        7.0       ?       ? 
1 1 1   28   27   57 o    122.1    7.6    0.0000   0.0000          ?        ?   150.6911  18.5171          ?        ?      122.1        7.6       ?       ? 
1 1 1   28   28    0 o    429.7    6.1 1847.8816  52.3588  1847.8816  52.3588  1847.8816  52.3588      429.7      6.1      429.7        6.1     0.0     0.0 
1 1 1   28   28    1 o    188.8    7.1  358.2106  26.8179   358.2106  26.8179   358.2106  26.8179      188.8      7.1      188.8        7.1     0.0     0.0 
1 1 1   28   28    2 o    314.5    4.5  989.7085  28.0950   989.7085  28.0950   989.7085  28.0950      314.5      4.5      314.5        4.5     0.0     0.0 
1 1 1   28   28    3 o    303.7    4.7  923.3023  28.7335   923.3023  28.7335   923.3023  28.7335      303.7      4.7      303.7        4.7     0.0     0.0 
1 1 1   28   28    4 f    239.4    6.5  574.6694  31.2876   574.6694  31.2876   574.6694  31.2876      239.4      6.5      239.4        6.5     0.0     0.0 
1 1 1   28   28    5 o    880.2    5.8 7752.2910 101.5249  7752.2910 101.5249  7752.2910 101.5249      880.2      5.8      880.2        5.8     0.0     0.0 
1 1 1   28   28    6 o    151.3   12.0  233.6989  35.7572   233.6989  35.7572   233.6989  35.7572      151.3     12.0      151.3       12.0     0.0     0.0 
1 1 1   28   28    7 o    181.5   10.8  333.3083  38.9498   333.3083  38.9498   333.3083  38.9498      181.5     10.8      181.5       10.8     0.0     0.0 
1 1 1   28   28    8 o   1003.8    6.2 10082.2568 125.1502 10082.2568 125.1502 10082.2568 125.1502     1003.8      6.2     1003.8        6.2     0.0     0.0 
1 1 1   28   28    9 o    369.5    4.1 1365.7977  30.0105  1365.7977  30.0105  1365.7977  30.0105      369.5      4.1      369.5        4.1     0.0     0.0 
1 1 1   28   28   10 o    130.1    5.9  170.4853  15.3245   170.4853  15.3245   170.4853  15.3245      130.1      5.9      130.1        5.9     0.0     0.0 
1 1 1   28   28   11 o    272.4    3.9  742.6006  21.0712   742.6006  21.0712   742.6006  21.0712      272.4      3.9      272.4        3.9     0.0     0.0 
1 1 1   28   28   12 o    168.0    5.7  283.5036  19.1556   283.5036  19.1556   283.5036  19.1556      168.0      5.7      168.0        5.7     0.0     0.0 
1 1 1   28   28   13 o    680.0    4.7 4626.0894  63.8522  4626.0894  63.8522  4626.0894  63.8522      680.0      4.7      680.0        4.7     0.0     0.0 
1 1 1   28   28   14 o     84.0    5.8   71.5144   9.5778    71.5144   9.5778    71.5144   9.5778       84.0      5.8       84.0        5.8     0.0     0.0 
1 1 1   28   28   15 o    358.0    3.3 1282.1515  23.6253  1282.1515  23.6253  1282.1515  23.6253      358.0      3.3      358.0        3.3     0.0     0.0 
1 1 1   28   28   16 o    598.5    3.5 3582.7446  42.1424  3582.7446  42.1424  3582.7446  42.1424      598.5      3.5      598.5        3.5     0.0     0.0 
1 1 1   28   28   17 o    207.3    3.5  430.3636  14.6860   430.3636  14.6860   430.3636  14.6860      207.3      3.5      207.3        3.5     0.0     0.0 
1 1 1   28   28   18 o    261.5    3.3  684.4952  17.2401   684.4952  17.2401   684.4952  17.2401      261.5      3.3      261.5        3.3     0.0     0.0 
1 1 1   28   28   19 o    176.1    4.4  310.9600  15.3245   310.9600  15.3245   310.9600  15.3245      176.1      4.4      176.1        4.4     0.0     0.0 
1 1 1   28   28   20 o    193.6    4.3  375.4507  16.6016   375.4507  16.6016   375.4507  16.6016      193.6      4.3      193.6        4.3     0.0     0.0 
1 1 1   28   28   21 o    290.1    3.6  842.2100  21.0712   842.2100  21.0712   842.2100  21.0712      290.1      3.6      290.1        3.6     0.0     0.0 
1 1 1   28   28   22 o    357.1    3.5 1275.7662  24.9023  1275.7662  24.9023  1275.7662  24.9023      357.1      3.5      357.1        3.5     0.0     0.0 
1 1 1   28   28   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   28   24 f     18.6   13.1  -17.2401  17.8786   -17.2401  17.8786   -17.2401  17.8786       18.6     13.1       18.6       13.1     0.0     0.0 
1 1 1   28   28   25 o    139.5    6.7  196.0261  18.5171   196.0261  18.5171   196.0261  18.5171      139.5      6.7      139.5        6.7     0.0     0.0 
1 1 1   28   28   26 o     32.4   18.5   14.0475  18.5171    14.0475  18.5171    14.0475  18.5171       32.4     18.5       32.4       18.5     0.0     0.0 
1 1 1   28   28   27 o    456.4    3.3 2084.1345  30.0105  2084.1345  30.0105  2084.1345  30.0105      456.4      3.3      456.4        3.3     0.0     0.0 
1 1 1   28   28   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   28   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   28   30 o    461.1    3.5 2126.9155  32.5646  2126.9155  32.5646  2126.9155  32.5646      461.1      3.5      461.1        3.5     0.0     0.0 
1 1 1   28   28   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   28   32 o    296.8    4.4  881.7984  26.1794   881.7984  26.1794   881.7984  26.1794      296.8      4.4      296.8        4.4     0.0     0.0 
1 1 1   28   28   33 o    291.4    4.2  849.8723  24.2638   849.8723  24.2638   849.8723  24.2638      291.4      4.2      291.4        4.2     0.0     0.0 
1 1 1   28   28   34 o     15.8   11.7  -49.1662  21.7097   -49.1662  21.7097   -49.1662  21.7097       15.8     11.7       15.8       11.7     0.0     0.0 
1 1 1   28   28   35 o    378.8    3.7 1436.0352  28.0950  1436.0352  28.0950  1436.0352  28.0950      378.8      3.7      378.8        3.7     0.0     0.0 
1 1 1   28   28   36 o    153.6    7.9  238.1686  24.2638   238.1686  24.2638   238.1686  24.2638      153.6      7.9      153.6        7.9     0.0     0.0 
1 1 1   28   28   37 o     16.7   12.3  -45.3350  22.3483   -45.3350  22.3483   -45.3350  22.3483       16.7     12.3       16.7       12.3     0.0     0.0 
1 1 1   28   28   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   28   39 o    283.6    4.4  805.1758  24.9023   805.1758  24.9023   805.1758  24.9023      283.6      4.4      283.6        4.4     0.0     0.0 
1 1 1   28   28   40 o     14.4   10.7  -66.4062  22.3483   -66.4062  22.3483   -66.4062  22.3483       14.4     10.7       14.4       10.7     0.0     0.0 
1 1 1   28   28   41 o     14.6   10.9  -64.4907  22.3483   -64.4907  22.3483   -64.4907  22.3483       14.6     10.9       14.6       10.9     0.0     0.0 
1 1 1   28   28   42 o     24.3   16.5   -9.5778  22.9868    -9.5778  22.9868    -9.5778  22.9868       24.3     16.5       24.3       16.5     0.0     0.0 
1 1 1   28   28   43 o    223.9    5.3  502.5165  23.6253   502.5165  23.6253   502.5165  23.6253      223.9      5.3      223.9        5.3     0.0     0.0 
1 1 1   28   28   44 o     51.0   22.0   37.6728  22.9868    37.6728  22.9868    37.6728  22.9868       51.0     22.0       51.0       22.0     0.0     0.0 
1 1 1   28   28   45 o    443.6    3.9 1969.2007  34.4802  1969.2007  34.4802  1969.2007  34.4802      443.6      3.9      443.6        3.9     0.0     0.0 
1 1 1   28   28   46 o     77.0   18.2   68.9603  24.2638    68.9603  24.2638    68.9603  24.2638       77.0     18.2       77.0       18.2     0.0     0.0 
1 1 1   28   28   47 o     18.0   13.2  -50.4432  25.5409   -50.4432  25.5409   -50.4432  25.5409       18.0     13.2       18.0       13.2     0.0     0.0 
1 1 1   28   28   48 o    111.8   11.4  129.6199  24.9023   129.6199  24.9023   129.6199  24.9023      111.8     11.4      111.8       11.4     0.0     0.0 
1 1 1   28   28   49 o    149.6    8.4  226.6752  24.9023   226.6752  24.9023   226.6752  24.9023      149.6      8.4      149.6        8.4     0.0     0.0 
1 1 1   28   28   50 o     31.3   19.6    7.0237  24.9023     7.0237  24.9023     7.0237  24.9023       31.3     19.6       31.3       19.6     0.0     0.0 
1 1 1   28   28   51 o    192.7    7.0  374.1737  26.8179   374.1737  26.8179   374.1737  26.8179      192.7      7.0      192.7        7.0     0.0     0.0 
1 1 1   28   28   52 o    142.9    9.5  208.1580  26.8179   208.1580  26.8179   208.1580  26.8179      142.9      9.5      142.9        9.5     0.0     0.0 
1 1 1   28   28   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   28   28   54 o     84.3   17.6   81.0922  26.1794    81.0922  26.1794    81.0922  26.1794       84.3     17.6       84.3       17.6     0.0     0.0 
1 1 1   28   28   55 f    140.7    8.9  201.7728  24.9023   201.7728  24.9023   201.7728  24.9023      140.7      8.9      140.7        8.9     0.0     0.0 
1 1 1   28   28   56 o    125.2   10.3  161.5460  25.5409   161.5460  25.5409   161.5460  25.5409      125.2     10.3      125.2       10.3     0.0     0.0 
1 1 1   29    0    0 o    845.4    6.3 7147.6113 105.9946  7147.6113 105.9946  7147.6113 105.9946      845.4      6.3      845.4        6.3     0.0     0.0 
1 1 1   29    0    1 o    639.9    3.6 4095.4778  45.9736  4095.4778  45.9736  4095.4778  45.9736      639.9      3.6      639.9        3.6     0.0     0.0 
1 1 1   29    0    2 o   1168.5    5.8 13656.0615 134.7281 13656.0615 134.7281 13656.0615 134.7281     1168.5      5.8     1168.5        5.8     0.0     0.0 
1 1 1   29    0    3 o   1410.9    6.8 19908.4648 192.1950 19908.4648 192.1950 19908.4648 192.1950     1410.9      6.8     1410.9        6.8     0.0     0.0 
1 1 1   29    0    4 o   1201.3    6.0 14432.5049 143.6674 14432.5049 143.6674 14432.5049 143.6674     1201.3      6.0     1201.3        6.0     0.0     0.0 
1 1 1   29    0    5 o   2085.4    9.7 43496.7305 404.8227 43496.7305 404.8227 43496.7305 404.8227     2085.4      9.7     2085.4        9.7     0.0     0.0 
1 1 1   29    0    6 o   1734.0    8.1 30073.0898 282.2266 30073.0898 282.2266 30073.0898 282.2266     1734.0      8.1     1734.0        8.1     0.0     0.0 
1 1 1   29    0    7 o   1413.6    6.7 19984.4492 189.6409 19984.4492 189.6409 19984.4492 189.6409     1413.6      6.7     1413.6        6.7     0.0     0.0 
1 1 1   29    0    8 o   2015.5    9.4 40632.3242 378.0048 40632.3242 378.0048 40632.3242 378.0048     2015.5      9.4     2015.5        9.4     0.0     0.0 
1 1 1   29    0    9 o   2116.9   11.3 44825.4961 477.6142 44825.4961 477.6142 44825.4961 477.6142     2116.9     11.3     2116.9       11.3     0.0     0.0 
1 1 1   29    0   10 o    214.6    3.9  461.0126  16.6016   461.0126  16.6016   461.0126  16.6016      214.6      3.9      214.6        3.9     0.0     0.0 
1 1 1   29    0   11 o    461.4    3.2 2128.8311  29.3720  2128.8311  29.3720  2128.8311  29.3720      461.4      3.2      461.4        3.2     0.0     0.0 
1 1 1   29    0   12 o   2422.3   11.1 58691.6289 538.2737 58691.6289 538.2737 58691.6289 538.2737     2422.3     11.1     2422.3       11.1     0.0     0.0 
1 1 1   29    0   13 o    456.0    3.2 2079.6650  29.3720  2079.6650  29.3720  2079.6650  29.3720      456.0      3.2      456.0        3.2     0.0     0.0 
1 1 1   29    0   14 o   1590.9    7.6 25312.9141 241.3612 25312.9141 241.3612 25312.9141 241.3612     1590.9      7.6     1590.9        7.6     0.0     0.0 
1 1 1   29    0   15 o    534.5    3.3 2857.3843  35.1187  2857.3843  35.1187  2857.3843  35.1187      534.5      3.3      534.5        3.3     0.0     0.0 
1 1 1   29    0   16 o   1363.9    6.6 18604.6035 178.7861 18604.6035 178.7861 18604.6035 178.7861     1363.9      6.6     1363.9        6.6     0.0     0.0 
1 1 1   29    0   17 o    230.8    3.2  533.1656  14.6860   533.1656  14.6860   533.1656  14.6860      230.8      3.2      230.8        3.2     0.0     0.0 
1 1 1   29    0   18 o    903.3    4.6 8160.3062  83.6463  8160.3062  83.6463  8160.3062  83.6463      903.3      4.6      903.3        4.6     0.0     0.0 
1 1 1   29    0   19 o   1688.0    7.9 28500.4121 267.5406 28500.4121 267.5406 28500.4121 267.5406     1688.0      7.9     1688.0        7.9     0.0     0.0 
1 1 1   29    0   20 o    334.7    3.2 1120.6055  21.7097  1120.6055  21.7097  1120.6055  21.7097      334.7      3.2      334.7        3.2     0.0     0.0 
1 1 1   29    0   21 o   1595.8    7.5 25470.6270 238.1686 25470.6270 238.1686 25470.6270 238.1686     1595.8      7.5     1595.8        7.5     0.0     0.0 
1 1 1   29    0   22 o   1619.3    8.0 26225.9980 260.5168 26225.9980 260.5168 26225.9980 260.5168     1619.3      8.0     1619.3        8.0     0.0     0.0 
1 1 1   29    0   23 o    422.7    3.4 1787.2220  28.7335  1787.2220  28.7335  1787.2220  28.7335      422.7      3.4      422.7        3.4     0.0     0.0 
1 1 1   29    0   24 o   1462.2    7.3 21385.3652 213.2662 21385.3652 213.2662 21385.3652 213.2662     1462.2      7.3     1462.2        7.3     0.0     0.0 
1 1 1   29    0   25 o    210.2    4.7  442.4955  19.7942   442.4955  19.7942   442.4955  19.7942      210.2      4.7      210.2        4.7     0.0     0.0 
1 1 1   29    0   26 o   1037.3    6.8 10763.5586 141.7518 10763.5586 141.7518 10763.5586 141.7518     1037.3      6.8     1037.3        6.8     0.0     0.0 
1 1 1   29    0   27 o    847.0    6.5 7176.9829 110.4642  7176.9829 110.4642  7176.9829 110.4642      847.0      6.5      847.0        6.5     0.0     0.0 
1 1 1   29    0   28 o   1786.0   10.2 31909.4785 364.5958 31909.4785 364.5958 31909.4785 364.5958     1786.0     10.2     1786.0       10.2     0.0     0.0 
1 1 1   29    0   29 o   1248.9    7.1 15600.9990 176.8705 15600.9990 176.8705 15600.9990 176.8705     1248.9      7.1     1248.9        7.1     0.0     0.0 
1 1 1   29    0   30 o    628.7    4.2 3953.7261  52.3588  3953.7261  52.3588  3953.7261  52.3588      628.7      4.2      628.7        4.2     0.0     0.0 
1 1 1   29    0   31 o    210.3    5.8  443.1340  24.2638   443.1340  24.2638   443.1340  24.2638      210.3      5.8      210.3        5.8     0.0     0.0 
1 1 1   29    0   32 o    408.0    4.5 1665.2643  36.3957  1665.2643  36.3957  1665.2643  36.3957      408.0      4.5      408.0        4.5     0.0     0.0 
1 1 1   29    0   33 o    165.4    7.4  275.2028  24.2638   275.2028  24.2638   275.2028  24.2638      165.4      7.4      165.4        7.4     0.0     0.0 
1 1 1   29    0   34 o    734.1    4.3 5389.7607  63.8522  5389.7607  63.8522  5389.7607  63.8522      734.1      4.3      734.1        4.3     0.0     0.0 
1 1 1   29    0   35 o   1209.5    5.9 14633.0000 143.0288 14633.0000 143.0288 14633.0000 143.0288     1209.5      5.9     1209.5        5.9     0.0     0.0 
1 1 1   29    0   36 o    278.6    4.5  777.0808  24.9023   777.0808  24.9023   777.0808  24.9023      278.6      4.5      278.6        4.5     0.0     0.0 
1 1 1   29    0   37 o    328.5    4.0 1079.7401  26.1794  1079.7401  26.1794  1079.7401  26.1794      328.5      4.0      328.5        4.0     0.0     0.0 
1 1 1   29    0   38 o    130.3    8.2  171.7623  21.0712   171.7623  21.0712   171.7623  21.0712      130.3      8.2      130.3        8.2     0.0     0.0 
1 1 1   29    0   39 o    210.7    5.8  445.0496  24.2638   445.0496  24.2638   445.0496  24.2638      210.7      5.8      210.7        5.8     0.0     0.0 
1 1 1   29    0   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    0   41 o    881.5    4.8 7772.0850  84.9234  7772.0850  84.9234  7772.0850  84.9234      881.5      4.8      881.5        4.8     0.0     0.0 
1 1 1   29    0   42 o    230.8    5.8  533.8041  26.8179   533.8041  26.8179   533.8041  26.8179      230.8      5.8      230.8        5.8     0.0     0.0 
1 1 1   29    0   43 o    822.7    4.5 6770.2451  74.0685  6770.2451  74.0685  6770.2451  74.0685      822.7      4.5      822.7        4.5     0.0     0.0 
1 1 1   29    0   44 o    460.5    3.8 2121.8074  35.1187  2121.8074  35.1187  2121.8074  35.1187      460.5      3.8      460.5        3.8     0.0     0.0 
1 1 1   29    0   45 o    387.9    4.1 1505.6340  31.9261  1505.6340  31.9261  1505.6340  31.9261      387.9      4.1      387.9        4.1     0.0     0.0 
1 1 1   29    0   46 o    618.6    3.8 3827.2988  46.6121  3827.2988  46.6121  3827.2988  46.6121      618.6      3.8      618.6        3.8     0.0     0.0 
1 1 1   29    0   47 o    123.3   10.0  155.1608  24.2638   155.1608  24.2638   155.1608  24.2638      123.3     10.0      123.3       10.0     0.0     0.0 
1 1 1   29    0   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    0   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    0   50 o    303.2    4.3  920.1097  26.1794   920.1097  26.1794   920.1097  26.1794      303.2      4.3      303.2        4.3     0.0     0.0 
1 1 1   29    0   51 o    512.4    4.0 2626.2393  40.8654  2626.2393  40.8654  2626.2393  40.8654      512.4      4.0      512.4        4.0     0.0     0.0 
1 1 1   29    0   52 o     21.2   15.0  -23.6253  23.6253   -23.6253  23.6253   -23.6253  23.6253       21.2     15.0       21.2       15.0     0.0     0.0 
1 1 1   29    0   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    0   54 o     28.7   19.0   -4.4697  27.4564    -4.4697  27.4564    -4.4697  27.4564       28.7     19.0       28.7       19.0     0.0     0.0 
1 1 1   29    0   55 o    728.6    4.1 5311.2227  60.0210  5311.2227  60.0210  5311.2227  60.0210      728.6      4.1      728.6        4.1     0.0     0.0 
1 1 1   29    0   56 o     17.8   13.1  -52.3588  25.5409   -52.3588  25.5409   -52.3588  25.5409       17.8     13.1       17.8       13.1     0.0     0.0 
1 1 1   29    0   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    0   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    0   59 o    128.0   10.9  167.9312  27.4564   167.9312  27.4564   167.9312  27.4564      128.0     10.9      128.0       10.9     0.0     0.0 
1 1 1   29    0   60 o    102.4   13.0  106.6331  26.8179   106.6331  26.8179   106.6331  26.8179      102.4     13.0      102.4       13.0     0.0     0.0 
1 1 1   29    0   61 o    234.8    6.1  552.9597  28.7335   552.9597  28.7335   552.9597  28.7335      234.8      6.1      234.8        6.1     0.0     0.0 
1 1 1   29    0   62 o     21.2   15.2  -36.3957  27.4564   -36.3957  27.4564   -36.3957  27.4564       21.2     15.2       21.2       15.2     0.0     0.0 
1 1 1   29    0   63 o    330.3    4.8 1092.5105  31.9261  1092.5105  31.9261  1092.5105  31.9261      330.3      4.8      330.3        4.8     0.0     0.0 
1 1 1   29    0   64 o    426.5    4.3 1821.0637  37.0343  1821.0637  37.0343  1821.0637  37.0343      426.5      4.3      426.5        4.3     0.0     0.0 
1 1 1   29    0   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    0   66 o     17.1   12.7  -83.6463  30.0105   -83.6463  30.0105   -83.6463  30.0105       17.1     12.7       17.1       12.7     0.0     0.0 
1 1 1   29    0   67 o    352.8    4.6 1246.3942  32.5646  1246.3942  32.5646  1246.3942  32.5646      352.8      4.6      352.8        4.6     0.0     0.0 
1 1 1   29    0   68 o    355.5    4.7 1266.1884  33.2031  1266.1884  33.2031  1266.1884  33.2031      355.5      4.7      355.5        4.7     0.0     0.0 
1 1 1   29    0   69 o     37.9   22.4   17.8786  28.7335    17.8786  28.7335    17.8786  28.7335       37.9     22.4       37.9       22.4     0.0     0.0 
1 1 1   29    0   70 o    209.8    7.3  443.1340  30.6490   443.1340  30.6490   443.1340  30.6490      209.8      7.3      209.8        7.3     0.0     0.0 
1 1 1   29    0   71 o     38.1   22.5   18.5171  28.7335    18.5171  28.7335    18.5171  28.7335       38.1     22.5       38.1       22.5     0.0     0.0 
1 1 1   29    0   72 o    168.7    8.8  288.6118  29.3720   288.6118  29.3720   288.6118  29.3720      168.7      8.8      168.7        8.8     0.0     0.0 
1 1 1   29    0   73 o    121.4   12.3  153.8837  29.3720   153.8837  29.3720   153.8837  29.3720      121.4     12.3      121.4       12.3     0.0     0.0 
1 1 1   29    0   74 o     27.1   18.4  -10.8549  28.7335   -10.8549  28.7335   -10.8549  28.7335       27.1     18.4       27.1       18.4     0.0     0.0 
1 1 1   29    1    0 o   2033.3    9.5 41350.0195 384.3900 41350.0195 384.3900 41350.0195 384.3900     2033.3      9.5     2033.3        9.5     0.0     0.0 
1 1 1   29    1    1 o    894.6    3.4    0.0000   0.0000          ?        ?  8003.8687  61.2981          ?        ?      894.6        3.4       ?       ? 
1 1 1   29    1    2 o   1917.9    6.3    0.0000   0.0000          ?        ? 36789.7031 241.9997          ?        ?     1917.9        6.3       ?       ? 
1 1 1   29    1    3 o    380.4    2.2    0.0000   0.0000          ?        ?  1446.8900  16.6016          ?        ?      380.4        2.2       ?       ? 
1 1 1   29    1    4 o    360.7    2.1    0.0000   0.0000          ?        ?  1301.3071  15.3245          ?        ?      360.7        2.1       ?       ? 
1 1 1   29    1    5 o   1093.8    3.9    0.0000   0.0000          ?        ? 11964.6182  84.2849          ?        ?     1093.8        3.9       ?       ? 
1 1 1   29    1    6 o    826.2    3.2    0.0000   0.0000          ?        ?  6826.4346  52.3588          ?        ?      826.2        3.2       ?       ? 
1 1 1   29    1    7 o    887.4    3.2    0.0000   0.0000          ?        ?  7874.2485  57.4669          ?        ?      887.4        3.2       ?       ? 
1 1 1   29    1    8 o   1700.7    5.6    0.0000   0.0000          ?        ? 28925.0293 191.5565          ?        ?     1700.7        5.6       ?       ? 
1 1 1   29    1    9 o    839.0    3.1    0.0000   0.0000          ?        ?  7039.7012  52.3588          ?        ?      839.0        3.1       ?       ? 
1 1 1   29    1   10 o   1189.4    4.1    0.0000   0.0000          ?        ? 14148.3623  98.3323          ?        ?     1189.4        4.1       ?       ? 
1 1 1   29    1   11 o    812.1    3.1    0.0000   0.0000          ?        ?  6594.6519  49.8047          ?        ?      812.1        3.1       ?       ? 
1 1 1   29    1   12 o   1024.5    4.0    0.0000   0.0000          ?        ? 10496.0186  81.7308          ?        ?     1024.5        4.0       ?       ? 
1 1 1   29    1   13 o    709.4    2.9    0.0000   0.0000          ?        ?  5032.8276  40.8654          ?        ?      709.4        2.9       ?       ? 
1 1 1   29    1   14 o   1104.7    4.0    0.0000   0.0000          ?        ? 12205.3408  89.3930          ?        ?     1104.7        4.0       ?       ? 
1 1 1   29    1   15 o   1239.1    4.5    0.0000   0.0000          ?        ? 15354.5293 111.1028          ?        ?     1239.1        4.5       ?       ? 
1 1 1   29    1   16 o   1604.2    5.7    0.0000   0.0000          ?        ? 25736.8906 183.2557          ?        ?     1604.2        5.7       ?       ? 
1 1 1   29    1   17 o   1719.4    6.1    0.0000   0.0000          ?        ? 29569.2969 208.7966          ?        ?     1719.4        6.1       ?       ? 
1 1 1   29    1   18 o    291.3    2.5    0.0000   0.0000          ?        ?   848.5952  14.6860          ?        ?      291.3        2.5       ?       ? 
1 1 1   29    1   19 o   1682.2    5.8    0.0000   0.0000          ?        ? 28301.8320 196.6647          ?        ?     1682.2        5.8       ?       ? 
1 1 1   29    1   20 o    289.5    2.9    0.0000   0.0000          ?        ?   838.3789  16.6016          ?        ?      289.5        2.9       ?       ? 
1 1 1   29    1   21 o   1106.4    4.1    0.0000   0.0000          ?        ? 12243.0137  90.0316          ?        ?     1106.4        4.1       ?       ? 
1 1 1   29    1   22 o    315.5    2.5    0.0000   0.0000          ?        ?   995.4552  15.9630          ?        ?      315.5        2.5       ?       ? 
1 1 1   29    1   23 o    978.7    3.6    0.0000   0.0000          ?        ?  9578.4629  69.5989          ?        ?      978.7        3.6       ?       ? 
1 1 1   29    1   24 o    523.1    2.4    0.0000   0.0000          ?        ?  2736.0652  25.5409          ?        ?      523.1        2.4       ?       ? 
1 1 1   29    1   25 o    311.0    2.7    0.0000   0.0000          ?        ?   967.3603  16.6016          ?        ?      311.0        2.7       ?       ? 
1 1 1   29    1   26 o    451.1    2.6    0.0000   0.0000          ?        ?  2034.9685  23.6253          ?        ?      451.1        2.6       ?       ? 
1 1 1   29    1   27 o    859.1    3.4    0.0000   0.0000          ?        ?  7381.3101  58.7440          ?        ?      859.1        3.4       ?       ? 
1 1 1   29    1   28 o    103.2    7.7    0.0000   0.0000          ?        ?   106.6331  15.9630          ?        ?      103.2        7.7       ?       ? 
1 1 1   29    1   29 o    635.1    3.1    0.0000   0.0000          ?        ?  4033.5413  38.9498          ?        ?      635.1        3.1       ?       ? 
1 1 1   29    1   30 o    980.7    4.1    0.0000   0.0000          ?        ?  9618.6895  79.8152          ?        ?      980.7        4.1       ?       ? 
1 1 1   29    1   31 o    379.7    2.7    0.0000   0.0000          ?        ?  1441.7819  20.4327          ?        ?      379.7        2.7       ?       ? 
1 1 1   29    1   32 o    601.1    3.2    0.0000   0.0000          ?        ?  3614.0325  38.3113          ?        ?      601.1        3.2       ?       ? 
1 1 1   29    1   33 o    517.0    2.7    0.0000   0.0000          ?        ?  2672.8516  27.4564          ?        ?      517.0        2.7       ?       ? 
1 1 1   29    1   34 o    709.4    3.0    0.0000   0.0000          ?        ?  5033.4658  42.1424          ?        ?      709.4        3.0       ?       ? 
1 1 1   29    1   35 o    529.2    2.7    0.0000   0.0000          ?        ?  2800.5559  28.0950          ?        ?      529.2        2.7       ?       ? 
1 1 1   29    1   36 o    505.4    2.6    0.0000   0.0000          ?        ?  2554.0864  26.1794          ?        ?      505.4        2.6       ?       ? 
1 1 1   29    1   37 o    860.5    3.3    0.0000   0.0000          ?        ?  7406.2124  56.1899          ?        ?      860.5        3.3       ?       ? 
1 1 1   29    1   38 o    279.8    3.2    0.0000   0.0000          ?        ?   782.8275  17.8786          ?        ?      279.8        3.2       ?       ? 
1 1 1   29    1   39 o    451.9    2.6    0.0000   0.0000          ?        ?  2042.6306  23.6253          ?        ?      451.9        2.6       ?       ? 
1 1 1   29    1   40 o    241.4    3.4    0.0000   0.0000          ?        ?   582.9703  16.6016          ?        ?      241.4        3.4       ?       ? 
1 1 1   29    1   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    1   42 o    893.6    3.4    0.0000   0.0000          ?        ?  7985.9897  60.0210          ?        ?      893.6        3.4       ?       ? 
1 1 1   29    1   43 o    250.6    3.4    0.0000   0.0000          ?        ?   628.3053  17.2401          ?        ?      250.6        3.4       ?       ? 
1 1 1   29    1   44 o    458.3    2.6    0.0000   0.0000          ?        ?  2100.7361  23.6253          ?        ?      458.3        2.6       ?       ? 
1 1 1   29    1   45 o     96.1    8.3    0.0000   0.0000          ?        ?    92.5856  15.9630          ?        ?       96.1        8.3       ?       ? 
1 1 1   29    1   46 o    386.7    2.6    0.0000   0.0000          ?        ?  1495.4176  20.4327          ?        ?      386.7        2.6       ?       ? 
1 1 1   29    1   47 o    245.9    3.4    0.0000   0.0000          ?        ?   604.6799  16.6016          ?        ?      245.9        3.4       ?       ? 
1 1 1   29    1   48 o    384.0    2.8    0.0000   0.0000          ?        ?  1474.9850  21.7097          ?        ?      384.0        2.8       ?       ? 
1 1 1   29    1   49 o    371.8    2.7    0.0000   0.0000          ?        ?  1382.3993  20.4327          ?        ?      371.8        2.7       ?       ? 
1 1 1   29    1   50 o    186.0    4.6    0.0000   0.0000          ?        ?   346.0787  17.2401          ?        ?      186.0        4.6       ?       ? 
1 1 1   29    1   51 o    211.3    4.2    0.0000   0.0000          ?        ?   446.9651  17.8786          ?        ?      211.3        4.2       ?       ? 
1 1 1   29    1   52 o    570.9    2.6    0.0000   0.0000          ?        ?  3260.2915  30.0105          ?        ?      570.9        2.6       ?       ? 
1 1 1   29    1   53 o    133.1    6.2    0.0000   0.0000          ?        ?   177.5090  16.6016          ?        ?      133.1        6.2       ?       ? 
1 1 1   29    1   54 o    167.5    5.3    0.0000   0.0000          ?        ?   280.9495  17.8786          ?        ?      167.5        5.3       ?       ? 
1 1 1   29    1   55 o    109.1    7.9    0.0000   0.0000          ?        ?   119.4035  17.2401          ?        ?      109.1        7.9       ?       ? 
1 1 1   29    1   56 o    141.7    6.5    0.0000   0.0000          ?        ?   201.1343  18.5171          ?        ?      141.7        6.5       ?       ? 
1 1 1   29    1   57 o    123.1    7.5    0.0000   0.0000          ?        ?   151.9681  18.5171          ?        ?      123.1        7.5       ?       ? 
1 1 1   29    1   58 o     23.3   11.5    0.0000   0.0000          ?        ?   -38.3113  18.5171          ?        ?       23.3       11.5       ?       ? 
1 1 1   29    1   59 o    259.9    3.9    0.0000   0.0000          ?        ?   676.1944  20.4327          ?        ?      259.9        3.9       ?       ? 
1 1 1   29    1   60 o    184.8    5.4    0.0000   0.0000          ?        ?   342.2476  19.7942          ?        ?      184.8        5.4       ?       ? 
1 1 1   29    1   61 o     79.5   12.0    0.0000   0.0000          ?        ?    63.8522  19.1556          ?        ?       79.5       12.0       ?       ? 
1 1 1   29    1   62 o    235.9    4.5    0.0000   0.0000          ?        ?   557.4294  21.0712          ?        ?      235.9        4.5       ?       ? 
1 1 1   29    1   63 o    140.2    7.1    0.0000   0.0000          ?        ?   197.3032  19.7942          ?        ?      140.2        7.1       ?       ? 
1 1 1   29    1   64 o     39.7   15.7    0.0000   0.0000          ?        ?     8.9393  18.5171          ?        ?       39.7       15.7       ?       ? 
1 1 1   29    1   65 o     81.4   12.2    0.0000   0.0000          ?        ?    67.0448  19.7942          ?        ?       81.4       12.2       ?       ? 
1 1 1   29    1   66 f    397.7    3.1    0.0000   0.0000          ?        ?  1582.8950  24.9023          ?        ?      397.7        3.1       ?       ? 
1 1 1   29    1   67 o     93.3   11.3    0.0000   0.0000          ?        ?    88.1160  21.0712          ?        ?       93.3       11.3       ?       ? 
1 1 1   29    1   68 o    162.0    6.3    0.0000   0.0000          ?        ?   263.7094  20.4327          ?        ?      162.0        6.3       ?       ? 
1 1 1   29    1   69 o    381.9    3.2    0.0000   0.0000          ?        ?  1460.2990  24.2638          ?        ?      381.9        3.2       ?       ? 
1 1 1   29    1   70 f    151.7    7.2    0.0000   0.0000          ?        ?   231.7833  21.7097          ?        ?      151.7        7.2       ?       ? 
1 1 1   29    1   71 o    112.9    9.1    0.0000   0.0000          ?        ?   128.9814  20.4327          ?        ?      112.9        9.1       ?       ? 
1 1 1   29    1   72 o    164.8    6.4    0.0000   0.0000          ?        ?   273.2873  21.0712          ?        ?      164.8        6.4       ?       ? 
1 1 1   29    1   73 o     24.8   12.1    0.0000   0.0000          ?        ?   -35.7572  19.7942          ?        ?       24.8       12.1       ?       ? 
1 1 1   29    1   74 o    218.3    4.8    0.0000   0.0000          ?        ?   478.8912  21.0712          ?        ?      218.3        4.8       ?       ? 
1 1 1   29    2    0 o   1482.9    7.8 21993.2383 230.5063 21993.2383 230.5063 21993.2383 230.5063     1482.9      7.8     1482.9        7.8     0.0     0.0 
1 1 1   29    2    1 o   1564.8    5.6    0.0000   0.0000          ?        ? 24489.8574 175.5934          ?        ?     1564.8        5.6       ?       ? 
1 1 1   29    2    2 o    490.9    2.5    0.0000   0.0000          ?        ?  2409.7805  24.9023          ?        ?      490.9        2.5       ?       ? 
1 1 1   29    2    3 o    609.4    2.7    0.0000   0.0000          ?        ?  3714.2803  32.5646          ?        ?      609.4        2.7       ?       ? 
1 1 1   29    2    4 o   1431.6    5.2    0.0000   0.0000          ?        ? 20497.8203 148.1370          ?        ?     1431.6        5.2       ?       ? 
1 1 1   29    2    5 o    499.4    2.5    0.0000   0.0000          ?        ?  2494.0654  24.9023          ?        ?      499.4        2.5       ?       ? 
1 1 1   29    2    6 o   1541.1    5.4    0.0000   0.0000          ?        ? 23753.0039 166.6541          ?        ?     1541.1        5.4       ?       ? 
1 1 1   29    2    7 o   1180.1    4.3    0.0000   0.0000          ?        ? 13926.1562 100.8864          ?        ?     1180.1        4.3       ?       ? 
1 1 1   29    2    8 o   1071.7    3.8    0.0000   0.0000          ?        ? 11486.3652  82.3693          ?        ?     1071.7        3.8       ?       ? 
1 1 1   29    2    9 o    898.5    3.3    0.0000   0.0000          ?        ?  8074.1060  60.0210          ?        ?      898.5        3.3       ?       ? 
1 1 1   29    2   10 o   1066.1    3.9    0.0000   0.0000          ?        ? 11365.6846  82.3693          ?        ?     1066.1        3.9       ?       ? 
1 1 1   29    2   11 o   1193.8    4.2    0.0000   0.0000          ?        ? 14251.8027 100.8864          ?        ?     1193.8        4.2       ?       ? 
1 1 1   29    2   12 o    520.8    2.3    0.0000   0.0000          ?        ?  2712.4397  24.2638          ?        ?      520.8        2.3       ?       ? 
1 1 1   29    2   13 o   1608.7    5.5    0.0000   0.0000          ?        ? 25882.4746 176.2320          ?        ?     1608.7        5.5       ?       ? 
1 1 1   29    2   14 o   1994.7    6.7    0.0000   0.0000          ?        ? 39794.5820 266.9020          ?        ?     1994.7        6.7       ?       ? 
1 1 1   29    2   15 o    957.5    3.6    0.0000   0.0000          ?        ?  9167.8936  68.3218          ?        ?      957.5        3.6       ?       ? 
1 1 1   29    2   16 o   1481.5    5.0    0.0000   0.0000          ?        ? 21951.0977 148.7755          ?        ?     1481.5        5.0       ?       ? 
1 1 1   29    2   17 o    482.8    2.4    0.0000   0.0000          ?        ?  2331.2424  23.6253          ?        ?      482.8        2.4       ?       ? 
1 1 1   29    2   18 o   1406.3    4.8    0.0000   0.0000          ?        ? 19778.2070 134.0895          ?        ?     1406.3        4.8       ?       ? 
1 1 1   29    2   19 o    839.8    3.2    0.0000   0.0000          ?        ?  7052.4712  53.6358          ?        ?      839.8        3.2       ?       ? 
1 1 1   29    2   20 o    800.6    3.0    0.0000   0.0000          ?        ?  6410.1187  47.8891          ?        ?      800.6        3.0       ?       ? 
1 1 1   29    2   21 o   1269.5    4.4    0.0000   0.0000          ?        ? 16118.8389 112.3798          ?        ?     1269.5        4.4       ?       ? 
1 1 1   29    2   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    2   23 o    480.3    2.4    0.0000   0.0000          ?        ?  2306.9785  22.9868          ?        ?      480.3        2.4       ?       ? 
1 1 1   29    2   24 o    217.5    3.5    0.0000   0.0000          ?        ?   473.1445  15.3245          ?        ?      217.5        3.5       ?       ? 
1 1 1   29    2   25 o    203.7    3.6    0.0000   0.0000          ?        ?   415.0391  14.6860          ?        ?      203.7        3.6       ?       ? 
1 1 1   29    2   26 o    544.3    2.8    0.0000   0.0000          ?        ?  2962.7402  30.6490          ?        ?      544.3        2.8       ?       ? 
1 1 1   29    2   27 o    842.5    3.6    0.0000   0.0000          ?        ?  7098.4448  60.0210          ?        ?      842.5        3.6       ?       ? 
1 1 1   29    2   28 o    436.9    2.6    0.0000   0.0000          ?        ?  1908.5411  22.9868          ?        ?      436.9        2.6       ?       ? 
1 1 1   29    2   29 o    765.0    3.4    0.0000   0.0000          ?        ?  5853.3276  51.7203          ?        ?      765.0        3.4       ?       ? 
1 1 1   29    2   30 o    400.3    2.6    0.0000   0.0000          ?        ?  1602.6893  21.0712          ?        ?      400.3        2.6       ?       ? 
1 1 1   29    2   31 f    487.6    2.7    0.0000   0.0000          ?        ?  2377.2158  26.1794          ?        ?      487.6        2.7       ?       ? 
1 1 1   29    2   32 o    890.2    3.5    0.0000   0.0000          ?        ?  7924.6919  62.5751          ?        ?      890.2        3.5       ?       ? 
1 1 1   29    2   33 o    537.7    2.7    0.0000   0.0000          ?        ?  2891.8645  28.7335          ?        ?      537.7        2.7       ?       ? 
1 1 1   29    2   34 o    479.2    2.7    0.0000   0.0000          ?        ?  2296.7625  25.5409          ?        ?      479.2        2.7       ?       ? 
1 1 1   29    2   35 o    569.0    2.7    0.0000   0.0000          ?        ?  3237.3047  30.6490          ?        ?      569.0        2.7       ?       ? 
1 1 1   29    2   36 o    574.1    2.7    0.0000   0.0000          ?        ?  3296.6870  30.6490          ?        ?      574.1        2.7       ?       ? 
1 1 1   29    2   37 o    675.5    2.8    0.0000   0.0000          ?        ?  4562.8755  38.3113          ?        ?      675.5        2.8       ?       ? 
1 1 1   29    2   38 o    423.3    2.6    0.0000   0.0000          ?        ?  1792.3303  22.3483          ?        ?      423.3        2.6       ?       ? 
1 1 1   29    2   39 o    751.0    3.1    0.0000   0.0000          ?        ?  5640.7002  45.9736          ?        ?      751.0        3.1       ?       ? 
1 1 1   29    2   40 f    876.0    3.2    0.0000   0.0000          ?        ?  7675.6685  56.8284          ?        ?      876.0        3.2       ?       ? 
1 1 1   29    2   41 o    123.0    6.5    0.0000   0.0000          ?        ?   151.3296  15.9630          ?        ?      123.0        6.5       ?       ? 
1 1 1   29    2   42 o    233.2    3.4    0.0000   0.0000          ?        ?   544.0204  15.9630          ?        ?      233.2        3.4       ?       ? 
1 1 1   29    2   43 o    469.8    2.5    0.0000   0.0000          ?        ?  2207.3694  23.6253          ?        ?      469.8        2.5       ?       ? 
1 1 1   29    2   44 o    416.3    2.6    0.0000   0.0000          ?        ?  1733.5862  21.7097          ?        ?      416.3        2.6       ?       ? 
1 1 1   29    2   45 o    350.4    2.7    0.0000   0.0000          ?        ?  1227.8771  19.1556          ?        ?      350.4        2.7       ?       ? 
1 1 1   29    2   46 o    522.6    2.6    0.0000   0.0000          ?        ?  2731.5955  26.8179          ?        ?      522.6        2.6       ?       ? 
1 1 1   29    2   47 o    219.8    3.9    0.0000   0.0000          ?        ?   483.3608  17.2401          ?        ?      219.8        3.9       ?       ? 
1 1 1   29    2   48 o    188.4    4.2    0.0000   0.0000          ?        ?   355.0180  15.9630          ?        ?      188.4        4.2       ?       ? 
1 1 1   29    2   49 o    303.7    2.9    0.0000   0.0000          ?        ?   922.6638  17.8786          ?        ?      303.7        2.9       ?       ? 
1 1 1   29    2   50 o    265.4    3.5    0.0000   0.0000          ?        ?   704.9279  18.5171          ?        ?      265.4        3.5       ?       ? 
1 1 1   29    2   51 o    174.1    5.1    0.0000   0.0000          ?        ?   303.2978  17.8786          ?        ?      174.1        5.1       ?       ? 
1 1 1   29    2   52 o     98.4    8.8    0.0000   0.0000          ?        ?    97.0553  17.2401          ?        ?       98.4        8.8       ?       ? 
1 1 1   29    2   53 o    120.5    7.4    0.0000   0.0000          ?        ?   145.5829  17.8786          ?        ?      120.5        7.4       ?       ? 
1 1 1   29    2   54 f    359.7    2.9    0.0000   0.0000          ?        ?  1294.2833  21.0712          ?        ?      359.7        2.9       ?       ? 
1 1 1   29    2   55 o    340.3    3.1    0.0000   0.0000          ?        ?  1158.9167  21.0712          ?        ?      340.3        3.1       ?       ? 
1 1 1   29    2   56 o    345.3    3.0    0.0000   0.0000          ?        ?  1192.7584  20.4327          ?        ?      345.3        3.0       ?       ? 
1 1 1   29    2   57 o     61.3   14.7    0.0000   0.0000          ?        ?    39.5883  17.8786          ?        ?       61.3       14.7       ?       ? 
1 1 1   29    2   58 o    332.6    3.2    0.0000   0.0000          ?        ?  1106.5580  21.0712          ?        ?      332.6        3.2       ?       ? 
1 1 1   29    2   59 o    214.7    4.6    0.0000   0.0000          ?        ?   461.6512  19.7942          ?        ?      214.7        4.6       ?       ? 
1 1 1   29    2   60 o    481.0    2.7    0.0000   0.0000          ?        ?  2314.6409  25.5409          ?        ?      481.0        2.7       ?       ? 
1 1 1   29    2   61 o     55.4   15.9    0.0000   0.0000          ?        ?    31.9261  18.5171          ?        ?       55.4       15.9       ?       ? 
1 1 1   29    2   62 o     57.8   16.0    0.0000   0.0000          ?        ?    35.1187  19.1556          ?        ?       57.8       16.0       ?       ? 
1 1 1   29    2   63 o     23.3   11.5    0.0000   0.0000          ?        ?   -41.5039  19.1556          ?        ?       23.3       11.5       ?       ? 
1 1 1   29    2   64 f    136.5    7.5    0.0000   0.0000          ?        ?   187.0868  20.4327          ?        ?      136.5        7.5       ?       ? 
1 1 1   29    2   65 o     31.8   14.5    0.0000   0.0000          ?        ?   -12.7704  20.4327          ?        ?       31.8       14.5       ?       ? 
1 1 1   29    2   66 o    154.8    6.8    0.0000   0.0000          ?        ?   240.7227  21.0712          ?        ?      154.8        6.8       ?       ? 
1 1 1   29    2   67 o    229.8    4.7    0.0000   0.0000          ?        ?   529.3344  21.7097          ?        ?      229.8        4.7       ?       ? 
1 1 1   29    2   68 o    165.0    7.0    0.0000   0.0000          ?        ?   273.9258  22.9868          ?        ?      165.0        7.0       ?       ? 
1 1 1   29    2   69 o     49.9   17.3    0.0000   0.0000          ?        ?    23.6253  21.0712          ?        ?       49.9       17.3       ?       ? 
1 1 1   29    2   70 o    237.8    4.7    0.0000   0.0000          ?        ?   567.0072  22.3483          ?        ?      237.8        4.7       ?       ? 
1 1 1   29    2   71 o     54.5   17.6    0.0000   0.0000          ?        ?    30.6490  21.7097          ?        ?       54.5       17.6       ?       ? 
1 1 1   29    2   72 o     54.2   17.3    0.0000   0.0000          ?        ?    30.6490  21.0712          ?        ?       54.2       17.3       ?       ? 
1 1 1   29    2   73 o     59.5   17.9    0.0000   0.0000          ?        ?    38.3113  22.9868          ?        ?       59.5       17.9       ?       ? 
1 1 1   29    3    0 o    672.0    3.9 4516.2632  52.3588  4516.2632  52.3588  4516.2632  52.3588      672.0      3.9      672.0        3.9     0.0     0.0 
1 1 1   29    3    1 o   1059.5    3.8    0.0000   0.0000          ?        ? 11225.2100  79.8152          ?        ?     1059.5        3.8       ?       ? 
1 1 1   29    3    2 o    638.6    2.7    0.0000   0.0000          ?        ?  4078.2378  35.1187          ?        ?      638.6        2.7       ?       ? 
1 1 1   29    3    3 o   1550.9    5.2    0.0000   0.0000          ?        ? 24053.7480 162.8230          ?        ?     1550.9        5.2       ?       ? 
1 1 1   29    3    4 o    433.2    2.3    0.0000   0.0000          ?        ?  1876.6150  19.7942          ?        ?      433.2        2.3       ?       ? 
1 1 1   29    3    5 o   1070.2    3.8    0.0000   0.0000          ?        ? 11453.1621  81.0922          ?        ?     1070.2        3.8       ?       ? 
1 1 1   29    3    6 o   1027.0    3.6    0.0000   0.0000          ?        ? 10547.1006  74.7070          ?        ?     1027.0        3.6       ?       ? 
1 1 1   29    3    7 o     19.9    9.7    0.0000   0.0000          ?        ?   -24.2638  12.7704          ?        ?       19.9        9.7       ?       ? 
1 1 1   29    3    8 f    207.3    2.5    0.0000   0.0000          ?        ?   429.7251  10.2163          ?        ?      207.3        2.5       ?       ? 
1 1 1   29    3    9 o    436.3    2.2    0.0000   0.0000          ?        ?  1903.4330  19.1556          ?        ?      436.3        2.2       ?       ? 
1 1 1   29    3   10 o    227.1    2.4    0.0000   0.0000          ?        ?   515.9255  10.8549          ?        ?      227.1        2.4       ?       ? 
1 1 1   29    3   11 o    499.8    2.3    0.0000   0.0000          ?        ?  2497.8967  22.9868          ?        ?      499.8        2.3       ?       ? 
1 1 1   29    3   12 o   1703.1    5.7    0.0000   0.0000          ?        ? 29009.3164 193.4720          ?        ?     1703.1        5.7       ?       ? 
1 1 1   29    3   13 o    112.4    4.3    0.0000   0.0000          ?        ?   126.4273   9.5778          ?        ?      112.4        4.3       ?       ? 
1 1 1   29    3   14 o    388.6    2.3    0.0000   0.0000          ?        ?  1510.1036  17.8786          ?        ?      388.6        2.3       ?       ? 
1 1 1   29    3   15 o    600.1    2.5    0.0000   0.0000          ?        ?  3601.2620  30.0105          ?        ?      600.1        2.5       ?       ? 
1 1 1   29    3   16 o    528.7    2.4    0.0000   0.0000          ?        ?  2794.8093  24.9023          ?        ?      528.7        2.4       ?       ? 
1 1 1   29    3   17 o    201.7    2.8    0.0000   0.0000          ?        ?   406.7383  11.4934          ?        ?      201.7        2.8       ?       ? 
1 1 1   29    3   18 o   1209.0    4.3    0.0000   0.0000          ?        ? 14618.3135 103.4405          ?        ?     1209.0        4.3       ?       ? 
1 1 1   29    3   19 o    922.2    3.5    0.0000   0.0000          ?        ?  8505.7461  65.1292          ?        ?      922.2        3.5       ?       ? 
1 1 1   29    3   20 o    600.8    2.8    0.0000   0.0000          ?        ?  3609.5627  33.8416          ?        ?      600.8        2.8       ?       ? 
1 1 1   29    3   21 o    344.4    2.4    0.0000   0.0000          ?        ?  1186.3732  16.6016          ?        ?      344.4        2.4       ?       ? 
1 1 1   29    3   22 o   1507.4    5.5    0.0000   0.0000          ?        ? 22726.9004 166.6541          ?        ?     1507.4        5.5       ?       ? 
1 1 1   29    3   23 o    384.4    2.7    0.0000   0.0000          ?        ?  1477.5391  21.0712          ?        ?      384.4        2.7       ?       ? 
1 1 1   29    3   24 o   1062.9    4.1    0.0000   0.0000          ?        ? 11299.2783  87.4775          ?        ?     1062.9        4.1       ?       ? 
1 1 1   29    3   25 o   1120.1    4.2    0.0000   0.0000          ?        ? 12546.9502  94.5012          ?        ?     1120.1        4.2       ?       ? 
1 1 1   29    3   26 o    470.3    2.8    0.0000   0.0000          ?        ?  2211.8389  26.1794          ?        ?      470.3        2.8       ?       ? 
1 1 1   29    3   27 o    681.7    3.3    0.0000   0.0000          ?        ?  4647.7993  45.3350          ?        ?      681.7        3.3       ?       ? 
1 1 1   29    3   28 o    402.8    2.7    0.0000   0.0000          ?        ?  1622.4835  21.7097          ?        ?      402.8        2.7       ?       ? 
1 1 1   29    3   29 o    535.6    2.8    0.0000   0.0000          ?        ?  2868.8777  30.0105          ?        ?      535.6        2.8       ?       ? 
1 1 1   29    3   30 o    805.0    3.4    0.0000   0.0000          ?        ?  6480.9946  54.9129          ?        ?      805.0        3.4       ?       ? 
1 1 1   29    3   31 o    216.0    4.1    0.0000   0.0000          ?        ?   466.7593  17.8786          ?        ?      216.0        4.1       ?       ? 
1 1 1   29    3   32 o    514.1    2.7    0.0000   0.0000          ?        ?  2643.4795  28.0950          ?        ?      514.1        2.7       ?       ? 
1 1 1   29    3   33 o    964.0    3.8    0.0000   0.0000          ?        ?  9293.6826  72.7915          ?        ?      964.0        3.8       ?       ? 
1 1 1   29    3   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    3   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    3   36 o    606.4    2.8    0.0000   0.0000          ?        ?  3677.2461  34.4802          ?        ?      606.4        2.8       ?       ? 
1 1 1   29    3   37 f    574.6    2.7    0.0000   0.0000          ?        ?  3301.7952  31.2876          ?        ?      574.6        2.7       ?       ? 
1 1 1   29    3   38 o    234.7    3.8    0.0000   0.0000          ?        ?   551.0442  17.8786          ?        ?      234.7        3.8       ?       ? 
1 1 1   29    3   39 o    346.3    2.9    0.0000   0.0000          ?        ?  1199.1437  19.7942          ?        ?      346.3        2.9       ?       ? 
1 1 1   29    3   40 o    768.7    3.2    0.0000   0.0000          ?        ?  5910.1562  49.1662          ?        ?      768.7        3.2       ?       ? 
1 1 1   29    3   41 o    352.6    2.7    0.0000   0.0000          ?        ?  1243.2015  19.1556          ?        ?      352.6        2.7       ?       ? 
1 1 1   29    3   42 o    365.6    3.0    0.0000   0.0000          ?        ?  1337.0642  21.7097          ?        ?      365.6        3.0       ?       ? 
1 1 1   29    3   43 o    284.8    3.3    0.0000   0.0000          ?        ?   811.5610  18.5171          ?        ?      284.8        3.3       ?       ? 
1 1 1   29    3   44 o    368.2    2.8    0.0000   0.0000          ?        ?  1356.2198  20.4327          ?        ?      368.2        2.8       ?       ? 
1 1 1   29    3   45 o     99.1    8.1    0.0000   0.0000          ?        ?    98.3323  15.9630          ?        ?       99.1        8.1       ?       ? 
1 1 1   29    3   46 o    251.8    3.6    0.0000   0.0000          ?        ?   634.0520  17.8786          ?        ?      251.8        3.6       ?       ? 
1 1 1   29    3   47 o     26.9   12.6    0.0000   0.0000          ?        ?   -15.9630  16.6016          ?        ?       26.9       12.6       ?       ? 
1 1 1   29    3   48 o    253.0    3.5    0.0000   0.0000          ?        ?   640.4372  17.8786          ?        ?      253.0        3.5       ?       ? 
1 1 1   29    3   49 o    203.8    4.5    0.0000   0.0000          ?        ?   415.6776  18.5171          ?        ?      203.8        4.5       ?       ? 
1 1 1   29    3   50 o    262.9    3.4    0.0000   0.0000          ?        ?   691.5189  17.8786          ?        ?      262.9        3.4       ?       ? 
1 1 1   29    3   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    3   52 o     38.3   15.3    0.0000   0.0000          ?        ?     7.0237  17.8786          ?        ?       38.3       15.3       ?       ? 
1 1 1   29    3   53 o    300.9    3.2    0.0000   0.0000          ?        ?   906.0621  19.1556          ?        ?      300.9        3.2       ?       ? 
1 1 1   29    3   54 o    231.1    4.0    0.0000   0.0000          ?        ?   534.4426  18.5171          ?        ?      231.1        4.0       ?       ? 
1 1 1   29    3   55 o     83.9   10.6    0.0000   0.0000          ?        ?    70.8759  17.8786          ?        ?       83.9       10.6       ?       ? 
1 1 1   29    3   56 o    294.2    3.5    0.0000   0.0000          ?        ?   865.8354  20.4327          ?        ?      294.2        3.5       ?       ? 
1 1 1   29    3   57 o    296.8    3.5    0.0000   0.0000          ?        ?   881.7984  21.0712          ?        ?      296.8        3.5       ?       ? 
1 1 1   29    3   58 o    233.9    4.2    0.0000   0.0000          ?        ?   547.8516  19.7942          ?        ?      233.9        4.2       ?       ? 
1 1 1   29    3   59 o    262.7    4.1    0.0000   0.0000          ?        ?   690.8804  21.7097          ?        ?      262.7        4.1       ?       ? 
1 1 1   29    3   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    3   61 f    289.0    3.8    0.0000   0.0000          ?        ?   835.8248  21.7097          ?        ?      289.0        3.8       ?       ? 
1 1 1   29    3   62 o     23.2   11.5    0.0000   0.0000          ?        ?   -45.3350  19.7942          ?        ?       23.2       11.5       ?       ? 
1 1 1   29    3   63 o     87.5   10.9    0.0000   0.0000          ?        ?    77.2611  19.1556          ?        ?       87.5       10.9       ?       ? 
1 1 1   29    3   64 o     93.1   10.6    0.0000   0.0000          ?        ?    87.4775  19.7942          ?        ?       93.1       10.6       ?       ? 
1 1 1   29    3   65 f    416.4    3.0    0.0000   0.0000          ?        ?  1735.5017  24.9023          ?        ?      416.4        3.0       ?       ? 
1 1 1   29    3   66 o    267.0    3.8    0.0000   0.0000          ?        ?   713.8672  20.4327          ?        ?      267.0        3.8       ?       ? 
1 1 1   29    3   67 o     26.1   12.6    0.0000   0.0000          ?        ?   -33.2031  20.4327          ?        ?       26.1       12.6       ?       ? 
1 1 1   29    3   68 o    161.0    6.3    0.0000   0.0000          ?        ?   260.5168  20.4327          ?        ?      161.0        6.3       ?       ? 
1 1 1   29    3   69 o    157.2    6.5    0.0000   0.0000          ?        ?   248.3849  20.4327          ?        ?      157.2        6.5       ?       ? 
1 1 1   29    3   70 o    151.5    6.7    0.0000   0.0000          ?        ?   231.1448  20.4327          ?        ?      151.5        6.7       ?       ? 
1 1 1   29    3   71 o    113.6    9.3    0.0000   0.0000          ?        ?   130.8969  21.0712          ?        ?      113.6        9.3       ?       ? 
1 1 1   29    3   72 o     36.3   15.6    0.0000   0.0000          ?        ?     0.0000  20.4327          ?        ?       36.3       15.6       ?       ? 
1 1 1   29    3   73 o     27.5   13.0    0.0000   0.0000          ?        ?   -21.7097  19.1556          ?        ?       27.5       13.0       ?       ? 
1 1 1   29    4    0 o   2462.2   11.3 60642.9570 558.7064 60642.9570 558.7064 60642.9570 558.7064     2462.2     11.3     2462.2       11.3     0.0     0.0 
1 1 1   29    4    1 o    504.8    2.5    0.0000   0.0000          ?        ?  2548.3398  25.5409          ?        ?      504.8        2.5       ?       ? 
1 1 1   29    4    2 o    372.9    2.1    0.0000   0.0000          ?        ?  1390.7001  15.3245          ?        ?      372.9        2.1       ?       ? 
1 1 1   29    4    3 o    506.1    2.4    0.0000   0.0000          ?        ?  2561.7488  24.2638          ?        ?      506.1        2.4       ?       ? 
1 1 1   29    4    4 o   1608.2    5.4    0.0000   0.0000          ?        ? 25864.5957 172.4008          ?        ?     1608.2        5.4       ?       ? 
1 1 1   29    4    5 o   1679.8    5.6    0.0000   0.0000          ?        ? 28220.1016 188.3639          ?        ?     1679.8        5.6       ?       ? 
1 1 1   29    4    6 o    888.7    3.3    0.0000   0.0000          ?        ?  7897.8740  58.7440          ?        ?      888.7        3.3       ?       ? 
1 1 1   29    4    7 o    855.5    3.2    0.0000   0.0000          ?        ?  7318.7344  54.9129          ?        ?      855.5        3.2       ?       ? 
1 1 1   29    4    8 o     54.2    8.2    0.0000   0.0000          ?        ?    29.3720   8.9393          ?        ?       54.2        8.2       ?       ? 
1 1 1   29    4    9 o     13.1    6.7    0.0000   0.0000          ?        ?   -32.5646   8.9393          ?        ?       13.1        6.7       ?       ? 
1 1 1   29    4   10 o   1357.5    4.7    0.0000   0.0000          ?        ? 18428.3730 128.3428          ?        ?     1357.5        4.7       ?       ? 
1 1 1   29    4   11 o   1057.8    3.8    0.0000   0.0000          ?        ? 11190.7295  81.0922          ?        ?     1057.8        3.8       ?       ? 
1 1 1   29    4   12 o    789.0    3.1    0.0000   0.0000          ?        ?  6225.5859  49.1662          ?        ?      789.0        3.1       ?       ? 
1 1 1   29    4   13 o   1105.6    4.0    0.0000   0.0000          ?        ? 12223.8584  87.4775          ?        ?     1105.6        4.0       ?       ? 
1 1 1   29    4   14 o   1452.5    5.0    0.0000   0.0000          ?        ? 21098.6699 144.9444          ?        ?     1452.5        5.0       ?       ? 
1 1 1   29    4   15 o    652.7    2.7    0.0000   0.0000          ?        ?  4260.2163  35.7572          ?        ?      652.7        2.7       ?       ? 
1 1 1   29    4   16 o   1159.4    4.2    0.0000   0.0000          ?        ? 13443.4336  98.3323          ?        ?     1159.4        4.2       ?       ? 
1 1 1   29    4   17 o   1340.8    4.8    0.0000   0.0000          ?        ? 17978.8535 128.3428          ?        ?     1340.8        4.8       ?       ? 
1 1 1   29    4   18 o    586.4    2.8    0.0000   0.0000          ?        ?  3439.0774  33.2031          ?        ?      586.4        2.8       ?       ? 
1 1 1   29    4   19 o    879.8    3.3    0.0000   0.0000          ?        ?  7741.4365  58.1055          ?        ?      879.8        3.3       ?       ? 
1 1 1   29    4   20 o    778.6    3.0    0.0000   0.0000          ?        ?  6062.1245  47.2506          ?        ?      778.6        3.0       ?       ? 
1 1 1   29    4   21 o    806.3    3.2    0.0000   0.0000          ?        ?  6502.0654  51.7203          ?        ?      806.3        3.2       ?       ? 
1 1 1   29    4   22 o   1012.0    3.9    0.0000   0.0000          ?        ? 10241.8867  79.1767          ?        ?     1012.0        3.9       ?       ? 
1 1 1   29    4   23 o    721.1    3.0    0.0000   0.0000          ?        ?  5200.1201  43.4195          ?        ?      721.1        3.0       ?       ? 
1 1 1   29    4   24 o   1607.8    5.9    0.0000   0.0000          ?        ? 25855.6562 189.0024          ?        ?     1607.8        5.9       ?       ? 
1 1 1   29    4   25 o    997.0    3.8    0.0000   0.0000          ?        ?  9940.5049  76.6226          ?        ?      997.0        3.8       ?       ? 
1 1 1   29    4   26 o    635.6    3.0    0.0000   0.0000          ?        ?  4040.5647  38.3113          ?        ?      635.6        3.0       ?       ? 
1 1 1   29    4   27 o    772.7    3.2    0.0000   0.0000          ?        ?  5970.8154  49.1662          ?        ?      772.7        3.2       ?       ? 
1 1 1   29    4   28 o    609.8    3.2    0.0000   0.0000          ?        ?  3719.3884  39.5883          ?        ?      609.8        3.2       ?       ? 
1 1 1   29    4   29 o    712.7    2.9    0.0000   0.0000          ?        ?  5080.0781  41.5039          ?        ?      712.7        2.9       ?       ? 
1 1 1   29    4   30 o    339.0    2.8    0.0000   0.0000          ?        ?  1149.3389  19.1556          ?        ?      339.0        2.8       ?       ? 
1 1 1   29    4   31 o    741.2    3.1    0.0000   0.0000          ?        ?  5494.4785  46.6121          ?        ?      741.2        3.1       ?       ? 
1 1 1   29    4   32 f    785.9    3.3    0.0000   0.0000          ?        ?  6176.4194  51.0817          ?        ?      785.9        3.3       ?       ? 
1 1 1   29    4   33 o    564.6    2.7    0.0000   0.0000          ?        ?  3188.1384  30.0105          ?        ?      564.6        2.7       ?       ? 
1 1 1   29    4   34 o    511.9    2.6    0.0000   0.0000          ?        ?  2620.4927  26.8179          ?        ?      511.9        2.6       ?       ? 
1 1 1   29    4   35 o    355.6    2.8    0.0000   0.0000          ?        ?  1264.9114  19.7942          ?        ?      355.6        2.8       ?       ? 
1 1 1   29    4   36 o    859.3    3.4    0.0000   0.0000          ?        ?  7384.5024  58.1055          ?        ?      859.3        3.4       ?       ? 
1 1 1   29    4   37 o    660.0    2.9    0.0000   0.0000          ?        ?  4355.9946  38.3113          ?        ?      660.0        2.9       ?       ? 
1 1 1   29    4   38 o    439.5    2.5    0.0000   0.0000          ?        ?  1931.5280  22.3483          ?        ?      439.5        2.5       ?       ? 
1 1 1   29    4   39 o    354.4    2.7    0.0000   0.0000          ?        ?  1255.9720  19.1556          ?        ?      354.4        2.7       ?       ? 
1 1 1   29    4   40 o    188.2    4.2    0.0000   0.0000          ?        ?   354.3795  15.9630          ?        ?      188.2        4.2       ?       ? 
1 1 1   29    4   41 o    342.5    2.7    0.0000   0.0000          ?        ?  1172.9642  18.5171          ?        ?      342.5        2.7       ?       ? 
1 1 1   29    4   42 o    192.7    4.1    0.0000   0.0000          ?        ?   371.6196  15.9630          ?        ?      192.7        4.1       ?       ? 
1 1 1   29    4   43 o    382.7    2.6    0.0000   0.0000          ?        ?  1464.7686  19.7942          ?        ?      382.7        2.6       ?       ? 
1 1 1   29    4   44 o    297.2    3.0    0.0000   0.0000          ?        ?   883.7139  17.8786          ?        ?      297.2        3.0       ?       ? 
1 1 1   29    4   45 o    469.4    2.6    0.0000   0.0000          ?        ?  2203.5381  24.2638          ?        ?      469.4        2.6       ?       ? 
1 1 1   29    4   46 o    284.4    3.1    0.0000   0.0000          ?        ?   809.0069  17.8786          ?        ?      284.4        3.1       ?       ? 
1 1 1   29    4   47 f    121.9    6.5    0.0000   0.0000          ?        ?   148.7755  15.9630          ?        ?      121.9        6.5       ?       ? 
1 1 1   29    4   48 o    211.7    3.9    0.0000   0.0000          ?        ?   448.2422  16.6016          ?        ?      211.7        3.9       ?       ? 
1 1 1   29    4   49 o    314.7    3.0    0.0000   0.0000          ?        ?   990.9855  19.1556          ?        ?      314.7        3.0       ?       ? 
1 1 1   29    4   50 o    467.2    2.7    0.0000   0.0000          ?        ?  2183.1055  24.9023          ?        ?      467.2        2.7       ?       ? 
1 1 1   29    4   51 f    239.3    3.9    0.0000   0.0000          ?        ?   572.7539  18.5171          ?        ?      239.3        3.9       ?       ? 
1 1 1   29    4   52 o    304.4    3.0    0.0000   0.0000          ?        ?   927.1334  18.5171          ?        ?      304.4        3.0       ?       ? 
1 1 1   29    4   53 o    144.8    6.0    0.0000   0.0000          ?        ?   210.0736  17.2401          ?        ?      144.8        6.0       ?       ? 
1 1 1   29    4   54 o    334.2    3.0    0.0000   0.0000          ?        ?  1117.4128  19.7942          ?        ?      334.2        3.0       ?       ? 
1 1 1   29    4   55 o     54.9   15.6    0.0000   0.0000          ?        ?    31.2876  17.8786          ?        ?       54.9       15.6       ?       ? 
1 1 1   29    4   56 o     69.8   14.2    0.0000   0.0000          ?        ?    51.0817  19.1556          ?        ?       69.8       14.2       ?       ? 
1 1 1   29    4   57 o    121.8    7.6    0.0000   0.0000          ?        ?   148.7755  18.5171          ?        ?      121.8        7.6       ?       ? 
1 1 1   29    4   58 o    345.7    3.2    0.0000   0.0000          ?        ?  1195.9510  22.3483          ?        ?      345.7        3.2       ?       ? 
1 1 1   29    4   59 o    102.4    9.4    0.0000   0.0000          ?        ?   105.3561  19.1556          ?        ?      102.4        9.4       ?       ? 
1 1 1   29    4   60 f    193.3    4.8    0.0000   0.0000          ?        ?   374.1737  18.5171          ?        ?      193.3        4.8       ?       ? 
1 1 1   29    4   61 o     65.5   14.9    0.0000   0.0000          ?        ?    45.3350  19.1556          ?        ?       65.5       14.9       ?       ? 
1 1 1   29    4   62 o    171.9    5.8    0.0000   0.0000          ?        ?   296.2740  19.7942          ?        ?      171.9        5.8       ?       ? 
1 1 1   29    4   63 o    337.6    3.3    0.0000   0.0000          ?        ?  1141.0381  22.3483          ?        ?      337.6        3.3       ?       ? 
1 1 1   29    4   64 o    102.2    9.7    0.0000   0.0000          ?        ?   105.3561  19.7942          ?        ?      102.2        9.7       ?       ? 
1 1 1   29    4   65 f    112.0    8.8    0.0000   0.0000          ?        ?   126.4273  19.7942          ?        ?      112.0        8.8       ?       ? 
1 1 1   29    4   66 o    104.3    9.8    0.0000   0.0000          ?        ?   109.8257  20.4327          ?        ?      104.3        9.8       ?       ? 
1 1 1   29    4   67 o    160.6    6.4    0.0000   0.0000          ?        ?   259.2398  20.4327          ?        ?      160.6        6.4       ?       ? 
1 1 1   29    4   68 o     38.7   16.1    0.0000   0.0000          ?        ?     4.4697  20.4327          ?        ?       38.7       16.1       ?       ? 
1 1 1   29    4   69 o    305.6    3.7    0.0000   0.0000          ?        ?   935.4342  22.3483          ?        ?      305.6        3.7       ?       ? 
1 1 1   29    4   70 o    107.1    9.5    0.0000   0.0000          ?        ?   116.2109  20.4327          ?        ?      107.1        9.5       ?       ? 
1 1 1   29    4   71 o     94.6   10.8    0.0000   0.0000          ?        ?    91.3086  20.4327          ?        ?       94.6       10.8       ?       ? 
1 1 1   29    4   72 o     64.6   15.9    0.0000   0.0000          ?        ?    45.3350  20.4327          ?        ?       64.6       15.9       ?       ? 
1 1 1   29    4   73 o     37.8   15.6    0.0000   0.0000          ?        ?     5.7467  19.1556          ?        ?       37.8       15.6       ?       ? 
1 1 1   29    5    0 o    217.6    4.0  473.7830  17.2401   473.7830  17.2401   473.7830  17.2401      217.6      4.0      217.6        4.0     0.0     0.0 
1 1 1   29    5    1 o    300.6    2.3    0.0000   0.0000          ?        ?   903.5081  14.0475          ?        ?      300.6        2.3       ?       ? 
1 1 1   29    5    2 f   1111.2    4.1    0.0000   0.0000          ?        ? 12347.7314  90.0316          ?        ?     1111.2        4.1       ?       ? 
1 1 1   29    5    3 o    737.0    2.9    0.0000   0.0000          ?        ?  5432.5420  43.4195          ?        ?      737.0        2.9       ?       ? 
1 1 1   29    5    4 f    605.2    2.6    0.0000   0.0000          ?        ?  3663.1987  31.9261          ?        ?      605.2        2.6       ?       ? 
1 1 1   29    5    5 o   1025.3    3.8    0.0000   0.0000          ?        ? 10512.6201  78.5382          ?        ?     1025.3        3.8       ?       ? 
1 1 1   29    5    6 o    970.7    3.7    0.0000   0.0000          ?        ?  9423.9404  72.7915          ?        ?      970.7        3.7       ?       ? 
1 1 1   29    5    7 o    437.8    2.4    0.0000   0.0000          ?        ?  1916.8420  21.0712          ?        ?      437.8        2.4       ?       ? 
1 1 1   29    5    8 o    164.5    3.1    0.0000   0.0000          ?        ?   270.7332  10.2163          ?        ?      164.5        3.1       ?       ? 
1 1 1   29    5    9 o    242.8    2.6    0.0000   0.0000          ?        ?   589.3555  12.7704          ?        ?      242.8        2.6       ?       ? 
1 1 1   29    5   10 o    474.6    2.4    0.0000   0.0000          ?        ?  2252.0659  22.3483          ?        ?      474.6        2.4       ?       ? 
1 1 1   29    5   11 o    485.7    2.2    0.0000   0.0000          ?        ?  2359.3374  21.7097          ?        ?      485.7        2.2       ?       ? 
1 1 1   29    5   12 o    916.6    3.5    0.0000   0.0000          ?        ?  8401.6680  64.4907          ?        ?      916.6        3.5       ?       ? 
1 1 1   29    5   13 o    549.7    2.5    0.0000   0.0000          ?        ?  3021.4844  27.4564          ?        ?      549.7        2.5       ?       ? 
1 1 1   29    5   14 o   1151.4    4.3    0.0000   0.0000          ?        ? 13257.6250  99.6094          ?        ?     1151.4        4.3       ?       ? 
1 1 1   29    5   15 o    429.0    2.3    0.0000   0.0000          ?        ?  1840.8578  19.7942          ?        ?      429.0        2.3       ?       ? 
1 1 1   29    5   16 o    276.0    2.8    0.0000   0.0000          ?        ?   761.7563  15.3245          ?        ?      276.0        2.8       ?       ? 
1 1 1   29    5   17 o    178.0    4.5    0.0000   0.0000          ?        ?   316.7067  15.9630          ?        ?      178.0        4.5       ?       ? 
1 1 1   29    5   18 o   1324.0    4.7    0.0000   0.0000          ?        ? 17531.2500 125.1502          ?        ?     1324.0        4.7       ?       ? 
1 1 1   29    5   19 o    796.4    3.2    0.0000   0.0000          ?        ?  6343.0742  50.4432          ?        ?      796.4        3.2       ?       ? 
1 1 1   29    5   20 o   1027.9    3.9    0.0000   0.0000          ?        ? 10565.6172  81.0922          ?        ?     1027.9        3.9       ?       ? 
1 1 1   29    5   21 o    333.1    2.6    0.0000   0.0000          ?        ?  1109.7506  17.2401          ?        ?      333.1        2.6       ?       ? 
1 1 1   29    5   22 o    288.4    3.0    0.0000   0.0000          ?        ?   831.9937  17.2401          ?        ?      288.4        3.0       ?       ? 
1 1 1   29    5   23 o    424.2    2.6    0.0000   0.0000          ?        ?  1799.3539  22.3483          ?        ?      424.2        2.6       ?       ? 
1 1 1   29    5   24 o   1617.9    5.8    0.0000   0.0000          ?        ? 26179.3867 187.7254          ?        ?     1617.9        5.8       ?       ? 
1 1 1   29    5   25 o    988.7    4.1    0.0000   0.0000          ?        ?  9775.7656  81.0922          ?        ?      988.7        4.1       ?       ? 
1 1 1   29    5   26 o    944.8    3.8    0.0000   0.0000          ?        ?  8927.8086  71.5144          ?        ?      944.8        3.8       ?       ? 
1 1 1   29    5   27 o   1549.7    5.2    0.0000   0.0000          ?        ? 24019.2676 162.1845          ?        ?     1549.7        5.2       ?       ? 
1 1 1   29    5   28 o    473.3    2.8    0.0000   0.0000          ?        ?  2239.9338  26.8179          ?        ?      473.3        2.8       ?       ? 
1 1 1   29    5   29 o    353.7    2.8    0.0000   0.0000          ?        ?  1250.8638  19.7942          ?        ?      353.7        2.8       ?       ? 
1 1 1   29    5   30 o    934.5    3.6    0.0000   0.0000          ?        ?  8733.6992  67.6833          ?        ?      934.5        3.6       ?       ? 
1 1 1   29    5   31 o    262.8    3.0    0.0000   0.0000          ?        ?   690.8804  15.9630          ?        ?      262.8        3.0       ?       ? 
1 1 1   29    5   32 o    833.1    3.4    0.0000   0.0000          ?        ?  6942.0068  56.8284          ?        ?      833.1        3.4       ?       ? 
1 1 1   29    5   33 o    396.6    2.7    0.0000   0.0000          ?        ?  1573.3173  21.0712          ?        ?      396.6        2.7       ?       ? 
1 1 1   29    5   34 o    509.9    2.6    0.0000   0.0000          ?        ?  2600.0601  26.8179          ?        ?      509.9        2.6       ?       ? 
1 1 1   29    5   35 o    236.5    3.6    0.0000   0.0000          ?        ?   559.3449  17.2401          ?        ?      236.5        3.6       ?       ? 
1 1 1   29    5   36 o    284.6    2.9    0.0000   0.0000          ?        ?   810.2839  16.6016          ?        ?      284.6        2.9       ?       ? 
1 1 1   29    5   37 o    647.9    2.9    0.0000   0.0000          ?        ?  4197.6411  37.6728          ?        ?      647.9        2.9       ?       ? 
1 1 1   29    5   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    5   39 o    424.6    2.6    0.0000   0.0000          ?        ?  1803.1851  21.7097          ?        ?      424.6        2.6       ?       ? 
1 1 1   29    5   40 o    232.5    3.6    0.0000   0.0000          ?        ?   540.8278  16.6016          ?        ?      232.5        3.6       ?       ? 
1 1 1   29    5   41 o    521.6    2.6    0.0000   0.0000          ?        ?  2721.3792  26.8179          ?        ?      521.6        2.6       ?       ? 
1 1 1   29    5   42 o    271.9    3.4    0.0000   0.0000          ?        ?   739.4081  18.5171          ?        ?      271.9        3.4       ?       ? 
1 1 1   29    5   43 o     93.8    8.5    0.0000   0.0000          ?        ?    88.1160  15.9630          ?        ?       93.8        8.5       ?       ? 
1 1 1   29    5   44 o    321.7    2.9    0.0000   0.0000          ?        ?  1035.0436  18.5171          ?        ?      321.7        2.9       ?       ? 
1 1 1   29    5   45 o    271.2    3.1    0.0000   0.0000          ?        ?   735.5769  16.6016          ?        ?      271.2        3.1       ?       ? 
1 1 1   29    5   46 o    305.3    2.9    0.0000   0.0000          ?        ?   932.2416  17.8786          ?        ?      305.3        2.9       ?       ? 
1 1 1   29    5   47 o    465.3    2.6    0.0000   0.0000          ?        ?  2165.8655  24.2638          ?        ?      465.3        2.6       ?       ? 
1 1 1   29    5   48 o    320.0    2.8    0.0000   0.0000          ?        ?  1024.1886  17.8786          ?        ?      320.0        2.8       ?       ? 
1 1 1   29    5   49 o    179.9    4.4    0.0000   0.0000          ?        ?   323.7305  15.9630          ?        ?      179.9        4.4       ?       ? 
1 1 1   29    5   50 o    496.3    2.6    0.0000   0.0000          ?        ?  2463.4163  26.1794          ?        ?      496.3        2.6       ?       ? 
1 1 1   29    5   51 o    301.6    3.3    0.0000   0.0000          ?        ?   909.8933  19.7942          ?        ?      301.6        3.3       ?       ? 
1 1 1   29    5   52 o    379.4    2.8    0.0000   0.0000          ?        ?  1439.8662  21.0712          ?        ?      379.4        2.8       ?       ? 
1 1 1   29    5   53 o    183.3    5.1    0.0000   0.0000          ?        ?   336.5009  18.5171          ?        ?      183.3        5.1       ?       ? 
1 1 1   29    5   54 o    450.1    2.8    0.0000   0.0000          ?        ?  2026.6676  24.9023          ?        ?      450.1        2.8       ?       ? 
1 1 1   29    5   55 o     90.1   10.3    0.0000   0.0000          ?        ?    81.7308  18.5171          ?        ?       90.1       10.3       ?       ? 
1 1 1   29    5   56 o     57.4   15.7    0.0000   0.0000          ?        ?    34.4802  18.5171          ?        ?       57.4       15.7       ?       ? 
1 1 1   29    5   57 o    234.9    4.1    0.0000   0.0000          ?        ?   552.3212  19.1556          ?        ?      234.9        4.1       ?       ? 
1 1 1   29    5   58 o    226.7    4.4    0.0000   0.0000          ?        ?   514.6484  19.7942          ?        ?      226.7        4.4       ?       ? 
1 1 1   29    5   59 o    273.7    4.0    0.0000   0.0000          ?        ?   749.6244  21.7097          ?        ?      273.7        4.0       ?       ? 
1 1 1   29    5   60 o     42.6   16.6    0.0000   0.0000          ?        ?    11.4934  20.4327          ?        ?       42.6       16.6       ?       ? 
1 1 1   29    5   61 o    328.6    3.3    0.0000   0.0000          ?        ?  1080.3785  21.7097          ?        ?      328.6        3.3       ?       ? 
1 1 1   29    5   62 o    144.9    6.8    0.0000   0.0000          ?        ?   210.7121  19.7942          ?        ?      144.9        6.8       ?       ? 
1 1 1   29    5   63 o     87.4   11.3    0.0000   0.0000          ?        ?    77.2611  19.7942          ?        ?       87.4       11.3       ?       ? 
1 1 1   29    5   64 o    146.6    6.5    0.0000   0.0000          ?        ?   215.8203  19.1556          ?        ?      146.6        6.5       ?       ? 
1 1 1   29    5   65 o    154.0    6.4    0.0000   0.0000          ?        ?   238.1686  19.7942          ?        ?      154.0        6.4       ?       ? 
1 1 1   29    5   66 o    159.6    6.8    0.0000   0.0000          ?        ?   256.0471  21.7097          ?        ?      159.6        6.8       ?       ? 
1 1 1   29    5   67 o     92.1   11.4    0.0000   0.0000          ?        ?    86.2004  21.0712          ?        ?       92.1       11.4       ?       ? 
1 1 1   29    5   68 o    130.3    8.1    0.0000   0.0000          ?        ?   171.1238  21.0712          ?        ?      130.3        8.1       ?       ? 
1 1 1   29    5   69 o     50.2   17.3    0.0000   0.0000          ?        ?    24.2638  21.0712          ?        ?       50.2       17.3       ?       ? 
1 1 1   29    5   70 o     26.9   13.0    0.0000   0.0000          ?        ?   -31.9261  21.0712          ?        ?       26.9       13.0       ?       ? 
1 1 1   29    5   71 o    156.8    6.5    0.0000   0.0000          ?        ?   247.7464  20.4327          ?        ?      156.8        6.5       ?       ? 
1 1 1   29    5   72 o     66.8   15.6    0.0000   0.0000          ?        ?    48.5276  20.4327          ?        ?       66.8       15.6       ?       ? 
1 1 1   29    6    0 o    679.3    4.0 4614.5957  54.2743  4614.5957  54.2743  4614.5957  54.2743      679.3      4.0      679.3        4.0     0.0     0.0 
1 1 1   29    6    1 o   1094.8    4.1    0.0000   0.0000          ?        ? 11987.6055  90.6701          ?        ?     1094.8        4.1       ?       ? 
1 1 1   29    6    2 o   1568.2    5.4    0.0000   0.0000          ?        ? 24593.9375 169.2082          ?        ?     1568.2        5.4       ?       ? 
1 1 1   29    6    3 o   1728.3    5.8    0.0000   0.0000          ?        ? 29873.8730 199.2188          ?        ?     1728.3        5.8       ?       ? 
1 1 1   29    6    4 o    915.0    3.5    0.0000   0.0000          ?        ?  8372.2949  63.8522          ?        ?      915.0        3.5       ?       ? 
1 1 1   29    6    5 o    830.5    3.3    0.0000   0.0000          ?        ?  6897.9492  55.5514          ?        ?      830.5        3.3       ?       ? 
1 1 1   29    6    6 o   1529.6    5.2    0.0000   0.0000          ?        ? 23400.5410 158.3534          ?        ?     1529.6        5.2       ?       ? 
1 1 1   29    6    7 o    339.6    2.3    0.0000   0.0000          ?        ?  1153.1700  15.3245          ?        ?      339.6        2.3       ?       ? 
1 1 1   29    6    8 o    261.9    2.3    0.0000   0.0000          ?        ?   685.7722  12.1319          ?        ?      261.9        2.3       ?       ? 
1 1 1   29    6    9 o    556.8    2.4    0.0000   0.0000          ?        ?  3100.6611  26.1794          ?        ?      556.8        2.4       ?       ? 
1 1 1   29    6   10 o    439.9    2.4    0.0000   0.0000          ?        ?  1935.3591  21.0712          ?        ?      439.9        2.4       ?       ? 
1 1 1   29    6   11 o   1082.1    3.8    0.0000   0.0000          ?        ? 11709.8486  82.3693          ?        ?     1082.1        3.8       ?       ? 
1 1 1   29    6   12 o    551.1    2.5    0.0000   0.0000          ?        ?  3037.4475  27.4564          ?        ?      551.1        2.5       ?       ? 
1 1 1   29    6   13 o   1812.5    6.0    0.0000   0.0000          ?        ? 32857.0430 217.7359          ?        ?     1812.5        6.0       ?       ? 
1 1 1   29    6   14 o    399.6    2.4    0.0000   0.0000          ?        ?  1596.9426  19.1556          ?        ?      399.6        2.4       ?       ? 
1 1 1   29    6   15 o   1118.4    3.9    0.0000   0.0000          ?        ? 12509.9150  88.1160          ?        ?     1118.4        3.9       ?       ? 
1 1 1   29    6   16 o    628.7    2.7    0.0000   0.0000          ?        ?  3953.0872  34.4802          ?        ?      628.7        2.7       ?       ? 
1 1 1   29    6   17 o   1567.9    5.8    0.0000   0.0000          ?        ? 24585.6367 180.7016          ?        ?     1567.9        5.8       ?       ? 
1 1 1   29    6   18 o   1383.8    4.9    0.0000   0.0000          ?        ? 19149.9023 136.0051          ?        ?     1383.8        4.9       ?       ? 
1 1 1   29    6   19 o    268.1    3.0    0.0000   0.0000          ?        ?   718.9753  15.9630          ?        ?      268.1        3.0       ?       ? 
1 1 1   29    6   20 o    876.4    3.8    0.0000   0.0000          ?        ?  7682.0537  65.7677          ?        ?      876.4        3.8       ?       ? 
1 1 1   29    6   21 o    962.1    3.7    0.0000   0.0000          ?        ?  9256.6475  72.1529          ?        ?      962.1        3.7       ?       ? 
1 1 1   29    6   22 f   1907.9    6.4    0.0000   0.0000          ?        ? 36409.7812 244.5538          ?        ?     1907.9        6.4       ?       ? 
1 1 1   29    6   23 o    756.1    3.3    0.0000   0.0000          ?        ?  5717.9609  49.8047          ?        ?      756.1        3.3       ?       ? 
1 1 1   29    6   24 o    914.3    3.5    0.0000   0.0000          ?        ?  8360.8027  64.4907          ?        ?      914.3        3.5       ?       ? 
1 1 1   29    6   25 o    524.9    2.9    0.0000   0.0000          ?        ?  2755.2207  30.0105          ?        ?      524.9        2.9       ?       ? 
1 1 1   29    6   26 o    701.7    2.8    0.0000   0.0000          ?        ?  4924.2788  39.5883          ?        ?      701.7        2.8       ?       ? 
1 1 1   29    6   27 o    370.0    2.7    0.0000   0.0000          ?        ?  1368.9904  19.7942          ?        ?      370.0        2.7       ?       ? 
1 1 1   29    6   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    6   29 o    194.6    3.8    0.0000   0.0000          ?        ?   378.6433  14.6860          ?        ?      194.6        3.8       ?       ? 
1 1 1   29    6   30 o    269.7    2.8    0.0000   0.0000          ?        ?   727.2761  15.3245          ?        ?      269.7        2.8       ?       ? 
1 1 1   29    6   31 o    609.4    2.7    0.0000   0.0000          ?        ?  3713.6416  33.2031          ?        ?      609.4        2.7       ?       ? 
1 1 1   29    6   32 o    402.3    2.6    0.0000   0.0000          ?        ?  1618.6523  21.0712          ?        ?      402.3        2.6       ?       ? 
1 1 1   29    6   33 o    457.4    2.6    0.0000   0.0000          ?        ?  2092.4355  23.6253          ?        ?      457.4        2.6       ?       ? 
1 1 1   29    6   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    6   35 o     91.8    8.4    0.0000   0.0000          ?        ?    84.2849  15.3245          ?        ?       91.8        8.4       ?       ? 
1 1 1   29    6   36 o    583.6    2.7    0.0000   0.0000          ?        ?  3405.8745  31.9261          ?        ?      583.6        2.7       ?       ? 
1 1 1   29    6   37 o   1147.8    4.1    0.0000   0.0000          ?        ? 13178.4473  95.1397          ?        ?     1147.8        4.1       ?       ? 
1 1 1   29    6   38 o    606.5    2.9    0.0000   0.0000          ?        ?  3678.5229  35.1187          ?        ?      606.5        2.9       ?       ? 
1 1 1   29    6   39 o    687.3    3.0    0.0000   0.0000          ?        ?  4725.0601  40.8654          ?        ?      687.3        3.0       ?       ? 
1 1 1   29    6   40 o    239.6    3.9    0.0000   0.0000          ?        ?   574.0309  18.5171          ?        ?      239.6        3.9       ?       ? 
1 1 1   29    6   41 o    436.5    2.6    0.0000   0.0000          ?        ?  1905.9871  22.3483          ?        ?      436.5        2.6       ?       ? 
1 1 1   29    6   42 o    365.2    2.6    0.0000   0.0000          ?        ?  1333.8716  19.1556          ?        ?      365.2        2.6       ?       ? 
1 1 1   29    6   43 o    269.8    3.1    0.0000   0.0000          ?        ?   727.9147  16.6016          ?        ?      269.8        3.1       ?       ? 
1 1 1   29    6   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    6   45 o    379.6    2.8    0.0000   0.0000          ?        ?  1441.1433  21.0712          ?        ?      379.6        2.8       ?       ? 
1 1 1   29    6   46 o    382.5    2.7    0.0000   0.0000          ?        ?  1463.4916  20.4327          ?        ?      382.5        2.7       ?       ? 
1 1 1   29    6   47 o     18.4    9.3    0.0000   0.0000          ?        ?   -51.7203  15.9630          ?        ?       18.4        9.3       ?       ? 
1 1 1   29    6   48 o     28.2   13.0    0.0000   0.0000          ?        ?   -14.0475  17.2401          ?        ?       28.2       13.0       ?       ? 
1 1 1   29    6   49 o     73.9   10.8    0.0000   0.0000          ?        ?    54.9129  15.9630          ?        ?       73.9       10.8       ?       ? 
1 1 1   29    6   50 f     88.1    9.4    0.0000   0.0000          ?        ?    77.8996  16.6016          ?        ?       88.1        9.4       ?       ? 
1 1 1   29    6   51 o    233.4    3.8    0.0000   0.0000          ?        ?   545.2975  17.8786          ?        ?      233.4        3.8       ?       ? 
1 1 1   29    6   52 o    311.3    3.0    0.0000   0.0000          ?        ?   969.2759  18.5171          ?        ?      311.3        3.0       ?       ? 
1 1 1   29    6   53 o    394.2    2.8    0.0000   0.0000          ?        ?  1554.1616  21.7097          ?        ?      394.2        2.8       ?       ? 
1 1 1   29    6   54 o    150.2    6.0    0.0000   0.0000          ?        ?   226.0367  17.8786          ?        ?      150.2        6.0       ?       ? 
1 1 1   29    6   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    6   56 o    221.6    4.2    0.0000   0.0000          ?        ?   491.6617  18.5171          ?        ?      221.6        4.2       ?       ? 
1 1 1   29    6   57 o    219.3    4.4    0.0000   0.0000          ?        ?   481.4453  19.1556          ?        ?      219.3        4.4       ?       ? 
1 1 1   29    6   58 o    124.9    7.4    0.0000   0.0000          ?        ?   156.4378  18.5171          ?        ?      124.9        7.4       ?       ? 
1 1 1   29    6   59 f    228.5    4.2    0.0000   0.0000          ?        ?   522.9492  19.1556          ?        ?      228.5        4.2       ?       ? 
1 1 1   29    6   60 o    278.3    3.6    0.0000   0.0000          ?        ?   775.1653  19.7942          ?        ?      278.3        3.6       ?       ? 
1 1 1   29    6   61 o     71.9   14.3    0.0000   0.0000          ?        ?    54.2743  19.7942          ?        ?       71.9       14.3       ?       ? 
1 1 1   29    6   62 o    146.2    7.0    0.0000   0.0000          ?        ?   214.5433  20.4327          ?        ?      146.2        7.0       ?       ? 
1 1 1   29    6   63 o     40.6   16.2    0.0000   0.0000          ?        ?     8.9393  19.7942          ?        ?       40.6       16.2       ?       ? 
1 1 1   29    6   64 o     50.2   16.5    0.0000   0.0000          ?        ?    24.9023  19.1556          ?        ?       50.2       16.5       ?       ? 
1 1 1   29    6   65 o    111.1    9.2    0.0000   0.0000          ?        ?   124.5117  20.4327          ?        ?      111.1        9.2       ?       ? 
1 1 1   29    6   66 o    195.6    5.2    0.0000   0.0000          ?        ?   383.7515  20.4327          ?        ?      195.6        5.2       ?       ? 
1 1 1   29    6   67 o    143.4    7.1    0.0000   0.0000          ?        ?   206.8810  20.4327          ?        ?      143.4        7.1       ?       ? 
1 1 1   29    6   68 o     87.9   11.3    0.0000   0.0000          ?        ?    78.5382  19.7942          ?        ?       87.9       11.3       ?       ? 
1 1 1   29    6   69 o     23.4   11.6    0.0000   0.0000          ?        ?   -47.2506  20.4327          ?        ?       23.4       11.6       ?       ? 
1 1 1   29    6   70 o     32.4   14.7    0.0000   0.0000          ?        ?   -10.2163  20.4327          ?        ?       32.4       14.7       ?       ? 
1 1 1   29    6   71 f    213.5    4.8    0.0000   0.0000          ?        ?   457.8200  20.4327          ?        ?      213.5        4.8       ?       ? 
1 1 1   29    6   72 o     20.5   10.3    0.0000   0.0000          ?        ?   -57.4669  19.1556          ?        ?       20.5       10.3       ?       ? 
1 1 1   29    7    0 o    986.9    5.1 9740.6475 100.8864  9740.6475 100.8864  9740.6475 100.8864      986.9      5.1      986.9        5.1     0.0     0.0 
1 1 1   29    7    1 o   1074.2    3.9    0.0000   0.0000          ?        ? 11539.3623  84.2849          ?        ?     1074.2        3.9       ?       ? 
1 1 1   29    7    2 o    502.9    2.3    0.0000   0.0000          ?        ?  2529.1841  23.6253          ?        ?      502.9        2.3       ?       ? 
1 1 1   29    7    3 o    962.1    3.5    0.0000   0.0000          ?        ?  9256.6475  67.0448          ?        ?      962.1        3.5       ?       ? 
1 1 1   29    7    4 o   1308.4    4.6    0.0000   0.0000          ?        ? 17121.3184 119.4035          ?        ?     1308.4        4.6       ?       ? 
1 1 1   29    7    5 o   1728.5    5.7    0.0000   0.0000          ?        ? 29882.8125 198.5802          ?        ?     1728.5        5.7       ?       ? 
1 1 1   29    7    6 f    979.8    3.6    0.0000   0.0000          ?        ?  9600.8105  71.5144          ?        ?      979.8        3.6       ?       ? 
1 1 1   29    7    7 o    455.3    2.3    0.0000   0.0000          ?        ?  2072.6414  21.0712          ?        ?      455.3        2.3       ?       ? 
1 1 1   29    7    8 o   1858.0    6.7    0.0000   0.0000          ?        ? 34527.4180 250.3005          ?        ?     1858.0        6.7       ?       ? 
1 1 1   29    7    9 o    492.1    2.5    0.0000   0.0000          ?        ?  2421.9124  24.2638          ?        ?      492.1        2.5       ?       ? 
1 1 1   29    7   10 o   1085.1    3.9    0.0000   0.0000          ?        ? 11775.6152  83.6463          ?        ?     1085.1        3.9       ?       ? 
1 1 1   29    7   11 o   1402.9    4.9    0.0000   0.0000          ?        ? 19682.4297 137.2822          ?        ?     1402.9        4.9       ?       ? 
1 1 1   29    7   12 o    452.0    2.3    0.0000   0.0000          ?        ?  2043.2692  21.0712          ?        ?      452.0        2.3       ?       ? 
1 1 1   29    7   13 f   1233.0    4.5    0.0000   0.0000          ?        ? 15203.2002 109.8257          ?        ?     1233.0        4.5       ?       ? 
1 1 1   29    7   14 o    905.7    3.5    0.0000   0.0000          ?        ?  8203.7266  63.8522          ?        ?      905.7        3.5       ?       ? 
1 1 1   29    7   15 o   1054.8    3.8    0.0000   0.0000          ?        ? 11126.8779  80.4537          ?        ?     1054.8        3.8       ?       ? 
1 1 1   29    7   16 o    118.8    5.6    0.0000   0.0000          ?        ?   141.1133  13.4090          ?        ?      118.8        5.6       ?       ? 
1 1 1   29    7   17 o   1378.4    4.9    0.0000   0.0000          ?        ? 19001.7637 134.7281          ?        ?     1378.4        4.9       ?       ? 
1 1 1   29    7   18 o   1412.4    5.1    0.0000   0.0000          ?        ? 19952.5234 144.9444          ?        ?     1412.4        5.1       ?       ? 
1 1 1   29    7   19 o    549.5    2.7    0.0000   0.0000          ?        ?  3019.5688  30.0105          ?        ?      549.5        2.7       ?       ? 
1 1 1   29    7   20 o    695.8    2.9    0.0000   0.0000          ?        ?  4841.2710  40.8654          ?        ?      695.8        2.9       ?       ? 
1 1 1   29    7   21 o   1290.0    4.7    0.0000   0.0000          ?        ? 16643.0664 121.9576          ?        ?     1290.0        4.7       ?       ? 
1 1 1   29    7   22 o   1363.8    4.9    0.0000   0.0000          ?        ? 18602.0508 132.8125          ?        ?     1363.8        4.9       ?       ? 
1 1 1   29    7   23 o    329.2    2.9    0.0000   0.0000          ?        ?  1083.5712  19.1556          ?        ?      329.2        2.9       ?       ? 
1 1 1   29    7   24 o    778.4    3.0    0.0000   0.0000          ?        ?  6059.5703  46.6121          ?        ?      778.4        3.0       ?       ? 
1 1 1   29    7   25 o   1124.5    4.5    0.0000   0.0000          ?        ? 12647.1973 100.8864          ?        ?     1124.5        4.5       ?       ? 
1 1 1   29    7   26 o    366.5    2.5    0.0000   0.0000          ?        ?  1343.4495  18.5171          ?        ?      366.5        2.5       ?       ? 
1 1 1   29    7   27 o    152.4    4.6    0.0000   0.0000          ?        ?   232.4219  14.0475          ?        ?      152.4        4.6       ?       ? 
1 1 1   29    7   28 o    467.0    2.6    0.0000   0.0000          ?        ?  2180.5513  24.2638          ?        ?      467.0        2.6       ?       ? 
1 1 1   29    7   29 o   1904.4    6.9    0.0000   0.0000          ?        ? 36282.7148 261.1554          ?        ?     1904.4        6.9       ?       ? 
1 1 1   29    7   30 o    113.8    7.3    0.0000   0.0000          ?        ?   129.6199  16.6016          ?        ?      113.8        7.3       ?       ? 
1 1 1   29    7   31 o    426.9    2.6    0.0000   0.0000          ?        ?  1822.9792  22.3483          ?        ?      426.9        2.6       ?       ? 
1 1 1   29    7   32 o    167.2    4.8    0.0000   0.0000          ?        ?   279.6725  15.9630          ?        ?      167.2        4.8       ?       ? 
1 1 1   29    7   33 o    354.2    2.7    0.0000   0.0000          ?        ?  1254.6949  19.1556          ?        ?      354.2        2.7       ?       ? 
1 1 1   29    7   34 o    612.3    2.8    0.0000   0.0000          ?        ?  3749.3992  33.8416          ?        ?      612.3        2.8       ?       ? 
1 1 1   29    7   35 o    309.5    3.2    0.0000   0.0000          ?        ?   957.7824  19.7942          ?        ?      309.5        3.2       ?       ? 
1 1 1   29    7   36 o    267.3    3.3    0.0000   0.0000          ?        ?   714.5057  17.8786          ?        ?      267.3        3.3       ?       ? 
1 1 1   29    7   37 o    221.6    3.6    0.0000   0.0000          ?        ?   491.0231  15.9630          ?        ?      221.6        3.6       ?       ? 
1 1 1   29    7   38 o    574.7    2.7    0.0000   0.0000          ?        ?  3303.0723  31.2876          ?        ?      574.7        2.7       ?       ? 
1 1 1   29    7   39 o    215.7    4.0    0.0000   0.0000          ?        ?   465.4823  17.2401          ?        ?      215.7        4.0       ?       ? 
1 1 1   29    7   40 o    523.2    2.7    0.0000   0.0000          ?        ?  2737.3423  28.0950          ?        ?      523.2        2.7       ?       ? 
1 1 1   29    7   41 o    647.1    2.9    0.0000   0.0000          ?        ?  4188.7017  37.0343          ?        ?      647.1        2.9       ?       ? 
1 1 1   29    7   42 o    539.1    2.6    0.0000   0.0000          ?        ?  2906.5505  28.0950          ?        ?      539.1        2.6       ?       ? 
1 1 1   29    7   43 o     99.4    7.7    0.0000   0.0000          ?        ?    98.9709  15.3245          ?        ?       99.4        7.7       ?       ? 
1 1 1   29    7   44 o    544.5    2.6    0.0000   0.0000          ?        ?  2965.9329  28.7335          ?        ?      544.5        2.6       ?       ? 
1 1 1   29    7   45 o    172.8    4.8    0.0000   0.0000          ?        ?   298.8281  16.6016          ?        ?      172.8        4.8       ?       ? 
1 1 1   29    7   46 o    161.1    4.8    0.0000   0.0000          ?        ?   259.8783  15.3245          ?        ?      161.1        4.8       ?       ? 
1 1 1   29    7   47 o    129.5    6.4    0.0000   0.0000          ?        ?   167.9312  16.6016          ?        ?      129.5        6.4       ?       ? 
1 1 1   29    7   48 o     23.2   11.2    0.0000   0.0000          ?        ?   -26.1794  15.9630          ?        ?       23.2       11.2       ?       ? 
1 1 1   29    7   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    7   50 o    246.1    3.6    0.0000   0.0000          ?        ?   605.9570  17.8786          ?        ?      246.1        3.6       ?       ? 
1 1 1   29    7   51 o    204.7    4.1    0.0000   0.0000          ?        ?   419.5087  16.6016          ?        ?      204.7        4.1       ?       ? 
1 1 1   29    7   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    7   53 o    165.6    5.2    0.0000   0.0000          ?        ?   274.5643  17.2401          ?        ?      165.6        5.2       ?       ? 
1 1 1   29    7   54 o    474.3    2.8    0.0000   0.0000          ?        ?  2250.7888  26.1794          ?        ?      474.3        2.8       ?       ? 
1 1 1   29    7   55 o     32.1   14.3    0.0000   0.0000          ?        ?    -7.0237  18.5171          ?        ?       32.1       14.3       ?       ? 
1 1 1   29    7   56 o    104.6    8.9    0.0000   0.0000          ?        ?   109.8257  18.5171          ?        ?      104.6        8.9       ?       ? 
1 1 1   29    7   57 o    315.2    3.2    0.0000   0.0000          ?        ?   994.1782  20.4327          ?        ?      315.2        3.2       ?       ? 
1 1 1   29    7   58 f    254.3    3.9    0.0000   0.0000          ?        ?   647.4609  19.7942          ?        ?      254.3        3.9       ?       ? 
1 1 1   29    7   59 o    108.1    8.9    0.0000   0.0000          ?        ?   117.4880  19.1556          ?        ?      108.1        8.9       ?       ? 
1 1 1   29    7   60 o     52.4   16.1    0.0000   0.0000          ?        ?    28.0950  18.5171          ?        ?       52.4       16.1       ?       ? 
1 1 1   29    7   61 o    317.3    3.3    0.0000   0.0000          ?        ?  1007.5872  21.0712          ?        ?      317.3        3.3       ?       ? 
1 1 1   29    7   62 f    101.3    9.1    0.0000   0.0000          ?        ?   103.4405  18.5171          ?        ?      101.3        9.1       ?       ? 
1 1 1   29    7   63 o    252.2    4.2    0.0000   0.0000          ?        ?   637.2446  21.0712          ?        ?      252.2        4.2       ?       ? 
1 1 1   29    7   64 o     32.2   14.6    0.0000   0.0000          ?        ?   -11.4934  20.4327          ?        ?       32.2       14.6       ?       ? 
1 1 1   29    7   65 o     35.8   15.5    0.0000   0.0000          ?        ?    -1.9156  20.4327          ?        ?       35.8       15.5       ?       ? 
1 1 1   29    7   66 o     79.5   12.8    0.0000   0.0000          ?        ?    64.4907  20.4327          ?        ?       79.5       12.8       ?       ? 
1 1 1   29    7   67 o    245.9    4.3    0.0000   0.0000          ?        ?   605.9570  21.0712          ?        ?      245.9        4.3       ?       ? 
1 1 1   29    7   68 o    203.8    5.0    0.0000   0.0000          ?        ?   416.9547  20.4327          ?        ?      203.8        5.0       ?       ? 
1 1 1   29    7   69 o    107.3    9.5    0.0000   0.0000          ?        ?   116.8494  20.4327          ?        ?      107.3        9.5       ?       ? 
1 1 1   29    7   70 o     51.2   16.8    0.0000   0.0000          ?        ?    26.8179  19.7942          ?        ?       51.2       16.8       ?       ? 
1 1 1   29    7   71 o    116.6    8.8    0.0000   0.0000          ?        ?   137.9207  20.4327          ?        ?      116.6        8.8       ?       ? 
1 1 1   29    8    0 o   1078.2    5.7 11627.4785 122.5962 11627.4785 122.5962 11627.4785 122.5962     1078.2      5.7     1078.2        5.7     0.0     0.0 
1 1 1   29    8    1 o   1547.3    5.2    0.0000   0.0000          ?        ? 23945.8379 162.1845          ?        ?     1547.3        5.2       ?       ? 
1 1 1   29    8    2 o    187.9    2.9    0.0000   0.0000          ?        ?   353.1024  10.8549          ?        ?      187.9        2.9       ?       ? 
1 1 1   29    8    3 o   1067.4    3.8    0.0000   0.0000          ?        ? 11394.4180  81.7308          ?        ?     1067.4        3.8       ?       ? 
1 1 1   29    8    4 o   1189.9    4.3    0.0000   0.0000          ?        ? 14160.4941 103.4405          ?        ?     1189.9        4.3       ?       ? 
1 1 1   29    8    5 o   1739.3    6.0    0.0000   0.0000          ?        ? 30256.3477 209.4351          ?        ?     1739.3        6.0       ?       ? 
1 1 1   29    8    6 o    512.3    2.4    0.0000   0.0000          ?        ?  2624.3240  24.9023          ?        ?      512.3        2.4       ?       ? 
1 1 1   29    8    7 o    734.8    3.0    0.0000   0.0000          ?        ?  5399.9775  44.0580          ?        ?      734.8        3.0       ?       ? 
1 1 1   29    8    8 o    646.5    2.7    0.0000   0.0000          ?        ?  4179.7622  35.1187          ?        ?      646.5        2.7       ?       ? 
1 1 1   29    8    9 o    214.3    2.5    0.0000   0.0000          ?        ?   459.0970  10.8549          ?        ?      214.3        2.5       ?       ? 
1 1 1   29    8   10 o   1292.3    4.6    0.0000   0.0000          ?        ? 16702.4492 119.4035          ?        ?     1292.3        4.6       ?       ? 
1 1 1   29    8   11 o    838.3    3.4    0.0000   0.0000          ?        ?  7027.5688  56.1899          ?        ?      838.3        3.4       ?       ? 
1 1 1   29    8   12 o    527.7    2.6    0.0000   0.0000          ?        ?  2784.5928  27.4564          ?        ?      527.7        2.6       ?       ? 
1 1 1   29    8   13 o    779.3    3.0    0.0000   0.0000          ?        ?  6073.6177  47.2506          ?        ?      779.3        3.0       ?       ? 
1 1 1   29    8   14 f   1413.3    5.1    0.0000   0.0000          ?        ? 19977.4258 144.9444          ?        ?     1413.3        5.1       ?       ? 
1 1 1   29    8   15 f    625.1    2.8    0.0000   0.0000          ?        ?  3907.1140  35.1187          ?        ?      625.1        2.8       ?       ? 
1 1 1   29    8   16 o    431.6    2.6    0.0000   0.0000          ?        ?  1862.5676  22.3483          ?        ?      431.6        2.6       ?       ? 
1 1 1   29    8   17 o   1420.9    5.3    0.0000   0.0000          ?        ? 20193.2461 151.3296          ?        ?     1420.9        5.3       ?       ? 
1 1 1   29    8   18 o   1363.4    4.9    0.0000   0.0000          ?        ? 18589.9180 132.8125          ?        ?     1363.4        4.9       ?       ? 
1 1 1   29    8   19 o   1202.4    4.5    0.0000   0.0000          ?        ? 14459.3223 107.9102          ?        ?     1202.4        4.5       ?       ? 
1 1 1   29    8   20 o    850.6    3.3    0.0000   0.0000          ?        ?  7235.0884  55.5514          ?        ?      850.6        3.3       ?       ? 
1 1 1   29    8   21 o    693.7    3.0    0.0000   0.0000          ?        ?  4812.5376  42.1424          ?        ?      693.7        3.0       ?       ? 
1 1 1   29    8   22 o   1831.0    6.6    0.0000   0.0000          ?        ? 33534.5156 242.6382          ?        ?     1831.0        6.6       ?       ? 
1 1 1   29    8   23 o    323.9    2.8    0.0000   0.0000          ?        ?  1049.0911  17.8786          ?        ?      323.9        2.8       ?       ? 
1 1 1   29    8   24 o    552.4    2.5    0.0000   0.0000          ?        ?  3051.4949  28.0950          ?        ?      552.4        2.5       ?       ? 
1 1 1   29    8   25 o   1004.6    3.9    0.0000   0.0000          ?        ? 10092.4727  77.8996          ?        ?     1004.6        3.9       ?       ? 
1 1 1   29    8   26 o    759.8    3.0    0.0000   0.0000          ?        ?  5774.1509  45.9736          ?        ?      759.8        3.0       ?       ? 
1 1 1   29    8   27 o    371.5    2.5    0.0000   0.0000          ?        ?  1380.4838  18.5171          ?        ?      371.5        2.5       ?       ? 
1 1 1   29    8   28 o    853.8    3.2    0.0000   0.0000          ?        ?  7290.0010  54.9129          ?        ?      853.8        3.2       ?       ? 
1 1 1   29    8   29 o    413.1    2.6    0.0000   0.0000          ?        ?  1706.7682  21.0712          ?        ?      413.1        2.6       ?       ? 
1 1 1   29    8   30 o    730.7    3.0    0.0000   0.0000          ?        ?  5339.3179  43.4195          ?        ?      730.7        3.0       ?       ? 
1 1 1   29    8   31 o    545.6    2.6    0.0000   0.0000          ?        ?  2976.7878  28.0950          ?        ?      545.6        2.6       ?       ? 
1 1 1   29    8   32 o    433.2    2.5    0.0000   0.0000          ?        ?  1876.6150  21.7097          ?        ?      433.2        2.5       ?       ? 
1 1 1   29    8   33 o    489.2    2.5    0.0000   0.0000          ?        ?  2393.8176  24.2638          ?        ?      489.2        2.5       ?       ? 
1 1 1   29    8   34 o    317.9    2.8    0.0000   0.0000          ?        ?  1010.7797  17.8786          ?        ?      317.9        2.8       ?       ? 
1 1 1   29    8   35 o    465.9    2.7    0.0000   0.0000          ?        ?  2170.9736  24.9023          ?        ?      465.9        2.7       ?       ? 
1 1 1   29    8   36 o    362.1    2.6    0.0000   0.0000          ?        ?  1311.5234  18.5171          ?        ?      362.1        2.6       ?       ? 
1 1 1   29    8   37 o    248.5    3.6    0.0000   0.0000          ?        ?   617.4504  17.8786          ?        ?      248.5        3.6       ?       ? 
1 1 1   29    8   38 o    191.7    4.2    0.0000   0.0000          ?        ?   367.7885  15.9630          ?        ?      191.7        4.2       ?       ? 
1 1 1   29    8   39 o     19.4    9.7    0.0000   0.0000          ?        ?   -40.8654  15.3245          ?        ?       19.4        9.7       ?       ? 
1 1 1   29    8   40 o    310.1    3.0    0.0000   0.0000          ?        ?   961.6136  18.5171          ?        ?      310.1        3.0       ?       ? 
1 1 1   29    8   41 o    584.9    2.7    0.0000   0.0000          ?        ?  3421.8376  31.2876          ?        ?      584.9        2.7       ?       ? 
1 1 1   29    8   42 o    332.6    2.8    0.0000   0.0000          ?        ?  1106.5580  18.5171          ?        ?      332.6        2.8       ?       ? 
1 1 1   29    8   43 o    235.1    3.5    0.0000   0.0000          ?        ?   552.9597  16.6016          ?        ?      235.1        3.5       ?       ? 
1 1 1   29    8   44 o    345.8    2.7    0.0000   0.0000          ?        ?  1195.9510  18.5171          ?        ?      345.8        2.7       ?       ? 
1 1 1   29    8   45 o    289.0    3.1    0.0000   0.0000          ?        ?   835.1863  17.8786          ?        ?      289.0        3.1       ?       ? 
1 1 1   29    8   46 o     21.0   10.4    0.0000   0.0000          ?        ?   -39.5883  16.6016          ?        ?       21.0       10.4       ?       ? 
1 1 1   29    8   47 o    642.5    2.7    0.0000   0.0000          ?        ?  4128.6807  35.1187          ?        ?      642.5        2.7       ?       ? 
1 1 1   29    8   48 o    132.9    6.2    0.0000   0.0000          ?        ?   176.8705  16.6016          ?        ?      132.9        6.2       ?       ? 
1 1 1   29    8   49 o     18.3    9.2    0.0000   0.0000          ?        ?   -47.8891  15.3245          ?        ?       18.3        9.2       ?       ? 
1 1 1   29    8   50 o     44.5   15.1    0.0000   0.0000          ?        ?    18.5171  15.9630          ?        ?       44.5       15.1       ?       ? 
1 1 1   29    8   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    8   52 o    305.5    3.1    0.0000   0.0000          ?        ?   933.5186  19.1556          ?        ?      305.5        3.1       ?       ? 
1 1 1   29    8   53 o    512.7    2.6    0.0000   0.0000          ?        ?  2629.4319  26.8179          ?        ?      512.7        2.6       ?       ? 
1 1 1   29    8   54 o    338.6    3.0    0.0000   0.0000          ?        ?  1147.4233  20.4327          ?        ?      338.6        3.0       ?       ? 
1 1 1   29    8   55 o     71.7   13.4    0.0000   0.0000          ?        ?    53.6358  18.5171          ?        ?       71.7       13.4       ?       ? 
1 1 1   29    8   56 o    327.2    3.1    0.0000   0.0000          ?        ?  1071.4393  20.4327          ?        ?      327.2        3.1       ?       ? 
1 1 1   29    8   57 o    176.5    5.4    0.0000   0.0000          ?        ?   312.2371  19.1556          ?        ?      176.5        5.4       ?       ? 
1 1 1   29    8   58 o    102.0    9.4    0.0000   0.0000          ?        ?   104.7175  19.1556          ?        ?      102.0        9.4       ?       ? 
1 1 1   29    8   59 o     19.3    9.8    0.0000   0.0000          ?        ?   -68.9603  19.1556          ?        ?       19.3        9.8       ?       ? 
1 1 1   29    8   60 o    385.5    3.0    0.0000   0.0000          ?        ?  1487.1168  22.9868          ?        ?      385.5        3.0       ?       ? 
1 1 1   29    8   61 o    186.9    5.1    0.0000   0.0000          ?        ?   349.9099  19.1556          ?        ?      186.9        5.1       ?       ? 
1 1 1   29    8   62 o    243.1    4.2    0.0000   0.0000          ?        ?   591.9095  20.4327          ?        ?      243.1        4.2       ?       ? 
1 1 1   29    8   63 o     86.2   11.8    0.0000   0.0000          ?        ?    75.3456  20.4327          ?        ?       86.2       11.8       ?       ? 
1 1 1   29    8   64 o    185.2    5.7    0.0000   0.0000          ?        ?   344.1632  21.0712          ?        ?      185.2        5.7       ?       ? 
1 1 1   29    8   65 o    120.9    8.7    0.0000   0.0000          ?        ?   147.4985  21.0712          ?        ?      120.9        8.7       ?       ? 
1 1 1   29    8   66 o    144.5    7.1    0.0000   0.0000          ?        ?   210.0736  20.4327          ?        ?      144.5        7.1       ?       ? 
1 1 1   29    8   67 o     48.0   16.7    0.0000   0.0000          ?        ?    21.7097  19.7942          ?        ?       48.0       16.7       ?       ? 
1 1 1   29    8   68 o    166.0    6.2    0.0000   0.0000          ?        ?   277.1184  20.4327          ?        ?      166.0        6.2       ?       ? 
1 1 1   29    8   69 o     44.6   16.4    0.0000   0.0000          ?        ?    17.2401  19.1556          ?        ?       44.6       16.4       ?       ? 
1 1 1   29    8   70 o    167.8    5.9    0.0000   0.0000          ?        ?   283.5036  19.7942          ?        ?      167.8        5.9       ?       ? 
1 1 1   29    8   71 o    104.3    8.9    0.0000   0.0000          ?        ?   110.4642  18.5171          ?        ?      104.3        8.9       ?       ? 
1 1 1   29    9    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    9    1 o    327.3    2.3    0.0000   0.0000          ?        ?  1071.4393  15.3245          ?        ?      327.3        2.3       ?       ? 
1 1 1   29    9    2 o    445.6    2.6    0.0000   0.0000          ?        ?  1985.8022  22.9868          ?        ?      445.6        2.6       ?       ? 
1 1 1   29    9    3 o    206.7    2.6    0.0000   0.0000          ?        ?   427.1710  10.8549          ?        ?      206.7        2.6       ?       ? 
1 1 1   29    9    4 o   1118.3    4.1    0.0000   0.0000          ?        ? 12506.7227  90.6701          ?        ?     1118.3        4.1       ?       ? 
1 1 1   29    9    5 o    819.6    3.2    0.0000   0.0000          ?        ?  6717.8857  52.9973          ?        ?      819.6        3.2       ?       ? 
1 1 1   29    9    6 o   1420.1    4.9    0.0000   0.0000          ?        ? 20169.6211 139.8362          ?        ?     1420.1        4.9       ?       ? 
1 1 1   29    9    7 f    628.1    2.6    0.0000   0.0000          ?        ?  3945.4253  32.5646          ?        ?      628.1        2.6       ?       ? 
1 1 1   29    9    8 o    958.4    3.5    0.0000   0.0000          ?        ?  9185.7715  67.6833          ?        ?      958.4        3.5       ?       ? 
1 1 1   29    9    9 o   1053.6    4.0    0.0000   0.0000          ?        ? 11100.6982  83.6463          ?        ?     1053.6        4.0       ?       ? 
1 1 1   29    9   10 o    488.2    2.5    0.0000   0.0000          ?        ?  2383.6011  24.2638          ?        ?      488.2        2.5       ?       ? 
1 1 1   29    9   11 o   1728.3    6.1    0.0000   0.0000          ?        ? 29876.4277 211.3506          ?        ?     1728.3        6.1       ?       ? 
1 1 1   29    9   12 o    782.9    3.2    0.0000   0.0000          ?        ?  6129.1694  49.8047          ?        ?      782.9        3.2       ?       ? 
1 1 1   29    9   13 o    657.0    2.9    0.0000   0.0000          ?        ?  4317.0444  38.3113          ?        ?      657.0        2.9       ?       ? 
1 1 1   29    9   14 f    620.1    2.8    0.0000   0.0000          ?        ?  3845.8157  34.4802          ?        ?      620.1        2.8       ?       ? 
1 1 1   29    9   15 o    735.2    3.1    0.0000   0.0000          ?        ?  5405.0854  45.3350          ?        ?      735.2        3.1       ?       ? 
1 1 1   29    9   16 o   1105.8    4.1    0.0000   0.0000          ?        ? 12229.6055  90.6701          ?        ?     1105.8        4.1       ?       ? 
1 1 1   29    9   17 o    635.8    2.8    0.0000   0.0000          ?        ?  4042.4802  35.7572          ?        ?      635.8        2.8       ?       ? 
1 1 1   29    9   18 f    309.0    2.9    0.0000   0.0000          ?        ?   954.5898  17.8786          ?        ?      309.0        2.9       ?       ? 
1 1 1   29    9   19 o    662.0    3.0    0.0000   0.0000          ?        ?  4382.8125  40.2269          ?        ?      662.0        3.0       ?       ? 
1 1 1   29    9   20 o    633.7    2.8    0.0000   0.0000          ?        ?  4015.6626  35.7572          ?        ?      633.7        2.8       ?       ? 
1 1 1   29    9   21 o    579.5    2.7    0.0000   0.0000          ?        ?  3358.6238  31.2876          ?        ?      579.5        2.7       ?       ? 
1 1 1   29    9   22 o    635.6    2.8    0.0000   0.0000          ?        ?  4039.9265  35.1187          ?        ?      635.6        2.8       ?       ? 
1 1 1   29    9   23 o    459.1    2.5    0.0000   0.0000          ?        ?  2107.7600  22.9868          ?        ?      459.1        2.5       ?       ? 
1 1 1   29    9   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    9   25 o   1179.6    4.1    0.0000   0.0000          ?        ? 13916.5791  97.6938          ?        ?     1179.6        4.1       ?       ? 
1 1 1   29    9   26 f    288.9    2.8    0.0000   0.0000          ?        ?   834.5477  15.9630          ?        ?      288.9        2.8       ?       ? 
1 1 1   29    9   27 o    782.1    3.0    0.0000   0.0000          ?        ?  6117.0371  46.6121          ?        ?      782.1        3.0       ?       ? 
1 1 1   29    9   28 o    430.2    2.4    0.0000   0.0000          ?        ?  1851.0741  21.0712          ?        ?      430.2        2.4       ?       ? 
1 1 1   29    9   29 o    112.4    6.8    0.0000   0.0000          ?        ?   126.4273  15.3245          ?        ?      112.4        6.8       ?       ? 
1 1 1   29    9   30 o    614.4    2.7    0.0000   0.0000          ?        ?  3775.5784  33.2031          ?        ?      614.4        2.7       ?       ? 
1 1 1   29    9   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    9   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    9   33 o    100.4    7.3    0.0000   0.0000          ?        ?   100.8864  14.6860          ?        ?      100.4        7.3       ?       ? 
1 1 1   29    9   34 o    281.5    3.1    0.0000   0.0000          ?        ?   792.4053  17.2401          ?        ?      281.5        3.1       ?       ? 
1 1 1   29    9   35 f    453.1    2.5    0.0000   0.0000          ?        ?  2052.8469  22.3483          ?        ?      453.1        2.5       ?       ? 
1 1 1   29    9   36 f    349.1    2.9    0.0000   0.0000          ?        ?  1218.9377  20.4327          ?        ?      349.1        2.9       ?       ? 
1 1 1   29    9   37 o    473.3    2.5    0.0000   0.0000          ?        ?  2240.5723  23.6253          ?        ?      473.3        2.5       ?       ? 
1 1 1   29    9   38 o    394.1    2.6    0.0000   0.0000          ?        ?  1553.5232  20.4327          ?        ?      394.1        2.6       ?       ? 
1 1 1   29    9   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    9   40 o    394.9    2.7    0.0000   0.0000          ?        ?  1559.9083  21.0712          ?        ?      394.9        2.7       ?       ? 
1 1 1   29    9   41 o    220.1    3.9    0.0000   0.0000          ?        ?   484.6379  17.2401          ?        ?      220.1        3.9       ?       ? 
1 1 1   29    9   42 o    189.7    4.2    0.0000   0.0000          ?        ?   360.1262  15.9630          ?        ?      189.7        4.2       ?       ? 
1 1 1   29    9   43 o    125.0    6.4    0.0000   0.0000          ?        ?   156.4378  15.9630          ?        ?      125.0        6.4       ?       ? 
1 1 1   29    9   44 o    358.6    2.8    0.0000   0.0000          ?        ?  1285.9825  20.4327          ?        ?      358.6        2.8       ?       ? 
1 1 1   29    9   45 o    106.2    7.2    0.0000   0.0000          ?        ?   113.0183  15.3245          ?        ?      106.2        7.2       ?       ? 
1 1 1   29    9   46 o    238.7    3.6    0.0000   0.0000          ?        ?   570.1998  17.2401          ?        ?      238.7        3.6       ?       ? 
1 1 1   29    9   47 o    107.1    7.5    0.0000   0.0000          ?        ?   114.9339  15.9630          ?        ?      107.1        7.5       ?       ? 
1 1 1   29    9   48 o    377.3    2.7    0.0000   0.0000          ?        ?  1423.9032  20.4327          ?        ?      377.3        2.7       ?       ? 
1 1 1   29    9   49 o     20.6   10.3    0.0000   0.0000          ?        ?   -45.9736  17.2401          ?        ?       20.6       10.3       ?       ? 
1 1 1   29    9   50 o    131.7    6.3    0.0000   0.0000          ?        ?   173.6779  16.6016          ?        ?      131.7        6.3       ?       ? 
1 1 1   29    9   51 o    412.1    2.7    0.0000   0.0000          ?        ?  1699.1061  22.3483          ?        ?      412.1        2.7       ?       ? 
1 1 1   29    9   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    9   53 o    410.2    2.7    0.0000   0.0000          ?        ?  1683.1431  22.3483          ?        ?      410.2        2.7       ?       ? 
1 1 1   29    9   54 o    286.6    3.3    0.0000   0.0000          ?        ?   821.7773  19.1556          ?        ?      286.6        3.3       ?       ? 
1 1 1   29    9   55 o    219.0    4.1    0.0000   0.0000          ?        ?   480.1682  17.8786          ?        ?      219.0        4.1       ?       ? 
1 1 1   29    9   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29    9   57 o     67.4   14.6    0.0000   0.0000          ?        ?    47.8891  19.1556          ?        ?       67.4       14.6       ?       ? 
1 1 1   29    9   58 o     46.7   15.9    0.0000   0.0000          ?        ?    20.4327  17.8786          ?        ?       46.7       15.9       ?       ? 
1 1 1   29    9   59 o     49.9   16.5    0.0000   0.0000          ?        ?    24.2638  19.1556          ?        ?       49.9       16.5       ?       ? 
1 1 1   29    9   60 o    109.5    9.0    0.0000   0.0000          ?        ?   120.6806  19.7942          ?        ?      109.5        9.0       ?       ? 
1 1 1   29    9   61 o     37.4   15.7    0.0000   0.0000          ?        ?     2.5541  19.7942          ?        ?       37.4       15.7       ?       ? 
1 1 1   29    9   62 o    448.9    2.9    0.0000   0.0000          ?        ?  2017.0897  26.1794          ?        ?      448.9        2.9       ?       ? 
1 1 1   29    9   63 o    255.3    3.9    0.0000   0.0000          ?        ?   652.5691  19.7942          ?        ?      255.3        3.9       ?       ? 
1 1 1   29    9   64 o    171.6    5.8    0.0000   0.0000          ?        ?   295.6355  19.7942          ?        ?      171.6        5.8       ?       ? 
1 1 1   29    9   65 o    216.2    4.6    0.0000   0.0000          ?        ?   468.6749  19.7942          ?        ?      216.2        4.6       ?       ? 
1 1 1   29    9   66 o    130.1    7.9    0.0000   0.0000          ?        ?   170.4853  20.4327          ?        ?      130.1        7.9       ?       ? 
1 1 1   29    9   67 o     23.7   11.7    0.0000   0.0000          ?        ?   -42.1424  19.7942          ?        ?       23.7       11.7       ?       ? 
1 1 1   29    9   68 f    177.3    5.8    0.0000   0.0000          ?        ?   316.0682  20.4327          ?        ?      177.3        5.8       ?       ? 
1 1 1   29    9   69 o     20.9   10.5    0.0000   0.0000          ?        ?   -59.3825  19.7942          ?        ?       20.9       10.5       ?       ? 
1 1 1   29    9   70 o    158.6    6.0    0.0000   0.0000          ?        ?   253.4931  19.1556          ?        ?      158.6        6.0       ?       ? 
1 1 1   29   10    0 o    201.6    3.8  406.7383  15.3245   406.7383  15.3245   406.7383  15.3245      201.6      3.8      201.6        3.8     0.0     0.0 
1 1 1   29   10    1 o   1288.9    4.6    0.0000   0.0000          ?        ? 16614.9727 119.4035          ?        ?     1288.9        4.6       ?       ? 
1 1 1   29   10    2 o   1140.5    4.1    0.0000   0.0000          ?        ? 13007.3242  93.8627          ?        ?     1140.5        4.1       ?       ? 
1 1 1   29   10    3 o    931.2    3.6    0.0000   0.0000          ?        ?  8671.7617  66.4062          ?        ?      931.2        3.6       ?       ? 
1 1 1   29   10    4 o    109.0    4.4    0.0000   0.0000          ?        ?   118.7650   9.5778          ?        ?      109.0        4.4       ?       ? 
1 1 1   29   10    5 o    413.8    2.4    0.0000   0.0000          ?        ?  1712.5151  19.7942          ?        ?      413.8        2.4       ?       ? 
1 1 1   29   10    6 o    506.4    2.6    0.0000   0.0000          ?        ?  2564.9414  26.1794          ?        ?      506.4        2.6       ?       ? 
1 1 1   29   10    7 o   1216.7    4.5    0.0000   0.0000          ?        ? 14804.1240 109.1872          ?        ?     1216.7        4.5       ?       ? 
1 1 1   29   10    8 o   1224.0    4.6    0.0000   0.0000          ?        ? 14984.1865 113.6568          ?        ?     1224.0        4.6       ?       ? 
1 1 1   29   10    9 o   1047.4    4.0    0.0000   0.0000          ?        ? 10971.0781  84.2849          ?        ?     1047.4        4.0       ?       ? 
1 1 1   29   10   10 o    676.1    2.8    0.0000   0.0000          ?        ?  4571.8149  37.6728          ?        ?      676.1        2.8       ?       ? 
1 1 1   29   10   11 o    491.3    2.7    0.0000   0.0000          ?        ?  2413.6118  26.1794          ?        ?      491.3        2.7       ?       ? 
1 1 1   29   10   12 o    314.6    2.4    0.0000   0.0000          ?        ?   989.7085  15.3245          ?        ?      314.6        2.4       ?       ? 
1 1 1   29   10   13 o    491.2    2.4    0.0000   0.0000          ?        ?  2412.9731  23.6253          ?        ?      491.2        2.4       ?       ? 
1 1 1   29   10   14 o    879.6    3.4    0.0000   0.0000          ?        ?  7737.6055  59.3825          ?        ?      879.6        3.4       ?       ? 
1 1 1   29   10   15 o    172.7    3.9    0.0000   0.0000          ?        ?   298.1896  13.4090          ?        ?      172.7        3.9       ?       ? 
1 1 1   29   10   16 o   1481.5    5.2    0.0000   0.0000          ?        ? 21950.4570 155.1608          ?        ?     1481.5        5.2       ?       ? 
1 1 1   29   10   17 o    478.2    2.5    0.0000   0.0000          ?        ?  2286.5459  23.6253          ?        ?      478.2        2.5       ?       ? 
1 1 1   29   10   18 o    889.5    3.6    0.0000   0.0000          ?        ?  7913.1987  63.2136          ?        ?      889.5        3.6       ?       ? 
1 1 1   29   10   19 o    646.1    2.9    0.0000   0.0000          ?        ?  4174.6543  37.0343          ?        ?      646.1        2.9       ?       ? 
1 1 1   29   10   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   10   21 o    827.2    3.4    0.0000   0.0000          ?        ?  6842.3975  56.8284          ?        ?      827.2        3.4       ?       ? 
1 1 1   29   10   22 o    309.6    2.8    0.0000   0.0000          ?        ?   958.4210  17.2401          ?        ?      309.6        2.8       ?       ? 
1 1 1   29   10   23 o    884.0    3.5    0.0000   0.0000          ?        ?  7814.8662  61.2981          ?        ?      884.0        3.5       ?       ? 
1 1 1   29   10   24 o    918.3    3.5    0.0000   0.0000          ?        ?  8434.2324  63.8522          ?        ?      918.3        3.5       ?       ? 
1 1 1   29   10   25 o   1083.0    3.9    0.0000   0.0000          ?        ? 11730.2803  84.2849          ?        ?     1083.0        3.9       ?       ? 
1 1 1   29   10   26 o    348.8    2.5    0.0000   0.0000          ?        ?  1217.0222  17.2401          ?        ?      348.8        2.5       ?       ? 
1 1 1   29   10   27 o    611.8    2.7    0.0000   0.0000          ?        ?  3743.0139  33.2031          ?        ?      611.8        2.7       ?       ? 
1 1 1   29   10   28 o    648.7    2.8    0.0000   0.0000          ?        ?  4208.4961  36.3957          ?        ?      648.7        2.8       ?       ? 
1 1 1   29   10   29 o    681.2    2.9    0.0000   0.0000          ?        ?  4640.1367  39.5883          ?        ?      681.2        2.9       ?       ? 
1 1 1   29   10   30 o    176.1    4.4    0.0000   0.0000          ?        ?   310.3215  15.3245          ?        ?      176.1        4.4       ?       ? 
1 1 1   29   10   31 o    312.7    2.8    0.0000   0.0000          ?        ?   978.2151  17.2401          ?        ?      312.7        2.8       ?       ? 
1 1 1   29   10   32 o    564.4    2.7    0.0000   0.0000          ?        ?  3186.2229  30.0105          ?        ?      564.4        2.7       ?       ? 
1 1 1   29   10   33 o    153.9    5.0    0.0000   0.0000          ?        ?   236.8915  15.3245          ?        ?      153.9        5.0       ?       ? 
1 1 1   29   10   34 f    671.8    2.8    0.0000   0.0000          ?        ?  4513.7095  37.0343          ?        ?      671.8        2.8       ?       ? 
1 1 1   29   10   35 o    147.7    5.4    0.0000   0.0000          ?        ?   218.3744  15.9630          ?        ?      147.7        5.4       ?       ? 
1 1 1   29   10   36 o    652.3    2.9    0.0000   0.0000          ?        ?  4255.7466  37.6728          ?        ?      652.3        2.9       ?       ? 
1 1 1   29   10   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   10   38 o    377.7    2.6    0.0000   0.0000          ?        ?  1426.4573  19.7942          ?        ?      377.7        2.6       ?       ? 
1 1 1   29   10   39 o     69.6   11.0    0.0000   0.0000          ?        ?    48.5276  15.3245          ?        ?       69.6       11.0       ?       ? 
1 1 1   29   10   40 o    202.7    3.9    0.0000   0.0000          ?        ?   411.2079  15.9630          ?        ?      202.7        3.9       ?       ? 
1 1 1   29   10   41 o    703.8    2.9    0.0000   0.0000          ?        ?  4954.2896  41.5039          ?        ?      703.8        2.9       ?       ? 
1 1 1   29   10   42 f    393.1    2.6    0.0000   0.0000          ?        ?  1545.2223  20.4327          ?        ?      393.1        2.6       ?       ? 
1 1 1   29   10   43 o    592.9    2.6    0.0000   0.0000          ?        ?  3516.3386  31.2876          ?        ?      592.9        2.6       ?       ? 
1 1 1   29   10   44 o    209.4    4.1    0.0000   0.0000          ?        ?   438.6643  17.2401          ?        ?      209.4        4.1       ?       ? 
1 1 1   29   10   45 o    514.9    2.7    0.0000   0.0000          ?        ?  2651.7803  28.0950          ?        ?      514.9        2.7       ?       ? 
1 1 1   29   10   46 f    363.2    2.7    0.0000   0.0000          ?        ?  1319.8242  19.7942          ?        ?      363.2        2.7       ?       ? 
1 1 1   29   10   47 o    272.9    3.2    0.0000   0.0000          ?        ?   745.1547  17.2401          ?        ?      272.9        3.2       ?       ? 
1 1 1   29   10   48 f    238.6    3.6    0.0000   0.0000          ?        ?   569.5613  17.2401          ?        ?      238.6        3.6       ?       ? 
1 1 1   29   10   49 o     30.0   13.3    0.0000   0.0000          ?        ?    -5.7467  15.9630          ?        ?       30.0       13.3       ?       ? 
1 1 1   29   10   50 o    430.2    2.6    0.0000   0.0000          ?        ?  1851.7128  22.3483          ?        ?      430.2        2.6       ?       ? 
1 1 1   29   10   51 o     63.9   13.4    0.0000   0.0000          ?        ?    42.7809  16.6016          ?        ?       63.9       13.4       ?       ? 
1 1 1   29   10   52 o     54.7   14.8    0.0000   0.0000          ?        ?    31.2876  16.6016          ?        ?       54.7       14.8       ?       ? 
1 1 1   29   10   53 o    150.8    5.7    0.0000   0.0000          ?        ?   227.9522  17.2401          ?        ?      150.8        5.7       ?       ? 
1 1 1   29   10   54 o    159.1    5.4    0.0000   0.0000          ?        ?   253.4931  17.2401          ?        ?      159.1        5.4       ?       ? 
1 1 1   29   10   55 o    178.7    5.2    0.0000   0.0000          ?        ?   319.8993  18.5171          ?        ?      178.7        5.2       ?       ? 
1 1 1   29   10   56 o    338.4    3.0    0.0000   0.0000          ?        ?  1145.5078  20.4327          ?        ?      338.4        3.0       ?       ? 
1 1 1   29   10   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   10   58 o     24.8   12.0    0.0000   0.0000          ?        ?   -30.6490  18.5171          ?        ?       24.8       12.0       ?       ? 
1 1 1   29   10   59 o    267.4    3.8    0.0000   0.0000          ?        ?   715.7827  20.4327          ?        ?      267.4        3.8       ?       ? 
1 1 1   29   10   60 o     79.0   12.9    0.0000   0.0000          ?        ?    63.2136  20.4327          ?        ?       79.0       12.9       ?       ? 
1 1 1   29   10   61 o    100.4    9.5    0.0000   0.0000          ?        ?   101.5249  19.1556          ?        ?      100.4        9.5       ?       ? 
1 1 1   29   10   62 o     42.3   16.4    0.0000   0.0000          ?        ?    12.1319  19.7942          ?        ?       42.3       16.4       ?       ? 
1 1 1   29   10   63 o     22.0   11.0    0.0000   0.0000          ?        ?   -52.3588  19.7942          ?        ?       22.0       11.0       ?       ? 
1 1 1   29   10   64 o    162.0    6.3    0.0000   0.0000          ?        ?   263.7094  20.4327          ?        ?      162.0        6.3       ?       ? 
1 1 1   29   10   65 o    132.5    7.5    0.0000   0.0000          ?        ?   176.8705  19.7942          ?        ?      132.5        7.5       ?       ? 
1 1 1   29   10   66 o    214.8    4.9    0.0000   0.0000          ?        ?   462.9282  21.0712          ?        ?      214.8        4.9       ?       ? 
1 1 1   29   10   67 f     41.0   16.3    0.0000   0.0000          ?        ?    10.2163  19.7942          ?        ?       41.0       16.3       ?       ? 
1 1 1   29   10   68 o     90.9   11.2    0.0000   0.0000          ?        ?    84.2849  20.4327          ?        ?       90.9       11.2       ?       ? 
1 1 1   29   10   69 o    116.7    8.5    0.0000   0.0000          ?        ?   137.9207  19.7942          ?        ?      116.7        8.5       ?       ? 
1 1 1   29   10   70 o     68.4   14.5    0.0000   0.0000          ?        ?    50.4432  19.1556          ?        ?       68.4       14.5       ?       ? 
1 1 1   29   11    0 o   1428.5    7.6 20410.9824 215.8203 20410.9824 215.8203 20410.9824 215.8203     1428.5      7.6     1428.5        7.6     0.0     0.0 
1 1 1   29   11    1 o    728.9    3.0    0.0000   0.0000          ?        ?  5312.5000  44.0580          ?        ?      728.9        3.0       ?       ? 
1 1 1   29   11    2 o   1329.5    4.9    0.0000   0.0000          ?        ? 17678.1113 130.2584          ?        ?     1329.5        4.9       ?       ? 
1 1 1   29   11    3 o    377.7    2.4    0.0000   0.0000          ?        ?  1426.4573  17.8786          ?        ?      377.7        2.4       ?       ? 
1 1 1   29   11    4 o    252.9    2.4    0.0000   0.0000          ?        ?   639.7986  12.1319          ?        ?      252.9        2.4       ?       ? 
1 1 1   29   11    5 o    772.4    3.2    0.0000   0.0000          ?        ?  5966.3462  49.1662          ?        ?      772.4        3.2       ?       ? 
1 1 1   29   11    6 o    983.3    3.8    0.0000   0.0000          ?        ?  9670.4102  75.3456          ?        ?      983.3        3.8       ?       ? 
1 1 1   29   11    7 o    529.4    2.4    0.0000   0.0000          ?        ?  2803.1099  25.5409          ?        ?      529.4        2.4       ?       ? 
1 1 1   29   11    8 o    919.8    3.5    0.0000   0.0000          ?        ?  8461.6885  65.1292          ?        ?      919.8        3.5       ?       ? 
1 1 1   29   11    9 o   1070.2    4.1    0.0000   0.0000          ?        ? 11455.0781  86.8389          ?        ?     1070.2        4.1       ?       ? 
1 1 1   29   11   10 o    284.7    2.4    0.0000   0.0000          ?        ?   810.2839  13.4090          ?        ?      284.7        2.4       ?       ? 
1 1 1   29   11   11 o    755.5    3.1    0.0000   0.0000          ?        ?  5708.3833  46.6121          ?        ?      755.5        3.1       ?       ? 
1 1 1   29   11   12 o   1127.0    4.1    0.0000   0.0000          ?        ? 12701.4717  93.2242          ?        ?     1127.0        4.1       ?       ? 
1 1 1   29   11   13 o    137.9    3.9    0.0000   0.0000          ?        ?   190.2794  10.8549          ?        ?      137.9        3.9       ?       ? 
1 1 1   29   11   14 o    757.8    3.0    0.0000   0.0000          ?        ?  5742.2251  45.9736          ?        ?      757.8        3.0       ?       ? 
1 1 1   29   11   15 o   1177.6    4.3    0.0000   0.0000          ?        ? 13869.9668 101.5249          ?        ?     1177.6        4.3       ?       ? 
1 1 1   29   11   16 o    865.1    3.4    0.0000   0.0000          ?        ?  7484.1118  58.7440          ?        ?      865.1        3.4       ?       ? 
1 1 1   29   11   17 o    287.0    2.7    0.0000   0.0000          ?        ?   823.6929  15.3245          ?        ?      287.0        2.7       ?       ? 
1 1 1   29   11   18 o    912.0    3.6    0.0000   0.0000          ?        ?  8317.3828  65.1292          ?        ?      912.0        3.6       ?       ? 
1 1 1   29   11   19 o    450.8    2.4    0.0000   0.0000          ?        ?  2032.4143  21.7097          ?        ?      450.8        2.4       ?       ? 
1 1 1   29   11   20 o    762.0    3.1    0.0000   0.0000          ?        ?  5807.3540  46.6121          ?        ?      762.0        3.1       ?       ? 
1 1 1   29   11   21 o    640.0    2.9    0.0000   0.0000          ?        ?  4096.1162  37.0343          ?        ?      640.0        2.9       ?       ? 
1 1 1   29   11   22 o    619.1    2.8    0.0000   0.0000          ?        ?  3833.6841  34.4802          ?        ?      619.1        2.8       ?       ? 
1 1 1   29   11   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   11   24 o    783.7    3.1    0.0000   0.0000          ?        ?  6141.9395  47.8891          ?        ?      783.7        3.1       ?       ? 
1 1 1   29   11   25 o    534.3    2.7    0.0000   0.0000          ?        ?  2854.8303  29.3720          ?        ?      534.3        2.7       ?       ? 
1 1 1   29   11   26 o    140.0    6.2    0.0000   0.0000          ?        ?   196.0261  17.2401          ?        ?      140.0        6.2       ?       ? 
1 1 1   29   11   27 o    193.4    3.8    0.0000   0.0000          ?        ?   374.1737  14.6860          ?        ?      193.4        3.8       ?       ? 
1 1 1   29   11   28 o   1296.2    4.5    0.0000   0.0000          ?        ? 16806.5293 116.2109          ?        ?     1296.2        4.5       ?       ? 
1 1 1   29   11   29 o    325.0    2.7    0.0000   0.0000          ?        ?  1056.1147  17.2401          ?        ?      325.0        2.7       ?       ? 
1 1 1   29   11   30 o    909.0    3.4    0.0000   0.0000          ?        ?  8265.0244  61.9366          ?        ?      909.0        3.4       ?       ? 
1 1 1   29   11   31 o    878.2    3.4    0.0000   0.0000          ?        ?  7713.9795  59.3825          ?        ?      878.2        3.4       ?       ? 
1 1 1   29   11   32 o    531.1    2.5    0.0000   0.0000          ?        ?  2820.9885  26.8179          ?        ?      531.1        2.5       ?       ? 
1 1 1   29   11   33 o    605.6    2.7    0.0000   0.0000          ?        ?  3667.6685  32.5646          ?        ?      605.6        2.7       ?       ? 
1 1 1   29   11   34 o    409.1    2.6    0.0000   0.0000          ?        ?  1674.2037  21.0712          ?        ?      409.1        2.6       ?       ? 
1 1 1   29   11   35 o    661.5    2.8    0.0000   0.0000          ?        ?  4377.0659  37.0343          ?        ?      661.5        2.8       ?       ? 
1 1 1   29   11   36 o    306.2    2.9    0.0000   0.0000          ?        ?   937.9882  17.8786          ?        ?      306.2        2.9       ?       ? 
1 1 1   29   11   37 o    202.6    4.1    0.0000   0.0000          ?        ?   410.5694  16.6016          ?        ?      202.6        4.1       ?       ? 
1 1 1   29   11   38 o    247.5    3.4    0.0000   0.0000          ?        ?   612.9808  16.6016          ?        ?      247.5        3.4       ?       ? 
1 1 1   29   11   39 o    335.6    3.0    0.0000   0.0000          ?        ?  1126.3521  20.4327          ?        ?      335.6        3.0       ?       ? 
1 1 1   29   11   40 f    388.4    2.6    0.0000   0.0000          ?        ?  1508.8267  20.4327          ?        ?      388.4        2.6       ?       ? 
1 1 1   29   11   41 o    455.5    2.6    0.0000   0.0000          ?        ?  2075.1953  23.6253          ?        ?      455.5        2.6       ?       ? 
1 1 1   29   11   42 f     91.0    9.1    0.0000   0.0000          ?        ?    83.0078  16.6016          ?        ?       91.0        9.1       ?       ? 
1 1 1   29   11   43 o     90.3    8.5    0.0000   0.0000          ?        ?    81.7308  15.3245          ?        ?       90.3        8.5       ?       ? 
1 1 1   29   11   44 o     19.2    9.6    0.0000   0.0000          ?        ?   -42.1424  15.3245          ?        ?       19.2        9.6       ?       ? 
1 1 1   29   11   45 o     36.8   14.8    0.0000   0.0000          ?        ?     6.3852  16.6016          ?        ?       36.8       14.8       ?       ? 
1 1 1   29   11   46 o    375.7    2.7    0.0000   0.0000          ?        ?  1411.7714  20.4327          ?        ?      375.7        2.7       ?       ? 
1 1 1   29   11   47 o    227.4    3.8    0.0000   0.0000          ?        ?   517.2025  17.2401          ?        ?      227.4        3.8       ?       ? 
1 1 1   29   11   48 o    270.2    3.3    0.0000   0.0000          ?        ?   730.4688  17.8786          ?        ?      270.2        3.3       ?       ? 
1 1 1   29   11   49 o    199.2    4.2    0.0000   0.0000          ?        ?   397.1605  16.6016          ?        ?      199.2        4.2       ?       ? 
1 1 1   29   11   50 o     37.1   14.8    0.0000   0.0000          ?        ?     7.0237  16.6016          ?        ?       37.1       14.8       ?       ? 
1 1 1   29   11   51 o    231.1    3.9    0.0000   0.0000          ?        ?   534.4426  17.8786          ?        ?      231.1        3.9       ?       ? 
1 1 1   29   11   52 f    169.0    5.1    0.0000   0.0000          ?        ?   286.0577  17.2401          ?        ?      169.0        5.1       ?       ? 
1 1 1   29   11   53 o    404.0    2.7    0.0000   0.0000          ?        ?  1632.6998  21.7097          ?        ?      404.0        2.7       ?       ? 
1 1 1   29   11   54 o    204.2    4.5    0.0000   0.0000          ?        ?   417.5931  18.5171          ?        ?      204.2        4.5       ?       ? 
1 1 1   29   11   55 o    223.2    4.0    0.0000   0.0000          ?        ?   498.6854  17.8786          ?        ?      223.2        4.0       ?       ? 
1 1 1   29   11   56 o    336.6    3.0    0.0000   0.0000          ?        ?  1133.3759  20.4327          ?        ?      336.6        3.0       ?       ? 
1 1 1   29   11   57 o     23.7   11.7    0.0000   0.0000          ?        ?   -45.9736  20.4327          ?        ?       23.7       11.7       ?       ? 
1 1 1   29   11   58 o    190.7    5.2    0.0000   0.0000          ?        ?   364.5958  19.7942          ?        ?      190.7        5.2       ?       ? 
1 1 1   29   11   59 o    308.0    3.4    0.0000   0.0000          ?        ?   949.4816  21.0712          ?        ?      308.0        3.4       ?       ? 
1 1 1   29   11   60 o    186.0    5.3    0.0000   0.0000          ?        ?   346.7172  19.7942          ?        ?      186.0        5.3       ?       ? 
1 1 1   29   11   61 o    122.6    8.1    0.0000   0.0000          ?        ?   151.3296  19.7942          ?        ?      122.6        8.1       ?       ? 
1 1 1   29   11   62 o     72.2   14.2    0.0000   0.0000          ?        ?    54.9129  19.7942          ?        ?       72.2       14.2       ?       ? 
1 1 1   29   11   63 o     38.2   15.8    0.0000   0.0000          ?        ?     4.4697  19.7942          ?        ?       38.2       15.8       ?       ? 
1 1 1   29   11   64 o    237.7    4.4    0.0000   0.0000          ?        ?   566.3687  21.0712          ?        ?      237.7        4.4       ?       ? 
1 1 1   29   11   65 o     69.6   15.1    0.0000   0.0000          ?        ?    51.7203  20.4327          ?        ?       69.6       15.1       ?       ? 
1 1 1   29   11   66 o    110.0    9.3    0.0000   0.0000          ?        ?   122.5962  20.4327          ?        ?      110.0        9.3       ?       ? 
1 1 1   29   11   67 o     93.0   11.0    0.0000   0.0000          ?        ?    88.1160  20.4327          ?        ?       93.0       11.0       ?       ? 
1 1 1   29   11   68 o     40.1   16.1    0.0000   0.0000          ?        ?     8.9393  19.7942          ?        ?       40.1       16.1       ?       ? 
1 1 1   29   11   69 o    217.5    4.7    0.0000   0.0000          ?        ?   475.0601  20.4327          ?        ?      217.5        4.7       ?       ? 
1 1 1   29   12    0 o   1050.6    6.4 11040.0391 134.0895 11040.0391 134.0895 11040.0391 134.0895     1050.6      6.4     1050.6        6.4     0.0     0.0 
1 1 1   29   12    1 o    985.5    4.0    0.0000   0.0000          ?        ?  9713.8301  79.8152          ?        ?      985.5        4.0       ?       ? 
1 1 1   29   12    2 o   1090.4    4.5    0.0000   0.0000          ?        ? 11891.1885  97.0553          ?        ?     1090.4        4.5       ?       ? 
1 1 1   29   12    3 o    624.7    2.8    0.0000   0.0000          ?        ?  3903.2827  35.1187          ?        ?      624.7        2.8       ?       ? 
1 1 1   29   12    4 o    973.6    3.8    0.0000   0.0000          ?        ?  9480.1299  73.4300          ?        ?      973.6        3.8       ?       ? 
1 1 1   29   12    5 o    924.9    3.5    0.0000   0.0000          ?        ?  8554.2734  64.4907          ?        ?      924.9        3.5       ?       ? 
1 1 1   29   12    6 o    716.6    2.9    0.0000   0.0000          ?        ?  5135.6294  42.1424          ?        ?      716.6        2.9       ?       ? 
1 1 1   29   12    7 o    235.8    2.4    0.0000   0.0000          ?        ?   556.1523  11.4934          ?        ?      235.8        2.4       ?       ? 
1 1 1   29   12    8 o    535.8    2.6    0.0000   0.0000          ?        ?  2871.4319  28.0950          ?        ?      535.8        2.6       ?       ? 
1 1 1   29   12    9 o   1307.4    4.8    0.0000   0.0000          ?        ? 17094.5000 126.4273          ?        ?     1307.4        4.8       ?       ? 
1 1 1   29   12   10 o    441.2    2.5    0.0000   0.0000          ?        ?  1946.8524  21.7097          ?        ?      441.2        2.5       ?       ? 
1 1 1   29   12   11 o    646.8    3.0    0.0000   0.0000          ?        ?  4184.2319  38.9498          ?        ?      646.8        3.0       ?       ? 
1 1 1   29   12   12 o    425.3    2.5    0.0000   0.0000          ?        ?  1808.9316  21.0712          ?        ?      425.3        2.5       ?       ? 
1 1 1   29   12   13 o    399.7    2.3    0.0000   0.0000          ?        ?  1597.5811  18.5171          ?        ?      399.7        2.3       ?       ? 
1 1 1   29   12   14 o    838.9    3.4    0.0000   0.0000          ?        ?  7038.4243  56.8284          ?        ?      838.9        3.4       ?       ? 
1 1 1   29   12   15 o    667.3    3.0    0.0000   0.0000          ?        ?  4453.0498  39.5883          ?        ?      667.3        3.0       ?       ? 
1 1 1   29   12   16 o     74.1    8.6    0.0000   0.0000          ?        ?    54.9129  12.7704          ?        ?       74.1        8.6       ?       ? 
1 1 1   29   12   17 o    924.2    3.6    0.0000   0.0000          ?        ?  8542.7812  65.7677          ?        ?      924.2        3.6       ?       ? 
1 1 1   29   12   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   12   19 o    649.4    3.0    0.0000   0.0000          ?        ?  4217.4355  39.5883          ?        ?      649.4        3.0       ?       ? 
1 1 1   29   12   20 o    240.0    2.7    0.0000   0.0000          ?        ?   575.9465  12.7704          ?        ?      240.0        2.7       ?       ? 
1 1 1   29   12   21 o    777.6    3.2    0.0000   0.0000          ?        ?  6047.4380  49.1662          ?        ?      777.6        3.2       ?       ? 
1 1 1   29   12   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   12   23 o    772.9    3.1    0.0000   0.0000          ?        ?  5974.0083  47.2506          ?        ?      772.9        3.1       ?       ? 
1 1 1   29   12   24 o    588.7    2.8    0.0000   0.0000          ?        ?  3466.5342  32.5646          ?        ?      588.7        2.8       ?       ? 
1 1 1   29   12   25 o    418.2    2.4    0.0000   0.0000          ?        ?  1748.9106  19.7942          ?        ?      418.2        2.4       ?       ? 
1 1 1   29   12   26 o    854.2    3.3    0.0000   0.0000          ?        ?  7297.6641  56.1899          ?        ?      854.2        3.3       ?       ? 
1 1 1   29   12   27 o    418.4    2.4    0.0000   0.0000          ?        ?  1750.8264  19.7942          ?        ?      418.4        2.4       ?       ? 
1 1 1   29   12   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   12   29 o    463.3    2.5    0.0000   0.0000          ?        ?  2146.7097  22.9868          ?        ?      463.3        2.5       ?       ? 
1 1 1   29   12   30 o    871.3    3.3    0.0000   0.0000          ?        ?  7593.2988  56.8284          ?        ?      871.3        3.3       ?       ? 
1 1 1   29   12   31 o    265.4    3.1    0.0000   0.0000          ?        ?   704.2894  16.6016          ?        ?      265.4        3.1       ?       ? 
1 1 1   29   12   32 o    902.8    3.5    0.0000   0.0000          ?        ?  8152.6445  63.2136          ?        ?      902.8        3.5       ?       ? 
1 1 1   29   12   33 o    244.4    3.3    0.0000   0.0000          ?        ?   597.6562  15.9630          ?        ?      244.4        3.3       ?       ? 
1 1 1   29   12   34 o    234.8    3.5    0.0000   0.0000          ?        ?   551.6827  16.6016          ?        ?      234.8        3.5       ?       ? 
1 1 1   29   12   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   12   36 o    455.4    2.5    0.0000   0.0000          ?        ?  2073.9182  22.9868          ?        ?      455.4        2.5       ?       ? 
1 1 1   29   12   37 o    591.5    2.6    0.0000   0.0000          ?        ?  3499.7368  30.6490          ?        ?      591.5        2.6       ?       ? 
1 1 1   29   12   38 o    176.8    4.7    0.0000   0.0000          ?        ?   312.8756  16.6016          ?        ?      176.8        4.7       ?       ? 
1 1 1   29   12   39 o    187.7    4.6    0.0000   0.0000          ?        ?   352.4639  17.2401          ?        ?      187.7        4.6       ?       ? 
1 1 1   29   12   40 o    321.6    3.0    0.0000   0.0000          ?        ?  1034.4050  19.1556          ?        ?      321.6        3.0       ?       ? 
1 1 1   29   12   41 o    499.7    2.6    0.0000   0.0000          ?        ?  2497.2581  26.1794          ?        ?      499.7        2.6       ?       ? 
1 1 1   29   12   42 f    604.5    2.8    0.0000   0.0000          ?        ?  3654.8979  33.8416          ?        ?      604.5        2.8       ?       ? 
1 1 1   29   12   43 f    486.1    2.7    0.0000   0.0000          ?        ?  2363.8071  26.1794          ?        ?      486.1        2.7       ?       ? 
1 1 1   29   12   44 o    370.7    2.6    0.0000   0.0000          ?        ?  1374.7371  19.1556          ?        ?      370.7        2.6       ?       ? 
1 1 1   29   12   45 o    113.2    6.8    0.0000   0.0000          ?        ?   128.3428  15.3245          ?        ?      113.2        6.8       ?       ? 
1 1 1   29   12   46 o    247.0    3.5    0.0000   0.0000          ?        ?   610.4266  17.2401          ?        ?      247.0        3.5       ?       ? 
1 1 1   29   12   47 o     49.1   15.3    0.0000   0.0000          ?        ?    24.2638  16.6016          ?        ?       49.1       15.3       ?       ? 
1 1 1   29   12   48 o    191.0    4.7    0.0000   0.0000          ?        ?   365.2344  17.8786          ?        ?      191.0        4.7       ?       ? 
1 1 1   29   12   49 o     54.3   15.3    0.0000   0.0000          ?        ?    30.6490  17.2401          ?        ?       54.3       15.3       ?       ? 
1 1 1   29   12   50 o    210.2    4.4    0.0000   0.0000          ?        ?   442.4955  18.5171          ?        ?      210.2        4.4       ?       ? 
1 1 1   29   12   51 o     20.8   10.3    0.0000   0.0000          ?        ?   -40.8654  16.6016          ?        ?       20.8       10.3       ?       ? 
1 1 1   29   12   52 o     99.3    8.7    0.0000   0.0000          ?        ?    98.9709  17.2401          ?        ?       99.3        8.7       ?       ? 
1 1 1   29   12   53 o    447.1    2.7    0.0000   0.0000          ?        ?  1999.8499  24.2638          ?        ?      447.1        2.7       ?       ? 
1 1 1   29   12   54 o    398.1    2.9    0.0000   0.0000          ?        ?  1585.4492  22.9868          ?        ?      398.1        2.9       ?       ? 
1 1 1   29   12   55 o    284.7    3.5    0.0000   0.0000          ?        ?   810.9225  19.7942          ?        ?      284.7        3.5       ?       ? 
1 1 1   29   12   56 o    133.5    6.9    0.0000   0.0000          ?        ?   178.7861  18.5171          ?        ?      133.5        6.9       ?       ? 
1 1 1   29   12   57 o    314.6    3.2    0.0000   0.0000          ?        ?   990.3471  20.4327          ?        ?      314.6        3.2       ?       ? 
1 1 1   29   12   58 o     94.1   10.5    0.0000   0.0000          ?        ?    89.3930  19.7942          ?        ?       94.1       10.5       ?       ? 
1 1 1   29   12   59 o    376.5    3.0    0.0000   0.0000          ?        ?  1418.7950  22.3483          ?        ?      376.5        3.0       ?       ? 
1 1 1   29   12   60 o    171.7    5.8    0.0000   0.0000          ?        ?   295.6355  19.7942          ?        ?      171.7        5.8       ?       ? 
1 1 1   29   12   61 o    111.7    8.6    0.0000   0.0000          ?        ?   125.7888  19.1556          ?        ?      111.7        8.6       ?       ? 
1 1 1   29   12   62 o     28.2   13.3    0.0000   0.0000          ?        ?   -22.3483  19.7942          ?        ?       28.2       13.3       ?       ? 
1 1 1   29   12   63 o    265.4    3.8    0.0000   0.0000          ?        ?   705.5664  20.4327          ?        ?      265.4        3.8       ?       ? 
1 1 1   29   12   64 o     52.3   16.5    0.0000   0.0000          ?        ?    28.0950  19.1556          ?        ?       52.3       16.5       ?       ? 
1 1 1   29   12   65 o    205.0    4.8    0.0000   0.0000          ?        ?   421.4243  19.7942          ?        ?      205.0        4.8       ?       ? 
1 1 1   29   12   66 o     28.7   13.5    0.0000   0.0000          ?        ?   -19.7942  19.7942          ?        ?       28.7       13.5       ?       ? 
1 1 1   29   12   67 f    117.3    8.2    0.0000   0.0000          ?        ?   139.1977  19.1556          ?        ?      117.3        8.2       ?       ? 
1 1 1   29   12   68 o    268.8    3.9    0.0000   0.0000          ?        ?   724.7220  21.0712          ?        ?      268.8        3.9       ?       ? 
1 1 1   29   12   69 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   13    0 o   1723.6    9.4 29719.3496 325.0075 29719.3496 325.0075 29719.3496 325.0075     1723.6      9.4     1723.6        9.4     0.0     0.0 
1 1 1   29   13    1 o    607.2    3.4    0.0000   0.0000          ?        ?  3687.4624  41.5039          ?        ?      607.2        3.4       ?       ? 
1 1 1   29   13    2 o   1101.0    4.6    0.0000   0.0000          ?        ? 12122.9717 100.8864          ?        ?     1101.0        4.6       ?       ? 
1 1 1   29   13    3 o    823.5    3.5    0.0000   0.0000          ?        ?  6782.3765  58.1055          ?        ?      823.5        3.5       ?       ? 
1 1 1   29   13    4 o    646.3    2.9    0.0000   0.0000          ?        ?  4177.2085  37.6728          ?        ?      646.3        2.9       ?       ? 
1 1 1   29   13    5 o    160.6    3.6    0.0000   0.0000          ?        ?   257.9627  11.4934          ?        ?      160.6        3.6       ?       ? 
1 1 1   29   13    6 o    253.9    2.6    0.0000   0.0000          ?        ?   644.9069  13.4090          ?        ?      253.9        2.6       ?       ? 
1 1 1   29   13    7 o    815.1    3.3    0.0000   0.0000          ?        ?  6645.0942  53.6358          ?        ?      815.1        3.3       ?       ? 
1 1 1   29   13    8 o   1075.7    3.9    0.0000   0.0000          ?        ? 11572.5664  84.9234          ?        ?     1075.7        3.9       ?       ? 
1 1 1   29   13    9 o    527.3    2.5    0.0000   0.0000          ?        ?  2780.1230  26.1794          ?        ?      527.3        2.5       ?       ? 
1 1 1   29   13   10 o   1102.2    4.1    0.0000   0.0000          ?        ? 12149.1504  91.3086          ?        ?     1102.2        4.1       ?       ? 
1 1 1   29   13   11 f   1693.7    5.9    0.0000   0.0000          ?        ? 28691.9688 198.5802          ?        ?     1693.7        5.9       ?       ? 
1 1 1   29   13   12 o    442.2    2.5    0.0000   0.0000          ?        ?  1955.1533  22.3483          ?        ?      442.2        2.5       ?       ? 
1 1 1   29   13   13 o    169.9    3.2    0.0000   0.0000          ?        ?   288.6118  10.8549          ?        ?      169.9        3.2       ?       ? 
1 1 1   29   13   14 o    476.6    2.4    0.0000   0.0000          ?        ?  2271.8599  22.9868          ?        ?      476.6        2.4       ?       ? 
1 1 1   29   13   15 o    895.5    3.5    0.0000   0.0000          ?        ?  8019.1934  62.5751          ?        ?      895.5        3.5       ?       ? 
1 1 1   29   13   16 o    282.6    3.1    0.0000   0.0000          ?        ?   798.7905  17.2401          ?        ?      282.6        3.1       ?       ? 
1 1 1   29   13   17 o    263.1    2.7    0.0000   0.0000          ?        ?   692.1575  14.0475          ?        ?      263.1        2.7       ?       ? 
1 1 1   29   13   18 o    996.5    3.7    0.0000   0.0000          ?        ?  9932.2041  74.0685          ?        ?      996.5        3.7       ?       ? 
1 1 1   29   13   19 o   1019.5    3.7    0.0000   0.0000          ?        ? 10395.1318  75.9841          ?        ?     1019.5        3.7       ?       ? 
1 1 1   29   13   20 o     94.9    6.4    0.0000   0.0000          ?        ?    90.0316  12.1319          ?        ?       94.9        6.4       ?       ? 
1 1 1   29   13   21 f   1305.1    4.6    0.0000   0.0000          ?        ? 17035.7578 118.7650          ?        ?     1305.1        4.6       ?       ? 
1 1 1   29   13   22 o    466.7    2.5    0.0000   0.0000          ?        ?  2178.6360  22.9868          ?        ?      466.7        2.5       ?       ? 
1 1 1   29   13   23 o    389.7    2.5    0.0000   0.0000          ?        ?  1518.4044  19.1556          ?        ?      389.7        2.5       ?       ? 
1 1 1   29   13   24 o    635.5    2.7    0.0000   0.0000          ?        ?  4039.2876  33.8416          ?        ?      635.5        2.7       ?       ? 
1 1 1   29   13   25 o    391.9    2.4    0.0000   0.0000          ?        ?  1535.6445  18.5171          ?        ?      391.9        2.4       ?       ? 
1 1 1   29   13   26 o    861.6    3.2    0.0000   0.0000          ?        ?  7424.7300  55.5514          ?        ?      861.6        3.2       ?       ? 
1 1 1   29   13   27 o    288.1    2.8    0.0000   0.0000          ?        ?   830.0781  15.9630          ?        ?      288.1        2.8       ?       ? 
1 1 1   29   13   28 o    128.1    5.2    0.0000   0.0000          ?        ?   164.1001  13.4090          ?        ?      128.1        5.2       ?       ? 
1 1 1   29   13   29 o    803.9    3.1    0.0000   0.0000          ?        ?  6463.7544  49.8047          ?        ?      803.9        3.1       ?       ? 
1 1 1   29   13   30 o    267.8    3.0    0.0000   0.0000          ?        ?   717.0598  15.9630          ?        ?      267.8        3.0       ?       ? 
1 1 1   29   13   31 f    232.3    3.3    0.0000   0.0000          ?        ?   539.5508  15.3245          ?        ?      232.3        3.3       ?       ? 
1 1 1   29   13   32 o    374.4    2.6    0.0000   0.0000          ?        ?  1402.1935  19.1556          ?        ?      374.4        2.6       ?       ? 
1 1 1   29   13   33 o    448.2    2.6    0.0000   0.0000          ?        ?  2009.4276  23.6253          ?        ?      448.2        2.6       ?       ? 
1 1 1   29   13   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   13   35 o    346.4    2.6    0.0000   0.0000          ?        ?  1200.4207  17.8786          ?        ?      346.4        2.6       ?       ? 
1 1 1   29   13   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   13   37 o    421.3    2.5    0.0000   0.0000          ?        ?  1775.0901  21.0712          ?        ?      421.3        2.5       ?       ? 
1 1 1   29   13   38 o    606.6    2.6    0.0000   0.0000          ?        ?  3679.8000  31.9261          ?        ?      606.6        2.6       ?       ? 
1 1 1   29   13   39 o     82.1   10.1    0.0000   0.0000          ?        ?    67.6833  16.6016          ?        ?       82.1       10.1       ?       ? 
1 1 1   29   13   40 o     45.3   15.4    0.0000   0.0000          ?        ?    19.1556  16.6016          ?        ?       45.3       15.4       ?       ? 
1 1 1   29   13   41 o    293.8    3.0    0.0000   0.0000          ?        ?   863.2812  17.8786          ?        ?      293.8        3.0       ?       ? 
1 1 1   29   13   42 o    104.4    7.6    0.0000   0.0000          ?        ?   109.1872  15.9630          ?        ?      104.4        7.6       ?       ? 
1 1 1   29   13   43 o    222.0    3.7    0.0000   0.0000          ?        ?   492.9387  16.6016          ?        ?      222.0        3.7       ?       ? 
1 1 1   29   13   44 o    110.3    7.2    0.0000   0.0000          ?        ?   121.9576  15.9630          ?        ?      110.3        7.2       ?       ? 
1 1 1   29   13   45 o     57.9   14.4    0.0000   0.0000          ?        ?    35.1187  16.6016          ?        ?       57.9       14.4       ?       ? 
1 1 1   29   13   46 o    115.4    7.2    0.0000   0.0000          ?        ?   133.4510  16.6016          ?        ?      115.4        7.2       ?       ? 
1 1 1   29   13   47 o    366.2    2.8    0.0000   0.0000          ?        ?  1341.5339  20.4327          ?        ?      366.2        2.8       ?       ? 
1 1 1   29   13   48 o    471.8    2.6    0.0000   0.0000          ?        ?  2227.1633  24.9023          ?        ?      471.8        2.6       ?       ? 
1 1 1   29   13   49 o    191.3    4.5    0.0000   0.0000          ?        ?   366.5114  17.2401          ?        ?      191.3        4.5       ?       ? 
1 1 1   29   13   50 o    349.3    2.9    0.0000   0.0000          ?        ?  1220.8533  20.4327          ?        ?      349.3        2.9       ?       ? 
1 1 1   29   13   51 o    141.9    6.3    0.0000   0.0000          ?        ?   201.7728  17.8786          ?        ?      141.9        6.3       ?       ? 
1 1 1   29   13   52 o    206.3    4.3    0.0000   0.0000          ?        ?   425.8939  17.8786          ?        ?      206.3        4.3       ?       ? 
1 1 1   29   13   53 o     54.2   15.3    0.0000   0.0000          ?        ?    30.6490  17.2401          ?        ?       54.2       15.3       ?       ? 
1 1 1   29   13   54 o    147.4    6.5    0.0000   0.0000          ?        ?   217.7359  19.1556          ?        ?      147.4        6.5       ?       ? 
1 1 1   29   13   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   13   56 o    152.0    6.1    0.0000   0.0000          ?        ?   231.7833  18.5171          ?        ?      152.0        6.1       ?       ? 
1 1 1   29   13   57 o    184.8    5.2    0.0000   0.0000          ?        ?   342.2476  19.1556          ?        ?      184.8        5.2       ?       ? 
1 1 1   29   13   58 o     41.1   15.9    0.0000   0.0000          ?        ?    11.4934  18.5171          ?        ?       41.1       15.9       ?       ? 
1 1 1   29   13   59 o     37.8   15.6    0.0000   0.0000          ?        ?     4.4697  19.1556          ?        ?       37.8       15.6       ?       ? 
1 1 1   29   13   60 o    318.7    3.3    0.0000   0.0000          ?        ?  1016.5264  21.0712          ?        ?      318.7        3.3       ?       ? 
1 1 1   29   13   61 o     95.1   10.1    0.0000   0.0000          ?        ?    91.3086  19.1556          ?        ?       95.1       10.1       ?       ? 
1 1 1   29   13   62 o    227.2    4.5    0.0000   0.0000          ?        ?   517.2025  20.4327          ?        ?      227.2        4.5       ?       ? 
1 1 1   29   13   63 o     33.1   14.7    0.0000   0.0000          ?        ?    -7.0237  19.7942          ?        ?       33.1       14.7       ?       ? 
1 1 1   29   13   64 o     92.5   10.7    0.0000   0.0000          ?        ?    86.8389  19.7942          ?        ?       92.5       10.7       ?       ? 
1 1 1   29   13   65 o     31.4   14.3    0.0000   0.0000          ?        ?   -11.4934  19.7942          ?        ?       31.4       14.3       ?       ? 
1 1 1   29   13   66 o    105.2    9.7    0.0000   0.0000          ?        ?   112.3798  20.4327          ?        ?      105.2        9.7       ?       ? 
1 1 1   29   13   67 o    136.6    7.2    0.0000   0.0000          ?        ?   188.3639  19.7942          ?        ?      136.6        7.2       ?       ? 
1 1 1   29   13   68 o     38.2   15.7    0.0000   0.0000          ?        ?     6.3852  19.1556          ?        ?       38.2       15.7       ?       ? 
1 1 1   29   14    0 o    591.2    4.3 3495.9060  50.4432  3495.9060  50.4432  3495.9060  50.4432      591.2      4.3      591.2        4.3     0.0     0.0 
1 1 1   29   14    1 o    476.8    2.9    0.0000   0.0000          ?        ?  2273.7756  27.4564          ?        ?      476.8        2.9       ?       ? 
1 1 1   29   14    2 o   1048.5    4.5    0.0000   0.0000          ?        ? 10994.0654  93.8627          ?        ?     1048.5        4.5       ?       ? 
1 1 1   29   14    3 f    961.0    4.1    0.0000   0.0000          ?        ?  9235.5771  78.5382          ?        ?      961.0        4.1       ?       ? 
1 1 1   29   14    4 f    628.4    3.0    0.0000   0.0000          ?        ?  3948.6179  37.6728          ?        ?      628.4        3.0       ?       ? 
1 1 1   29   14    5 o    913.9    3.6    0.0000   0.0000          ?        ?  8352.5010  65.1292          ?        ?      913.9        3.6       ?       ? 
1 1 1   29   14    6 o    597.6    2.7    0.0000   0.0000          ?        ?  3571.8901  32.5646          ?        ?      597.6        2.7       ?       ? 
1 1 1   29   14    7 o    608.0    2.8    0.0000   0.0000          ?        ?  3696.4019  33.8416          ?        ?      608.0        2.8       ?       ? 
1 1 1   29   14    8 o    143.2    3.3    0.0000   0.0000          ?        ?   204.9654   9.5778          ?        ?      143.2        3.3       ?       ? 
1 1 1   29   14    9 o    736.3    3.1    0.0000   0.0000          ?        ?  5421.6870  45.3350          ?        ?      736.3        3.1       ?       ? 
1 1 1   29   14   10 o    290.3    2.3    0.0000   0.0000          ?        ?   842.8486  13.4090          ?        ?      290.3        2.3       ?       ? 
1 1 1   29   14   11 o    812.1    3.2    0.0000   0.0000          ?        ?  6595.2900  51.7203          ?        ?      812.1        3.2       ?       ? 
1 1 1   29   14   12 o    213.8    2.7    0.0000   0.0000          ?        ?   457.1815  11.4934          ?        ?      213.8        2.7       ?       ? 
1 1 1   29   14   13 o    483.0    2.5    0.0000   0.0000          ?        ?  2333.1580  24.2638          ?        ?      483.0        2.5       ?       ? 
1 1 1   29   14   14 o    389.0    2.3    0.0000   0.0000          ?        ?  1513.2963  17.8786          ?        ?      389.0        2.3       ?       ? 
1 1 1   29   14   15 o    955.6    3.6    0.0000   0.0000          ?        ?  9133.4131  68.3218          ?        ?      955.6        3.6       ?       ? 
1 1 1   29   14   16 o    976.7    3.9    0.0000   0.0000          ?        ?  9541.4287  75.3456          ?        ?      976.7        3.9       ?       ? 
1 1 1   29   14   17 o    365.3    2.4    0.0000   0.0000          ?        ?  1334.5103  17.8786          ?        ?      365.3        2.4       ?       ? 
1 1 1   29   14   18 o    147.3    4.1    0.0000   0.0000          ?        ?   217.0974  12.1319          ?        ?      147.3        4.1       ?       ? 
1 1 1   29   14   19 o    926.9    3.5    0.0000   0.0000          ?        ?  8591.9473  65.1292          ?        ?      926.9        3.5       ?       ? 
1 1 1   29   14   20 o    290.7    2.5    0.0000   0.0000          ?        ?   845.4026  14.6860          ?        ?      290.7        2.5       ?       ? 
1 1 1   29   14   21 o    902.4    3.4    0.0000   0.0000          ?        ?  8144.3433  61.9366          ?        ?      902.4        3.4       ?       ? 
1 1 1   29   14   22 o    593.2    2.5    0.0000   0.0000          ?        ?  3519.5312  30.0105          ?        ?      593.2        2.5       ?       ? 
1 1 1   29   14   23 o    520.4    2.5    0.0000   0.0000          ?        ?  2708.6089  26.1794          ?        ?      520.4        2.5       ?       ? 
1 1 1   29   14   24 o    847.1    3.2    0.0000   0.0000          ?        ?  7176.9829  53.6358          ?        ?      847.1        3.2       ?       ? 
1 1 1   29   14   25 o    715.4    2.9    0.0000   0.0000          ?        ?  5119.0278  41.5039          ?        ?      715.4        2.9       ?       ? 
1 1 1   29   14   26 o    348.3    2.7    0.0000   0.0000          ?        ?  1213.1910  18.5171          ?        ?      348.3        2.7       ?       ? 
1 1 1   29   14   27 o    418.7    2.4    0.0000   0.0000          ?        ?  1753.3804  20.4327          ?        ?      418.7        2.4       ?       ? 
1 1 1   29   14   28 o    306.1    2.5    0.0000   0.0000          ?        ?   937.3498  15.3245          ?        ?      306.1        2.5       ?       ? 
1 1 1   29   14   29 o    587.3    2.6    0.0000   0.0000          ?        ?  3449.9324  30.6490          ?        ?      587.3        2.6       ?       ? 
1 1 1   29   14   30 o    216.3    3.4    0.0000   0.0000          ?        ?   468.0364  14.6860          ?        ?      216.3        3.4       ?       ? 
1 1 1   29   14   31 o    550.4    2.6    0.0000   0.0000          ?        ?  3029.7852  28.0950          ?        ?      550.4        2.6       ?       ? 
1 1 1   29   14   32 o    341.4    2.7    0.0000   0.0000          ?        ?  1165.9406  18.5171          ?        ?      341.4        2.7       ?       ? 
1 1 1   29   14   33 o    134.4    5.5    0.0000   0.0000          ?        ?   180.7016  14.6860          ?        ?      134.4        5.5       ?       ? 
1 1 1   29   14   34 o    766.4    3.1    0.0000   0.0000          ?        ?  5875.6763  47.2506          ?        ?      766.4        3.1       ?       ? 
1 1 1   29   14   35 o    230.7    3.3    0.0000   0.0000          ?        ?   532.5270  15.3245          ?        ?      230.7        3.3       ?       ? 
1 1 1   29   14   36 o    202.7    3.5    0.0000   0.0000          ?        ?   411.2079  14.0475          ?        ?      202.7        3.5       ?       ? 
1 1 1   29   14   37 o    669.1    2.8    0.0000   0.0000          ?        ?  4477.9521  37.0343          ?        ?      669.1        2.8       ?       ? 
1 1 1   29   14   38 o    115.2    6.9    0.0000   0.0000          ?        ?   132.8125  15.9630          ?        ?      115.2        6.9       ?       ? 
1 1 1   29   14   39 o    168.5    5.1    0.0000   0.0000          ?        ?   284.1421  17.2401          ?        ?      168.5        5.1       ?       ? 
1 1 1   29   14   40 o    176.5    4.7    0.0000   0.0000          ?        ?   311.5985  16.6016          ?        ?      176.5        4.7       ?       ? 
1 1 1   29   14   41 o    571.8    2.7    0.0000   0.0000          ?        ?  3269.8691  30.6490          ?        ?      571.8        2.7       ?       ? 
1 1 1   29   14   42 o    358.3    2.8    0.0000   0.0000          ?        ?  1284.0670  19.7942          ?        ?      358.3        2.8       ?       ? 
1 1 1   29   14   43 o    284.0    3.3    0.0000   0.0000          ?        ?   807.0914  18.5171          ?        ?      284.0        3.3       ?       ? 
1 1 1   29   14   44 o     84.4    9.5    0.0000   0.0000          ?        ?    71.5144  15.9630          ?        ?       84.4        9.5       ?       ? 
1 1 1   29   14   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   14   46 o    403.4    2.7    0.0000   0.0000          ?        ?  1628.2301  21.7097          ?        ?      403.4        2.7       ?       ? 
1 1 1   29   14   47 o     79.7   10.8    0.0000   0.0000          ?        ?    63.8522  17.2401          ?        ?       79.7       10.8       ?       ? 
1 1 1   29   14   48 o    166.5    5.0    0.0000   0.0000          ?        ?   277.7569  16.6016          ?        ?      166.5        5.0       ?       ? 
1 1 1   29   14   49 o    292.1    3.2    0.0000   0.0000          ?        ?   853.7034  18.5171          ?        ?      292.1        3.2       ?       ? 
1 1 1   29   14   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   14   51 o    444.4    2.7    0.0000   0.0000          ?        ?  1975.5858  24.2638          ?        ?      444.4        2.7       ?       ? 
1 1 1   29   14   52 o    286.1    3.3    0.0000   0.0000          ?        ?   819.2233  19.1556          ?        ?      286.1        3.3       ?       ? 
1 1 1   29   14   53 o     27.7   13.0    0.0000   0.0000          ?        ?   -19.7942  18.5171          ?        ?       27.7       13.0       ?       ? 
1 1 1   29   14   54 o    159.5    5.4    0.0000   0.0000          ?        ?   254.7701  17.2401          ?        ?      159.5        5.4       ?       ? 
1 1 1   29   14   55 o     39.6   15.5    0.0000   0.0000          ?        ?     9.5778  17.8786          ?        ?       39.6       15.5       ?       ? 
1 1 1   29   14   56 o    185.9    5.0    0.0000   0.0000          ?        ?   346.0787  18.5171          ?        ?      185.9        5.0       ?       ? 
1 1 1   29   14   57 o    230.7    4.2    0.0000   0.0000          ?        ?   533.1656  19.1556          ?        ?      230.7        4.2       ?       ? 
1 1 1   29   14   58 o    213.3    4.6    0.0000   0.0000          ?        ?   455.9044  19.7942          ?        ?      213.3        4.6       ?       ? 
1 1 1   29   14   59 o     79.8   12.0    0.0000   0.0000          ?        ?    64.4907  19.1556          ?        ?       79.8       12.0       ?       ? 
1 1 1   29   14   60 o    228.7    4.3    0.0000   0.0000          ?        ?   524.2263  19.7942          ?        ?      228.7        4.3       ?       ? 
1 1 1   29   14   61 o     69.3   15.2    0.0000   0.0000          ?        ?    51.0817  20.4327          ?        ?       69.3       15.2       ?       ? 
1 1 1   29   14   62 o     47.3   16.7    0.0000   0.0000          ?        ?    20.4327  19.7942          ?        ?       47.3       16.7       ?       ? 
1 1 1   29   14   63 o    161.2    6.3    0.0000   0.0000          ?        ?   261.1554  20.4327          ?        ?      161.2        6.3       ?       ? 
1 1 1   29   14   64 o     25.4   12.4    0.0000   0.0000          ?        ?   -36.3957  20.4327          ?        ?       25.4       12.4       ?       ? 
1 1 1   29   14   65 o     67.5   15.9    0.0000   0.0000          ?        ?    49.1662  21.0712          ?        ?       67.5       15.9       ?       ? 
1 1 1   29   14   66 o     21.8   10.9    0.0000   0.0000          ?        ?   -52.9973  19.7942          ?        ?       21.8       10.9       ?       ? 
1 1 1   29   14   67 o    142.7    6.9    0.0000   0.0000          ?        ?   205.6040  19.7942          ?        ?      142.7        6.9       ?       ? 
1 1 1   29   14   68 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   15    0 o    369.6    3.9 1366.4363  28.7335  1366.4363  28.7335  1366.4363  28.7335      369.6      3.9      369.6        3.9     0.0     0.0 
1 1 1   29   15    1 o    461.8    2.8    0.0000   0.0000          ?        ?  2132.6624  25.5409          ?        ?      461.8        2.8       ?       ? 
1 1 1   29   15    2 o    551.5    3.0    0.0000   0.0000          ?        ?  3041.2783  32.5646          ?        ?      551.5        3.0       ?       ? 
1 1 1   29   15    3 o    572.6    2.9    0.0000   0.0000          ?        ?  3278.8086  33.2031          ?        ?      572.6        2.9       ?       ? 
1 1 1   29   15    4 o    513.6    2.9    0.0000   0.0000          ?        ?  2638.3713  30.0105          ?        ?      513.6        2.9       ?       ? 
1 1 1   29   15    5 o    287.1    2.7    0.0000   0.0000          ?        ?   824.3315  15.3245          ?        ?      287.1        2.7       ?       ? 
1 1 1   29   15    6 o    345.0    2.6    0.0000   0.0000          ?        ?  1190.2042  17.8786          ?        ?      345.0        2.6       ?       ? 
1 1 1   29   15    7 o   1028.2    4.1    0.0000   0.0000          ?        ? 10573.2793  84.2849          ?        ?     1028.2        4.1       ?       ? 
1 1 1   29   15    8 o    320.9    2.6    0.0000   0.0000          ?        ?  1029.9354  16.6016          ?        ?      320.9        2.6       ?       ? 
1 1 1   29   15    9 o    437.5    2.3    0.0000   0.0000          ?        ?  1914.2877  20.4327          ?        ?      437.5        2.3       ?       ? 
1 1 1   29   15   10 o   1007.7    4.1    0.0000   0.0000          ?        ? 10155.0479  81.7308          ?        ?     1007.7        4.1       ?       ? 
1 1 1   29   15   11 o    222.4    2.7    0.0000   0.0000          ?        ?   494.8542  12.1319          ?        ?      222.4        2.7       ?       ? 
1 1 1   29   15   12 o    724.2    3.1    0.0000   0.0000          ?        ?  5245.4551  45.3350          ?        ?      724.2        3.1       ?       ? 
1 1 1   29   15   13 o    317.6    2.3    0.0000   0.0000          ?        ?  1008.8642  14.6860          ?        ?      317.6        2.3       ?       ? 
1 1 1   29   15   14 o    333.7    2.4    0.0000   0.0000          ?        ?  1113.5817  15.9630          ?        ?      333.7        2.4       ?       ? 
1 1 1   29   15   15 o    468.1    2.4    0.0000   0.0000          ?        ?  2191.4062  22.3483          ?        ?      468.1        2.4       ?       ? 
1 1 1   29   15   16 o    837.8    3.2    0.0000   0.0000          ?        ?  7019.2686  52.9973          ?        ?      837.8        3.2       ?       ? 
1 1 1   29   15   17 o    696.3    2.8    0.0000   0.0000          ?        ?  4848.2944  39.5883          ?        ?      696.3        2.8       ?       ? 
1 1 1   29   15   18 o    959.4    3.6    0.0000   0.0000          ?        ?  9205.5664  68.3218          ?        ?      959.4        3.6       ?       ? 
1 1 1   29   15   19 o    922.1    3.5    0.0000   0.0000          ?        ?  8503.1924  63.8522          ?        ?      922.1        3.5       ?       ? 
1 1 1   29   15   20 f    553.3    2.5    0.0000   0.0000          ?        ?  3061.7112  28.0950          ?        ?      553.3        2.5       ?       ? 
1 1 1   29   15   21 o    303.1    2.6    0.0000   0.0000          ?        ?   918.8326  15.9630          ?        ?      303.1        2.6       ?       ? 
1 1 1   29   15   22 f    670.6    2.8    0.0000   0.0000          ?        ?  4497.1079  37.0343          ?        ?      670.6        2.8       ?       ? 
1 1 1   29   15   23 o     77.0    8.3    0.0000   0.0000          ?        ?    59.3825  12.7704          ?        ?       77.0        8.3       ?       ? 
1 1 1   29   15   24 o    259.7    3.0    0.0000   0.0000          ?        ?   674.2788  15.3245          ?        ?      259.7        3.0       ?       ? 
1 1 1   29   15   25 o    409.5    2.6    0.0000   0.0000          ?        ?  1677.3964  21.0712          ?        ?      409.5        2.6       ?       ? 
1 1 1   29   15   26 o    856.5    3.3    0.0000   0.0000          ?        ?  7337.2520  56.1899          ?        ?      856.5        3.3       ?       ? 
1 1 1   29   15   27 o    493.4    2.7    0.0000   0.0000          ?        ?  2434.6829  26.1794          ?        ?      493.4        2.7       ?       ? 
1 1 1   29   15   28 o    181.3    3.7    0.0000   0.0000          ?        ?   328.8386  13.4090          ?        ?      181.3        3.7       ?       ? 
1 1 1   29   15   29 o    440.3    2.4    0.0000   0.0000          ?        ?  1938.5518  21.0712          ?        ?      440.3        2.4       ?       ? 
1 1 1   29   15   30 o    351.7    2.6    0.0000   0.0000          ?        ?  1236.8164  18.5171          ?        ?      351.7        2.6       ?       ? 
1 1 1   29   15   31 o    483.2    2.4    0.0000   0.0000          ?        ?  2335.0737  23.6253          ?        ?      483.2        2.4       ?       ? 
1 1 1   29   15   32 o    349.9    2.6    0.0000   0.0000          ?        ?  1224.6844  18.5171          ?        ?      349.9        2.6       ?       ? 
1 1 1   29   15   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   15   34 o    142.0    5.2    0.0000   0.0000          ?        ?   201.7728  14.6860          ?        ?      142.0        5.2       ?       ? 
1 1 1   29   15   35 f    416.0    2.5    0.0000   0.0000          ?        ?  1731.0322  21.0712          ?        ?      416.0        2.5       ?       ? 
1 1 1   29   15   36 o    686.9    2.8    0.0000   0.0000          ?        ?  4719.3130  38.9498          ?        ?      686.9        2.8       ?       ? 
1 1 1   29   15   37 o    225.5    3.7    0.0000   0.0000          ?        ?   508.9017  16.6016          ?        ?      225.5        3.7       ?       ? 
1 1 1   29   15   38 o    423.6    2.5    0.0000   0.0000          ?        ?  1794.8843  21.0712          ?        ?      423.6        2.5       ?       ? 
1 1 1   29   15   39 o    116.0    6.6    0.0000   0.0000          ?        ?   134.7281  15.3245          ?        ?      116.0        6.6       ?       ? 
1 1 1   29   15   40 o    211.4    3.8    0.0000   0.0000          ?        ?   446.9651  15.9630          ?        ?      211.4        3.8       ?       ? 
1 1 1   29   15   41 f    272.5    3.3    0.0000   0.0000          ?        ?   742.6006  17.8786          ?        ?      272.5        3.3       ?       ? 
1 1 1   29   15   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   15   43 o    532.8    2.6    0.0000   0.0000          ?        ?  2839.5059  28.0950          ?        ?      532.8        2.6       ?       ? 
1 1 1   29   15   44 o    473.3    2.8    0.0000   0.0000          ?        ?  2241.2109  26.1794          ?        ?      473.3        2.8       ?       ? 
1 1 1   29   15   45 o    179.1    4.8    0.0000   0.0000          ?        ?   321.1764  17.2401          ?        ?      179.1        4.8       ?       ? 
1 1 1   29   15   46 o    382.6    2.7    0.0000   0.0000          ?        ?  1464.1301  20.4327          ?        ?      382.6        2.7       ?       ? 
1 1 1   29   15   47 o     38.3   15.0    0.0000   0.0000          ?        ?     8.9393  16.6016          ?        ?       38.3       15.0       ?       ? 
1 1 1   29   15   48 o    629.9    2.7    0.0000   0.0000          ?        ?  3969.6890  34.4802          ?        ?      629.9        2.7       ?       ? 
1 1 1   29   15   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   15   50 o    183.3    5.1    0.0000   0.0000          ?        ?   336.5009  18.5171          ?        ?      183.3        5.1       ?       ? 
1 1 1   29   15   51 o    424.7    2.7    0.0000   0.0000          ?        ?  1804.4622  22.9868          ?        ?      424.7        2.7       ?       ? 
1 1 1   29   15   52 o    206.7    4.3    0.0000   0.0000          ?        ?   427.8095  17.8786          ?        ?      206.7        4.3       ?       ? 
1 1 1   29   15   53 o    186.7    5.0    0.0000   0.0000          ?        ?   349.2713  18.5171          ?        ?      186.7        5.0       ?       ? 
1 1 1   29   15   54 o    144.5    6.2    0.0000   0.0000          ?        ?   209.4351  17.8786          ?        ?      144.5        6.2       ?       ? 
1 1 1   29   15   55 o    254.0    4.0    0.0000   0.0000          ?        ?   646.1838  20.4327          ?        ?      254.0        4.0       ?       ? 
1 1 1   29   15   56 o    163.4    5.7    0.0000   0.0000          ?        ?   267.5406  18.5171          ?        ?      163.4        5.7       ?       ? 
1 1 1   29   15   57 o     84.9   11.3    0.0000   0.0000          ?        ?    72.7915  19.1556          ?        ?       84.9       11.3       ?       ? 
1 1 1   29   15   58 o     26.4   12.7    0.0000   0.0000          ?        ?   -29.3720  19.7942          ?        ?       26.4       12.7       ?       ? 
1 1 1   29   15   59 o     21.6   10.8    0.0000   0.0000          ?        ?   -55.5514  19.7942          ?        ?       21.6       10.8       ?       ? 
1 1 1   29   15   60 o    190.3    5.5    0.0000   0.0000          ?        ?   363.3188  21.0712          ?        ?      190.3        5.5       ?       ? 
1 1 1   29   15   61 o    119.9    8.3    0.0000   0.0000          ?        ?   144.9444  19.7942          ?        ?      119.9        8.3       ?       ? 
1 1 1   29   15   62 o     62.2   16.6    0.0000   0.0000          ?        ?    41.5039  21.0712          ?        ?       62.2       16.6       ?       ? 
1 1 1   29   15   63 o     40.4   16.2    0.0000   0.0000          ?        ?     8.9393  19.7942          ?        ?       40.4       16.2       ?       ? 
1 1 1   29   15   64 o    109.1    9.7    0.0000   0.0000          ?        ?   120.6806  21.0712          ?        ?      109.1        9.7       ?       ? 
1 1 1   29   15   65 o    186.1    5.5    0.0000   0.0000          ?        ?   347.9943  20.4327          ?        ?      186.1        5.5       ?       ? 
1 1 1   29   15   66 o     34.4   15.1    0.0000   0.0000          ?        ?    -3.1926  19.7942          ?        ?       34.4       15.1       ?       ? 
1 1 1   29   15   67 o    103.4    9.9    0.0000   0.0000          ?        ?   109.1872  20.4327          ?        ?      103.4        9.9       ?       ? 
1 1 1   29   16    0 o    893.4    5.4 7982.7969  95.7782  7982.7969  95.7782  7982.7969  95.7782      893.4      5.4      893.4        5.4     0.0     0.0 
1 1 1   29   16    1 o    660.5    3.0    0.0000   0.0000          ?        ?  4363.0181  40.2269          ?        ?      660.5        3.0       ?       ? 
1 1 1   29   16    2 o     78.7    8.5    0.0000   0.0000          ?        ?    61.9366  13.4090          ?        ?       78.7        8.5       ?       ? 
1 1 1   29   16    3 o    783.1    3.4    0.0000   0.0000          ?        ?  6133.0000  53.6358          ?        ?      783.1        3.4       ?       ? 
1 1 1   29   16    4 o    165.5    4.1    0.0000   0.0000          ?        ?   273.9258  13.4090          ?        ?      165.5        4.1       ?       ? 
1 1 1   29   16    5 o   1009.9    4.1    0.0000   0.0000          ?        ? 10200.3828  82.3693          ?        ?     1009.9        4.1       ?       ? 
1 1 1   29   16    6 o    861.9    3.6    0.0000   0.0000          ?        ?  7429.8374  61.9366          ?        ?      861.9        3.6       ?       ? 
1 1 1   29   16    7 o   1011.3    4.0    0.0000   0.0000          ?        ? 10229.1162  80.4537          ?        ?     1011.3        4.0       ?       ? 
1 1 1   29   16    8 o    263.1    2.5    0.0000   0.0000          ?        ?   692.1575  13.4090          ?        ?      263.1        2.5       ?       ? 
1 1 1   29   16    9 o    449.6    2.6    0.0000   0.0000          ?        ?  2021.5594  23.6253          ?        ?      449.6        2.6       ?       ? 
1 1 1   29   16   10 o   1136.9    4.2    0.0000   0.0000          ?        ? 12928.1475  95.7782          ?        ?     1136.9        4.2       ?       ? 
1 1 1   29   16   11 o    519.9    2.5    0.0000   0.0000          ?        ?  2703.5005  26.1794          ?        ?      519.9        2.5       ?       ? 
1 1 1   29   16   12 o    743.5    3.0    0.0000   0.0000          ?        ?  5528.3203  44.6965          ?        ?      743.5        3.0       ?       ? 
1 1 1   29   16   13 o    425.5    2.5    0.0000   0.0000          ?        ?  1810.2089  21.0712          ?        ?      425.5        2.5       ?       ? 
1 1 1   29   16   14 o    990.1    3.8    0.0000   0.0000          ?        ?  9805.1377  75.9841          ?        ?      990.1        3.8       ?       ? 
1 1 1   29   16   15 o    397.4    2.4    0.0000   0.0000          ?        ?  1579.0640  19.1556          ?        ?      397.4        2.4       ?       ? 
1 1 1   29   16   16 o    772.3    3.1    0.0000   0.0000          ?        ?  5965.0693  47.8891          ?        ?      772.3        3.1       ?       ? 
1 1 1   29   16   17 o    324.0    2.4    0.0000   0.0000          ?        ?  1049.7295  15.3245          ?        ?      324.0        2.4       ?       ? 
1 1 1   29   16   18 o    235.4    2.8    0.0000   0.0000          ?        ?   554.2368  13.4090          ?        ?      235.4        2.8       ?       ? 
1 1 1   29   16   19 o    854.6    3.3    0.0000   0.0000          ?        ?  7304.6875  56.1899          ?        ?      854.6        3.3       ?       ? 
1 1 1   29   16   20 o    552.4    2.5    0.0000   0.0000          ?        ?  3052.1333  27.4564          ?        ?      552.4        2.5       ?       ? 
1 1 1   29   16   21 o    427.7    2.4    0.0000   0.0000          ?        ?  1829.3645  20.4327          ?        ?      427.7        2.4       ?       ? 
1 1 1   29   16   22 o    417.0    2.4    0.0000   0.0000          ?        ?  1739.3329  20.4327          ?        ?      417.0        2.4       ?       ? 
1 1 1   29   16   23 o    546.5    2.5    0.0000   0.0000          ?        ?  2987.0042  26.8179          ?        ?      546.5        2.5       ?       ? 
1 1 1   29   16   24 f    116.3    5.2    0.0000   0.0000          ?        ?   135.3666  12.1319          ?        ?      116.3        5.2       ?       ? 
1 1 1   29   16   25 o    475.8    2.5    0.0000   0.0000          ?        ?  2264.1978  23.6253          ?        ?      475.8        2.5       ?       ? 
1 1 1   29   16   26 o    489.2    2.5    0.0000   0.0000          ?        ?  2393.1790  24.2638          ?        ?      489.2        2.5       ?       ? 
1 1 1   29   16   27 f    126.6    5.3    0.0000   0.0000          ?        ?   160.2689  13.4090          ?        ?      126.6        5.3       ?       ? 
1 1 1   29   16   28 o    338.5    2.5    0.0000   0.0000          ?        ?  1146.1464  17.2401          ?        ?      338.5        2.5       ?       ? 
1 1 1   29   16   29 o    369.5    2.5    0.0000   0.0000          ?        ?  1365.7977  18.5171          ?        ?      369.5        2.5       ?       ? 
1 1 1   29   16   30 o    269.7    3.1    0.0000   0.0000          ?        ?   727.2761  16.6016          ?        ?      269.7        3.1       ?       ? 
1 1 1   29   16   31 o    144.0    5.1    0.0000   0.0000          ?        ?   207.5195  14.6860          ?        ?      144.0        5.1       ?       ? 
1 1 1   29   16   32 o    279.0    3.0    0.0000   0.0000          ?        ?   778.3578  16.6016          ?        ?      279.0        3.0       ?       ? 
1 1 1   29   16   33 o    330.0    2.6    0.0000   0.0000          ?        ?  1089.3180  17.2401          ?        ?      330.0        2.6       ?       ? 
1 1 1   29   16   34 o    383.9    2.7    0.0000   0.0000          ?        ?  1473.7079  20.4327          ?        ?      383.9        2.7       ?       ? 
1 1 1   29   16   35 o    750.7    3.0    0.0000   0.0000          ?        ?  5637.5078  45.3350          ?        ?      750.7        3.0       ?       ? 
1 1 1   29   16   36 o    126.5    6.6    0.0000   0.0000          ?        ?   160.2689  16.6016          ?        ?      126.5        6.6       ?       ? 
1 1 1   29   16   37 o    633.8    2.8    0.0000   0.0000          ?        ?  4017.5781  35.1187          ?        ?      633.8        2.8       ?       ? 
1 1 1   29   16   38 o    364.2    2.7    0.0000   0.0000          ?        ?  1326.8479  19.7942          ?        ?      364.2        2.7       ?       ? 
1 1 1   29   16   39 o    299.4    2.9    0.0000   0.0000          ?        ?   896.4843  17.2401          ?        ?      299.4        2.9       ?       ? 
1 1 1   29   16   40 o    913.4    3.4    0.0000   0.0000          ?        ?  8346.1162  61.9366          ?        ?      913.4        3.4       ?       ? 
1 1 1   29   16   41 o     58.9   14.7    0.0000   0.0000          ?        ?    36.3957  17.2401          ?        ?       58.9       14.7       ?       ? 
1 1 1   29   16   42 o    192.2    4.3    0.0000   0.0000          ?        ?   369.7040  16.6016          ?        ?      192.2        4.3       ?       ? 
1 1 1   29   16   43 o    512.6    2.7    0.0000   0.0000          ?        ?  2628.7937  27.4564          ?        ?      512.6        2.7       ?       ? 
1 1 1   29   16   44 o     19.6    9.8    0.0000   0.0000          ?        ?   -44.0580  15.9630          ?        ?       19.6        9.8       ?       ? 
1 1 1   29   16   45 o     90.6    8.8    0.0000   0.0000          ?        ?    82.3693  15.9630          ?        ?       90.6        8.8       ?       ? 
1 1 1   29   16   46 o    193.5    4.5    0.0000   0.0000          ?        ?   374.8122  17.2401          ?        ?      193.5        4.5       ?       ? 
1 1 1   29   16   47 o    283.1    3.3    0.0000   0.0000          ?        ?   801.9832  18.5171          ?        ?      283.1        3.3       ?       ? 
1 1 1   29   16   48 o    254.8    3.8    0.0000   0.0000          ?        ?   650.0150  19.1556          ?        ?      254.8        3.8       ?       ? 
1 1 1   29   16   49 o    552.9    2.8    0.0000   0.0000          ?        ?  3058.5186  30.6490          ?        ?      552.9        2.8       ?       ? 
1 1 1   29   16   50 o    208.1    4.3    0.0000   0.0000          ?        ?   433.5562  17.8786          ?        ?      208.1        4.3       ?       ? 
1 1 1   29   16   51 o    341.6    3.1    0.0000   0.0000          ?        ?  1167.8560  21.0712          ?        ?      341.6        3.1       ?       ? 
1 1 1   29   16   52 o    131.3    6.8    0.0000   0.0000          ?        ?   173.0394  17.8786          ?        ?      131.3        6.8       ?       ? 
1 1 1   29   16   53 o    211.2    4.7    0.0000   0.0000          ?        ?   446.9651  19.7942          ?        ?      211.2        4.7       ?       ? 
1 1 1   29   16   54 o     72.4   13.7    0.0000   0.0000          ?        ?    54.9129  19.1556          ?        ?       72.4       13.7       ?       ? 
1 1 1   29   16   55 o     27.8   13.1    0.0000   0.0000          ?        ?   -19.1556  18.5171          ?        ?       27.8       13.1       ?       ? 
1 1 1   29   16   56 o     22.3   11.1    0.0000   0.0000          ?        ?   -51.0817  19.7942          ?        ?       22.3       11.1       ?       ? 
1 1 1   29   16   57 o     57.3   16.4    0.0000   0.0000          ?        ?    34.4802  19.7942          ?        ?       57.3       16.4       ?       ? 
1 1 1   29   16   58 o    184.7    5.5    0.0000   0.0000          ?        ?   342.2476  20.4327          ?        ?      184.7        5.5       ?       ? 
1 1 1   29   16   59 o    200.4    5.1    0.0000   0.0000          ?        ?   402.9071  20.4327          ?        ?      200.4        5.1       ?       ? 
1 1 1   29   16   60 o    249.8    4.3    0.0000   0.0000          ?        ?   625.1127  21.7097          ?        ?      249.8        4.3       ?       ? 
1 1 1   29   16   61 o    219.0    4.7    0.0000   0.0000          ?        ?   480.8068  20.4327          ?        ?      219.0        4.7       ?       ? 
1 1 1   29   16   62 o    142.0    7.0    0.0000   0.0000          ?        ?   203.0499  19.7942          ?        ?      142.0        7.0       ?       ? 
1 1 1   29   16   63 o    152.2    6.7    0.0000   0.0000          ?        ?   233.0604  20.4327          ?        ?      152.2        6.7       ?       ? 
1 1 1   29   16   64 o    102.5    9.7    0.0000   0.0000          ?        ?   106.6331  19.7942          ?        ?      102.5        9.7       ?       ? 
1 1 1   29   16   65 o    122.2    8.4    0.0000   0.0000          ?        ?   151.3296  20.4327          ?        ?      122.2        8.4       ?       ? 
1 1 1   29   16   66 o    201.2    5.1    0.0000   0.0000          ?        ?   406.7383  20.4327          ?        ?      201.2        5.1       ?       ? 
1 1 1   29   17    0 o   1177.5    6.8 13869.3291 159.6304 13869.3291 159.6304 13869.3291 159.6304     1177.5      6.8     1177.5        6.8     0.0     0.0 
1 1 1   29   17    1 o    823.1    3.7    0.0000   0.0000          ?        ?  6775.9912  61.2981          ?        ?      823.1        3.7       ?       ? 
1 1 1   29   17    2 o    824.0    3.6    0.0000   0.0000          ?        ?  6790.6777  58.7440          ?        ?      824.0        3.6       ?       ? 
1 1 1   29   17    3 o    445.8    2.6    0.0000   0.0000          ?        ?  1987.7178  23.6253          ?        ?      445.8        2.6       ?       ? 
1 1 1   29   17    4 o    596.5    2.9    0.0000   0.0000          ?        ?  3557.8425  34.4802          ?        ?      596.5        2.9       ?       ? 
1 1 1   29   17    5 o    496.4    2.8    0.0000   0.0000          ?        ?  2464.0549  28.0950          ?        ?      496.4        2.8       ?       ? 
1 1 1   29   17    6 o    745.5    3.2    0.0000   0.0000          ?        ?  5558.9692  47.2506          ?        ?      745.5        3.2       ?       ? 
1 1 1   29   17    7 o   1172.5    4.4    0.0000   0.0000          ?        ? 13749.9238 102.1635          ?        ?     1172.5        4.4       ?       ? 
1 1 1   29   17    8 o    577.5    2.7    0.0000   0.0000          ?        ?  3334.9983  31.2876          ?        ?      577.5        2.7       ?       ? 
1 1 1   29   17    9 o    473.9    2.7    0.0000   0.0000          ?        ?  2246.3191  25.5409          ?        ?      473.9        2.7       ?       ? 
1 1 1   29   17   10 o    627.1    2.7    0.0000   0.0000          ?        ?  3932.6548  33.8416          ?        ?      627.1        2.7       ?       ? 
1 1 1   29   17   11 o    560.0    2.5    0.0000   0.0000          ?        ?  3136.4182  27.4564          ?        ?      560.0        2.5       ?       ? 
1 1 1   29   17   12 o    224.0    2.4    0.0000   0.0000          ?        ?   501.8780  10.8549          ?        ?      224.0        2.4       ?       ? 
1 1 1   29   17   13 o    350.0    2.3    0.0000   0.0000          ?        ?  1225.3230  15.9630          ?        ?      350.0        2.3       ?       ? 
1 1 1   29   17   14 o    526.2    2.4    0.0000   0.0000          ?        ?  2769.2683  25.5409          ?        ?      526.2        2.4       ?       ? 
1 1 1   29   17   15 o    362.0    2.3    0.0000   0.0000          ?        ?  1310.2463  16.6016          ?        ?      362.0        2.3       ?       ? 
1 1 1   29   17   16 o    354.3    2.5    0.0000   0.0000          ?        ?  1255.3335  17.8786          ?        ?      354.3        2.5       ?       ? 
1 1 1   29   17   17 o    199.3    3.4    0.0000   0.0000          ?        ?   397.1605  13.4090          ?        ?      199.3        3.4       ?       ? 
1 1 1   29   17   18 o    258.4    2.6    0.0000   0.0000          ?        ?   667.8936  13.4090          ?        ?      258.4        2.6       ?       ? 
1 1 1   29   17   19 o    572.0    2.7    0.0000   0.0000          ?        ?  3272.4233  30.6490          ?        ?      572.0        2.7       ?       ? 
1 1 1   29   17   20 o    266.3    2.5    0.0000   0.0000          ?        ?   709.3975  13.4090          ?        ?      266.3        2.5       ?       ? 
1 1 1   29   17   21 o     89.7    6.4    0.0000   0.0000          ?        ?    80.4537  11.4934          ?        ?       89.7        6.4       ?       ? 
1 1 1   29   17   22 o    550.4    2.5    0.0000   0.0000          ?        ?  3029.7852  27.4564          ?        ?      550.4        2.5       ?       ? 
1 1 1   29   17   23 o    169.1    3.8    0.0000   0.0000          ?        ?   286.0577  12.7704          ?        ?      169.1        3.8       ?       ? 
1 1 1   29   17   24 o    527.5    2.5    0.0000   0.0000          ?        ?  2782.6772  26.1794          ?        ?      527.5        2.5       ?       ? 
1 1 1   29   17   25 o    395.2    2.5    0.0000   0.0000          ?        ?  1561.8240  19.7942          ?        ?      395.2        2.5       ?       ? 
1 1 1   29   17   26 o    400.9    2.5    0.0000   0.0000          ?        ?  1607.7975  19.7942          ?        ?      400.9        2.5       ?       ? 
1 1 1   29   17   27 o    371.4    2.6    0.0000   0.0000          ?        ?  1379.8452  19.1556          ?        ?      371.4        2.6       ?       ? 
1 1 1   29   17   28 o    341.7    2.6    0.0000   0.0000          ?        ?  1167.8560  17.8786          ?        ?      341.7        2.6       ?       ? 
1 1 1   29   17   29 o    444.9    2.4    0.0000   0.0000          ?        ?  1979.4170  21.7097          ?        ?      444.9        2.4       ?       ? 
1 1 1   29   17   30 o    509.0    2.7    0.0000   0.0000          ?        ?  2591.7593  27.4564          ?        ?      509.0        2.7       ?       ? 
1 1 1   29   17   31 o    832.2    3.2    0.0000   0.0000          ?        ?  6927.9595  53.6358          ?        ?      832.2        3.2       ?       ? 
1 1 1   29   17   32 o     85.6    9.3    0.0000   0.0000          ?        ?    73.4300  15.9630          ?        ?       85.6        9.3       ?       ? 
1 1 1   29   17   33 o    357.0    2.9    0.0000   0.0000          ?        ?  1274.4893  20.4327          ?        ?      357.0        2.9       ?       ? 
1 1 1   29   17   34 o    603.9    2.7    0.0000   0.0000          ?        ?  3647.8740  33.2031          ?        ?      603.9        2.7       ?       ? 
1 1 1   29   17   35 o    114.6    8.1    0.0000   0.0000          ?        ?   131.5355  18.5171          ?        ?      114.6        8.1       ?       ? 
1 1 1   29   17   36 o     40.4   14.4    0.0000   0.0000          ?        ?    14.0475  14.6860          ?        ?       40.4       14.4       ?       ? 
1 1 1   29   17   37 o    263.7    3.1    0.0000   0.0000          ?        ?   695.3500  16.6016          ?        ?      263.7        3.1       ?       ? 
1 1 1   29   17   38 o    501.1    2.6    0.0000   0.0000          ?        ?  2511.9441  26.1794          ?        ?      501.1        2.6       ?       ? 
1 1 1   29   17   39 o    235.6    3.5    0.0000   0.0000          ?        ?   555.5138  16.6016          ?        ?      235.6        3.5       ?       ? 
1 1 1   29   17   40 o    588.4    2.7    0.0000   0.0000          ?        ?  3463.3416  31.9261          ?        ?      588.4        2.7       ?       ? 
1 1 1   29   17   41 o    143.5    5.8    0.0000   0.0000          ?        ?   206.2425  16.6016          ?        ?      143.5        5.8       ?       ? 
1 1 1   29   17   42 o    339.1    2.9    0.0000   0.0000          ?        ?  1150.6160  19.7942          ?        ?      339.1        2.9       ?       ? 
1 1 1   29   17   43 f    598.7    2.8    0.0000   0.0000          ?        ?  3585.9373  33.2031          ?        ?      598.7        2.8       ?       ? 
1 1 1   29   17   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   17   45 o     23.9   11.7    0.0000   0.0000          ?        ?   -31.9261  17.8786          ?        ?       23.9       11.7       ?       ? 
1 1 1   29   17   46 f    397.2    3.0    0.0000   0.0000          ?        ?  1578.4254  23.6253          ?        ?      397.2        3.0       ?       ? 
1 1 1   29   17   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   17   48 o    380.4    2.9    0.0000   0.0000          ?        ?  1448.1671  22.3483          ?        ?      380.4        2.9       ?       ? 
1 1 1   29   17   49 o    377.8    2.9    0.0000   0.0000          ?        ?  1428.3728  21.7097          ?        ?      377.8        2.9       ?       ? 
1 1 1   29   17   50 o    255.2    3.8    0.0000   0.0000          ?        ?   651.9305  19.1556          ?        ?      255.2        3.8       ?       ? 
1 1 1   29   17   51 o     77.5   11.5    0.0000   0.0000          ?        ?    60.6596  17.8786          ?        ?       77.5       11.5       ?       ? 
1 1 1   29   17   52 o     59.8   15.8    0.0000   0.0000          ?        ?    37.6728  19.1556          ?        ?       59.8       15.8       ?       ? 
1 1 1   29   17   53 o    125.8    7.6    0.0000   0.0000          ?        ?   158.9919  19.1556          ?        ?      125.8        7.6       ?       ? 
1 1 1   29   17   54 o    288.2    3.8    0.0000   0.0000          ?        ?   831.3552  21.7097          ?        ?      288.2        3.8       ?       ? 
1 1 1   29   17   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   17   56 o    108.9    9.1    0.0000   0.0000          ?        ?   119.4035  19.7942          ?        ?      108.9        9.1       ?       ? 
1 1 1   29   17   57 o     25.3   12.2    0.0000   0.0000          ?        ?   -31.2876  19.1556          ?        ?       25.3       12.2       ?       ? 
1 1 1   29   17   58 o    421.1    3.0    0.0000   0.0000          ?        ?  1775.0901  24.9023          ?        ?      421.1        3.0       ?       ? 
1 1 1   29   17   59 o    281.1    3.9    0.0000   0.0000          ?        ?   791.7668  21.7097          ?        ?      281.1        3.9       ?       ? 
1 1 1   29   17   60 o    148.4    6.7    0.0000   0.0000          ?        ?   221.5670  19.7942          ?        ?      148.4        6.7       ?       ? 
1 1 1   29   17   61 o     28.2   13.4    0.0000   0.0000          ?        ?   -24.2638  20.4327          ?        ?       28.2       13.4       ?       ? 
1 1 1   29   17   62 o    107.2    8.9    0.0000   0.0000          ?        ?   116.2109  19.1556          ?        ?      107.2        8.9       ?       ? 
1 1 1   29   17   63 o     79.7   12.4    0.0000   0.0000          ?        ?    65.1292  19.7942          ?        ?       79.7       12.4       ?       ? 
1 1 1   29   17   64 o     70.0   14.2    0.0000   0.0000          ?        ?    52.3588  19.1556          ?        ?       70.0       14.2       ?       ? 
1 1 1   29   17   65 o     40.2   15.8    0.0000   0.0000          ?        ?    10.8549  18.5171          ?        ?       40.2       15.8       ?       ? 
1 1 1   29   18    0 o    740.3    4.7 5481.7080  70.2374  5481.7080  70.2374  5481.7080  70.2374      740.3      4.7      740.3        4.7     0.0     0.0 
1 1 1   29   18    1 o    277.9    2.8    0.0000   0.0000          ?        ?   772.6111  15.3245          ?        ?      277.9        2.8       ?       ? 
1 1 1   29   18    2 o    482.6    2.7    0.0000   0.0000          ?        ?  2329.3269  26.1794          ?        ?      482.6        2.7       ?       ? 
1 1 1   29   18    3 o     64.4    8.4    0.0000   0.0000          ?        ?    41.5039  10.8549          ?        ?       64.4        8.4       ?       ? 
1 1 1   29   18    4 o    449.5    2.6    0.0000   0.0000          ?        ?  2020.9209  23.6253          ?        ?      449.5        2.6       ?       ? 
1 1 1   29   18    5 o    892.3    3.6    0.0000   0.0000          ?        ?  7963.0029  64.4907          ?        ?      892.3        3.6       ?       ? 
1 1 1   29   18    6 o    259.3    2.8    0.0000   0.0000          ?        ?   672.3633  14.6860          ?        ?      259.3        2.8       ?       ? 
1 1 1   29   18    7 o    473.3    2.4    0.0000   0.0000          ?        ?  2240.5723  22.9868          ?        ?      473.3        2.4       ?       ? 
1 1 1   29   18    8 o    444.4    2.4    0.0000   0.0000          ?        ?  1974.9473  21.7097          ?        ?      444.4        2.4       ?       ? 
1 1 1   29   18    9 o    861.4    3.4    0.0000   0.0000          ?        ?  7420.8979  58.1055          ?        ?      861.4        3.4       ?       ? 
1 1 1   29   18   10 o   1168.1    4.4    0.0000   0.0000          ?        ? 13648.3994 102.1635          ?        ?     1168.1        4.4       ?       ? 
1 1 1   29   18   11 o    358.9    2.2    0.0000   0.0000          ?        ?  1287.8981  15.9630          ?        ?      358.9        2.2       ?       ? 
1 1 1   29   18   12 o    319.2    2.2    0.0000   0.0000          ?        ?  1019.0806  14.0475          ?        ?      319.2        2.2       ?       ? 
1 1 1   29   18   13 o    591.8    2.5    0.0000   0.0000          ?        ?  3502.2910  30.0105          ?        ?      591.8        2.5       ?       ? 
1 1 1   29   18   14 o    683.8    2.8    0.0000   0.0000          ?        ?  4676.5327  38.9498          ?        ?      683.8        2.8       ?       ? 
1 1 1   29   18   15 o    318.5    2.3    0.0000   0.0000          ?        ?  1014.6108  14.6860          ?        ?      318.5        2.3       ?       ? 
1 1 1   29   18   16 o    551.0    2.5    0.0000   0.0000          ?        ?  3036.8088  28.0950          ?        ?      551.0        2.5       ?       ? 
1 1 1   29   18   17 o    634.9    2.8    0.0000   0.0000          ?        ?  4031.6257  35.7572          ?        ?      634.9        2.8       ?       ? 
1 1 1   29   18   18 o    615.4    2.7    0.0000   0.0000          ?        ?  3787.0715  33.2031          ?        ?      615.4        2.7       ?       ? 
1 1 1   29   18   19 o     22.2   10.4    0.0000   0.0000          ?        ?   -11.4934  11.4934          ?        ?       22.2       10.4       ?       ? 
1 1 1   29   18   20 o    428.1    2.5    0.0000   0.0000          ?        ?  1832.5571  21.0712          ?        ?      428.1        2.5       ?       ? 
1 1 1   29   18   21 o    229.1    3.1    0.0000   0.0000          ?        ?   524.8647  14.0475          ?        ?      229.1        3.1       ?       ? 
1 1 1   29   18   22 o    447.2    2.5    0.0000   0.0000          ?        ?  1999.8499  22.3483          ?        ?      447.2        2.5       ?       ? 
1 1 1   29   18   23 o    145.8    4.6    0.0000   0.0000          ?        ?   212.6277  13.4090          ?        ?      145.8        4.6       ?       ? 
1 1 1   29   18   24 o    490.3    2.6    0.0000   0.0000          ?        ?  2404.0339  25.5409          ?        ?      490.3        2.6       ?       ? 
1 1 1   29   18   25 o    154.5    4.3    0.0000   0.0000          ?        ?   238.8071  13.4090          ?        ?      154.5        4.3       ?       ? 
1 1 1   29   18   26 o    801.6    3.1    0.0000   0.0000          ?        ?  6427.3584  50.4432          ?        ?      801.6        3.1       ?       ? 
1 1 1   29   18   27 o    146.0    4.8    0.0000   0.0000          ?        ?   213.2662  14.0475          ?        ?      146.0        4.8       ?       ? 
1 1 1   29   18   28 o    129.1    4.9    0.0000   0.0000          ?        ?   166.6541  12.7704          ?        ?      129.1        4.9       ?       ? 
1 1 1   29   18   29 o    311.8    2.7    0.0000   0.0000          ?        ?   972.4684  16.6016          ?        ?      311.8        2.7       ?       ? 
1 1 1   29   18   30 o    198.0    3.5    0.0000   0.0000          ?        ?   392.0523  14.0475          ?        ?      198.0        3.5       ?       ? 
1 1 1   29   18   31 o    136.3    5.2    0.0000   0.0000          ?        ?   185.8098  14.0475          ?        ?      136.3        5.2       ?       ? 
1 1 1   29   18   32 o    411.0    2.6    0.0000   0.0000          ?        ?  1689.5283  21.0712          ?        ?      411.0        2.6       ?       ? 
1 1 1   29   18   33 o    151.6    4.8    0.0000   0.0000          ?        ?   229.8678  14.6860          ?        ?      151.6        4.8       ?       ? 
1 1 1   29   18   34 o     86.0    8.5    0.0000   0.0000          ?        ?    74.0685  14.6860          ?        ?       86.0        8.5       ?       ? 
1 1 1   29   18   35 o    302.7    3.2    0.0000   0.0000          ?        ?   916.2786  19.1556          ?        ?      302.7        3.2       ?       ? 
1 1 1   29   18   36 o    282.7    3.0    0.0000   0.0000          ?        ?   799.4291  17.2401          ?        ?      282.7        3.0       ?       ? 
1 1 1   29   18   37 o    296.9    3.2    0.0000   0.0000          ?        ?   881.7984  19.1556          ?        ?      296.9        3.2       ?       ? 
1 1 1   29   18   38 o    668.9    2.9    0.0000   0.0000          ?        ?  4475.3984  38.3113          ?        ?      668.9        2.9       ?       ? 
1 1 1   29   18   39 o    426.3    2.7    0.0000   0.0000          ?        ?  1817.8711  22.9868          ?        ?      426.3        2.7       ?       ? 
1 1 1   29   18   40 o    291.2    3.3    0.0000   0.0000          ?        ?   848.5952  19.1556          ?        ?      291.2        3.3       ?       ? 
1 1 1   29   18   41 o    544.9    2.7    0.0000   0.0000          ?        ?  2969.7642  29.3720          ?        ?      544.9        2.7       ?       ? 
1 1 1   29   18   42 o    483.6    2.6    0.0000   0.0000          ?        ?  2339.5432  25.5409          ?        ?      483.6        2.6       ?       ? 
1 1 1   29   18   43 o    129.7    6.9    0.0000   0.0000          ?        ?   168.5697  17.8786          ?        ?      129.7        6.9       ?       ? 
1 1 1   29   18   44 o    168.3    4.9    0.0000   0.0000          ?        ?   283.5036  16.6016          ?        ?      168.3        4.9       ?       ? 
1 1 1   29   18   45 o    198.2    4.5    0.0000   0.0000          ?        ?   393.3293  17.8786          ?        ?      198.2        4.5       ?       ? 
1 1 1   29   18   46 o    376.4    2.9    0.0000   0.0000          ?        ?  1417.5181  21.7097          ?        ?      376.4        2.9       ?       ? 
1 1 1   29   18   47 o     57.4   15.7    0.0000   0.0000          ?        ?    34.4802  18.5171          ?        ?       57.4       15.7       ?       ? 
1 1 1   29   18   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   18   49 o    194.3    4.8    0.0000   0.0000          ?        ?   378.0048  18.5171          ?        ?      194.3        4.8       ?       ? 
1 1 1   29   18   50 o    169.3    5.5    0.0000   0.0000          ?        ?   287.3347  18.5171          ?        ?      169.3        5.5       ?       ? 
1 1 1   29   18   51 o    137.0    6.8    0.0000   0.0000          ?        ?   188.3639  18.5171          ?        ?      137.0        6.8       ?       ? 
1 1 1   29   18   52 o    127.1    7.5    0.0000   0.0000          ?        ?   162.1845  19.1556          ?        ?      127.1        7.5       ?       ? 
1 1 1   29   18   53 o     40.4   15.8    0.0000   0.0000          ?        ?    10.2163  18.5171          ?        ?       40.4       15.8       ?       ? 
1 1 1   29   18   54 o    345.4    3.3    0.0000   0.0000          ?        ?  1194.0354  22.9868          ?        ?      345.4        3.3       ?       ? 
1 1 1   29   18   55 o    154.2    6.4    0.0000   0.0000          ?        ?   238.8071  19.7942          ?        ?      154.2        6.4       ?       ? 
1 1 1   29   18   56 o    110.9    8.9    0.0000   0.0000          ?        ?   123.8732  19.7942          ?        ?      110.9        8.9       ?       ? 
1 1 1   29   18   57 o    180.2    5.3    0.0000   0.0000          ?        ?   325.6460  19.1556          ?        ?      180.2        5.3       ?       ? 
1 1 1   29   18   58 o    225.9    4.5    0.0000   0.0000          ?        ?   511.4558  20.4327          ?        ?      225.9        4.5       ?       ? 
1 1 1   29   18   59 o    185.7    5.3    0.0000   0.0000          ?        ?   346.0787  19.7942          ?        ?      185.7        5.3       ?       ? 
1 1 1   29   18   60 o     84.2   11.8    0.0000   0.0000          ?        ?    72.1529  19.7942          ?        ?       84.2       11.8       ?       ? 
1 1 1   29   18   61 o    213.8    4.6    0.0000   0.0000          ?        ?   458.4586  19.7942          ?        ?      213.8        4.6       ?       ? 
1 1 1   29   18   62 f    416.9    2.8    0.0000   0.0000          ?        ?  1739.9714  23.6253          ?        ?      416.9        2.8       ?       ? 
1 1 1   29   18   63 o    191.0    5.2    0.0000   0.0000          ?        ?   366.5114  19.7942          ?        ?      191.0        5.2       ?       ? 
1 1 1   29   18   64 o     64.1   15.6    0.0000   0.0000          ?        ?    44.6965  19.7942          ?        ?       64.1       15.6       ?       ? 
1 1 1   29   18   65 o    103.5    9.2    0.0000   0.0000          ?        ?   109.1872  19.1556          ?        ?      103.5        9.2       ?       ? 
1 1 1   29   19    0 o     18.4   13.3  -39.5883  23.6253   -39.5883  23.6253   -39.5883  23.6253       18.4     13.3       18.4       13.3     0.0     0.0 
1 1 1   29   19    1 o    567.7    2.8    0.0000   0.0000          ?        ?  3223.2571  31.2876          ?        ?      567.7        2.8       ?       ? 
1 1 1   29   19    2 o    452.7    2.5    0.0000   0.0000          ?        ?  2049.6545  22.9868          ?        ?      452.7        2.5       ?       ? 
1 1 1   29   19    3 o    523.2    2.6    0.0000   0.0000          ?        ?  2737.9807  27.4564          ?        ?      523.2        2.6       ?       ? 
1 1 1   29   19    4 o    646.2    2.9    0.0000   0.0000          ?        ?  4175.9316  37.6728          ?        ?      646.2        2.9       ?       ? 
1 1 1   29   19    5 o    477.6    2.8    0.0000   0.0000          ?        ?  2281.4377  26.8179          ?        ?      477.6        2.8       ?       ? 
1 1 1   29   19    6 o    326.7    2.6    0.0000   0.0000          ?        ?  1067.6082  17.2401          ?        ?      326.7        2.6       ?       ? 
1 1 1   29   19    7 o    141.4    4.1    0.0000   0.0000          ?        ?   199.8573  11.4934          ?        ?      141.4        4.1       ?       ? 
1 1 1   29   19    8 o   1112.3    4.2    0.0000   0.0000          ?        ? 12373.9111  94.5012          ?        ?     1112.3        4.2       ?       ? 
1 1 1   29   19    9 o    147.8    3.5    0.0000   0.0000          ?        ?   218.3744  10.2163          ?        ?      147.8        3.5       ?       ? 
1 1 1   29   19   10 o    391.4    2.4    0.0000   0.0000          ?        ?  1531.8134  18.5171          ?        ?      391.4        2.4       ?       ? 
1 1 1   29   19   11 o    524.1    2.7    0.0000   0.0000          ?        ?  2746.9202  28.0950          ?        ?      524.1        2.7       ?       ? 
1 1 1   29   19   12 o    408.7    2.2    0.0000   0.0000          ?        ?  1670.3726  17.8786          ?        ?      408.7        2.2       ?       ? 
1 1 1   29   19   13 o    387.0    2.1    0.0000   0.0000          ?        ?  1497.9718  16.6016          ?        ?      387.0        2.1       ?       ? 
1 1 1   29   19   14 o    374.5    2.2    0.0000   0.0000          ?        ?  1402.8320  16.6016          ?        ?      374.5        2.2       ?       ? 
1 1 1   29   19   15 o    337.8    2.4    0.0000   0.0000          ?        ?  1141.0381  15.9630          ?        ?      337.8        2.4       ?       ? 
1 1 1   29   19   16 o    224.9    2.7    0.0000   0.0000          ?        ?   505.7091  12.1319          ?        ?      224.9        2.7       ?       ? 
1 1 1   29   19   17 o    557.2    2.5    0.0000   0.0000          ?        ?  3104.4922  28.0950          ?        ?      557.2        2.5       ?       ? 
1 1 1   29   19   18 o    424.6    2.4    0.0000   0.0000          ?        ?  1803.1851  20.4327          ?        ?      424.6        2.4       ?       ? 
1 1 1   29   19   19 o    321.0    2.4    0.0000   0.0000          ?        ?  1030.5739  15.3245          ?        ?      321.0        2.4       ?       ? 
1 1 1   29   19   20 o    640.2    2.7    0.0000   0.0000          ?        ?  4098.6704  34.4802          ?        ?      640.2        2.7       ?       ? 
1 1 1   29   19   21 o    394.0    2.3    0.0000   0.0000          ?        ?  1552.8845  18.5171          ?        ?      394.0        2.3       ?       ? 
1 1 1   29   19   22 o    329.1    2.5    0.0000   0.0000          ?        ?  1082.9327  16.6016          ?        ?      329.1        2.5       ?       ? 
1 1 1   29   19   23 o    241.0    3.0    0.0000   0.0000          ?        ?   581.0547  14.6860          ?        ?      241.0        3.0       ?       ? 
1 1 1   29   19   24 o    408.2    2.6    0.0000   0.0000          ?        ?  1666.5415  21.0712          ?        ?      408.2        2.6       ?       ? 
1 1 1   29   19   25 o    754.7    3.1    0.0000   0.0000          ?        ?  5697.5283  46.6121          ?        ?      754.7        3.1       ?       ? 
1 1 1   29   19   26 o    241.3    3.2    0.0000   0.0000          ?        ?   582.3317  15.3245          ?        ?      241.3        3.2       ?       ? 
1 1 1   29   19   27 o    121.9    5.2    0.0000   0.0000          ?        ?   148.7755  12.7704          ?        ?      121.9        5.2       ?       ? 
1 1 1   29   19   28 o     20.2   10.0    0.0000   0.0000          ?        ?   -29.3720  14.0475          ?        ?       20.2       10.0       ?       ? 
1 1 1   29   19   29 o    406.5    2.4    0.0000   0.0000          ?        ?  1652.4939  19.7942          ?        ?      406.5        2.4       ?       ? 
1 1 1   29   19   30 o    307.1    2.9    0.0000   0.0000          ?        ?   943.0964  17.8786          ?        ?      307.1        2.9       ?       ? 
1 1 1   29   19   31 o    180.1    3.9    0.0000   0.0000          ?        ?   324.3690  14.0475          ?        ?      180.1        3.9       ?       ? 
1 1 1   29   19   32 o    394.4    2.5    0.0000   0.0000          ?        ?  1556.0771  19.7942          ?        ?      394.4        2.5       ?       ? 
1 1 1   29   19   33 o     62.2   12.2    0.0000   0.0000          ?        ?    40.2269  14.6860          ?        ?       62.2       12.2       ?       ? 
1 1 1   29   19   34 o    416.1    2.6    0.0000   0.0000          ?        ?  1731.6708  21.7097          ?        ?      416.1        2.6       ?       ? 
1 1 1   29   19   35 o    180.1    4.1    0.0000   0.0000          ?        ?   324.3690  14.6860          ?        ?      180.1        4.1       ?       ? 
1 1 1   29   19   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   19   37 o    410.9    2.6    0.0000   0.0000          ?        ?  1688.8896  21.0712          ?        ?      410.9        2.6       ?       ? 
1 1 1   29   19   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   19   39 o     78.1    9.8    0.0000   0.0000          ?        ?    61.2981  15.3245          ?        ?       78.1        9.8       ?       ? 
1 1 1   29   19   40 o    264.2    3.3    0.0000   0.0000          ?        ?   698.5427  17.2401          ?        ?      264.2        3.3       ?       ? 
1 1 1   29   19   41 o    122.9    6.5    0.0000   0.0000          ?        ?   151.3296  15.9630          ?        ?      122.9        6.5       ?       ? 
1 1 1   29   19   42 o    274.0    3.1    0.0000   0.0000          ?        ?   750.9014  17.2401          ?        ?      274.0        3.1       ?       ? 
1 1 1   29   19   43 o    235.9    3.7    0.0000   0.0000          ?        ?   556.7908  17.2401          ?        ?      235.9        3.7       ?       ? 
1 1 1   29   19   44 o     61.4   14.3    0.0000   0.0000          ?        ?    39.5883  17.2401          ?        ?       61.4       14.3       ?       ? 
1 1 1   29   19   45 o     70.7   11.7    0.0000   0.0000          ?        ?    50.4432  16.6016          ?        ?       70.7       11.7       ?       ? 
1 1 1   29   19   46 o    192.3    4.8    0.0000   0.0000          ?        ?   370.3425  18.5171          ?        ?      192.3        4.8       ?       ? 
1 1 1   29   19   47 o    351.4    3.0    0.0000   0.0000          ?        ?  1235.5393  21.0712          ?        ?      351.4        3.0       ?       ? 
1 1 1   29   19   48 o    137.7    6.7    0.0000   0.0000          ?        ?   190.2794  18.5171          ?        ?      137.7        6.7       ?       ? 
1 1 1   29   19   49 o     83.1   10.4    0.0000   0.0000          ?        ?    69.5989  17.2401          ?        ?       83.1       10.4       ?       ? 
1 1 1   29   19   50 o    153.7    5.8    0.0000   0.0000          ?        ?   236.8915  17.8786          ?        ?      153.7        5.8       ?       ? 
1 1 1   29   19   51 o    131.6    6.6    0.0000   0.0000          ?        ?   173.6779  17.2401          ?        ?      131.6        6.6       ?       ? 
1 1 1   29   19   52 o    271.2    3.6    0.0000   0.0000          ?        ?   736.2155  19.7942          ?        ?      271.2        3.6       ?       ? 
1 1 1   29   19   53 o     62.6   15.0    0.0000   0.0000          ?        ?    41.5039  18.5171          ?        ?       62.6       15.0       ?       ? 
1 1 1   29   19   54 o     43.5   16.1    0.0000   0.0000          ?        ?    15.3245  18.5171          ?        ?       43.5       16.1       ?       ? 
1 1 1   29   19   55 o    272.8    3.6    0.0000   0.0000          ?        ?   745.1547  19.7942          ?        ?      272.8        3.6       ?       ? 
1 1 1   29   19   56 o    138.3    7.2    0.0000   0.0000          ?        ?   192.1950  19.7942          ?        ?      138.3        7.2       ?       ? 
1 1 1   29   19   57 o    161.3    5.9    0.0000   0.0000          ?        ?   261.1554  19.1556          ?        ?      161.3        5.9       ?       ? 
1 1 1   29   19   58 o     78.0   11.9    0.0000   0.0000          ?        ?    61.9366  18.5171          ?        ?       78.0       11.9       ?       ? 
1 1 1   29   19   59 o     89.7   10.7    0.0000   0.0000          ?        ?    81.7308  19.1556          ?        ?       89.7       10.7       ?       ? 
1 1 1   29   19   60 o    101.7    9.7    0.0000   0.0000          ?        ?   104.7175  19.7942          ?        ?      101.7        9.7       ?       ? 
1 1 1   29   19   61 o     83.2   12.3    0.0000   0.0000          ?        ?    70.8759  20.4327          ?        ?       83.2       12.3       ?       ? 
1 1 1   29   19   62 o    201.1    4.9    0.0000   0.0000          ?        ?   406.0997  19.7942          ?        ?      201.1        4.9       ?       ? 
1 1 1   29   19   63 o    227.8    4.5    0.0000   0.0000          ?        ?   521.0336  20.4327          ?        ?      227.8        4.5       ?       ? 
1 1 1   29   19   64 o     28.9   13.5    0.0000   0.0000          ?        ?   -16.6016  19.1556          ?        ?       28.9       13.5       ?       ? 
1 1 1   29   20    0 o    568.4    3.8 3231.5581  42.7809  3231.5581  42.7809  3231.5581  42.7809      568.4      3.8      568.4        3.8     0.0     0.0 
1 1 1   29   20    1 o    569.7    2.9    0.0000   0.0000          ?        ?  3245.6055  32.5646          ?        ?      569.7        2.9       ?       ? 
1 1 1   29   20    2 o    779.1    3.3    0.0000   0.0000          ?        ?  6071.0635  51.0817          ?        ?      779.1        3.3       ?       ? 
1 1 1   29   20    3 o    399.4    2.6    0.0000   0.0000          ?        ?  1595.0271  21.0712          ?        ?      399.4        2.6       ?       ? 
1 1 1   29   20    4 o    161.0    3.8    0.0000   0.0000          ?        ?   259.2398  12.1319          ?        ?      161.0        3.8       ?       ? 
1 1 1   29   20    5 o    619.5    3.0    0.0000   0.0000          ?        ?  3838.7920  37.0343          ?        ?      619.5        3.0       ?       ? 
1 1 1   29   20    6 o    608.2    2.8    0.0000   0.0000          ?        ?  3698.9558  34.4802          ?        ?      608.2        2.8       ?       ? 
1 1 1   29   20    7 o    288.5    2.3    0.0000   0.0000          ?        ?   832.6321  13.4090          ?        ?      288.5        2.3       ?       ? 
1 1 1   29   20    8 o    463.8    2.5    0.0000   0.0000          ?        ?  2151.1792  22.9868          ?        ?      463.8        2.5       ?       ? 
1 1 1   29   20    9 o    505.4    2.4    0.0000   0.0000          ?        ?  2554.0864  24.2638          ?        ?      505.4        2.4       ?       ? 
1 1 1   29   20   10 f    588.6    2.6    0.0000   0.0000          ?        ?  3464.6182  30.6490          ?        ?      588.6        2.6       ?       ? 
1 1 1   29   20   11 o    259.3    2.6    0.0000   0.0000          ?        ?   672.3633  13.4090          ?        ?      259.3        2.6       ?       ? 
1 1 1   29   20   12 o    549.0    2.4    0.0000   0.0000          ?        ?  3013.8220  26.1794          ?        ?      549.0        2.4       ?       ? 
1 1 1   29   20   13 o    505.7    2.3    0.0000   0.0000          ?        ?  2557.2791  23.6253          ?        ?      505.7        2.3       ?       ? 
1 1 1   29   20   14 o    361.9    2.1    0.0000   0.0000          ?        ?  1309.6079  15.3245          ?        ?      361.9        2.1       ?       ? 
1 1 1   29   20   15 o    492.8    2.3    0.0000   0.0000          ?        ?  2428.2976  22.9868          ?        ?      492.8        2.3       ?       ? 
1 1 1   29   20   16 o    494.5    2.3    0.0000   0.0000          ?        ?  2445.5378  22.9868          ?        ?      494.5        2.3       ?       ? 
1 1 1   29   20   17 o    307.1    2.3    0.0000   0.0000          ?        ?   943.0964  14.0475          ?        ?      307.1        2.3       ?       ? 
1 1 1   29   20   18 o    813.5    3.1    0.0000   0.0000          ?        ?  6619.5532  50.4432          ?        ?      813.5        3.1       ?       ? 
1 1 1   29   20   19 f    621.6    2.6    0.0000   0.0000          ?        ?  3864.9714  32.5646          ?        ?      621.6        2.6       ?       ? 
1 1 1   29   20   20 o    243.8    2.6    0.0000   0.0000          ?        ?   594.4636  12.7704          ?        ?      243.8        2.6       ?       ? 
1 1 1   29   20   21 o    250.6    2.8    0.0000   0.0000          ?        ?   628.3053  14.0475          ?        ?      250.6        2.8       ?       ? 
1 1 1   29   20   22 o    619.8    2.6    0.0000   0.0000          ?        ?  3841.9846  32.5646          ?        ?      619.8        2.6       ?       ? 
1 1 1   29   20   23 o    310.4    2.6    0.0000   0.0000          ?        ?   963.5291  15.9630          ?        ?      310.4        2.6       ?       ? 
1 1 1   29   20   24 o    500.1    2.4    0.0000   0.0000          ?        ?  2501.7275  24.2638          ?        ?      500.1        2.4       ?       ? 
1 1 1   29   20   25 o    458.7    2.4    0.0000   0.0000          ?        ?  2104.5674  22.3483          ?        ?      458.7        2.4       ?       ? 
1 1 1   29   20   26 o    327.4    2.6    0.0000   0.0000          ?        ?  1072.0778  17.2401          ?        ?      327.4        2.6       ?       ? 
1 1 1   29   20   27 o    123.7    5.7    0.0000   0.0000          ?        ?   153.2452  14.0475          ?        ?      123.7        5.7       ?       ? 
1 1 1   29   20   28 o    341.8    2.6    0.0000   0.0000          ?        ?  1168.4946  17.8786          ?        ?      341.8        2.6       ?       ? 
1 1 1   29   20   29 o    565.8    2.7    0.0000   0.0000          ?        ?  3202.1860  30.6490          ?        ?      565.8        2.7       ?       ? 
1 1 1   29   20   30 o    404.7    2.5    0.0000   0.0000          ?        ?  1638.4465  20.4327          ?        ?      404.7        2.5       ?       ? 
1 1 1   29   20   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   20   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   20   33 o    400.5    2.6    0.0000   0.0000          ?        ?  1604.6049  20.4327          ?        ?      400.5        2.6       ?       ? 
1 1 1   29   20   34 o    231.8    3.3    0.0000   0.0000          ?        ?   537.6352  15.3245          ?        ?      231.8        3.3       ?       ? 
1 1 1   29   20   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   20   36 o    175.6    4.2    0.0000   0.0000          ?        ?   308.4059  14.6860          ?        ?      175.6        4.2       ?       ? 
1 1 1   29   20   37 o    471.8    2.5    0.0000   0.0000          ?        ?  2226.5249  23.6253          ?        ?      471.8        2.5       ?       ? 
1 1 1   29   20   38 o    182.7    4.2    0.0000   0.0000          ?        ?   333.9468  15.3245          ?        ?      182.7        4.2       ?       ? 
1 1 1   29   20   39 o     91.7    8.0    0.0000   0.0000          ?        ?    84.2849  14.6860          ?        ?       91.7        8.0       ?       ? 
1 1 1   29   20   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   20   41 o    220.4    3.6    0.0000   0.0000          ?        ?   485.9149  15.9630          ?        ?      220.4        3.6       ?       ? 
1 1 1   29   20   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   20   43 f    424.2    2.7    0.0000   0.0000          ?        ?  1800.6310  22.9868          ?        ?      424.2        2.7       ?       ? 
1 1 1   29   20   44 o    346.7    2.9    0.0000   0.0000          ?        ?  1202.9747  20.4327          ?        ?      346.7        2.9       ?       ? 
1 1 1   29   20   45 o    259.0    3.5    0.0000   0.0000          ?        ?   671.0862  17.8786          ?        ?      259.0        3.5       ?       ? 
1 1 1   29   20   46 o    230.2    3.9    0.0000   0.0000          ?        ?   530.6115  17.8786          ?        ?      230.2        3.9       ?       ? 
1 1 1   29   20   47 o    159.3    5.6    0.0000   0.0000          ?        ?   254.1316  17.8786          ?        ?      159.3        5.6       ?       ? 
1 1 1   29   20   48 o    394.9    2.8    0.0000   0.0000          ?        ?  1560.5469  22.3483          ?        ?      394.9        2.8       ?       ? 
1 1 1   29   20   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   20   50 f     80.7   11.1    0.0000   0.0000          ?        ?    65.7677  17.8786          ?        ?       80.7       11.1       ?       ? 
1 1 1   29   20   51 o     92.2    9.7    0.0000   0.0000          ?        ?    85.5619  17.8786          ?        ?       92.2        9.7       ?       ? 
1 1 1   29   20   52 o    159.6    5.8    0.0000   0.0000          ?        ?   255.4086  18.5171          ?        ?      159.6        5.8       ?       ? 
1 1 1   29   20   53 o     31.3   14.0    0.0000   0.0000          ?        ?    -7.0237  17.8786          ?        ?       31.3       14.0       ?       ? 
1 1 1   29   20   54 o    146.6    6.3    0.0000   0.0000          ?        ?   215.8203  18.5171          ?        ?      146.6        6.3       ?       ? 
1 1 1   29   20   55 o    223.2    4.6    0.0000   0.0000          ?        ?   499.3239  20.4327          ?        ?      223.2        4.6       ?       ? 
1 1 1   29   20   56 o     27.0   12.9    0.0000   0.0000          ?        ?   -24.2638  19.1556          ?        ?       27.0       12.9       ?       ? 
1 1 1   29   20   57 o     78.0   11.9    0.0000   0.0000          ?        ?    61.9366  18.5171          ?        ?       78.0       11.9       ?       ? 
1 1 1   29   20   58 o    218.4    4.7    0.0000   0.0000          ?        ?   478.2527  20.4327          ?        ?      218.4        4.7       ?       ? 
1 1 1   29   20   59 o     65.5   14.9    0.0000   0.0000          ?        ?    45.9736  19.1556          ?        ?       65.5       14.9       ?       ? 
1 1 1   29   20   60 o     79.9   11.6    0.0000   0.0000          ?        ?    65.1292  18.5171          ?        ?       79.9       11.6       ?       ? 
1 1 1   29   20   61 o    124.7    7.7    0.0000   0.0000          ?        ?   157.0763  19.1556          ?        ?      124.7        7.7       ?       ? 
1 1 1   29   20   62 o    176.2    5.4    0.0000   0.0000          ?        ?   312.2371  19.1556          ?        ?      176.2        5.4       ?       ? 
1 1 1   29   20   63 o    157.4    6.3    0.0000   0.0000          ?        ?   249.6619  19.7942          ?        ?      157.4        6.3       ?       ? 
1 1 1   29   21    0 o    409.3    3.9 1676.1193  31.9261  1676.1193  31.9261  1676.1193  31.9261      409.3      3.9      409.3        3.9     0.0     0.0 
1 1 1   29   21    1 o    634.7    3.0    0.0000   0.0000          ?        ?  4029.0715  38.3113          ?        ?      634.7        3.0       ?       ? 
1 1 1   29   21    2 o    605.6    2.9    0.0000   0.0000          ?        ?  3667.6685  35.1187          ?        ?      605.6        2.9       ?       ? 
1 1 1   29   21    3 o    297.4    2.7    0.0000   0.0000          ?        ?   884.3525  15.9630          ?        ?      297.4        2.7       ?       ? 
1 1 1   29   21    4 o    632.8    3.1    0.0000   0.0000          ?        ?  4004.8076  38.9498          ?        ?      632.8        3.1       ?       ? 
1 1 1   29   21    5 o    242.7    3.6    0.0000   0.0000          ?        ?   589.3555  17.2401          ?        ?      242.7        3.6       ?       ? 
1 1 1   29   21    6 o    235.0    2.7    0.0000   0.0000          ?        ?   552.3212  12.7704          ?        ?      235.0        2.7       ?       ? 
1 1 1   29   21    7 o    328.1    2.7    0.0000   0.0000          ?        ?  1076.5475  17.8786          ?        ?      328.1        2.7       ?       ? 
1 1 1   29   21    8 o     86.4    5.2    0.0000   0.0000          ?        ?    74.7070   8.9393          ?        ?       86.4        5.2       ?       ? 
1 1 1   29   21    9 o    198.3    2.9    0.0000   0.0000          ?        ?   393.3293  11.4934          ?        ?      198.3        2.9       ?       ? 
1 1 1   29   21   10 o    488.6    2.4    0.0000   0.0000          ?        ?  2387.4324  23.6253          ?        ?      488.6        2.4       ?       ? 
1 1 1   29   21   11 o    271.2    2.4    0.0000   0.0000          ?        ?   735.5769  12.7704          ?        ?      271.2        2.4       ?       ? 
1 1 1   29   21   12 o    591.7    2.6    0.0000   0.0000          ?        ?  3501.0139  31.2876          ?        ?      591.7        2.6       ?       ? 
1 1 1   29   21   13 o    462.3    2.2    0.0000   0.0000          ?        ?  2137.7703  20.4327          ?        ?      462.3        2.2       ?       ? 
1 1 1   29   21   14 o    572.7    2.5    0.0000   0.0000          ?        ?  3280.7241  28.0950          ?        ?      572.7        2.5       ?       ? 
1 1 1   29   21   15 o    756.0    2.9    0.0000   0.0000          ?        ?  5716.6841  43.4195          ?        ?      756.0        2.9       ?       ? 
1 1 1   29   21   16 o     90.0    5.7    0.0000   0.0000          ?        ?    81.0922  10.2163          ?        ?       90.0        5.7       ?       ? 
1 1 1   29   21   17 o    230.6    2.5    0.0000   0.0000          ?        ?   531.8885  11.4934          ?        ?      230.6        2.5       ?       ? 
1 1 1   29   21   18 o    347.0    2.2    0.0000   0.0000          ?        ?  1204.2518  15.3245          ?        ?      347.0        2.2       ?       ? 
1 1 1   29   21   19 o    367.6    2.3    0.0000   0.0000          ?        ?  1351.1118  17.2401          ?        ?      367.6        2.3       ?       ? 
1 1 1   29   21   20 o    335.9    2.4    0.0000   0.0000          ?        ?  1128.2677  15.9630          ?        ?      335.9        2.4       ?       ? 
1 1 1   29   21   21 o    653.2    2.8    0.0000   0.0000          ?        ?  4267.8789  37.0343          ?        ?      653.2        2.8       ?       ? 
1 1 1   29   21   22 o    467.9    2.4    0.0000   0.0000          ?        ?  2189.4907  22.3483          ?        ?      467.9        2.4       ?       ? 
1 1 1   29   21   23 o    256.4    2.9    0.0000   0.0000          ?        ?   657.6772  14.6860          ?        ?      256.4        2.9       ?       ? 
1 1 1   29   21   24 o    215.9    3.0    0.0000   0.0000          ?        ?   466.1208  12.7704          ?        ?      215.9        3.0       ?       ? 
1 1 1   29   21   25 f    308.5    2.6    0.0000   0.0000          ?        ?   952.0358  15.9630          ?        ?      308.5        2.6       ?       ? 
1 1 1   29   21   26 o    273.1    2.7    0.0000   0.0000          ?        ?   745.7933  14.6860          ?        ?      273.1        2.7       ?       ? 
1 1 1   29   21   27 o    512.6    2.6    0.0000   0.0000          ?        ?  2628.1550  26.1794          ?        ?      512.6        2.6       ?       ? 
1 1 1   29   21   28 o    687.7    2.8    0.0000   0.0000          ?        ?  4730.8071  38.9498          ?        ?      687.7        2.8       ?       ? 
1 1 1   29   21   29 o    125.5    5.3    0.0000   0.0000          ?        ?   157.7148  13.4090          ?        ?      125.5        5.3       ?       ? 
1 1 1   29   21   30 o    288.2    2.8    0.0000   0.0000          ?        ?   830.7167  15.9630          ?        ?      288.2        2.8       ?       ? 
1 1 1   29   21   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   21   32 o     49.2   14.2    0.0000   0.0000          ?        ?    24.9023  14.6860          ?        ?       49.2       14.2       ?       ? 
1 1 1   29   21   33 o    107.1    6.9    0.0000   0.0000          ?        ?   114.9339  14.6860          ?        ?      107.1        6.9       ?       ? 
1 1 1   29   21   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   21   35 o     35.1   14.0    0.0000   0.0000          ?        ?     6.3852  14.6860          ?        ?       35.1       14.0       ?       ? 
1 1 1   29   21   36 o     25.4   11.9    0.0000   0.0000          ?        ?   -15.9630  15.3245          ?        ?       25.4       11.9       ?       ? 
1 1 1   29   21   37 o    295.1    2.8    0.0000   0.0000          ?        ?   870.9435  16.6016          ?        ?      295.1        2.8       ?       ? 
1 1 1   29   21   38 o    294.1    2.9    0.0000   0.0000          ?        ?   865.1968  17.2401          ?        ?      294.1        2.9       ?       ? 
1 1 1   29   21   39 o     33.1   13.7    0.0000   0.0000          ?        ?     3.1926  14.6860          ?        ?       33.1       13.7       ?       ? 
1 1 1   29   21   40 o    228.0    3.5    0.0000   0.0000          ?        ?   520.3951  15.9630          ?        ?      228.0        3.5       ?       ? 
1 1 1   29   21   41 o    336.0    2.8    0.0000   0.0000          ?        ?  1129.5447  18.5171          ?        ?      336.0        2.8       ?       ? 
1 1 1   29   21   42 o    225.4    3.7    0.0000   0.0000          ?        ?   508.2632  16.6016          ?        ?      225.4        3.7       ?       ? 
1 1 1   29   21   43 o    495.1    2.7    0.0000   0.0000          ?        ?  2451.9231  26.8179          ?        ?      495.1        2.7       ?       ? 
1 1 1   29   21   44 o    127.7    6.5    0.0000   0.0000          ?        ?   163.4615  16.6016          ?        ?      127.7        6.5       ?       ? 
1 1 1   29   21   45 o    210.2    4.4    0.0000   0.0000          ?        ?   442.4955  18.5171          ?        ?      210.2        4.4       ?       ? 
1 1 1   29   21   46 o    199.2    4.3    0.0000   0.0000          ?        ?   397.1605  17.2401          ?        ?      199.2        4.3       ?       ? 
1 1 1   29   21   47 o    412.1    2.8    0.0000   0.0000          ?        ?  1699.1061  22.9868          ?        ?      412.1        2.8       ?       ? 
1 1 1   29   21   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   21   49 o    380.7    2.9    0.0000   0.0000          ?        ?  1450.0826  22.3483          ?        ?      380.7        2.9       ?       ? 
1 1 1   29   21   50 o    197.0    4.5    0.0000   0.0000          ?        ?   388.8597  17.8786          ?        ?      197.0        4.5       ?       ? 
1 1 1   29   21   51 o    276.2    3.5    0.0000   0.0000          ?        ?   763.6719  19.1556          ?        ?      276.2        3.5       ?       ? 
1 1 1   29   21   52 f     32.1   14.2    0.0000   0.0000          ?        ?    -5.1082  17.8786          ?        ?       32.1       14.2       ?       ? 
1 1 1   29   21   53 o    138.1    6.7    0.0000   0.0000          ?        ?   191.5565  18.5171          ?        ?      138.1        6.7       ?       ? 
1 1 1   29   21   54 o    224.7    4.3    0.0000   0.0000          ?        ?   505.7091  19.1556          ?        ?      224.7        4.3       ?       ? 
1 1 1   29   21   55 o    119.2    7.8    0.0000   0.0000          ?        ?   143.0288  18.5171          ?        ?      119.2        7.8       ?       ? 
1 1 1   29   21   56 o     28.7   13.4    0.0000   0.0000          ?        ?   -15.9630  18.5171          ?        ?       28.7       13.4       ?       ? 
1 1 1   29   21   57 o    200.9    4.6    0.0000   0.0000          ?        ?   404.8227  18.5171          ?        ?      200.9        4.6       ?       ? 
1 1 1   29   21   58 o    218.2    4.7    0.0000   0.0000          ?        ?   477.6142  20.4327          ?        ?      218.2        4.7       ?       ? 
1 1 1   29   21   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   21   60 o     78.2   11.8    0.0000   0.0000          ?        ?    62.5751  18.5171          ?        ?       78.2       11.8       ?       ? 
1 1 1   29   21   61 o    163.5    5.7    0.0000   0.0000          ?        ?   268.8176  18.5171          ?        ?      163.5        5.7       ?       ? 
1 1 1   29   21   62 o    109.1    8.5    0.0000   0.0000          ?        ?   120.6806  18.5171          ?        ?      109.1        8.5       ?       ? 
1 1 1   29   22    0 o     28.9   18.3    3.8311  22.3483     3.8311  22.3483     3.8311  22.3483       28.9     18.3       28.9       18.3     0.0     0.0 
1 1 1   29   22    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   22    2 o    258.4    2.5    0.0000   0.0000          ?        ?   667.8936  12.7704          ?        ?      258.4        2.5       ?       ? 
1 1 1   29   22    3 o    271.4    2.5    0.0000   0.0000          ?        ?   736.8539  13.4090          ?        ?      271.4        2.5       ?       ? 
1 1 1   29   22    4 o    565.2    2.9    0.0000   0.0000          ?        ?  3195.1621  32.5646          ?        ?      565.2        2.9       ?       ? 
1 1 1   29   22    5 o   1027.8    4.0    0.0000   0.0000          ?        ? 10567.5332  81.7308          ?        ?     1027.8        4.0       ?       ? 
1 1 1   29   22    6 o    571.4    2.7    0.0000   0.0000          ?        ?  3265.3997  31.2876          ?        ?      571.4        2.7       ?       ? 
1 1 1   29   22    7 o    387.8    2.5    0.0000   0.0000          ?        ?  1503.7184  19.1556          ?        ?      387.8        2.5       ?       ? 
1 1 1   29   22    8 o     90.4    4.9    0.0000   0.0000          ?        ?    81.7308   8.9393          ?        ?       90.4        4.9       ?       ? 
1 1 1   29   22    9 o    971.3    3.6    0.0000   0.0000          ?        ?  9436.0732  70.8759          ?        ?      971.3        3.6       ?       ? 
1 1 1   29   22   10 o    686.5    2.9    0.0000   0.0000          ?        ?  4712.9277  39.5883          ?        ?      686.5        2.9       ?       ? 
1 1 1   29   22   11 o    330.0    2.3    0.0000   0.0000          ?        ?  1089.3180  15.3245          ?        ?      330.0        2.3       ?       ? 
1 1 1   29   22   12 o     63.9    8.0    0.0000   0.0000          ?        ?    40.8654  10.2163          ?        ?       63.9        8.0       ?       ? 
1 1 1   29   22   13 o    381.4    2.1    0.0000   0.0000          ?        ?  1454.5522  15.9630          ?        ?      381.4        2.1       ?       ? 
1 1 1   29   22   14 o    500.3    2.3    0.0000   0.0000          ?        ?  2503.0049  22.9868          ?        ?      500.3        2.3       ?       ? 
1 1 1   29   22   15 o    169.3    2.8    0.0000   0.0000          ?        ?   286.6962   9.5778          ?        ?      169.3        2.8       ?       ? 
1 1 1   29   22   16 o    233.6    2.5    0.0000   0.0000          ?        ?   545.9360  11.4934          ?        ?      233.6        2.5       ?       ? 
1 1 1   29   22   17 o    312.6    2.2    0.0000   0.0000          ?        ?   977.5767  14.0475          ?        ?      312.6        2.2       ?       ? 
1 1 1   29   22   18 o    297.4    2.3    0.0000   0.0000          ?        ?   884.3525  13.4090          ?        ?      297.4        2.3       ?       ? 
1 1 1   29   22   19 o    431.5    2.3    0.0000   0.0000          ?        ?  1862.5676  19.7942          ?        ?      431.5        2.3       ?       ? 
1 1 1   29   22   20 o    494.4    2.4    0.0000   0.0000          ?        ?  2444.2607  23.6253          ?        ?      494.4        2.4       ?       ? 
1 1 1   29   22   21 o    399.2    2.3    0.0000   0.0000          ?        ?  1593.7500  18.5171          ?        ?      399.2        2.3       ?       ? 
1 1 1   29   22   22 o    637.4    2.7    0.0000   0.0000          ?        ?  4063.5518  33.8416          ?        ?      637.4        2.7       ?       ? 
1 1 1   29   22   23 o    553.1    2.4    0.0000   0.0000          ?        ?  3059.1572  26.8179          ?        ?      553.1        2.4       ?       ? 
1 1 1   29   22   24 o    471.4    2.4    0.0000   0.0000          ?        ?  2222.6938  22.9868          ?        ?      471.4        2.4       ?       ? 
1 1 1   29   22   25 o    133.7    4.5    0.0000   0.0000          ?        ?   178.7861  12.1319          ?        ?      133.7        4.5       ?       ? 
1 1 1   29   22   26 o     40.5   13.1    0.0000   0.0000          ?        ?    15.9630  12.1319          ?        ?       40.5       13.1       ?       ? 
1 1 1   29   22   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   22   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   22   29 o    165.1    4.3    0.0000   0.0000          ?        ?   272.6487  14.0475          ?        ?      165.1        4.3       ?       ? 
1 1 1   29   22   30 o    444.6    2.6    0.0000   0.0000          ?        ?  1977.5016  22.9868          ?        ?      444.6        2.6       ?       ? 
1 1 1   29   22   31 o    283.9    2.9    0.0000   0.0000          ?        ?   806.4528  16.6016          ?        ?      283.9        2.9       ?       ? 
1 1 1   29   22   32 o     17.1    8.6    0.0000   0.0000          ?        ?   -37.6728  12.7704          ?        ?       17.1        8.6       ?       ? 
1 1 1   29   22   33 o    189.0    3.9    0.0000   0.0000          ?        ?   357.5721  14.6860          ?        ?      189.0        3.9       ?       ? 
1 1 1   29   22   34 o     89.2    7.9    0.0000   0.0000          ?        ?    79.8152  14.0475          ?        ?       89.2        7.9       ?       ? 
1 1 1   29   22   35 o    146.6    5.2    0.0000   0.0000          ?        ?   215.1818  15.3245          ?        ?      146.6        5.2       ?       ? 
1 1 1   29   22   36 f    356.3    2.7    0.0000   0.0000          ?        ?  1270.0195  19.1556          ?        ?      356.3        2.7       ?       ? 
1 1 1   29   22   37 o     26.5   12.1    0.0000   0.0000          ?        ?   -10.8549  14.6860          ?        ?       26.5       12.1       ?       ? 
1 1 1   29   22   38 o     26.7   12.3    0.0000   0.0000          ?        ?   -12.1319  15.3245          ?        ?       26.7       12.3       ?       ? 
1 1 1   29   22   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   22   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   22   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   22   42 o    381.6    2.8    0.0000   0.0000          ?        ?  1457.1063  21.0712          ?        ?      381.6        2.8       ?       ? 
1 1 1   29   22   43 f    179.6    4.8    0.0000   0.0000          ?        ?   323.0919  17.2401          ?        ?      179.6        4.8       ?       ? 
1 1 1   29   22   44 o    259.3    3.6    0.0000   0.0000          ?        ?   673.0018  18.5171          ?        ?      259.3        3.6       ?       ? 
1 1 1   29   22   45 o     99.6    8.0    0.0000   0.0000          ?        ?    99.6094  15.9630          ?        ?       99.6        8.0       ?       ? 
1 1 1   29   22   46 o    313.9    3.2    0.0000   0.0000          ?        ?   985.8774  19.7942          ?        ?      313.9        3.2       ?       ? 
1 1 1   29   22   47 o    205.8    4.3    0.0000   0.0000          ?        ?   423.9784  17.8786          ?        ?      205.8        4.3       ?       ? 
1 1 1   29   22   48 o     25.4   12.3    0.0000   0.0000          ?        ?   -28.0950  18.5171          ?        ?       25.4       12.3       ?       ? 
1 1 1   29   22   49 o    142.7    6.0    0.0000   0.0000          ?        ?   204.3269  17.2401          ?        ?      142.7        6.0       ?       ? 
1 1 1   29   22   50 o    282.8    3.6    0.0000   0.0000          ?        ?   800.7061  20.4327          ?        ?      282.8        3.6       ?       ? 
1 1 1   29   22   51 o    126.5    7.6    0.0000   0.0000          ?        ?   160.9075  19.1556          ?        ?      126.5        7.6       ?       ? 
1 1 1   29   22   52 o    288.2    3.4    0.0000   0.0000          ?        ?   831.3552  19.7942          ?        ?      288.2        3.4       ?       ? 
1 1 1   29   22   53 o    181.6    5.1    0.0000   0.0000          ?        ?   330.7542  18.5171          ?        ?      181.6        5.1       ?       ? 
1 1 1   29   22   54 o    177.7    5.6    0.0000   0.0000          ?        ?   316.7067  19.7942          ?        ?      177.7        5.6       ?       ? 
1 1 1   29   22   55 o    245.4    4.0    0.0000   0.0000          ?        ?   603.4030  19.7942          ?        ?      245.4        4.0       ?       ? 
1 1 1   29   22   56 o    162.8    5.7    0.0000   0.0000          ?        ?   266.2635  18.5171          ?        ?      162.8        5.7       ?       ? 
1 1 1   29   22   57 o    142.0    7.0    0.0000   0.0000          ?        ?   203.0499  19.7942          ?        ?      142.0        7.0       ?       ? 
1 1 1   29   22   58 o     52.6   16.4    0.0000   0.0000          ?        ?    28.7335  19.1556          ?        ?       52.6       16.4       ?       ? 
1 1 1   29   22   59 o    175.0    5.7    0.0000   0.0000          ?        ?   307.7674  19.7942          ?        ?      175.0        5.7       ?       ? 
1 1 1   29   22   60 o    129.4    7.4    0.0000   0.0000          ?        ?   169.2082  19.1556          ?        ?      129.4        7.4       ?       ? 
1 1 1   29   22   61 o    254.9    4.1    0.0000   0.0000          ?        ?   651.9305  21.0712          ?        ?      254.9        4.1       ?       ? 
1 1 1   29   23    0 o    171.2    7.3  294.9970  24.9023   294.9970  24.9023   294.9970  24.9023      171.2      7.3      171.2        7.3     0.0     0.0 
1 1 1   29   23    1 o    541.4    3.2    0.0000   0.0000          ?        ?  2932.0913  34.4802          ?        ?      541.4        3.2       ?       ? 
1 1 1   29   23    2 o    459.4    2.9    0.0000   0.0000          ?        ?  2110.9526  26.8179          ?        ?      459.4        2.9       ?       ? 
1 1 1   29   23    3 o    378.8    4.3    0.0000   0.0000          ?        ?  1435.3966  32.5646          ?        ?      378.8        4.3       ?       ? 
1 1 1   29   23    4 o   1233.2    5.1    0.0000   0.0000          ?        ? 15215.3311 126.4273          ?        ?     1233.2        5.1       ?       ? 
1 1 1   29   23    5 o    418.4    3.1    0.0000   0.0000          ?        ?  1750.8264  26.1794          ?        ?      418.4        3.1       ?       ? 
1 1 1   29   23    6 o    553.4    2.9    0.0000   0.0000          ?        ?  3062.9883  32.5646          ?        ?      553.4        2.9       ?       ? 
1 1 1   29   23    7 o    352.1    2.8    0.0000   0.0000          ?        ?  1240.0090  19.7942          ?        ?      352.1        2.8       ?       ? 
1 1 1   29   23    8 o    497.8    2.9    0.0000   0.0000          ?        ?  2478.7410  28.7335          ?        ?      497.8        2.9       ?       ? 
1 1 1   29   23    9 o     82.2    5.0    0.0000   0.0000          ?        ?    67.6833   8.3008          ?        ?       82.2        5.0       ?       ? 
1 1 1   29   23   10 o    745.0    3.2    0.0000   0.0000          ?        ?  5551.9453  47.2506          ?        ?      745.0        3.2       ?       ? 
1 1 1   29   23   11 o     74.5    6.0    0.0000   0.0000          ?        ?    55.5514   8.9393          ?        ?       74.5        6.0       ?       ? 
1 1 1   29   23   12 o    331.5    2.5    0.0000   0.0000          ?        ?  1098.8958  16.6016          ?        ?      331.5        2.5       ?       ? 
1 1 1   29   23   13 o    423.2    2.1    0.0000   0.0000          ?        ?  1791.0532  17.8786          ?        ?      423.2        2.1       ?       ? 
1 1 1   29   23   14 o    342.2    2.2    0.0000   0.0000          ?        ?  1171.0486  15.3245          ?        ?      342.2        2.2       ?       ? 
1 1 1   29   23   15 o     15.1    7.5    0.0000   0.0000          ?        ?   -19.1556   8.3008          ?        ?       15.1        7.5       ?       ? 
1 1 1   29   23   16 o    494.0    2.4    0.0000   0.0000          ?        ?  2441.0681  23.6253          ?        ?      494.0        2.4       ?       ? 
1 1 1   29   23   17 o    271.5    2.5    0.0000   0.0000          ?        ?   737.4925  13.4090          ?        ?      271.5        2.5       ?       ? 
1 1 1   29   23   18 o    304.4    2.4    0.0000   0.0000          ?        ?   926.4949  14.6860          ?        ?      304.4        2.4       ?       ? 
1 1 1   29   23   19 o    259.2    2.7    0.0000   0.0000          ?        ?   671.7247  14.0475          ?        ?      259.2        2.7       ?       ? 
1 1 1   29   23   20 o    115.2    5.0    0.0000   0.0000          ?        ?   132.8125  11.4934          ?        ?      115.2        5.0       ?       ? 
1 1 1   29   23   21 o    323.3    2.5    0.0000   0.0000          ?        ?  1045.2599  15.9630          ?        ?      323.3        2.5       ?       ? 
1 1 1   29   23   22 o    346.4    2.3    0.0000   0.0000          ?        ?  1200.4207  15.9630          ?        ?      346.4        2.3       ?       ? 
1 1 1   29   23   23 o    354.7    2.3    0.0000   0.0000          ?        ?  1258.5261  16.6016          ?        ?      354.7        2.3       ?       ? 
1 1 1   29   23   24 o    581.7    2.6    0.0000   0.0000          ?        ?  3384.1646  30.0105          ?        ?      581.7        2.6       ?       ? 
1 1 1   29   23   25 o    143.8    4.2    0.0000   0.0000          ?        ?   206.8810  12.1319          ?        ?      143.8        4.2       ?       ? 
1 1 1   29   23   26 o    322.4    2.5    0.0000   0.0000          ?        ?  1039.5132  15.9630          ?        ?      322.4        2.5       ?       ? 
1 1 1   29   23   27 o    259.0    2.7    0.0000   0.0000          ?        ?   671.0862  14.0475          ?        ?      259.0        2.7       ?       ? 
1 1 1   29   23   28 o    252.4    2.8    0.0000   0.0000          ?        ?   637.2446  14.0475          ?        ?      252.4        2.8       ?       ? 
1 1 1   29   23   29 o    631.4    2.7    0.0000   0.0000          ?        ?  3987.5676  34.4802          ?        ?      631.4        2.7       ?       ? 
1 1 1   29   23   30 f    304.1    2.7    0.0000   0.0000          ?        ?   925.2178  16.6016          ?        ?      304.1        2.7       ?       ? 
1 1 1   29   23   31 o    171.7    4.3    0.0000   0.0000          ?        ?   294.9970  14.6860          ?        ?      171.7        4.3       ?       ? 
1 1 1   29   23   32 o    329.6    2.7    0.0000   0.0000          ?        ?  1086.7638  17.8786          ?        ?      329.6        2.7       ?       ? 
1 1 1   29   23   33 o    201.0    3.7    0.0000   0.0000          ?        ?   404.1842  14.6860          ?        ?      201.0        3.7       ?       ? 
1 1 1   29   23   34 f    192.7    4.0    0.0000   0.0000          ?        ?   371.6196  15.3245          ?        ?      192.7        4.0       ?       ? 
1 1 1   29   23   35 o    438.5    2.5    0.0000   0.0000          ?        ?  1923.2272  21.7097          ?        ?      438.5        2.5       ?       ? 
1 1 1   29   23   36 o    143.7    5.1    0.0000   0.0000          ?        ?   206.8810  14.6860          ?        ?      143.7        5.1       ?       ? 
1 1 1   29   23   37 o    357.7    2.6    0.0000   0.0000          ?        ?  1279.5973  18.5171          ?        ?      357.7        2.6       ?       ? 
1 1 1   29   23   38 o    111.7    7.1    0.0000   0.0000          ?        ?   125.1502  15.9630          ?        ?      111.7        7.1       ?       ? 
1 1 1   29   23   39 o    514.5    2.6    0.0000   0.0000          ?        ?  2647.9492  26.8179          ?        ?      514.5        2.6       ?       ? 
1 1 1   29   23   40 o    166.0    4.8    0.0000   0.0000          ?        ?   275.8413  15.9630          ?        ?      166.0        4.8       ?       ? 
1 1 1   29   23   41 o    355.6    3.0    0.0000   0.0000          ?        ?  1264.9114  21.0712          ?        ?      355.6        3.0       ?       ? 
1 1 1   29   23   42 o    116.7    7.1    0.0000   0.0000          ?        ?   136.6436  16.6016          ?        ?      116.7        7.1       ?       ? 
1 1 1   29   23   43 o    130.2    6.4    0.0000   0.0000          ?        ?   169.8468  16.6016          ?        ?      130.2        6.4       ?       ? 
1 1 1   29   23   44 o    305.5    3.2    0.0000   0.0000          ?        ?   934.1572  19.7942          ?        ?      305.5        3.2       ?       ? 
1 1 1   29   23   45 o     45.3   15.9    0.0000   0.0000          ?        ?    18.5171  17.8786          ?        ?       45.3       15.9       ?       ? 
1 1 1   29   23   46 o    107.0    8.1    0.0000   0.0000          ?        ?   114.9339  17.2401          ?        ?      107.0        8.1       ?       ? 
1 1 1   29   23   47 o     23.6   11.6    0.0000   0.0000          ?        ?   -36.3957  18.5171          ?        ?       23.6       11.6       ?       ? 
1 1 1   29   23   48 o    583.3    3.0    0.0000   0.0000          ?        ?  3404.5974  34.4802          ?        ?      583.3        3.0       ?       ? 
1 1 1   29   23   49 o    121.1    7.6    0.0000   0.0000          ?        ?   147.4985  18.5171          ?        ?      121.1        7.6       ?       ? 
1 1 1   29   23   50 o    162.7    5.7    0.0000   0.0000          ?        ?   265.6250  18.5171          ?        ?      162.7        5.7       ?       ? 
1 1 1   29   23   51 o     96.1    9.6    0.0000   0.0000          ?        ?    93.2242  18.5171          ?        ?       96.1        9.6       ?       ? 
1 1 1   29   23   52 o    224.7    4.3    0.0000   0.0000          ?        ?   505.7091  19.1556          ?        ?      224.7        4.3       ?       ? 
1 1 1   29   23   53 o    115.7    8.0    0.0000   0.0000          ?        ?   134.7281  18.5171          ?        ?      115.7        8.0       ?       ? 
1 1 1   29   23   54 o     87.3   10.6    0.0000   0.0000          ?        ?    77.2611  18.5171          ?        ?       87.3       10.6       ?       ? 
1 1 1   29   23   55 f    138.2    6.9    0.0000   0.0000          ?        ?   192.1950  19.1556          ?        ?      138.2        6.9       ?       ? 
1 1 1   29   23   56 o    200.7    4.8    0.0000   0.0000          ?        ?   404.1842  19.1556          ?        ?      200.7        4.8       ?       ? 
1 1 1   29   23   57 f     73.6   14.0    0.0000   0.0000          ?        ?    57.4669  19.7942          ?        ?       73.6       14.0       ?       ? 
1 1 1   29   23   58 o     29.4   13.5    0.0000   0.0000          ?        ?   -11.4934  17.8786          ?        ?       29.4       13.5       ?       ? 
1 1 1   29   23   59 o     21.7   10.8    0.0000   0.0000          ?        ?   -45.9736  18.5171          ?        ?       21.7       10.8       ?       ? 
1 1 1   29   23   60 o     54.2   16.7    0.0000   0.0000          ?        ?    31.2876  19.7942          ?        ?       54.2       16.7       ?       ? 
1 1 1   29   24    0 o    285.7    5.3  817.3077  30.0105   817.3077  30.0105   817.3077  30.0105      285.7      5.3      285.7        5.3     0.0     0.0 
1 1 1   29   24    1 o    334.9    3.5    0.0000   0.0000          ?        ?  1121.8824  23.6253          ?        ?      334.9        3.5       ?       ? 
1 1 1   29   24    2 o    384.3    3.4    0.0000   0.0000          ?        ?  1477.5391  26.1794          ?        ?      384.3        3.4       ?       ? 
1 1 1   29   24    3 o    258.3    4.2    0.0000   0.0000          ?        ?   667.2551  21.7097          ?        ?      258.3        4.2       ?       ? 
1 1 1   29   24    4 o    277.7    3.9    0.0000   0.0000          ?        ?   771.3342  21.7097          ?        ?      277.7        3.9       ?       ? 
1 1 1   29   24    5 o    420.0    3.0    0.0000   0.0000          ?        ?  1764.2352  25.5409          ?        ?      420.0        3.0       ?       ? 
1 1 1   29   24    6 o    477.5    2.9    0.0000   0.0000          ?        ?  2280.7993  27.4564          ?        ?      477.5        2.9       ?       ? 
1 1 1   29   24    7 o    458.7    2.9    0.0000   0.0000          ?        ?  2104.5674  26.1794          ?        ?      458.7        2.9       ?       ? 
1 1 1   29   24    8 o    352.8    3.0    0.0000   0.0000          ?        ?  1245.1172  21.0712          ?        ?      352.8        3.0       ?       ? 
1 1 1   29   24    9 o    137.0    2.6    0.0000   0.0000          ?        ?   187.7254   7.0237          ?        ?      137.0        2.6       ?       ? 
1 1 1   29   24   10 o     93.8    4.4    0.0000   0.0000          ?        ?    88.1160   8.3008          ?        ?       93.8        4.4       ?       ? 
1 1 1   29   24   11 o    244.6    2.3    0.0000   0.0000          ?        ?   598.2947  11.4934          ?        ?      244.6        2.3       ?       ? 
1 1 1   29   24   12 o    372.9    2.4    0.0000   0.0000          ?        ?  1390.7001  17.8786          ?        ?      372.9        2.4       ?       ? 
1 1 1   29   24   13 o    277.6    2.5    0.0000   0.0000          ?        ?   770.6956  14.0475          ?        ?      277.6        2.5       ?       ? 
1 1 1   29   24   14 o    545.4    2.4    0.0000   0.0000          ?        ?  2974.8723  26.1794          ?        ?      545.4        2.4       ?       ? 
1 1 1   29   24   15 o    170.2    2.8    0.0000   0.0000          ?        ?   289.8888   9.5778          ?        ?      170.2        2.8       ?       ? 
1 1 1   29   24   16 o    573.7    2.6    0.0000   0.0000          ?        ?  3292.2173  29.3720          ?        ?      573.7        2.6       ?       ? 
1 1 1   29   24   17 o    166.3    3.1    0.0000   0.0000          ?        ?   276.4799  10.2163          ?        ?      166.3        3.1       ?       ? 
1 1 1   29   24   18 o     68.7    7.4    0.0000   0.0000          ?        ?    47.2506  10.2163          ?        ?       68.7        7.4       ?       ? 
1 1 1   29   24   19 o    307.8    2.4    0.0000   0.0000          ?        ?   947.5660  14.6860          ?        ?      307.8        2.4       ?       ? 
1 1 1   29   24   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   24   21 o    194.1    3.1    0.0000   0.0000          ?        ?   376.7278  12.1319          ?        ?      194.1        3.1       ?       ? 
1 1 1   29   24   22 o    280.4    2.6    0.0000   0.0000          ?        ?   786.6586  14.6860          ?        ?      280.4        2.6       ?       ? 
1 1 1   29   24   23 o    494.7    2.5    0.0000   0.0000          ?        ?  2448.0918  24.9023          ?        ?      494.7        2.5       ?       ? 
1 1 1   29   24   24 o    323.1    2.5    0.0000   0.0000          ?        ?  1043.9829  15.9630          ?        ?      323.1        2.5       ?       ? 
1 1 1   29   24   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   24   26 o    574.8    2.6    0.0000   0.0000          ?        ?  3304.3494  30.0105          ?        ?      574.8        2.6       ?       ? 
1 1 1   29   24   27 o    261.0    2.7    0.0000   0.0000          ?        ?   681.3026  14.0475          ?        ?      261.0        2.7       ?       ? 
1 1 1   29   24   28 o    271.6    2.8    0.0000   0.0000          ?        ?   738.1310  15.3245          ?        ?      271.6        2.8       ?       ? 
1 1 1   29   24   29 o    333.8    2.7    0.0000   0.0000          ?        ?  1114.2202  17.8786          ?        ?      333.8        2.7       ?       ? 
1 1 1   29   24   30 o     17.8    9.0    0.0000   0.0000          ?        ?   -46.6121  14.6860          ?        ?       17.8        9.0       ?       ? 
1 1 1   29   24   31 o    319.7    2.5    0.0000   0.0000          ?        ?  1022.2732  15.9630          ?        ?      319.7        2.5       ?       ? 
1 1 1   29   24   32 o    598.4    2.8    0.0000   0.0000          ?        ?  3582.1064  33.2031          ?        ?      598.4        2.8       ?       ? 
1 1 1   29   24   33 o    297.2    2.9    0.0000   0.0000          ?        ?   883.7139  17.2401          ?        ?      297.2        2.9       ?       ? 
1 1 1   29   24   34 o    140.6    5.2    0.0000   0.0000          ?        ?   197.9417  14.6860          ?        ?      140.6        5.2       ?       ? 
1 1 1   29   24   35 o     16.6    8.4    0.0000   0.0000          ?        ?   -49.8047  14.0475          ?        ?       16.6        8.4       ?       ? 
1 1 1   29   24   36 o    318.5    2.8    0.0000   0.0000          ?        ?  1014.6108  17.8786          ?        ?      318.5        2.8       ?       ? 
1 1 1   29   24   37 o    345.5    2.8    0.0000   0.0000          ?        ?  1194.0354  19.1556          ?        ?      345.5        2.8       ?       ? 
1 1 1   29   24   38 o    184.0    4.5    0.0000   0.0000          ?        ?   339.0550  16.6016          ?        ?      184.0        4.5       ?       ? 
1 1 1   29   24   39 o    162.1    4.9    0.0000   0.0000          ?        ?   263.0709  15.9630          ?        ?      162.1        4.9       ?       ? 
1 1 1   29   24   40 o    142.8    5.8    0.0000   0.0000          ?        ?   204.3269  16.6016          ?        ?      142.8        5.8       ?       ? 
1 1 1   29   24   41 o    213.6    3.9    0.0000   0.0000          ?        ?   456.5430  16.6016          ?        ?      213.6        3.9       ?       ? 
1 1 1   29   24   42 o    419.4    2.8    0.0000   0.0000          ?        ?  1759.7656  23.6253          ?        ?      419.4        2.8       ?       ? 
1 1 1   29   24   43 o    246.7    3.6    0.0000   0.0000          ?        ?   609.1497  17.8786          ?        ?      246.7        3.6       ?       ? 
1 1 1   29   24   44 o    242.7    3.7    0.0000   0.0000          ?        ?   589.3555  17.8786          ?        ?      242.7        3.7       ?       ? 
1 1 1   29   24   45 o    158.4    5.4    0.0000   0.0000          ?        ?   251.5775  17.2401          ?        ?      158.4        5.4       ?       ? 
1 1 1   29   24   46 o    408.5    2.7    0.0000   0.0000          ?        ?  1669.7340  22.3483          ?        ?      408.5        2.7       ?       ? 
1 1 1   29   24   47 o    254.6    3.6    0.0000   0.0000          ?        ?   648.7380  18.5171          ?        ?      254.6        3.6       ?       ? 
1 1 1   29   24   48 o     21.5   10.7    0.0000   0.0000          ?        ?   -44.0580  17.8786          ?        ?       21.5       10.7       ?       ? 
1 1 1   29   24   49 o    151.1    6.1    0.0000   0.0000          ?        ?   229.2293  18.5171          ?        ?      151.1        6.1       ?       ? 
1 1 1   29   24   50 o     53.1   15.7    0.0000   0.0000          ?        ?    29.3720  17.8786          ?        ?       53.1       15.7       ?       ? 
1 1 1   29   24   51 o    143.9    6.7    0.0000   0.0000          ?        ?   208.1580  19.1556          ?        ?      143.9        6.7       ?       ? 
1 1 1   29   24   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   24   53 o    285.0    3.6    0.0000   0.0000          ?        ?   813.4766  20.4327          ?        ?      285.0        3.6       ?       ? 
1 1 1   29   24   54 o    144.7    6.8    0.0000   0.0000          ?        ?   210.7121  19.7942          ?        ?      144.7        6.8       ?       ? 
1 1 1   29   24   55 o     71.1   14.0    0.0000   0.0000          ?        ?    53.6358  19.1556          ?        ?       71.1       14.0       ?       ? 
1 1 1   29   24   56 o    372.0    3.3    0.0000   0.0000          ?        ?  1386.2305  24.2638          ?        ?      372.0        3.3       ?       ? 
1 1 1   29   24   57 o     19.9   10.1    0.0000   0.0000          ?        ?   -67.6833  19.7942          ?        ?       19.9       10.1       ?       ? 
1 1 1   29   24   58 o     23.6   11.6    0.0000   0.0000          ?        ?   -35.7572  18.5171          ?        ?       23.6       11.6       ?       ? 
1 1 1   29   24   59 o     54.1   16.3    0.0000   0.0000          ?        ?    31.2876  19.1556          ?        ?       54.1       16.3       ?       ? 
1 1 1   29   25    0 o     24.8   16.8   -9.5778  23.6253    -9.5778  23.6253    -9.5778  23.6253       24.8     16.8       24.8       16.8     0.0     0.0 
1 1 1   29   25    1 o    172.8    5.9    0.0000   0.0000          ?        ?   298.8281  20.4327          ?        ?      172.8        5.9       ?       ? 
1 1 1   29   25    2 o    943.7    4.3    0.0000   0.0000          ?        ?  8910.5693  81.7308          ?        ?      943.7        4.3       ?       ? 
1 1 1   29   25    3 o    653.9    3.6    0.0000   0.0000          ?        ?  4277.4565  47.2506          ?        ?      653.9        3.6       ?       ? 
1 1 1   29   25    4 o    422.9    3.1    0.0000   0.0000          ?        ?  1788.4991  26.1794          ?        ?      422.9        3.1       ?       ? 
1 1 1   29   25    5 o    403.5    3.1    0.0000   0.0000          ?        ?  1628.8687  24.9023          ?        ?      403.5        3.1       ?       ? 
1 1 1   29   25    6 o    260.9    3.3    0.0000   0.0000          ?        ?   680.6641  17.2401          ?        ?      260.9        3.3       ?       ? 
1 1 1   29   25    7 o    448.0    2.8    0.0000   0.0000          ?        ?  2007.5120  24.9023          ?        ?      448.0        2.8       ?       ? 
1 1 1   29   25    8 o    662.6    3.3    0.0000   0.0000          ?        ?  4391.1133  43.4195          ?        ?      662.6        3.3       ?       ? 
1 1 1   29   25    9 o    308.6    2.4    0.0000   0.0000          ?        ?   952.6743  14.6860          ?        ?      308.6        2.4       ?       ? 
1 1 1   29   25   10 o    129.3    4.0    0.0000   0.0000          ?        ?   167.2927  10.2163          ?        ?      129.3        4.0       ?       ? 
1 1 1   29   25   11 o    144.5    2.9    0.0000   0.0000          ?        ?   208.7966   8.3008          ?        ?      144.5        2.9       ?       ? 
1 1 1   29   25   12 f     79.9    5.2    0.0000   0.0000          ?        ?    63.8522   8.3008          ?        ?       79.9        5.2       ?       ? 
1 1 1   29   25   13 o    336.5    2.4    0.0000   0.0000          ?        ?  1132.7373  15.9630          ?        ?      336.5        2.4       ?       ? 
1 1 1   29   25   14 o     13.0    6.5    0.0000   0.0000          ?        ?   -23.6253   7.6623          ?        ?       13.0        6.5       ?       ? 
1 1 1   29   25   15 o    560.4    2.5    0.0000   0.0000          ?        ?  3141.5264  28.0950          ?        ?      560.4        2.5       ?       ? 
1 1 1   29   25   16 o    431.2    2.3    0.0000   0.0000          ?        ?  1859.3750  19.7942          ?        ?      431.2        2.3       ?       ? 
1 1 1   29   25   17 o    409.0    2.3    0.0000   0.0000          ?        ?  1672.9266  18.5171          ?        ?      409.0        2.3       ?       ? 
1 1 1   29   25   18 o    429.4    2.2    0.0000   0.0000          ?        ?  1844.0504  19.1556          ?        ?      429.4        2.2       ?       ? 
1 1 1   29   25   19 o    470.6    2.4    0.0000   0.0000          ?        ?  2215.0315  22.3483          ?        ?      470.6        2.4       ?       ? 
1 1 1   29   25   20 o    142.9    3.8    0.0000   0.0000          ?        ?   204.3269  10.8549          ?        ?      142.9        3.8       ?       ? 
1 1 1   29   25   21 o    719.7    2.8    0.0000   0.0000          ?        ?  5181.6030  40.8654          ?        ?      719.7        2.8       ?       ? 
1 1 1   29   25   22 o    258.9    2.6    0.0000   0.0000          ?        ?   670.4477  13.4090          ?        ?      258.9        2.6       ?       ? 
1 1 1   29   25   23 o    441.0    2.4    0.0000   0.0000          ?        ?  1944.9369  21.0712          ?        ?      441.0        2.4       ?       ? 
1 1 1   29   25   24 o     20.9   10.1    0.0000   0.0000          ?        ?   -20.4327  12.7704          ?        ?       20.9       10.1       ?       ? 
1 1 1   29   25   25 o   1030.6    3.8    0.0000   0.0000          ?        ? 10626.2764  78.5382          ?        ?     1030.6        3.8       ?       ? 
1 1 1   29   25   26 o    216.0    3.4    0.0000   0.0000          ?        ?   466.7593  14.6860          ?        ?      216.0        3.4       ?       ? 
1 1 1   29   25   27 o    480.8    2.5    0.0000   0.0000          ?        ?  2312.0869  24.2638          ?        ?      480.8        2.5       ?       ? 
1 1 1   29   25   28 o     94.1    6.8    0.0000   0.0000          ?        ?    88.7545  12.7704          ?        ?       94.1        6.8       ?       ? 
1 1 1   29   25   29 o    324.8    2.7    0.0000   0.0000          ?        ?  1055.4763  17.2401          ?        ?      324.8        2.7       ?       ? 
1 1 1   29   25   30 o    199.9    3.7    0.0000   0.0000          ?        ?   399.7145  14.6860          ?        ?      199.9        3.7       ?       ? 
1 1 1   29   25   31 o    390.2    2.6    0.0000   0.0000          ?        ?  1522.8740  20.4327          ?        ?      390.2        2.6       ?       ? 
1 1 1   29   25   32 o    301.8    2.8    0.0000   0.0000          ?        ?   911.1703  16.6016          ?        ?      301.8        2.8       ?       ? 
1 1 1   29   25   33 o    127.0    5.5    0.0000   0.0000          ?        ?   161.5460  14.0475          ?        ?      127.0        5.5       ?       ? 
1 1 1   29   25   34 o    410.0    2.6    0.0000   0.0000          ?        ?  1681.2274  21.0712          ?        ?      410.0        2.6       ?       ? 
1 1 1   29   25   35 o    425.9    2.6    0.0000   0.0000          ?        ?  1814.6786  22.3483          ?        ?      425.9        2.6       ?       ? 
1 1 1   29   25   36 o     41.2   14.7    0.0000   0.0000          ?        ?    14.6860  15.3245          ?        ?       41.2       14.7       ?       ? 
1 1 1   29   25   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   25   38 f    132.4    5.5    0.0000   0.0000          ?        ?   175.5934  14.6860          ?        ?      132.4        5.5       ?       ? 
1 1 1   29   25   39 o    239.6    3.5    0.0000   0.0000          ?        ?   574.6694  16.6016          ?        ?      239.6        3.5       ?       ? 
1 1 1   29   25   40 o    190.2    4.4    0.0000   0.0000          ?        ?   362.0418  16.6016          ?        ?      190.2        4.4       ?       ? 
1 1 1   29   25   41 o    483.4    2.6    0.0000   0.0000          ?        ?  2338.2664  25.5409          ?        ?      483.4        2.6       ?       ? 
1 1 1   29   25   42 f    273.9    3.3    0.0000   0.0000          ?        ?   750.9014  17.8786          ?        ?      273.9        3.3       ?       ? 
1 1 1   29   25   43 o    231.8    3.7    0.0000   0.0000          ?        ?   537.6352  17.2401          ?        ?      231.8        3.7       ?       ? 
1 1 1   29   25   44 o    462.6    2.7    0.0000   0.0000          ?        ?  2141.6016  24.9023          ?        ?      462.6        2.7       ?       ? 
1 1 1   29   25   45 o    235.2    3.8    0.0000   0.0000          ?        ?   553.5982  17.8786          ?        ?      235.2        3.8       ?       ? 
1 1 1   29   25   46 o    285.4    3.5    0.0000   0.0000          ?        ?   815.3921  19.7942          ?        ?      285.4        3.5       ?       ? 
1 1 1   29   25   47 o    182.7    4.9    0.0000   0.0000          ?        ?   334.5853  17.8786          ?        ?      182.7        4.9       ?       ? 
1 1 1   29   25   48 o     86.7   10.3    0.0000   0.0000          ?        ?    75.9841  17.8786          ?        ?       86.7       10.3       ?       ? 
1 1 1   29   25   49 o    259.1    3.7    0.0000   0.0000          ?        ?   672.3633  19.1556          ?        ?      259.1        3.7       ?       ? 
1 1 1   29   25   50 o    114.0    7.8    0.0000   0.0000          ?        ?   130.8969  17.8786          ?        ?      114.0        7.8       ?       ? 
1 1 1   29   25   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   25   52 o    270.0    3.8    0.0000   0.0000          ?        ?   730.4688  20.4327          ?        ?      270.0        3.8       ?       ? 
1 1 1   29   25   53 o    399.3    2.9    0.0000   0.0000          ?        ?  1596.3041  22.9868          ?        ?      399.3        2.9       ?       ? 
1 1 1   29   25   54 o    130.8    7.3    0.0000   0.0000          ?        ?   172.4008  19.1556          ?        ?      130.8        7.3       ?       ? 
1 1 1   29   25   55 o    131.3    6.8    0.0000   0.0000          ?        ?   173.6779  17.8786          ?        ?      131.3        6.8       ?       ? 
1 1 1   29   25   56 o    190.4    5.0    0.0000   0.0000          ?        ?   363.9573  19.1556          ?        ?      190.4        5.0       ?       ? 
1 1 1   29   25   57 o    190.2    5.0    0.0000   0.0000          ?        ?   363.3188  19.1556          ?        ?      190.2        5.0       ?       ? 
1 1 1   29   25   58 o    129.6    7.4    0.0000   0.0000          ?        ?   169.8468  19.1556          ?        ?      129.6        7.4       ?       ? 
1 1 1   29   26    0 o    270.4    6.9  733.0228  37.0343   733.0228  37.0343   733.0228  37.0343      270.4      6.9      270.4        6.9     0.0     0.0 
1 1 1   29   26    1 o    805.3    3.8    0.0000   0.0000          ?        ?  6488.0181  61.9366          ?        ?      805.3        3.8       ?       ? 
1 1 1   29   26    2 o    271.9    3.9    0.0000   0.0000          ?        ?   739.4081  21.0712          ?        ?      271.9        3.9       ?       ? 
1 1 1   29   26    3 o    449.2    3.2    0.0000   0.0000          ?        ?  2018.3669  28.7335          ?        ?      449.2        3.2       ?       ? 
1 1 1   29   26    4 o    620.6    3.3    0.0000   0.0000          ?        ?  3852.2009  41.5039          ?        ?      620.6        3.3       ?       ? 
1 1 1   29   26    5 o    270.9    3.9    0.0000   0.0000          ?        ?   734.2999  21.0712          ?        ?      270.9        3.9       ?       ? 
1 1 1   29   26    6 o    330.0    3.1    0.0000   0.0000          ?        ?  1089.3180  20.4327          ?        ?      330.0        3.1       ?       ? 
1 1 1   29   26    7 o    224.0    3.4    0.0000   0.0000          ?        ?   501.8780  15.3245          ?        ?      224.0        3.4       ?       ? 
1 1 1   29   26    8 o     16.7    8.4    0.0000   0.0000          ?        ?   -40.2269  12.7704          ?        ?       16.7        8.4       ?       ? 
1 1 1   29   26    9 o    439.4    2.8    0.0000   0.0000          ?        ?  1930.8894  24.9023          ?        ?      439.4        2.8       ?       ? 
1 1 1   29   26   10 o     21.2    9.9    0.0000   0.0000          ?        ?    -9.5778  10.2163          ?        ?       21.2        9.9       ?       ? 
1 1 1   29   26   11 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   26   12 o     30.2   11.5    0.0000   0.0000          ?        ?     6.3852   9.5778          ?        ?       30.2       11.5       ?       ? 
1 1 1   29   26   13 o    384.1    2.3    0.0000   0.0000          ?        ?  1475.6235  17.8786          ?        ?      384.1        2.3       ?       ? 
1 1 1   29   26   14 o    606.2    2.6    0.0000   0.0000          ?        ?  3675.9690  31.9261          ?        ?      606.2        2.6       ?       ? 
1 1 1   29   26   15 o     98.5    4.5    0.0000   0.0000          ?        ?    97.0553   8.9393          ?        ?       98.5        4.5       ?       ? 
1 1 1   29   26   16 o    274.4    2.3    0.0000   0.0000          ?        ?   752.8170  12.7704          ?        ?      274.4        2.3       ?       ? 
1 1 1   29   26   17 o     79.5    5.6    0.0000   0.0000          ?        ?    63.2136   8.9393          ?        ?       79.5        5.6       ?       ? 
1 1 1   29   26   18 o    104.8    4.9    0.0000   0.0000          ?        ?   109.8257  10.2163          ?        ?      104.8        4.9       ?       ? 
1 1 1   29   26   19 o    155.7    3.3    0.0000   0.0000          ?        ?   242.6382  10.2163          ?        ?      155.7        3.3       ?       ? 
1 1 1   29   26   20 o    215.0    2.8    0.0000   0.0000          ?        ?   462.2897  12.1319          ?        ?      215.0        2.8       ?       ? 
1 1 1   29   26   21 o     24.1   10.9    0.0000   0.0000          ?        ?    -7.0237  11.4934          ?        ?       24.1       10.9       ?       ? 
1 1 1   29   26   22 o     78.2    8.2    0.0000   0.0000          ?        ?    61.2981  12.7704          ?        ?       78.2        8.2       ?       ? 
1 1 1   29   26   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   26   24 o    121.7    5.0    0.0000   0.0000          ?        ?   148.1370  12.1319          ?        ?      121.7        5.0       ?       ? 
1 1 1   29   26   25 o    277.8    3.0    0.0000   0.0000          ?        ?   771.9727  16.6016          ?        ?      277.8        3.0       ?       ? 
1 1 1   29   26   26 o    463.4    2.4    0.0000   0.0000          ?        ?  2147.9868  22.3483          ?        ?      463.4        2.4       ?       ? 
1 1 1   29   26   27 o    176.8    3.8    0.0000   0.0000          ?        ?   312.8756  13.4090          ?        ?      176.8        3.8       ?       ? 
1 1 1   29   26   28 o    296.0    2.7    0.0000   0.0000          ?        ?   876.6902  15.9630          ?        ?      296.0        2.7       ?       ? 
1 1 1   29   26   29 o     64.8    9.9    0.0000   0.0000          ?        ?    42.1424  12.7704          ?        ?       64.8        9.9       ?       ? 
1 1 1   29   26   30 o     33.9   13.4    0.0000   0.0000          ?        ?     6.3852  13.4090          ?        ?       33.9       13.4       ?       ? 
1 1 1   29   26   31 o    249.5    3.1    0.0000   0.0000          ?        ?   622.5586  15.3245          ?        ?      249.5        3.1       ?       ? 
1 1 1   29   26   32 o    126.7    5.8    0.0000   0.0000          ?        ?   160.9075  14.6860          ?        ?      126.7        5.8       ?       ? 
1 1 1   29   26   33 o    442.3    2.5    0.0000   0.0000          ?        ?  1957.0687  22.3483          ?        ?      442.3        2.5       ?       ? 
1 1 1   29   26   34 o    372.3    2.7    0.0000   0.0000          ?        ?  1386.8689  19.7942          ?        ?      372.3        2.7       ?       ? 
1 1 1   29   26   35 o    221.5    3.9    0.0000   0.0000          ?        ?   491.0231  17.2401          ?        ?      221.5        3.9       ?       ? 
1 1 1   29   26   36 o    102.5    7.5    0.0000   0.0000          ?        ?   105.3561  15.3245          ?        ?      102.5        7.5       ?       ? 
1 1 1   29   26   37 f     61.6   12.4    0.0000   0.0000          ?        ?    39.5883  14.6860          ?        ?       61.6       12.4       ?       ? 
1 1 1   29   26   38 o    260.2    3.2    0.0000   0.0000          ?        ?   677.4714  16.6016          ?        ?      260.2        3.2       ?       ? 
1 1 1   29   26   39 o    304.1    2.8    0.0000   0.0000          ?        ?   925.2178  17.2401          ?        ?      304.1        2.8       ?       ? 
1 1 1   29   26   40 o    165.2    4.8    0.0000   0.0000          ?        ?   273.2873  15.9630          ?        ?      165.2        4.8       ?       ? 
1 1 1   29   26   41 o     66.3   13.0    0.0000   0.0000          ?        ?    45.9736  16.6016          ?        ?       66.3       13.0       ?       ? 
1 1 1   29   26   42 o    530.0    2.7    0.0000   0.0000          ?        ?  2810.7722  28.0950          ?        ?      530.0        2.7       ?       ? 
1 1 1   29   26   43 o    314.1    3.0    0.0000   0.0000          ?        ?   987.1545  19.1556          ?        ?      314.1        3.0       ?       ? 
1 1 1   29   26   44 o     85.7    9.7    0.0000   0.0000          ?        ?    74.0685  16.6016          ?        ?       85.7        9.7       ?       ? 
1 1 1   29   26   45 o     19.9    9.9    0.0000   0.0000          ?        ?   -45.9736  16.6016          ?        ?       19.9        9.9       ?       ? 
1 1 1   29   26   46 o    433.4    2.8    0.0000   0.0000          ?        ?  1879.8076  24.2638          ?        ?      433.4        2.8       ?       ? 
1 1 1   29   26   47 o    161.0    5.6    0.0000   0.0000          ?        ?   259.8783  17.8786          ?        ?      161.0        5.6       ?       ? 
1 1 1   29   26   48 o    168.1    5.7    0.0000   0.0000          ?        ?   283.5036  19.1556          ?        ?      168.1        5.7       ?       ? 
1 1 1   29   26   49 o    310.9    3.2    0.0000   0.0000          ?        ?   967.3603  19.7942          ?        ?      310.9        3.2       ?       ? 
1 1 1   29   26   50 o    123.4    7.5    0.0000   0.0000          ?        ?   153.2452  18.5171          ?        ?      123.4        7.5       ?       ? 
1 1 1   29   26   51 o    132.1    6.8    0.0000   0.0000          ?        ?   175.5934  17.8786          ?        ?      132.1        6.8       ?       ? 
1 1 1   29   26   52 o    318.5    3.3    0.0000   0.0000          ?        ?  1015.8879  21.0712          ?        ?      318.5        3.3       ?       ? 
1 1 1   29   26   53 o     39.5   15.9    0.0000   0.0000          ?        ?     8.3008  19.1556          ?        ?       39.5       15.9       ?       ? 
1 1 1   29   26   54 o     88.6   10.5    0.0000   0.0000          ?        ?    79.8152  18.5171          ?        ?       88.6       10.5       ?       ? 
1 1 1   29   26   55 o     79.9   11.2    0.0000   0.0000          ?        ?    65.1292  17.8786          ?        ?       79.9       11.2       ?       ? 
1 1 1   29   26   56 o    182.7    5.1    0.0000   0.0000          ?        ?   335.2238  18.5171          ?        ?      182.7        5.1       ?       ? 
1 1 1   29   26   57 o     45.9   15.9    0.0000   0.0000          ?        ?    20.4327  17.8786          ?        ?       45.9       15.9       ?       ? 
1 1 1   29   27    0 o    284.4    4.6  809.6454  26.1794   809.6454  26.1794   809.6454  26.1794      284.4      4.6      284.4        4.6     0.0     0.0 
1 1 1   29   27    1 o    307.7    3.4    0.0000   0.0000          ?        ?   946.9276  21.0712          ?        ?      307.7        3.4       ?       ? 
1 1 1   29   27    2 o    269.7    3.6    0.0000   0.0000          ?        ?   727.9147  19.1556          ?        ?      269.7        3.6       ?       ? 
1 1 1   29   27    3 o    398.8    3.0    0.0000   0.0000          ?        ?  1591.1959  23.6253          ?        ?      398.8        3.0       ?       ? 
1 1 1   29   27    4 o    489.5    3.2    0.0000   0.0000          ?        ?  2396.3716  31.2876          ?        ?      489.5        3.2       ?       ? 
1 1 1   29   27    5 o    182.5    4.9    0.0000   0.0000          ?        ?   333.3083  17.8786          ?        ?      182.5        4.9       ?       ? 
1 1 1   29   27    6 o    395.3    3.4    0.0000   0.0000          ?        ?  1563.1010  26.8179          ?        ?      395.3        3.4       ?       ? 
1 1 1   29   27    7 o    367.2    3.7    0.0000   0.0000          ?        ?  1349.1962  27.4564          ?        ?      367.2        3.7       ?       ? 
1 1 1   29   27    8 o    465.3    2.9    0.0000   0.0000          ?        ?  2165.2268  26.8179          ?        ?      465.3        2.9       ?       ? 
1 1 1   29   27    9 o    149.5    3.4    0.0000   0.0000          ?        ?   223.4826  10.2163          ?        ?      149.5        3.4       ?       ? 
1 1 1   29   27   10 o    128.8    4.7    0.0000   0.0000          ?        ?   166.0156  12.1319          ?        ?      128.8        4.7       ?       ? 
1 1 1   29   27   11 o    725.5    3.4    0.0000   0.0000          ?        ?  5265.8877  49.1662          ?        ?      725.5        3.4       ?       ? 
1 1 1   29   27   12 o    322.7    2.8    0.0000   0.0000          ?        ?  1041.4288  17.8786          ?        ?      322.7        2.8       ?       ? 
1 1 1   29   27   13 o    488.3    2.6    0.0000   0.0000          ?        ?  2384.8782  25.5409          ?        ?      488.3        2.6       ?       ? 
1 1 1   29   27   14 o    345.2    2.2    0.0000   0.0000          ?        ?  1191.4814  15.3245          ?        ?      345.2        2.2       ?       ? 
1 1 1   29   27   15 o    374.0    2.1    0.0000   0.0000          ?        ?  1399.0010  15.9630          ?        ?      374.0        2.1       ?       ? 
1 1 1   29   27   16 o    449.6    2.3    0.0000   0.0000          ?        ?  2021.5594  20.4327          ?        ?      449.6        2.3       ?       ? 
1 1 1   29   27   17 o    160.0    3.0    0.0000   0.0000          ?        ?   256.0471   9.5778          ?        ?      160.0        3.0       ?       ? 
1 1 1   29   27   18 o    295.8    2.2    0.0000   0.0000          ?        ?   875.4132  12.7704          ?        ?      295.8        2.2       ?       ? 
1 1 1   29   27   19 o    250.3    2.4    0.0000   0.0000          ?        ?   626.3897  12.1319          ?        ?      250.3        2.4       ?       ? 
1 1 1   29   27   20 o    456.6    2.4    0.0000   0.0000          ?        ?  2085.4116  21.7097          ?        ?      456.6        2.4       ?       ? 
1 1 1   29   27   21 o    166.0    3.5    0.0000   0.0000          ?        ?   275.8413  11.4934          ?        ?      166.0        3.5       ?       ? 
1 1 1   29   27   22 o    292.4    2.5    0.0000   0.0000          ?        ?   854.9804  14.6860          ?        ?      292.4        2.5       ?       ? 
1 1 1   29   27   23 o    217.9    2.9    0.0000   0.0000          ?        ?   475.0601  12.7704          ?        ?      217.9        2.9       ?       ? 
1 1 1   29   27   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   27   25 o    402.0    2.5    0.0000   0.0000          ?        ?  1616.7367  19.7942          ?        ?      402.0        2.5       ?       ? 
1 1 1   29   27   26 o    383.7    2.5    0.0000   0.0000          ?        ?  1472.4309  19.1556          ?        ?      383.7        2.5       ?       ? 
1 1 1   29   27   27 o    381.8    2.4    0.0000   0.0000          ?        ?  1457.7449  18.5171          ?        ?      381.8        2.4       ?       ? 
1 1 1   29   27   28 o    185.8    3.6    0.0000   0.0000          ?        ?   345.4402  13.4090          ?        ?      185.8        3.6       ?       ? 
1 1 1   29   27   29 o    264.6    3.0    0.0000   0.0000          ?        ?   700.4582  15.9630          ?        ?      264.6        3.0       ?       ? 
1 1 1   29   27   30 o    316.5    2.6    0.0000   0.0000          ?        ?  1001.8404  16.6016          ?        ?      316.5        2.6       ?       ? 
1 1 1   29   27   31 o    444.9    2.5    0.0000   0.0000          ?        ?  1980.0555  22.3483          ?        ?      444.9        2.5       ?       ? 
1 1 1   29   27   32 o    108.5    7.1    0.0000   0.0000          ?        ?   118.1265  15.3245          ?        ?      108.5        7.1       ?       ? 
1 1 1   29   27   33 o     25.0   11.7    0.0000   0.0000          ?        ?   -14.6860  14.6860          ?        ?       25.0       11.7       ?       ? 
1 1 1   29   27   34 o    354.7    2.6    0.0000   0.0000          ?        ?  1258.5261  18.5171          ?        ?      354.7        2.6       ?       ? 
1 1 1   29   27   35 f    293.7    2.9    0.0000   0.0000          ?        ?   863.2812  17.2401          ?        ?      293.7        2.9       ?       ? 
1 1 1   29   27   36 o     29.4   13.2    0.0000   0.0000          ?        ?    -7.0237  15.9630          ?        ?       29.4       13.2       ?       ? 
1 1 1   29   27   37 o    290.6    3.0    0.0000   0.0000          ?        ?   844.7642  17.2401          ?        ?      290.6        3.0       ?       ? 
1 1 1   29   27   38 o    351.4    2.9    0.0000   0.0000          ?        ?  1235.5393  20.4327          ?        ?      351.4        2.9       ?       ? 
1 1 1   29   27   39 f    315.8    2.9    0.0000   0.0000          ?        ?   998.0093  18.5171          ?        ?      315.8        2.9       ?       ? 
1 1 1   29   27   40 o    287.6    3.2    0.0000   0.0000          ?        ?   827.5240  18.5171          ?        ?      287.6        3.2       ?       ? 
1 1 1   29   27   41 o    247.1    3.5    0.0000   0.0000          ?        ?   611.0652  17.2401          ?        ?      247.1        3.5       ?       ? 
1 1 1   29   27   42 o    193.3    4.5    0.0000   0.0000          ?        ?   374.1737  17.2401          ?        ?      193.3        4.5       ?       ? 
1 1 1   29   27   43 o    161.6    5.3    0.0000   0.0000          ?        ?   261.7939  17.2401          ?        ?      161.6        5.3       ?       ? 
1 1 1   29   27   44 o    121.2    7.1    0.0000   0.0000          ?        ?   147.4985  17.2401          ?        ?      121.2        7.1       ?       ? 
1 1 1   29   27   45 o    292.1    3.3    0.0000   0.0000          ?        ?   854.3420  19.1556          ?        ?      292.1        3.3       ?       ? 
1 1 1   29   27   46 o    152.0    5.9    0.0000   0.0000          ?        ?   231.7833  17.8786          ?        ?      152.0        5.9       ?       ? 
1 1 1   29   27   47 o     21.5   10.7    0.0000   0.0000          ?        ?   -44.0580  17.8786          ?        ?       21.5       10.7       ?       ? 
1 1 1   29   27   48 o    200.3    4.6    0.0000   0.0000          ?        ?   402.2686  18.5171          ?        ?      200.3        4.6       ?       ? 
1 1 1   29   27   49 o    100.9    9.2    0.0000   0.0000          ?        ?   102.8020  18.5171          ?        ?      100.9        9.2       ?       ? 
1 1 1   29   27   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   27   51 o     35.4   15.0    0.0000   0.0000          ?        ?     1.2770  18.5171          ?        ?       35.4       15.0       ?       ? 
1 1 1   29   27   52 o    297.2    3.5    0.0000   0.0000          ?        ?   884.9910  21.0712          ?        ?      297.2        3.5       ?       ? 
1 1 1   29   27   53 o    164.1    5.6    0.0000   0.0000          ?        ?   270.7332  18.5171          ?        ?      164.1        5.6       ?       ? 
1 1 1   29   27   54 o     78.2   11.4    0.0000   0.0000          ?        ?    62.5751  17.8786          ?        ?       78.2       11.4       ?       ? 
1 1 1   29   27   55 o     54.1   16.0    0.0000   0.0000          ?        ?    31.2876  18.5171          ?        ?       54.1       16.0       ?       ? 
1 1 1   29   27   56 o     32.7   14.5    0.0000   0.0000          ?        ?    -5.7467  19.1556          ?        ?       32.7       14.5       ?       ? 
1 1 1   29   28    0 o    374.4    4.4 1402.8320  33.2031  1402.8320  33.2031  1402.8320  33.2031      374.4      4.4      374.4        4.4     0.0     0.0 
1 1 1   29   28    1 o    519.8    3.1    0.0000   0.0000          ?        ?  2702.8621  32.5646          ?        ?      519.8        3.1       ?       ? 
1 1 1   29   28    2 o    358.0    3.2    0.0000   0.0000          ?        ?  1282.1515  22.9868          ?        ?      358.0        3.2       ?       ? 
1 1 1   29   28    3 o    311.5    3.4    0.0000   0.0000          ?        ?   970.5529  21.0712          ?        ?      311.5        3.4       ?       ? 
1 1 1   29   28    4 o    348.8    3.2    0.0000   0.0000          ?        ?  1217.0222  22.3483          ?        ?      348.8        3.2       ?       ? 
1 1 1   29   28    5 o    405.3    3.2    0.0000   0.0000          ?        ?  1643.5547  25.5409          ?        ?      405.3        3.2       ?       ? 
1 1 1   29   28    6 o    329.5    5.6    0.0000   0.0000          ?        ?  1086.7638  37.0343          ?        ?      329.5        5.6       ?       ? 
1 1 1   29   28    7 o   1111.9    4.9    0.0000   0.0000          ?        ? 12371.9951 109.1872          ?        ?     1111.9        4.9       ?       ? 
1 1 1   29   28    8 o    635.3    3.5    0.0000   0.0000          ?        ?  4038.0110  44.6965          ?        ?      635.3        3.5       ?       ? 
1 1 1   29   28    9 o    254.0    4.4    0.0000   0.0000          ?        ?   645.5453  22.3483          ?        ?      254.0        4.4       ?       ? 
1 1 1   29   28   10 o    638.8    2.8    0.0000   0.0000          ?        ?  4081.4304  36.3957          ?        ?      638.8        2.8       ?       ? 
1 1 1   29   28   11 o    207.9    3.8    0.0000   0.0000          ?        ?   432.2791  15.9630          ?        ?      207.9        3.8       ?       ? 
1 1 1   29   28   12 o    565.2    3.0    0.0000   0.0000          ?        ?  3195.8008  33.8416          ?        ?      565.2        3.0       ?       ? 
1 1 1   29   28   13 o    195.4    3.3    0.0000   0.0000          ?        ?   381.8359  12.7704          ?        ?      195.4        3.3       ?       ? 
1 1 1   29   28   14 o    244.2    2.5    0.0000   0.0000          ?        ?   596.3792  12.1319          ?        ?      244.2        2.5       ?       ? 
1 1 1   29   28   15 o    295.2    2.2    0.0000   0.0000          ?        ?   871.5820  12.7704          ?        ?      295.2        2.2       ?       ? 
1 1 1   29   28   16 o    210.3    2.4    0.0000   0.0000          ?        ?   442.4955  10.2163          ?        ?      210.3        2.4       ?       ? 
1 1 1   29   28   17 f    135.8    3.5    0.0000   0.0000          ?        ?   184.5327   9.5778          ?        ?      135.8        3.5       ?       ? 
1 1 1   29   28   18 o    317.4    2.3    0.0000   0.0000          ?        ?  1007.5872  14.6860          ?        ?      317.4        2.3       ?       ? 
1 1 1   29   28   19 f    305.0    2.5    0.0000   0.0000          ?        ?   930.3260  15.3245          ?        ?      305.0        2.5       ?       ? 
1 1 1   29   28   20 o    261.0    2.6    0.0000   0.0000          ?        ?   681.3026  13.4090          ?        ?      261.0        2.6       ?       ? 
1 1 1   29   28   21 o    321.0    2.4    0.0000   0.0000          ?        ?  1030.5739  15.3245          ?        ?      321.0        2.4       ?       ? 
1 1 1   29   28   22 o    272.4    2.6    0.0000   0.0000          ?        ?   741.9621  14.0475          ?        ?      272.4        2.6       ?       ? 
1 1 1   29   28   23 o    334.3    2.4    0.0000   0.0000          ?        ?  1118.0514  15.9630          ?        ?      334.3        2.4       ?       ? 
1 1 1   29   28   24 o    347.8    2.5    0.0000   0.0000          ?        ?  1209.9985  17.2401          ?        ?      347.8        2.5       ?       ? 
1 1 1   29   28   25 o    613.3    2.7    0.0000   0.0000          ?        ?  3762.8079  32.5646          ?        ?      613.3        2.7       ?       ? 
1 1 1   29   28   26 o    386.4    2.4    0.0000   0.0000          ?        ?  1493.5021  18.5171          ?        ?      386.4        2.4       ?       ? 
1 1 1   29   28   27 o    422.5    2.4    0.0000   0.0000          ?        ?  1785.3065  20.4327          ?        ?      422.5        2.4       ?       ? 
1 1 1   29   28   28 o    297.7    2.8    0.0000   0.0000          ?        ?   886.9065  16.6016          ?        ?      297.7        2.8       ?       ? 
1 1 1   29   28   29 o    386.8    2.5    0.0000   0.0000          ?        ?  1496.6947  19.1556          ?        ?      386.8        2.5       ?       ? 
1 1 1   29   28   30 o    285.7    2.9    0.0000   0.0000          ?        ?   816.6692  16.6016          ?        ?      285.7        2.9       ?       ? 
1 1 1   29   28   31 o    179.3    4.1    0.0000   0.0000          ?        ?   321.8149  14.6860          ?        ?      179.3        4.1       ?       ? 
1 1 1   29   28   32 o    393.8    2.8    0.0000   0.0000          ?        ?  1551.6075  22.3483          ?        ?      393.8        2.8       ?       ? 
1 1 1   29   28   33 o    495.9    2.6    0.0000   0.0000          ?        ?  2460.2236  25.5409          ?        ?      495.9        2.6       ?       ? 
1 1 1   29   28   34 o    295.0    2.9    0.0000   0.0000          ?        ?   870.9435  17.2401          ?        ?      295.0        2.9       ?       ? 
1 1 1   29   28   35 o    281.3    3.0    0.0000   0.0000          ?        ?   791.7668  16.6016          ?        ?      281.3        3.0       ?       ? 
1 1 1   29   28   36 o    351.0    3.0    0.0000   0.0000          ?        ?  1232.9854  21.0712          ?        ?      351.0        3.0       ?       ? 
1 1 1   29   28   37 o     26.2   12.1    0.0000   0.0000          ?        ?   -11.4934  14.6860          ?        ?       26.2       12.1       ?       ? 
1 1 1   29   28   38 o    114.2    7.0    0.0000   0.0000          ?        ?   130.8969  15.9630          ?        ?      114.2        7.0       ?       ? 
1 1 1   29   28   39 o    225.8    3.7    0.0000   0.0000          ?        ?   510.1788  16.6016          ?        ?      225.8        3.7       ?       ? 
1 1 1   29   28   40 o    151.5    5.3    0.0000   0.0000          ?        ?   229.8678  15.9630          ?        ?      151.5        5.3       ?       ? 
1 1 1   29   28   41 o     72.5   10.6    0.0000   0.0000          ?        ?    52.9973  15.3245          ?        ?       72.5       10.6       ?       ? 
1 1 1   29   28   42 o     48.9   15.3    0.0000   0.0000          ?        ?    24.2638  16.6016          ?        ?       48.9       15.3       ?       ? 
1 1 1   29   28   43 o    115.3    7.2    0.0000   0.0000          ?        ?   133.4510  16.6016          ?        ?      115.3        7.2       ?       ? 
1 1 1   29   28   44 o    247.8    3.6    0.0000   0.0000          ?        ?   614.8964  17.8786          ?        ?      247.8        3.6       ?       ? 
1 1 1   29   28   45 o     73.6   11.7    0.0000   0.0000          ?        ?    54.9129  17.2401          ?        ?       73.6       11.7       ?       ? 
1 1 1   29   28   46 o     90.7    9.5    0.0000   0.0000          ?        ?    83.0078  17.2401          ?        ?       90.7        9.5       ?       ? 
1 1 1   29   28   47 o    147.7    5.8    0.0000   0.0000          ?        ?   219.0129  17.2401          ?        ?      147.7        5.8       ?       ? 
1 1 1   29   28   48 o     92.0    9.4    0.0000   0.0000          ?        ?    85.5619  17.2401          ?        ?       92.0        9.4       ?       ? 
1 1 1   29   28   49 o     22.5   11.1    0.0000   0.0000          ?        ?   -38.3113  17.8786          ?        ?       22.5       11.1       ?       ? 
1 1 1   29   28   50 o    135.7    6.6    0.0000   0.0000          ?        ?   185.1713  17.8786          ?        ?      135.7        6.6       ?       ? 
1 1 1   29   28   51 o     24.6   11.9    0.0000   0.0000          ?        ?   -28.0950  17.8786          ?        ?       24.6       11.9       ?       ? 
1 1 1   29   28   52 o    254.9    3.9    0.0000   0.0000          ?        ?   651.2921  19.7942          ?        ?      254.9        3.9       ?       ? 
1 1 1   29   28   53 o    157.0    5.7    0.0000   0.0000          ?        ?   247.7464  17.8786          ?        ?      157.0        5.7       ?       ? 
1 1 1   29   28   54 f     34.3   14.7    0.0000   0.0000          ?        ?     0.6385  17.8786          ?        ?       34.3       14.7       ?       ? 
1 1 1   29   28   55 o    214.9    4.3    0.0000   0.0000          ?        ?   463.5667  18.5171          ?        ?      214.9        4.3       ?       ? 
1 1 1   29   29    0 o    880.5    9.4 7761.8687 165.3771  7761.8687 165.3771  7761.8687 165.3771      880.5      9.4      880.5        9.4     0.0     0.0 
1 1 1   29   29    1 o    304.1    5.9  926.4949  35.7572   926.4949  35.7572   926.4949  35.7572      304.1      5.9      304.1        5.9     0.0     0.0 
1 1 1   29   29    2 o    278.6    5.7  777.7194  31.9261   777.7194  31.9261   777.7194  31.9261      278.6      5.7      278.6        5.7     0.0     0.0 
1 1 1   29   29    3 o    469.0    5.4 2201.6226  50.4432  2201.6226  50.4432  2201.6226  50.4432      469.0      5.4      469.0        5.4     0.0     0.0 
1 1 1   29   29    4 o    393.5    5.1 1549.6920  40.2269  1549.6920  40.2269  1549.6920  40.2269      393.5      5.1      393.5        5.1     0.0     0.0 
1 1 1   29   29    5 o    439.6    5.0 1934.0819  44.0580  1934.0819  44.0580  1934.0819  44.0580      439.6      5.0      439.6        5.0     0.0     0.0 
1 1 1   29   29    6 o    326.9    5.3 1070.1622  34.4802  1070.1622  34.4802  1070.1622  34.4802      326.9      5.3      326.9        5.3     0.0     0.0 
1 1 1   29   29    7 o    152.3    9.3  234.9760  28.0950   234.9760  28.0950   234.9760  28.0950      152.3      9.3      152.3        9.3     0.0     0.0 
1 1 1   29   29    8 o    252.3    5.8  637.8831  29.3720   637.8831  29.3720   637.8831  29.3720      252.3      5.8      252.3        5.8     0.0     0.0 
1 1 1   29   29    9 o     60.4   13.3   41.5039  14.0475    41.5039  14.0475    41.5039  14.0475       60.4     13.3       60.4       13.3     0.0     0.0 
1 1 1   29   29   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   29   11 o    331.4    3.8 1098.8958  24.9023  1098.8958  24.9023  1098.8958  24.9023      331.4      3.8      331.4        3.8     0.0     0.0 
1 1 1   29   29   12 o    257.4    4.0  663.4240  20.4327   663.4240  20.4327   663.4240  20.4327      257.4      4.0      257.4        4.0     0.0     0.0 
1 1 1   29   29   13 o    254.0    3.8  645.5453  19.1556   645.5453  19.1556   645.5453  19.1556      254.0      3.8      254.0        3.8     0.0     0.0 
1 1 1   29   29   14 o     13.3    9.9  -41.5039  16.6016   -41.5039  16.6016   -41.5039  16.6016       13.3      9.9       13.3        9.9     0.0     0.0 
1 1 1   29   29   15 o    121.7    4.2  148.7755  10.2163   148.7755  10.2163   148.7755  10.2163      121.7      4.2      121.7        4.2     0.0     0.0 
1 1 1   29   29   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   29   17 o     10.9    8.1  -38.3113  12.7704   -38.3113  12.7704   -38.3113  12.7704       10.9      8.1       10.9        8.1     0.0     0.0 
1 1 1   29   29   18 o    343.0    3.3 1176.7954  22.3483  1176.7954  22.3483  1176.7954  22.3483      343.0      3.3      343.0        3.3     0.0     0.0 
1 1 1   29   29   19 o    338.0    3.4 1142.9537  22.9868  1142.9537  22.9868  1142.9537  22.9868      338.0      3.4      338.0        3.4     0.0     0.0 
1 1 1   29   29   20 o    364.3    3.2 1327.4865  23.6253  1327.4865  23.6253  1327.4865  23.6253      364.3      3.2      364.3        3.2     0.0     0.0 
1 1 1   29   29   21 o    194.6    4.4  379.2819  17.2401   379.2819  17.2401   379.2819  17.2401      194.6      4.4      194.6        4.4     0.0     0.0 
1 1 1   29   29   22 o     11.6    8.7  -53.6358  15.9630   -53.6358  15.9630   -53.6358  15.9630       11.6      8.7       11.6        8.7     0.0     0.0 
1 1 1   29   29   23 o    142.2    6.3  203.6884  17.8786   203.6884  17.8786   203.6884  17.8786      142.2      6.3      142.2        6.3     0.0     0.0 
1 1 1   29   29   24 o    564.9    3.7 3192.6082  42.1424  3192.6082  42.1424  3192.6082  42.1424      564.9      3.7      564.9        3.7     0.0     0.0 
1 1 1   29   29   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   29   26 o     62.3   16.0   45.9736  17.2401    45.9736  17.2401    45.9736  17.2401       62.3     16.0       62.3       16.0     0.0     0.0 
1 1 1   29   29   27 o    190.3    5.0  363.3188  19.1556   363.3188  19.1556   363.3188  19.1556      190.3      5.0      190.3        5.0     0.0     0.0 
1 1 1   29   29   28 o     17.4   12.5  -22.3483  17.8786   -22.3483  17.8786   -22.3483  17.8786       17.4     12.5       17.4       12.5     0.0     0.0 
1 1 1   29   29   29 o    311.1    4.1  968.6373  25.5409   968.6373  25.5409   968.6373  25.5409      311.1      4.1      311.1        4.1     0.0     0.0 
1 1 1   29   29   30 o    349.6    3.7 1223.4075  25.5409  1223.4075  25.5409  1223.4075  25.5409      349.6      3.7      349.6        3.7     0.0     0.0 
1 1 1   29   29   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   29   32 o    410.0    3.9 1682.5045  31.9261  1682.5045  31.9261  1682.5045  31.9261      410.0      3.9      410.0        3.9     0.0     0.0 
1 1 1   29   29   33 o    607.4    3.9 3691.2935  47.8891  3691.2935  47.8891  3691.2935  47.8891      607.4      3.9      607.4        3.9     0.0     0.0 
1 1 1   29   29   34 o     49.6   21.7   35.7572  22.3483    35.7572  22.3483    35.7572  22.3483       49.6     21.7       49.6       21.7     0.0     0.0 
1 1 1   29   29   35 o    340.8    3.8 1162.7479  26.1794  1162.7479  26.1794  1162.7479  26.1794      340.8      3.8      340.8        3.8     0.0     0.0 
1 1 1   29   29   36 o     20.7   14.7  -25.5409  23.6253   -25.5409  23.6253   -25.5409  23.6253       20.7     14.7       20.7       14.7     0.0     0.0 
1 1 1   29   29   37 o    196.2    5.7  386.3056  22.3483   386.3056  22.3483   386.3056  22.3483      196.2      5.7      196.2        5.7     0.0     0.0 
1 1 1   29   29   38 o    343.1    4.0 1178.7109  27.4564  1178.7109  27.4564  1178.7109  27.4564      343.1      4.0      343.1        4.0     0.0     0.0 
1 1 1   29   29   39 o    135.7    8.1  186.4483  21.7097   186.4483  21.7097   186.4483  21.7097      135.7      8.1      135.7        8.1     0.0     0.0 
1 1 1   29   29   40 o     51.2   21.7   37.6728  22.3483    37.6728  22.3483    37.6728  22.3483       51.2     21.7       51.2       21.7     0.0     0.0 
1 1 1   29   29   41 o    288.2    4.4  831.9937  25.5409   831.9937  25.5409   831.9937  25.5409      288.2      4.4      288.2        4.4     0.0     0.0 
1 1 1   29   29   42 o    126.3    8.7  162.1845  21.7097   162.1845  21.7097   162.1845  21.7097      126.3      8.7      126.3        8.7     0.0     0.0 
1 1 1   29   29   43 o     48.4   22.6   35.1187  24.2638    35.1187  24.2638    35.1187  24.2638       48.4     22.6       48.4       22.6     0.0     0.0 
1 1 1   29   29   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   29   29   45 o    380.2    4.0 1447.5286  30.6490  1447.5286  30.6490  1447.5286  30.6490      380.2      4.0      380.2        4.0     0.0     0.0 
1 1 1   29   29   46 o     24.1   16.5  -11.4934  23.6253   -11.4934  23.6253   -11.4934  23.6253       24.1     16.5       24.1       16.5     0.0     0.0 
1 1 1   29   29   47 o    495.8    4.0 2460.8623  39.5883  2460.8623  39.5883  2460.8623  39.5883      495.8      4.0      495.8        4.0     0.0     0.0 
1 1 1   29   29   48 o     17.9   13.1  -47.8891  24.9023   -47.8891  24.9023   -47.8891  24.9023       17.9     13.1       17.9       13.1     0.0     0.0 
1 1 1   29   29   49 o     29.4   19.1    0.6385  26.1794     0.6385  26.1794     0.6385  26.1794       29.4     19.1       29.4       19.1     0.0     0.0 
1 1 1   29   29   50 o    130.9    9.9  175.5934  25.5409   175.5934  25.5409   175.5934  25.5409      130.9      9.9      130.9        9.9     0.0     0.0 
1 1 1   29   29   51 o    239.6    5.7  576.5850  27.4564   576.5850  27.4564   576.5850  27.4564      239.6      5.7      239.6        5.7     0.0     0.0 
1 1 1   29   29   52 o     33.5   20.2   12.7704  24.2638    12.7704  24.2638    12.7704  24.2638       33.5     20.2       33.5       20.2     0.0     0.0 
1 1 1   29   29   53 o    303.1    4.6  921.3867  28.0950   921.3867  28.0950   921.3867  28.0950      303.1      4.6      303.1        4.6     0.0     0.0 
1 1 1   29   29   54 o    116.8   11.1  141.7518  25.5409   141.7518  25.5409   141.7518  25.5409      116.8     11.1      116.8       11.1     0.0     0.0 
1 1 1   30    0    0 o    505.5    4.5 2556.0020  45.9736  2556.0020  45.9736  2556.0020  45.9736      505.5      4.5      505.5        4.5     0.0     0.0 
1 1 1   30    0    1 o   1116.5    5.5 12466.4961 122.5962 12466.4961 122.5962 12466.4961 122.5962     1116.5      5.5     1116.5        5.5     0.0     0.0 
1 1 1   30    0    2 f    178.6    3.8  319.2608  13.4090   319.2608  13.4090   319.2608  13.4090      178.6      3.8      178.6        3.8     0.0     0.0 
1 1 1   30    0    3 o   2334.6   10.7 54515.6992 500.6010 54515.6992 500.6010 54515.6992 500.6010     2334.6     10.7     2334.6       10.7     0.0     0.0 
1 1 1   30    0    4 o    487.4    3.4 2375.9390  33.2031  2375.9390  33.2031  2375.9390  33.2031      487.4      3.4      487.4        3.4     0.0     0.0 
1 1 1   30    0    5 o   1415.5    6.9 20038.7246 194.1106 20038.7246 194.1106 20038.7246 194.1106     1415.5      6.9     1415.5        6.9     0.0     0.0 
1 1 1   30    0    6 o    216.2    5.0  468.0364  21.7097   468.0364  21.7097   468.0364  21.7097      216.2      5.0      216.2        5.0     0.0     0.0 
1 1 1   30    0    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    0    8 o   1087.3    6.0 11823.5049 130.2584 11823.5049 130.2584 11823.5049 130.2584     1087.3      6.0     1087.3        6.0     0.0     0.0 
1 1 1   30    0    9 o   3286.5   20.9 108099.1562 1371.5444 108099.1562 1371.5444 108099.1562 1371.5444     3286.5     20.9     3286.5       20.9     0.0     0.0 
1 1 1   30    0   10 o    861.0    4.5 7413.8745  77.2611  7413.8745  77.2611  7413.8745  77.2611      861.0      4.5      861.0        4.5     0.0     0.0 
1 1 1   30    0   11 o   1668.4    7.9 27841.4570 264.3480 27841.4570 264.3480 27841.4570 264.3480     1668.4      7.9     1668.4        7.9     0.0     0.0 
1 1 1   30    0   12 o   1324.3    6.9 17541.4648 183.8942 17541.4648 183.8942 17541.4648 183.8942     1324.3      6.9     1324.3        6.9     0.0     0.0 
1 1 1   30    0   13 o   1230.4    6.6 15141.2637 162.1845 15141.2637 162.1845 15141.2637 162.1845     1230.4      6.6     1230.4        6.6     0.0     0.0 
1 1 1   30    0   14 o    742.2    4.5 5509.8032  67.0448  5509.8032  67.0448  5509.8032  67.0448      742.2      4.5      742.2        4.5     0.0     0.0 
1 1 1   30    0   15 o   1002.7    5.8 10056.7158 116.8494 10056.7158 116.8494 10056.7158 116.8494     1002.7      5.8     1002.7        5.8     0.0     0.0 
1 1 1   30    0   16 o     26.4   17.1    0.6385  20.4327     0.6385  20.4327     0.6385  20.4327       26.4     17.1       26.4       17.1     0.0     0.0 
1 1 1   30    0   17 o     25.8   18.5  -51.0817  39.5883   -51.0817  39.5883   -51.0817  39.5883       25.8     18.5       25.8       18.5     0.0     0.0 
1 1 1   30    0   18 o    166.3    6.6  277.7569  21.7097   277.7569  21.7097   277.7569  21.7097      166.3      6.6      166.3        6.6     0.0     0.0 
1 1 1   30    0   19 o    173.7    5.7  302.6593  19.7942   302.6593  19.7942   302.6593  19.7942      173.7      5.7      173.7        5.7     0.0     0.0 
1 1 1   30    0   20 o    817.8    5.1 6689.1523  83.6463  6689.1523  83.6463  6689.1523  83.6463      817.8      5.1      817.8        5.1     0.0     0.0 
1 1 1   30    0   21 o    657.3    3.8 4320.8760  49.8047  4320.8760  49.8047  4320.8760  49.8047      657.3      3.8      657.3        3.8     0.0     0.0 
1 1 1   30    0   22 o    502.2    3.6 2522.1604  36.3957  2522.1604  36.3957  2522.1604  36.3957      502.2      3.6      502.2        3.6     0.0     0.0 
1 1 1   30    0   23 f    763.1    4.3 5823.3174  65.7677  5823.3174  65.7677  5823.3174  65.7677      763.1      4.3      763.1        4.3     0.0     0.0 
1 1 1   30    0   24 o   1100.8    5.7 12120.4170 125.1502 12120.4170 125.1502 12120.4170 125.1502     1100.8      5.7     1100.8        5.7     0.0     0.0 
1 1 1   30    0   25 o   1438.7    7.3 20702.7871 208.7966 20702.7871 208.7966 20702.7871 208.7966     1438.7      7.3     1438.7        7.3     0.0     0.0 
1 1 1   30    0   26 o     18.9   13.7  -36.3957  23.6253   -36.3957  23.6253   -36.3957  23.6253       18.9     13.7       18.9       13.7     0.0     0.0 
1 1 1   30    0   27 o   1135.6    5.7 12896.8604 128.9814 12896.8604 128.9814 12896.8604 128.9814     1135.6      5.7     1135.6        5.7     0.0     0.0 
1 1 1   30    0   28 o    464.0    4.1 2153.7334  38.3113  2153.7334  38.3113  2153.7334  38.3113      464.0      4.1      464.0        4.1     0.0     0.0 
1 1 1   30    0   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    0   30 o   1654.2    9.1 27374.0605 299.4666 27374.0605 299.4666 27374.0605 299.4666     1654.2      9.1     1654.2        9.1     0.0     0.0 
1 1 1   30    0   31 o    523.7    3.9 2743.7275  40.8654  2743.7275  40.8654  2743.7275  40.8654      523.7      3.9      523.7        3.9     0.0     0.0 
1 1 1   30    0   32 o     62.4   21.2   50.4432  23.6253    50.4432  23.6253    50.4432  23.6253       62.4     21.2       62.4       21.2     0.0     0.0 
1 1 1   30    0   33 o    537.3    3.9 2888.0332  41.5039  2888.0332  41.5039  2888.0332  41.5039      537.3      3.9      537.3        3.9     0.0     0.0 
1 1 1   30    0   34 o    418.1    3.6 1748.2721  30.0105  1748.2721  30.0105  1748.2721  30.0105      418.1      3.6      418.1        3.6     0.0     0.0 
1 1 1   30    0   35 o    620.4    4.1 3850.2854  50.4432  3850.2854  50.4432  3850.2854  50.4432      620.4      4.1      620.4        4.1     0.0     0.0 
1 1 1   30    0   36 o   1310.4    6.4 17176.2324 167.2927 17176.2324 167.2927 17176.2324 167.2927     1310.4      6.4     1310.4        6.4     0.0     0.0 
1 1 1   30    0   37 o    381.0    4.2 1452.6367  31.9261  1452.6367  31.9261  1452.6367  31.9261      381.0      4.2      381.0        4.2     0.0     0.0 
1 1 1   30    0   38 o    316.9    3.8 1005.0330  24.2638  1005.0330  24.2638  1005.0330  24.2638      316.9      3.8      316.9        3.8     0.0     0.0 
1 1 1   30    0   39 f    494.3    3.7 2444.2607  37.0343  2444.2607  37.0343  2444.2607  37.0343      494.3      3.7      494.3        3.7     0.0     0.0 
1 1 1   30    0   40 o    480.8    3.9 2312.0869  37.0343  2312.0869  37.0343  2312.0869  37.0343      480.8      3.9      480.8        3.9     0.0     0.0 
1 1 1   30    0   41 o    760.8    4.3 5790.1143  65.1292  5790.1143  65.1292  5790.1143  65.1292      760.8      4.3      760.8        4.3     0.0     0.0 
1 1 1   30    0   42 o    239.9    5.2  576.5850  24.9023   576.5850  24.9023   576.5850  24.9023      239.9      5.2      239.9        5.2     0.0     0.0 
1 1 1   30    0   43 o    587.9    4.1 3456.9563  48.5276  3456.9563  48.5276  3456.9563  48.5276      587.9      4.1      587.9        4.1     0.0     0.0 
1 1 1   30    0   44 o    749.4    4.2 5618.3521  62.5751  5618.3521  62.5751  5618.3521  62.5751      749.4      4.2      749.4        4.2     0.0     0.0 
1 1 1   30    0   45 o    560.1    3.6 3137.6953  40.2269  3137.6953  40.2269  3137.6953  40.2269      560.1      3.6      560.1        3.6     0.0     0.0 
1 1 1   30    0   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    0   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    0   48 o    785.9    4.4 6178.9736  69.5989  6178.9736  69.5989  6178.9736  69.5989      785.9      4.4      785.9        4.4     0.0     0.0 
1 1 1   30    0   49 o     79.4   18.0   72.1529  24.9023    72.1529  24.9023    72.1529  24.9023       79.4     18.0       79.4       18.0     0.0     0.0 
1 1 1   30    0   50 o    480.4    3.9 2308.8943  37.6728  2308.8943  37.6728  2308.8943  37.6728      480.4      3.9      480.4        3.9     0.0     0.0 
1 1 1   30    0   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    0   52 o    284.5    5.1  810.2839  28.7335   810.2839  28.7335   810.2839  28.7335      284.5      5.1      284.5        5.1     0.0     0.0 
1 1 1   30    0   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    0   54 o     17.9   13.1  -51.7203  25.5409   -51.7203  25.5409   -51.7203  25.5409       17.9     13.1       17.9       13.1     0.0     0.0 
1 1 1   30    0   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    0   56 o    138.3    9.1  194.1106  24.9023   194.1106  24.9023   194.1106  24.9023      138.3      9.1      138.3        9.1     0.0     0.0 
1 1 1   30    0   57 o     23.1   16.1  -20.4327  25.5409   -20.4327  25.5409   -20.4327  25.5409       23.1     16.1       23.1       16.1     0.0     0.0 
1 1 1   30    0   58 o     37.1   21.5   17.8786  25.5409    17.8786  25.5409    17.8786  25.5409       37.1     21.5       37.1       21.5     0.0     0.0 
1 1 1   30    0   59 o    234.3    5.7  550.4056  26.8179   550.4056  26.8179   550.4056  26.8179      234.3      5.7      234.3        5.7     0.0     0.0 
1 1 1   30    0   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    0   61 o    186.5    7.0  349.9099  26.1794   349.9099  26.1794   349.9099  26.1794      186.5      7.0      186.5        7.0     0.0     0.0 
1 1 1   30    0   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    0   63 o    319.7    4.9 1023.5502  31.2876  1023.5502  31.2876  1023.5502  31.2876      319.7      4.9      319.7        4.9     0.0     0.0 
1 1 1   30    0   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    0   65 o     25.0   17.4  -20.4327  28.7335   -20.4327  28.7335   -20.4327  28.7335       25.0     17.4       25.0       17.4     0.0     0.0 
1 1 1   30    0   66 o    143.7   10.3  210.7121  29.3720   210.7121  29.3720   210.7121  29.3720      143.7     10.3      143.7       10.3     0.0     0.0 
1 1 1   30    0   67 o     21.5   15.5  -40.8654  29.3720   -40.8654  29.3720   -40.8654  29.3720       21.5     15.5       21.5       15.5     0.0     0.0 
1 1 1   30    0   68 o     37.6   22.4   17.2401  28.7335    17.2401  28.7335    17.2401  28.7335       37.6     22.4       37.6       22.4     0.0     0.0 
1 1 1   30    0   69 o     35.8   21.8   13.4090  28.7335    13.4090  28.7335    13.4090  28.7335       35.8     21.8       35.8       21.8     0.0     0.0 
1 1 1   30    0   70 o    272.9    5.3  747.0703  28.7335   747.0703  28.7335   747.0703  28.7335      272.9      5.3      272.9        5.3     0.0     0.0 
1 1 1   30    0   71 o     23.2   16.5  -37.0343  31.2876   -37.0343  31.2876   -37.0343  31.2876       23.2     16.5       23.2       16.5     0.0     0.0 
1 1 1   30    0   72 o    110.6   13.6  129.6199  29.3720   129.6199  29.3720   129.6199  29.3720      110.6     13.6      110.6       13.6     0.0     0.0 
1 1 1   30    0   73 o     27.3   18.5  -10.2163  28.7335   -10.2163  28.7335   -10.2163  28.7335       27.3     18.5       27.3       18.5     0.0     0.0 
1 1 1   30    1    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    1    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    1    2 o   1625.6    6.0    0.0000   0.0000          ?        ? 26429.6875 196.0261          ?        ?     1625.6        6.0       ?       ? 
1 1 1   30    1    3 o    390.2    2.5    0.0000   0.0000          ?        ?  1522.2355  19.1556          ?        ?      390.2        2.5       ?       ? 
1 1 1   30    1    4 o    938.1    3.7    0.0000   0.0000          ?        ?  8800.7441  68.9603          ?        ?      938.1        3.7       ?       ? 
1 1 1   30    1    5 o   1271.4    4.6    0.0000   0.0000          ?        ? 16166.7285 116.8494          ?        ?     1271.4        4.6       ?       ? 
1 1 1   30    1    6 o    952.6    3.7    0.0000   0.0000          ?        ?  9074.6689  70.2374          ?        ?      952.6        3.7       ?       ? 
1 1 1   30    1    7 o   2103.7    7.3    0.0000   0.0000          ?        ? 44264.2344 309.0445          ?        ?     2103.7        7.3       ?       ? 
1 1 1   30    1    8 o   1414.6    5.1    0.0000   0.0000          ?        ? 20013.8203 143.0288          ?        ?     1414.6        5.1       ?       ? 
1 1 1   30    1    9 o    881.3    3.4    0.0000   0.0000          ?        ?  7766.3389  60.6596          ?        ?      881.3        3.4       ?       ? 
1 1 1   30    1   10 o   1015.0    3.7    0.0000   0.0000          ?        ? 10302.5469  75.9841          ?        ?     1015.0        3.7       ?       ? 
1 1 1   30    1   11 o    791.1    3.1    0.0000   0.0000          ?        ?  6258.1504  49.1662          ?        ?      791.1        3.1       ?       ? 
1 1 1   30    1   12 o    590.6    2.6    0.0000   0.0000          ?        ?  3487.6052  31.2876          ?        ?      590.6        2.6       ?       ? 
1 1 1   30    1   13 o   1737.6    5.9    0.0000   0.0000          ?        ? 30195.0488 203.6884          ?        ?     1737.6        5.9       ?       ? 
1 1 1   30    1   14 o   1244.4    4.5    0.0000   0.0000          ?        ? 15486.7031 111.7413          ?        ?     1244.4        4.5       ?       ? 
1 1 1   30    1   15 o    886.2    3.5    0.0000   0.0000          ?        ?  7853.8159  61.9366          ?        ?      886.2        3.5       ?       ? 
1 1 1   30    1   16 o    293.5    2.4    0.0000   0.0000          ?        ?   861.3657  14.0475          ?        ?      293.5        2.4       ?       ? 
1 1 1   30    1   17 o   2050.5    7.3    0.0000   0.0000          ?        ? 42056.8672 301.3822          ?        ?     2050.5        7.3       ?       ? 
1 1 1   30    1   18 o    624.2    2.8    0.0000   0.0000          ?        ?  3896.8975  35.1187          ?        ?      624.2        2.8       ?       ? 
1 1 1   30    1   19 o   1022.2    3.8    0.0000   0.0000          ?        ? 10448.7676  77.8996          ?        ?     1022.2        3.8       ?       ? 
1 1 1   30    1   20 o   1026.8    3.8    0.0000   0.0000          ?        ? 10543.2686  77.8996          ?        ?     1026.8        3.8       ?       ? 
1 1 1   30    1   21 o   1443.6    5.3    0.0000   0.0000          ?        ? 20843.8984 153.8837          ?        ?     1443.6        5.3       ?       ? 
1 1 1   30    1   22 o   1632.1    5.5    0.0000   0.0000          ?        ? 26641.0371 178.1475          ?        ?     1632.1        5.5       ?       ? 
1 1 1   30    1   23 o    212.0    3.2    0.0000   0.0000          ?        ?   449.5192  13.4090          ?        ?      212.0        3.2       ?       ? 
1 1 1   30    1   24 o     79.5    9.2    0.0000   0.0000          ?        ?    63.2136  14.6860          ?        ?       79.5        9.2       ?       ? 
1 1 1   30    1   25 o    440.4    2.3    0.0000   0.0000          ?        ?  1939.8286  20.4327          ?        ?      440.4        2.3       ?       ? 
1 1 1   30    1   26 o    701.3    3.4    0.0000   0.0000          ?        ?  4917.8936  47.2506          ?        ?      701.3        3.4       ?       ? 
1 1 1   30    1   27 o    615.3    2.8    0.0000   0.0000          ?        ?  3785.7949  34.4802          ?        ?      615.3        2.8       ?       ? 
1 1 1   30    1   28 o    516.0    2.8    0.0000   0.0000          ?        ?  2662.6353  29.3720          ?        ?      516.0        2.8       ?       ? 
1 1 1   30    1   29 o    623.2    3.0    0.0000   0.0000          ?        ?  3884.1270  37.0343          ?        ?      623.2        3.0       ?       ? 
1 1 1   30    1   30 o   1339.8    4.9    0.0000   0.0000          ?        ? 17953.3125 132.1740          ?        ?     1339.8        4.9       ?       ? 
1 1 1   30    1   31 o    789.8    3.3    0.0000   0.0000          ?        ?  6238.3564  52.3588          ?        ?      789.8        3.3       ?       ? 
1 1 1   30    1   32 o    677.2    2.8    0.0000   0.0000          ?        ?  4585.8623  38.3113          ?        ?      677.2        2.8       ?       ? 
1 1 1   30    1   33 o    793.4    3.3    0.0000   0.0000          ?        ?  6295.8232  52.3588          ?        ?      793.4        3.3       ?       ? 
1 1 1   30    1   34 o     79.1   10.1    0.0000   0.0000          ?        ?    62.5751  15.9630          ?        ?       79.1       10.1       ?       ? 
1 1 1   30    1   35 o     80.3    9.5    0.0000   0.0000          ?        ?    64.4907  15.3245          ?        ?       80.3        9.5       ?       ? 
1 1 1   30    1   36 o    569.1    2.7    0.0000   0.0000          ?        ?  3238.5818  30.6490          ?        ?      569.1        2.7       ?       ? 
1 1 1   30    1   37 o    127.6    6.0    0.0000   0.0000          ?        ?   162.8230  15.3245          ?        ?      127.6        6.0       ?       ? 
1 1 1   30    1   38 o    819.0    3.3    0.0000   0.0000          ?        ?  6708.3081  53.6358          ?        ?      819.0        3.3       ?       ? 
1 1 1   30    1   39 o    397.8    2.6    0.0000   0.0000          ?        ?  1582.2566  20.4327          ?        ?      397.8        2.6       ?       ? 
1 1 1   30    1   40 o    185.3    4.3    0.0000   0.0000          ?        ?   343.5246  15.9630          ?        ?      185.3        4.3       ?       ? 
1 1 1   30    1   41 o    153.9    5.4    0.0000   0.0000          ?        ?   236.8915  16.6016          ?        ?      153.9        5.4       ?       ? 
1 1 1   30    1   42 f    600.8    2.7    0.0000   0.0000          ?        ?  3610.2014  32.5646          ?        ?      600.8        2.7       ?       ? 
1 1 1   30    1   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    1   44 o    235.2    3.7    0.0000   0.0000          ?        ?   553.5982  17.2401          ?        ?      235.2        3.7       ?       ? 
1 1 1   30    1   45 o    173.2    4.6    0.0000   0.0000          ?        ?   300.1052  15.9630          ?        ?      173.2        4.6       ?       ? 
1 1 1   30    1   46 o     55.8   14.2    0.0000   0.0000          ?        ?    32.5646  15.9630          ?        ?       55.8       14.2       ?       ? 
1 1 1   30    1   47 f    231.0    3.7    0.0000   0.0000          ?        ?   533.8041  17.2401          ?        ?      231.0        3.7       ?       ? 
1 1 1   30    1   48 o    531.1    2.6    0.0000   0.0000          ?        ?  2820.9885  28.0950          ?        ?      531.1        2.6       ?       ? 
1 1 1   30    1   49 o    334.3    2.8    0.0000   0.0000          ?        ?  1118.0514  18.5171          ?        ?      334.3        2.8       ?       ? 
1 1 1   30    1   50 o    332.2    2.9    0.0000   0.0000          ?        ?  1104.0039  19.1556          ?        ?      332.2        2.9       ?       ? 
1 1 1   30    1   51 o    178.8    4.8    0.0000   0.0000          ?        ?   319.8993  17.2401          ?        ?      178.8        4.8       ?       ? 
1 1 1   30    1   52 o     62.5   13.7    0.0000   0.0000          ?        ?    40.8654  16.6016          ?        ?       62.5       13.7       ?       ? 
1 1 1   30    1   53 o    192.7    5.0    0.0000   0.0000          ?        ?   371.6196  19.1556          ?        ?      192.7        5.0       ?       ? 
1 1 1   30    1   54 o    531.6    2.6    0.0000   0.0000          ?        ?  2826.7354  28.0950          ?        ?      531.6        2.6       ?       ? 
1 1 1   30    1   55 f    771.7    3.1    0.0000   0.0000          ?        ?  5958.6841  47.8891          ?        ?      771.7        3.1       ?       ? 
1 1 1   30    1   56 o    500.4    2.7    0.0000   0.0000          ?        ?  2504.9202  26.8179          ?        ?      500.4        2.7       ?       ? 
1 1 1   30    1   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    1   58 o    519.4    2.7    0.0000   0.0000          ?        ?  2699.0310  28.0950          ?        ?      519.4        2.7       ?       ? 
1 1 1   30    1   59 f    264.2    3.7    0.0000   0.0000          ?        ?   698.5427  19.7942          ?        ?      264.2        3.7       ?       ? 
1 1 1   30    1   60 o     65.2   14.1    0.0000   0.0000          ?        ?    44.6965  17.8786          ?        ?       65.2       14.1       ?       ? 
1 1 1   30    1   61 o    187.7    5.1    0.0000   0.0000          ?        ?   353.1024  19.1556          ?        ?      187.7        5.1       ?       ? 
1 1 1   30    1   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    1   63 o    376.3    3.3    0.0000   0.0000          ?        ?  1417.5181  24.9023          ?        ?      376.3        3.3       ?       ? 
1 1 1   30    1   64 o     51.8   16.8    0.0000   0.0000          ?        ?    26.8179  19.7942          ?        ?       51.8       16.8       ?       ? 
1 1 1   30    1   65 o    234.5    4.6    0.0000   0.0000          ?        ?   551.0442  21.7097          ?        ?      234.5        4.6       ?       ? 
1 1 1   30    1   66 o    197.8    5.6    0.0000   0.0000          ?        ?   392.6908  22.3483          ?        ?      197.8        5.6       ?       ? 
1 1 1   30    1   67 o     21.8   11.0    0.0000   0.0000          ?        ?   -66.4062  21.7097          ?        ?       21.8       11.0       ?       ? 
1 1 1   30    1   68 o    177.9    6.3    0.0000   0.0000          ?        ?   317.9838  22.3483          ?        ?      177.9        6.3       ?       ? 
1 1 1   30    1   69 o     27.1   13.1    0.0000   0.0000          ?        ?   -31.2876  21.0712          ?        ?       27.1       13.1       ?       ? 
1 1 1   30    1   70 o     29.7   13.9    0.0000   0.0000          ?        ?   -21.0712  21.0712          ?        ?       29.7       13.9       ?       ? 
1 1 1   30    1   71 o     40.7   16.4    0.0000   0.0000          ?        ?     8.9393  20.4327          ?        ?       40.7       16.4       ?       ? 
1 1 1   30    1   72 o     98.1   11.1    0.0000   0.0000          ?        ?    98.3323  21.7097          ?        ?       98.1       11.1       ?       ? 
1 1 1   30    1   73 o    217.1    5.0    0.0000   0.0000          ?        ?   473.7830  21.7097          ?        ?      217.1        5.0       ?       ? 
1 1 1   30    2    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    2    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    2    2 o    577.1    2.5    0.0000   0.0000          ?        ?  3330.5286  28.7335          ?        ?      577.1        2.5       ?       ? 
1 1 1   30    2    3 o   1159.3    4.2    0.0000   0.0000          ?        ? 13440.2412  96.4168          ?        ?     1159.3        4.2       ?       ? 
1 1 1   30    2    4 o   1522.4    5.2    0.0000   0.0000          ?        ? 23180.2500 157.7148          ?        ?     1522.4        5.2       ?       ? 
1 1 1   30    2    5 o    556.5    2.5    0.0000   0.0000          ?        ?  3096.8298  28.0950          ?        ?      556.5        2.5       ?       ? 
1 1 1   30    2    6 o    317.3    2.4    0.0000   0.0000          ?        ?  1006.9486  15.3245          ?        ?      317.3        2.4       ?       ? 
1 1 1   30    2    7 o   1586.6    5.3    0.0000   0.0000          ?        ? 25174.9922 169.2082          ?        ?     1586.6        5.3       ?       ? 
1 1 1   30    2    8 f    169.9    3.6    0.0000   0.0000          ?        ?   288.6118  12.1319          ?        ?      169.9        3.6       ?       ? 
1 1 1   30    2    9 o    592.0    2.5    0.0000   0.0000          ?        ?  3504.2065  30.0105          ?        ?      592.0        2.5       ?       ? 
1 1 1   30    2   10 o    707.2    2.9    0.0000   0.0000          ?        ?  5001.5400  40.8654          ?        ?      707.2        2.9       ?       ? 
1 1 1   30    2   11 o    698.5    2.8    0.0000   0.0000          ?        ?  4879.5825  38.9498          ?        ?      698.5        2.8       ?       ? 
1 1 1   30    2   12 o    823.1    3.1    0.0000   0.0000          ?        ?  6774.7144  51.7203          ?        ?      823.1        3.1       ?       ? 
1 1 1   30    2   13 o    566.3    2.6    0.0000   0.0000          ?        ?  3207.2939  29.3720          ?        ?      566.3        2.6       ?       ? 
1 1 1   30    2   14 o    820.0    3.2    0.0000   0.0000          ?        ?  6724.9097  52.3588          ?        ?      820.0        3.2       ?       ? 
1 1 1   30    2   15 o    658.7    2.9    0.0000   0.0000          ?        ?  4338.7544  38.3113          ?        ?      658.7        2.9       ?       ? 
1 1 1   30    2   16 o    868.7    3.5    0.0000   0.0000          ?        ?  7546.0488  60.0210          ?        ?      868.7        3.5       ?       ? 
1 1 1   30    2   17 o   1133.2    4.0    0.0000   0.0000          ?        ? 12841.3086  91.3086          ?        ?     1133.2        4.0       ?       ? 
1 1 1   30    2   18 o    826.7    3.2    0.0000   0.0000          ?        ?  6835.3740  53.6358          ?        ?      826.7        3.2       ?       ? 
1 1 1   30    2   19 o    730.5    2.9    0.0000   0.0000          ?        ?  5336.1255  42.7809          ?        ?      730.5        2.9       ?       ? 
1 1 1   30    2   20 o   1159.2    4.2    0.0000   0.0000          ?        ? 13437.6875  97.0553          ?        ?     1159.2        4.2       ?       ? 
1 1 1   30    2   21 f    505.6    2.5    0.0000   0.0000          ?        ?  2556.0020  25.5409          ?        ?      505.6        2.5       ?       ? 
1 1 1   30    2   22 o    484.4    2.4    0.0000   0.0000          ?        ?  2346.5669  22.9868          ?        ?      484.4        2.4       ?       ? 
1 1 1   30    2   23 o    804.3    3.5    0.0000   0.0000          ?        ?  6469.5010  56.1899          ?        ?      804.3        3.5       ?       ? 
1 1 1   30    2   24 o    442.6    2.4    0.0000   0.0000          ?        ?  1958.9843  21.0712          ?        ?      442.6        2.4       ?       ? 
1 1 1   30    2   25 o    344.2    2.5    0.0000   0.0000          ?        ?  1184.4576  17.2401          ?        ?      344.2        2.5       ?       ? 
1 1 1   30    2   26 o    748.6    3.3    0.0000   0.0000          ?        ?  5604.9429  49.1662          ?        ?      748.6        3.3       ?       ? 
1 1 1   30    2   27 o    940.3    3.9    0.0000   0.0000          ?        ?  8842.2480  74.0685          ?        ?      940.3        3.9       ?       ? 
1 1 1   30    2   28 o    555.3    2.7    0.0000   0.0000          ?        ?  3083.4209  30.0105          ?        ?      555.3        2.7       ?       ? 
1 1 1   30    2   29 o    352.9    2.6    0.0000   0.0000          ?        ?  1245.7557  18.5171          ?        ?      352.9        2.6       ?       ? 
1 1 1   30    2   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    2   31 o    583.3    2.8    0.0000   0.0000          ?        ?  3402.6819  32.5646          ?        ?      583.3        2.8       ?       ? 
1 1 1   30    2   32 o    160.4    5.2    0.0000   0.0000          ?        ?   257.3242  16.6016          ?        ?      160.4        5.2       ?       ? 
1 1 1   30    2   33 f    811.4    3.6    0.0000   0.0000          ?        ?  6583.7964  58.1055          ?        ?      811.4        3.6       ?       ? 
1 1 1   30    2   34 o    581.1    2.7    0.0000   0.0000          ?        ?  3377.1411  31.2876          ?        ?      581.1        2.7       ?       ? 
1 1 1   30    2   35 o    459.8    2.6    0.0000   0.0000          ?        ?  2114.1453  24.2638          ?        ?      459.8        2.6       ?       ? 
1 1 1   30    2   36 o    229.6    3.8    0.0000   0.0000          ?        ?   527.4188  17.2401          ?        ?      229.6        3.8       ?       ? 
1 1 1   30    2   37 o    487.3    2.7    0.0000   0.0000          ?        ?  2374.6619  26.1794          ?        ?      487.3        2.7       ?       ? 
1 1 1   30    2   38 o    660.1    2.9    0.0000   0.0000          ?        ?  4357.2720  38.3113          ?        ?      660.1        2.9       ?       ? 
1 1 1   30    2   39 o    602.2    2.8    0.0000   0.0000          ?        ?  3627.4412  33.2031          ?        ?      602.2        2.8       ?       ? 
1 1 1   30    2   40 o    587.5    2.7    0.0000   0.0000          ?        ?  3452.4866  31.9261          ?        ?      587.5        2.7       ?       ? 
1 1 1   30    2   41 o    382.4    2.7    0.0000   0.0000          ?        ?  1462.2145  20.4327          ?        ?      382.4        2.7       ?       ? 
1 1 1   30    2   42 o    505.2    2.6    0.0000   0.0000          ?        ?  2552.8093  26.1794          ?        ?      505.2        2.6       ?       ? 
1 1 1   30    2   43 o    230.2    3.7    0.0000   0.0000          ?        ?   529.9730  17.2401          ?        ?      230.2        3.7       ?       ? 
1 1 1   30    2   44 o    389.3    2.7    0.0000   0.0000          ?        ?  1515.8503  21.0712          ?        ?      389.3        2.7       ?       ? 
1 1 1   30    2   45 o    376.3    2.7    0.0000   0.0000          ?        ?  1416.2410  20.4327          ?        ?      376.3        2.7       ?       ? 
1 1 1   30    2   46 o     20.6   10.3    0.0000   0.0000          ?        ?   -45.9736  17.2401          ?        ?       20.6       10.3       ?       ? 
1 1 1   30    2   47 o    289.6    3.1    0.0000   0.0000          ?        ?   839.0174  17.8786          ?        ?      289.6        3.1       ?       ? 
1 1 1   30    2   48 o     30.3   13.4    0.0000   0.0000          ?        ?    -5.1082  15.9630          ?        ?       30.3       13.4       ?       ? 
1 1 1   30    2   49 o    265.0    3.4    0.0000   0.0000          ?        ?   702.3738  17.8786          ?        ?      265.0        3.4       ?       ? 
1 1 1   30    2   50 o    296.6    3.1    0.0000   0.0000          ?        ?   879.8828  18.5171          ?        ?      296.6        3.1       ?       ? 
1 1 1   30    2   51 o    311.4    3.1    0.0000   0.0000          ?        ?   969.9143  19.1556          ?        ?      311.4        3.1       ?       ? 
1 1 1   30    2   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    2   53 o    187.1    4.9    0.0000   0.0000          ?        ?   350.5484  18.5171          ?        ?      187.1        4.9       ?       ? 
1 1 1   30    2   54 o    300.7    3.3    0.0000   0.0000          ?        ?   904.7851  19.7942          ?        ?      300.7        3.3       ?       ? 
1 1 1   30    2   55 o    579.9    2.7    0.0000   0.0000          ?        ?  3364.3706  31.2876          ?        ?      579.9        2.7       ?       ? 
1 1 1   30    2   56 o    295.7    3.3    0.0000   0.0000          ?        ?   874.7747  19.7942          ?        ?      295.7        3.3       ?       ? 
1 1 1   30    2   57 o     21.0   10.4    0.0000   0.0000          ?        ?   -43.4195  17.2401          ?        ?       21.0       10.4       ?       ? 
1 1 1   30    2   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    2   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    2   60 o    307.5    3.4    0.0000   0.0000          ?        ?   946.2890  21.0712          ?        ?      307.5        3.4       ?       ? 
1 1 1   30    2   61 o    226.0    4.4    0.0000   0.0000          ?        ?   511.4558  19.7942          ?        ?      226.0        4.4       ?       ? 
1 1 1   30    2   62 o     50.3   16.5    0.0000   0.0000          ?        ?    24.9023  19.1556          ?        ?       50.3       16.5       ?       ? 
1 1 1   30    2   63 o    298.7    3.5    0.0000   0.0000          ?        ?   893.2917  21.0712          ?        ?      298.7        3.5       ?       ? 
1 1 1   30    2   64 o     90.6   11.3    0.0000   0.0000          ?        ?    83.0078  20.4327          ?        ?       90.6       11.3       ?       ? 
1 1 1   30    2   65 o    171.8    6.1    0.0000   0.0000          ?        ?   296.2740  21.0712          ?        ?      171.8        6.1       ?       ? 
1 1 1   30    2   66 o     25.6   12.5    0.0000   0.0000          ?        ?   -35.7572  20.4327          ?        ?       25.6       12.5       ?       ? 
1 1 1   30    2   67 o    157.4    6.7    0.0000   0.0000          ?        ?   249.0234  21.0712          ?        ?      157.4        6.7       ?       ? 
1 1 1   30    2   68 o     40.4   16.2    0.0000   0.0000          ?        ?     8.9393  19.7942          ?        ?       40.4       16.2       ?       ? 
1 1 1   30    2   69 o     39.7   16.4    0.0000   0.0000          ?        ?     5.7467  21.0712          ?        ?       39.7       16.4       ?       ? 
1 1 1   30    2   70 o    143.0    7.4    0.0000   0.0000          ?        ?   206.2425  21.0712          ?        ?      143.0        7.4       ?       ? 
1 1 1   30    2   71 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    2   72 o    213.3    5.1    0.0000   0.0000          ?        ?   457.1815  21.7097          ?        ?      213.3        5.1       ?       ? 
1 1 1   30    2   73 o     19.6   10.0    0.0000   0.0000          ?        ?   -74.7070  20.4327          ?        ?       19.6       10.0       ?       ? 
1 1 1   30    3    0 o   1190.0    6.4 14163.6865 151.9681 14163.6865 151.9681 14163.6865 151.9681     1190.0      6.4     1190.0        6.4     0.0     0.0 
1 1 1   30    3    1 o   1138.2    4.1    0.0000   0.0000          ?        ? 12956.8809  92.5856          ?        ?     1138.2        4.1       ?       ? 
1 1 1   30    3    2 o   1008.5    3.6    0.0000   0.0000          ?        ? 10170.3730  72.1529          ?        ?     1008.5        3.6       ?       ? 
1 1 1   30    3    3 o   1343.8    4.6    0.0000   0.0000          ?        ? 18060.5840 123.8732          ?        ?     1343.8        4.6       ?       ? 
1 1 1   30    3    4 o   1813.7    6.0    0.0000   0.0000          ?        ? 32900.4648 218.3744          ?        ?     1813.7        6.0       ?       ? 
1 1 1   30    3    5 o    579.8    2.6    0.0000   0.0000          ?        ?  3361.8164  30.0105          ?        ?      579.8        2.6       ?       ? 
1 1 1   30    3    6 o    386.8    2.2    0.0000   0.0000          ?        ?  1496.0562  17.2401          ?        ?      386.8        2.2       ?       ? 
1 1 1   30    3    7 o    494.0    2.5    0.0000   0.0000          ?        ?  2440.4297  24.2638          ?        ?      494.0        2.5       ?       ? 
1 1 1   30    3    8 o   1686.2    5.7    0.0000   0.0000          ?        ? 28435.9219 193.4720          ?        ?     1686.2        5.7       ?       ? 
1 1 1   30    3    9 o    238.0    2.4    0.0000   0.0000          ?        ?   566.3687  11.4934          ?        ?      238.0        2.4       ?       ? 
1 1 1   30    3   10 o    283.6    2.3    0.0000   0.0000          ?        ?   804.5372  12.7704          ?        ?      283.6        2.3       ?       ? 
1 1 1   30    3   11 o    452.9    2.4    0.0000   0.0000          ?        ?  2051.5698  21.7097          ?        ?      452.9        2.4       ?       ? 
1 1 1   30    3   12 o   1068.0    3.9    0.0000   0.0000          ?        ? 11407.1885  84.2849          ?        ?     1068.0        3.9       ?       ? 
1 1 1   30    3   13 o     20.6   10.0    0.0000   0.0000          ?        ?   -21.7097  12.7704          ?        ?       20.6       10.0       ?       ? 
1 1 1   30    3   14 o    559.8    2.6    0.0000   0.0000          ?        ?  3133.8640  28.7335          ?        ?      559.8        2.6       ?       ? 
1 1 1   30    3   15 o    837.2    3.2    0.0000   0.0000          ?        ?  7009.6909  52.9973          ?        ?      837.2        3.2       ?       ? 
1 1 1   30    3   16 o    420.3    2.3    0.0000   0.0000          ?        ?  1766.7894  19.1556          ?        ?      420.3        2.3       ?       ? 
1 1 1   30    3   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    3   18 o    796.8    3.4    0.0000   0.0000          ?        ?  6349.4590  53.6358          ?        ?      796.8        3.4       ?       ? 
1 1 1   30    3   19 o   1406.7    5.1    0.0000   0.0000          ?        ? 19790.3379 142.3903          ?        ?     1406.7        5.1       ?       ? 
1 1 1   30    3   20 o    893.2    3.4    0.0000   0.0000          ?        ?  7978.3276  60.0210          ?        ?      893.2        3.4       ?       ? 
1 1 1   30    3   21 o    696.4    2.8    0.0000   0.0000          ?        ?  4849.5718  38.9498          ?        ?      696.4        2.8       ?       ? 
1 1 1   30    3   22 o    264.7    2.8    0.0000   0.0000          ?        ?   700.4582  14.6860          ?        ?      264.7        2.8       ?       ? 
1 1 1   30    3   23 o    927.0    3.5    0.0000   0.0000          ?        ?  8593.8623  64.4907          ?        ?      927.0        3.5       ?       ? 
1 1 1   30    3   24 o    749.4    3.1    0.0000   0.0000          ?        ?  5615.7979  46.6121          ?        ?      749.4        3.1       ?       ? 
1 1 1   30    3   25 o    210.8    3.6    0.0000   0.0000          ?        ?   444.4110  15.3245          ?        ?      210.8        3.6       ?       ? 
1 1 1   30    3   26 o    535.6    3.0    0.0000   0.0000          ?        ?  2868.8777  32.5646          ?        ?      535.6        3.0       ?       ? 
1 1 1   30    3   27 o    780.6    3.4    0.0000   0.0000          ?        ?  6094.0508  52.3588          ?        ?      780.6        3.4       ?       ? 
1 1 1   30    3   28 o    479.0    2.5    0.0000   0.0000          ?        ?  2294.8467  24.2638          ?        ?      479.0        2.5       ?       ? 
1 1 1   30    3   29 o   1076.2    4.1    0.0000   0.0000          ?        ? 11584.0586  88.1160          ?        ?     1076.2        4.1       ?       ? 
1 1 1   30    3   30 o    863.3    3.7    0.0000   0.0000          ?        ?  7453.4634  63.2136          ?        ?      863.3        3.7       ?       ? 
1 1 1   30    3   31 o    641.8    3.0    0.0000   0.0000          ?        ?  4119.1030  38.3113          ?        ?      641.8        3.0       ?       ? 
1 1 1   30    3   32 o    605.6    2.8    0.0000   0.0000          ?        ?  3668.3066  34.4802          ?        ?      605.6        2.8       ?       ? 
1 1 1   30    3   33 o    924.8    3.5    0.0000   0.0000          ?        ?  8553.6357  65.1292          ?        ?      924.8        3.5       ?       ? 
1 1 1   30    3   34 o   1096.9    3.8    0.0000   0.0000          ?        ? 12033.5781  84.2849          ?        ?     1096.9        3.8       ?       ? 
1 1 1   30    3   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    3   36 o    540.5    2.8    0.0000   0.0000          ?        ?  2921.8750  30.0105          ?        ?      540.5        2.8       ?       ? 
1 1 1   30    3   37 o    679.0    2.8    0.0000   0.0000          ?        ?  4610.7646  38.3113          ?        ?      679.0        2.8       ?       ? 
1 1 1   30    3   38 o    651.0    2.8    0.0000   0.0000          ?        ?  4239.1450  37.0343          ?        ?      651.0        2.8       ?       ? 
1 1 1   30    3   39 o    529.0    2.7    0.0000   0.0000          ?        ?  2798.6401  28.0950          ?        ?      529.0        2.7       ?       ? 
1 1 1   30    3   40 o    385.7    2.6    0.0000   0.0000          ?        ?  1487.7554  20.4327          ?        ?      385.7        2.6       ?       ? 
1 1 1   30    3   41 o    614.6    2.8    0.0000   0.0000          ?        ?  3778.1326  33.8416          ?        ?      614.6        2.8       ?       ? 
1 1 1   30    3   42 o     22.5   10.9    0.0000   0.0000          ?        ?   -29.3720  15.9630          ?        ?       22.5       10.9       ?       ? 
1 1 1   30    3   43 o    189.7    4.0    0.0000   0.0000          ?        ?   360.1262  15.3245          ?        ?      189.7        4.0       ?       ? 
1 1 1   30    3   44 o    225.1    3.7    0.0000   0.0000          ?        ?   506.9862  16.6016          ?        ?      225.1        3.7       ?       ? 
1 1 1   30    3   45 o    375.4    2.7    0.0000   0.0000          ?        ?  1409.2172  20.4327          ?        ?      375.4        2.7       ?       ? 
1 1 1   30    3   46 o    227.9    3.6    0.0000   0.0000          ?        ?   519.7566  16.6016          ?        ?      227.9        3.6       ?       ? 
1 1 1   30    3   47 o    578.9    2.6    0.0000   0.0000          ?        ?  3351.6001  30.6490          ?        ?      578.9        2.6       ?       ? 
1 1 1   30    3   48 o    127.8    6.5    0.0000   0.0000          ?        ?   163.4615  16.6016          ?        ?      127.8        6.5       ?       ? 
1 1 1   30    3   49 o    132.9    6.2    0.0000   0.0000          ?        ?   176.8705  16.6016          ?        ?      132.9        6.2       ?       ? 
1 1 1   30    3   50 o    558.3    2.6    0.0000   0.0000          ?        ?  3117.9011  29.3720          ?        ?      558.3        2.6       ?       ? 
1 1 1   30    3   51 o    116.8    6.8    0.0000   0.0000          ?        ?   136.6436  15.9630          ?        ?      116.8        6.8       ?       ? 
1 1 1   30    3   52 o     72.1   11.9    0.0000   0.0000          ?        ?    52.3588  17.2401          ?        ?       72.1       11.9       ?       ? 
1 1 1   30    3   53 o     35.9   14.8    0.0000   0.0000          ?        ?     3.8311  17.2401          ?        ?       35.9       14.8       ?       ? 
1 1 1   30    3   54 o    174.0    5.3    0.0000   0.0000          ?        ?   303.2978  18.5171          ?        ?      174.0        5.3       ?       ? 
1 1 1   30    3   55 o     70.0   13.3    0.0000   0.0000          ?        ?    51.0817  17.8786          ?        ?       70.0       13.3       ?       ? 
1 1 1   30    3   56 o    461.8    2.8    0.0000   0.0000          ?        ?  2133.3008  25.5409          ?        ?      461.8        2.8       ?       ? 
1 1 1   30    3   57 o    240.4    3.9    0.0000   0.0000          ?        ?   578.5006  18.5171          ?        ?      240.4        3.9       ?       ? 
1 1 1   30    3   58 o    124.9    7.4    0.0000   0.0000          ?        ?   156.4378  18.5171          ?        ?      124.9        7.4       ?       ? 
1 1 1   30    3   59 o    362.8    3.0    0.0000   0.0000          ?        ?  1317.2701  21.7097          ?        ?      362.8        3.0       ?       ? 
1 1 1   30    3   60 o    200.3    4.8    0.0000   0.0000          ?        ?   401.6301  19.1556          ?        ?      200.3        4.8       ?       ? 
1 1 1   30    3   61 o    177.8    5.6    0.0000   0.0000          ?        ?   316.7067  19.7942          ?        ?      177.8        5.6       ?       ? 
1 1 1   30    3   62 o     27.2   12.9    0.0000   0.0000          ?        ?   -23.6253  19.1556          ?        ?       27.2       12.9       ?       ? 
1 1 1   30    3   63 o     54.0   16.3    0.0000   0.0000          ?        ?    30.0105  19.1556          ?        ?       54.0       16.3       ?       ? 
1 1 1   30    3   64 o     26.4   12.7    0.0000   0.0000          ?        ?   -29.3720  19.7942          ?        ?       26.4       12.7       ?       ? 
1 1 1   30    3   65 o    241.9    4.4    0.0000   0.0000          ?        ?   586.1629  21.0712          ?        ?      241.9        4.4       ?       ? 
1 1 1   30    3   66 o     20.4   10.3    0.0000   0.0000          ?        ?   -64.4907  19.7942          ?        ?       20.4       10.3       ?       ? 
1 1 1   30    3   67 o    263.3    4.1    0.0000   0.0000          ?        ?   694.7115  21.7097          ?        ?      263.3        4.1       ?       ? 
1 1 1   30    3   68 o     46.8   16.7    0.0000   0.0000          ?        ?    19.7942  19.7942          ?        ?       46.8       16.7       ?       ? 
1 1 1   30    3   69 f    297.1    3.7    0.0000   0.0000          ?        ?   884.3525  21.7097          ?        ?      297.1        3.7       ?       ? 
1 1 1   30    3   70 o    176.2    6.0    0.0000   0.0000          ?        ?   312.2371  21.0712          ?        ?      176.2        6.0       ?       ? 
1 1 1   30    3   71 o    180.1    5.9    0.0000   0.0000          ?        ?   326.2845  21.0712          ?        ?      180.1        5.9       ?       ? 
1 1 1   30    3   72 o    143.6    7.1    0.0000   0.0000          ?        ?   208.1580  20.4327          ?        ?      143.6        7.1       ?       ? 
1 1 1   30    4    0 o    447.5    3.4 2003.0425  30.6490  2003.0425  30.6490  2003.0425  30.6490      447.5      3.4      447.5        3.4     0.0     0.0 
1 1 1   30    4    1 o   1102.0    4.0    0.0000   0.0000          ?        ? 12144.6816  88.1160          ?        ?     1102.0        4.0       ?       ? 
1 1 1   30    4    2 o    228.0    2.9    0.0000   0.0000          ?        ?   519.7566  13.4090          ?        ?      228.0        2.9       ?       ? 
1 1 1   30    4    3 o   1575.5    5.6    0.0000   0.0000          ?        ? 24823.8047 176.2320          ?        ?     1575.5        5.6       ?       ? 
1 1 1   30    4    4 o    788.8    3.2    0.0000   0.0000          ?        ?  6223.0317  51.0817          ?        ?      788.8        3.2       ?       ? 
1 1 1   30    4    5 o    734.8    3.1    0.0000   0.0000          ?        ?  5399.3389  45.9736          ?        ?      734.8        3.1       ?       ? 
1 1 1   30    4    6 o   1382.2    5.0    0.0000   0.0000          ?        ? 19107.1211 139.1977          ?        ?     1382.2        5.0       ?       ? 
1 1 1   30    4    7 o    866.5    3.5    0.0000   0.0000          ?        ?  7507.7378  60.0210          ?        ?      866.5        3.5       ?       ? 
1 1 1   30    4    8 o    833.2    3.4    0.0000   0.0000          ?        ?  6943.2842  56.8284          ?        ?      833.2        3.4       ?       ? 
1 1 1   30    4    9 o    868.1    3.3    0.0000   0.0000          ?        ?  7535.8320  58.1055          ?        ?      868.1        3.3       ?       ? 
1 1 1   30    4   10 o    549.0    2.6    0.0000   0.0000          ?        ?  3014.4607  28.7335          ?        ?      549.0        2.6       ?       ? 
1 1 1   30    4   11 o    561.6    2.6    0.0000   0.0000          ?        ?  3153.6582  29.3720          ?        ?      561.6        2.6       ?       ? 
1 1 1   30    4   12 o    384.8    2.2    0.0000   0.0000          ?        ?  1480.7316  17.2401          ?        ?      384.8        2.2       ?       ? 
1 1 1   30    4   13 o    205.3    3.3    0.0000   0.0000          ?        ?   421.4243  13.4090          ?        ?      205.3        3.3       ?       ? 
1 1 1   30    4   14 o    889.5    3.4    0.0000   0.0000          ?        ?  7911.9214  60.6596          ?        ?      889.5        3.4       ?       ? 
1 1 1   30    4   15 o    842.2    3.3    0.0000   0.0000          ?        ?  7093.3369  55.5514          ?        ?      842.2        3.3       ?       ? 
1 1 1   30    4   16 o    577.9    2.5    0.0000   0.0000          ?        ?  3340.1064  28.7335          ?        ?      577.9        2.5       ?       ? 
1 1 1   30    4   17 o   1113.3    4.3    0.0000   0.0000          ?        ? 12396.2588  95.1397          ?        ?     1113.3        4.3       ?       ? 
1 1 1   30    4   18 o   1456.8    5.1    0.0000   0.0000          ?        ? 21224.4590 149.4141          ?        ?     1456.8        5.1       ?       ? 
1 1 1   30    4   19 o   1051.5    3.9    0.0000   0.0000          ?        ? 11057.2783  82.3693          ?        ?     1051.5        3.9       ?       ? 
1 1 1   30    4   20 o   1119.5    4.1    0.0000   0.0000          ?        ? 12532.9023  91.9471          ?        ?     1119.5        4.1       ?       ? 
1 1 1   30    4   21 o   1118.1    4.3    0.0000   0.0000          ?        ? 12502.8916  96.4168          ?        ?     1118.1        4.3       ?       ? 
1 1 1   30    4   22 o    387.1    2.5    0.0000   0.0000          ?        ?  1498.6102  19.1556          ?        ?      387.1        2.5       ?       ? 
1 1 1   30    4   23 o    673.5    3.0    0.0000   0.0000          ?        ?  4536.6963  40.2269          ?        ?      673.5        3.0       ?       ? 
1 1 1   30    4   24 f   1182.4    4.6    0.0000   0.0000          ?        ? 13982.3467 109.1872          ?        ?     1182.4        4.6       ?       ? 
1 1 1   30    4   25 o    230.5    3.3    0.0000   0.0000          ?        ?   531.2500  15.3245          ?        ?      230.5        3.3       ?       ? 
1 1 1   30    4   26 o   1034.0    4.1    0.0000   0.0000          ?        ? 10692.0449  85.5619          ?        ?     1034.0        4.1       ?       ? 
1 1 1   30    4   27 f    532.6    2.9    0.0000   0.0000          ?        ?  2836.9514  30.6490          ?        ?      532.6        2.9       ?       ? 
1 1 1   30    4   28 o    295.3    2.7    0.0000   0.0000          ?        ?   872.2206  15.9630          ?        ?      295.3        2.7       ?       ? 
1 1 1   30    4   29 o   1430.4    5.2    0.0000   0.0000          ?        ? 20465.8945 149.4141          ?        ?     1430.4        5.2       ?       ? 
1 1 1   30    4   30 o    545.0    2.8    0.0000   0.0000          ?        ?  2970.4026  30.0105          ?        ?      545.0        2.8       ?       ? 
1 1 1   30    4   31 o    731.5    3.0    0.0000   0.0000          ?        ?  5351.4497  44.0580          ?        ?      731.5        3.0       ?       ? 
1 1 1   30    4   32 o    228.7    3.4    0.0000   0.0000          ?        ?   522.9492  15.3245          ?        ?      228.7        3.4       ?       ? 
1 1 1   30    4   33 o   1035.4    3.7    0.0000   0.0000          ?        ? 10721.4160  77.2611          ?        ?     1035.4        3.7       ?       ? 
1 1 1   30    4   34 o    485.1    2.6    0.0000   0.0000          ?        ?  2353.5908  24.9023          ?        ?      485.1        2.6       ?       ? 
1 1 1   30    4   35 o    619.2    2.7    0.0000   0.0000          ?        ?  3834.3223  33.2031          ?        ?      619.2        2.7       ?       ? 
1 1 1   30    4   36 o    608.4    2.7    0.0000   0.0000          ?        ?  3701.5100  32.5646          ?        ?      608.4        2.7       ?       ? 
1 1 1   30    4   37 o    223.0    3.7    0.0000   0.0000          ?        ?   497.4084  16.6016          ?        ?      223.0        3.7       ?       ? 
1 1 1   30    4   38 o    358.8    2.8    0.0000   0.0000          ?        ?  1287.2596  19.7942          ?        ?      358.8        2.8       ?       ? 
1 1 1   30    4   39 o    642.4    2.8    0.0000   0.0000          ?        ?  4126.7651  35.7572          ?        ?      642.4        2.8       ?       ? 
1 1 1   30    4   40 o    543.7    2.7    0.0000   0.0000          ?        ?  2956.3552  29.3720          ?        ?      543.7        2.7       ?       ? 
1 1 1   30    4   41 o    191.7    4.7    0.0000   0.0000          ?        ?   367.7885  17.8786          ?        ?      191.7        4.7       ?       ? 
1 1 1   30    4   42 o    466.4    2.5    0.0000   0.0000          ?        ?  2176.0815  23.6253          ?        ?      466.4        2.5       ?       ? 
1 1 1   30    4   43 o    130.8    6.1    0.0000   0.0000          ?        ?   171.1238  15.9630          ?        ?      130.8        6.1       ?       ? 
1 1 1   30    4   44 o    656.0    2.9    0.0000   0.0000          ?        ?  4304.2739  37.6728          ?        ?      656.0        2.9       ?       ? 
1 1 1   30    4   45 o    250.4    3.4    0.0000   0.0000          ?        ?   627.0282  17.2401          ?        ?      250.4        3.4       ?       ? 
1 1 1   30    4   46 o    312.7    2.9    0.0000   0.0000          ?        ?   978.2151  17.8786          ?        ?      312.7        2.9       ?       ? 
1 1 1   30    4   47 o    426.3    2.5    0.0000   0.0000          ?        ?  1817.8711  21.7097          ?        ?      426.3        2.5       ?       ? 
1 1 1   30    4   48 o    278.1    3.2    0.0000   0.0000          ?        ?   773.8882  17.8786          ?        ?      278.1        3.2       ?       ? 
1 1 1   30    4   49 o    217.6    4.0    0.0000   0.0000          ?        ?   473.7830  17.2401          ?        ?      217.6        4.0       ?       ? 
1 1 1   30    4   50 o     25.7   12.1    0.0000   0.0000          ?        ?   -19.7942  16.6016          ?        ?       25.7       12.1       ?       ? 
1 1 1   30    4   51 o    230.8    3.7    0.0000   0.0000          ?        ?   533.1656  17.2401          ?        ?      230.8        3.7       ?       ? 
1 1 1   30    4   52 o     27.6   12.8    0.0000   0.0000          ?        ?   -15.9630  17.2401          ?        ?       27.6       12.8       ?       ? 
1 1 1   30    4   53 o    309.7    3.1    0.0000   0.0000          ?        ?   959.6980  19.1556          ?        ?      309.7        3.1       ?       ? 
1 1 1   30    4   54 o    262.5    3.5    0.0000   0.0000          ?        ?   689.6033  18.5171          ?        ?      262.5        3.5       ?       ? 
1 1 1   30    4   55 o    346.8    3.0    0.0000   0.0000          ?        ?  1203.6133  21.0712          ?        ?      346.8        3.0       ?       ? 
1 1 1   30    4   56 o    418.3    2.8    0.0000   0.0000          ?        ?  1750.8264  23.6253          ?        ?      418.3        2.8       ?       ? 
1 1 1   30    4   57 o    108.2    8.6    0.0000   0.0000          ?        ?   117.4880  18.5171          ?        ?      108.2        8.6       ?       ? 
1 1 1   30    4   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    4   59 o    242.4    4.2    0.0000   0.0000          ?        ?   588.0784  20.4327          ?        ?      242.4        4.2       ?       ? 
1 1 1   30    4   60 o     39.2   15.8    0.0000   0.0000          ?        ?     7.0237  19.1556          ?        ?       39.2       15.8       ?       ? 
1 1 1   30    4   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    4   62 o    209.7    4.9    0.0000   0.0000          ?        ?   440.5799  20.4327          ?        ?      209.7        4.9       ?       ? 
1 1 1   30    4   63 f    179.5    5.7    0.0000   0.0000          ?        ?   323.0919  20.4327          ?        ?      179.5        5.7       ?       ? 
1 1 1   30    4   64 o    161.7    6.3    0.0000   0.0000          ?        ?   262.4324  20.4327          ?        ?      161.7        6.3       ?       ? 
1 1 1   30    4   65 o     22.0   11.0    0.0000   0.0000          ?        ?   -60.6596  21.0712          ?        ?       22.0       11.0       ?       ? 
1 1 1   30    4   66 o    192.5    5.3    0.0000   0.0000          ?        ?   371.6196  20.4327          ?        ?      192.5        5.3       ?       ? 
1 1 1   30    4   67 o     99.8   10.2    0.0000   0.0000          ?        ?   100.8864  20.4327          ?        ?       99.8       10.2       ?       ? 
1 1 1   30    4   68 o    182.8    5.9    0.0000   0.0000          ?        ?   335.8624  21.7097          ?        ?      182.8        5.9       ?       ? 
1 1 1   30    4   69 o     84.4   12.1    0.0000   0.0000          ?        ?    72.7915  20.4327          ?        ?       84.4       12.1       ?       ? 
1 1 1   30    4   70 o     93.9   11.2    0.0000   0.0000          ?        ?    90.0316  21.0712          ?        ?       93.9       11.2       ?       ? 
1 1 1   30    4   71 o    235.8    4.7    0.0000   0.0000          ?        ?   558.0679  22.3483          ?        ?      235.8        4.7       ?       ? 
1 1 1   30    4   72 o     29.8   13.9    0.0000   0.0000          ?        ?   -17.8786  20.4327          ?        ?       29.8       13.9       ?       ? 
1 1 1   30    5    0 o   1049.4    5.6 11014.4980 117.4880 11014.4980 117.4880 11014.4980 117.4880     1049.4      5.6     1049.4        5.6     0.0     0.0 
1 1 1   30    5    1 o    991.6    3.7    0.0000   0.0000          ?        ?  9832.5947  74.0685          ?        ?      991.6        3.7       ?       ? 
1 1 1   30    5    2 o    602.5    2.8    0.0000   0.0000          ?        ?  3629.9954  33.2031          ?        ?      602.5        2.8       ?       ? 
1 1 1   30    5    3 o    306.8    2.5    0.0000   0.0000          ?        ?   941.1808  15.3245          ?        ?      306.8        2.5       ?       ? 
1 1 1   30    5    4 o   1235.3    4.6    0.0000   0.0000          ?        ? 15261.3057 113.0183          ?        ?     1235.3        4.6       ?       ? 
1 1 1   30    5    5 o    774.4    3.2    0.0000   0.0000          ?        ?  5996.9951  49.8047          ?        ?      774.4        3.2       ?       ? 
1 1 1   30    5    6 o   1209.0    4.3    0.0000   0.0000          ?        ? 14617.6758 104.0790          ?        ?     1209.0        4.3       ?       ? 
1 1 1   30    5    7 o   1496.6    5.4    0.0000   0.0000          ?        ? 22400.6152 162.1845          ?        ?     1496.6        5.4       ?       ? 
1 1 1   30    5    8 o    428.7    2.3    0.0000   0.0000          ?        ?  1838.3037  19.7942          ?        ?      428.7        2.3       ?       ? 
1 1 1   30    5    9 o    942.3    3.5    0.0000   0.0000          ?        ?  8879.9199  65.1292          ?        ?      942.3        3.5       ?       ? 
1 1 1   30    5   10 o    625.8    2.6    0.0000   0.0000          ?        ?  3916.0530  32.5646          ?        ?      625.8        2.6       ?       ? 
1 1 1   30    5   11 o    418.0    2.4    0.0000   0.0000          ?        ?  1747.6338  19.7942          ?        ?      418.0        2.4       ?       ? 
1 1 1   30    5   12 o   1019.1    3.6    0.0000   0.0000          ?        ? 10386.8311  74.0685          ?        ?     1019.1        3.6       ?       ? 
1 1 1   30    5   13 o    641.2    2.7    0.0000   0.0000          ?        ?  4112.0791  35.1187          ?        ?      641.2        2.7       ?       ? 
1 1 1   30    5   14 f    613.4    2.7    0.0000   0.0000          ?        ?  3762.8079  32.5646          ?        ?      613.4        2.7       ?       ? 
1 1 1   30    5   15 o   1107.3    4.0    0.0000   0.0000          ?        ? 12262.8076  89.3930          ?        ?     1107.3        4.0       ?       ? 
1 1 1   30    5   16 o    908.4    3.3    0.0000   0.0000          ?        ?  8252.8916  60.6596          ?        ?      908.4        3.3       ?       ? 
1 1 1   30    5   17 o   1145.8    4.1    0.0000   0.0000          ?        ? 13129.9209  94.5012          ?        ?     1145.8        4.1       ?       ? 
1 1 1   30    5   18 o   1073.8    4.0    0.0000   0.0000          ?        ? 11532.3389  86.2004          ?        ?     1073.8        4.0       ?       ? 
1 1 1   30    5   19 o   1222.6    4.7    0.0000   0.0000          ?        ? 14948.4307 114.9339          ?        ?     1222.6        4.7       ?       ? 
1 1 1   30    5   20 o   1000.1    3.9    0.0000   0.0000          ?        ? 10003.7178  77.8996          ?        ?     1000.1        3.9       ?       ? 
1 1 1   30    5   21 o    601.0    2.8    0.0000   0.0000          ?        ?  3612.7554  33.2031          ?        ?      601.0        2.8       ?       ? 
1 1 1   30    5   22 o    927.3    4.1    0.0000   0.0000          ?        ?  8599.6094  75.3456          ?        ?      927.3        4.1       ?       ? 
1 1 1   30    5   23 o    335.8    2.6    0.0000   0.0000          ?        ?  1127.6293  17.2401          ?        ?      335.8        2.6       ?       ? 
1 1 1   30    5   24 o    261.6    3.3    0.0000   0.0000          ?        ?   684.4952  17.2401          ?        ?      261.6        3.3       ?       ? 
1 1 1   30    5   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    5   26 o    627.9    2.8    0.0000   0.0000          ?        ?  3942.2327  35.1187          ?        ?      627.9        2.8       ?       ? 
1 1 1   30    5   27 o    664.0    2.9    0.0000   0.0000          ?        ?  4409.6304  38.3113          ?        ?      664.0        2.9       ?       ? 
1 1 1   30    5   28 o   1057.2    4.2    0.0000   0.0000          ?        ? 11179.2373  88.7545          ?        ?     1057.2        4.2       ?       ? 
1 1 1   30    5   29 o    695.7    2.8    0.0000   0.0000          ?        ?  4839.9941  39.5883          ?        ?      695.7        2.8       ?       ? 
1 1 1   30    5   30 o    129.8    5.4    0.0000   0.0000          ?        ?   168.5697  14.0475          ?        ?      129.8        5.4       ?       ? 
1 1 1   30    5   31 o    210.9    3.6    0.0000   0.0000          ?        ?   445.0496  15.3245          ?        ?      210.9        3.6       ?       ? 
1 1 1   30    5   32 o    371.6    2.7    0.0000   0.0000          ?        ?  1381.1223  19.7942          ?        ?      371.6        2.7       ?       ? 
1 1 1   30    5   33 o    254.9    3.1    0.0000   0.0000          ?        ?   650.0150  15.9630          ?        ?      254.9        3.1       ?       ? 
1 1 1   30    5   34 o    580.6    2.7    0.0000   0.0000          ?        ?  3370.7559  31.2876          ?        ?      580.6        2.7       ?       ? 
1 1 1   30    5   35 o   1338.5    4.6    0.0000   0.0000          ?        ? 17920.1094 123.2347          ?        ?     1338.5        4.6       ?       ? 
1 1 1   30    5   36 o    466.1    2.5    0.0000   0.0000          ?        ?  2172.8889  22.9868          ?        ?      466.1        2.5       ?       ? 
1 1 1   30    5   37 o    326.5    3.2    0.0000   0.0000          ?        ?  1066.3312  21.0712          ?        ?      326.5        3.2       ?       ? 
1 1 1   30    5   38 o    591.5    2.6    0.0000   0.0000          ?        ?  3499.0986  31.2876          ?        ?      591.5        2.6       ?       ? 
1 1 1   30    5   39 o    326.2    2.8    0.0000   0.0000          ?        ?  1064.4155  18.5171          ?        ?      326.2        2.8       ?       ? 
1 1 1   30    5   40 o    295.1    3.0    0.0000   0.0000          ?        ?   870.9435  17.8786          ?        ?      295.1        3.0       ?       ? 
1 1 1   30    5   41 o     79.4   10.1    0.0000   0.0000          ?        ?    63.2136  15.9630          ?        ?       79.4       10.1       ?       ? 
1 1 1   30    5   42 o    348.5    2.7    0.0000   0.0000          ?        ?  1214.4681  19.1556          ?        ?      348.5        2.7       ?       ? 
1 1 1   30    5   43 o    386.2    2.6    0.0000   0.0000          ?        ?  1491.5865  19.7942          ?        ?      386.2        2.6       ?       ? 
1 1 1   30    5   44 o    221.5    3.7    0.0000   0.0000          ?        ?   491.0231  16.6016          ?        ?      221.5        3.7       ?       ? 
1 1 1   30    5   45 o    556.6    2.8    0.0000   0.0000          ?        ?  3098.7454  30.6490          ?        ?      556.6        2.8       ?       ? 
1 1 1   30    5   46 o    423.3    2.6    0.0000   0.0000          ?        ?  1792.3303  22.3483          ?        ?      423.3        2.6       ?       ? 
1 1 1   30    5   47 o    422.6    2.7    0.0000   0.0000          ?        ?  1786.5834  22.9868          ?        ?      422.6        2.7       ?       ? 
1 1 1   30    5   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    5   49 o    630.3    2.7    0.0000   0.0000          ?        ?  3973.5200  34.4802          ?        ?      630.3        2.7       ?       ? 
1 1 1   30    5   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    5   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    5   52 f    159.5    5.4    0.0000   0.0000          ?        ?   254.7701  17.2401          ?        ?      159.5        5.4       ?       ? 
1 1 1   30    5   53 o    369.8    2.9    0.0000   0.0000          ?        ?  1368.3518  21.7097          ?        ?      369.8        2.9       ?       ? 
1 1 1   30    5   54 o    246.4    4.0    0.0000   0.0000          ?        ?   607.8726  19.7942          ?        ?      246.4        4.0       ?       ? 
1 1 1   30    5   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    5   56 o    567.1    2.7    0.0000   0.0000          ?        ?  3216.8718  30.6490          ?        ?      567.1        2.7       ?       ? 
1 1 1   30    5   57 o    329.4    3.1    0.0000   0.0000          ?        ?  1085.4868  20.4327          ?        ?      329.4        3.1       ?       ? 
1 1 1   30    5   58 o     44.9   16.1    0.0000   0.0000          ?        ?    17.2401  18.5171          ?        ?       44.9       16.1       ?       ? 
1 1 1   30    5   59 o    208.2    4.8    0.0000   0.0000          ?        ?   434.1947  19.7942          ?        ?      208.2        4.8       ?       ? 
1 1 1   30    5   60 o    475.2    2.8    0.0000   0.0000          ?        ?  2259.7280  26.1794          ?        ?      475.2        2.8       ?       ? 
1 1 1   30    5   61 o    197.6    5.2    0.0000   0.0000          ?        ?   391.4138  20.4327          ?        ?      197.6        5.2       ?       ? 
1 1 1   30    5   62 o    147.5    6.7    0.0000   0.0000          ?        ?   218.3744  19.7942          ?        ?      147.5        6.7       ?       ? 
1 1 1   30    5   63 o     32.3   14.5    0.0000   0.0000          ?        ?    -9.5778  19.7942          ?        ?       32.3       14.5       ?       ? 
1 1 1   30    5   64 o     23.4   11.5    0.0000   0.0000          ?        ?   -40.8654  19.1556          ?        ?       23.4       11.5       ?       ? 
1 1 1   30    5   65 o    121.0    8.4    0.0000   0.0000          ?        ?   147.4985  20.4327          ?        ?      121.0        8.4       ?       ? 
1 1 1   30    5   66 o    114.7    8.9    0.0000   0.0000          ?        ?   132.8125  20.4327          ?        ?      114.7        8.9       ?       ? 
1 1 1   30    5   67 o    239.1    4.5    0.0000   0.0000          ?        ?   573.3925  21.7097          ?        ?      239.1        4.5       ?       ? 
1 1 1   30    5   68 o    143.8    7.1    0.0000   0.0000          ?        ?   208.1580  20.4327          ?        ?      143.8        7.1       ?       ? 
1 1 1   30    5   69 o    239.9    4.5    0.0000   0.0000          ?        ?   577.2236  21.7097          ?        ?      239.9        4.5       ?       ? 
1 1 1   30    5   70 o     45.3   17.1    0.0000   0.0000          ?        ?    16.6016  21.0712          ?        ?       45.3       17.1       ?       ? 
1 1 1   30    5   71 o    237.4    4.6    0.0000   0.0000          ?        ?   565.7302  21.7097          ?        ?      237.4        4.6       ?       ? 
1 1 1   30    5   72 o    139.1    7.8    0.0000   0.0000          ?        ?   196.0261  21.7097          ?        ?      139.1        7.8       ?       ? 
1 1 1   30    6    0 o    136.7    5.4  187.7254  14.6860   187.7254  14.6860   187.7254  14.6860      136.7      5.4      136.7        5.4     0.0     0.0 
1 1 1   30    6    1 o   1666.8    6.0    0.0000   0.0000          ?        ? 27787.1836 200.4958          ?        ?     1666.8        6.0       ?       ? 
1 1 1   30    6    2 o    846.7    3.5    0.0000   0.0000          ?        ?  7168.6821  58.7440          ?        ?      846.7        3.5       ?       ? 
1 1 1   30    6    3 o   1330.2    4.9    0.0000   0.0000          ?        ? 17695.3496 130.8969          ?        ?     1330.2        4.9       ?       ? 
1 1 1   30    6    4 o    535.4    2.4    0.0000   0.0000          ?        ?  2866.3235  26.1794          ?        ?      535.4        2.4       ?       ? 
1 1 1   30    6    5 o   1113.7    4.1    0.0000   0.0000          ?        ? 12405.1982  91.9471          ?        ?     1113.7        4.1       ?       ? 
1 1 1   30    6    6 o    883.2    3.5    0.0000   0.0000          ?        ?  7801.4575  61.2981          ?        ?      883.2        3.5       ?       ? 
1 1 1   30    6    7 o    617.4    2.6    0.0000   0.0000          ?        ?  3811.3357  32.5646          ?        ?      617.4        2.6       ?       ? 
1 1 1   30    6    8 o    776.1    3.3    0.0000   0.0000          ?        ?  6023.8130  51.7203          ?        ?      776.1        3.3       ?       ? 
1 1 1   30    6    9 f    137.5    3.7    0.0000   0.0000          ?        ?   189.0024  10.2163          ?        ?      137.5        3.7       ?       ? 
1 1 1   30    6   10 o    720.7    2.9    0.0000   0.0000          ?        ?  5193.7349  41.5039          ?        ?      720.7        2.9       ?       ? 
1 1 1   30    6   11 o   1371.9    4.7    0.0000   0.0000          ?        ? 18824.2559 128.9814          ?        ?     1371.9        4.7       ?       ? 
1 1 1   30    6   12 o    818.2    3.4    0.0000   0.0000          ?        ?  6694.8994  55.5514          ?        ?      818.2        3.4       ?       ? 
1 1 1   30    6   13 o   1285.5    4.7    0.0000   0.0000          ?        ? 16525.5781 121.3191          ?        ?     1285.5        4.7       ?       ? 
1 1 1   30    6   14 o    920.1    3.5    0.0000   0.0000          ?        ?  8466.7969  64.4907          ?        ?      920.1        3.5       ?       ? 
1 1 1   30    6   15 o    947.2    3.5    0.0000   0.0000          ?        ?  8971.8672  67.0448          ?        ?      947.2        3.5       ?       ? 
1 1 1   30    6   16 o    597.1    2.8    0.0000   0.0000          ?        ?  3564.8662  33.8416          ?        ?      597.1        2.8       ?       ? 
1 1 1   30    6   17 f    429.7    2.5    0.0000   0.0000          ?        ?  1846.6046  21.7097          ?        ?      429.7        2.5       ?       ? 
1 1 1   30    6   18 o   1003.8    3.9    0.0000   0.0000          ?        ? 10077.1484  77.8996          ?        ?     1003.8        3.9       ?       ? 
1 1 1   30    6   19 o     86.8    7.4    0.0000   0.0000          ?        ?    75.3456  12.7704          ?        ?       86.8        7.4       ?       ? 
1 1 1   30    6   20 f   2170.7    7.8    0.0000   0.0000          ?        ? 47134.3867 336.5009          ?        ?     2170.7        7.8       ?       ? 
1 1 1   30    6   21 o    748.4    3.2    0.0000   0.0000          ?        ?  5601.1118  47.2506          ?        ?      748.4        3.2       ?       ? 
1 1 1   30    6   22 o    729.9    3.1    0.0000   0.0000          ?        ?  5327.1860  45.3350          ?        ?      729.9        3.1       ?       ? 
1 1 1   30    6   23 o    835.9    3.4    0.0000   0.0000          ?        ?  6988.6191  57.4669          ?        ?      835.9        3.4       ?       ? 
1 1 1   30    6   24 o    830.5    3.5    0.0000   0.0000          ?        ?  6897.9492  58.7440          ?        ?      830.5        3.5       ?       ? 
1 1 1   30    6   25 o     18.1    9.1    0.0000   0.0000          ?        ?   -49.1662  15.3245          ?        ?       18.1        9.1       ?       ? 
1 1 1   30    6   26 o    509.7    2.9    0.0000   0.0000          ?        ?  2598.1445  29.3720          ?        ?      509.7        2.9       ?       ? 
1 1 1   30    6   27 o    534.6    2.8    0.0000   0.0000          ?        ?  2858.6614  30.0105          ?        ?      534.6        2.8       ?       ? 
1 1 1   30    6   28 o    671.7    2.9    0.0000   0.0000          ?        ?  4512.4326  38.3113          ?        ?      671.7        2.9       ?       ? 
1 1 1   30    6   29 o    491.7    2.6    0.0000   0.0000          ?        ?  2418.0815  25.5409          ?        ?      491.7        2.6       ?       ? 
1 1 1   30    6   30 o    564.2    2.7    0.0000   0.0000          ?        ?  3183.6689  30.0105          ?        ?      564.2        2.7       ?       ? 
1 1 1   30    6   31 o    445.0    2.4    0.0000   0.0000          ?        ?  1980.0555  21.7097          ?        ?      445.0        2.4       ?       ? 
1 1 1   30    6   32 o     72.3   11.0    0.0000   0.0000          ?        ?    52.3588  15.9630          ?        ?       72.3       11.0       ?       ? 
1 1 1   30    6   33 o    539.8    2.5    0.0000   0.0000          ?        ?  2913.5742  26.8179          ?        ?      539.8        2.5       ?       ? 
1 1 1   30    6   34 o    604.6    2.6    0.0000   0.0000          ?        ?  3656.1746  31.9261          ?        ?      604.6        2.6       ?       ? 
1 1 1   30    6   35 o    216.9    3.5    0.0000   0.0000          ?        ?   470.5904  15.3245          ?        ?      216.9        3.5       ?       ? 
1 1 1   30    6   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    6   37 o    334.9    3.1    0.0000   0.0000          ?        ?  1121.8824  20.4327          ?        ?      334.9        3.1       ?       ? 
1 1 1   30    6   38 o    844.7    3.3    0.0000   0.0000          ?        ?  7136.7559  55.5514          ?        ?      844.7        3.3       ?       ? 
1 1 1   30    6   39 o    244.3    3.3    0.0000   0.0000          ?        ?   597.0177  15.9630          ?        ?      244.3        3.3       ?       ? 
1 1 1   30    6   40 o    326.8    2.8    0.0000   0.0000          ?        ?  1068.2467  18.5171          ?        ?      326.8        2.8       ?       ? 
1 1 1   30    6   41 o    626.2    2.8    0.0000   0.0000          ?        ?  3922.4382  34.4802          ?        ?      626.2        2.8       ?       ? 
1 1 1   30    6   42 o    746.4    2.9    0.0000   0.0000          ?        ?  5571.7397  43.4195          ?        ?      746.4        2.9       ?       ? 
1 1 1   30    6   43 o    350.6    2.8    0.0000   0.0000          ?        ?  1229.7927  19.7942          ?        ?      350.6        2.8       ?       ? 
1 1 1   30    6   44 o    218.4    3.7    0.0000   0.0000          ?        ?   476.9756  15.9630          ?        ?      218.4        3.7       ?       ? 
1 1 1   30    6   45 o    438.0    2.6    0.0000   0.0000          ?        ?  1918.7574  22.3483          ?        ?      438.0        2.6       ?       ? 
1 1 1   30    6   46 o    172.1    4.8    0.0000   0.0000          ?        ?   296.2740  16.6016          ?        ?      172.1        4.8       ?       ? 
1 1 1   30    6   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    6   48 o    460.0    2.5    0.0000   0.0000          ?        ?  2116.0605  22.9868          ?        ?      460.0        2.5       ?       ? 
1 1 1   30    6   49 o    283.0    3.0    0.0000   0.0000          ?        ?   801.3447  17.2401          ?        ?      283.0        3.0       ?       ? 
1 1 1   30    6   50 o    216.1    4.0    0.0000   0.0000          ?        ?   467.3978  17.2401          ?        ?      216.1        4.0       ?       ? 
1 1 1   30    6   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    6   52 o     37.3   15.0    0.0000   0.0000          ?        ?     6.3852  17.2401          ?        ?       37.3       15.0       ?       ? 
1 1 1   30    6   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    6   54 o    223.5    4.1    0.0000   0.0000          ?        ?   499.9625  18.5171          ?        ?      223.5        4.1       ?       ? 
1 1 1   30    6   55 o     56.4   15.8    0.0000   0.0000          ?        ?    33.2031  18.5171          ?        ?       56.4       15.8       ?       ? 
1 1 1   30    6   56 o    196.9    4.9    0.0000   0.0000          ?        ?   388.2211  19.1556          ?        ?      196.9        4.9       ?       ? 
1 1 1   30    6   57 o    312.2    3.3    0.0000   0.0000          ?        ?   975.0225  20.4327          ?        ?      312.2        3.3       ?       ? 
1 1 1   30    6   58 o    189.6    5.1    0.0000   0.0000          ?        ?   360.1262  19.1556          ?        ?      189.6        5.1       ?       ? 
1 1 1   30    6   59 o    161.6    6.1    0.0000   0.0000          ?        ?   261.7939  19.7942          ?        ?      161.6        6.1       ?       ? 
1 1 1   30    6   60 o    175.0    5.7    0.0000   0.0000          ?        ?   307.1289  19.7942          ?        ?      175.0        5.7       ?       ? 
1 1 1   30    6   61 o    123.2    8.0    0.0000   0.0000          ?        ?   152.6067  19.7942          ?        ?      123.2        8.0       ?       ? 
1 1 1   30    6   62 o    289.2    3.6    0.0000   0.0000          ?        ?   837.1019  21.0712          ?        ?      289.2        3.6       ?       ? 
1 1 1   30    6   63 o    393.4    3.0    0.0000   0.0000          ?        ?  1549.0535  23.6253          ?        ?      393.4        3.0       ?       ? 
1 1 1   30    6   64 o    126.9    8.0    0.0000   0.0000          ?        ?   162.1845  20.4327          ?        ?      126.9        8.0       ?       ? 
1 1 1   30    6   65 o     72.1   14.2    0.0000   0.0000          ?        ?    54.9129  19.7942          ?        ?       72.1       14.2       ?       ? 
1 1 1   30    6   66 o    117.7    8.7    0.0000   0.0000          ?        ?   139.8362  20.4327          ?        ?      117.7        8.7       ?       ? 
1 1 1   30    6   67 o     84.5   12.1    0.0000   0.0000          ?        ?    72.7915  20.4327          ?        ?       84.5       12.1       ?       ? 
1 1 1   30    6   68 o     63.9   16.4    0.0000   0.0000          ?        ?    44.0580  21.0712          ?        ?       63.9       16.4       ?       ? 
1 1 1   30    6   69 o    125.6    8.4    0.0000   0.0000          ?        ?   159.6304  21.0712          ?        ?      125.6        8.4       ?       ? 
1 1 1   30    6   70 o     69.0   16.0    0.0000   0.0000          ?        ?    51.7203  21.7097          ?        ?       69.0       16.0       ?       ? 
1 1 1   30    6   71 o     34.5   15.3    0.0000   0.0000          ?        ?    -5.7467  21.0712          ?        ?       34.5       15.3       ?       ? 
1 1 1   30    7    0 o     78.5    8.7   63.8522  13.4090    63.8522  13.4090    63.8522  13.4090       78.5      8.7       78.5        8.7     0.0     0.0 
1 1 1   30    7    1 o   1203.8    4.5    0.0000   0.0000          ?        ? 14491.8877 108.5487          ?        ?     1203.8        4.5       ?       ? 
1 1 1   30    7    2 o   1836.3    6.7    0.0000   0.0000          ?        ? 33726.0742 246.4693          ?        ?     1836.3        6.7       ?       ? 
1 1 1   30    7    3 o    895.3    3.6    0.0000   0.0000          ?        ?  8015.3623  64.4907          ?        ?      895.3        3.6       ?       ? 
1 1 1   30    7    4 o    574.4    2.7    0.0000   0.0000          ?        ?  3299.2412  30.6490          ?        ?      574.4        2.7       ?       ? 
1 1 1   30    7    5 o   1590.5    5.7    0.0000   0.0000          ?        ? 25301.4199 181.3401          ?        ?     1590.5        5.7       ?       ? 
1 1 1   30    7    6 o   1106.0    4.1    0.0000   0.0000          ?        ? 12233.4355  90.6701          ?        ?     1106.0        4.1       ?       ? 
1 1 1   30    7    7 o    429.9    2.3    0.0000   0.0000          ?        ?  1848.5201  19.7942          ?        ?      429.9        2.3       ?       ? 
1 1 1   30    7    8 o    738.0    3.2    0.0000   0.0000          ?        ?  5446.5894  47.8891          ?        ?      738.0        3.2       ?       ? 
1 1 1   30    7    9 o     16.1    8.2    0.0000   0.0000          ?        ?   -49.1662  13.4090          ?        ?       16.1        8.2       ?       ? 
1 1 1   30    7   10 o    535.2    2.6    0.0000   0.0000          ?        ?  2864.4080  28.0950          ?        ?      535.2        2.6       ?       ? 
1 1 1   30    7   11 o    250.3    4.1    0.0000   0.0000          ?        ?   626.3897  20.4327          ?        ?      250.3        4.1       ?       ? 
1 1 1   30    7   12 o    738.6    3.0    0.0000   0.0000          ?        ?  5454.8901  44.6965          ?        ?      738.6        3.0       ?       ? 
1 1 1   30    7   13 o    230.8    3.3    0.0000   0.0000          ?        ?   532.5270  15.3245          ?        ?      230.8        3.3       ?       ? 
1 1 1   30    7   14 o   1863.1    6.4    0.0000   0.0000          ?        ? 34719.6133 238.1686          ?        ?     1863.1        6.4       ?       ? 
1 1 1   30    7   15 o   1289.9    4.8    0.0000   0.0000          ?        ? 16640.5137 123.2347          ?        ?     1289.9        4.8       ?       ? 
1 1 1   30    7   16 o   1074.8    4.0    0.0000   0.0000          ?        ? 11552.7725  85.5619          ?        ?     1074.8        4.0       ?       ? 
1 1 1   30    7   17 o   1382.6    4.7    0.0000   0.0000          ?        ? 19118.6133 130.2584          ?        ?     1382.6        4.7       ?       ? 
1 1 1   30    7   18 o    892.5    3.5    0.0000   0.0000          ?        ?  7966.8340  63.2136          ?        ?      892.5        3.5       ?       ? 
1 1 1   30    7   19 f   1439.8    5.1    0.0000   0.0000          ?        ? 20734.7129 146.8600          ?        ?     1439.8        5.1       ?       ? 
1 1 1   30    7   20 o    495.8    2.6    0.0000   0.0000          ?        ?  2458.3083  25.5409          ?        ?      495.8        2.6       ?       ? 
1 1 1   30    7   21 o    547.4    2.7    0.0000   0.0000          ?        ?  2996.5820  29.3720          ?        ?      547.4        2.7       ?       ? 
1 1 1   30    7   22 o    321.2    3.2    0.0000   0.0000          ?        ?  1031.8510  20.4327          ?        ?      321.2        3.2       ?       ? 
1 1 1   30    7   23 o    618.4    2.9    0.0000   0.0000          ?        ?  3824.7446  35.7572          ?        ?      618.4        2.9       ?       ? 
1 1 1   30    7   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    7   25 o    317.3    2.7    0.0000   0.0000          ?        ?  1006.9486  17.2401          ?        ?      317.3        2.7       ?       ? 
1 1 1   30    7   26 o    458.2    2.4    0.0000   0.0000          ?        ?  2099.4590  22.3483          ?        ?      458.2        2.4       ?       ? 
1 1 1   30    7   27 o    337.4    2.5    0.0000   0.0000          ?        ?  1138.4841  16.6016          ?        ?      337.4        2.5       ?       ? 
1 1 1   30    7   28 o    806.3    3.1    0.0000   0.0000          ?        ?  6502.0654  50.4432          ?        ?      806.3        3.1       ?       ? 
1 1 1   30    7   29 o    358.5    2.8    0.0000   0.0000          ?        ?  1285.3440  19.7942          ?        ?      358.5        2.8       ?       ? 
1 1 1   30    7   30 o    795.7    3.1    0.0000   0.0000          ?        ?  6331.5801  49.8047          ?        ?      795.7        3.1       ?       ? 
1 1 1   30    7   31 o    247.4    3.4    0.0000   0.0000          ?        ?   612.3422  16.6016          ?        ?      247.4        3.4       ?       ? 
1 1 1   30    7   32 o    530.0    2.7    0.0000   0.0000          ?        ?  2808.8567  28.0950          ?        ?      530.0        2.7       ?       ? 
1 1 1   30    7   33 o    979.1    3.6    0.0000   0.0000          ?        ?  9588.0410  70.2374          ?        ?      979.1        3.6       ?       ? 
1 1 1   30    7   34 o    295.4    2.9    0.0000   0.0000          ?        ?   872.8591  17.2401          ?        ?      295.4        2.9       ?       ? 
1 1 1   30    7   35 o     30.5   13.2    0.0000   0.0000          ?        ?    -1.9156  14.6860          ?        ?       30.5       13.2       ?       ? 
1 1 1   30    7   36 o    516.3    2.6    0.0000   0.0000          ?        ?  2665.8279  26.8179          ?        ?      516.3        2.6       ?       ? 
1 1 1   30    7   37 o    687.4    3.0    0.0000   0.0000          ?        ?  4725.6982  40.8654          ?        ?      687.4        3.0       ?       ? 
1 1 1   30    7   38 o    369.3    2.6    0.0000   0.0000          ?        ?  1363.8822  19.1556          ?        ?      369.3        2.6       ?       ? 
1 1 1   30    7   39 o    251.3    3.3    0.0000   0.0000          ?        ?   631.4979  16.6016          ?        ?      251.3        3.3       ?       ? 
1 1 1   30    7   40 o    436.0    2.6    0.0000   0.0000          ?        ?  1900.8789  22.3483          ?        ?      436.0        2.6       ?       ? 
1 1 1   30    7   41 o    364.0    2.7    0.0000   0.0000          ?        ?  1324.9324  19.7942          ?        ?      364.0        2.7       ?       ? 
1 1 1   30    7   42 o    227.9    3.6    0.0000   0.0000          ?        ?   519.7566  16.6016          ?        ?      227.9        3.6       ?       ? 
1 1 1   30    7   43 o     18.7    9.4    0.0000   0.0000          ?        ?   -49.8047  15.9630          ?        ?       18.7        9.4       ?       ? 
1 1 1   30    7   44 o    209.8    4.0    0.0000   0.0000          ?        ?   440.5799  16.6016          ?        ?      209.8        4.0       ?       ? 
1 1 1   30    7   45 f    308.7    2.9    0.0000   0.0000          ?        ?   953.3128  17.8786          ?        ?      308.7        2.9       ?       ? 
1 1 1   30    7   46 f    155.7    5.3    0.0000   0.0000          ?        ?   242.6382  16.6016          ?        ?      155.7        5.3       ?       ? 
1 1 1   30    7   47 o    211.2    4.1    0.0000   0.0000          ?        ?   446.3266  17.2401          ?        ?      211.2        4.1       ?       ? 
1 1 1   30    7   48 o    115.4    7.2    0.0000   0.0000          ?        ?   133.4510  16.6016          ?        ?      115.4        7.2       ?       ? 
1 1 1   30    7   49 o    359.4    2.8    0.0000   0.0000          ?        ?  1292.3677  19.7942          ?        ?      359.4        2.8       ?       ? 
1 1 1   30    7   50 o    204.3    4.2    0.0000   0.0000          ?        ?   417.5931  17.2401          ?        ?      204.3        4.2       ?       ? 
1 1 1   30    7   51 o     24.2   11.7    0.0000   0.0000          ?        ?   -24.9023  16.6016          ?        ?       24.2       11.7       ?       ? 
1 1 1   30    7   52 f    122.6    7.3    0.0000   0.0000          ?        ?   150.6911  17.8786          ?        ?      122.6        7.3       ?       ? 
1 1 1   30    7   53 o    350.3    3.0    0.0000   0.0000          ?        ?  1227.8771  21.0712          ?        ?      350.3        3.0       ?       ? 
1 1 1   30    7   54 o    237.6    4.0    0.0000   0.0000          ?        ?   565.0916  19.1556          ?        ?      237.6        4.0       ?       ? 
1 1 1   30    7   55 o    306.4    3.2    0.0000   0.0000          ?        ?   939.2654  19.7942          ?        ?      306.4        3.2       ?       ? 
1 1 1   30    7   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    7   57 o    291.4    3.5    0.0000   0.0000          ?        ?   849.8723  20.4327          ?        ?      291.4        3.5       ?       ? 
1 1 1   30    7   58 o     19.3    9.8    0.0000   0.0000          ?        ?   -68.9603  19.1556          ?        ?       19.3        9.8       ?       ? 
1 1 1   30    7   59 o    372.4    3.1    0.0000   0.0000          ?        ?  1388.1460  22.9868          ?        ?      372.4        3.1       ?       ? 
1 1 1   30    7   60 o    208.5    4.9    0.0000   0.0000          ?        ?   435.4717  20.4327          ?        ?      208.5        4.9       ?       ? 
1 1 1   30    7   61 o    207.4    4.9    0.0000   0.0000          ?        ?   431.0021  20.4327          ?        ?      207.4        4.9       ?       ? 
1 1 1   30    7   62 o    282.9    4.0    0.0000   0.0000          ?        ?   801.3447  22.3483          ?        ?      282.9        4.0       ?       ? 
1 1 1   30    7   63 o    142.6    7.4    0.0000   0.0000          ?        ?   204.3269  21.0712          ?        ?      142.6        7.4       ?       ? 
1 1 1   30    7   64 o     91.5   11.5    0.0000   0.0000          ?        ?    84.9234  21.0712          ?        ?       91.5       11.5       ?       ? 
1 1 1   30    7   65 o     93.2   11.0    0.0000   0.0000          ?        ?    88.1160  20.4327          ?        ?       93.2       11.0       ?       ? 
1 1 1   30    7   66 o     40.7   16.5    0.0000   0.0000          ?        ?     7.6623  21.0712          ?        ?       40.7       16.5       ?       ? 
1 1 1   30    7   67 o     29.2   13.7    0.0000   0.0000          ?        ?   -22.9868  21.0712          ?        ?       29.2       13.7       ?       ? 
1 1 1   30    7   68 o     75.0   15.0    0.0000   0.0000          ?        ?    60.0210  21.7097          ?        ?       75.0       15.0       ?       ? 
1 1 1   30    7   69 o    177.8    5.9    0.0000   0.0000          ?        ?   317.9838  21.0712          ?        ?      177.8        5.9       ?       ? 
1 1 1   30    7   70 o     29.6   14.0    0.0000   0.0000          ?        ?   -22.9868  21.7097          ?        ?       29.6       14.0       ?       ? 
1 1 1   30    7   71 o    170.2    6.0    0.0000   0.0000          ?        ?   291.8044  20.4327          ?        ?      170.2        6.0       ?       ? 
1 1 1   30    8    0 o    524.9    3.6 2755.8594  37.6728  2755.8594  37.6728  2755.8594  37.6728      524.9      3.6      524.9        3.6     0.0     0.0 
1 1 1   30    8    1 o    840.4    3.3    0.0000   0.0000          ?        ?  7062.6875  55.5514          ?        ?      840.4        3.3       ?       ? 
1 1 1   30    8    2 o    981.9    3.9    0.0000   0.0000          ?        ?  9641.6768  76.6226          ?        ?      981.9        3.9       ?       ? 
1 1 1   30    8    3 o   1414.2    5.1    0.0000   0.0000          ?        ? 20002.9668 143.0288          ?        ?     1414.2        5.1       ?       ? 
1 1 1   30    8    4 o    511.6    2.6    0.0000   0.0000          ?        ?  2617.9387  26.8179          ?        ?      511.6        2.6       ?       ? 
1 1 1   30    8    5 f    480.9    2.6    0.0000   0.0000          ?        ?  2312.7253  24.9023          ?        ?      480.9        2.6       ?       ? 
1 1 1   30    8    6 o   1237.2    4.6    0.0000   0.0000          ?        ? 15309.1953 114.9339          ?        ?     1237.2        4.6       ?       ? 
1 1 1   30    8    7 o   1259.7    4.6    0.0000   0.0000          ?        ? 15871.0938 114.9339          ?        ?     1259.7        4.6       ?       ? 
1 1 1   30    8    8 o    817.7    3.4    0.0000   0.0000          ?        ?  6686.5981  55.5514          ?        ?      817.7        3.4       ?       ? 
1 1 1   30    8    9 o    660.7    2.9    0.0000   0.0000          ?        ?  4364.9336  37.6728          ?        ?      660.7        2.9       ?       ? 
1 1 1   30    8   10 o   1251.7    4.5    0.0000   0.0000          ?        ? 15668.0439 112.3798          ?        ?     1251.7        4.5       ?       ? 
1 1 1   30    8   11 o    548.0    3.0    0.0000   0.0000          ?        ?  3002.9670  33.2031          ?        ?      548.0        3.0       ?       ? 
1 1 1   30    8   12 o   2669.1    9.9    0.0000   0.0000          ?        ? 71276.2578 528.6959          ?        ?     2669.1        9.9       ?       ? 
1 1 1   30    8   13 o    154.7    3.9    0.0000   0.0000          ?        ?   239.4456  12.1319          ?        ?      154.7        3.9       ?       ? 
1 1 1   30    8   14 o    215.1    3.7    0.0000   0.0000          ?        ?   462.9282  15.9630          ?        ?      215.1        3.7       ?       ? 
1 1 1   30    8   15 o    374.6    2.6    0.0000   0.0000          ?        ?  1403.4706  19.7942          ?        ?      374.6        2.6       ?       ? 
1 1 1   30    8   16 o   1180.5    4.3    0.0000   0.0000          ?        ? 13937.0107 102.1635          ?        ?     1180.5        4.3       ?       ? 
1 1 1   30    8   17 o    661.7    2.8    0.0000   0.0000          ?        ?  4378.9814  37.6728          ?        ?      661.7        2.8       ?       ? 
1 1 1   30    8   18 o   1164.0    4.2    0.0000   0.0000          ?        ? 13549.4287  97.6938          ?        ?     1164.0        4.2       ?       ? 
1 1 1   30    8   19 o    743.6    3.0    0.0000   0.0000          ?        ?  5529.5972  44.6965          ?        ?      743.6        3.0       ?       ? 
1 1 1   30    8   20 o    600.4    2.9    0.0000   0.0000          ?        ?  3604.4546  34.4802          ?        ?      600.4        2.9       ?       ? 
1 1 1   30    8   21 o    759.8    3.1    0.0000   0.0000          ?        ?  5773.5127  46.6121          ?        ?      759.8        3.1       ?       ? 
1 1 1   30    8   22 f    456.5    2.5    0.0000   0.0000          ?        ?  2084.1345  22.9868          ?        ?      456.5        2.5       ?       ? 
1 1 1   30    8   23 o   1039.5    3.9    0.0000   0.0000          ?        ? 10807.6172  80.4537          ?        ?     1039.5        3.9       ?       ? 
1 1 1   30    8   24 o    632.4    2.8    0.0000   0.0000          ?        ?  3999.6997  35.1187          ?        ?      632.4        2.8       ?       ? 
1 1 1   30    8   25 o    712.3    3.1    0.0000   0.0000          ?        ?  5073.6929  44.0580          ?        ?      712.3        3.1       ?       ? 
1 1 1   30    8   26 o    274.7    2.9    0.0000   0.0000          ?        ?   754.7325  15.9630          ?        ?      274.7        2.9       ?       ? 
1 1 1   30    8   27 o    134.6    5.2    0.0000   0.0000          ?        ?   181.3401  14.0475          ?        ?      134.6        5.2       ?       ? 
1 1 1   30    8   28 o    481.6    2.7    0.0000   0.0000          ?        ?  2319.1106  25.5409          ?        ?      481.6        2.7       ?       ? 
1 1 1   30    8   29 o    403.7    2.7    0.0000   0.0000          ?        ?  1629.5072  21.7097          ?        ?      403.7        2.7       ?       ? 
1 1 1   30    8   30 o    333.9    2.8    0.0000   0.0000          ?        ?  1114.8588  18.5171          ?        ?      333.9        2.8       ?       ? 
1 1 1   30    8   31 o    314.3    2.8    0.0000   0.0000          ?        ?   987.7929  17.8786          ?        ?      314.3        2.8       ?       ? 
1 1 1   30    8   32 o    684.6    2.8    0.0000   0.0000          ?        ?  4687.3872  38.9498          ?        ?      684.6        2.8       ?       ? 
1 1 1   30    8   33 o     76.6   10.4    0.0000   0.0000          ?        ?    58.7440  15.9630          ?        ?       76.6       10.4       ?       ? 
1 1 1   30    8   34 o    431.1    2.5    0.0000   0.0000          ?        ?  1858.7365  21.7097          ?        ?      431.1        2.5       ?       ? 
1 1 1   30    8   35 o    729.3    2.9    0.0000   0.0000          ?        ?  5320.1621  42.7809          ?        ?      729.3        2.9       ?       ? 
1 1 1   30    8   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    8   37 o    829.9    3.2    0.0000   0.0000          ?        ?  6888.3716  52.9973          ?        ?      829.9        3.2       ?       ? 
1 1 1   30    8   38 o    496.7    2.5    0.0000   0.0000          ?        ?  2467.8860  24.9023          ?        ?      496.7        2.5       ?       ? 
1 1 1   30    8   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    8   40 o    766.0    3.0    0.0000   0.0000          ?        ?  5868.6523  45.9736          ?        ?      766.0        3.0       ?       ? 
1 1 1   30    8   41 o    462.4    2.6    0.0000   0.0000          ?        ?  2138.4089  23.6253          ?        ?      462.4        2.6       ?       ? 
1 1 1   30    8   42 o    138.3    6.0    0.0000   0.0000          ?        ?   191.5565  16.6016          ?        ?      138.3        6.0       ?       ? 
1 1 1   30    8   43 o    191.7    4.3    0.0000   0.0000          ?        ?   367.7885  16.6016          ?        ?      191.7        4.3       ?       ? 
1 1 1   30    8   44 o    205.2    4.0    0.0000   0.0000          ?        ?   421.4243  16.6016          ?        ?      205.2        4.0       ?       ? 
1 1 1   30    8   45 o     45.2   14.8    0.0000   0.0000          ?        ?    19.7942  15.3245          ?        ?       45.2       14.8       ?       ? 
1 1 1   30    8   46 o    469.2    2.6    0.0000   0.0000          ?        ?  2201.6226  24.2638          ?        ?      469.2        2.6       ?       ? 
1 1 1   30    8   47 o    499.1    2.6    0.0000   0.0000          ?        ?  2491.5115  25.5409          ?        ?      499.1        2.6       ?       ? 
1 1 1   30    8   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    8   49 o     22.4   11.0    0.0000   0.0000          ?        ?   -32.5646  16.6016          ?        ?       22.4       11.0       ?       ? 
1 1 1   30    8   50 o    236.6    3.6    0.0000   0.0000          ?        ?   559.9835  17.2401          ?        ?      236.6        3.6       ?       ? 
1 1 1   30    8   51 o     30.0   13.6    0.0000   0.0000          ?        ?    -8.9393  17.2401          ?        ?       30.0       13.6       ?       ? 
1 1 1   30    8   52 f    317.1    3.1    0.0000   0.0000          ?        ?  1006.3101  19.7942          ?        ?      317.1        3.1       ?       ? 
1 1 1   30    8   53 o     37.3   15.0    0.0000   0.0000          ?        ?     6.3852  17.2401          ?        ?       37.3       15.0       ?       ? 
1 1 1   30    8   54 o    312.1    3.3    0.0000   0.0000          ?        ?   974.3840  20.4327          ?        ?      312.1        3.3       ?       ? 
1 1 1   30    8   55 o    231.5    4.3    0.0000   0.0000          ?        ?   536.3582  19.7942          ?        ?      231.5        4.3       ?       ? 
1 1 1   30    8   56 o    438.4    2.8    0.0000   0.0000          ?        ?  1923.2272  24.9023          ?        ?      438.4        2.8       ?       ? 
1 1 1   30    8   57 o    526.1    2.9    0.0000   0.0000          ?        ?  2769.2683  30.6490          ?        ?      526.1        2.9       ?       ? 
1 1 1   30    8   58 o    235.8    4.3    0.0000   0.0000          ?        ?   556.7908  20.4327          ?        ?      235.8        4.3       ?       ? 
1 1 1   30    8   59 o     98.5    9.7    0.0000   0.0000          ?        ?    97.6938  19.1556          ?        ?       98.5        9.7       ?       ? 
1 1 1   30    8   60 o     83.7   11.8    0.0000   0.0000          ?        ?    70.8759  19.7942          ?        ?       83.7       11.8       ?       ? 
1 1 1   30    8   61 o    271.1    4.0    0.0000   0.0000          ?        ?   736.2155  21.7097          ?        ?      271.1        4.0       ?       ? 
1 1 1   30    8   62 o    392.7    3.3    0.0000   0.0000          ?        ?  1543.9453  25.5409          ?        ?      392.7        3.3       ?       ? 
1 1 1   30    8   63 o    163.2    6.7    0.0000   0.0000          ?        ?   267.5406  21.7097          ?        ?      163.2        6.7       ?       ? 
1 1 1   30    8   64 o    440.1    3.1    0.0000   0.0000          ?        ?  1939.1903  27.4564          ?        ?      440.1        3.1       ?       ? 
1 1 1   30    8   65 f    230.9    4.7    0.0000   0.0000          ?        ?   534.4426  21.7097          ?        ?      230.9        4.7       ?       ? 
1 1 1   30    8   66 f    258.0    4.2    0.0000   0.0000          ?        ?   667.2551  21.7097          ?        ?      258.0        4.2       ?       ? 
1 1 1   30    8   67 o     25.7   12.5    0.0000   0.0000          ?        ?   -35.1187  20.4327          ?        ?       25.7       12.5       ?       ? 
1 1 1   30    8   68 o     20.2   10.2    0.0000   0.0000          ?        ?   -70.2374  20.4327          ?        ?       20.2       10.2       ?       ? 
1 1 1   30    8   69 o     71.0   14.9    0.0000   0.0000          ?        ?    54.2743  20.4327          ?        ?       71.0       14.9       ?       ? 
1 1 1   30    8   70 o     50.2   17.3    0.0000   0.0000          ?        ?    24.9023  21.0712          ?        ?       50.2       17.3       ?       ? 
1 1 1   30    9    0 o    554.3    4.0 3072.5662  44.0580  3072.5662  44.0580  3072.5662  44.0580      554.3      4.0      554.3        4.0     0.0     0.0 
1 1 1   30    9    1 o    976.4    3.7    0.0000   0.0000          ?        ?  9534.4043  71.5144          ?        ?      976.4        3.7       ?       ? 
1 1 1   30    9    2 o    348.7    2.2    0.0000   0.0000          ?        ?  1215.7451  15.3245          ?        ?      348.7        2.2       ?       ? 
1 1 1   30    9    3 o    749.5    3.2    0.0000   0.0000          ?        ?  5617.7134  48.5276          ?        ?      749.5        3.2       ?       ? 
1 1 1   30    9    4 o   1276.3    4.8    0.0000   0.0000          ?        ? 16290.6025 123.2347          ?        ?     1276.3        4.8       ?       ? 
1 1 1   30    9    5 o    640.3    3.0    0.0000   0.0000          ?        ?  4099.9473  38.3113          ?        ?      640.3        3.0       ?       ? 
1 1 1   30    9    6 o   1718.4    6.0    0.0000   0.0000          ?        ? 29534.8184 204.9654          ?        ?     1718.4        6.0       ?       ? 
1 1 1   30    9    7 o    341.8    2.5    0.0000   0.0000          ?        ?  1168.4946  17.2401          ?        ?      341.8        2.5       ?       ? 
1 1 1   30    9    8 o   1293.8    4.8    0.0000   0.0000          ?        ? 16741.3984 123.8732          ?        ?     1293.8        4.8       ?       ? 
1 1 1   30    9    9 o   1173.1    4.4    0.0000   0.0000          ?        ? 13762.0566 102.8020          ?        ?     1173.1        4.4       ?       ? 
1 1 1   30    9   10 o   1136.5    4.1    0.0000   0.0000          ?        ? 12917.9307  93.8627          ?        ?     1136.5        4.1       ?       ? 
1 1 1   30    9   11 o    880.2    3.4    0.0000   0.0000          ?        ?  7747.1831  60.6596          ?        ?      880.2        3.4       ?       ? 
1 1 1   30    9   12 o    948.9    3.8    0.0000   0.0000          ?        ?  9004.4316  71.5144          ?        ?      948.9        3.8       ?       ? 
1 1 1   30    9   13 o   1072.3    4.1    0.0000   0.0000          ?        ? 11498.4980  87.4775          ?        ?     1072.3        4.1       ?       ? 
1 1 1   30    9   14 o    720.3    3.0    0.0000   0.0000          ?        ?  5187.9883  43.4195          ?        ?      720.3        3.0       ?       ? 
1 1 1   30    9   15 f    271.0    2.4    0.0000   0.0000          ?        ?   734.2999  12.7704          ?        ?      271.0        2.4       ?       ? 
1 1 1   30    9   16 o    845.5    3.4    0.0000   0.0000          ?        ?  7149.5264  58.1055          ?        ?      845.5        3.4       ?       ? 
1 1 1   30    9   17 o   1004.6    3.8    0.0000   0.0000          ?        ? 10093.1113  75.9841          ?        ?     1004.6        3.8       ?       ? 
1 1 1   30    9   18 o   1820.0    6.3    0.0000   0.0000          ?        ? 33134.1641 228.5907          ?        ?     1820.0        6.3       ?       ? 
1 1 1   30    9   19 o    806.9    3.1    0.0000   0.0000          ?        ?  6511.6436  50.4432          ?        ?      806.9        3.1       ?       ? 
1 1 1   30    9   20 o    810.1    3.3    0.0000   0.0000          ?        ?  6563.3638  53.6358          ?        ?      810.1        3.3       ?       ? 
1 1 1   30    9   21 o   1426.0    5.2    0.0000   0.0000          ?        ? 20340.1055 147.4985          ?        ?     1426.0        5.2       ?       ? 
1 1 1   30    9   22 o    645.5    2.8    0.0000   0.0000          ?        ?  4166.9922  35.7572          ?        ?      645.5        2.8       ?       ? 
1 1 1   30    9   23 f    686.3    3.0    0.0000   0.0000          ?        ?  4711.0127  41.5039          ?        ?      686.3        3.0       ?       ? 
1 1 1   30    9   24 o    473.7    2.6    0.0000   0.0000          ?        ?  2243.7649  24.9023          ?        ?      473.7        2.6       ?       ? 
1 1 1   30    9   25 o    575.0    2.6    0.0000   0.0000          ?        ?  3306.2649  30.0105          ?        ?      575.0        2.6       ?       ? 
1 1 1   30    9   26 o    510.8    2.5    0.0000   0.0000          ?        ?  2609.6379  25.5409          ?        ?      510.8        2.5       ?       ? 
1 1 1   30    9   27 o    484.1    2.6    0.0000   0.0000          ?        ?  2343.3743  24.9023          ?        ?      484.1        2.6       ?       ? 
1 1 1   30    9   28 o    136.5    5.4    0.0000   0.0000          ?        ?   186.4483  14.6860          ?        ?      136.5        5.4       ?       ? 
1 1 1   30    9   29 o    297.6    2.9    0.0000   0.0000          ?        ?   885.6295  17.2401          ?        ?      297.6        2.9       ?       ? 
1 1 1   30    9   30 o    521.6    2.5    0.0000   0.0000          ?        ?  2721.3792  26.1794          ?        ?      521.6        2.5       ?       ? 
1 1 1   30    9   31 o    504.1    2.5    0.0000   0.0000          ?        ?  2541.3162  24.9023          ?        ?      504.1        2.5       ?       ? 
1 1 1   30    9   32 o    231.3    3.3    0.0000   0.0000          ?        ?   535.0811  15.3245          ?        ?      231.3        3.3       ?       ? 
1 1 1   30    9   33 o    265.8    3.0    0.0000   0.0000          ?        ?   706.8434  15.9630          ?        ?      265.8        3.0       ?       ? 
1 1 1   30    9   34 o    459.4    2.5    0.0000   0.0000          ?        ?  2110.3140  22.9868          ?        ?      459.4        2.5       ?       ? 
1 1 1   30    9   35 o    394.9    2.6    0.0000   0.0000          ?        ?  1559.2698  20.4327          ?        ?      394.9        2.6       ?       ? 
1 1 1   30    9   36 o    430.7    2.5    0.0000   0.0000          ?        ?  1854.9053  21.7097          ?        ?      430.7        2.5       ?       ? 
1 1 1   30    9   37 o    291.9    2.8    0.0000   0.0000          ?        ?   852.4264  16.6016          ?        ?      291.9        2.8       ?       ? 
1 1 1   30    9   38 o    316.9    2.9    0.0000   0.0000          ?        ?  1004.3945  18.5171          ?        ?      316.9        2.9       ?       ? 
1 1 1   30    9   39 o    416.9    2.5    0.0000   0.0000          ?        ?  1738.6943  21.0712          ?        ?      416.9        2.5       ?       ? 
1 1 1   30    9   40 o    496.3    2.5    0.0000   0.0000          ?        ?  2464.0549  24.9023          ?        ?      496.3        2.5       ?       ? 
1 1 1   30    9   41 o     90.7    8.8    0.0000   0.0000          ?        ?    82.3693  15.9630          ?        ?       90.7        8.8       ?       ? 
1 1 1   30    9   42 o     38.2   14.5    0.0000   0.0000          ?        ?    10.2163  15.3245          ?        ?       38.2       14.5       ?       ? 
1 1 1   30    9   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    9   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    9   45 o    182.5    4.5    0.0000   0.0000          ?        ?   333.3083  16.6016          ?        ?      182.5        4.5       ?       ? 
1 1 1   30    9   46 o    407.2    2.7    0.0000   0.0000          ?        ?  1658.8792  21.7097          ?        ?      407.2        2.7       ?       ? 
1 1 1   30    9   47 o    164.6    5.2    0.0000   0.0000          ?        ?   271.3717  17.2401          ?        ?      164.6        5.2       ?       ? 
1 1 1   30    9   48 o    429.4    2.7    0.0000   0.0000          ?        ?  1844.0504  22.9868          ?        ?      429.4        2.7       ?       ? 
1 1 1   30    9   49 o    265.8    3.5    0.0000   0.0000          ?        ?   706.8434  18.5171          ?        ?      265.8        3.5       ?       ? 
1 1 1   30    9   50 o    304.8    3.2    0.0000   0.0000          ?        ?   929.6875  19.7942          ?        ?      304.8        3.2       ?       ? 
1 1 1   30    9   51 o     56.3   15.0    0.0000   0.0000          ?        ?    33.2031  17.2401          ?        ?       56.3       15.0       ?       ? 
1 1 1   30    9   52 o    249.8    3.7    0.0000   0.0000          ?        ?   624.4742  18.5171          ?        ?      249.8        3.7       ?       ? 
1 1 1   30    9   53 o    155.2    6.0    0.0000   0.0000          ?        ?   241.3612  18.5171          ?        ?      155.2        6.0       ?       ? 
1 1 1   30    9   54 o     39.1   15.6    0.0000   0.0000          ?        ?     7.6623  18.5171          ?        ?       39.1       15.6       ?       ? 
1 1 1   30    9   55 o     33.9   14.9    0.0000   0.0000          ?        ?    -5.7467  19.7942          ?        ?       33.9       14.9       ?       ? 
1 1 1   30    9   56 o    118.8    7.8    0.0000   0.0000          ?        ?   141.7518  18.5171          ?        ?      118.8        7.8       ?       ? 
1 1 1   30    9   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30    9   58 o    240.1    4.4    0.0000   0.0000          ?        ?   577.2236  21.0712          ?        ?      240.1        4.4       ?       ? 
1 1 1   30    9   59 f    120.6    8.5    0.0000   0.0000          ?        ?   146.2215  20.4327          ?        ?      120.6        8.5       ?       ? 
1 1 1   30    9   60 o    396.5    3.2    0.0000   0.0000          ?        ?  1573.3173  25.5409          ?        ?      396.5        3.2       ?       ? 
1 1 1   30    9   61 o     44.7   16.8    0.0000   0.0000          ?        ?    15.3245  20.4327          ?        ?       44.7       16.8       ?       ? 
1 1 1   30    9   62 o     97.0   10.9    0.0000   0.0000          ?        ?    95.1397  21.0712          ?        ?       97.0       10.9       ?       ? 
1 1 1   30    9   63 o    147.6    7.1    0.0000   0.0000          ?        ?   219.0129  21.0712          ?        ?      147.6        7.1       ?       ? 
1 1 1   30    9   64 o    164.9    6.4    0.0000   0.0000          ?        ?   273.2873  21.0712          ?        ?      164.9        6.4       ?       ? 
1 1 1   30    9   65 o     38.5   16.3    0.0000   0.0000          ?        ?     1.9156  21.7097          ?        ?       38.5       16.3       ?       ? 
1 1 1   30    9   66 o     42.5   16.6    0.0000   0.0000          ?        ?    12.1319  20.4327          ?        ?       42.5       16.6       ?       ? 
1 1 1   30    9   67 o     22.2   11.1    0.0000   0.0000          ?        ?   -58.7440  21.0712          ?        ?       22.2       11.1       ?       ? 
1 1 1   30    9   68 o     74.7   14.2    0.0000   0.0000          ?        ?    59.3825  20.4327          ?        ?       74.7       14.2       ?       ? 
1 1 1   30    9   69 o    178.0    5.6    0.0000   0.0000          ?        ?   318.6223  19.7942          ?        ?      178.0        5.6       ?       ? 
1 1 1   30    9   70 o    113.5    8.7    0.0000   0.0000          ?        ?   130.8969  19.7942          ?        ?      113.5        8.7       ?       ? 
1 1 1   30   10    0 o   1840.7    9.0 33891.4492 330.1157 33891.4492 330.1157 33891.4492 330.1157     1840.7      9.0     1840.7        9.0     0.0     0.0 
1 1 1   30   10    1 o    723.3    3.1    0.0000   0.0000          ?        ?  5232.0464  45.3350          ?        ?      723.3        3.1       ?       ? 
1 1 1   30   10    2 o   1004.1    3.8    0.0000   0.0000          ?        ? 10082.8945  76.6226          ?        ?     1004.1        3.8       ?       ? 
1 1 1   30   10    3 f    588.7    2.6    0.0000   0.0000          ?        ?  3465.2568  30.6490          ?        ?      588.7        2.6       ?       ? 
1 1 1   30   10    4 o   1078.6    4.1    0.0000   0.0000          ?        ? 11634.5020  87.4775          ?        ?     1078.6        4.1       ?       ? 
1 1 1   30   10    5 o    812.4    3.4    0.0000   0.0000          ?        ?  6601.0371  54.9129          ?        ?      812.4        3.4       ?       ? 
1 1 1   30   10    6 o   1266.4    5.1    0.0000   0.0000          ?        ? 16040.3027 128.9814          ?        ?     1266.4        5.1       ?       ? 
1 1 1   30   10    7 o    586.5    2.7    0.0000   0.0000          ?        ?  3439.7161  31.9261          ?        ?      586.5        2.7       ?       ? 
1 1 1   30   10    8 o    148.2    4.3    0.0000   0.0000          ?        ?   219.6514  12.7704          ?        ?      148.2        4.3       ?       ? 
1 1 1   30   10    9 o    273.3    2.9    0.0000   0.0000          ?        ?   747.0703  15.9630          ?        ?      273.3        2.9       ?       ? 
1 1 1   30   10   10 o    205.1    3.3    0.0000   0.0000          ?        ?   420.7858  13.4090          ?        ?      205.1        3.3       ?       ? 
1 1 1   30   10   11 o   1020.3    3.8    0.0000   0.0000          ?        ? 10411.7334  77.8996          ?        ?     1020.3        3.8       ?       ? 
1 1 1   30   10   12 o    195.2    2.9    0.0000   0.0000          ?        ?   381.1974  11.4934          ?        ?      195.2        2.9       ?       ? 
1 1 1   30   10   13 o    663.6    2.8    0.0000   0.0000          ?        ?  4403.8838  37.6728          ?        ?      663.6        2.8       ?       ? 
1 1 1   30   10   14 o    261.9    2.4    0.0000   0.0000          ?        ?   685.7722  12.7704          ?        ?      261.9        2.4       ?       ? 
1 1 1   30   10   15 o    382.5    2.4    0.0000   0.0000          ?        ?  1463.4916  18.5171          ?        ?      382.5        2.4       ?       ? 
1 1 1   30   10   16 o    914.3    3.6    0.0000   0.0000          ?        ?  8360.1641  65.1292          ?        ?      914.3        3.6       ?       ? 
1 1 1   30   10   17 o    448.5    2.4    0.0000   0.0000          ?        ?  2011.3431  21.7097          ?        ?      448.5        2.4       ?       ? 
1 1 1   30   10   18 o    656.1    2.9    0.0000   0.0000          ?        ?  4304.9131  38.3113          ?        ?      656.1        2.9       ?       ? 
1 1 1   30   10   19 o    491.2    2.6    0.0000   0.0000          ?        ?  2412.9731  25.5409          ?        ?      491.2        2.6       ?       ? 
1 1 1   30   10   20 o    601.0    2.9    0.0000   0.0000          ?        ?  3612.1169  34.4802          ?        ?      601.0        2.9       ?       ? 
1 1 1   30   10   21 f    167.6    4.6    0.0000   0.0000          ?        ?   280.9495  15.3245          ?        ?      167.6        4.6       ?       ? 
1 1 1   30   10   22 o    521.2    2.8    0.0000   0.0000          ?        ?  2716.2710  29.3720          ?        ?      521.2        2.8       ?       ? 
1 1 1   30   10   23 o    339.4    2.6    0.0000   0.0000          ?        ?  1151.8929  17.8786          ?        ?      339.4        2.6       ?       ? 
1 1 1   30   10   24 o    389.7    2.6    0.0000   0.0000          ?        ?  1518.4044  20.4327          ?        ?      389.7        2.6       ?       ? 
1 1 1   30   10   25 o    554.5    2.8    0.0000   0.0000          ?        ?  3074.4817  31.2876          ?        ?      554.5        2.8       ?       ? 
1 1 1   30   10   26 o    375.0    2.6    0.0000   0.0000          ?        ?  1406.0247  19.1556          ?        ?      375.0        2.6       ?       ? 
1 1 1   30   10   27 o   1074.7    4.0    0.0000   0.0000          ?        ? 11551.4941  86.2004          ?        ?     1074.7        4.0       ?       ? 
1 1 1   30   10   28 o    200.2    3.8    0.0000   0.0000          ?        ?   400.9916  15.3245          ?        ?      200.2        3.8       ?       ? 
1 1 1   30   10   29 o    834.5    3.4    0.0000   0.0000          ?        ?  6965.6328  57.4669          ?        ?      834.5        3.4       ?       ? 
1 1 1   30   10   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   10   31 o    597.1    2.7    0.0000   0.0000          ?        ?  3565.5049  31.9261          ?        ?      597.1        2.7       ?       ? 
1 1 1   30   10   32 o     36.0   14.1    0.0000   0.0000          ?        ?     7.6623  14.6860          ?        ?       36.0       14.1       ?       ? 
1 1 1   30   10   33 o    408.0    2.6    0.0000   0.0000          ?        ?  1664.6260  21.0712          ?        ?      408.0        2.6       ?       ? 
1 1 1   30   10   34 o    410.9    2.6    0.0000   0.0000          ?        ?  1688.8896  21.7097          ?        ?      410.9        2.6       ?       ? 
1 1 1   30   10   35 o    385.0    2.7    0.0000   0.0000          ?        ?  1482.6472  20.4327          ?        ?      385.0        2.7       ?       ? 
1 1 1   30   10   36 o    348.7    2.8    0.0000   0.0000          ?        ?  1216.3837  19.7942          ?        ?      348.7        2.8       ?       ? 
1 1 1   30   10   37 o    406.6    2.5    0.0000   0.0000          ?        ?  1653.7710  20.4327          ?        ?      406.6        2.5       ?       ? 
1 1 1   30   10   38 o    567.5    2.7    0.0000   0.0000          ?        ?  3221.3416  30.6490          ?        ?      567.5        2.7       ?       ? 
1 1 1   30   10   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   10   40 o    229.7    3.8    0.0000   0.0000          ?        ?   528.0574  17.2401          ?        ?      229.7        3.8       ?       ? 
1 1 1   30   10   41 o    208.5    4.0    0.0000   0.0000          ?        ?   434.8332  16.6016          ?        ?      208.5        4.0       ?       ? 
1 1 1   30   10   42 o    505.1    2.6    0.0000   0.0000          ?        ?  2551.5325  26.1794          ?        ?      505.1        2.6       ?       ? 
1 1 1   30   10   43 o    366.5    2.9    0.0000   0.0000          ?        ?  1343.4495  21.0712          ?        ?      366.5        2.9       ?       ? 
1 1 1   30   10   44 o    461.8    2.6    0.0000   0.0000          ?        ?  2133.3008  24.2638          ?        ?      461.8        2.6       ?       ? 
1 1 1   30   10   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   10   46 o    164.1    5.3    0.0000   0.0000          ?        ?   269.4561  17.2401          ?        ?      164.1        5.3       ?       ? 
1 1 1   30   10   47 o    253.1    3.5    0.0000   0.0000          ?        ?   641.0757  17.8786          ?        ?      253.1        3.5       ?       ? 
1 1 1   30   10   48 o    386.6    3.0    0.0000   0.0000          ?        ?  1495.4176  22.9868          ?        ?      386.6        3.0       ?       ? 
1 1 1   30   10   49 o    265.4    3.6    0.0000   0.0000          ?        ?   704.9279  19.1556          ?        ?      265.4        3.6       ?       ? 
1 1 1   30   10   50 o    325.6    3.1    0.0000   0.0000          ?        ?  1060.5845  20.4327          ?        ?      325.6        3.1       ?       ? 
1 1 1   30   10   51 o     24.0   11.6    0.0000   0.0000          ?        ?   -28.7335  17.2401          ?        ?       24.0       11.6       ?       ? 
1 1 1   30   10   52 o    248.6    4.0    0.0000   0.0000          ?        ?   618.7275  19.7942          ?        ?      248.6        4.0       ?       ? 
1 1 1   30   10   53 o     48.8   16.2    0.0000   0.0000          ?        ?    22.9868  18.5171          ?        ?       48.8       16.2       ?       ? 
1 1 1   30   10   54 o    427.4    2.8    0.0000   0.0000          ?        ?  1827.4490  24.2638          ?        ?      427.4        2.8       ?       ? 
1 1 1   30   10   55 o    258.7    3.8    0.0000   0.0000          ?        ?   669.8092  19.7942          ?        ?      258.7        3.8       ?       ? 
1 1 1   30   10   56 o     89.7   10.7    0.0000   0.0000          ?        ?    81.0922  19.1556          ?        ?       89.7       10.7       ?       ? 
1 1 1   30   10   57 o    303.8    3.4    0.0000   0.0000          ?        ?   923.9408  20.4327          ?        ?      303.8        3.4       ?       ? 
1 1 1   30   10   58 o    244.2    4.3    0.0000   0.0000          ?        ?   597.0177  21.0712          ?        ?      244.2        4.3       ?       ? 
1 1 1   30   10   59 o     26.5   12.8    0.0000   0.0000          ?        ?   -31.9261  20.4327          ?        ?       26.5       12.8       ?       ? 
1 1 1   30   10   60 o    265.0    4.0    0.0000   0.0000          ?        ?   703.0123  21.0712          ?        ?      265.0        4.0       ?       ? 
1 1 1   30   10   61 o    212.7    5.0    0.0000   0.0000          ?        ?   453.3503  21.0712          ?        ?      212.7        5.0       ?       ? 
1 1 1   30   10   62 o    174.2    5.9    0.0000   0.0000          ?        ?   304.5748  20.4327          ?        ?      174.2        5.9       ?       ? 
1 1 1   30   10   63 o     44.5   16.6    0.0000   0.0000          ?        ?    15.9630  19.7942          ?        ?       44.5       16.6       ?       ? 
1 1 1   30   10   64 o    244.2    4.3    0.0000   0.0000          ?        ?   597.6562  21.0712          ?        ?      244.2        4.3       ?       ? 
1 1 1   30   10   65 o    128.1    8.0    0.0000   0.0000          ?        ?   165.3771  20.4327          ?        ?      128.1        8.0       ?       ? 
1 1 1   30   10   66 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   10   67 o    173.0    5.7    0.0000   0.0000          ?        ?   300.7437  19.7942          ?        ?      173.0        5.7       ?       ? 
1 1 1   30   10   68 o     24.8   12.1    0.0000   0.0000          ?        ?   -35.7572  19.7942          ?        ?       24.8       12.1       ?       ? 
1 1 1   30   10   69 o     97.3    9.5    0.0000   0.0000          ?        ?    96.4168  18.5171          ?        ?       97.3        9.5       ?       ? 
1 1 1   30   11    0 f    558.8    3.7 3123.0093  41.5039  3123.0093  41.5039  3123.0093  41.5039      558.8      3.7      558.8        3.7     0.0     0.0 
1 1 1   30   11    1 o    391.5    2.4    0.0000   0.0000          ?        ?  1532.4519  18.5171          ?        ?      391.5        2.4       ?       ? 
1 1 1   30   11    2 o   1104.7    4.1    0.0000   0.0000          ?        ? 12205.3408  90.0316          ?        ?     1104.7        4.1       ?       ? 
1 1 1   30   11    3 o    705.6    2.9    0.0000   0.0000          ?        ?  4978.5532  40.2269          ?        ?      705.6        2.9       ?       ? 
1 1 1   30   11    4 o   1007.7    3.8    0.0000   0.0000          ?        ? 10155.0479  76.6226          ?        ?     1007.7        3.8       ?       ? 
1 1 1   30   11    5 o    941.5    3.6    0.0000   0.0000          ?        ?  8863.9570  68.3218          ?        ?      941.5        3.6       ?       ? 
1 1 1   30   11    6 o    835.1    3.3    0.0000   0.0000          ?        ?  6973.9331  55.5514          ?        ?      835.1        3.3       ?       ? 
1 1 1   30   11    7 o    849.6    3.3    0.0000   0.0000          ?        ?  7219.1255  56.1899          ?        ?      849.6        3.3       ?       ? 
1 1 1   30   11    8 o    934.7    3.6    0.0000   0.0000          ?        ?  8736.8916  67.0448          ?        ?      934.7        3.6       ?       ? 
1 1 1   30   11    9 o    990.8    3.8    0.0000   0.0000          ?        ?  9818.5469  75.3456          ?        ?      990.8        3.8       ?       ? 
1 1 1   30   11   10 o    869.6    3.6    0.0000   0.0000          ?        ?  7562.6504  61.9366          ?        ?      869.6        3.6       ?       ? 
1 1 1   30   11   11 o   1075.7    4.1    0.0000   0.0000          ?        ? 11572.5664  87.4775          ?        ?     1075.7        4.1       ?       ? 
1 1 1   30   11   12 o   1006.8    3.8    0.0000   0.0000          ?        ? 10137.1689  76.6226          ?        ?     1006.8        3.8       ?       ? 
1 1 1   30   11   13 o    855.8    3.5    0.0000   0.0000          ?        ?  7324.4814  59.3825          ?        ?      855.8        3.5       ?       ? 
1 1 1   30   11   14 o    217.2    2.8    0.0000   0.0000          ?        ?   471.8675  12.1319          ?        ?      217.2        2.8       ?       ? 
1 1 1   30   11   15 o    444.8    2.4    0.0000   0.0000          ?        ?  1978.1399  21.7097          ?        ?      444.8        2.4       ?       ? 
1 1 1   30   11   16 o    858.8    3.5    0.0000   0.0000          ?        ?  7375.5630  60.6596          ?        ?      858.8        3.5       ?       ? 
1 1 1   30   11   17 o    541.7    2.7    0.0000   0.0000          ?        ?  2934.6455  28.7335          ?        ?      541.7        2.7       ?       ? 
1 1 1   30   11   18 o    530.9    2.6    0.0000   0.0000          ?        ?  2819.0730  28.0950          ?        ?      530.9        2.6       ?       ? 
1 1 1   30   11   19 o    837.7    3.4    0.0000   0.0000          ?        ?  7017.9912  57.4669          ?        ?      837.7        3.4       ?       ? 
1 1 1   30   11   20 o    351.9    2.5    0.0000   0.0000          ?        ?  1238.0934  17.8786          ?        ?      351.9        2.5       ?       ? 
1 1 1   30   11   21 o    831.1    3.3    0.0000   0.0000          ?        ?  6908.1655  54.9129          ?        ?      831.1        3.3       ?       ? 
1 1 1   30   11   22 o    954.3    3.6    0.0000   0.0000          ?        ?  9107.2344  69.5989          ?        ?      954.3        3.6       ?       ? 
1 1 1   30   11   23 o    288.3    2.9    0.0000   0.0000          ?        ?   831.3552  16.6016          ?        ?      288.3        2.9       ?       ? 
1 1 1   30   11   24 o    196.2    3.6    0.0000   0.0000          ?        ?   385.0285  14.0475          ?        ?      196.2        3.6       ?       ? 
1 1 1   30   11   25 o    727.9    3.2    0.0000   0.0000          ?        ?  5298.4521  45.9736          ?        ?      727.9        3.2       ?       ? 
1 1 1   30   11   26 o     32.9   13.6    0.0000   0.0000          ?        ?     2.5541  14.6860          ?        ?       32.9       13.6       ?       ? 
1 1 1   30   11   27 o    377.8    2.5    0.0000   0.0000          ?        ?  1427.7344  19.1556          ?        ?      377.8        2.5       ?       ? 
1 1 1   30   11   28 o    392.3    2.7    0.0000   0.0000          ?        ?  1539.4757  21.0712          ?        ?      392.3        2.7       ?       ? 
1 1 1   30   11   29 o    143.4    5.3    0.0000   0.0000          ?        ?   205.6040  15.3245          ?        ?      143.4        5.3       ?       ? 
1 1 1   30   11   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   11   31 o    332.2    2.7    0.0000   0.0000          ?        ?  1104.0039  17.8786          ?        ?      332.2        2.7       ?       ? 
1 1 1   30   11   32 o    334.3    2.9    0.0000   0.0000          ?        ?  1117.4128  19.1556          ?        ?      334.3        2.9       ?       ? 
1 1 1   30   11   33 o    508.6    2.8    0.0000   0.0000          ?        ?  2587.2898  28.0950          ?        ?      508.6        2.8       ?       ? 
1 1 1   30   11   34 o    680.1    2.9    0.0000   0.0000          ?        ?  4626.7275  39.5883          ?        ?      680.1        2.9       ?       ? 
1 1 1   30   11   35 f    122.4    6.5    0.0000   0.0000          ?        ?   150.0526  15.9630          ?        ?      122.4        6.5       ?       ? 
1 1 1   30   11   36 o    232.4    3.6    0.0000   0.0000          ?        ?   540.1893  16.6016          ?        ?      232.4        3.6       ?       ? 
1 1 1   30   11   37 o    319.8    2.8    0.0000   0.0000          ?        ?  1022.9116  17.8786          ?        ?      319.8        2.8       ?       ? 
1 1 1   30   11   38 o    265.7    3.4    0.0000   0.0000          ?        ?   706.2049  17.8786          ?        ?      265.7        3.4       ?       ? 
1 1 1   30   11   39 o    205.1    4.2    0.0000   0.0000          ?        ?   420.7858  17.2401          ?        ?      205.1        4.2       ?       ? 
1 1 1   30   11   40 o    268.6    3.3    0.0000   0.0000          ?        ?   721.5294  17.8786          ?        ?      268.6        3.3       ?       ? 
1 1 1   30   11   41 o    335.4    3.0    0.0000   0.0000          ?        ?  1125.0751  19.7942          ?        ?      335.4        3.0       ?       ? 
1 1 1   30   11   42 o    115.1    7.2    0.0000   0.0000          ?        ?   132.8125  16.6016          ?        ?      115.1        7.2       ?       ? 
1 1 1   30   11   43 o    373.6    2.8    0.0000   0.0000          ?        ?  1396.4468  21.0712          ?        ?      373.6        2.8       ?       ? 
1 1 1   30   11   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   11   45 o    309.8    3.0    0.0000   0.0000          ?        ?   960.3365  18.5171          ?        ?      309.8        3.0       ?       ? 
1 1 1   30   11   46 o     55.3   14.7    0.0000   0.0000          ?        ?    31.9261  16.6016          ?        ?       55.3       14.7       ?       ? 
1 1 1   30   11   47 o     71.4   13.0    0.0000   0.0000          ?        ?    52.9973  17.8786          ?        ?       71.4       13.0       ?       ? 
1 1 1   30   11   48 o    121.3    7.1    0.0000   0.0000          ?        ?   147.4985  17.2401          ?        ?      121.3        7.1       ?       ? 
1 1 1   30   11   49 o     49.8   15.6    0.0000   0.0000          ?        ?    24.9023  17.2401          ?        ?       49.8       15.6       ?       ? 
1 1 1   30   11   50 o    219.9    4.1    0.0000   0.0000          ?        ?   483.9994  17.8786          ?        ?      219.9        4.1       ?       ? 
1 1 1   30   11   51 o    205.6    4.7    0.0000   0.0000          ?        ?   423.3398  19.1556          ?        ?      205.6        4.7       ?       ? 
1 1 1   30   11   52 o    200.0    4.6    0.0000   0.0000          ?        ?   400.3531  18.5171          ?        ?      200.0        4.6       ?       ? 
1 1 1   30   11   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   11   54 o     42.4   16.0    0.0000   0.0000          ?        ?    13.4090  18.5171          ?        ?       42.4       16.0       ?       ? 
1 1 1   30   11   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   11   56 o     21.4   10.7    0.0000   0.0000          ?        ?   -48.5276  18.5171          ?        ?       21.4       10.7       ?       ? 
1 1 1   30   11   57 o     25.9   12.6    0.0000   0.0000          ?        ?   -34.4802  20.4327          ?        ?       25.9       12.6       ?       ? 
1 1 1   30   11   58 o    117.6    8.4    0.0000   0.0000          ?        ?   139.1977  19.7942          ?        ?      117.6        8.4       ?       ? 
1 1 1   30   11   59 o     26.1   12.5    0.0000   0.0000          ?        ?   -28.0950  19.1556          ?        ?       26.1       12.5       ?       ? 
1 1 1   30   11   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   11   61 o    145.3    6.8    0.0000   0.0000          ?        ?   211.9892  19.7942          ?        ?      145.3        6.8       ?       ? 
1 1 1   30   11   62 o    188.1    5.3    0.0000   0.0000          ?        ?   355.0180  19.7942          ?        ?      188.1        5.3       ?       ? 
1 1 1   30   11   63 o    355.0    3.3    0.0000   0.0000          ?        ?  1261.7188  23.6253          ?        ?      355.0        3.3       ?       ? 
1 1 1   30   11   64 o     23.4   11.5    0.0000   0.0000          ?        ?   -40.2269  19.1556          ?        ?       23.4       11.5       ?       ? 
1 1 1   30   11   65 o    204.3    5.0    0.0000   0.0000          ?        ?   418.8702  20.4327          ?        ?      204.3        5.0       ?       ? 
1 1 1   30   11   66 o     54.2   17.0    0.0000   0.0000          ?        ?    30.6490  20.4327          ?        ?       54.2       17.0       ?       ? 
1 1 1   30   11   67 o    188.3    5.4    0.0000   0.0000          ?        ?   356.2951  20.4327          ?        ?      188.3        5.4       ?       ? 
1 1 1   30   11   68 o    121.5    8.1    0.0000   0.0000          ?        ?   149.4141  19.7942          ?        ?      121.5        8.1       ?       ? 
1 1 1   30   11   69 o     33.9   14.7    0.0000   0.0000          ?        ?    -1.2770  18.5171          ?        ?       33.9       14.7       ?       ? 
1 1 1   30   12    0 o     42.4   15.0   23.6253  11.4934    23.6253  11.4934    23.6253  11.4934       42.4     15.0       42.4       15.0     0.0     0.0 
1 1 1   30   12    1 o   1349.7    5.2    0.0000   0.0000          ?        ? 18219.5762 140.4748          ?        ?     1349.7        5.2       ?       ? 
1 1 1   30   12    2 o    423.9    3.2    0.0000   0.0000          ?        ?  1797.4384  27.4564          ?        ?      423.9        3.2       ?       ? 
1 1 1   30   12    3 o   1452.1    5.3    0.0000   0.0000          ?        ? 21090.3691 152.6067          ?        ?     1452.1        5.3       ?       ? 
1 1 1   30   12    4 o    732.9    3.4    0.0000   0.0000          ?        ?  5371.8823  49.8047          ?        ?      732.9        3.4       ?       ? 
1 1 1   30   12    5 o   1220.1    4.4    0.0000   0.0000          ?        ? 14887.1318 107.9102          ?        ?     1220.1        4.4       ?       ? 
1 1 1   30   12    6 o    964.0    3.8    0.0000   0.0000          ?        ?  9293.0439  72.7915          ?        ?      964.0        3.8       ?       ? 
1 1 1   30   12    7 o    870.5    3.6    0.0000   0.0000          ?        ?  7577.9751  61.9366          ?        ?      870.5        3.6       ?       ? 
1 1 1   30   12    8 o   1429.1    5.0    0.0000   0.0000          ?        ? 20426.3066 144.3059          ?        ?     1429.1        5.0       ?       ? 
1 1 1   30   12    9 o    963.1    3.8    0.0000   0.0000          ?        ?  9275.8037  73.4300          ?        ?      963.1        3.8       ?       ? 
1 1 1   30   12   10 o    891.0    3.4    0.0000   0.0000          ?        ?  7938.7397  60.0210          ?        ?      891.0        3.4       ?       ? 
1 1 1   30   12   11 o    744.0    3.2    0.0000   0.0000          ?        ?  5535.9824  47.2506          ?        ?      744.0        3.2       ?       ? 
1 1 1   30   12   12 o   1513.0    5.3    0.0000   0.0000          ?        ? 22896.7461 159.6304          ?        ?     1513.0        5.3       ?       ? 
1 1 1   30   12   13 o    480.7    2.5    0.0000   0.0000          ?        ?  2310.8098  24.2638          ?        ?      480.7        2.5       ?       ? 
1 1 1   30   12   14 o    950.5    3.6    0.0000   0.0000          ?        ?  9034.4424  67.6833          ?        ?      950.5        3.6       ?       ? 
1 1 1   30   12   15 o    465.2    2.3    0.0000   0.0000          ?        ?  2164.5884  21.7097          ?        ?      465.2        2.3       ?       ? 
1 1 1   30   12   16 o    861.8    3.3    0.0000   0.0000          ?        ?  7427.9224  56.8284          ?        ?      861.8        3.3       ?       ? 
1 1 1   30   12   17 o    422.4    2.4    0.0000   0.0000          ?        ?  1784.0294  20.4327          ?        ?      422.4        2.4       ?       ? 
1 1 1   30   12   18 o    557.7    2.7    0.0000   0.0000          ?        ?  3110.8774  30.0105          ?        ?      557.7        2.7       ?       ? 
1 1 1   30   12   19 o   1207.0    4.5    0.0000   0.0000          ?        ? 14570.4248 108.5487          ?        ?     1207.0        4.5       ?       ? 
1 1 1   30   12   20 o    419.9    2.4    0.0000   0.0000          ?        ?  1762.9583  19.7942          ?        ?      419.9        2.4       ?       ? 
1 1 1   30   12   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   12   22 o    539.3    2.7    0.0000   0.0000          ?        ?  2909.1045  28.7335          ?        ?      539.3        2.7       ?       ? 
1 1 1   30   12   23 o    419.3    2.4    0.0000   0.0000          ?        ?  1758.4885  20.4327          ?        ?      419.3        2.4       ?       ? 
1 1 1   30   12   24 o    213.1    3.3    0.0000   0.0000          ?        ?   453.9889  14.0475          ?        ?      213.1        3.3       ?       ? 
1 1 1   30   12   25 o    502.8    2.5    0.0000   0.0000          ?        ?  2528.5457  24.9023          ?        ?      502.8        2.5       ?       ? 
1 1 1   30   12   26 o    179.6    3.9    0.0000   0.0000          ?        ?   322.4534  14.0475          ?        ?      179.6        3.9       ?       ? 
1 1 1   30   12   27 o    657.7    2.9    0.0000   0.0000          ?        ?  4325.9839  37.6728          ?        ?      657.7        2.9       ?       ? 
1 1 1   30   12   28 o    113.8    6.2    0.0000   0.0000          ?        ?   129.6199  14.0475          ?        ?      113.8        6.2       ?       ? 
1 1 1   30   12   29 o     20.6   10.1    0.0000   0.0000          ?        ?   -28.0950  14.0475          ?        ?       20.6       10.1       ?       ? 
1 1 1   30   12   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   12   31 o    305.5    2.8    0.0000   0.0000          ?        ?   933.5186  17.2401          ?        ?      305.5        2.8       ?       ? 
1 1 1   30   12   32 o    368.4    2.6    0.0000   0.0000          ?        ?  1357.4971  19.1556          ?        ?      368.4        2.6       ?       ? 
1 1 1   30   12   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   12   34 o    198.1    3.9    0.0000   0.0000          ?        ?   392.6908  15.3245          ?        ?      198.1        3.9       ?       ? 
1 1 1   30   12   35 o    447.9    2.5    0.0000   0.0000          ?        ?  2006.2350  22.3483          ?        ?      447.9        2.5       ?       ? 
1 1 1   30   12   36 o    228.4    3.6    0.0000   0.0000          ?        ?   521.6721  16.6016          ?        ?      228.4        3.6       ?       ? 
1 1 1   30   12   37 o    222.7    3.7    0.0000   0.0000          ?        ?   496.1313  16.6016          ?        ?      222.7        3.7       ?       ? 
1 1 1   30   12   38 f    390.0    2.6    0.0000   0.0000          ?        ?  1521.5970  20.4327          ?        ?      390.0        2.6       ?       ? 
1 1 1   30   12   39 o    530.9    2.6    0.0000   0.0000          ?        ?  2819.0730  28.0950          ?        ?      530.9        2.6       ?       ? 
1 1 1   30   12   40 o    445.8    2.7    0.0000   0.0000          ?        ?  1987.7178  24.2638          ?        ?      445.8        2.7       ?       ? 
1 1 1   30   12   41 f    541.9    2.8    0.0000   0.0000          ?        ?  2937.8381  30.6490          ?        ?      541.9        2.8       ?       ? 
1 1 1   30   12   42 o    388.3    2.8    0.0000   0.0000          ?        ?  1508.1881  21.7097          ?        ?      388.3        2.8       ?       ? 
1 1 1   30   12   43 o    474.4    2.7    0.0000   0.0000          ?        ?  2250.7888  25.5409          ?        ?      474.4        2.7       ?       ? 
1 1 1   30   12   44 o     29.6   13.4    0.0000   0.0000          ?        ?   -10.2163  17.2401          ?        ?       29.6       13.4       ?       ? 
1 1 1   30   12   45 o    196.5    4.4    0.0000   0.0000          ?        ?   386.3056  17.2401          ?        ?      196.5        4.4       ?       ? 
1 1 1   30   12   46 o     25.8   12.3    0.0000   0.0000          ?        ?   -21.7097  17.2401          ?        ?       25.8       12.3       ?       ? 
1 1 1   30   12   47 o    115.4    7.5    0.0000   0.0000          ?        ?   133.4510  17.2401          ?        ?      115.4        7.5       ?       ? 
1 1 1   30   12   48 o    521.8    2.8    0.0000   0.0000          ?        ?  2723.9333  28.7335          ?        ?      521.8        2.8       ?       ? 
1 1 1   30   12   49 o    121.8    7.6    0.0000   0.0000          ?        ?   148.7755  18.5171          ?        ?      121.8        7.6       ?       ? 
1 1 1   30   12   50 o    138.7    6.4    0.0000   0.0000          ?        ?   192.8335  17.8786          ?        ?      138.7        6.4       ?       ? 
1 1 1   30   12   51 o     63.3   14.4    0.0000   0.0000          ?        ?    42.1424  17.8786          ?        ?       63.3       14.4       ?       ? 
1 1 1   30   12   52 o    172.2    5.2    0.0000   0.0000          ?        ?   296.9126  17.8786          ?        ?      172.2        5.2       ?       ? 
1 1 1   30   12   53 o    216.7    4.4    0.0000   0.0000          ?        ?   469.9519  19.1556          ?        ?      216.7        4.4       ?       ? 
1 1 1   30   12   54 o    598.6    2.9    0.0000   0.0000          ?        ?  3585.2988  34.4802          ?        ?      598.6        2.9       ?       ? 
1 1 1   30   12   55 o     97.9    9.5    0.0000   0.0000          ?        ?    96.4168  18.5171          ?        ?       97.9        9.5       ?       ? 
1 1 1   30   12   56 o    110.7    8.7    0.0000   0.0000          ?        ?   123.2347  19.1556          ?        ?      110.7        8.7       ?       ? 
1 1 1   30   12   57 o    217.4    4.4    0.0000   0.0000          ?        ?   473.1445  19.1556          ?        ?      217.4        4.4       ?       ? 
1 1 1   30   12   58 o    374.1    3.0    0.0000   0.0000          ?        ?  1400.9164  22.3483          ?        ?      374.1        3.0       ?       ? 
1 1 1   30   12   59 o    152.4    6.3    0.0000   0.0000          ?        ?   233.0604  19.1556          ?        ?      152.4        6.3       ?       ? 
1 1 1   30   12   60 o    119.2    8.0    0.0000   0.0000          ?        ?   143.0288  19.1556          ?        ?      119.2        8.0       ?       ? 
1 1 1   30   12   61 o    183.7    5.6    0.0000   0.0000          ?        ?   338.4165  20.4327          ?        ?      183.7        5.6       ?       ? 
1 1 1   30   12   62 o     22.6   11.2    0.0000   0.0000          ?        ?   -48.5276  19.7942          ?        ?       22.6       11.2       ?       ? 
1 1 1   30   12   63 o     79.5   12.4    0.0000   0.0000          ?        ?    64.4907  19.7942          ?        ?       79.5       12.4       ?       ? 
1 1 1   30   12   64 o     93.2   10.3    0.0000   0.0000          ?        ?    88.1160  19.1556          ?        ?       93.2       10.3       ?       ? 
1 1 1   30   12   65 o    180.4    5.5    0.0000   0.0000          ?        ?   326.9231  19.7942          ?        ?      180.4        5.5       ?       ? 
1 1 1   30   12   66 o    195.5    5.1    0.0000   0.0000          ?        ?   383.7515  19.7942          ?        ?      195.5        5.1       ?       ? 
1 1 1   30   12   67 o     65.6   15.3    0.0000   0.0000          ?        ?    46.6121  19.7942          ?        ?       65.6       15.3       ?       ? 
1 1 1   30   12   68 o     27.9   13.2    0.0000   0.0000          ?        ?   -22.3483  19.7942          ?        ?       27.9       13.2       ?       ? 
1 1 1   30   13    0 o    841.0    5.4 7074.1812  91.3086  7074.1812  91.3086  7074.1812  91.3086      841.0      5.4      841.0        5.4     0.0     0.0 
1 1 1   30   13    1 o   1050.0    4.4    0.0000   0.0000          ?        ? 11025.3525  92.5856          ?        ?     1050.0        4.4       ?       ? 
1 1 1   30   13    2 o    613.9    3.0    0.0000   0.0000          ?        ?  3768.5547  36.3957          ?        ?      613.9        3.0       ?       ? 
1 1 1   30   13    3 o    250.1    3.1    0.0000   0.0000          ?        ?   625.7512  15.3245          ?        ?      250.1        3.1       ?       ? 
1 1 1   30   13    4 o    164.1    3.5    0.0000   0.0000          ?        ?   269.4561  11.4934          ?        ?      164.1        3.5       ?       ? 
1 1 1   30   13    5 o    686.7    3.2    0.0000   0.0000          ?        ?  4715.4824  43.4195          ?        ?      686.7        3.2       ?       ? 
1 1 1   30   13    6 o   1183.0    4.5    0.0000   0.0000          ?        ? 13996.3945 105.3561          ?        ?     1183.0        4.5       ?       ? 
1 1 1   30   13    7 o    960.4    3.7    0.0000   0.0000          ?        ?  9224.0830  70.2374          ?        ?      960.4        3.7       ?       ? 
1 1 1   30   13    8 o    503.8    2.5    0.0000   0.0000          ?        ?  2538.1235  25.5409          ?        ?      503.8        2.5       ?       ? 
1 1 1   30   13    9 f    465.1    2.4    0.0000   0.0000          ?        ?  2163.3113  22.3483          ?        ?      465.1        2.4       ?       ? 
1 1 1   30   13   10 o    356.3    2.3    0.0000   0.0000          ?        ?  1269.3810  16.6016          ?        ?      356.3        2.3       ?       ? 
1 1 1   30   13   11 f    275.4    2.8    0.0000   0.0000          ?        ?   758.5637  15.3245          ?        ?      275.4        2.8       ?       ? 
1 1 1   30   13   12 o   1500.6    5.5    0.0000   0.0000          ?        ? 22522.5742 166.0156          ?        ?     1500.6        5.5       ?       ? 
1 1 1   30   13   13 o    178.3    3.0    0.0000   0.0000          ?        ?   317.9838  10.8549          ?        ?      178.3        3.0       ?       ? 
1 1 1   30   13   14 o    351.3    2.3    0.0000   0.0000          ?        ?  1234.2623  15.9630          ?        ?      351.3        2.3       ?       ? 
1 1 1   30   13   15 o    876.6    3.5    0.0000   0.0000          ?        ?  7685.2461  61.9366          ?        ?      876.6        3.5       ?       ? 
1 1 1   30   13   16 o    434.4    2.4    0.0000   0.0000          ?        ?  1886.8314  21.0712          ?        ?      434.4        2.4       ?       ? 
1 1 1   30   13   17 o    370.7    2.3    0.0000   0.0000          ?        ?  1374.0985  17.2401          ?        ?      370.7        2.3       ?       ? 
1 1 1   30   13   18 o    932.6    3.5    0.0000   0.0000          ?        ?  8697.9414  64.4907          ?        ?      932.6        3.5       ?       ? 
1 1 1   30   13   19 o    469.9    2.4    0.0000   0.0000          ?        ?  2208.6462  22.9868          ?        ?      469.9        2.4       ?       ? 
1 1 1   30   13   20 o    677.8    2.8    0.0000   0.0000          ?        ?  4594.1631  38.3113          ?        ?      677.8        2.8       ?       ? 
1 1 1   30   13   21 o    462.4    2.5    0.0000   0.0000          ?        ?  2138.4089  22.9868          ?        ?      462.4        2.5       ?       ? 
1 1 1   30   13   22 o    400.7    2.5    0.0000   0.0000          ?        ?  1605.8818  19.7942          ?        ?      400.7        2.5       ?       ? 
1 1 1   30   13   23 o    844.7    3.3    0.0000   0.0000          ?        ?  7136.1177  54.9129          ?        ?      844.7        3.3       ?       ? 
1 1 1   30   13   24 o    334.7    2.5    0.0000   0.0000          ?        ?  1120.6055  16.6016          ?        ?      334.7        2.5       ?       ? 
1 1 1   30   13   25 o    173.6    3.7    0.0000   0.0000          ?        ?   301.3822  12.7704          ?        ?      173.6        3.7       ?       ? 
1 1 1   30   13   26 o    608.5    2.7    0.0000   0.0000          ?        ?  3702.7871  33.2031          ?        ?      608.5        2.7       ?       ? 
1 1 1   30   13   27 o    313.4    2.9    0.0000   0.0000          ?        ?   982.0463  17.8786          ?        ?      313.4        2.9       ?       ? 
1 1 1   30   13   28 o    816.3    3.3    0.0000   0.0000          ?        ?  6664.8892  53.6358          ?        ?      816.3        3.3       ?       ? 
1 1 1   30   13   29 o    599.6    2.8    0.0000   0.0000          ?        ?  3596.1538  33.2031          ?        ?      599.6        2.8       ?       ? 
1 1 1   30   13   30 o    477.7    2.5    0.0000   0.0000          ?        ?  2282.0762  24.2638          ?        ?      477.7        2.5       ?       ? 
1 1 1   30   13   31 o    334.3    2.8    0.0000   0.0000          ?        ?  1117.4128  18.5171          ?        ?      334.3        2.8       ?       ? 
1 1 1   30   13   32 o    425.7    2.7    0.0000   0.0000          ?        ?  1812.7628  22.9868          ?        ?      425.7        2.7       ?       ? 
1 1 1   30   13   33 o    325.1    2.7    0.0000   0.0000          ?        ?  1057.3918  17.8786          ?        ?      325.1        2.7       ?       ? 
1 1 1   30   13   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   13   35 o    208.5    3.7    0.0000   0.0000          ?        ?   434.8332  15.3245          ?        ?      208.5        3.7       ?       ? 
1 1 1   30   13   36 o     58.0   13.0    0.0000   0.0000          ?        ?    35.1187  14.6860          ?        ?       58.0       13.0       ?       ? 
1 1 1   30   13   37 o    289.0    3.1    0.0000   0.0000          ?        ?   835.1863  17.8786          ?        ?      289.0        3.1       ?       ? 
1 1 1   30   13   38 o    297.7    2.9    0.0000   0.0000          ?        ?   886.2681  17.2401          ?        ?      297.7        2.9       ?       ? 
1 1 1   30   13   39 o    497.3    2.7    0.0000   0.0000          ?        ?  2473.6328  26.8179          ?        ?      497.3        2.7       ?       ? 
1 1 1   30   13   40 o    362.5    2.7    0.0000   0.0000          ?        ?  1314.7159  19.7942          ?        ?      362.5        2.7       ?       ? 
1 1 1   30   13   41 o    390.6    2.6    0.0000   0.0000          ?        ?  1526.0667  20.4327          ?        ?      390.6        2.6       ?       ? 
1 1 1   30   13   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   13   43 o    150.5    5.3    0.0000   0.0000          ?        ?   226.6752  15.9630          ?        ?      150.5        5.3       ?       ? 
1 1 1   30   13   44 o     93.7    8.5    0.0000   0.0000          ?        ?    88.1160  15.9630          ?        ?       93.7        8.5       ?       ? 
1 1 1   30   13   45 o    192.5    4.3    0.0000   0.0000          ?        ?   370.9810  16.6016          ?        ?      192.5        4.3       ?       ? 
1 1 1   30   13   46 o    637.1    2.9    0.0000   0.0000          ?        ?  4060.3591  36.3957          ?        ?      637.1        2.9       ?       ? 
1 1 1   30   13   47 o    435.0    2.7    0.0000   0.0000          ?        ?  1893.2167  23.6253          ?        ?      435.0        2.7       ?       ? 
1 1 1   30   13   48 o    198.7    4.3    0.0000   0.0000          ?        ?   395.2449  17.2401          ?        ?      198.7        4.3       ?       ? 
1 1 1   30   13   49 o    250.1    3.7    0.0000   0.0000          ?        ?   625.7512  18.5171          ?        ?      250.1        3.7       ?       ? 
1 1 1   30   13   50 o    172.5    5.2    0.0000   0.0000          ?        ?   298.1896  17.8786          ?        ?      172.5        5.2       ?       ? 
1 1 1   30   13   51 o     20.5   10.2    0.0000   0.0000          ?        ?   -46.6121  17.2401          ?        ?       20.5       10.2       ?       ? 
1 1 1   30   13   52 o    470.7    2.6    0.0000   0.0000          ?        ?  2216.3086  24.9023          ?        ?      470.7        2.6       ?       ? 
1 1 1   30   13   53 o    316.6    3.2    0.0000   0.0000          ?        ?  1003.1175  20.4327          ?        ?      316.6        3.2       ?       ? 
1 1 1   30   13   54 o    182.6    5.2    0.0000   0.0000          ?        ?   333.9468  19.1556          ?        ?      182.6        5.2       ?       ? 
1 1 1   30   13   55 o    186.4    5.0    0.0000   0.0000          ?        ?   347.9943  18.5171          ?        ?      186.4        5.0       ?       ? 
1 1 1   30   13   56 o    153.3    5.8    0.0000   0.0000          ?        ?   235.6145  17.8786          ?        ?      153.3        5.8       ?       ? 
1 1 1   30   13   57 o    248.4    4.0    0.0000   0.0000          ?        ?   618.0889  19.7942          ?        ?      248.4        4.0       ?       ? 
1 1 1   30   13   58 o    317.9    3.3    0.0000   0.0000          ?        ?  1011.4182  21.0712          ?        ?      317.9        3.3       ?       ? 
1 1 1   30   13   59 o    121.6    8.1    0.0000   0.0000          ?        ?   148.7755  19.7942          ?        ?      121.6        8.1       ?       ? 
1 1 1   30   13   60 o     47.0   16.7    0.0000   0.0000          ?        ?    19.7942  19.7942          ?        ?       47.0       16.7       ?       ? 
1 1 1   30   13   61 o     55.8   16.6    0.0000   0.0000          ?        ?    32.5646  19.7942          ?        ?       55.8       16.6       ?       ? 
1 1 1   30   13   62 o    138.2    6.9    0.0000   0.0000          ?        ?   192.1950  19.1556          ?        ?      138.2        6.9       ?       ? 
1 1 1   30   13   63 o     94.5   10.5    0.0000   0.0000          ?        ?    90.6701  19.7942          ?        ?       94.5       10.5       ?       ? 
1 1 1   30   13   64 o    279.7    3.9    0.0000   0.0000          ?        ?   784.1046  21.7097          ?        ?      279.7        3.9       ?       ? 
1 1 1   30   13   65 o     70.4   14.6    0.0000   0.0000          ?        ?    52.9973  19.7942          ?        ?       70.4       14.6       ?       ? 
1 1 1   30   13   66 o    114.8    8.6    0.0000   0.0000          ?        ?   133.4510  19.7942          ?        ?      114.8        8.6       ?       ? 
1 1 1   30   13   67 o     59.8   16.2    0.0000   0.0000          ?        ?    38.9498  19.7942          ?        ?       59.8       16.2       ?       ? 
1 1 1   30   14    0 o    575.6    4.3 3313.9272  49.1662  3313.9272  49.1662  3313.9272  49.1662      575.6      4.3      575.6        4.3     0.0     0.0 
1 1 1   30   14    1 o    697.7    3.4    0.0000   0.0000          ?        ?  4868.0889  47.2506          ?        ?      697.7        3.4       ?       ? 
1 1 1   30   14    2 o   1184.4    4.9    0.0000   0.0000          ?        ? 14030.8740 114.9339          ?        ?     1184.4        4.9       ?       ? 
1 1 1   30   14    3 o    679.7    3.3    0.0000   0.0000          ?        ?  4619.7041  44.6965          ?        ?      679.7        3.3       ?       ? 
1 1 1   30   14    4 o    959.6    4.0    0.0000   0.0000          ?        ?  9209.3975  76.6226          ?        ?      959.6        4.0       ?       ? 
1 1 1   30   14    5 o    558.4    2.7    0.0000   0.0000          ?        ?  3118.5396  30.6490          ?        ?      558.4        2.7       ?       ? 
1 1 1   30   14    6 o    950.7    3.8    0.0000   0.0000          ?        ?  9040.1895  71.5144          ?        ?      950.7        3.8       ?       ? 
1 1 1   30   14    7 o     85.7    6.3    0.0000   0.0000          ?        ?    73.4300  10.8549          ?        ?       85.7        6.3       ?       ? 
1 1 1   30   14    8 o    962.9    3.7    0.0000   0.0000          ?        ?  9272.6104  72.1529          ?        ?      962.9        3.7       ?       ? 
1 1 1   30   14    9 o   1580.1    5.6    0.0000   0.0000          ?        ? 24974.4961 176.8705          ?        ?     1580.1        5.6       ?       ? 
1 1 1   30   14   10 o    857.2    3.4    0.0000   0.0000          ?        ?  7348.1074  58.7440          ?        ?      857.2        3.4       ?       ? 
1 1 1   30   14   11 o    549.3    2.6    0.0000   0.0000          ?        ?  3017.0146  28.7335          ?        ?      549.3        2.6       ?       ? 
1 1 1   30   14   12 o    674.0    2.8    0.0000   0.0000          ?        ?  4542.4429  38.3113          ?        ?      674.0        2.8       ?       ? 
1 1 1   30   14   13 o    214.7    2.8    0.0000   0.0000          ?        ?   461.0126  12.1319          ?        ?      214.7        2.8       ?       ? 
1 1 1   30   14   14 o    253.8    2.6    0.0000   0.0000          ?        ?   644.2683  13.4090          ?        ?      253.8        2.6       ?       ? 
1 1 1   30   14   15 o    800.5    3.3    0.0000   0.0000          ?        ?  6408.2031  52.3588          ?        ?      800.5        3.3       ?       ? 
1 1 1   30   14   16 o    311.4    2.4    0.0000   0.0000          ?        ?   969.9143  14.6860          ?        ?      311.4        2.4       ?       ? 
1 1 1   30   14   17 o    871.8    3.3    0.0000   0.0000          ?        ?  7600.9614  57.4669          ?        ?      871.8        3.3       ?       ? 
1 1 1   30   14   18 o    483.7    2.4    0.0000   0.0000          ?        ?  2339.5432  23.6253          ?        ?      483.7        2.4       ?       ? 
1 1 1   30   14   19 o    505.9    2.6    0.0000   0.0000          ?        ?  2559.8333  26.1794          ?        ?      505.9        2.6       ?       ? 
1 1 1   30   14   20 o    596.3    2.6    0.0000   0.0000          ?        ?  3555.9270  31.2876          ?        ?      596.3        2.6       ?       ? 
1 1 1   30   14   21 o    112.1    5.4    0.0000   0.0000          ?        ?   125.7888  12.1319          ?        ?      112.1        5.4       ?       ? 
1 1 1   30   14   22 o    655.1    2.7    0.0000   0.0000          ?        ?  4291.5039  35.1187          ?        ?      655.1        2.7       ?       ? 
1 1 1   30   14   23 o    710.3    2.9    0.0000   0.0000          ?        ?  5045.5981  41.5039          ?        ?      710.3        2.9       ?       ? 
1 1 1   30   14   24 o    779.3    3.1    0.0000   0.0000          ?        ?  6074.2563  47.8891          ?        ?      779.3        3.1       ?       ? 
1 1 1   30   14   25 o    627.7    2.7    0.0000   0.0000          ?        ?  3940.9556  33.8416          ?        ?      627.7        2.7       ?       ? 
1 1 1   30   14   26 o    245.5    2.9    0.0000   0.0000          ?        ?   602.7644  14.0475          ?        ?      245.5        2.9       ?       ? 
1 1 1   30   14   27 o    231.4    3.2    0.0000   0.0000          ?        ?   535.7197  14.6860          ?        ?      231.4        3.2       ?       ? 
1 1 1   30   14   28 o    399.3    2.6    0.0000   0.0000          ?        ?  1594.3884  21.0712          ?        ?      399.3        2.6       ?       ? 
1 1 1   30   14   29 o    259.9    2.9    0.0000   0.0000          ?        ?   675.5559  15.3245          ?        ?      259.9        2.9       ?       ? 
1 1 1   30   14   30 o    792.1    3.2    0.0000   0.0000          ?        ?  6276.0293  51.0817          ?        ?      792.1        3.2       ?       ? 
1 1 1   30   14   31 o    467.3    2.7    0.0000   0.0000          ?        ?  2184.3826  24.9023          ?        ?      467.3        2.7       ?       ? 
1 1 1   30   14   32 o    294.4    2.9    0.0000   0.0000          ?        ?   867.1124  17.2401          ?        ?      294.4        2.9       ?       ? 
1 1 1   30   14   33 o    322.9    2.8    0.0000   0.0000          ?        ?  1042.7058  17.8786          ?        ?      322.9        2.8       ?       ? 
1 1 1   30   14   34 o    286.9    3.0    0.0000   0.0000          ?        ?   823.0543  17.2401          ?        ?      286.9        3.0       ?       ? 
1 1 1   30   14   35 o     29.8   13.0    0.0000   0.0000          ?        ?    -3.1926  14.6860          ?        ?       29.8       13.0       ?       ? 
1 1 1   30   14   36 o    167.4    4.4    0.0000   0.0000          ?        ?   280.3110  14.6860          ?        ?      167.4        4.4       ?       ? 
1 1 1   30   14   37 o    350.9    2.6    0.0000   0.0000          ?        ?  1231.7081  18.5171          ?        ?      350.9        2.6       ?       ? 
1 1 1   30   14   38 o    152.4    5.0    0.0000   0.0000          ?        ?   232.4219  15.3245          ?        ?      152.4        5.0       ?       ? 
1 1 1   30   14   39 o    579.6    2.7    0.0000   0.0000          ?        ?  3359.9009  31.2876          ?        ?      579.6        2.7       ?       ? 
1 1 1   30   14   40 o    138.8    5.3    0.0000   0.0000          ?        ?   192.8335  14.6860          ?        ?      138.8        5.3       ?       ? 
1 1 1   30   14   41 o    166.4    5.0    0.0000   0.0000          ?        ?   277.1184  16.6016          ?        ?      166.4        5.0       ?       ? 
1 1 1   30   14   42 o    291.7    3.0    0.0000   0.0000          ?        ?   851.1494  17.2401          ?        ?      291.7        3.0       ?       ? 
1 1 1   30   14   43 o    128.5    6.0    0.0000   0.0000          ?        ?   165.3771  15.3245          ?        ?      128.5        6.0       ?       ? 
1 1 1   30   14   44 o    331.1    2.9    0.0000   0.0000          ?        ?  1096.9802  19.1556          ?        ?      331.1        2.9       ?       ? 
1 1 1   30   14   45 o     95.7    8.7    0.0000   0.0000          ?        ?    91.9471  16.6016          ?        ?       95.7        8.7       ?       ? 
1 1 1   30   14   46 o    167.7    5.3    0.0000   0.0000          ?        ?   281.5880  17.8786          ?        ?      167.7        5.3       ?       ? 
1 1 1   30   14   47 o    293.0    3.2    0.0000   0.0000          ?        ?   858.8116  18.5171          ?        ?      293.0        3.2       ?       ? 
1 1 1   30   14   48 o    256.4    3.5    0.0000   0.0000          ?        ?   657.6772  17.8786          ?        ?      256.4        3.5       ?       ? 
1 1 1   30   14   49 o    207.3    4.3    0.0000   0.0000          ?        ?   430.3636  17.8786          ?        ?      207.3        4.3       ?       ? 
1 1 1   30   14   50 o    152.5    5.9    0.0000   0.0000          ?        ?   233.0604  17.8786          ?        ?      152.5        5.9       ?       ? 
1 1 1   30   14   51 o     93.9    9.5    0.0000   0.0000          ?        ?    88.7545  17.8786          ?        ?       93.9        9.5       ?       ? 
1 1 1   30   14   52 o     43.7   15.6    0.0000   0.0000          ?        ?    16.6016  17.2401          ?        ?       43.7       15.6       ?       ? 
1 1 1   30   14   53 f    315.1    3.1    0.0000   0.0000          ?        ?   993.5397  19.7942          ?        ?      315.1        3.1       ?       ? 
1 1 1   30   14   54 o    122.5    7.6    0.0000   0.0000          ?        ?   150.6911  18.5171          ?        ?      122.5        7.6       ?       ? 
1 1 1   30   14   55 o    201.7    4.7    0.0000   0.0000          ?        ?   407.3768  19.1556          ?        ?      201.7        4.7       ?       ? 
1 1 1   30   14   56 o    235.0    4.2    0.0000   0.0000          ?        ?   552.9597  19.7942          ?        ?      235.0        4.2       ?       ? 
1 1 1   30   14   57 o     25.2   12.2    0.0000   0.0000          ?        ?   -31.9261  19.1556          ?        ?       25.2       12.2       ?       ? 
1 1 1   30   14   58 o    142.6    6.9    0.0000   0.0000          ?        ?   204.3269  19.7942          ?        ?      142.6        6.9       ?       ? 
1 1 1   30   14   59 o    228.9    4.5    0.0000   0.0000          ?        ?   524.8647  20.4327          ?        ?      228.9        4.5       ?       ? 
1 1 1   30   14   60 o     38.6   15.7    0.0000   0.0000          ?        ?     6.3852  19.1556          ?        ?       38.6       15.7       ?       ? 
1 1 1   30   14   61 o     39.3   15.8    0.0000   0.0000          ?        ?     7.6623  19.1556          ?        ?       39.3       15.8       ?       ? 
1 1 1   30   14   62 o    106.4    9.0    0.0000   0.0000          ?        ?   114.2954  19.1556          ?        ?      106.4        9.0       ?       ? 
1 1 1   30   14   63 o    120.6    8.2    0.0000   0.0000          ?        ?   146.8600  19.7942          ?        ?      120.6        8.2       ?       ? 
1 1 1   30   14   64 o     45.1   16.4    0.0000   0.0000          ?        ?    17.8786  19.1556          ?        ?       45.1       16.4       ?       ? 
1 1 1   30   14   65 o    154.0    6.4    0.0000   0.0000          ?        ?   238.8071  19.7942          ?        ?      154.0        6.4       ?       ? 
1 1 1   30   14   66 o     24.8   12.1    0.0000   0.0000          ?        ?   -32.5646  19.1556          ?        ?       24.8       12.1       ?       ? 
1 1 1   30   14   67 o     32.5   14.6    0.0000   0.0000          ?        ?    -7.6623  19.7942          ?        ?       32.5       14.6       ?       ? 
1 1 1   30   15    0 o    539.8    4.3 2914.8513  46.6121  2914.8513  46.6121  2914.8513  46.6121      539.8      4.3      539.8        4.3     0.0     0.0 
1 1 1   30   15    1 f    576.6    3.0    0.0000   0.0000          ?        ?  3325.4207  35.1187          ?        ?      576.6        3.0       ?       ? 
1 1 1   30   15    2 o   1136.8    4.8    0.0000   0.0000          ?        ? 12925.5938 108.5487          ?        ?     1136.8        4.8       ?       ? 
1 1 1   30   15    3 o    579.9    3.2    0.0000   0.0000          ?        ?  3363.0935  37.0343          ?        ?      579.9        3.2       ?       ? 
1 1 1   30   15    4 o    561.9    3.1    0.0000   0.0000          ?        ?  3157.4895  34.4802          ?        ?      561.9        3.1       ?       ? 
1 1 1   30   15    5 o    348.6    2.7    0.0000   0.0000          ?        ?  1215.1067  18.5171          ?        ?      348.6        2.7       ?       ? 
1 1 1   30   15    6 o    275.3    2.6    0.0000   0.0000          ?        ?   757.9252  14.0475          ?        ?      275.3        2.6       ?       ? 
1 1 1   30   15    7 o    671.5    3.0    0.0000   0.0000          ?        ?  4509.8779  40.2269          ?        ?      671.5        3.0       ?       ? 
1 1 1   30   15    8 f    648.6    2.9    0.0000   0.0000          ?        ?  4207.2192  37.0343          ?        ?      648.6        2.9       ?       ? 
1 1 1   30   15    9 o   1062.4    3.9    0.0000   0.0000          ?        ? 11288.4238  83.0078          ?        ?     1062.4        3.9       ?       ? 
1 1 1   30   15   10 o    674.1    2.9    0.0000   0.0000          ?        ?  4544.3584  38.9498          ?        ?      674.1        2.9       ?       ? 
1 1 1   30   15   11 o    966.1    3.6    0.0000   0.0000          ?        ?  9335.1865  68.9603          ?        ?      966.1        3.6       ?       ? 
1 1 1   30   15   12 o    356.7    2.2    0.0000   0.0000          ?        ?  1272.5736  15.9630          ?        ?      356.7        2.2       ?       ? 
1 1 1   30   15   13 o    230.6    2.6    0.0000   0.0000          ?        ?   531.8885  12.1319          ?        ?      230.6        2.6       ?       ? 
1 1 1   30   15   14 o    394.9    2.4    0.0000   0.0000          ?        ?  1559.2698  19.1556          ?        ?      394.9        2.4       ?       ? 
1 1 1   30   15   15 o    727.9    2.9    0.0000   0.0000          ?        ?  5299.0913  42.7809          ?        ?      727.9        2.9       ?       ? 
1 1 1   30   15   16 f    796.3    3.0    0.0000   0.0000          ?        ?  6341.7969  47.8891          ?        ?      796.3        3.0       ?       ? 
1 1 1   30   15   17 o    518.6    2.5    0.0000   0.0000          ?        ?  2689.4531  26.1794          ?        ?      518.6        2.5       ?       ? 
1 1 1   30   15   18 o    292.1    2.5    0.0000   0.0000          ?        ?   853.0649  14.6860          ?        ?      292.1        2.5       ?       ? 
1 1 1   30   15   19 o    273.2    2.6    0.0000   0.0000          ?        ?   746.4318  14.0475          ?        ?      273.2        2.6       ?       ? 
1 1 1   30   15   20 o    508.8    2.4    0.0000   0.0000          ?        ?  2589.2051  24.2638          ?        ?      508.8        2.4       ?       ? 
1 1 1   30   15   21 o    242.2    2.9    0.0000   0.0000          ?        ?   586.8014  14.0475          ?        ?      242.2        2.9       ?       ? 
1 1 1   30   15   22 o    472.6    2.4    0.0000   0.0000          ?        ?  2233.5486  22.3483          ?        ?      472.6        2.4       ?       ? 
1 1 1   30   15   23 o    229.2    2.8    0.0000   0.0000          ?        ?   525.5033  12.7704          ?        ?      229.2        2.8       ?       ? 
1 1 1   30   15   24 o    281.7    2.6    0.0000   0.0000          ?        ?   793.6824  14.6860          ?        ?      281.7        2.6       ?       ? 
1 1 1   30   15   25 o    343.1    2.6    0.0000   0.0000          ?        ?  1177.4338  17.8786          ?        ?      343.1        2.6       ?       ? 
1 1 1   30   15   26 o    139.7    5.3    0.0000   0.0000          ?        ?   195.3876  14.6860          ?        ?      139.7        5.3       ?       ? 
1 1 1   30   15   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   15   28 o    763.3    3.1    0.0000   0.0000          ?        ?  5827.7871  46.6121          ?        ?      763.3        3.1       ?       ? 
1 1 1   30   15   29 o    242.0    3.0    0.0000   0.0000          ?        ?   585.5243  14.6860          ?        ?      242.0        3.0       ?       ? 
1 1 1   30   15   30 o    270.9    3.1    0.0000   0.0000          ?        ?   734.2999  16.6016          ?        ?      270.9        3.1       ?       ? 
1 1 1   30   15   31 o     38.6   14.0    0.0000   0.0000          ?        ?    12.1319  14.0475          ?        ?       38.6       14.0       ?       ? 
1 1 1   30   15   32 o    148.4    4.7    0.0000   0.0000          ?        ?   220.2900  14.0475          ?        ?      148.4        4.7       ?       ? 
1 1 1   30   15   33 o    347.6    2.7    0.0000   0.0000          ?        ?  1208.7214  18.5171          ?        ?      347.6        2.7       ?       ? 
1 1 1   30   15   34 o    153.0    4.8    0.0000   0.0000          ?        ?   234.3374  14.6860          ?        ?      153.0        4.8       ?       ? 
1 1 1   30   15   35 o    914.7    3.4    0.0000   0.0000          ?        ?  8370.3799  62.5751          ?        ?      914.7        3.4       ?       ? 
1 1 1   30   15   36 o    325.0    2.8    0.0000   0.0000          ?        ?  1056.7533  18.5171          ?        ?      325.0        2.8       ?       ? 
1 1 1   30   15   37 o    267.9    3.2    0.0000   0.0000          ?        ?   717.6983  17.2401          ?        ?      267.9        3.2       ?       ? 
1 1 1   30   15   38 o    184.6    4.2    0.0000   0.0000          ?        ?   340.9706  15.3245          ?        ?      184.6        4.2       ?       ? 
1 1 1   30   15   39 o    136.9    5.6    0.0000   0.0000          ?        ?   187.7254  15.3245          ?        ?      136.9        5.6       ?       ? 
1 1 1   30   15   40 o    170.9    4.5    0.0000   0.0000          ?        ?   292.4429  15.3245          ?        ?      170.9        4.5       ?       ? 
1 1 1   30   15   41 o    326.8    2.7    0.0000   0.0000          ?        ?  1068.2467  17.8786          ?        ?      326.8        2.7       ?       ? 
1 1 1   30   15   42 o    345.5    2.8    0.0000   0.0000          ?        ?  1194.0354  19.1556          ?        ?      345.5        2.8       ?       ? 
1 1 1   30   15   43 o    396.9    2.6    0.0000   0.0000          ?        ?  1575.8713  20.4327          ?        ?      396.9        2.6       ?       ? 
1 1 1   30   15   44 o    233.7    3.7    0.0000   0.0000          ?        ?   546.5745  17.2401          ?        ?      233.7        3.7       ?       ? 
1 1 1   30   15   45 o    197.3    4.4    0.0000   0.0000          ?        ?   389.4982  17.2401          ?        ?      197.3        4.4       ?       ? 
1 1 1   30   15   46 o    228.9    3.8    0.0000   0.0000          ?        ?   524.2263  17.2401          ?        ?      228.9        3.8       ?       ? 
1 1 1   30   15   47 o    147.0    5.9    0.0000   0.0000          ?        ?   216.4588  17.2401          ?        ?      147.0        5.9       ?       ? 
1 1 1   30   15   48 o    262.4    3.7    0.0000   0.0000          ?        ?   688.9648  19.1556          ?        ?      262.4        3.7       ?       ? 
1 1 1   30   15   49 o    370.9    2.8    0.0000   0.0000          ?        ?  1376.0142  20.4327          ?        ?      370.9        2.8       ?       ? 
1 1 1   30   15   50 o    289.2    3.3    0.0000   0.0000          ?        ?   837.1019  19.1556          ?        ?      289.2        3.3       ?       ? 
1 1 1   30   15   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   15   52 o    261.1    3.7    0.0000   0.0000          ?        ?   682.5797  19.1556          ?        ?      261.1        3.7       ?       ? 
1 1 1   30   15   53 o    228.8    4.0    0.0000   0.0000          ?        ?   524.2263  18.5171          ?        ?      228.8        4.0       ?       ? 
1 1 1   30   15   54 f     21.0   10.5    0.0000   0.0000          ?        ?   -47.2506  17.8786          ?        ?       21.0       10.5       ?       ? 
1 1 1   30   15   55 o    301.8    3.4    0.0000   0.0000          ?        ?   911.8089  20.4327          ?        ?      301.8        3.4       ?       ? 
1 1 1   30   15   56 o     20.9   10.5    0.0000   0.0000          ?        ?   -56.1899  19.1556          ?        ?       20.9       10.5       ?       ? 
1 1 1   30   15   57 o    177.3    5.8    0.0000   0.0000          ?        ?   315.4297  20.4327          ?        ?      177.3        5.8       ?       ? 
1 1 1   30   15   58 o    208.9    4.6    0.0000   0.0000          ?        ?   437.3873  19.1556          ?        ?      208.9        4.6       ?       ? 
1 1 1   30   15   59 o    204.4    4.5    0.0000   0.0000          ?        ?   418.8702  18.5171          ?        ?      204.4        4.5       ?       ? 
1 1 1   30   15   60 o    176.4    5.6    0.0000   0.0000          ?        ?   312.2371  19.7942          ?        ?      176.4        5.6       ?       ? 
1 1 1   30   15   61 o     27.6   13.1    0.0000   0.0000          ?        ?   -24.2638  19.7942          ?        ?       27.6       13.1       ?       ? 
1 1 1   30   15   62 o     32.6   14.6    0.0000   0.0000          ?        ?    -8.3008  19.7942          ?        ?       32.6       14.6       ?       ? 
1 1 1   30   15   63 o    139.7    6.9    0.0000   0.0000          ?        ?   196.6647  19.1556          ?        ?      139.7        6.9       ?       ? 
1 1 1   30   15   64 o    127.2    7.5    0.0000   0.0000          ?        ?   163.4615  19.1556          ?        ?      127.2        7.5       ?       ? 
1 1 1   30   15   65 o     29.6   13.6    0.0000   0.0000          ?        ?   -12.7704  18.5171          ?        ?       29.6       13.6       ?       ? 
1 1 1   30   15   66 o    100.5    9.2    0.0000   0.0000          ?        ?   102.8020  18.5171          ?        ?      100.5        9.2       ?       ? 
1 1 1   30   16    0 o    762.0    5.3 5808.6313  81.0922  5808.6313  81.0922  5808.6313  81.0922      762.0      5.3      762.0        5.3     0.0     0.0 
1 1 1   30   16    1 o    888.4    3.7    0.0000   0.0000          ?        ?  7892.7656  66.4062          ?        ?      888.4        3.7       ?       ? 
1 1 1   30   16    2 o    864.3    3.8    0.0000   0.0000          ?        ?  7471.9800  65.1292          ?        ?      864.3        3.8       ?       ? 
1 1 1   30   16    3 o    402.1    2.7    0.0000   0.0000          ?        ?  1616.7367  21.7097          ?        ?      402.1        2.7       ?       ? 
1 1 1   30   16    4 o    855.1    3.7    0.0000   0.0000          ?        ?  7313.6270  62.5751          ?        ?      855.1        3.7       ?       ? 
1 1 1   30   16    5 o    660.8    3.0    0.0000   0.0000          ?        ?  4367.4878  40.2269          ?        ?      660.8        3.0       ?       ? 
1 1 1   30   16    6 o   1136.3    4.3    0.0000   0.0000          ?        ? 12914.0996  97.6938          ?        ?     1136.3        4.3       ?       ? 
1 1 1   30   16    7 o    191.8    3.0    0.0000   0.0000          ?        ?   367.7885  11.4934          ?        ?      191.8        3.0       ?       ? 
1 1 1   30   16    8 o    498.2    2.5    0.0000   0.0000          ?        ?  2481.9336  24.9023          ?        ?      498.2        2.5       ?       ? 
1 1 1   30   16    9 o    216.6    2.8    0.0000   0.0000          ?        ?   469.3134  12.1319          ?        ?      216.6        2.8       ?       ? 
1 1 1   30   16   10 f    612.1    2.6    0.0000   0.0000          ?        ?  3747.4836  31.2876          ?        ?      612.1        2.6       ?       ? 
1 1 1   30   16   11 o    431.3    2.4    0.0000   0.0000          ?        ?  1860.0134  20.4327          ?        ?      431.3        2.4       ?       ? 
1 1 1   30   16   12 o    581.2    2.5    0.0000   0.0000          ?        ?  3377.7793  29.3720          ?        ?      581.2        2.5       ?       ? 
1 1 1   30   16   13 f    670.9    2.8    0.0000   0.0000          ?        ?  4501.5776  37.0343          ?        ?      670.9        2.8       ?       ? 
1 1 1   30   16   14 o    204.8    3.1    0.0000   0.0000          ?        ?   419.5087  12.7704          ?        ?      204.8        3.1       ?       ? 
1 1 1   30   16   15 o    671.4    2.8    0.0000   0.0000          ?        ?  4507.9629  37.0343          ?        ?      671.4        2.8       ?       ? 
1 1 1   30   16   16 o    378.2    2.4    0.0000   0.0000          ?        ?  1430.2885  17.8786          ?        ?      378.2        2.4       ?       ? 
1 1 1   30   16   17 o    787.7    3.0    0.0000   0.0000          ?        ?  6205.1533  47.2506          ?        ?      787.7        3.0       ?       ? 
1 1 1   30   16   18 o    661.4    2.7    0.0000   0.0000          ?        ?  4375.1504  35.7572          ?        ?      661.4        2.7       ?       ? 
1 1 1   30   16   19 o   1016.5    3.8    0.0000   0.0000          ?        ? 10334.4727  77.2611          ?        ?     1016.5        3.8       ?       ? 
1 1 1   30   16   20 o    228.4    2.8    0.0000   0.0000          ?        ?   521.6721  12.7704          ?        ?      228.4        2.8       ?       ? 
1 1 1   30   16   21 o    264.5    2.7    0.0000   0.0000          ?        ?   699.8197  14.0475          ?        ?      264.5        2.7       ?       ? 
1 1 1   30   16   22 o    170.4    3.7    0.0000   0.0000          ?        ?   290.5273  12.7704          ?        ?      170.4        3.7       ?       ? 
1 1 1   30   16   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   16   24 o    237.2    3.0    0.0000   0.0000          ?        ?   562.5375  14.0475          ?        ?      237.2        3.0       ?       ? 
1 1 1   30   16   25 o    955.9    3.5    0.0000   0.0000          ?        ?  9139.1602  67.6833          ?        ?      955.9        3.5       ?       ? 
1 1 1   30   16   26 o    274.4    2.7    0.0000   0.0000          ?        ?   752.8170  14.6860          ?        ?      274.4        2.7       ?       ? 
1 1 1   30   16   27 o    478.9    2.4    0.0000   0.0000          ?        ?  2293.5698  22.9868          ?        ?      478.9        2.4       ?       ? 
1 1 1   30   16   28 o    605.6    2.7    0.0000   0.0000          ?        ?  3668.3066  33.2031          ?        ?      605.6        2.7       ?       ? 
1 1 1   30   16   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   16   30 o    121.1    5.5    0.0000   0.0000          ?        ?   146.8600  13.4090          ?        ?      121.1        5.5       ?       ? 
1 1 1   30   16   31 o    328.2    2.7    0.0000   0.0000          ?        ?  1077.1859  17.8786          ?        ?      328.2        2.7       ?       ? 
1 1 1   30   16   32 o    126.0    5.8    0.0000   0.0000          ?        ?   158.9919  14.6860          ?        ?      126.0        5.8       ?       ? 
1 1 1   30   16   33 o    626.2    2.7    0.0000   0.0000          ?        ?  3921.7998  33.8416          ?        ?      626.2        2.7       ?       ? 
1 1 1   30   16   34 o    311.8    2.9    0.0000   0.0000          ?        ?   972.4684  17.8786          ?        ?      311.8        2.9       ?       ? 
1 1 1   30   16   35 o    482.0    2.6    0.0000   0.0000          ?        ?  2323.5801  24.9023          ?        ?      482.0        2.6       ?       ? 
1 1 1   30   16   36 o    419.5    2.4    0.0000   0.0000          ?        ?  1760.4042  20.4327          ?        ?      419.5        2.4       ?       ? 
1 1 1   30   16   37 o    370.4    2.7    0.0000   0.0000          ?        ?  1372.1830  19.7942          ?        ?      370.4        2.7       ?       ? 
1 1 1   30   16   38 o    506.3    2.5    0.0000   0.0000          ?        ?  2564.3030  25.5409          ?        ?      506.3        2.5       ?       ? 
1 1 1   30   16   39 o    180.6    4.4    0.0000   0.0000          ?        ?   326.2845  15.9630          ?        ?      180.6        4.4       ?       ? 
1 1 1   30   16   40 o    109.4    7.3    0.0000   0.0000          ?        ?   120.0421  15.9630          ?        ?      109.4        7.3       ?       ? 
1 1 1   30   16   41 o    286.6    3.1    0.0000   0.0000          ?        ?   821.7773  17.8786          ?        ?      286.6        3.1       ?       ? 
1 1 1   30   16   42 o     17.5    8.9    0.0000   0.0000          ?        ?   -58.1055  15.9630          ?        ?       17.5        8.9       ?       ? 
1 1 1   30   16   43 o    229.3    3.6    0.0000   0.0000          ?        ?   526.1418  16.6016          ?        ?      229.3        3.6       ?       ? 
1 1 1   30   16   44 o     56.2   14.2    0.0000   0.0000          ?        ?    33.2031  15.9630          ?        ?       56.2       14.2       ?       ? 
1 1 1   30   16   45 o    330.7    2.9    0.0000   0.0000          ?        ?  1094.4260  19.1556          ?        ?      330.7        2.9       ?       ? 
1 1 1   30   16   46 o    149.1    5.8    0.0000   0.0000          ?        ?   222.8441  17.2401          ?        ?      149.1        5.8       ?       ? 
1 1 1   30   16   47 o     65.9   13.1    0.0000   0.0000          ?        ?    45.3350  16.6016          ?        ?       65.9       13.1       ?       ? 
1 1 1   30   16   48 o    118.1    7.0    0.0000   0.0000          ?        ?   139.8362  16.6016          ?        ?      118.1        7.0       ?       ? 
1 1 1   30   16   49 o    180.3    4.8    0.0000   0.0000          ?        ?   325.6460  17.2401          ?        ?      180.3        4.8       ?       ? 
1 1 1   30   16   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   16   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   16   52 o    534.8    2.7    0.0000   0.0000          ?        ?  2861.2153  29.3720          ?        ?      534.8        2.7       ?       ? 
1 1 1   30   16   53 o    207.3    4.6    0.0000   0.0000          ?        ?   430.3636  19.1556          ?        ?      207.3        4.6       ?       ? 
1 1 1   30   16   54 o    232.7    4.1    0.0000   0.0000          ?        ?   542.1049  19.1556          ?        ?      232.7        4.1       ?       ? 
1 1 1   30   16   55 o    354.9    3.1    0.0000   0.0000          ?        ?  1260.4417  22.3483          ?        ?      354.9        3.1       ?       ? 
1 1 1   30   16   56 o    195.5    4.9    0.0000   0.0000          ?        ?   383.1130  19.1556          ?        ?      195.5        4.9       ?       ? 
1 1 1   30   16   57 o    427.6    2.8    0.0000   0.0000          ?        ?  1830.0031  24.2638          ?        ?      427.6        2.8       ?       ? 
1 1 1   30   16   58 o     71.7   14.3    0.0000   0.0000          ?        ?    54.2743  19.7942          ?        ?       71.7       14.3       ?       ? 
1 1 1   30   16   59 o     63.3   15.7    0.0000   0.0000          ?        ?    42.7809  19.7942          ?        ?       63.3       15.7       ?       ? 
1 1 1   30   16   60 o    208.5    4.9    0.0000   0.0000          ?        ?   436.1103  20.4327          ?        ?      208.5        4.9       ?       ? 
1 1 1   30   16   61 o    109.6    8.7    0.0000   0.0000          ?        ?   121.3191  19.1556          ?        ?      109.6        8.7       ?       ? 
1 1 1   30   16   62 o     64.1   15.2    0.0000   0.0000          ?        ?    44.0580  19.1556          ?        ?       64.1       15.2       ?       ? 
1 1 1   30   16   63 o    126.8    7.6    0.0000   0.0000          ?        ?   162.1845  19.1556          ?        ?      126.8        7.6       ?       ? 
1 1 1   30   16   64 o     63.8   15.2    0.0000   0.0000          ?        ?    44.0580  19.1556          ?        ?       63.8       15.2       ?       ? 
1 1 1   30   16   65 o     69.8   14.2    0.0000   0.0000          ?        ?    52.3588  19.1556          ?        ?       69.8       14.2       ?       ? 
1 1 1   30   17    0 o    844.5    5.1 7133.5635  86.8389  7133.5635  86.8389  7133.5635  86.8389      844.5      5.1      844.5        5.1     0.0     0.0 
1 1 1   30   17    1 o    788.9    3.4    0.0000   0.0000          ?        ?  6224.3086  52.9973          ?        ?      788.9        3.4       ?       ? 
1 1 1   30   17    2 o    112.7    5.7    0.0000   0.0000          ?        ?   127.0658  12.7704          ?        ?      112.7        5.7       ?       ? 
1 1 1   30   17    3 o    367.0    2.6    0.0000   0.0000          ?        ?  1346.6421  19.1556          ?        ?      367.0        2.6       ?       ? 
1 1 1   30   17    4 o    888.6    3.8    0.0000   0.0000          ?        ?  7897.8740  68.3218          ?        ?      888.6        3.8       ?       ? 
1 1 1   30   17    5 o    301.8    2.8    0.0000   0.0000          ?        ?   911.1703  16.6016          ?        ?      301.8        2.8       ?       ? 
1 1 1   30   17    6 o    402.5    2.4    0.0000   0.0000          ?        ?  1619.9293  19.1556          ?        ?      402.5        2.4       ?       ? 
1 1 1   30   17    7 o    545.3    2.6    0.0000   0.0000          ?        ?  2974.2336  28.0950          ?        ?      545.3        2.6       ?       ? 
1 1 1   30   17    8 o     22.1   10.1    0.0000   0.0000          ?        ?    -7.6623  10.2163          ?        ?       22.1       10.1       ?       ? 
1 1 1   30   17    9 o    838.5    3.4    0.0000   0.0000          ?        ?  7032.0391  56.1899          ?        ?      838.5        3.4       ?       ? 
1 1 1   30   17   10 o    174.9    3.3    0.0000   0.0000          ?        ?   305.8519  11.4934          ?        ?      174.9        3.3       ?       ? 
1 1 1   30   17   11 o    240.6    2.5    0.0000   0.0000          ?        ?   579.1391  12.1319          ?        ?      240.6        2.5       ?       ? 
1 1 1   30   17   12 o     42.9    9.9    0.0000   0.0000          ?        ?    19.1556   8.3008          ?        ?       42.9        9.9       ?       ? 
1 1 1   30   17   13 o    166.3    3.1    0.0000   0.0000          ?        ?   276.4799  10.2163          ?        ?      166.3        3.1       ?       ? 
1 1 1   30   17   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   17   15 o    533.5    2.5    0.0000   0.0000          ?        ?  2846.5293  26.8179          ?        ?      533.5        2.5       ?       ? 
1 1 1   30   17   16 o    754.4    3.1    0.0000   0.0000          ?        ?  5692.4204  46.6121          ?        ?      754.4        3.1       ?       ? 
1 1 1   30   17   17 f    523.5    2.6    0.0000   0.0000          ?        ?  2741.1733  27.4564          ?        ?      523.5        2.6       ?       ? 
1 1 1   30   17   18 o    339.5    2.6    0.0000   0.0000          ?        ?  1152.5315  17.8786          ?        ?      339.5        2.6       ?       ? 
1 1 1   30   17   19 o    302.2    2.4    0.0000   0.0000          ?        ?   913.0859  14.6860          ?        ?      302.2        2.4       ?       ? 
1 1 1   30   17   20 o    357.6    2.3    0.0000   0.0000          ?        ?  1278.9589  16.6016          ?        ?      357.6        2.3       ?       ? 
1 1 1   30   17   21 o    456.8    2.4    0.0000   0.0000          ?        ?  2087.3271  21.7097          ?        ?      456.8        2.4       ?       ? 
1 1 1   30   17   22 f    178.3    3.4    0.0000   0.0000          ?        ?   317.9838  12.1319          ?        ?      178.3        3.4       ?       ? 
1 1 1   30   17   23 o    706.3    2.8    0.0000   0.0000          ?        ?  4988.7695  39.5883          ?        ?      706.3        2.8       ?       ? 
1 1 1   30   17   24 o    304.1    2.4    0.0000   0.0000          ?        ?   924.5793  14.6860          ?        ?      304.1        2.4       ?       ? 
1 1 1   30   17   25 o    148.2    4.7    0.0000   0.0000          ?        ?   219.6514  14.0475          ?        ?      148.2        4.7       ?       ? 
1 1 1   30   17   26 o    300.3    2.6    0.0000   0.0000          ?        ?   902.2311  15.3245          ?        ?      300.3        2.6       ?       ? 
1 1 1   30   17   27 o    413.3    2.5    0.0000   0.0000          ?        ?  1708.6840  21.0712          ?        ?      413.3        2.5       ?       ? 
1 1 1   30   17   28 o    651.5    2.7    0.0000   0.0000          ?        ?  4245.5303  35.1187          ?        ?      651.5        2.7       ?       ? 
1 1 1   30   17   29 o    604.5    2.7    0.0000   0.0000          ?        ?  3655.5364  33.2031          ?        ?      604.5        2.7       ?       ? 
1 1 1   30   17   30 o    276.0    3.0    0.0000   0.0000          ?        ?   761.7563  16.6016          ?        ?      276.0        3.0       ?       ? 
1 1 1   30   17   31 o    330.0    2.6    0.0000   0.0000          ?        ?  1089.3180  17.2401          ?        ?      330.0        2.6       ?       ? 
1 1 1   30   17   32 o    120.1    6.4    0.0000   0.0000          ?        ?   144.3059  15.3245          ?        ?      120.1        6.4       ?       ? 
1 1 1   30   17   33 o    476.9    2.5    0.0000   0.0000          ?        ?  2275.0525  24.2638          ?        ?      476.9        2.5       ?       ? 
1 1 1   30   17   34 o    421.0    2.5    0.0000   0.0000          ?        ?  1773.1747  21.0712          ?        ?      421.0        2.5       ?       ? 
1 1 1   30   17   35 o   1040.6    4.0    0.0000   0.0000          ?        ? 10834.4355  82.3693          ?        ?     1040.6        4.0       ?       ? 
1 1 1   30   17   36 o    436.2    2.6    0.0000   0.0000          ?        ?  1903.4330  22.9868          ?        ?      436.2        2.6       ?       ? 
1 1 1   30   17   37 o    552.3    2.7    0.0000   0.0000          ?        ?  3051.4949  29.3720          ?        ?      552.3        2.7       ?       ? 
1 1 1   30   17   38 o    341.1    2.7    0.0000   0.0000          ?        ?  1164.0249  18.5171          ?        ?      341.1        2.7       ?       ? 
1 1 1   30   17   39 o    476.8    2.5    0.0000   0.0000          ?        ?  2274.4141  24.2638          ?        ?      476.8        2.5       ?       ? 
1 1 1   30   17   40 o    502.4    2.5    0.0000   0.0000          ?        ?  2524.7144  25.5409          ?        ?      502.4        2.5       ?       ? 
1 1 1   30   17   41 o    205.2    3.9    0.0000   0.0000          ?        ?   421.4243  15.9630          ?        ?      205.2        3.9       ?       ? 
1 1 1   30   17   42 o    276.3    3.1    0.0000   0.0000          ?        ?   763.6719  17.2401          ?        ?      276.3        3.1       ?       ? 
1 1 1   30   17   43 o    122.4    6.8    0.0000   0.0000          ?        ?   150.0526  16.6016          ?        ?      122.4        6.8       ?       ? 
1 1 1   30   17   44 o    316.5    2.9    0.0000   0.0000          ?        ?  1002.4789  18.5171          ?        ?      316.5        2.9       ?       ? 
1 1 1   30   17   45 f    199.7    4.3    0.0000   0.0000          ?        ?   399.0760  17.2401          ?        ?      199.7        4.3       ?       ? 
1 1 1   30   17   46 o    196.8    4.2    0.0000   0.0000          ?        ?   387.5826  16.6016          ?        ?      196.8        4.2       ?       ? 
1 1 1   30   17   47 o    229.7    3.9    0.0000   0.0000          ?        ?   528.0574  17.8786          ?        ?      229.7        3.9       ?       ? 
1 1 1   30   17   48 o     85.8    9.7    0.0000   0.0000          ?        ?    74.0685  16.6016          ?        ?       85.8        9.7       ?       ? 
1 1 1   30   17   49 f     19.3    9.7    0.0000   0.0000          ?        ?   -49.8047  16.6016          ?        ?       19.3        9.7       ?       ? 
1 1 1   30   17   50 o    206.1    4.3    0.0000   0.0000          ?        ?   425.2554  17.8786          ?        ?      206.1        4.3       ?       ? 
1 1 1   30   17   51 o    113.6    7.9    0.0000   0.0000          ?        ?   129.6199  17.8786          ?        ?      113.6        7.9       ?       ? 
1 1 1   30   17   52 o    203.6    4.5    0.0000   0.0000          ?        ?   415.0391  18.5171          ?        ?      203.6        4.5       ?       ? 
1 1 1   30   17   53 o    179.2    5.3    0.0000   0.0000          ?        ?   321.8149  19.1556          ?        ?      179.2        5.3       ?       ? 
1 1 1   30   17   54 o    278.8    3.7    0.0000   0.0000          ?        ?   778.3578  20.4327          ?        ?      278.8        3.7       ?       ? 
1 1 1   30   17   55 o     90.0   10.3    0.0000   0.0000          ?        ?    81.7308  18.5171          ?        ?       90.0       10.3       ?       ? 
1 1 1   30   17   56 o    232.2    4.4    0.0000   0.0000          ?        ?   540.1893  20.4327          ?        ?      232.2        4.4       ?       ? 
1 1 1   30   17   57 o    188.3    5.1    0.0000   0.0000          ?        ?   355.6566  19.1556          ?        ?      188.3        5.1       ?       ? 
1 1 1   30   17   58 o    199.0    5.1    0.0000   0.0000          ?        ?   397.1605  20.4327          ?        ?      199.0        5.1       ?       ? 
1 1 1   30   17   59 o    149.9    6.6    0.0000   0.0000          ?        ?   226.0367  19.7942          ?        ?      149.9        6.6       ?       ? 
1 1 1   30   17   60 o    137.7    7.2    0.0000   0.0000          ?        ?   190.9180  19.7942          ?        ?      137.7        7.2       ?       ? 
1 1 1   30   17   61 o     31.5   14.2    0.0000   0.0000          ?        ?    -9.5778  19.1556          ?        ?       31.5       14.2       ?       ? 
1 1 1   30   17   62 o     84.1   11.4    0.0000   0.0000          ?        ?    72.1529  19.1556          ?        ?       84.1       11.4       ?       ? 
1 1 1   30   17   63 o    101.2    9.5    0.0000   0.0000          ?        ?   104.0790  19.1556          ?        ?      101.2        9.5       ?       ? 
1 1 1   30   17   64 o    225.8    4.2    0.0000   0.0000          ?        ?   511.4558  19.1556          ?        ?      225.8        4.2       ?       ? 
1 1 1   30   17   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   18    0 o    499.8    4.6 2499.1736  45.9736  2499.1736  45.9736  2499.1736  45.9736      499.8      4.6      499.8        4.6     0.0     0.0 
1 1 1   30   18    1 o   1142.3    4.4    0.0000   0.0000          ?        ? 13050.7441 100.8864          ?        ?     1142.3        4.4       ?       ? 
1 1 1   30   18    2 o    479.7    2.7    0.0000   0.0000          ?        ?  2301.2319  26.1794          ?        ?      479.7        2.7       ?       ? 
1 1 1   30   18    3 o    473.1    2.7    0.0000   0.0000          ?        ?  2238.6570  25.5409          ?        ?      473.1        2.7       ?       ? 
1 1 1   30   18    4 o    403.7    2.6    0.0000   0.0000          ?        ?  1630.1458  21.0712          ?        ?      403.7        2.6       ?       ? 
1 1 1   30   18    5 o    650.2    3.0    0.0000   0.0000          ?        ?  4227.6514  38.9498          ?        ?      650.2        3.0       ?       ? 
1 1 1   30   18    6 o    696.4    3.2    0.0000   0.0000          ?        ?  4850.2100  44.0580          ?        ?      696.4        3.2       ?       ? 
1 1 1   30   18    7 o    375.1    2.4    0.0000   0.0000          ?        ?  1407.3016  17.8786          ?        ?      375.1        2.4       ?       ? 
1 1 1   30   18    8 o    418.0    2.5    0.0000   0.0000          ?        ?  1747.6338  21.0712          ?        ?      418.0        2.5       ?       ? 
1 1 1   30   18    9 o    608.8    2.9    0.0000   0.0000          ?        ?  3706.6179  35.1187          ?        ?      608.8        2.9       ?       ? 
1 1 1   30   18   10 o    474.2    2.6    0.0000   0.0000          ?        ?  2248.8733  24.2638          ?        ?      474.2        2.6       ?       ? 
1 1 1   30   18   11 o    414.3    2.2    0.0000   0.0000          ?        ?  1716.3461  17.8786          ?        ?      414.3        2.2       ?       ? 
1 1 1   30   18   12 o     36.3   10.7    0.0000   0.0000          ?        ?    13.4090   8.3008          ?        ?       36.3       10.7       ?       ? 
1 1 1   30   18   13 o    317.3    2.1    0.0000   0.0000          ?        ?  1006.9486  13.4090          ?        ?      317.3        2.1       ?       ? 
1 1 1   30   18   14 o    339.9    2.3    0.0000   0.0000          ?        ?  1155.7241  15.3245          ?        ?      339.9        2.3       ?       ? 
1 1 1   30   18   15 f    418.5    2.4    0.0000   0.0000          ?        ?  1751.4647  20.4327          ?        ?      418.5        2.4       ?       ? 
1 1 1   30   18   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   18   17 o    666.6    2.8    0.0000   0.0000          ?        ?  4443.4722  37.0343          ?        ?      666.6        2.8       ?       ? 
1 1 1   30   18   18 o    768.3    3.0    0.0000   0.0000          ?        ?  5903.1323  45.3350          ?        ?      768.3        3.0       ?       ? 
1 1 1   30   18   19 o    587.9    2.6    0.0000   0.0000          ?        ?  3456.9563  30.6490          ?        ?      587.9        2.6       ?       ? 
1 1 1   30   18   20 o    986.9    3.8    0.0000   0.0000          ?        ?  9741.9238  74.0685          ?        ?      986.9        3.8       ?       ? 
1 1 1   30   18   21 o    203.4    3.3    0.0000   0.0000          ?        ?   413.7620  13.4090          ?        ?      203.4        3.3       ?       ? 
1 1 1   30   18   22 o    401.3    2.4    0.0000   0.0000          ?        ?  1610.9901  19.1556          ?        ?      401.3        2.4       ?       ? 
1 1 1   30   18   23 f    687.9    2.8    0.0000   0.0000          ?        ?  4732.7222  38.9498          ?        ?      687.9        2.8       ?       ? 
1 1 1   30   18   24 o    319.9    2.5    0.0000   0.0000          ?        ?  1023.5502  15.9630          ?        ?      319.9        2.5       ?       ? 
1 1 1   30   18   25 o    696.9    2.8    0.0000   0.0000          ?        ?  4857.2339  39.5883          ?        ?      696.9        2.8       ?       ? 
1 1 1   30   18   26 o    325.5    2.5    0.0000   0.0000          ?        ?  1059.9459  15.9630          ?        ?      325.5        2.5       ?       ? 
1 1 1   30   18   27 o    636.6    2.7    0.0000   0.0000          ?        ?  4053.3352  34.4802          ?        ?      636.6        2.7       ?       ? 
1 1 1   30   18   28 o    375.5    2.4    0.0000   0.0000          ?        ?  1410.4943  17.8786          ?        ?      375.5        2.4       ?       ? 
1 1 1   30   18   29 o    264.6    2.9    0.0000   0.0000          ?        ?   700.4582  15.3245          ?        ?      264.6        2.9       ?       ? 
1 1 1   30   18   30 o    122.4    5.7    0.0000   0.0000          ?        ?   150.0526  14.0475          ?        ?      122.4        5.7       ?       ? 
1 1 1   30   18   31 o    168.3    4.0    0.0000   0.0000          ?        ?   283.5036  13.4090          ?        ?      168.3        4.0       ?       ? 
1 1 1   30   18   32 o    266.4    3.0    0.0000   0.0000          ?        ?   710.0360  15.9630          ?        ?      266.4        3.0       ?       ? 
1 1 1   30   18   33 o    334.7    2.6    0.0000   0.0000          ?        ?  1120.6055  17.2401          ?        ?      334.7        2.6       ?       ? 
1 1 1   30   18   34 o     26.7   12.2    0.0000   0.0000          ?        ?   -10.2163  14.6860          ?        ?       26.7       12.2       ?       ? 
1 1 1   30   18   35 o    245.3    3.4    0.0000   0.0000          ?        ?   602.1259  16.6016          ?        ?      245.3        3.4       ?       ? 
1 1 1   30   18   36 o    161.7    4.9    0.0000   0.0000          ?        ?   261.7939  15.9630          ?        ?      161.7        4.9       ?       ? 
1 1 1   30   18   37 o    564.8    2.7    0.0000   0.0000          ?        ?  3191.3311  30.0105          ?        ?      564.8        2.7       ?       ? 
1 1 1   30   18   38 o    521.1    2.6    0.0000   0.0000          ?        ?  2716.2710  26.8179          ?        ?      521.1        2.6       ?       ? 
1 1 1   30   18   39 o    554.3    2.6    0.0000   0.0000          ?        ?  3073.8430  28.7335          ?        ?      554.3        2.6       ?       ? 
1 1 1   30   18   40 o    208.5    4.0    0.0000   0.0000          ?        ?   434.8332  16.6016          ?        ?      208.5        4.0       ?       ? 
1 1 1   30   18   41 o    221.4    3.6    0.0000   0.0000          ?        ?   490.3846  15.9630          ?        ?      221.4        3.6       ?       ? 
1 1 1   30   18   42 o    173.9    4.8    0.0000   0.0000          ?        ?   302.6593  16.6016          ?        ?      173.9        4.8       ?       ? 
1 1 1   30   18   43 o    256.5    3.4    0.0000   0.0000          ?        ?   658.3158  17.2401          ?        ?      256.5        3.4       ?       ? 
1 1 1   30   18   44 o    246.3    3.6    0.0000   0.0000          ?        ?   607.2341  17.8786          ?        ?      246.3        3.6       ?       ? 
1 1 1   30   18   45 o    266.4    3.4    0.0000   0.0000          ?        ?   710.0360  17.8786          ?        ?      266.4        3.4       ?       ? 
1 1 1   30   18   46 o    369.0    2.9    0.0000   0.0000          ?        ?  1362.6051  21.0712          ?        ?      369.0        2.9       ?       ? 
1 1 1   30   18   47 o    149.4    5.3    0.0000   0.0000          ?        ?   223.4826  15.9630          ?        ?      149.4        5.3       ?       ? 
1 1 1   30   18   48 o     58.3   14.3    0.0000   0.0000          ?        ?    35.7572  16.6016          ?        ?       58.3       14.3       ?       ? 
1 1 1   30   18   49 o    168.0    5.1    0.0000   0.0000          ?        ?   282.8651  17.2401          ?        ?      168.0        5.1       ?       ? 
1 1 1   30   18   50 o     46.1   15.4    0.0000   0.0000          ?        ?    20.4327  16.6016          ?        ?       46.1       15.4       ?       ? 
1 1 1   30   18   51 o    161.0    5.6    0.0000   0.0000          ?        ?   259.8783  17.8786          ?        ?      161.0        5.6       ?       ? 
1 1 1   30   18   52 o     82.3   10.5    0.0000   0.0000          ?        ?    68.3218  17.2401          ?        ?       82.3       10.5       ?       ? 
1 1 1   30   18   53 o     22.5   11.1    0.0000   0.0000          ?        ?   -42.1424  18.5171          ?        ?       22.5       11.1       ?       ? 
1 1 1   30   18   54 o    108.9    8.8    0.0000   0.0000          ?        ?   119.4035  19.1556          ?        ?      108.9        8.8       ?       ? 
1 1 1   30   18   55 o     46.2   16.7    0.0000   0.0000          ?        ?    18.5171  19.7942          ?        ?       46.2       16.7       ?       ? 
1 1 1   30   18   56 o    183.2    5.1    0.0000   0.0000          ?        ?   336.5009  18.5171          ?        ?      183.2        5.1       ?       ? 
1 1 1   30   18   57 f    146.6    6.5    0.0000   0.0000          ?        ?   215.8203  19.1556          ?        ?      146.6        6.5       ?       ? 
1 1 1   30   18   58 o    155.8    6.1    0.0000   0.0000          ?        ?   243.9153  19.1556          ?        ?      155.8        6.1       ?       ? 
1 1 1   30   18   59 o    147.8    6.5    0.0000   0.0000          ?        ?   219.6514  19.1556          ?        ?      147.8        6.5       ?       ? 
1 1 1   30   18   60 o     93.5   10.2    0.0000   0.0000          ?        ?    88.7545  19.1556          ?        ?       93.5       10.2       ?       ? 
1 1 1   30   18   61 o     24.9   12.1    0.0000   0.0000          ?        ?   -32.5646  19.1556          ?        ?       24.9       12.1       ?       ? 
1 1 1   30   18   62 f    192.8    5.1    0.0000   0.0000          ?        ?   373.5352  19.7942          ?        ?      192.8        5.1       ?       ? 
1 1 1   30   18   63 o    361.8    3.0    0.0000   0.0000          ?        ?  1311.5234  21.7097          ?        ?      361.8        3.0       ?       ? 
1 1 1   30   18   64 o     53.5   16.0    0.0000   0.0000          ?        ?    30.6490  18.5171          ?        ?       53.5       16.0       ?       ? 
1 1 1   30   19    0 o    856.9    5.0 7344.9146  84.9234  7344.9146  84.9234  7344.9146  84.9234      856.9      5.0      856.9        5.0     0.0     0.0 
1 1 1   30   19    1 o    292.5    2.6    0.0000   0.0000          ?        ?   855.6190  15.3245          ?        ?      292.5        2.6       ?       ? 
1 1 1   30   19    2 o    219.8    2.9    0.0000   0.0000          ?        ?   483.3608  12.7704          ?        ?      219.8        2.9       ?       ? 
1 1 1   30   19    3 o    311.8    2.6    0.0000   0.0000          ?        ?   972.4684  15.9630          ?        ?      311.8        2.6       ?       ? 
1 1 1   30   19    4 o    232.5    2.7    0.0000   0.0000          ?        ?   540.8278  12.7704          ?        ?      232.5        2.7       ?       ? 
1 1 1   30   19    5 o    456.2    2.6    0.0000   0.0000          ?        ?  2081.5806  23.6253          ?        ?      456.2        2.6       ?       ? 
1 1 1   30   19    6 f    486.2    3.0    0.0000   0.0000          ?        ?  2363.8071  28.7335          ?        ?      486.2        3.0       ?       ? 
1 1 1   30   19    7 o    908.2    3.7    0.0000   0.0000          ?        ?  8249.0615  67.0448          ?        ?      908.2        3.7       ?       ? 
1 1 1   30   19    8 f    663.0    2.8    0.0000   0.0000          ?        ?  4396.2212  37.0343          ?        ?      663.0        2.8       ?       ? 
1 1 1   30   19    9 o    224.9    2.6    0.0000   0.0000          ?        ?   505.7091  11.4934          ?        ?      224.9        2.6       ?       ? 
1 1 1   30   19   10 o    482.6    2.5    0.0000   0.0000          ?        ?  2329.3269  24.2638          ?        ?      482.6        2.5       ?       ? 
1 1 1   30   19   11 o    597.0    2.7    0.0000   0.0000          ?        ?  3564.2278  31.9261          ?        ?      597.0        2.7       ?       ? 
1 1 1   30   19   12 f    757.6    2.9    0.0000   0.0000          ?        ?  5740.9478  44.0580          ?        ?      757.6        2.9       ?       ? 
1 1 1   30   19   13 o    395.7    2.3    0.0000   0.0000          ?        ?  1566.2936  17.8786          ?        ?      395.7        2.3       ?       ? 
1 1 1   30   19   14 o    796.5    3.0    0.0000   0.0000          ?        ?  6344.3506  48.5276          ?        ?      796.5        3.0       ?       ? 
1 1 1   30   19   15 o    131.3    3.9    0.0000   0.0000          ?        ?   172.4008  10.2163          ?        ?      131.3        3.9       ?       ? 
1 1 1   30   19   16 o    633.8    2.7    0.0000   0.0000          ?        ?  4017.5781  34.4802          ?        ?      633.8        2.7       ?       ? 
1 1 1   30   19   17 o    405.3    2.4    0.0000   0.0000          ?        ?  1642.9160  19.1556          ?        ?      405.3        2.4       ?       ? 
1 1 1   30   19   18 o    648.5    2.8    0.0000   0.0000          ?        ?  4205.9419  36.3957          ?        ?      648.5        2.8       ?       ? 
1 1 1   30   19   19 o    500.5    2.4    0.0000   0.0000          ?        ?  2504.9202  23.6253          ?        ?      500.5        2.4       ?       ? 
1 1 1   30   19   20 o    341.1    2.3    0.0000   0.0000          ?        ?  1163.3864  15.9630          ?        ?      341.1        2.3       ?       ? 
1 1 1   30   19   21 o    443.5    2.4    0.0000   0.0000          ?        ?  1967.2852  21.0712          ?        ?      443.5        2.4       ?       ? 
1 1 1   30   19   22 o    610.8    2.7    0.0000   0.0000          ?        ?  3730.8818  32.5646          ?        ?      610.8        2.7       ?       ? 
1 1 1   30   19   23 o    581.6    2.6    0.0000   0.0000          ?        ?  3382.8875  30.6490          ?        ?      581.6        2.6       ?       ? 
1 1 1   30   19   24 o    463.4    2.5    0.0000   0.0000          ?        ?  2147.9868  22.9868          ?        ?      463.4        2.5       ?       ? 
1 1 1   30   19   25 o    483.7    2.5    0.0000   0.0000          ?        ?  2340.1816  24.2638          ?        ?      483.7        2.5       ?       ? 
1 1 1   30   19   26 o    374.2    2.6    0.0000   0.0000          ?        ?  1400.2780  19.1556          ?        ?      374.2        2.6       ?       ? 
1 1 1   30   19   27 o    668.6    2.7    0.0000   0.0000          ?        ?  4471.5669  36.3957          ?        ?      668.6        2.7       ?       ? 
1 1 1   30   19   28 o    321.1    2.6    0.0000   0.0000          ?        ?  1031.2124  16.6016          ?        ?      321.1        2.6       ?       ? 
1 1 1   30   19   29 o    265.2    2.8    0.0000   0.0000          ?        ?   703.6508  14.6860          ?        ?      265.2        2.8       ?       ? 
1 1 1   30   19   30 o    344.4    2.7    0.0000   0.0000          ?        ?  1186.3732  18.5171          ?        ?      344.4        2.7       ?       ? 
1 1 1   30   19   31 o     74.4    9.0    0.0000   0.0000          ?        ?    55.5514  13.4090          ?        ?       74.4        9.0       ?       ? 
1 1 1   30   19   32 o    277.0    3.0    0.0000   0.0000          ?        ?   767.5030  16.6016          ?        ?      277.0        3.0       ?       ? 
1 1 1   30   19   33 o     21.3   10.4    0.0000   0.0000          ?        ?   -28.0950  14.6860          ?        ?       21.3       10.4       ?       ? 
1 1 1   30   19   34 o    663.3    2.8    0.0000   0.0000          ?        ?  4401.3296  37.6728          ?        ?      663.3        2.8       ?       ? 
1 1 1   30   19   35 o    187.0    3.9    0.0000   0.0000          ?        ?   349.9099  14.6860          ?        ?      187.0        3.9       ?       ? 
1 1 1   30   19   36 o    326.7    2.7    0.0000   0.0000          ?        ?  1067.6082  17.8786          ?        ?      326.7        2.7       ?       ? 
1 1 1   30   19   37 o    264.4    3.1    0.0000   0.0000          ?        ?   699.1812  16.6016          ?        ?      264.4        3.1       ?       ? 
1 1 1   30   19   38 o    392.9    2.8    0.0000   0.0000          ?        ?  1544.5837  21.7097          ?        ?      392.9        2.8       ?       ? 
1 1 1   30   19   39 o    315.9    2.8    0.0000   0.0000          ?        ?   998.0093  17.8786          ?        ?      315.9        2.8       ?       ? 
1 1 1   30   19   40 o    232.2    3.6    0.0000   0.0000          ?        ?   539.5508  16.6016          ?        ?      232.2        3.6       ?       ? 
1 1 1   30   19   41 o    274.1    3.0    0.0000   0.0000          ?        ?   751.5399  16.6016          ?        ?      274.1        3.0       ?       ? 
1 1 1   30   19   42 o     76.0   10.5    0.0000   0.0000          ?        ?    58.1055  15.9630          ?        ?       76.0       10.5       ?       ? 
1 1 1   30   19   43 o     19.8    9.9    0.0000   0.0000          ?        ?   -42.7809  15.9630          ?        ?       19.8        9.9       ?       ? 
1 1 1   30   19   44 o    514.9    2.8    0.0000   0.0000          ?        ?  2652.4187  28.7335          ?        ?      514.9        2.8       ?       ? 
1 1 1   30   19   45 o    320.8    3.1    0.0000   0.0000          ?        ?  1029.9354  19.7942          ?        ?      320.8        3.1       ?       ? 
1 1 1   30   19   46 o    521.5    2.6    0.0000   0.0000          ?        ?  2720.7407  27.4564          ?        ?      521.5        2.6       ?       ? 
1 1 1   30   19   47 f    157.2    5.5    0.0000   0.0000          ?        ?   247.7464  17.2401          ?        ?      157.2        5.5       ?       ? 
1 1 1   30   19   48 o    198.5    4.2    0.0000   0.0000          ?        ?   394.6064  16.6016          ?        ?      198.5        4.2       ?       ? 
1 1 1   30   19   49 o     59.7   15.0    0.0000   0.0000          ?        ?    37.6728  17.8786          ?        ?       59.7       15.0       ?       ? 
1 1 1   30   19   50 o    177.1    5.0    0.0000   0.0000          ?        ?   314.1526  17.8786          ?        ?      177.1        5.0       ?       ? 
1 1 1   30   19   51 o     27.9   12.9    0.0000   0.0000          ?        ?   -14.6860  17.2401          ?        ?       27.9       12.9       ?       ? 
1 1 1   30   19   52 o    291.4    3.4    0.0000   0.0000          ?        ?   849.8723  19.7942          ?        ?      291.4        3.4       ?       ? 
1 1 1   30   19   53 o    197.0    4.9    0.0000   0.0000          ?        ?   388.8597  19.1556          ?        ?      197.0        4.9       ?       ? 
1 1 1   30   19   54 o    326.1    3.2    0.0000   0.0000          ?        ?  1064.4155  21.0712          ?        ?      326.1        3.2       ?       ? 
1 1 1   30   19   55 o     78.9   12.1    0.0000   0.0000          ?        ?    63.2136  19.1556          ?        ?       78.9       12.1       ?       ? 
1 1 1   30   19   56 o    173.1    5.7    0.0000   0.0000          ?        ?   300.7437  19.7942          ?        ?      173.1        5.7       ?       ? 
1 1 1   30   19   57 o     98.6   10.0    0.0000   0.0000          ?        ?    98.3323  19.7942          ?        ?       98.6       10.0       ?       ? 
1 1 1   30   19   58 o    184.9    5.2    0.0000   0.0000          ?        ?   342.8861  19.1556          ?        ?      184.9        5.2       ?       ? 
1 1 1   30   19   59 f     79.6   11.6    0.0000   0.0000          ?        ?    64.4907  18.5171          ?        ?       79.6       11.6       ?       ? 
1 1 1   30   19   60 o     48.3   16.8    0.0000   0.0000          ?        ?    22.3483  19.7942          ?        ?       48.3       16.8       ?       ? 
1 1 1   30   19   61 o     21.8   10.9    0.0000   0.0000          ?        ?   -45.3350  18.5171          ?        ?       21.8       10.9       ?       ? 
1 1 1   30   19   62 o     52.8   16.4    0.0000   0.0000          ?        ?    29.3720  19.1556          ?        ?       52.8       16.4       ?       ? 
1 1 1   30   19   63 f    142.5    6.9    0.0000   0.0000          ?        ?   204.9654  19.7942          ?        ?      142.5        6.9       ?       ? 
1 1 1   30   20    0 o    810.9    4.9 6578.0493  79.1767  6578.0493  79.1767  6578.0493  79.1767      810.9      4.9      810.9        4.9     0.0     0.0 
1 1 1   30   20    1 o    609.8    2.9    0.0000   0.0000          ?        ?  3718.7500  35.7572          ?        ?      609.8        2.9       ?       ? 
1 1 1   30   20    2 f    157.8    3.8    0.0000   0.0000          ?        ?   249.0234  12.1319          ?        ?      157.8        3.8       ?       ? 
1 1 1   30   20    3 o    421.8    2.5    0.0000   0.0000          ?        ?  1779.5598  21.0712          ?        ?      421.8        2.5       ?       ? 
1 1 1   30   20    4 o    705.2    3.3    0.0000   0.0000          ?        ?  4973.4453  46.6121          ?        ?      705.2        3.3       ?       ? 
1 1 1   30   20    5 o    543.0    2.8    0.0000   0.0000          ?        ?  2949.3313  30.0105          ?        ?      543.0        2.8       ?       ? 
1 1 1   30   20    6 o    354.1    2.7    0.0000   0.0000          ?        ?  1254.0564  19.1556          ?        ?      354.1        2.7       ?       ? 
1 1 1   30   20    7 o    522.4    2.7    0.0000   0.0000          ?        ?  2729.6799  28.7335          ?        ?      522.4        2.7       ?       ? 
1 1 1   30   20    8 o    530.5    2.5    0.0000   0.0000          ?        ?  2814.6033  26.8179          ?        ?      530.5        2.5       ?       ? 
1 1 1   30   20    9 o    222.9    2.6    0.0000   0.0000          ?        ?   496.7698  11.4934          ?        ?      222.9        2.6       ?       ? 
1 1 1   30   20   10 o    178.7    3.6    0.0000   0.0000          ?        ?   319.2608  12.7704          ?        ?      178.7        3.6       ?       ? 
1 1 1   30   20   11 f   1399.9    5.2    0.0000   0.0000          ?        ? 19605.8066 146.2215          ?        ?     1399.9        5.2       ?       ? 
1 1 1   30   20   12 o    415.9    2.5    0.0000   0.0000          ?        ?  1729.7550  20.4327          ?        ?      415.9        2.5       ?       ? 
1 1 1   30   20   13 o    408.4    2.2    0.0000   0.0000          ?        ?  1668.4569  17.8786          ?        ?      408.4        2.2       ?       ? 
1 1 1   30   20   14 o    149.7    3.2    0.0000   0.0000          ?        ?   224.1211   9.5778          ?        ?      149.7        3.2       ?       ? 
1 1 1   30   20   15 o    413.7    2.2    0.0000   0.0000          ?        ?  1711.2379  18.5171          ?        ?      413.7        2.2       ?       ? 
1 1 1   30   20   16 o    555.6    2.6    0.0000   0.0000          ?        ?  3087.2520  28.7335          ?        ?      555.6        2.6       ?       ? 
1 1 1   30   20   17 o    130.1    4.2    0.0000   0.0000          ?        ?   169.2082  10.8549          ?        ?      130.1        4.2       ?       ? 
1 1 1   30   20   18 o    313.1    2.3    0.0000   0.0000          ?        ?   980.1307  14.6860          ?        ?      313.1        2.3       ?       ? 
1 1 1   30   20   19 o    320.5    2.3    0.0000   0.0000          ?        ?  1027.3812  14.6860          ?        ?      320.5        2.3       ?       ? 
1 1 1   30   20   20 o    237.8    2.8    0.0000   0.0000          ?        ?   565.7302  13.4090          ?        ?      237.8        2.8       ?       ? 
1 1 1   30   20   21 o    648.9    2.8    0.0000   0.0000          ?        ?  4211.0503  35.7572          ?        ?      648.9        2.8       ?       ? 
1 1 1   30   20   22 o     90.7    6.7    0.0000   0.0000          ?        ?    82.3693  12.1319          ?        ?       90.7        6.7       ?       ? 
1 1 1   30   20   23 o    511.4    2.6    0.0000   0.0000          ?        ?  2615.3845  26.1794          ?        ?      511.4        2.6       ?       ? 
1 1 1   30   20   24 o    346.0    2.4    0.0000   0.0000          ?        ?  1197.2280  16.6016          ?        ?      346.0        2.4       ?       ? 
1 1 1   30   20   25 o    280.8    2.6    0.0000   0.0000          ?        ?   788.5742  14.6860          ?        ?      280.8        2.6       ?       ? 
1 1 1   30   20   26 f     95.2    6.7    0.0000   0.0000          ?        ?    90.6701  12.7704          ?        ?       95.2        6.7       ?       ? 
1 1 1   30   20   27 o    489.2    2.5    0.0000   0.0000          ?        ?  2393.1790  24.9023          ?        ?      489.2        2.5       ?       ? 
1 1 1   30   20   28 o    362.0    2.6    0.0000   0.0000          ?        ?  1310.8849  19.1556          ?        ?      362.0        2.6       ?       ? 
1 1 1   30   20   29 o    374.6    2.6    0.0000   0.0000          ?        ?  1403.4706  19.1556          ?        ?      374.6        2.6       ?       ? 
1 1 1   30   20   30 o    273.9    3.0    0.0000   0.0000          ?        ?   750.2629  16.6016          ?        ?      273.9        3.0       ?       ? 
1 1 1   30   20   31 o     22.9   10.8    0.0000   0.0000          ?        ?   -14.0475  12.7704          ?        ?       22.9       10.8       ?       ? 
1 1 1   30   20   32 o    133.6    5.5    0.0000   0.0000          ?        ?   178.7861  14.6860          ?        ?      133.6        5.5       ?       ? 
1 1 1   30   20   33 o    472.3    2.5    0.0000   0.0000          ?        ?  2230.9946  23.6253          ?        ?      472.3        2.5       ?       ? 
1 1 1   30   20   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   20   35 o    269.2    3.1    0.0000   0.0000          ?        ?   724.7220  16.6016          ?        ?      269.2        3.1       ?       ? 
1 1 1   30   20   36 f    163.5    4.9    0.0000   0.0000          ?        ?   267.5406  15.9630          ?        ?      163.5        4.9       ?       ? 
1 1 1   30   20   37 o    174.8    4.2    0.0000   0.0000          ?        ?   305.8519  14.6860          ?        ?      174.8        4.2       ?       ? 
1 1 1   30   20   38 o    335.8    2.9    0.0000   0.0000          ?        ?  1128.2677  19.1556          ?        ?      335.8        2.9       ?       ? 
1 1 1   30   20   39 o     25.5   11.9    0.0000   0.0000          ?        ?   -13.4090  14.6860          ?        ?       25.5       11.9       ?       ? 
1 1 1   30   20   40 o    213.7    3.6    0.0000   0.0000          ?        ?   457.1815  15.3245          ?        ?      213.7        3.6       ?       ? 
1 1 1   30   20   41 o    274.8    3.0    0.0000   0.0000          ?        ?   755.3711  16.6016          ?        ?      274.8        3.0       ?       ? 
1 1 1   30   20   42 o    238.0    3.5    0.0000   0.0000          ?        ?   567.0072  16.6016          ?        ?      238.0        3.5       ?       ? 
1 1 1   30   20   43 o    215.2    4.0    0.0000   0.0000          ?        ?   463.5667  17.2401          ?        ?      215.2        4.0       ?       ? 
1 1 1   30   20   44 o    130.7    6.4    0.0000   0.0000          ?        ?   171.1238  16.6016          ?        ?      130.7        6.4       ?       ? 
1 1 1   30   20   45 o    271.9    3.4    0.0000   0.0000          ?        ?   740.0466  18.5171          ?        ?      271.9        3.4       ?       ? 
1 1 1   30   20   46 o    232.0    3.9    0.0000   0.0000          ?        ?   538.9123  17.8786          ?        ?      232.0        3.9       ?       ? 
1 1 1   30   20   47 o    619.3    2.7    0.0000   0.0000          ?        ?  3837.5149  33.8416          ?        ?      619.3        2.7       ?       ? 
1 1 1   30   20   48 f    234.6    3.8    0.0000   0.0000          ?        ?   551.0442  17.8786          ?        ?      234.6        3.8       ?       ? 
1 1 1   30   20   49 o    320.1    3.3    0.0000   0.0000          ?        ?  1025.4658  21.0712          ?        ?      320.1        3.3       ?       ? 
1 1 1   30   20   50 o     61.7   14.7    0.0000   0.0000          ?        ?    40.2269  17.8786          ?        ?       61.7       14.7       ?       ? 
1 1 1   30   20   51 o    433.9    2.9    0.0000   0.0000          ?        ?  1884.2773  25.5409          ?        ?      433.9        2.9       ?       ? 
1 1 1   30   20   52 o    111.2    8.3    0.0000   0.0000          ?        ?   124.5117  18.5171          ?        ?      111.2        8.3       ?       ? 
1 1 1   30   20   53 o    139.7    6.6    0.0000   0.0000          ?        ?   196.0261  18.5171          ?        ?      139.7        6.6       ?       ? 
1 1 1   30   20   54 o    210.7    4.7    0.0000   0.0000          ?        ?   445.0496  19.7942          ?        ?      210.7        4.7       ?       ? 
1 1 1   30   20   55 o    262.3    3.9    0.0000   0.0000          ?        ?   688.9648  20.4327          ?        ?      262.3        3.9       ?       ? 
1 1 1   30   20   56 o    311.8    3.5    0.0000   0.0000          ?        ?   973.7455  21.7097          ?        ?      311.8        3.5       ?       ? 
1 1 1   30   20   57 o    104.5    9.2    0.0000   0.0000          ?        ?   110.4642  19.1556          ?        ?      104.5        9.2       ?       ? 
1 1 1   30   20   58 o    108.1    8.9    0.0000   0.0000          ?        ?   118.1265  19.1556          ?        ?      108.1        8.9       ?       ? 
1 1 1   30   20   59 o     47.2   16.5    0.0000   0.0000          ?        ?    21.0712  19.1556          ?        ?       47.2       16.5       ?       ? 
1 1 1   30   20   60 o    261.7    3.8    0.0000   0.0000          ?        ?   686.4108  19.7942          ?        ?      261.7        3.8       ?       ? 
1 1 1   30   20   61 o     30.1   13.7    0.0000   0.0000          ?        ?    -9.5778  17.8786          ?        ?       30.1       13.7       ?       ? 
1 1 1   30   20   62 o    187.8    5.1    0.0000   0.0000          ?        ?   354.3795  19.1556          ?        ?      187.8        5.1       ?       ? 
1 1 1   30   21    0 o    370.5    3.5 1373.4601  26.1794  1373.4601  26.1794  1373.4601  26.1794      370.5      3.5      370.5        3.5     0.0     0.0 
1 1 1   30   21    1 o    544.2    3.0    0.0000   0.0000          ?        ?  2962.1018  32.5646          ?        ?      544.2        3.0       ?       ? 
1 1 1   30   21    2 o    221.1    2.9    0.0000   0.0000          ?        ?   489.1075  12.7704          ?        ?      221.1        2.9       ?       ? 
1 1 1   30   21    3 o    196.9    3.1    0.0000   0.0000          ?        ?   387.5826  12.1319          ?        ?      196.9        3.1       ?       ? 
1 1 1   30   21    4 o    355.5    2.6    0.0000   0.0000          ?        ?  1264.2728  18.5171          ?        ?      355.5        2.6       ?       ? 
1 1 1   30   21    5 o    250.0    2.9    0.0000   0.0000          ?        ?   625.1127  14.6860          ?        ?      250.0        2.9       ?       ? 
1 1 1   30   21    6 o    151.0    3.6    0.0000   0.0000          ?        ?   227.9522  10.8549          ?        ?      151.0        3.6       ?       ? 
1 1 1   30   21    7 o    196.7    2.9    0.0000   0.0000          ?        ?   386.9441  11.4934          ?        ?      196.7        2.9       ?       ? 
1 1 1   30   21    8 o    293.9    2.5    0.0000   0.0000          ?        ?   863.9198  14.6860          ?        ?      293.9        2.5       ?       ? 
1 1 1   30   21    9 o    658.1    2.9    0.0000   0.0000          ?        ?  4331.7310  37.6728          ?        ?      658.1        2.9       ?       ? 
1 1 1   30   21   10 o    316.7    2.5    0.0000   0.0000          ?        ?  1003.1175  15.9630          ?        ?      316.7        2.5       ?       ? 
1 1 1   30   21   11 o    347.4    2.4    0.0000   0.0000          ?        ?  1206.8059  16.6016          ?        ?      347.4        2.4       ?       ? 
1 1 1   30   21   12 f    124.8    4.3    0.0000   0.0000          ?        ?   155.7993  10.8549          ?        ?      124.8        4.3       ?       ? 
1 1 1   30   21   13 o    440.6    2.3    0.0000   0.0000          ?        ?  1941.7443  20.4327          ?        ?      440.6        2.3       ?       ? 
1 1 1   30   21   14 o    378.6    2.2    0.0000   0.0000          ?        ?  1433.4811  16.6016          ?        ?      378.6        2.2       ?       ? 
1 1 1   30   21   15 o    565.0    2.4    0.0000   0.0000          ?        ?  3192.6082  27.4564          ?        ?      565.0        2.4       ?       ? 
1 1 1   30   21   16 o    286.2    2.2    0.0000   0.0000          ?        ?   819.2233  12.7704          ?        ?      286.2        2.2       ?       ? 
1 1 1   30   21   17 o    490.3    2.3    0.0000   0.0000          ?        ?  2404.0339  22.9868          ?        ?      490.3        2.3       ?       ? 
1 1 1   30   21   18 o    380.3    2.3    0.0000   0.0000          ?        ?  1446.2515  17.2401          ?        ?      380.3        2.3       ?       ? 
1 1 1   30   21   19 o    412.6    2.4    0.0000   0.0000          ?        ?  1702.9373  19.7942          ?        ?      412.6        2.4       ?       ? 
1 1 1   30   21   20 o    310.2    2.5    0.0000   0.0000          ?        ?   962.2521  15.3245          ?        ?      310.2        2.5       ?       ? 
1 1 1   30   21   21 o    172.7    3.5    0.0000   0.0000          ?        ?   298.1896  12.1319          ?        ?      172.7        3.5       ?       ? 
1 1 1   30   21   22 o    500.6    2.4    0.0000   0.0000          ?        ?  2506.1973  24.2638          ?        ?      500.6        2.4       ?       ? 
1 1 1   30   21   23 o    392.2    2.4    0.0000   0.0000          ?        ?  1538.8372  18.5171          ?        ?      392.2        2.4       ?       ? 
1 1 1   30   21   24 o    191.2    3.5    0.0000   0.0000          ?        ?   365.8729  13.4090          ?        ?      191.2        3.5       ?       ? 
1 1 1   30   21   25 o    245.5    2.9    0.0000   0.0000          ?        ?   602.7644  14.0475          ?        ?      245.5        2.9       ?       ? 
1 1 1   30   21   26 o    254.4    2.9    0.0000   0.0000          ?        ?   647.4609  14.6860          ?        ?      254.4        2.9       ?       ? 
1 1 1   30   21   27 o    155.3    4.1    0.0000   0.0000          ?        ?   241.3612  12.7704          ?        ?      155.3        4.1       ?       ? 
1 1 1   30   21   28 o    397.8    2.4    0.0000   0.0000          ?        ?  1582.8950  19.1556          ?        ?      397.8        2.4       ?       ? 
1 1 1   30   21   29 o    377.7    2.5    0.0000   0.0000          ?        ?  1427.0958  18.5171          ?        ?      377.7        2.5       ?       ? 
1 1 1   30   21   30 o    121.1    5.5    0.0000   0.0000          ?        ?   146.8600  13.4090          ?        ?      121.1        5.5       ?       ? 
1 1 1   30   21   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   21   32 o    168.7    4.5    0.0000   0.0000          ?        ?   284.7806  15.3245          ?        ?      168.7        4.5       ?       ? 
1 1 1   30   21   33 o    238.7    3.3    0.0000   0.0000          ?        ?   570.1998  15.9630          ?        ?      238.7        3.3       ?       ? 
1 1 1   30   21   34 o    255.3    3.4    0.0000   0.0000          ?        ?   651.9305  17.2401          ?        ?      255.3        3.4       ?       ? 
1 1 1   30   21   35 o    302.1    3.0    0.0000   0.0000          ?        ?   913.0859  17.8786          ?        ?      302.1        3.0       ?       ? 
1 1 1   30   21   36 o    432.5    2.7    0.0000   0.0000          ?        ?  1871.5070  23.6253          ?        ?      432.5        2.7       ?       ? 
1 1 1   30   21   37 o    114.3    6.4    0.0000   0.0000          ?        ?   130.8969  14.6860          ?        ?      114.3        6.4       ?       ? 
1 1 1   30   21   38 o    306.0    2.9    0.0000   0.0000          ?        ?   936.7112  17.8786          ?        ?      306.0        2.9       ?       ? 
1 1 1   30   21   39 o    392.0    2.7    0.0000   0.0000          ?        ?  1536.9215  21.0712          ?        ?      392.0        2.7       ?       ? 
1 1 1   30   21   40 o    365.0    2.7    0.0000   0.0000          ?        ?  1332.5946  19.7942          ?        ?      365.0        2.7       ?       ? 
1 1 1   30   21   41 o    141.2    5.9    0.0000   0.0000          ?        ?   199.8573  16.6016          ?        ?      141.2        5.9       ?       ? 
1 1 1   30   21   42 o    620.7    2.8    0.0000   0.0000          ?        ?  3854.7551  34.4802          ?        ?      620.7        2.8       ?       ? 
1 1 1   30   21   43 o    243.8    3.7    0.0000   0.0000          ?        ?   595.1021  17.8786          ?        ?      243.8        3.7       ?       ? 
1 1 1   30   21   44 o    242.4    3.7    0.0000   0.0000          ?        ?   588.0784  17.8786          ?        ?      242.4        3.7       ?       ? 
1 1 1   30   21   45 o    183.1    4.7    0.0000   0.0000          ?        ?   335.8624  17.2401          ?        ?      183.1        4.7       ?       ? 
1 1 1   30   21   46 o    191.3    4.7    0.0000   0.0000          ?        ?   366.5114  17.8786          ?        ?      191.3        4.7       ?       ? 
1 1 1   30   21   47 o    286.4    3.3    0.0000   0.0000          ?        ?   821.1389  19.1556          ?        ?      286.4        3.3       ?       ? 
1 1 1   30   21   48 o    245.1    3.8    0.0000   0.0000          ?        ?   601.4874  18.5171          ?        ?      245.1        3.8       ?       ? 
1 1 1   30   21   49 o    269.1    3.6    0.0000   0.0000          ?        ?   724.7220  19.1556          ?        ?      269.1        3.6       ?       ? 
1 1 1   30   21   50 o     44.7   16.1    0.0000   0.0000          ?        ?    17.2401  18.5171          ?        ?       44.7       16.1       ?       ? 
1 1 1   30   21   51 o    412.4    2.9    0.0000   0.0000          ?        ?  1701.6602  23.6253          ?        ?      412.4        2.9       ?       ? 
1 1 1   30   21   52 o    313.4    3.4    0.0000   0.0000          ?        ?   983.3233  21.0712          ?        ?      313.4        3.4       ?       ? 
1 1 1   30   21   53 o     79.7   11.6    0.0000   0.0000          ?        ?    64.4907  18.5171          ?        ?       79.7       11.6       ?       ? 
1 1 1   30   21   54 o    107.0    8.9    0.0000   0.0000          ?        ?   115.5724  19.1556          ?        ?      107.0        8.9       ?       ? 
1 1 1   30   21   55 o    203.2    4.6    0.0000   0.0000          ?        ?   413.7620  18.5171          ?        ?      203.2        4.6       ?       ? 
1 1 1   30   21   56 o    339.8    3.2    0.0000   0.0000          ?        ?  1156.3627  21.7097          ?        ?      339.8        3.2       ?       ? 
1 1 1   30   21   57 f     25.5   12.3    0.0000   0.0000          ?        ?   -27.4564  18.5171          ?        ?       25.5       12.3       ?       ? 
1 1 1   30   21   58 o    183.4    5.4    0.0000   0.0000          ?        ?   337.7780  19.7942          ?        ?      183.4        5.4       ?       ? 
1 1 1   30   21   59 o    122.3    8.1    0.0000   0.0000          ?        ?   151.3296  19.7942          ?        ?      122.3        8.1       ?       ? 
1 1 1   30   21   60 o     78.4   12.2    0.0000   0.0000          ?        ?    63.2136  19.1556          ?        ?       78.4       12.2       ?       ? 
1 1 1   30   21   61 o     51.1   16.2    0.0000   0.0000          ?        ?    27.4564  18.5171          ?        ?       51.1       16.2       ?       ? 
1 1 1   30   22    0 o    689.5    4.5 4755.7090  62.5751  4755.7090  62.5751  4755.7090  62.5751      689.5      4.5      689.5        4.5     0.0     0.0 
1 1 1   30   22    1 o    566.3    2.9    0.0000   0.0000          ?        ?  3207.2939  32.5646          ?        ?      566.3        2.9       ?       ? 
1 1 1   30   22    2 o    592.0    3.0    0.0000   0.0000          ?        ?  3505.4836  35.1187          ?        ?      592.0        3.0       ?       ? 
1 1 1   30   22    3 o    423.2    2.4    0.0000   0.0000          ?        ?  1791.0532  20.4327          ?        ?      423.2        2.4       ?       ? 
1 1 1   30   22    4 o    576.5    2.7    0.0000   0.0000          ?        ?  3324.1433  31.2876          ?        ?      576.5        2.7       ?       ? 
1 1 1   30   22    5 o    423.4    2.5    0.0000   0.0000          ?        ?  1792.9686  21.0712          ?        ?      423.4        2.5       ?       ? 
1 1 1   30   22    6 o    538.8    2.7    0.0000   0.0000          ?        ?  2903.3579  28.7335          ?        ?      538.8        2.7       ?       ? 
1 1 1   30   22    7 o    700.9    3.0    0.0000   0.0000          ?        ?  4914.0625  42.1424          ?        ?      700.9        3.0       ?       ? 
1 1 1   30   22    8 o    684.9    2.9    0.0000   0.0000          ?        ?  4691.2183  39.5883          ?        ?      684.9        2.9       ?       ? 
1 1 1   30   22    9 o    515.2    2.4    0.0000   0.0000          ?        ?  2654.9729  24.9023          ?        ?      515.2        2.4       ?       ? 
1 1 1   30   22   10 o    377.7    2.5    0.0000   0.0000          ?        ?  1426.4573  19.1556          ?        ?      377.7        2.5       ?       ? 
1 1 1   30   22   11 o    317.6    2.3    0.0000   0.0000          ?        ?  1008.8642  14.6860          ?        ?      317.6        2.3       ?       ? 
1 1 1   30   22   12 f    639.3    2.7    0.0000   0.0000          ?        ?  4087.1768  34.4802          ?        ?      639.3        2.7       ?       ? 
1 1 1   30   22   13 o    881.8    3.4    0.0000   0.0000          ?        ?  7778.4702  59.3825          ?        ?      881.8        3.4       ?       ? 
1 1 1   30   22   14 o    303.8    2.2    0.0000   0.0000          ?        ?   923.3023  13.4090          ?        ?      303.8        2.2       ?       ? 
1 1 1   30   22   15 o    192.1    2.5    0.0000   0.0000          ?        ?   369.0655   9.5778          ?        ?      192.1        2.5       ?       ? 
1 1 1   30   22   16 o    252.5    2.5    0.0000   0.0000          ?        ?   637.8831  12.7704          ?        ?      252.5        2.5       ?       ? 
1 1 1   30   22   17 o    518.1    2.4    0.0000   0.0000          ?        ?  2684.3450  24.9023          ?        ?      518.1        2.4       ?       ? 
1 1 1   30   22   18 o    322.2    2.3    0.0000   0.0000          ?        ?  1038.2362  14.6860          ?        ?      322.2        2.3       ?       ? 
1 1 1   30   22   19 o    233.2    2.6    0.0000   0.0000          ?        ?   544.0204  12.1319          ?        ?      233.2        2.6       ?       ? 
1 1 1   30   22   20 o     97.5    6.2    0.0000   0.0000          ?        ?    95.1397  12.1319          ?        ?       97.5        6.2       ?       ? 
1 1 1   30   22   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   22   22 o    332.4    2.5    0.0000   0.0000          ?        ?  1105.2810  16.6016          ?        ?      332.4        2.5       ?       ? 
1 1 1   30   22   23 o    287.3    2.6    0.0000   0.0000          ?        ?   825.6085  14.6860          ?        ?      287.3        2.6       ?       ? 
1 1 1   30   22   24 o    789.6    3.0    0.0000   0.0000          ?        ?  6237.0791  47.8891          ?        ?      789.6        3.0       ?       ? 
1 1 1   30   22   25 o     16.6    8.4    0.0000   0.0000          ?        ?   -35.7572  12.1319          ?        ?       16.6        8.4       ?       ? 
1 1 1   30   22   26 o    159.4    3.8    0.0000   0.0000          ?        ?   254.1316  12.1319          ?        ?      159.4        3.8       ?       ? 
1 1 1   30   22   27 f    515.8    2.5    0.0000   0.0000          ?        ?  2661.3582  25.5409          ?        ?      515.8        2.5       ?       ? 
1 1 1   30   22   28 o    401.6    2.6    0.0000   0.0000          ?        ?  1612.9056  21.0712          ?        ?      401.6        2.6       ?       ? 
1 1 1   30   22   29 o    186.0    3.8    0.0000   0.0000          ?        ?   346.0787  14.0475          ?        ?      186.0        3.8       ?       ? 
1 1 1   30   22   30 o    364.8    2.6    0.0000   0.0000          ?        ?  1331.3176  19.1556          ?        ?      364.8        2.6       ?       ? 
1 1 1   30   22   31 o     29.7   12.9    0.0000   0.0000          ?        ?    -1.9156  14.0475          ?        ?       29.7       12.9       ?       ? 
1 1 1   30   22   32 o    231.8    3.4    0.0000   0.0000          ?        ?   537.6352  15.9630          ?        ?      231.8        3.4       ?       ? 
1 1 1   30   22   33 o    364.5    2.6    0.0000   0.0000          ?        ?  1328.7635  19.1556          ?        ?      364.5        2.6       ?       ? 
1 1 1   30   22   34 o    183.7    4.2    0.0000   0.0000          ?        ?   337.7780  15.3245          ?        ?      183.7        4.2       ?       ? 
1 1 1   30   22   35 o    419.6    2.7    0.0000   0.0000          ?        ?  1761.0426  22.3483          ?        ?      419.6        2.7       ?       ? 
1 1 1   30   22   36 o    570.3    2.8    0.0000   0.0000          ?        ?  3253.9062  31.9261          ?        ?      570.3        2.8       ?       ? 
1 1 1   30   22   37 o    149.8    5.1    0.0000   0.0000          ?        ?   224.7596  15.3245          ?        ?      149.8        5.1       ?       ? 
1 1 1   30   22   38 o    193.2    4.3    0.0000   0.0000          ?        ?   373.5352  16.6016          ?        ?      193.2        4.3       ?       ? 
1 1 1   30   22   39 o    411.0    2.6    0.0000   0.0000          ?        ?  1690.1669  21.7097          ?        ?      411.0        2.6       ?       ? 
1 1 1   30   22   40 o    498.5    2.6    0.0000   0.0000          ?        ?  2485.7646  26.1794          ?        ?      498.5        2.6       ?       ? 
1 1 1   30   22   41 o    390.5    2.7    0.0000   0.0000          ?        ?  1525.4281  21.0712          ?        ?      390.5        2.7       ?       ? 
1 1 1   30   22   42 o    330.7    3.1    0.0000   0.0000          ?        ?  1094.4260  20.4327          ?        ?      330.7        3.1       ?       ? 
1 1 1   30   22   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   22   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   22   45 o    137.1    5.8    0.0000   0.0000          ?        ?   188.3639  15.9630          ?        ?      137.1        5.8       ?       ? 
1 1 1   30   22   46 o    141.2    5.9    0.0000   0.0000          ?        ?   199.8573  16.6016          ?        ?      141.2        5.9       ?       ? 
1 1 1   30   22   47 o    331.8    3.1    0.0000   0.0000          ?        ?  1101.4498  20.4327          ?        ?      331.8        3.1       ?       ? 
1 1 1   30   22   48 o    442.3    2.8    0.0000   0.0000          ?        ?  1957.7074  24.9023          ?        ?      442.3        2.8       ?       ? 
1 1 1   30   22   49 f    236.5    3.9    0.0000   0.0000          ?        ?   559.9835  18.5171          ?        ?      236.5        3.9       ?       ? 
1 1 1   30   22   50 o    257.6    3.8    0.0000   0.0000          ?        ?   664.7010  19.7942          ?        ?      257.6        3.8       ?       ? 
1 1 1   30   22   51 o     60.1   16.1    0.0000   0.0000          ?        ?    38.3113  19.7942          ?        ?       60.1       16.1       ?       ? 
1 1 1   30   22   52 o     91.0    9.8    0.0000   0.0000          ?        ?    83.6463  17.8786          ?        ?       91.0        9.8       ?       ? 
1 1 1   30   22   53 o     19.3    9.7    0.0000   0.0000          ?        ?   -58.7440  17.8786          ?        ?       19.3        9.7       ?       ? 
1 1 1   30   22   54 o    182.1    5.3    0.0000   0.0000          ?        ?   332.6698  19.1556          ?        ?      182.1        5.3       ?       ? 
1 1 1   30   22   55 o    221.0    4.3    0.0000   0.0000          ?        ?   489.7461  19.1556          ?        ?      221.0        4.3       ?       ? 
1 1 1   30   22   56 o    187.2    5.1    0.0000   0.0000          ?        ?   351.8254  19.1556          ?        ?      187.2        5.1       ?       ? 
1 1 1   30   22   57 o    110.1    8.4    0.0000   0.0000          ?        ?   122.5962  18.5171          ?        ?      110.1        8.4       ?       ? 
1 1 1   30   22   58 f     41.9   15.9    0.0000   0.0000          ?        ?    13.4090  18.5171          ?        ?       41.9       15.9       ?       ? 
1 1 1   30   22   59 o    259.2    3.9    0.0000   0.0000          ?        ?   673.6403  20.4327          ?        ?      259.2        3.9       ?       ? 
1 1 1   30   22   60 o    129.6    7.6    0.0000   0.0000          ?        ?   169.8468  19.7942          ?        ?      129.6        7.6       ?       ? 
1 1 1   30   23    0 o    137.7    8.9  192.1950  24.2638   192.1950  24.2638   192.1950  24.2638      137.7      8.9      137.7        8.9     0.0     0.0 
1 1 1   30   23    1 o    323.5    3.1    0.0000   0.0000          ?        ?  1046.5369  19.7942          ?        ?      323.5        3.1       ?       ? 
1 1 1   30   23    2 o    479.6    3.0    0.0000   0.0000          ?        ?  2300.5933  28.7335          ?        ?      479.6        3.0       ?       ? 
1 1 1   30   23    3 o    806.6    3.8    0.0000   0.0000          ?        ?  6508.4507  61.2981          ?        ?      806.6        3.8       ?       ? 
1 1 1   30   23    4 o    632.4    3.2    0.0000   0.0000          ?        ?  4000.3379  40.8654          ?        ?      632.4        3.2       ?       ? 
1 1 1   30   23    5 o    383.6    2.7    0.0000   0.0000          ?        ?  1471.7924  21.0712          ?        ?      383.6        2.7       ?       ? 
1 1 1   30   23    6 o    561.6    3.1    0.0000   0.0000          ?        ?  3154.9353  35.1187          ?        ?      561.6        3.1       ?       ? 
1 1 1   30   23    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   23    8 o    343.3    2.5    0.0000   0.0000          ?        ?  1178.7109  17.2401          ?        ?      343.3        2.5       ?       ? 
1 1 1   30   23    9 o    616.0    2.7    0.0000   0.0000          ?        ?  3794.7339  33.2031          ?        ?      616.0        2.7       ?       ? 
1 1 1   30   23   10 o    218.2    2.5    0.0000   0.0000          ?        ?   476.3371  10.8549          ?        ?      218.2        2.5       ?       ? 
1 1 1   30   23   11 o    176.5    3.1    0.0000   0.0000          ?        ?   311.5985  10.8549          ?        ?      176.5        3.1       ?       ? 
1 1 1   30   23   12 o    312.7    2.3    0.0000   0.0000          ?        ?   978.2151  14.6860          ?        ?      312.7        2.3       ?       ? 
1 1 1   30   23   13 o    106.0    5.1    0.0000   0.0000          ?        ?   112.3798  10.8549          ?        ?      106.0        5.1       ?       ? 
1 1 1   30   23   14 o    482.9    2.4    0.0000   0.0000          ?        ?  2331.8811  22.9868          ?        ?      482.9        2.4       ?       ? 
1 1 1   30   23   15 o    447.6    2.3    0.0000   0.0000          ?        ?  2003.6808  20.4327          ?        ?      447.6        2.3       ?       ? 
1 1 1   30   23   16 o    228.2    2.5    0.0000   0.0000          ?        ?   521.0336  11.4934          ?        ?      228.2        2.5       ?       ? 
1 1 1   30   23   17 o    449.4    2.3    0.0000   0.0000          ?        ?  2019.6438  20.4327          ?        ?      449.4        2.3       ?       ? 
1 1 1   30   23   18 o    462.9    2.3    0.0000   0.0000          ?        ?  2142.8787  21.7097          ?        ?      462.9        2.3       ?       ? 
1 1 1   30   23   19 o    285.3    2.5    0.0000   0.0000          ?        ?   814.1151  14.0475          ?        ?      285.3        2.5       ?       ? 
1 1 1   30   23   20 o    508.0    2.4    0.0000   0.0000          ?        ?  2581.5430  24.2638          ?        ?      508.0        2.4       ?       ? 
1 1 1   30   23   21 o    290.7    2.4    0.0000   0.0000          ?        ?   845.4026  14.0475          ?        ?      290.7        2.4       ?       ? 
1 1 1   30   23   22 o    455.0    2.4    0.0000   0.0000          ?        ?  2070.7256  21.7097          ?        ?      455.0        2.4       ?       ? 
1 1 1   30   23   23 o    247.5    3.0    0.0000   0.0000          ?        ?   612.9808  14.6860          ?        ?      247.5        3.0       ?       ? 
1 1 1   30   23   24 o    185.3    3.8    0.0000   0.0000          ?        ?   343.5246  14.0475          ?        ?      185.3        3.8       ?       ? 
1 1 1   30   23   25 o    580.7    2.5    0.0000   0.0000          ?        ?  3372.6714  29.3720          ?        ?      580.7        2.5       ?       ? 
1 1 1   30   23   26 o    362.6    2.5    0.0000   0.0000          ?        ?  1315.3545  17.8786          ?        ?      362.6        2.5       ?       ? 
1 1 1   30   23   27 o     18.5    9.2    0.0000   0.0000          ?        ?   -33.8416  13.4090          ?        ?       18.5        9.2       ?       ? 
1 1 1   30   23   28 o    241.3    2.9    0.0000   0.0000          ?        ?   582.3317  14.0475          ?        ?      241.3        2.9       ?       ? 
1 1 1   30   23   29 o    249.2    2.9    0.0000   0.0000          ?        ?   621.2816  14.6860          ?        ?      249.2        2.9       ?       ? 
1 1 1   30   23   30 o    371.6    2.5    0.0000   0.0000          ?        ?  1381.1223  18.5171          ?        ?      371.6        2.5       ?       ? 
1 1 1   30   23   31 o    301.4    2.9    0.0000   0.0000          ?        ?   908.6163  17.2401          ?        ?      301.4        2.9       ?       ? 
1 1 1   30   23   32 o    308.9    2.7    0.0000   0.0000          ?        ?   954.5898  16.6016          ?        ?      308.9        2.7       ?       ? 
1 1 1   30   23   33 o     20.1    9.9    0.0000   0.0000          ?        ?   -30.0105  14.0475          ?        ?       20.1        9.9       ?       ? 
1 1 1   30   23   34 o    265.9    3.1    0.0000   0.0000          ?        ?   707.4820  16.6016          ?        ?      265.9        3.1       ?       ? 
1 1 1   30   23   35 o    176.3    4.3    0.0000   0.0000          ?        ?   310.9600  15.3245          ?        ?      176.3        4.3       ?       ? 
1 1 1   30   23   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   23   37 o    262.4    3.3    0.0000   0.0000          ?        ?   688.9648  17.2401          ?        ?      262.4        3.3       ?       ? 
1 1 1   30   23   38 o    376.8    2.7    0.0000   0.0000          ?        ?  1420.7106  20.4327          ?        ?      376.8        2.7       ?       ? 
1 1 1   30   23   39 o    312.5    2.9    0.0000   0.0000          ?        ?   976.9381  17.8786          ?        ?      312.5        2.9       ?       ? 
1 1 1   30   23   40 o    218.3    3.7    0.0000   0.0000          ?        ?   476.9756  15.9630          ?        ?      218.3        3.7       ?       ? 
1 1 1   30   23   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   23   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   23   43 o     19.7    9.9    0.0000   0.0000          ?        ?   -56.1899  17.8786          ?        ?       19.7        9.9       ?       ? 
1 1 1   30   23   44 o    259.7    3.7    0.0000   0.0000          ?        ?   674.9174  19.1556          ?        ?      259.7        3.7       ?       ? 
1 1 1   30   23   45 o    230.9    4.0    0.0000   0.0000          ?        ?   533.8041  18.5171          ?        ?      230.9        4.0       ?       ? 
1 1 1   30   23   46 o    240.4    3.9    0.0000   0.0000          ?        ?   578.5006  18.5171          ?        ?      240.4        3.9       ?       ? 
1 1 1   30   23   47 o    198.6    4.8    0.0000   0.0000          ?        ?   395.2449  19.1556          ?        ?      198.6        4.8       ?       ? 
1 1 1   30   23   48 o     61.1   15.6    0.0000   0.0000          ?        ?    39.5883  19.1556          ?        ?       61.1       15.6       ?       ? 
1 1 1   30   23   49 o    262.0    3.7    0.0000   0.0000          ?        ?   687.0493  19.1556          ?        ?      262.0        3.7       ?       ? 
1 1 1   30   23   50 o    276.4    3.7    0.0000   0.0000          ?        ?   764.9489  20.4327          ?        ?      276.4        3.7       ?       ? 
1 1 1   30   23   51 o    147.9    6.3    0.0000   0.0000          ?        ?   219.6514  18.5171          ?        ?      147.9        6.3       ?       ? 
1 1 1   30   23   52 o    287.1    3.6    0.0000   0.0000          ?        ?   825.6085  20.4327          ?        ?      287.1        3.6       ?       ? 
1 1 1   30   23   53 o    100.9    9.2    0.0000   0.0000          ?        ?   102.8020  18.5171          ?        ?      100.9        9.2       ?       ? 
1 1 1   30   23   54 o     84.0   10.6    0.0000   0.0000          ?        ?    71.5144  17.8786          ?        ?       84.0       10.6       ?       ? 
1 1 1   30   23   55 o    181.9    5.1    0.0000   0.0000          ?        ?   332.0312  18.5171          ?        ?      181.9        5.1       ?       ? 
1 1 1   30   23   56 o    210.6    4.7    0.0000   0.0000          ?        ?   445.0496  19.7942          ?        ?      210.6        4.7       ?       ? 
1 1 1   30   23   57 o    232.4    4.0    0.0000   0.0000          ?        ?   541.4664  18.5171          ?        ?      232.4        4.0       ?       ? 
1 1 1   30   23   58 o     60.4   15.7    0.0000   0.0000          ?        ?    39.5883  19.1556          ?        ?       60.4       15.7       ?       ? 
1 1 1   30   23   59 o    342.6    3.1    0.0000   0.0000          ?        ?  1176.1569  21.0712          ?        ?      342.6        3.1       ?       ? 
1 1 1   30   24    0 o     68.2   20.9   58.1055  24.9023    58.1055  24.9023    58.1055  24.9023       68.2     20.9       68.2       20.9     0.0     0.0 
1 1 1   30   24    1 o    339.2    3.5    0.0000   0.0000          ?        ?  1150.6160  23.6253          ?        ?      339.2        3.5       ?       ? 
1 1 1   30   24    2 o    444.7    3.3    0.0000   0.0000          ?        ?  1978.1399  29.3720          ?        ?      444.7        3.3       ?       ? 
1 1 1   30   24    3 o    607.7    3.4    0.0000   0.0000          ?        ?  3693.8477  40.8654          ?        ?      607.7        3.4       ?       ? 
1 1 1   30   24    4 o    745.6    3.9    0.0000   0.0000          ?        ?  5561.5234  58.7440          ?        ?      745.6        3.9       ?       ? 
1 1 1   30   24    5 o    308.2    3.3    0.0000   0.0000          ?        ?   950.1202  20.4327          ?        ?      308.2        3.3       ?       ? 
1 1 1   30   24    6 o    362.9    2.7    0.0000   0.0000          ?        ?  1317.2701  19.7942          ?        ?      362.9        2.7       ?       ? 
1 1 1   30   24    7 f    287.4    3.4    0.0000   0.0000          ?        ?   826.2469  19.7942          ?        ?      287.4        3.4       ?       ? 
1 1 1   30   24    8 o    570.6    3.2    0.0000   0.0000          ?        ?  3256.4602  37.0343          ?        ?      570.6        3.2       ?       ? 
1 1 1   30   24    9 o    353.8    2.3    0.0000   0.0000          ?        ?  1252.1410  15.9630          ?        ?      353.8        2.3       ?       ? 
1 1 1   30   24   10 o    240.6    2.3    0.0000   0.0000          ?        ?   579.1391  10.8549          ?        ?      240.6        2.3       ?       ? 
1 1 1   30   24   11 o    353.6    2.3    0.0000   0.0000          ?        ?  1250.2253  15.9630          ?        ?      353.6        2.3       ?       ? 
1 1 1   30   24   12 o     83.4    5.7    0.0000   0.0000          ?        ?    69.5989   9.5778          ?        ?       83.4        5.7       ?       ? 
1 1 1   30   24   13 o    480.1    2.6    0.0000   0.0000          ?        ?  2305.0630  24.9023          ?        ?      480.1        2.6       ?       ? 
1 1 1   30   24   14 o    259.3    2.1    0.0000   0.0000          ?        ?   672.3633  10.8549          ?        ?      259.3        2.1       ?       ? 
1 1 1   30   24   15 o    473.6    2.4    0.0000   0.0000          ?        ?  2243.1265  22.3483          ?        ?      473.6        2.4       ?       ? 
1 1 1   30   24   16 o    518.5    2.4    0.0000   0.0000          ?        ?  2688.8147  24.9023          ?        ?      518.5        2.4       ?       ? 
1 1 1   30   24   17 o    199.7    2.7    0.0000   0.0000          ?        ?   399.0760  10.8549          ?        ?      199.7        2.7       ?       ? 
1 1 1   30   24   18 o     59.7    8.0    0.0000   0.0000          ?        ?    35.7572   9.5778          ?        ?       59.7        8.0       ?       ? 
1 1 1   30   24   19 f     60.8    8.4    0.0000   0.0000          ?        ?    37.0343  10.2163          ?        ?       60.8        8.4       ?       ? 
1 1 1   30   24   20 o    671.7    2.7    0.0000   0.0000          ?        ?  4513.0708  36.3957          ?        ?      671.7        2.7       ?       ? 
1 1 1   30   24   21 o    265.1    2.5    0.0000   0.0000          ?        ?   703.0123  13.4090          ?        ?      265.1        2.5       ?       ? 
1 1 1   30   24   22 o    135.3    4.2    0.0000   0.0000          ?        ?   183.2557  11.4934          ?        ?      135.3        4.2       ?       ? 
1 1 1   30   24   23 o    533.7    2.5    0.0000   0.0000          ?        ?  2849.0835  26.1794          ?        ?      533.7        2.5       ?       ? 
1 1 1   30   24   24 o    700.7    2.7    0.0000   0.0000          ?        ?  4910.8696  38.3113          ?        ?      700.7        2.7       ?       ? 
1 1 1   30   24   25 f    118.2    5.4    0.0000   0.0000          ?        ?   139.8362  12.7704          ?        ?      118.2        5.4       ?       ? 
1 1 1   30   24   26 o    746.0    3.0    0.0000   0.0000          ?        ?  5566.6313  44.6965          ?        ?      746.0        3.0       ?       ? 
1 1 1   30   24   27 o    487.7    2.4    0.0000   0.0000          ?        ?  2379.1316  23.6253          ?        ?      487.7        2.4       ?       ? 
1 1 1   30   24   28 o    326.1    2.5    0.0000   0.0000          ?        ?  1063.7771  16.6016          ?        ?      326.1        2.5       ?       ? 
1 1 1   30   24   29 o     63.8    9.5    0.0000   0.0000          ?        ?    40.8654  12.1319          ?        ?       63.8        9.5       ?       ? 
1 1 1   30   24   30 o    348.1    2.6    0.0000   0.0000          ?        ?  1211.9141  17.8786          ?        ?      348.1        2.6       ?       ? 
1 1 1   30   24   31 o    315.6    2.7    0.0000   0.0000          ?        ?   996.0938  17.2401          ?        ?      315.6        2.7       ?       ? 
1 1 1   30   24   32 o     37.5   13.7    0.0000   0.0000          ?        ?    11.4934  13.4090          ?        ?       37.5       13.7       ?       ? 
1 1 1   30   24   33 o    319.2    2.7    0.0000   0.0000          ?        ?  1019.0806  17.2401          ?        ?      319.2        2.7       ?       ? 
1 1 1   30   24   34 o    231.0    3.5    0.0000   0.0000          ?        ?   533.8041  15.9630          ?        ?      231.0        3.5       ?       ? 
1 1 1   30   24   35 o    406.2    2.7    0.0000   0.0000          ?        ?  1650.5784  21.7097          ?        ?      406.2        2.7       ?       ? 
1 1 1   30   24   36 f    224.2    3.6    0.0000   0.0000          ?        ?   503.1551  15.9630          ?        ?      224.2        3.6       ?       ? 
1 1 1   30   24   37 o    135.0    6.1    0.0000   0.0000          ?        ?   182.6172  16.6016          ?        ?      135.0        6.1       ?       ? 
1 1 1   30   24   38 o     31.1   13.6    0.0000   0.0000          ?        ?    -3.1926  15.9630          ?        ?       31.1       13.6       ?       ? 
1 1 1   30   24   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   24   40 o    118.1    6.8    0.0000   0.0000          ?        ?   139.8362  15.9630          ?        ?      118.1        6.8       ?       ? 
1 1 1   30   24   41 f    285.6    3.2    0.0000   0.0000          ?        ?   816.0306  18.5171          ?        ?      285.6        3.2       ?       ? 
1 1 1   30   24   42 o    168.4    4.7    0.0000   0.0000          ?        ?   284.1421  15.9630          ?        ?      168.4        4.7       ?       ? 
1 1 1   30   24   43 o    345.6    2.9    0.0000   0.0000          ?        ?  1195.3125  19.7942          ?        ?      345.6        2.9       ?       ? 
1 1 1   30   24   44 o     20.2   10.1    0.0000   0.0000          ?        ?   -44.0580  16.6016          ?        ?       20.2       10.1       ?       ? 
1 1 1   30   24   45 o    104.8    8.2    0.0000   0.0000          ?        ?   110.4642  17.2401          ?        ?      104.8        8.2       ?       ? 
1 1 1   30   24   46 o    101.1    8.5    0.0000   0.0000          ?        ?   102.8020  17.2401          ?        ?      101.1        8.5       ?       ? 
1 1 1   30   24   47 o    207.6    4.2    0.0000   0.0000          ?        ?   431.6406  17.2401          ?        ?      207.6        4.2       ?       ? 
1 1 1   30   24   48 o    282.6    3.5    0.0000   0.0000          ?        ?   799.4291  19.7942          ?        ?      282.6        3.5       ?       ? 
1 1 1   30   24   49 o    274.2    3.6    0.0000   0.0000          ?        ?   752.8170  19.7942          ?        ?      274.2        3.6       ?       ? 
1 1 1   30   24   50 o    183.4    4.9    0.0000   0.0000          ?        ?   337.1394  17.8786          ?        ?      183.4        4.9       ?       ? 
1 1 1   30   24   51 o     78.9   11.3    0.0000   0.0000          ?        ?    63.2136  17.8786          ?        ?       78.9       11.3       ?       ? 
1 1 1   30   24   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   24   53 o     78.0   11.9    0.0000   0.0000          ?        ?    61.9366  18.5171          ?        ?       78.0       11.9       ?       ? 
1 1 1   30   24   54 o    123.1    7.3    0.0000   0.0000          ?        ?   152.6067  17.8786          ?        ?      123.1        7.3       ?       ? 
1 1 1   30   24   55 o     83.3   11.5    0.0000   0.0000          ?        ?    70.8759  19.1556          ?        ?       83.3       11.5       ?       ? 
1 1 1   30   24   56 o    270.6    3.7    0.0000   0.0000          ?        ?   733.6614  19.7942          ?        ?      270.6        3.7       ?       ? 
1 1 1   30   24   57 f     96.7    9.9    0.0000   0.0000          ?        ?    95.1397  19.1556          ?        ?       96.7        9.9       ?       ? 
1 1 1   30   24   58 o    143.8    6.9    0.0000   0.0000          ?        ?   208.7966  19.7942          ?        ?      143.8        6.9       ?       ? 
1 1 1   30   25    0 o    179.8    6.9  325.0075  24.9023   325.0075  24.9023   325.0075  24.9023      179.8      6.9      179.8        6.9     0.0     0.0 
1 1 1   30   25    1 o    417.9    3.1    0.0000   0.0000          ?        ?  1746.9952  26.1794          ?        ?      417.9        3.1       ?       ? 
1 1 1   30   25    2 o    769.5    3.8    0.0000   0.0000          ?        ?  5924.2036  58.7440          ?        ?      769.5        3.8       ?       ? 
1 1 1   30   25    3 o    350.0    3.6    0.0000   0.0000          ?        ?  1225.3230  24.9023          ?        ?      350.0        3.6       ?       ? 
1 1 1   30   25    4 o    262.7    3.8    0.0000   0.0000          ?        ?   690.2419  19.7942          ?        ?      262.7        3.8       ?       ? 
1 1 1   30   25    5 o    143.3    6.2    0.0000   0.0000          ?        ?   205.6040  17.8786          ?        ?      143.3        6.2       ?       ? 
1 1 1   30   25    6 f    602.1    3.3    0.0000   0.0000          ?        ?  3626.8027  39.5883          ?        ?      602.1        3.3       ?       ? 
1 1 1   30   25    7 o    581.7    3.0    0.0000   0.0000          ?        ?  3384.1646  35.1187          ?        ?      581.7        3.0       ?       ? 
1 1 1   30   25    8 o    678.9    3.2    0.0000   0.0000          ?        ?  4610.7646  43.4195          ?        ?      678.9        3.2       ?       ? 
1 1 1   30   25    9 o    227.4    4.6    0.0000   0.0000          ?        ?   517.2025  21.0712          ?        ?      227.4        4.6       ?       ? 
1 1 1   30   25   10 o    585.7    2.8    0.0000   0.0000          ?        ?  3431.4153  32.5646          ?        ?      585.7        2.8       ?       ? 
1 1 1   30   25   11 o    459.6    2.4    0.0000   0.0000          ?        ?  2112.2295  22.3483          ?        ?      459.6        2.4       ?       ? 
1 1 1   30   25   12 o    642.4    2.8    0.0000   0.0000          ?        ?  4127.4038  36.3957          ?        ?      642.4        2.8       ?       ? 
1 1 1   30   25   13 o    484.4    2.5    0.0000   0.0000          ?        ?  2346.5669  24.2638          ?        ?      484.4        2.5       ?       ? 
1 1 1   30   25   14 o    268.3    2.5    0.0000   0.0000          ?        ?   720.2524  13.4090          ?        ?      268.3        2.5       ?       ? 
1 1 1   30   25   15 o    523.5    2.4    0.0000   0.0000          ?        ?  2741.1733  25.5409          ?        ?      523.5        2.4       ?       ? 
1 1 1   30   25   16 o    527.6    2.4    0.0000   0.0000          ?        ?  2784.5928  25.5409          ?        ?      527.6        2.4       ?       ? 
1 1 1   30   25   17 o    150.1    3.2    0.0000   0.0000          ?        ?   225.3981   9.5778          ?        ?      150.1        3.2       ?       ? 
1 1 1   30   25   18 o    318.1    2.3    0.0000   0.0000          ?        ?  1012.0568  14.6860          ?        ?      318.1        2.3       ?       ? 
1 1 1   30   25   19 o    149.9    3.8    0.0000   0.0000          ?        ?   224.7596  11.4934          ?        ?      149.9        3.8       ?       ? 
1 1 1   30   25   20 o    364.2    2.4    0.0000   0.0000          ?        ?  1326.8479  17.2401          ?        ?      364.2        2.4       ?       ? 
1 1 1   30   25   21 o    653.6    2.6    0.0000   0.0000          ?        ?  4273.6250  34.4802          ?        ?      653.6        2.6       ?       ? 
1 1 1   30   25   22 o    406.7    2.4    0.0000   0.0000          ?        ?  1654.4095  19.7942          ?        ?      406.7        2.4       ?       ? 
1 1 1   30   25   23 o    289.1    2.5    0.0000   0.0000          ?        ?   835.8248  14.6860          ?        ?      289.1        2.5       ?       ? 
1 1 1   30   25   24 o    397.6    2.5    0.0000   0.0000          ?        ?  1581.6180  19.7942          ?        ?      397.6        2.5       ?       ? 
1 1 1   30   25   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   25   26 o    243.1    3.0    0.0000   0.0000          ?        ?   591.2710  14.6860          ?        ?      243.1        3.0       ?       ? 
1 1 1   30   25   27 o    512.9    2.6    0.0000   0.0000          ?        ?  2631.3477  26.1794          ?        ?      512.9        2.6       ?       ? 
1 1 1   30   25   28 o     42.4   13.4    0.0000   0.0000          ?        ?    17.8786  12.7704          ?        ?       42.4       13.4       ?       ? 
1 1 1   30   25   29 o     30.0   12.8    0.0000   0.0000          ?        ?     0.0000  13.4090          ?        ?       30.0       12.8       ?       ? 
1 1 1   30   25   30 o    300.5    2.8    0.0000   0.0000          ?        ?   903.5081  16.6016          ?        ?      300.5        2.8       ?       ? 
1 1 1   30   25   31 o    186.3    3.8    0.0000   0.0000          ?        ?   347.3558  14.0475          ?        ?      186.3        3.8       ?       ? 
1 1 1   30   25   32 o     78.9    9.3    0.0000   0.0000          ?        ?    62.5751  14.6860          ?        ?       78.9        9.3       ?       ? 
1 1 1   30   25   33 o    161.9    4.3    0.0000   0.0000          ?        ?   262.4324  14.0475          ?        ?      161.9        4.3       ?       ? 
1 1 1   30   25   34 o    501.7    2.6    0.0000   0.0000          ?        ?  2518.3293  26.1794          ?        ?      501.7        2.6       ?       ? 
1 1 1   30   25   35 o    221.4    3.8    0.0000   0.0000          ?        ?   490.3846  16.6016          ?        ?      221.4        3.8       ?       ? 
1 1 1   30   25   36 o    332.7    2.8    0.0000   0.0000          ?        ?  1107.1964  18.5171          ?        ?      332.7        2.8       ?       ? 
1 1 1   30   25   37 o     18.1    9.1    0.0000   0.0000          ?        ?   -49.1662  15.3245          ?        ?       18.1        9.1       ?       ? 
1 1 1   30   25   38 o     46.1   14.7    0.0000   0.0000          ?        ?    21.0712  15.3245          ?        ?       46.1       14.7       ?       ? 
1 1 1   30   25   39 o    260.4    3.3    0.0000   0.0000          ?        ?   678.7485  17.2401          ?        ?      260.4        3.3       ?       ? 
1 1 1   30   25   40 o    259.1    3.3    0.0000   0.0000          ?        ?   671.7247  17.2401          ?        ?      259.1        3.3       ?       ? 
1 1 1   30   25   41 o     90.2    8.9    0.0000   0.0000          ?        ?    81.7308  15.9630          ?        ?       90.2        8.9       ?       ? 
1 1 1   30   25   42 o    188.6    4.4    0.0000   0.0000          ?        ?   356.2951  16.6016          ?        ?      188.6        4.4       ?       ? 
1 1 1   30   25   43 o     42.8   15.3    0.0000   0.0000          ?        ?    15.9630  16.6016          ?        ?       42.8       15.3       ?       ? 
1 1 1   30   25   44 o     41.9   15.3    0.0000   0.0000          ?        ?    14.6860  16.6016          ?        ?       41.9       15.3       ?       ? 
1 1 1   30   25   45 o    274.0    3.4    0.0000   0.0000          ?        ?   751.5399  18.5171          ?        ?      274.0        3.4       ?       ? 
1 1 1   30   25   46 o    180.8    4.9    0.0000   0.0000          ?        ?   327.5616  17.8786          ?        ?      180.8        4.9       ?       ? 
1 1 1   30   25   47 o    187.5    4.8    0.0000   0.0000          ?        ?   352.4639  17.8786          ?        ?      187.5        4.8       ?       ? 
1 1 1   30   25   48 o    195.2    4.6    0.0000   0.0000          ?        ?   381.8359  17.8786          ?        ?      195.2        4.6       ?       ? 
1 1 1   30   25   49 o     57.1   15.7    0.0000   0.0000          ?        ?    34.4802  18.5171          ?        ?       57.1       15.7       ?       ? 
1 1 1   30   25   50 o    234.1    4.1    0.0000   0.0000          ?        ?   549.1286  19.1556          ?        ?      234.1        4.1       ?       ? 
1 1 1   30   25   51 o    266.5    3.6    0.0000   0.0000          ?        ?   711.3131  19.1556          ?        ?      266.5        3.6       ?       ? 
1 1 1   30   25   52 o    276.2    3.6    0.0000   0.0000          ?        ?   764.3104  19.7942          ?        ?      276.2        3.6       ?       ? 
1 1 1   30   25   53 f    110.2    8.4    0.0000   0.0000          ?        ?   122.5962  18.5171          ?        ?      110.2        8.4       ?       ? 
1 1 1   30   25   54 o    237.0    4.2    0.0000   0.0000          ?        ?   563.1760  19.7942          ?        ?      237.0        4.2       ?       ? 
1 1 1   30   25   55 o    204.4    4.7    0.0000   0.0000          ?        ?   419.5087  19.1556          ?        ?      204.4        4.7       ?       ? 
1 1 1   30   25   56 o     79.3   11.7    0.0000   0.0000          ?        ?    64.4907  18.5171          ?        ?       79.3       11.7       ?       ? 
1 1 1   30   25   57 o     71.3   13.5    0.0000   0.0000          ?        ?    54.2743  18.5171          ?        ?       71.3       13.5       ?       ? 
1 1 1   30   26    0 o     24.3   16.6  -12.7704  24.2638   -12.7704  24.2638   -12.7704  24.2638       24.3     16.6       24.3       16.6     0.0     0.0 
1 1 1   30   26    1 o    223.3    4.3    0.0000   0.0000          ?        ?   498.6854  19.1556          ?        ?      223.3        4.3       ?       ? 
1 1 1   30   26    2 o    407.4    3.1    0.0000   0.0000          ?        ?  1660.1562  25.5409          ?        ?      407.4        3.1       ?       ? 
1 1 1   30   26    3 o    366.6    3.1    0.0000   0.0000          ?        ?  1344.0880  22.9868          ?        ?      366.6        3.1       ?       ? 
1 1 1   30   26    4 o    206.3    4.3    0.0000   0.0000          ?        ?   425.8939  17.8786          ?        ?      206.3        4.3       ?       ? 
1 1 1   30   26    5 o    269.7    3.7    0.0000   0.0000          ?        ?   727.9147  19.7942          ?        ?      269.7        3.7       ?       ? 
1 1 1   30   26    6 o    213.6    4.5    0.0000   0.0000          ?        ?   456.5430  19.1556          ?        ?      213.6        4.5       ?       ? 
1 1 1   30   26    7 f    247.8    3.0    0.0000   0.0000          ?        ?   614.2578  14.6860          ?        ?      247.8        3.0       ?       ? 
1 1 1   30   26    8 o    567.1    3.3    0.0000   0.0000          ?        ?  3217.5105  37.0343          ?        ?      567.1        3.3       ?       ? 
1 1 1   30   26    9 o    317.4    2.7    0.0000   0.0000          ?        ?  1007.5872  17.2401          ?        ?      317.4        2.7       ?       ? 
1 1 1   30   26   10 o    357.3    2.5    0.0000   0.0000          ?        ?  1277.0432  17.8786          ?        ?      357.3        2.5       ?       ? 
1 1 1   30   26   11 o    318.8    2.7    0.0000   0.0000          ?        ?  1016.5264  17.2401          ?        ?      318.8        2.7       ?       ? 
1 1 1   30   26   12 o    572.9    2.7    0.0000   0.0000          ?        ?  3282.6394  30.6490          ?        ?      572.9        2.7       ?       ? 
1 1 1   30   26   13 o    544.0    2.7    0.0000   0.0000          ?        ?  2959.5479  29.3720          ?        ?      544.0        2.7       ?       ? 
1 1 1   30   26   14 o    143.8    3.6    0.0000   0.0000          ?        ?   206.8810  10.2163          ?        ?      143.8        3.6       ?       ? 
1 1 1   30   26   15 o     14.6    7.2    0.0000   0.0000          ?        ?   -17.2401   7.6623          ?        ?       14.6        7.2       ?       ? 
1 1 1   30   26   16 o    450.1    2.3    0.0000   0.0000          ?        ?  2026.0291  21.0712          ?        ?      450.1        2.3       ?       ? 
1 1 1   30   26   17 o    101.7    4.4    0.0000   0.0000          ?        ?   103.4405   8.9393          ?        ?      101.7        4.4       ?       ? 
1 1 1   30   26   18 o    215.4    2.5    0.0000   0.0000          ?        ?   464.2052  10.8549          ?        ?      215.4        2.5       ?       ? 
1 1 1   30   26   19 o     31.9   11.9    0.0000   0.0000          ?        ?     7.6623  10.2163          ?        ?       31.9       11.9       ?       ? 
1 1 1   30   26   20 o    110.7    4.9    0.0000   0.0000          ?        ?   122.5962  10.8549          ?        ?      110.7        4.9       ?       ? 
1 1 1   30   26   21 o    189.9    3.0    0.0000   0.0000          ?        ?   360.7647  11.4934          ?        ?      189.9        3.0       ?       ? 
1 1 1   30   26   22 o    378.6    2.3    0.0000   0.0000          ?        ?  1433.4811  17.2401          ?        ?      378.6        2.3       ?       ? 
1 1 1   30   26   23 o     33.6   12.9    0.0000   0.0000          ?        ?     7.6623  12.1319          ?        ?       33.6       12.9       ?       ? 
1 1 1   30   26   24 o    251.6    2.8    0.0000   0.0000          ?        ?   633.4135  14.0475          ?        ?      251.6        2.8       ?       ? 
1 1 1   30   26   25 o    235.6    3.0    0.0000   0.0000          ?        ?   555.5138  14.0475          ?        ?      235.6        3.0       ?       ? 
1 1 1   30   26   26 o    224.0    3.1    0.0000   0.0000          ?        ?   501.8780  14.0475          ?        ?      224.0        3.1       ?       ? 
1 1 1   30   26   27 o    283.1    2.6    0.0000   0.0000          ?        ?   801.9832  14.6860          ?        ?      283.1        2.6       ?       ? 
1 1 1   30   26   28 o    360.1    2.4    0.0000   0.0000          ?        ?  1296.8374  17.2401          ?        ?      360.1        2.4       ?       ? 
1 1 1   30   26   29 o     69.5    9.2    0.0000   0.0000          ?        ?    48.5276  12.7704          ?        ?       69.5        9.2       ?       ? 
1 1 1   30   26   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   26   31 o    350.5    2.6    0.0000   0.0000          ?        ?  1229.1542  17.8786          ?        ?      350.5        2.6       ?       ? 
1 1 1   30   26   32 f    107.1    6.9    0.0000   0.0000          ?        ?   114.9339  14.6860          ?        ?      107.1        6.9       ?       ? 
1 1 1   30   26   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   26   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   26   35 o    362.7    2.7    0.0000   0.0000          ?        ?  1315.9932  19.7942          ?        ?      362.7        2.7       ?       ? 
1 1 1   30   26   36 o    141.5    5.4    0.0000   0.0000          ?        ?   200.4958  15.3245          ?        ?      141.5        5.4       ?       ? 
1 1 1   30   26   37 o    243.9    3.4    0.0000   0.0000          ?        ?   595.1021  16.6016          ?        ?      243.9        3.4       ?       ? 
1 1 1   30   26   38 o    148.5    5.4    0.0000   0.0000          ?        ?   220.9285  15.9630          ?        ?      148.5        5.4       ?       ? 
1 1 1   30   26   39 o    166.2    4.6    0.0000   0.0000          ?        ?   276.4799  15.3245          ?        ?      166.2        4.6       ?       ? 
1 1 1   30   26   40 o    293.5    3.0    0.0000   0.0000          ?        ?   862.0042  17.8786          ?        ?      293.5        3.0       ?       ? 
1 1 1   30   26   41 o    230.8    3.6    0.0000   0.0000          ?        ?   533.1656  16.6016          ?        ?      230.8        3.6       ?       ? 
1 1 1   30   26   42 o     19.9    9.9    0.0000   0.0000          ?        ?   -42.1424  15.9630          ?        ?       19.9        9.9       ?       ? 
1 1 1   30   26   43 o     35.7   14.4    0.0000   0.0000          ?        ?     5.7467  15.9630          ?        ?       35.7       14.4       ?       ? 
1 1 1   30   26   44 o    396.9    2.7    0.0000   0.0000          ?        ?  1576.5099  21.7097          ?        ?      396.9        2.7       ?       ? 
1 1 1   30   26   45 o    176.7    5.2    0.0000   0.0000          ?        ?   312.8756  18.5171          ?        ?      176.7        5.2       ?       ? 
1 1 1   30   26   46 o    159.0    5.6    0.0000   0.0000          ?        ?   253.4931  17.8786          ?        ?      159.0        5.6       ?       ? 
1 1 1   30   26   47 o    141.7    6.5    0.0000   0.0000          ?        ?   201.7728  18.5171          ?        ?      141.7        6.5       ?       ? 
1 1 1   30   26   48 o    220.8    4.2    0.0000   0.0000          ?        ?   488.4691  18.5171          ?        ?      220.8        4.2       ?       ? 
1 1 1   30   26   49 o     21.9   10.9    0.0000   0.0000          ?        ?   -41.5039  17.8786          ?        ?       21.9       10.9       ?       ? 
1 1 1   30   26   50 o    209.0    4.4    0.0000   0.0000          ?        ?   438.0258  18.5171          ?        ?      209.0        4.4       ?       ? 
1 1 1   30   26   51 o    126.6    7.3    0.0000   0.0000          ?        ?   161.5460  18.5171          ?        ?      126.6        7.3       ?       ? 
1 1 1   30   26   52 o    151.6    6.1    0.0000   0.0000          ?        ?   231.1448  18.5171          ?        ?      151.6        6.1       ?       ? 
1 1 1   30   26   53 o    131.1    6.8    0.0000   0.0000          ?        ?   173.0394  17.8786          ?        ?      131.1        6.8       ?       ? 
1 1 1   30   26   54 o     99.8    9.0    0.0000   0.0000          ?        ?   100.8864  17.8786          ?        ?       99.8        9.0       ?       ? 
1 1 1   30   26   55 o    246.2    3.9    0.0000   0.0000          ?        ?   607.8726  19.1556          ?        ?      246.2        3.9       ?       ? 
1 1 1   30   26   56 o     55.9   15.5    0.0000   0.0000          ?        ?    33.8416  17.8786          ?        ?       55.9       15.5       ?       ? 
1 1 1   30   27    0 o    194.8    6.7  381.1974  26.1794   381.1974  26.1794   381.1974  26.1794      194.8      6.7      194.8        6.7     0.0     0.0 
1 1 1   30   27    1 o    194.2    4.9    0.0000   0.0000          ?        ?   377.3663  19.1556          ?        ?      194.2        4.9       ?       ? 
1 1 1   30   27    2 o    521.6    3.4    0.0000   0.0000          ?        ?  2721.3792  35.1187          ?        ?      521.6        3.4       ?       ? 
1 1 1   30   27    3 o    139.9    6.8    0.0000   0.0000          ?        ?   196.0261  19.1556          ?        ?      139.9        6.8       ?       ? 
1 1 1   30   27    4 o     18.4    9.3    0.0000   0.0000          ?        ?   -56.8284  16.6016          ?        ?       18.4        9.3       ?       ? 
1 1 1   30   27    5 o    178.6    5.0    0.0000   0.0000          ?        ?   319.2608  17.8786          ?        ?      178.6        5.0       ?       ? 
1 1 1   30   27    6 o    243.1    4.1    0.0000   0.0000          ?        ?   591.2710  19.7942          ?        ?      243.1        4.1       ?       ? 
1 1 1   30   27    7 o    240.9    4.1    0.0000   0.0000          ?        ?   580.4161  19.7942          ?        ?      240.9        4.1       ?       ? 
1 1 1   30   27    8 o    354.2    2.8    0.0000   0.0000          ?        ?  1254.6949  19.7942          ?        ?      354.2        2.8       ?       ? 
1 1 1   30   27    9 o    255.7    3.4    0.0000   0.0000          ?        ?   653.8461  17.2401          ?        ?      255.7        3.4       ?       ? 
1 1 1   30   27   10 o    488.6    2.5    0.0000   0.0000          ?        ?  2388.0708  24.9023          ?        ?      488.6        2.5       ?       ? 
1 1 1   30   27   11 o    362.2    2.7    0.0000   0.0000          ?        ?  1312.1620  19.7942          ?        ?      362.2        2.7       ?       ? 
1 1 1   30   27   12 f    172.8    3.9    0.0000   0.0000          ?        ?   298.8281  13.4090          ?        ?      172.8        3.9       ?       ? 
1 1 1   30   27   13 o    213.8    2.5    0.0000   0.0000          ?        ?   457.1815  10.8549          ?        ?      213.8        2.5       ?       ? 
1 1 1   30   27   14 o    609.9    2.8    0.0000   0.0000          ?        ?  3721.3040  34.4802          ?        ?      609.9        2.8       ?       ? 
1 1 1   30   27   15 o    284.4    2.1    0.0000   0.0000          ?        ?   809.0069  12.1319          ?        ?      284.4        2.1       ?       ? 
1 1 1   30   27   16 o    303.4    2.2    0.0000   0.0000          ?        ?   920.7482  13.4090          ?        ?      303.4        2.2       ?       ? 
1 1 1   30   27   17 o    305.6    2.2    0.0000   0.0000          ?        ?   934.1572  13.4090          ?        ?      305.6        2.2       ?       ? 
1 1 1   30   27   18 o    143.3    3.8    0.0000   0.0000          ?        ?   205.6040  10.8549          ?        ?      143.3        3.8       ?       ? 
1 1 1   30   27   19 o    625.4    2.7    0.0000   0.0000          ?        ?  3912.8604  33.2031          ?        ?      625.4        2.7       ?       ? 
1 1 1   30   27   20 o    167.8    3.4    0.0000   0.0000          ?        ?   281.5880  11.4934          ?        ?      167.8        3.4       ?       ? 
1 1 1   30   27   21 o     61.8    8.8    0.0000   0.0000          ?        ?    38.3113  10.8549          ?        ?       61.8        8.8       ?       ? 
1 1 1   30   27   22 o    412.5    2.4    0.0000   0.0000          ?        ?  1702.2987  19.7942          ?        ?      412.5        2.4       ?       ? 
1 1 1   30   27   23 o     74.9    7.7    0.0000   0.0000          ?        ?    56.1899  11.4934          ?        ?       74.9        7.7       ?       ? 
1 1 1   30   27   24 o    289.7    2.6    0.0000   0.0000          ?        ?   839.6559  15.3245          ?        ?      289.7        2.6       ?       ? 
1 1 1   30   27   25 o    335.1    2.6    0.0000   0.0000          ?        ?  1123.1595  17.2401          ?        ?      335.1        2.6       ?       ? 
1 1 1   30   27   26 o    471.2    2.5    0.0000   0.0000          ?        ?  2220.7781  23.6253          ?        ?      471.2        2.5       ?       ? 
1 1 1   30   27   27 o    196.5    3.4    0.0000   0.0000          ?        ?   386.3056  13.4090          ?        ?      196.5        3.4       ?       ? 
1 1 1   30   27   28 o    222.2    3.2    0.0000   0.0000          ?        ?   494.2158  14.0475          ?        ?      222.2        3.2       ?       ? 
1 1 1   30   27   29 o    289.6    2.9    0.0000   0.0000          ?        ?   839.0174  16.6016          ?        ?      289.6        2.9       ?       ? 
1 1 1   30   27   30 o    523.7    2.7    0.0000   0.0000          ?        ?  2743.7275  28.0950          ?        ?      523.7        2.7       ?       ? 
1 1 1   30   27   31 o    256.1    3.1    0.0000   0.0000          ?        ?   656.4003  15.9630          ?        ?      256.1        3.1       ?       ? 
1 1 1   30   27   32 o    225.2    3.5    0.0000   0.0000          ?        ?   507.6247  15.9630          ?        ?      225.2        3.5       ?       ? 
1 1 1   30   27   33 o    290.9    3.0    0.0000   0.0000          ?        ?   846.6797  17.2401          ?        ?      290.9        3.0       ?       ? 
1 1 1   30   27   34 o    370.0    2.8    0.0000   0.0000          ?        ?  1369.6289  20.4327          ?        ?      370.0        2.8       ?       ? 
1 1 1   30   27   35 o     55.1   14.3    0.0000   0.0000          ?        ?    31.9261  15.9630          ?        ?       55.1       14.3       ?       ? 
1 1 1   30   27   36 o    124.6    6.7    0.0000   0.0000          ?        ?   155.7993  16.6016          ?        ?      124.6        6.7       ?       ? 
1 1 1   30   27   37 o     50.9   14.8    0.0000   0.0000          ?        ?    26.8179  15.9630          ?        ?       50.9       14.8       ?       ? 
1 1 1   30   27   38 o    244.6    3.5    0.0000   0.0000          ?        ?   598.9333  17.2401          ?        ?      244.6        3.5       ?       ? 
1 1 1   30   27   39 o     31.1   13.6    0.0000   0.0000          ?        ?    -3.1926  15.9630          ?        ?       31.1       13.6       ?       ? 
1 1 1   30   27   40 o    274.5    3.4    0.0000   0.0000          ?        ?   754.0941  18.5171          ?        ?      274.5        3.4       ?       ? 
1 1 1   30   27   41 o    141.6    5.9    0.0000   0.0000          ?        ?   201.1343  16.6016          ?        ?      141.6        5.9       ?       ? 
1 1 1   30   27   42 o    216.2    4.1    0.0000   0.0000          ?        ?   468.0364  17.8786          ?        ?      216.2        4.1       ?       ? 
1 1 1   30   27   43 o    187.9    4.6    0.0000   0.0000          ?        ?   353.7410  17.2401          ?        ?      187.9        4.6       ?       ? 
1 1 1   30   27   44 o     82.6   10.0    0.0000   0.0000          ?        ?    68.9603  16.6016          ?        ?       82.6       10.0       ?       ? 
1 1 1   30   27   45 o     34.1   14.5    0.0000   0.0000          ?        ?     0.6385  17.2401          ?        ?       34.1       14.5       ?       ? 
1 1 1   30   27   46 o    210.6    4.4    0.0000   0.0000          ?        ?   444.4110  18.5171          ?        ?      210.6        4.4       ?       ? 
1 1 1   30   27   47 o    110.6    7.8    0.0000   0.0000          ?        ?   123.2347  17.2401          ?        ?      110.6        7.8       ?       ? 
1 1 1   30   27   48 o    159.5    5.6    0.0000   0.0000          ?        ?   255.4086  17.8786          ?        ?      159.5        5.6       ?       ? 
1 1 1   30   27   49 f     21.1   10.5    0.0000   0.0000          ?        ?   -50.4432  18.5171          ?        ?       21.1       10.5       ?       ? 
1 1 1   30   27   50 o     22.3   11.1    0.0000   0.0000          ?        ?   -42.7809  18.5171          ?        ?       22.3       11.1       ?       ? 
1 1 1   30   27   51 o    202.2    4.4    0.0000   0.0000          ?        ?   409.9309  17.8786          ?        ?      202.2        4.4       ?       ? 
1 1 1   30   27   52 o    125.6    7.1    0.0000   0.0000          ?        ?   158.9919  17.8786          ?        ?      125.6        7.1       ?       ? 
1 1 1   30   27   53 o    171.7    5.4    0.0000   0.0000          ?        ?   296.2740  18.5171          ?        ?      171.7        5.4       ?       ? 
1 1 1   30   27   54 o     82.8   11.2    0.0000   0.0000          ?        ?    70.2374  18.5171          ?        ?       82.8       11.2       ?       ? 
1 1 1   30   27   55 o    101.5    8.8    0.0000   0.0000          ?        ?   104.7175  17.8786          ?        ?      101.5        8.8       ?       ? 
1 1 1   30   28    0 o     18.5   13.4  -35.7572  22.9868   -35.7572  22.9868   -35.7572  22.9868       18.5     13.4       18.5       13.4     0.0     0.0 
1 1 1   30   28    1 o    237.7    3.9    0.0000   0.0000          ?        ?   565.0916  18.5171          ?        ?      237.7        3.9       ?       ? 
1 1 1   30   28    2 o    231.5    3.9    0.0000   0.0000          ?        ?   536.3582  17.8786          ?        ?      231.5        3.9       ?       ? 
1 1 1   30   28    3 o    350.5    3.1    0.0000   0.0000          ?        ?  1229.1542  21.7097          ?        ?      350.5        3.1       ?       ? 
1 1 1   30   28    4 o    132.4    6.8    0.0000   0.0000          ?        ?   175.5934  17.8786          ?        ?      132.4        6.8       ?       ? 
1 1 1   30   28    5 o    401.5    3.2    0.0000   0.0000          ?        ?  1612.2671  25.5409          ?        ?      401.5        3.2       ?       ? 
1 1 1   30   28    6 f    319.4    3.4    0.0000   0.0000          ?        ?  1020.3576  21.7097          ?        ?      319.4        3.4       ?       ? 
1 1 1   30   28    7 f     18.6    9.5    0.0000   0.0000          ?        ?   -64.4907  17.8786          ?        ?       18.6        9.5       ?       ? 
1 1 1   30   28    8 o    258.2    3.8    0.0000   0.0000          ?        ?   667.2551  19.7942          ?        ?      258.2        3.8       ?       ? 
1 1 1   30   28    9 o    291.5    3.2    0.0000   0.0000          ?        ?   849.8723  18.5171          ?        ?      291.5        3.2       ?       ? 
1 1 1   30   28   10 o    540.1    2.8    0.0000   0.0000          ?        ?  2917.4053  30.0105          ?        ?      540.1        2.8       ?       ? 
1 1 1   30   28   11 o    371.6    2.5    0.0000   0.0000          ?        ?  1381.1223  18.5171          ?        ?      371.6        2.5       ?       ? 
1 1 1   30   28   12 o    380.8    2.4    0.0000   0.0000          ?        ?  1450.7211  18.5171          ?        ?      380.8        2.4       ?       ? 
1 1 1   30   28   13 o    322.4    2.7    0.0000   0.0000          ?        ?  1039.5132  17.2401          ?        ?      322.4        2.7       ?       ? 
1 1 1   30   28   14 o    384.2    2.3    0.0000   0.0000          ?        ?  1476.2620  17.8786          ?        ?      384.2        2.3       ?       ? 
1 1 1   30   28   15 o    218.8    2.3    0.0000   0.0000          ?        ?   478.8912  10.2163          ?        ?      218.8        2.3       ?       ? 
1 1 1   30   28   16 o    272.8    2.2    0.0000   0.0000          ?        ?   744.5162  12.1319          ?        ?      272.8        2.2       ?       ? 
1 1 1   30   28   17 o    177.9    2.9    0.0000   0.0000          ?        ?   316.7067  10.2163          ?        ?      177.9        2.9       ?       ? 
1 1 1   30   28   18 o    648.9    2.7    0.0000   0.0000          ?        ?  4211.6885  35.1187          ?        ?      648.9        2.7       ?       ? 
1 1 1   30   28   19 o    320.0    2.3    0.0000   0.0000          ?        ?  1024.1886  14.6860          ?        ?      320.0        2.3       ?       ? 
1 1 1   30   28   20 o    171.7    3.2    0.0000   0.0000          ?        ?   294.9970  10.8549          ?        ?      171.7        3.2       ?       ? 
1 1 1   30   28   21 o     53.7   10.5    0.0000   0.0000          ?        ?    30.0105  10.8549          ?        ?       53.7       10.5       ?       ? 
1 1 1   30   28   22 o    377.0    2.3    0.0000   0.0000          ?        ?  1421.9877  17.2401          ?        ?      377.0        2.3       ?       ? 
1 1 1   30   28   23 o    613.5    2.7    0.0000   0.0000          ?        ?  3764.7234  32.5646          ?        ?      613.5        2.7       ?       ? 
1 1 1   30   28   24 o    427.0    2.3    0.0000   0.0000          ?        ?  1823.6178  19.7942          ?        ?      427.0        2.3       ?       ? 
1 1 1   30   28   25 o     19.2    9.4    0.0000   0.0000          ?        ?   -20.4327  11.4934          ?        ?       19.2        9.4       ?       ? 
1 1 1   30   28   26 o    243.4    2.9    0.0000   0.0000          ?        ?   592.5481  14.0475          ?        ?      243.4        2.9       ?       ? 
1 1 1   30   28   27 o    109.2    6.1    0.0000   0.0000          ?        ?   119.4035  13.4090          ?        ?      109.2        6.1       ?       ? 
1 1 1   30   28   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   28   29 o    405.8    2.6    0.0000   0.0000          ?        ?  1647.3857  21.0712          ?        ?      405.8        2.6       ?       ? 
1 1 1   30   28   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   28   31 o     97.7    7.2    0.0000   0.0000          ?        ?    95.7782  14.0475          ?        ?       97.7        7.2       ?       ? 
1 1 1   30   28   32 o    237.4    3.6    0.0000   0.0000          ?        ?   563.8146  17.2401          ?        ?      237.4        3.6       ?       ? 
1 1 1   30   28   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   28   34 o    235.3    3.4    0.0000   0.0000          ?        ?   554.2368  15.9630          ?        ?      235.3        3.4       ?       ? 
1 1 1   30   28   35 o     58.3   12.9    0.0000   0.0000          ?        ?    35.7572  14.6860          ?        ?       58.3       12.9       ?       ? 
1 1 1   30   28   36 o     33.3   14.2    0.0000   0.0000          ?        ?     0.0000  16.6016          ?        ?       33.3       14.2       ?       ? 
1 1 1   30   28   37 o    134.3    5.7    0.0000   0.0000          ?        ?   180.7016  15.3245          ?        ?      134.3        5.7       ?       ? 
1 1 1   30   28   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   28   39 o    106.1    7.5    0.0000   0.0000          ?        ?   113.0183  15.9630          ?        ?      106.1        7.5       ?       ? 
1 1 1   30   28   40 o    156.6    5.3    0.0000   0.0000          ?        ?   245.8308  16.6016          ?        ?      156.6        5.3       ?       ? 
1 1 1   30   28   41 o     21.3   10.5    0.0000   0.0000          ?        ?   -34.4802  15.9630          ?        ?       21.3       10.5       ?       ? 
1 1 1   30   28   42 o    174.3    4.9    0.0000   0.0000          ?        ?   304.5748  17.2401          ?        ?      174.3        4.9       ?       ? 
1 1 1   30   28   43 o     20.4   10.2    0.0000   0.0000          ?        ?   -42.7809  16.6016          ?        ?       20.4       10.2       ?       ? 
1 1 1   30   28   44 o    190.1    4.4    0.0000   0.0000          ?        ?   362.0418  16.6016          ?        ?      190.1        4.4       ?       ? 
1 1 1   30   28   45 o    365.9    2.9    0.0000   0.0000          ?        ?  1340.2568  21.0712          ?        ?      365.9        2.9       ?       ? 
1 1 1   30   28   46 o     42.2   15.3    0.0000   0.0000          ?        ?    15.3245  16.6016          ?        ?       42.2       15.3       ?       ? 
1 1 1   30   28   47 o    130.0    6.4    0.0000   0.0000          ?        ?   169.8468  16.6016          ?        ?      130.0        6.4       ?       ? 
1 1 1   30   28   48 o    173.7    5.0    0.0000   0.0000          ?        ?   302.6593  17.2401          ?        ?      173.7        5.0       ?       ? 
1 1 1   30   28   49 o    172.2    5.0    0.0000   0.0000          ?        ?   297.5511  17.2401          ?        ?      172.2        5.0       ?       ? 
1 1 1   30   28   50 o    304.0    3.3    0.0000   0.0000          ?        ?   925.8564  19.7942          ?        ?      304.0        3.3       ?       ? 
1 1 1   30   28   51 o    169.7    5.5    0.0000   0.0000          ?        ?   289.2503  18.5171          ?        ?      169.7        5.5       ?       ? 
1 1 1   30   28   52 o    116.8    7.7    0.0000   0.0000          ?        ?   137.9207  17.8786          ?        ?      116.8        7.7       ?       ? 
1 1 1   30   28   53 o     36.4   14.9    0.0000   0.0000          ?        ?     5.7467  17.2401          ?        ?       36.4       14.9       ?       ? 
1 1 1   30   28   54 o    136.3    6.8    0.0000   0.0000          ?        ?   187.7254  18.5171          ?        ?      136.3        6.8       ?       ? 
1 1 1   30   29    0 o     74.5   19.9   66.4062  25.5409    66.4062  25.5409    66.4062  25.5409       74.5     19.9       74.5       19.9     0.0     0.0 
1 1 1   30   29    1 o    138.3    6.2    0.0000   0.0000          ?        ?   191.5565  17.2401          ?        ?      138.3        6.2       ?       ? 
1 1 1   30   29    2 o    239.3    4.0    0.0000   0.0000          ?        ?   572.7539  19.1556          ?        ?      239.3        4.0       ?       ? 
1 1 1   30   29    3 o    390.6    3.4    0.0000   0.0000          ?        ?  1526.7052  26.8179          ?        ?      390.6        3.4       ?       ? 
1 1 1   30   29    4 f    190.7    4.7    0.0000   0.0000          ?        ?   363.9573  17.8786          ?        ?      190.7        4.7       ?       ? 
1 1 1   30   29    5 o    175.0    5.7    0.0000   0.0000          ?        ?   306.4904  19.7942          ?        ?      175.0        5.7       ?       ? 
1 1 1   30   29    6 f    430.3    3.6    0.0000   0.0000          ?        ?  1852.3513  31.2876          ?        ?      430.3        3.6       ?       ? 
1 1 1   30   29    7 o    221.3    5.0    0.0000   0.0000          ?        ?   490.3846  22.3483          ?        ?      221.3        5.0       ?       ? 
1 1 1   30   29    8 o     39.2   16.4    0.0000   0.0000          ?        ?     2.5541  21.7097          ?        ?       39.2       16.4       ?       ? 
1 1 1   30   29    9 o     26.0   12.8    0.0000   0.0000          ?        ?   -54.2743  24.2638          ?        ?       26.0       12.8       ?       ? 
1 1 1   30   29   10 o    247.5    2.8    0.0000   0.0000          ?        ?   612.9808  14.0475          ?        ?      247.5        2.8       ?       ? 
1 1 1   30   29   11 o    296.7    2.5    0.0000   0.0000          ?        ?   880.5213  14.6860          ?        ?      296.7        2.5       ?       ? 
1 1 1   30   29   12 o    193.7    3.1    0.0000   0.0000          ?        ?   375.4507  12.1319          ?        ?      193.7        3.1       ?       ? 
1 1 1   30   29   13 o    140.6    4.3    0.0000   0.0000          ?        ?   197.9417  12.1319          ?        ?      140.6        4.3       ?       ? 
1 1 1   30   29   14 o    142.0    4.3    0.0000   0.0000          ?        ?   201.7728  12.1319          ?        ?      142.0        4.3       ?       ? 
1 1 1   30   29   15 o     26.1   10.5    0.0000   0.0000          ?        ?     3.1926   8.3008          ?        ?       26.1       10.5       ?       ? 
1 1 1   30   29   16 o    222.1    2.3    0.0000   0.0000          ?        ?   493.5772  10.2163          ?        ?      222.1        2.3       ?       ? 
1 1 1   30   29   17 o    405.3    2.2    0.0000   0.0000          ?        ?  1642.9160  17.8786          ?        ?      405.3        2.2       ?       ? 
1 1 1   30   29   18 o    188.2    2.7    0.0000   0.0000          ?        ?   354.3795  10.2163          ?        ?      188.2        2.7       ?       ? 
1 1 1   30   29   19 o    158.6    3.4    0.0000   0.0000          ?        ?   251.5775  10.8549          ?        ?      158.6        3.4       ?       ? 
1 1 1   30   29   20 o    170.4    3.4    0.0000   0.0000          ?        ?   290.5273  11.4934          ?        ?      170.4        3.4       ?       ? 
1 1 1   30   29   21 o    459.5    2.5    0.0000   0.0000          ?        ?  2112.2295  22.9868          ?        ?      459.5        2.5       ?       ? 
1 1 1   30   29   22 o    213.0    2.8    0.0000   0.0000          ?        ?   453.9889  12.1319          ?        ?      213.0        2.8       ?       ? 
1 1 1   30   29   23 o    179.3    3.4    0.0000   0.0000          ?        ?   321.8149  12.1319          ?        ?      179.3        3.4       ?       ? 
1 1 1   30   29   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   29   25 o    138.3    4.6    0.0000   0.0000          ?        ?   191.5565  12.7704          ?        ?      138.3        4.6       ?       ? 
1 1 1   30   29   26 o    218.8    3.1    0.0000   0.0000          ?        ?   478.8912  13.4090          ?        ?      218.8        3.1       ?       ? 
1 1 1   30   29   27 o     52.3   12.4    0.0000   0.0000          ?        ?    28.7335  12.7704          ?        ?       52.3       12.4       ?       ? 
1 1 1   30   29   28 o    516.2    2.5    0.0000   0.0000          ?        ?  2665.8279  26.1794          ?        ?      516.2        2.5       ?       ? 
1 1 1   30   29   29 o    528.7    2.6    0.0000   0.0000          ?        ?  2796.0862  27.4564          ?        ?      528.7        2.6       ?       ? 
1 1 1   30   29   30 o    209.8    3.5    0.0000   0.0000          ?        ?   440.5799  14.6860          ?        ?      209.8        3.5       ?       ? 
1 1 1   30   29   31 o    321.5    2.8    0.0000   0.0000          ?        ?  1034.4050  17.8786          ?        ?      321.5        2.8       ?       ? 
1 1 1   30   29   32 o    127.5    6.0    0.0000   0.0000          ?        ?   162.8230  15.3245          ?        ?      127.5        6.0       ?       ? 
1 1 1   30   29   33 o    512.8    2.6    0.0000   0.0000          ?        ?  2630.7090  26.8179          ?        ?      512.8        2.6       ?       ? 
1 1 1   30   29   34 o     19.6    9.7    0.0000   0.0000          ?        ?   -31.9261  14.0475          ?        ?       19.6        9.7       ?       ? 
1 1 1   30   29   35 o    145.9    5.3    0.0000   0.0000          ?        ?   213.2662  15.3245          ?        ?      145.9        5.3       ?       ? 
1 1 1   30   29   36 o    170.6    5.2    0.0000   0.0000          ?        ?   291.8044  17.8786          ?        ?      170.6        5.2       ?       ? 
1 1 1   30   29   37 o    168.0    4.6    0.0000   0.0000          ?        ?   282.8651  15.3245          ?        ?      168.0        4.6       ?       ? 
1 1 1   30   29   38 o     20.7   10.2    0.0000   0.0000          ?        ?   -33.8416  15.3245          ?        ?       20.7       10.2       ?       ? 
1 1 1   30   29   39 o     85.0    9.4    0.0000   0.0000          ?        ?    72.7915  15.9630          ?        ?       85.0        9.4       ?       ? 
1 1 1   30   29   40 f    228.4    3.8    0.0000   0.0000          ?        ?   522.3107  17.2401          ?        ?      228.4        3.8       ?       ? 
1 1 1   30   29   41 o    133.5    6.2    0.0000   0.0000          ?        ?   178.7861  16.6016          ?        ?      133.5        6.2       ?       ? 
1 1 1   30   29   42 o    104.8    7.6    0.0000   0.0000          ?        ?   110.4642  15.9630          ?        ?      104.8        7.6       ?       ? 
1 1 1   30   29   43 o    269.7    3.4    0.0000   0.0000          ?        ?   728.5532  18.5171          ?        ?      269.7        3.4       ?       ? 
1 1 1   30   29   44 o    105.3    8.2    0.0000   0.0000          ?        ?   111.7413  17.2401          ?        ?      105.3        8.2       ?       ? 
1 1 1   30   29   45 o     99.0    8.7    0.0000   0.0000          ?        ?    98.9709  17.2401          ?        ?       99.0        8.7       ?       ? 
1 1 1   30   29   46 o    207.8    4.3    0.0000   0.0000          ?        ?   432.9177  17.8786          ?        ?      207.8        4.3       ?       ? 
1 1 1   30   29   47 o     83.1   11.1    0.0000   0.0000          ?        ?    70.2374  18.5171          ?        ?       83.1       11.1       ?       ? 
1 1 1   30   29   48 o    298.1    3.4    0.0000   0.0000          ?        ?   890.0991  20.4327          ?        ?      298.1        3.4       ?       ? 
1 1 1   30   29   49 o    124.5    7.4    0.0000   0.0000          ?        ?   156.4378  18.5171          ?        ?      124.5        7.4       ?       ? 
1 1 1   30   29   50 o    153.6    6.0    0.0000   0.0000          ?        ?   237.5300  18.5171          ?        ?      153.6        6.0       ?       ? 
1 1 1   30   29   51 o    246.0    3.8    0.0000   0.0000          ?        ?   606.5955  18.5171          ?        ?      246.0        3.8       ?       ? 
1 1 1   30   29   52 o     75.2   11.9    0.0000   0.0000          ?        ?    58.1055  17.8786          ?        ?       75.2       11.9       ?       ? 
1 1 1   30   29   53 o     57.9   14.8    0.0000   0.0000          ?        ?    36.3957  17.2401          ?        ?       57.9       14.8       ?       ? 
1 1 1   30   30    0 o    258.4    9.3  671.0862  47.8891   671.0862  47.8891   671.0862  47.8891      258.4      9.3      258.4        9.3     0.0     0.0 
1 1 1   30   30    1 o    461.0    4.4 2126.9155  40.2269  2126.9155  40.2269  2126.9155  40.2269      461.0      4.4      461.0        4.4     0.0     0.0 
1 1 1   30   30    2 o    225.3    7.1  509.5403  31.9261   509.5403  31.9261   509.5403  31.9261      225.3      7.1      225.3        7.1     0.0     0.0 
1 1 1   30   30    3 o    186.2    8.3  349.2713  30.6490   349.2713  30.6490   349.2713  30.6490      186.2      8.3      186.2        8.3     0.0     0.0 
1 1 1   30   30    4 o    518.8    5.0 2693.9226  52.3588  2693.9226  52.3588  2693.9226  52.3588      518.8      5.0      518.8        5.0     0.0     0.0 
1 1 1   30   30    5 o    227.3    7.7  519.1181  35.1187   519.1181  35.1187   519.1181  35.1187      227.3      7.7      227.3        7.7     0.0     0.0 
1 1 1   30   30    6 o     79.9   25.9   81.7308  36.3957    81.7308  36.3957    81.7308  36.3957       79.9     25.9       79.9       25.9     0.0     0.0 
1 1 1   30   30    7 o    430.3    5.1 1853.6282  44.0580  1853.6282  44.0580  1853.6282  44.0580      430.3      5.1      430.3        5.1     0.0     0.0 
1 1 1   30   30    8 o    509.8    4.9 2600.6985  49.8047  2600.6985  49.8047  2600.6985  49.8047      509.8      4.9      509.8        4.9     0.0     0.0 
1 1 1   30   30    9 o    386.3    5.2 1494.1406  40.2269  1494.1406  40.2269  1494.1406  40.2269      386.3      5.2      386.3        5.2     0.0     0.0 
1 1 1   30   30   10 o    576.7    5.0 3327.9749  58.1055  3327.9749  58.1055  3327.9749  58.1055      576.7      5.0      576.7        5.0     0.0     0.0 
1 1 1   30   30   11 o    543.0    5.5 2951.2471  60.0210  2951.2471  60.0210  2951.2471  60.0210      543.0      5.5      543.0        5.5     0.0     0.0 
1 1 1   30   30   12 o    850.9    5.7 7247.2207  97.6938  7247.2207  97.6938  7247.2207  97.6938      850.9      5.7      850.9        5.7     0.0     0.0 
1 1 1   30   30   13 o    398.5    3.6 1589.2803  28.7335  1589.2803  28.7335  1589.2803  28.7335      398.5      3.6      398.5        3.6     0.0     0.0 
1 1 1   30   30   14 o    145.1    6.2  211.9892  17.8786   211.9892  17.8786   211.9892  17.8786      145.1      6.2      145.1        6.2     0.0     0.0 
1 1 1   30   30   15 o     12.8    9.5  -54.2743  17.8786   -54.2743  17.8786   -54.2743  17.8786       12.8      9.5       12.8        9.5     0.0     0.0 
1 1 1   30   30   16 o     10.1    7.5  -28.0950  10.2163   -28.0950  10.2163   -28.0950  10.2163       10.1      7.5       10.1        7.5     0.0     0.0 
1 1 1   30   30   17 o    361.2    3.1 1305.1382  22.3483  1305.1382  22.3483  1305.1382  22.3483      361.2      3.1      361.2        3.1     0.0     0.0 
1 1 1   30   30   18 o    222.3    3.6  494.8542  15.9630   494.8542  15.9630   494.8542  15.9630      222.3      3.6      222.3        3.6     0.0     0.0 
1 1 1   30   30   19 o    311.8    3.7  973.1069  22.9868   973.1069  22.9868   973.1069  22.9868      311.8      3.7      311.8        3.7     0.0     0.0 
1 1 1   30   30   20 o    230.1    3.7  529.9730  17.2401   529.9730  17.2401   529.9730  17.2401      230.1      3.7      230.1        3.7     0.0     0.0 
1 1 1   30   30   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   30   22 o    351.9    3.5 1239.3705  24.9023  1239.3705  24.9023  1239.3705  24.9023      351.9      3.5      351.9        3.5     0.0     0.0 
1 1 1   30   30   23 o    327.1    3.2 1070.8008  21.0712  1070.8008  21.0712  1070.8008  21.0712      327.1      3.2      327.1        3.2     0.0     0.0 
1 1 1   30   30   24 o    147.6    5.9  219.0129  17.2401   219.0129  17.2401   219.0129  17.2401      147.6      5.9      147.6        5.9     0.0     0.0 
1 1 1   30   30   25 o    240.9    4.2  581.0547  20.4327   581.0547  20.4327   581.0547  20.4327      240.9      4.2      240.9        4.2     0.0     0.0 
1 1 1   30   30   26 o    347.1    3.5 1205.5288  24.2638  1205.5288  24.2638  1205.5288  24.2638      347.1      3.5      347.1        3.5     0.0     0.0 
1 1 1   30   30   27 o    502.5    3.5 2525.9917  35.1187  2525.9917  35.1187  2525.9917  35.1187      502.5      3.5      502.5        3.5     0.0     0.0 
1 1 1   30   30   28 o     21.4   14.5   -7.6623  17.8786    -7.6623  17.8786    -7.6623  17.8786       21.4     14.5       21.4       14.5     0.0     0.0 
1 1 1   30   30   29 o    540.6    3.6 2923.7905  38.9498  2923.7905  38.9498  2923.7905  38.9498      540.6      3.6      540.6        3.6     0.0     0.0 
1 1 1   30   30   30 o    179.4    5.9  323.0919  21.0712   323.0919  21.0712   323.0919  21.0712      179.4      5.9      179.4        5.9     0.0     0.0 
1 1 1   30   30   31 o     15.5   11.4  -44.6965  20.4327   -44.6965  20.4327   -44.6965  20.4327       15.5     11.4       15.5       11.4     0.0     0.0 
1 1 1   30   30   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   30   33 o     62.5   19.3   49.1662  21.0712    49.1662  21.0712    49.1662  21.0712       62.5     19.3       62.5       19.3     0.0     0.0 
1 1 1   30   30   34 o    166.5    6.5  279.0340  21.7097   279.0340  21.7097   279.0340  21.7097      166.5      6.5      166.5        6.5     0.0     0.0 
1 1 1   30   30   35 o     73.0   16.6   61.2981  21.0712    61.2981  21.0712    61.2981  21.0712       73.0     16.6       73.0       16.6     0.0     0.0 
1 1 1   30   30   36 o    266.5    4.7  711.3131  24.9023   711.3131  24.9023   711.3131  24.9023      266.5      4.7      266.5        4.7     0.0     0.0 
1 1 1   30   30   37 o    215.3    5.5  464.8438  23.6253   464.8438  23.6253   464.8438  23.6253      215.3      5.5      215.3        5.5     0.0     0.0 
1 1 1   30   30   38 o    246.7    5.3  610.4266  26.1794   610.4266  26.1794   610.4266  26.1794      246.7      5.3      246.7        5.3     0.0     0.0 
1 1 1   30   30   39 o    167.6    7.7  283.5036  25.5409   283.5036  25.5409   283.5036  25.5409      167.6      7.7      167.6        7.7     0.0     0.0 
1 1 1   30   30   40 o    495.1    3.9 2453.8386  38.3113  2453.8386  38.3113  2453.8386  38.3113      495.1      3.9      495.1        3.9     0.0     0.0 
1 1 1   30   30   41 o     78.7   16.6   70.2374  22.9868    70.2374  22.9868    70.2374  22.9868       78.7     16.6       78.7       16.6     0.0     0.0 
1 1 1   30   30   42 f     23.8   16.1   -8.3008  21.7097    -8.3008  21.7097    -8.3008  21.7097       23.8     16.1       23.8       16.1     0.0     0.0 
1 1 1   30   30   43 o     24.8   16.7   -7.6623  22.9868    -7.6623  22.9868    -7.6623  22.9868       24.8     16.7       24.8       16.7     0.0     0.0 
1 1 1   30   30   44 o     33.4   20.1   12.7704  23.6253    12.7704  23.6253    12.7704  23.6253       33.4     20.1       33.4       20.1     0.0     0.0 
1 1 1   30   30   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   30   30   46 o     23.3   16.2  -17.2401  24.9023   -17.2401  24.9023   -17.2401  24.9023       23.3     16.2       23.3       16.2     0.0     0.0 
1 1 1   30   30   47 o    124.4   10.1  158.9919  24.9023   158.9919  24.9023   158.9919  24.9023      124.4     10.1      124.4       10.1     0.0     0.0 
1 1 1   30   30   48 o    234.6    5.9  552.9597  27.4564   552.9597  27.4564   552.9597  27.4564      234.6      5.9      234.6        5.9     0.0     0.0 
1 1 1   30   30   49 o     18.4   13.4  -40.8654  24.2638   -40.8654  24.2638   -40.8654  24.2638       18.4     13.4       18.4       13.4     0.0     0.0 
1 1 1   30   30   50 o    279.1    4.9  781.5505  27.4564   781.5505  27.4564   781.5505  27.4564      279.1      4.9      279.1        4.9     0.0     0.0 
1 1 1   30   30   51 o     87.0   14.2   81.7308  22.9868    81.7308  22.9868    81.7308  22.9868       87.0     14.2       87.0       14.2     0.0     0.0 
1 1 1   31    0    0 o   2157.2   17.2 46555.2500 741.9621 46555.2500 741.9621 46555.2500 741.9621     2157.2     17.2     2157.2       17.2     0.0     0.0 
1 1 1   31    0    1 o   1321.4    7.8 17463.5664 206.8810 17463.5664 206.8810 17463.5664 206.8810     1321.4      7.8     1321.4        7.8     0.0     0.0 
1 1 1   31    0    2 o   1288.6    7.3 16608.5859 188.3639 16608.5859 188.3639 16608.5859 188.3639     1288.6      7.3     1288.6        7.3     0.0     0.0 
1 1 1   31    0    3 o    161.4    6.1  261.7939  19.7942   261.7939  19.7942   261.7939  19.7942      161.4      6.1      161.4        6.1     0.0     0.0 
1 1 1   31    0    4 o   1788.3    9.7 31988.6543 348.6328 31988.6543 348.6328 31988.6543 348.6328     1788.3      9.7     1788.3        9.7     0.0     0.0 
1 1 1   31    0    5 o    684.5    5.2 4686.1104  70.8759  4686.1104  70.8759  4686.1104  70.8759      684.5      5.2      684.5        5.2     0.0     0.0 
1 1 1   31    0    6 f   2768.9   18.0 76721.5625 997.3708 76721.5625 997.3708 76721.5625 997.3708     2768.9     18.0     2768.9       18.0     0.0     0.0 
1 1 1   31    0    7 o   1767.2    9.6 31237.7559 340.3320 31237.7559 340.3320 31237.7559 340.3320     1767.2      9.6     1767.2        9.6     0.0     0.0 
1 1 1   31    0    8 o   1471.6    7.7 21660.5703 227.3137 21660.5703 227.3137 21660.5703 227.3137     1471.6      7.7     1471.6        7.7     0.0     0.0 
1 1 1   31    0    9 o    908.8    5.6 8259.9160 100.8864  8259.9160 100.8864  8259.9160 100.8864      908.8      5.6      908.8        5.6     0.0     0.0 
1 1 1   31    0   10 o     13.1    9.7  -40.2269  15.9630   -40.2269  15.9630   -40.2269  15.9630       13.1      9.7       13.1        9.7     0.0     0.0 
1 1 1   31    0   11 o    550.0    3.8 3025.9539  41.5039  3025.9539  41.5039  3025.9539  41.5039      550.0      3.8      550.0        3.8     0.0     0.0 
1 1 1   31    0   12 o    457.7    3.5 2094.9895  31.9261  2094.9895  31.9261  2094.9895  31.9261      457.7      3.5      457.7        3.5     0.0     0.0 
1 1 1   31    0   13 o   1143.8    5.9 13083.9473 135.3666 13083.9473 135.3666 13083.9473 135.3666     1143.8      5.9     1143.8        5.9     0.0     0.0 
1 1 1   31    0   14 o    559.3    3.5 3128.1174  38.9498  3128.1174  38.9498  3128.1174  38.9498      559.3      3.5      559.3        3.5     0.0     0.0 
1 1 1   31    0   15 o     20.4   15.2 -169.8468  49.8047  -169.8468  49.8047  -169.8468  49.8047       20.4     15.2       20.4       15.2     0.0     0.0 
1 1 1   31    0   16 o     78.9   12.5   65.7677  18.5171    65.7677  18.5171    65.7677  18.5171       78.9     12.5       78.9       12.5     0.0     0.0 
1 1 1   31    0   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    0   18 o    438.6    3.5 1923.8656  30.6490  1923.8656  30.6490  1923.8656  30.6490      438.6      3.5      438.6        3.5     0.0     0.0 
1 1 1   31    0   19 o    549.3    3.6 3017.6533  39.5883  3017.6533  39.5883  3017.6533  39.5883      549.3      3.6      549.3        3.6     0.0     0.0 
1 1 1   31    0   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    0   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    0   22 o    234.2    4.2  549.1286  19.7942   549.1286  19.7942   549.1286  19.7942      234.2      4.2      234.2        4.2     0.0     0.0 
1 1 1   31    0   23 o    336.4    3.6 1132.0989  24.2638  1132.0989  24.2638  1132.0989  24.2638      336.4      3.6      336.4        3.6     0.0     0.0 
1 1 1   31    0   24 o    877.1    5.1 7694.8237  88.7545  7694.8237  88.7545  7694.8237  88.7545      877.1      5.1      877.1        5.1     0.0     0.0 
1 1 1   31    0   25 f   1617.1    9.3 26157.6777 301.3822 26157.6777 301.3822 26157.6777 301.3822     1617.1      9.3     1617.1        9.3     0.0     0.0 
1 1 1   31    0   26 o    242.2    4.4  587.4399  21.0712   587.4399  21.0712   587.4399  21.0712      242.2      4.4      242.2        4.4     0.0     0.0 
1 1 1   31    0   27 o   1519.0    7.5 23079.3633 226.6752 23079.3633 226.6752 23079.3633 226.6752     1519.0      7.5     1519.0        7.5     0.0     0.0 
1 1 1   31    0   28 o    257.9    4.6  665.9781  23.6253   665.9781  23.6253   665.9781  23.6253      257.9      4.6      257.9        4.6     0.0     0.0 
1 1 1   31    0   29 o     88.0   12.2   79.8152  21.0712    79.8152  21.0712    79.8152  21.0712       88.0     12.2       88.0       12.2     0.0     0.0 
1 1 1   31    0   30 o    550.7    3.8 3033.6162  42.1424  3033.6162  42.1424  3033.6162  42.1424      550.7      3.8      550.7        3.8     0.0     0.0 
1 1 1   31    0   31 o    237.1    5.0  563.1760  23.6253   563.1760  23.6253   563.1760  23.6253      237.1      5.0      237.1        5.0     0.0     0.0 
1 1 1   31    0   32 f    538.2    4.4 2896.9727  47.2506  2896.9727  47.2506  2896.9727  47.2506      538.2      4.4      538.2        4.4     0.0     0.0 
1 1 1   31    0   33 o    776.1    4.3 6025.0898  66.4062  6025.0898  66.4062  6025.0898  66.4062      776.1      4.3      776.1        4.3     0.0     0.0 
1 1 1   31    0   34 o    384.2    3.8 1476.9005  29.3720  1476.9005  29.3720  1476.9005  29.3720      384.2      3.8      384.2        3.8     0.0     0.0 
1 1 1   31    0   35 o    117.0    9.7  139.8362  22.3483   139.8362  22.3483   139.8362  22.3483      117.0      9.7      117.0        9.7     0.0     0.0 
1 1 1   31    0   36 o    519.6    3.6 2700.9465  37.0343  2700.9465  37.0343  2700.9465  37.0343      519.6      3.6      519.6        3.6     0.0     0.0 
1 1 1   31    0   37 o    430.1    3.6 1850.4355  30.6490  1850.4355  30.6490  1850.4355  30.6490      430.1      3.6      430.1        3.6     0.0     0.0 
1 1 1   31    0   38 f    630.1    3.8 3970.9661  47.8891  3970.9661  47.8891  3970.9661  47.8891      630.1      3.8      630.1        3.8     0.0     0.0 
1 1 1   31    0   39 o    261.1    4.3  682.5797  22.3483   682.5797  22.3483   682.5797  22.3483      261.1      4.3      261.1        4.3     0.0     0.0 
1 1 1   31    0   40 o    251.4    5.0  632.7749  24.9023   632.7749  24.9023   632.7749  24.9023      251.4      5.0      251.4        5.0     0.0     0.0 
1 1 1   31    0   41 o   1153.4    5.8 13309.3438 133.4510 13309.3438 133.4510 13309.3438 133.4510     1153.4      5.8     1153.4        5.8     0.0     0.0 
1 1 1   31    0   42 o   1071.9    5.5 11493.3896 118.1265 11493.3896 118.1265 11493.3896 118.1265     1071.9      5.5     1071.9        5.5     0.0     0.0 
1 1 1   31    0   43 o    224.8    5.3  506.3477  23.6253   506.3477  23.6253   506.3477  23.6253      224.8      5.3      224.8        5.3     0.0     0.0 
1 1 1   31    0   44 o    701.7    4.1 4924.9170  58.1055  4924.9170  58.1055  4924.9170  58.1055      701.7      4.1      701.7        4.1     0.0     0.0 
1 1 1   31    0   45 o     94.9   12.0   91.3086  22.9868    91.3086  22.9868    91.3086  22.9868       94.9     12.0       94.9       12.0     0.0     0.0 
1 1 1   31    0   46 o    175.3    7.1  309.0445  24.9023   309.0445  24.9023   309.0445  24.9023      175.3      7.1      175.3        7.1     0.0     0.0 
1 1 1   31    0   47 o    404.5    3.7 1637.1694  30.0105  1637.1694  30.0105  1637.1694  30.0105      404.5      3.7      404.5        3.7     0.0     0.0 
1 1 1   31    0   48 o    116.5   10.3  139.1977  23.6253   139.1977  23.6253   139.1977  23.6253      116.5     10.3      116.5       10.3     0.0     0.0 
1 1 1   31    0   49 o    278.9    4.6  778.9964  25.5409   778.9964  25.5409   778.9964  25.5409      278.9      4.6      278.9        4.6     0.0     0.0 
1 1 1   31    0   50 o    112.8   10.6  130.8969  23.6253   130.8969  23.6253   130.8969  23.6253      112.8     10.6      112.8       10.6     0.0     0.0 
1 1 1   31    0   51 o    325.4    4.3 1059.9459  28.0950  1059.9459  28.0950  1059.9459  28.0950      325.4      4.3      325.4        4.3     0.0     0.0 
1 1 1   31    0   52 o    151.0    8.7  230.5063  26.1794   230.5063  26.1794   230.5063  26.1794      151.0      8.7      151.0        8.7     0.0     0.0 
1 1 1   31    0   53 o    268.9    5.6  724.7220  30.0105   724.7220  30.0105   724.7220  30.0105      268.9      5.6      268.9        5.6     0.0     0.0 
1 1 1   31    0   54 o    478.4    3.8 2289.7385  36.3957  2289.7385  36.3957  2289.7385  36.3957      478.4      3.8      478.4        3.8     0.0     0.0 
1 1 1   31    0   55 o    183.0    7.9  337.1394  28.7335   337.1394  28.7335   337.1394  28.7335      183.0      7.9      183.0        7.9     0.0     0.0 
1 1 1   31    0   56 f    265.7    5.5  707.4820  29.3720   707.4820  29.3720   707.4820  29.3720      265.7      5.5      265.7        5.5     0.0     0.0 
1 1 1   31    0   57 o    302.8    5.3  918.1941  31.9261   918.1941  31.9261   918.1941  31.9261      302.8      5.3      302.8        5.3     0.0     0.0 
1 1 1   31    0   58 o    244.6    6.1  600.2103  30.0105   600.2103  30.0105   600.2103  30.0105      244.6      6.1      244.6        6.1     0.0     0.0 
1 1 1   31    0   59 o    470.6    4.3 2216.3086  40.8654  2216.3086  40.8654  2216.3086  40.8654      470.6      4.3      470.6        4.3     0.0     0.0 
1 1 1   31    0   60 o    100.1   15.5  105.9946  29.3720   105.9946  29.3720   105.9946  29.3720      100.1     15.5      100.1       15.5     0.0     0.0 
1 1 1   31    0   61 o    134.6   10.6  185.1713  28.0950   185.1713  28.0950   185.1713  28.0950      134.6     10.6      134.6       10.6     0.0     0.0 
1 1 1   31    0   62 o    130.6   11.7  175.5934  30.0105   175.5934  30.0105   175.5934  30.0105      130.6     11.7      130.6       11.7     0.0     0.0 
1 1 1   31    0   63 o    206.4    7.9  429.0865  32.5646   429.0865  32.5646   429.0865  32.5646      206.4      7.9      206.4        7.9     0.0     0.0 
1 1 1   31    0   64 o    303.5    5.6  923.3023  33.8416   923.3023  33.8416   923.3023  33.8416      303.5      5.6      303.5        5.6     0.0     0.0 
1 1 1   31    0   65 o     70.8   23.4   65.1292  29.3720    65.1292  29.3720    65.1292  29.3720       70.8     23.4       70.8       23.4     0.0     0.0 
1 1 1   31    0   66 o     43.9   24.3   28.0950  30.6490    28.0950  30.6490    28.0950  30.6490       43.9     24.3       43.9       24.3     0.0     0.0 
1 1 1   31    0   67 o     60.1   26.0   52.9973  31.9261    52.9973  31.9261    52.9973  31.9261       60.1     26.0       60.1       26.0     0.0     0.0 
1 1 1   31    0   68 o    195.6    8.5  386.3056  33.2031   386.3056  33.2031   386.3056  33.2031      195.6      8.5      195.6        8.5     0.0     0.0 
1 1 1   31    0   69 o     24.4   17.3  -31.9261  31.9261   -31.9261  31.9261   -31.9261  31.9261       24.4     17.3       24.4       17.3     0.0     0.0 
1 1 1   31    0   70 o    179.8    8.0  326.9231  28.7335   326.9231  28.7335   326.9231  28.7335      179.8      8.0      179.8        8.0     0.0     0.0 
1 1 1   31    0   71 o    369.9    4.7 1371.5444  34.4802  1371.5444  34.4802  1371.5444  34.4802      369.9      4.7      369.9        4.7     0.0     0.0 
1 1 1   31    0   72 o     32.4   20.7    5.7467  28.7335     5.7467  28.7335     5.7467  28.7335       32.4     20.7       32.4       20.7     0.0     0.0 
1 1 1   31    0   73 o     28.1   19.0  -10.8549  30.6490   -10.8549  30.6490   -10.8549  30.6490       28.1     19.0       28.1       19.0     0.0     0.0 
1 1 1   31    1    0 o    338.1    2.9 1143.5923  19.7942  1143.5923  19.7942  1143.5923  19.7942      338.1      2.9      338.1        2.9     0.0     0.0 
1 1 1   31    1    1 o   1037.1    3.9    0.0000   0.0000          ?        ? 10757.1738  81.0922          ?        ?     1037.1        3.9       ?       ? 
1 1 1   31    1    2 o   1484.4    5.4    0.0000   0.0000          ?        ? 22037.9355 159.6304          ?        ?     1484.4        5.4       ?       ? 
1 1 1   31    1    3 o    879.2    3.7    0.0000   0.0000          ?        ?  7729.9429  64.4907          ?        ?      879.2        3.7       ?       ? 
1 1 1   31    1    4 o    818.5    3.4    0.0000   0.0000          ?        ?  6699.3687  54.9129          ?        ?      818.5        3.4       ?       ? 
1 1 1   31    1    5 o    548.1    2.9    0.0000   0.0000          ?        ?  3004.2441  31.2876          ?        ?      548.1        2.9       ?       ? 
1 1 1   31    1    6 o   1882.0    6.5    0.0000   0.0000          ?        ? 35425.8203 245.1923          ?        ?     1882.0        6.5       ?       ? 
1 1 1   31    1    7 o    194.7    3.1    0.0000   0.0000          ?        ?   379.2819  12.1319          ?        ?      194.7        3.1       ?       ? 
1 1 1   31    1    8 o   1754.7    6.0    0.0000   0.0000          ?        ? 30793.9844 209.4351          ?        ?     1754.7        6.0       ?       ? 
1 1 1   31    1    9 o    663.1    2.8    0.0000   0.0000          ?        ?  4397.4985  37.6728          ?        ?      663.1        2.8       ?       ? 
1 1 1   31    1   10 o    419.6    2.5    0.0000   0.0000          ?        ?  1761.0426  21.0712          ?        ?      419.6        2.5       ?       ? 
1 1 1   31    1   11 o   1419.9    4.9    0.0000   0.0000          ?        ? 20163.2363 140.4748          ?        ?     1419.9        4.9       ?       ? 
1 1 1   31    1   12 f   2074.7    6.9    0.0000   0.0000          ?        ? 43052.9609 286.6962          ?        ?     2074.7        6.9       ?       ? 
1 1 1   31    1   13 o   1178.1    4.2    0.0000   0.0000          ?        ? 13880.8213  99.6094          ?        ?     1178.1        4.2       ?       ? 
1 1 1   31    1   14 f    970.4    3.7    0.0000   0.0000          ?        ?  9417.5557  72.1529          ?        ?      970.4        3.7       ?       ? 
1 1 1   31    1   15 o   1155.8    4.1    0.0000   0.0000          ?        ? 13360.4258  94.5012          ?        ?     1155.8        4.1       ?       ? 
1 1 1   31    1   16 o    320.5    2.4    0.0000   0.0000          ?        ?  1027.3812  15.3245          ?        ?      320.5        2.4       ?       ? 
1 1 1   31    1   17 o   1796.1    6.1    0.0000   0.0000          ?        ? 32264.4980 217.7359          ?        ?     1796.1        6.1       ?       ? 
1 1 1   31    1   18 o    991.5    3.8    0.0000   0.0000          ?        ?  9831.3174  74.7070          ?        ?      991.5        3.8       ?       ? 
1 1 1   31    1   19 o    965.5    3.5    0.0000   0.0000          ?        ?  9323.0537  68.3218          ?        ?      965.5        3.5       ?       ? 
1 1 1   31    1   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    1   21 o    974.8    3.6    0.0000   0.0000          ?        ?  9503.1182  70.8759          ?        ?      974.8        3.6       ?       ? 
1 1 1   31    1   22 o    834.0    3.3    0.0000   0.0000          ?        ?  6955.4165  54.9129          ?        ?      834.0        3.3       ?       ? 
1 1 1   31    1   23 o    379.8    2.4    0.0000   0.0000          ?        ?  1442.4203  18.5171          ?        ?      379.8        2.4       ?       ? 
1 1 1   31    1   24 o    452.6    2.5    0.0000   0.0000          ?        ?  2048.3772  22.3483          ?        ?      452.6        2.5       ?       ? 
1 1 1   31    1   25 o   1246.1    4.8    0.0000   0.0000          ?        ? 15529.4854 120.6806          ?        ?     1246.1        4.8       ?       ? 
1 1 1   31    1   26 o    241.0    3.0    0.0000   0.0000          ?        ?   581.0547  14.6860          ?        ?      241.0        3.0       ?       ? 
1 1 1   31    1   27 o   1014.6    4.0    0.0000   0.0000          ?        ? 10296.1611  81.7308          ?        ?     1014.6        4.0       ?       ? 
1 1 1   31    1   28 o    851.3    3.5    0.0000   0.0000          ?        ?  7248.4971  59.3825          ?        ?      851.3        3.5       ?       ? 
1 1 1   31    1   29 o    901.1    3.6    0.0000   0.0000          ?        ?  8120.7183  65.1292          ?        ?      901.1        3.6       ?       ? 
1 1 1   31    1   30 o    949.9    3.7    0.0000   0.0000          ?        ?  9024.8652  69.5989          ?        ?      949.9        3.7       ?       ? 
1 1 1   31    1   31 o    665.6    2.9    0.0000   0.0000          ?        ?  4430.7017  38.9498          ?        ?      665.6        2.9       ?       ? 
1 1 1   31    1   32 o    599.1    2.8    0.0000   0.0000          ?        ?  3589.7686  33.8416          ?        ?      599.1        2.8       ?       ? 
1 1 1   31    1   33 o    688.3    2.9    0.0000   0.0000          ?        ?  4737.8306  40.2269          ?        ?      688.3        2.9       ?       ? 
1 1 1   31    1   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    1   35 o    535.2    2.7    0.0000   0.0000          ?        ?  2864.4080  29.3720          ?        ?      535.2        2.7       ?       ? 
1 1 1   31    1   36 o    234.3    3.7    0.0000   0.0000          ?        ?   549.1286  17.2401          ?        ?      234.3        3.7       ?       ? 
1 1 1   31    1   37 o    765.4    3.1    0.0000   0.0000          ?        ?  5858.4360  47.2506          ?        ?      765.4        3.1       ?       ? 
1 1 1   31    1   38 o    117.9    6.8    0.0000   0.0000          ?        ?   139.1977  15.9630          ?        ?      117.9        6.8       ?       ? 
1 1 1   31    1   39 o    407.2    2.7    0.0000   0.0000          ?        ?  1658.2407  21.7097          ?        ?      407.2        2.7       ?       ? 
1 1 1   31    1   40 o    226.0    3.8    0.0000   0.0000          ?        ?   510.8173  17.2401          ?        ?      226.0        3.8       ?       ? 
1 1 1   31    1   41 o    142.2    6.1    0.0000   0.0000          ?        ?   202.4114  17.2401          ?        ?      142.2        6.1       ?       ? 
1 1 1   31    1   42 o    381.4    2.8    0.0000   0.0000          ?        ?  1454.5522  21.0712          ?        ?      381.4        2.8       ?       ? 
1 1 1   31    1   43 o    400.9    2.9    0.0000   0.0000          ?        ?  1607.7975  22.9868          ?        ?      400.9        2.9       ?       ? 
1 1 1   31    1   44 o    299.3    3.0    0.0000   0.0000          ?        ?   895.8459  17.8786          ?        ?      299.3        3.0       ?       ? 
1 1 1   31    1   45 o    193.7    4.3    0.0000   0.0000          ?        ?   375.4507  16.6016          ?        ?      193.7        4.3       ?       ? 
1 1 1   31    1   46 o    225.5    3.8    0.0000   0.0000          ?        ?   508.9017  17.2401          ?        ?      225.5        3.8       ?       ? 
1 1 1   31    1   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    1   48 o    358.6    2.8    0.0000   0.0000          ?        ?  1285.9825  19.7942          ?        ?      358.6        2.8       ?       ? 
1 1 1   31    1   49 o    318.7    3.0    0.0000   0.0000          ?        ?  1015.8879  19.1556          ?        ?      318.7        3.0       ?       ? 
1 1 1   31    1   50 o     80.1   10.8    0.0000   0.0000          ?        ?    64.4907  17.2401          ?        ?       80.1       10.8       ?       ? 
1 1 1   31    1   51 o    198.9    4.5    0.0000   0.0000          ?        ?   395.8834  17.8786          ?        ?      198.9        4.5       ?       ? 
1 1 1   31    1   52 o    282.7    3.6    0.0000   0.0000          ?        ?   799.4291  20.4327          ?        ?      282.7        3.6       ?       ? 
1 1 1   31    1   53 o    282.8    3.6    0.0000   0.0000          ?        ?   800.0676  20.4327          ?        ?      282.8        3.6       ?       ? 
1 1 1   31    1   54 o    515.1    2.8    0.0000   0.0000          ?        ?  2654.3345  28.7335          ?        ?      515.1        2.8       ?       ? 
1 1 1   31    1   55 o     35.7   15.2    0.0000   0.0000          ?        ?     0.0000  19.1556          ?        ?       35.7       15.2       ?       ? 
1 1 1   31    1   56 o    203.3    5.0    0.0000   0.0000          ?        ?   413.7620  20.4327          ?        ?      203.3        5.0       ?       ? 
1 1 1   31    1   57 o    474.5    2.9    0.0000   0.0000          ?        ?  2252.7041  27.4564          ?        ?      474.5        2.9       ?       ? 
1 1 1   31    1   58 o    198.3    5.2    0.0000   0.0000          ?        ?   393.9678  20.4327          ?        ?      198.3        5.2       ?       ? 
1 1 1   31    1   59 o    238.7    4.1    0.0000   0.0000          ?        ?   570.1998  19.7942          ?        ?      238.7        4.1       ?       ? 
1 1 1   31    1   60 o    182.2    5.6    0.0000   0.0000          ?        ?   332.6698  20.4327          ?        ?      182.2        5.6       ?       ? 
1 1 1   31    1   61 o    107.2    9.2    0.0000   0.0000          ?        ?   115.5724  19.7942          ?        ?      107.2        9.2       ?       ? 
1 1 1   31    1   62 o    310.9    3.7    0.0000   0.0000          ?        ?   967.3603  22.9868          ?        ?      310.9        3.7       ?       ? 
1 1 1   31    1   63 o    120.3    8.2    0.0000   0.0000          ?        ?   145.5829  19.7942          ?        ?      120.3        8.2       ?       ? 
1 1 1   31    1   64 o    306.6    3.7    0.0000   0.0000          ?        ?   941.1808  22.9868          ?        ?      306.6        3.7       ?       ? 
1 1 1   31    1   65 o    147.2    7.2    0.0000   0.0000          ?        ?   217.7359  21.0712          ?        ?      147.2        7.2       ?       ? 
1 1 1   31    1   66 o     22.3   11.1    0.0000   0.0000          ?        ?   -58.7440  21.0712          ?        ?       22.3       11.1       ?       ? 
1 1 1   31    1   67 o     95.3   10.7    0.0000   0.0000          ?        ?    91.9471  20.4327          ?        ?       95.3       10.7       ?       ? 
1 1 1   31    1   68 o    120.1    8.5    0.0000   0.0000          ?        ?   145.5829  20.4327          ?        ?      120.1        8.5       ?       ? 
1 1 1   31    1   69 o     34.7   15.3    0.0000   0.0000          ?        ?    -4.4697  20.4327          ?        ?       34.7       15.3       ?       ? 
1 1 1   31    1   70 o    114.2    9.2    0.0000   0.0000          ?        ?   132.1740  21.0712          ?        ?      114.2        9.2       ?       ? 
1 1 1   31    1   71 o    292.4    3.7    0.0000   0.0000          ?        ?   856.8960  21.7097          ?        ?      292.4        3.7       ?       ? 
1 1 1   31    1   72 o     19.9   10.1    0.0000   0.0000          ?        ?   -72.1529  20.4327          ?        ?       19.9       10.1       ?       ? 
1 1 1   31    2    0 o    862.9    4.8 7446.4390  83.0078  7446.4390  83.0078  7446.4390  83.0078      862.9      4.8      862.9        4.8     0.0     0.0 
1 1 1   31    2    1 o   1020.1    3.8    0.0000   0.0000          ?        ? 10406.6260  77.8996          ?        ?     1020.1        3.8       ?       ? 
1 1 1   31    2    2 o   1217.6    4.5    0.0000   0.0000          ?        ? 14825.8330 109.8257          ?        ?     1217.6        4.5       ?       ? 
1 1 1   31    2    3 o   1071.0    4.0    0.0000   0.0000          ?        ? 11470.4023  86.2004          ?        ?     1071.0        4.0       ?       ? 
1 1 1   31    2    4 o   1047.5    3.9    0.0000   0.0000          ?        ? 10972.3555  81.7308          ?        ?     1047.5        3.9       ?       ? 
1 1 1   31    2    5 o   1300.5    4.7    0.0000   0.0000          ?        ? 16915.7148 123.2347          ?        ?     1300.5        4.7       ?       ? 
1 1 1   31    2    6 o   1433.9    5.1    0.0000   0.0000          ?        ? 20564.2285 145.5829          ?        ?     1433.9        5.1       ?       ? 
1 1 1   31    2    7 o   1432.3    5.0    0.0000   0.0000          ?        ? 20516.9766 143.0288          ?        ?     1432.3        5.0       ?       ? 
1 1 1   31    2    8 o   1529.7    5.3    0.0000   0.0000          ?        ? 23402.4570 162.8230          ?        ?     1529.7        5.3       ?       ? 
1 1 1   31    2    9 o    775.0    3.0    0.0000   0.0000          ?        ?  6007.2114  47.2506          ?        ?      775.0        3.0       ?       ? 
1 1 1   31    2   10 o    796.5    3.2    0.0000   0.0000          ?        ?  6344.9893  50.4432          ?        ?      796.5        3.2       ?       ? 
1 1 1   31    2   11 o    479.4    2.5    0.0000   0.0000          ?        ?  2298.6777  23.6253          ?        ?      479.4        2.5       ?       ? 
1 1 1   31    2   12 o    828.9    3.2    0.0000   0.0000          ?        ?  6871.1309  53.6358          ?        ?      828.9        3.2       ?       ? 
1 1 1   31    2   13 o   1093.5    4.0    0.0000   0.0000          ?        ? 11958.2334  88.1160          ?        ?     1093.5        4.0       ?       ? 
1 1 1   31    2   14 o    785.9    3.1    0.0000   0.0000          ?        ?  6177.0586  49.1662          ?        ?      785.9        3.1       ?       ? 
1 1 1   31    2   15 o    983.1    3.7    0.0000   0.0000          ?        ?  9665.3018  72.1529          ?        ?      983.1        3.7       ?       ? 
1 1 1   31    2   16 o    664.7    2.9    0.0000   0.0000          ?        ?  4418.5698  38.3113          ?        ?      664.7        2.9       ?       ? 
1 1 1   31    2   17 o    141.4    4.5    0.0000   0.0000          ?        ?   199.8573  12.7704          ?        ?      141.4        4.5       ?       ? 
1 1 1   31    2   18 o    627.7    2.7    0.0000   0.0000          ?        ?  3939.6785  34.4802          ?        ?      627.7        2.7       ?       ? 
1 1 1   31    2   19 o    148.0    5.2    0.0000   0.0000          ?        ?   219.0129  15.3245          ?        ?      148.0        5.2       ?       ? 
1 1 1   31    2   20 o    576.8    2.6    0.0000   0.0000          ?        ?  3327.3359  30.0105          ?        ?      576.8        2.6       ?       ? 
1 1 1   31    2   21 o    768.4    3.0    0.0000   0.0000          ?        ?  5904.4097  46.6121          ?        ?      768.4        3.0       ?       ? 
1 1 1   31    2   22 o    623.6    2.8    0.0000   0.0000          ?        ?  3888.5967  34.4802          ?        ?      623.6        2.8       ?       ? 
1 1 1   31    2   23 o    102.6    6.8    0.0000   0.0000          ?        ?   105.3561  14.0475          ?        ?      102.6        6.8       ?       ? 
1 1 1   31    2   24 o    920.5    4.0    0.0000   0.0000          ?        ?  8473.1816  72.7915          ?        ?      920.5        4.0       ?       ? 
1 1 1   31    2   25 o    205.7    3.4    0.0000   0.0000          ?        ?   423.3398  14.0475          ?        ?      205.7        3.4       ?       ? 
1 1 1   31    2   26 o    396.8    2.6    0.0000   0.0000          ?        ?  1574.5944  20.4327          ?        ?      396.8        2.6       ?       ? 
1 1 1   31    2   27 o    312.6    3.0    0.0000   0.0000          ?        ?   976.9381  18.5171          ?        ?      312.6        3.0       ?       ? 
1 1 1   31    2   28 f    431.4    2.9    0.0000   0.0000          ?        ?  1861.2905  24.9023          ?        ?      431.4        2.9       ?       ? 
1 1 1   31    2   29 o    895.7    3.5    0.0000   0.0000          ?        ?  8023.0244  62.5751          ?        ?      895.7        3.5       ?       ? 
1 1 1   31    2   30 o    425.9    2.4    0.0000   0.0000          ?        ?  1814.0400  20.4327          ?        ?      425.9        2.4       ?       ? 
1 1 1   31    2   31 o    362.7    2.7    0.0000   0.0000          ?        ?  1315.3545  19.7942          ?        ?      362.7        2.7       ?       ? 
1 1 1   31    2   32 o    925.1    3.4    0.0000   0.0000          ?        ?  8558.7441  62.5751          ?        ?      925.1        3.4       ?       ? 
1 1 1   31    2   33 f    319.4    2.9    0.0000   0.0000          ?        ?  1020.3576  18.5171          ?        ?      319.4        2.9       ?       ? 
1 1 1   31    2   34 o    995.5    3.6    0.0000   0.0000          ?        ?  9912.4102  71.5144          ?        ?      995.5        3.6       ?       ? 
1 1 1   31    2   35 o     79.8   11.2    0.0000   0.0000          ?        ?    63.8522  17.8786          ?        ?       79.8       11.2       ?       ? 
1 1 1   31    2   36 o    806.6    3.0    0.0000   0.0000          ?        ?  6506.5352  49.1662          ?        ?      806.6        3.0       ?       ? 
1 1 1   31    2   37 o    471.0    2.5    0.0000   0.0000          ?        ?  2218.2241  23.6253          ?        ?      471.0        2.5       ?       ? 
1 1 1   31    2   38 o     68.5   12.6    0.0000   0.0000          ?        ?    48.5276  16.6016          ?        ?       68.5       12.6       ?       ? 
1 1 1   31    2   39 o    266.6    3.1    0.0000   0.0000          ?        ?   710.6746  16.6016          ?        ?      266.6        3.1       ?       ? 
1 1 1   31    2   40 o    474.2    2.6    0.0000   0.0000          ?        ?  2248.8733  24.2638          ?        ?      474.2        2.6       ?       ? 
1 1 1   31    2   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    2   42 o    303.0    3.1    0.0000   0.0000          ?        ?   918.1941  18.5171          ?        ?      303.0        3.1       ?       ? 
1 1 1   31    2   43 o    440.2    2.7    0.0000   0.0000          ?        ?  1937.9131  23.6253          ?        ?      440.2        2.7       ?       ? 
1 1 1   31    2   44 o    389.9    2.7    0.0000   0.0000          ?        ?  1520.3201  21.0712          ?        ?      389.9        2.7       ?       ? 
1 1 1   31    2   45 o    430.0    2.7    0.0000   0.0000          ?        ?  1849.1587  23.6253          ?        ?      430.0        2.7       ?       ? 
1 1 1   31    2   46 o    364.4    2.7    0.0000   0.0000          ?        ?  1328.1250  19.7942          ?        ?      364.4        2.7       ?       ? 
1 1 1   31    2   47 f    285.8    3.4    0.0000   0.0000          ?        ?   817.3077  19.1556          ?        ?      285.8        3.4       ?       ? 
1 1 1   31    2   48 o    378.8    2.9    0.0000   0.0000          ?        ?  1435.3966  21.7097          ?        ?      378.8        2.9       ?       ? 
1 1 1   31    2   49 o     18.7    9.4    0.0000   0.0000          ?        ?   -59.3825  17.2401          ?        ?       18.7        9.4       ?       ? 
1 1 1   31    2   50 o     20.5   10.2    0.0000   0.0000          ?        ?   -46.6121  17.2401          ?        ?       20.5       10.2       ?       ? 
1 1 1   31    2   51 o    285.7    3.5    0.0000   0.0000          ?        ?   816.6692  19.7942          ?        ?      285.7        3.5       ?       ? 
1 1 1   31    2   52 o    221.5    4.2    0.0000   0.0000          ?        ?   491.0231  18.5171          ?        ?      221.5        4.2       ?       ? 
1 1 1   31    2   53 o    255.1    3.8    0.0000   0.0000          ?        ?   651.2921  19.1556          ?        ?      255.1        3.8       ?       ? 
1 1 1   31    2   54 o    493.9    2.8    0.0000   0.0000          ?        ?  2440.4297  28.0950          ?        ?      493.9        2.8       ?       ? 
1 1 1   31    2   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    2   56 o     80.3   12.3    0.0000   0.0000          ?        ?    65.1292  19.7942          ?        ?       80.3       12.3       ?       ? 
1 1 1   31    2   57 o    390.3    3.0    0.0000   0.0000          ?        ?  1524.1511  23.6253          ?        ?      390.3        3.0       ?       ? 
1 1 1   31    2   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    2   59 o    186.4    5.3    0.0000   0.0000          ?        ?   347.9943  19.7942          ?        ?      186.4        5.3       ?       ? 
1 1 1   31    2   60 o    341.3    3.4    0.0000   0.0000          ?        ?  1165.9406  22.9868          ?        ?      341.3        3.4       ?       ? 
1 1 1   31    2   61 o    185.8    5.7    0.0000   0.0000          ?        ?   346.0787  21.0712          ?        ?      185.8        5.7       ?       ? 
1 1 1   31    2   62 o    227.2    4.6    0.0000   0.0000          ?        ?   517.2025  21.0712          ?        ?      227.2        4.6       ?       ? 
1 1 1   31    2   63 o     24.5   12.1    0.0000   0.0000          ?        ?   -41.5039  20.4327          ?        ?       24.5       12.1       ?       ? 
1 1 1   31    2   64 o     47.0   16.9    0.0000   0.0000          ?        ?    19.1556  20.4327          ?        ?       47.0       16.9       ?       ? 
1 1 1   31    2   65 o    268.7    4.2    0.0000   0.0000          ?        ?   723.4450  22.3483          ?        ?      268.7        4.2       ?       ? 
1 1 1   31    2   66 o    195.3    5.4    0.0000   0.0000          ?        ?   382.4745  21.0712          ?        ?      195.3        5.4       ?       ? 
1 1 1   31    2   67 o    281.6    3.9    0.0000   0.0000          ?        ?   794.3209  21.7097          ?        ?      281.6        3.9       ?       ? 
1 1 1   31    2   68 o    106.2    9.9    0.0000   0.0000          ?        ?   114.2954  21.0712          ?        ?      106.2        9.9       ?       ? 
1 1 1   31    2   69 o    132.7    7.7    0.0000   0.0000          ?        ?   177.5090  20.4327          ?        ?      132.7        7.7       ?       ? 
1 1 1   31    2   70 o    170.0    6.0    0.0000   0.0000          ?        ?   290.5273  20.4327          ?        ?      170.0        6.0       ?       ? 
1 1 1   31    2   71 o     23.1   11.5    0.0000   0.0000          ?        ?   -52.3588  21.0712          ?        ?       23.1       11.5       ?       ? 
1 1 1   31    2   72 o    146.2    7.0    0.0000   0.0000          ?        ?   215.8203  20.4327          ?        ?      146.2        7.0       ?       ? 
1 1 1   31    3    0 o   1277.4    6.7 16319.9736 172.4008 16319.9736 172.4008 16319.9736 172.4008     1277.4      6.7     1277.4        6.7     0.0     0.0 
1 1 1   31    3    1 o    438.9    2.7    0.0000   0.0000          ?        ?  1926.4198  23.6253          ?        ?      438.9        2.7       ?       ? 
1 1 1   31    3    2 o    660.1    3.0    0.0000   0.0000          ?        ?  4357.2720  38.9498          ?        ?      660.1        3.0       ?       ? 
1 1 1   31    3    3 o    812.8    3.4    0.0000   0.0000          ?        ?  6606.7827  55.5514          ?        ?      812.8        3.4       ?       ? 
1 1 1   31    3    4 o    725.0    3.0    0.0000   0.0000          ?        ?  5256.3101  43.4195          ?        ?      725.0        3.0       ?       ? 
1 1 1   31    3    5 o    146.9    3.9    0.0000   0.0000          ?        ?   215.8203  11.4934          ?        ?      146.9        3.9       ?       ? 
1 1 1   31    3    6 o    611.5    2.7    0.0000   0.0000          ?        ?  3739.1824  33.2031          ?        ?      611.5        2.7       ?       ? 
1 1 1   31    3    7 o    898.9    3.5    0.0000   0.0000          ?        ?  8081.1294  63.2136          ?        ?      898.9        3.5       ?       ? 
1 1 1   31    3    8 o    280.5    2.5    0.0000   0.0000          ?        ?   786.6586  14.0475          ?        ?      280.5        2.5       ?       ? 
1 1 1   31    3    9 o    911.1    3.5    0.0000   0.0000          ?        ?  8300.7812  64.4907          ?        ?      911.1        3.5       ?       ? 
1 1 1   31    3   10 o   1470.3    5.2    0.0000   0.0000          ?        ? 21620.3418 153.2452          ?        ?     1470.3        5.2       ?       ? 
1 1 1   31    3   11 f   1952.3    6.7    0.0000   0.0000          ?        ? 38121.6562 262.4324          ?        ?     1952.3        6.7       ?       ? 
1 1 1   31    3   12 o    322.8    2.6    0.0000   0.0000          ?        ?  1042.0673  16.6016          ?        ?      322.8        2.6       ?       ? 
1 1 1   31    3   13 o   1210.6    4.5    0.0000   0.0000          ?        ? 14656.6250 109.1872          ?        ?     1210.6        4.5       ?       ? 
1 1 1   31    3   14 o    825.0    3.2    0.0000   0.0000          ?        ?  6806.0020  52.3588          ?        ?      825.0        3.2       ?       ? 
1 1 1   31    3   15 o    504.7    2.3    0.0000   0.0000          ?        ?  2547.0627  23.6253          ?        ?      504.7        2.3       ?       ? 
1 1 1   31    3   16 o    293.8    2.4    0.0000   0.0000          ?        ?   863.2812  14.0475          ?        ?      293.8        2.4       ?       ? 
1 1 1   31    3   17 o    872.1    3.4    0.0000   0.0000          ?        ?  7606.0693  58.7440          ?        ?      872.1        3.4       ?       ? 
1 1 1   31    3   18 o   1078.5    4.0    0.0000   0.0000          ?        ? 11631.9482  86.8389          ?        ?     1078.5        4.0       ?       ? 
1 1 1   31    3   19 o    336.0    2.7    0.0000   0.0000          ?        ?  1128.9062  17.8786          ?        ?      336.0        2.7       ?       ? 
1 1 1   31    3   20 o    491.7    2.5    0.0000   0.0000          ?        ?  2417.4429  24.9023          ?        ?      491.7        2.5       ?       ? 
1 1 1   31    3   21 o    660.4    2.9    0.0000   0.0000          ?        ?  4361.1025  38.3113          ?        ?      660.4        2.9       ?       ? 
1 1 1   31    3   22 o    602.5    2.6    0.0000   0.0000          ?        ?  3629.9954  31.9261          ?        ?      602.5        2.6       ?       ? 
1 1 1   31    3   23 o    893.3    3.6    0.0000   0.0000          ?        ?  7979.6045  65.1292          ?        ?      893.3        3.6       ?       ? 
1 1 1   31    3   24 o   1045.4    3.9    0.0000   0.0000          ?        ? 10928.9355  81.7308          ?        ?     1045.4        3.9       ?       ? 
1 1 1   31    3   25 o    595.6    2.7    0.0000   0.0000          ?        ?  3546.9875  32.5646          ?        ?      595.6        2.7       ?       ? 
1 1 1   31    3   26 o    646.2    3.1    0.0000   0.0000          ?        ?  4175.9316  40.2269          ?        ?      646.2        3.1       ?       ? 
1 1 1   31    3   27 f   1211.2    4.7    0.0000   0.0000          ?        ? 14671.9502 114.9339          ?        ?     1211.2        4.7       ?       ? 
1 1 1   31    3   28 o   1116.4    4.3    0.0000   0.0000          ?        ? 12464.5801  95.7782          ?        ?     1116.4        4.3       ?       ? 
1 1 1   31    3   29 o    969.3    4.1    0.0000   0.0000          ?        ?  9396.4844  79.1767          ?        ?      969.3        4.1       ?       ? 
1 1 1   31    3   30 o    184.6    5.2    0.0000   0.0000          ?        ?   340.9706  19.1556          ?        ?      184.6        5.2       ?       ? 
1 1 1   31    3   31 o    238.0    3.6    0.0000   0.0000          ?        ?   566.3687  17.2401          ?        ?      238.0        3.6       ?       ? 
1 1 1   31    3   32 o   1102.4    4.3    0.0000   0.0000          ?        ? 12154.2588  93.8627          ?        ?     1102.4        4.3       ?       ? 
1 1 1   31    3   33 o    446.7    2.7    0.0000   0.0000          ?        ?  1995.3801  24.2638          ?        ?      446.7        2.7       ?       ? 
1 1 1   31    3   34 o    657.0    3.1    0.0000   0.0000          ?        ?  4316.4062  40.2269          ?        ?      657.0        3.1       ?       ? 
1 1 1   31    3   35 o    539.6    2.7    0.0000   0.0000          ?        ?  2912.2971  29.3720          ?        ?      539.6        2.7       ?       ? 
1 1 1   31    3   36 f    671.0    2.9    0.0000   0.0000          ?        ?  4503.4932  39.5883          ?        ?      671.0        2.9       ?       ? 
1 1 1   31    3   37 o    122.2    6.8    0.0000   0.0000          ?        ?   149.4141  16.6016          ?        ?      122.2        6.8       ?       ? 
1 1 1   31    3   38 o    557.1    2.8    0.0000   0.0000          ?        ?  3104.4922  30.6490          ?        ?      557.1        2.8       ?       ? 
1 1 1   31    3   39 o    605.0    2.8    0.0000   0.0000          ?        ?  3661.2832  34.4802          ?        ?      605.0        2.8       ?       ? 
1 1 1   31    3   40 o    149.4    5.6    0.0000   0.0000          ?        ?   223.4826  16.6016          ?        ?      149.4        5.6       ?       ? 
1 1 1   31    3   41 o    511.4    2.7    0.0000   0.0000          ?        ?  2616.0232  27.4564          ?        ?      511.4        2.7       ?       ? 
1 1 1   31    3   42 o    563.7    2.7    0.0000   0.0000          ?        ?  3177.9221  30.6490          ?        ?      563.7        2.7       ?       ? 
1 1 1   31    3   43 o    351.1    2.8    0.0000   0.0000          ?        ?  1232.9854  19.7942          ?        ?      351.1        2.8       ?       ? 
1 1 1   31    3   44 o    264.7    3.5    0.0000   0.0000          ?        ?   701.0967  18.5171          ?        ?      264.7        3.5       ?       ? 
1 1 1   31    3   45 o    343.4    2.9    0.0000   0.0000          ?        ?  1179.3494  19.7942          ?        ?      343.4        2.9       ?       ? 
1 1 1   31    3   46 f     84.1    9.5    0.0000   0.0000          ?        ?    70.8759  15.9630          ?        ?       84.1        9.5       ?       ? 
1 1 1   31    3   47 o    245.7    3.5    0.0000   0.0000          ?        ?   604.0414  17.2401          ?        ?      245.7        3.5       ?       ? 
1 1 1   31    3   48 o    190.7    4.5    0.0000   0.0000          ?        ?   363.9573  17.2401          ?        ?      190.7        4.5       ?       ? 
1 1 1   31    3   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    3   50 o    175.2    5.1    0.0000   0.0000          ?        ?   307.1289  17.8786          ?        ?      175.2        5.1       ?       ? 
1 1 1   31    3   51 o    314.0    3.3    0.0000   0.0000          ?        ?   986.5159  20.4327          ?        ?      314.0        3.3       ?       ? 
1 1 1   31    3   52 o    359.8    3.1    0.0000   0.0000          ?        ?  1294.9219  22.3483          ?        ?      359.8        3.1       ?       ? 
1 1 1   31    3   53 o     19.3    9.8    0.0000   0.0000          ?        ?   -68.9603  19.1556          ?        ?       19.3        9.8       ?       ? 
1 1 1   31    3   54 o     31.3   14.3    0.0000   0.0000          ?        ?   -12.7704  19.7942          ?        ?       31.3       14.3       ?       ? 
1 1 1   31    3   55 f    534.0    2.8    0.0000   0.0000          ?        ?  2852.9146  30.0105          ?        ?      534.0        2.8       ?       ? 
1 1 1   31    3   56 o    122.3    7.8    0.0000   0.0000          ?        ?   150.0526  19.1556          ?        ?      122.3        7.8       ?       ? 
1 1 1   31    3   57 o     87.2   10.6    0.0000   0.0000          ?        ?    76.6226  18.5171          ?        ?       87.2       10.6       ?       ? 
1 1 1   31    3   58 f    378.9    3.1    0.0000   0.0000          ?        ?  1436.6737  23.6253          ?        ?      378.9        3.1       ?       ? 
1 1 1   31    3   59 o    160.4    6.2    0.0000   0.0000          ?        ?   257.9627  19.7942          ?        ?      160.4        6.2       ?       ? 
1 1 1   31    3   60 o    293.0    3.6    0.0000   0.0000          ?        ?   859.4501  21.0712          ?        ?      293.0        3.6       ?       ? 
1 1 1   31    3   61 o    196.0    5.0    0.0000   0.0000          ?        ?   385.0285  19.7942          ?        ?      196.0        5.0       ?       ? 
1 1 1   31    3   62 o     26.1   12.6    0.0000   0.0000          ?        ?   -30.6490  19.7942          ?        ?       26.1       12.6       ?       ? 
1 1 1   31    3   63 o     33.6   15.0    0.0000   0.0000          ?        ?    -7.6623  20.4327          ?        ?       33.6       15.0       ?       ? 
1 1 1   31    3   64 o    167.1    6.3    0.0000   0.0000          ?        ?   280.3110  21.0712          ?        ?      167.1        6.3       ?       ? 
1 1 1   31    3   65 o    304.4    3.7    0.0000   0.0000          ?        ?   927.7720  22.3483          ?        ?      304.4        3.7       ?       ? 
1 1 1   31    3   66 o    168.6    6.3    0.0000   0.0000          ?        ?   285.4192  21.0712          ?        ?      168.6        6.3       ?       ? 
1 1 1   31    3   67 o    122.9    8.8    0.0000   0.0000          ?        ?   152.6067  21.7097          ?        ?      122.9        8.8       ?       ? 
1 1 1   31    3   68 o    155.0    7.2    0.0000   0.0000          ?        ?   241.9997  22.3483          ?        ?      155.0        7.2       ?       ? 
1 1 1   31    3   69 o    162.3    6.5    0.0000   0.0000          ?        ?   264.9865  21.0712          ?        ?      162.3        6.5       ?       ? 
1 1 1   31    3   70 o     22.3   11.1    0.0000   0.0000          ?        ?   -58.1055  21.0712          ?        ?       22.3       11.1       ?       ? 
1 1 1   31    3   71 o     43.7   16.9    0.0000   0.0000          ?        ?    14.0475  21.0712          ?        ?       43.7       16.9       ?       ? 
1 1 1   31    3   72 o    103.7    9.8    0.0000   0.0000          ?        ?   109.8257  20.4327          ?        ?      103.7        9.8       ?       ? 
1 1 1   31    4    0 o    857.2    4.7 7348.7456  81.0922  7348.7456  81.0922  7348.7456  81.0922      857.2      4.7      857.2        4.7     0.0     0.0 
1 1 1   31    4    1 o   1267.0    4.7    0.0000   0.0000          ?        ? 16055.6260 118.1265          ?        ?     1267.0        4.7       ?       ? 
1 1 1   31    4    2 o    462.8    2.7    0.0000   0.0000          ?        ?  2142.2400  24.9023          ?        ?      462.8        2.7       ?       ? 
1 1 1   31    4    3 o   1596.0    5.6    0.0000   0.0000          ?        ? 25474.4590 179.4246          ?        ?     1596.0        5.6       ?       ? 
1 1 1   31    4    4 o    750.6    3.0    0.0000   0.0000          ?        ?  5634.9531  44.6965          ?        ?      750.6        3.0       ?       ? 
1 1 1   31    4    5 o    599.7    2.6    0.0000   0.0000          ?        ?  3596.1538  30.6490          ?        ?      599.7        2.6       ?       ? 
1 1 1   31    4    6 o   1031.6    3.8    0.0000   0.0000          ?        ? 10643.5176  77.8996          ?        ?     1031.6        3.8       ?       ? 
1 1 1   31    4    7 o    548.0    2.6    0.0000   0.0000          ?        ?  3002.9670  28.0950          ?        ?      548.0        2.6       ?       ? 
1 1 1   31    4    8 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    4    9 f    344.2    2.3    0.0000   0.0000          ?        ?  1184.4576  15.9630          ?        ?      344.2        2.3       ?       ? 
1 1 1   31    4   10 o    956.5    3.5    0.0000   0.0000          ?        ?  9149.3770  66.4062          ?        ?      956.5        3.5       ?       ? 
1 1 1   31    4   11 o    965.0    3.6    0.0000   0.0000          ?        ?  9313.4766  68.9603          ?        ?      965.0        3.6       ?       ? 
1 1 1   31    4   12 o    398.6    2.3    0.0000   0.0000          ?        ?  1588.6418  18.5171          ?        ?      398.6        2.3       ?       ? 
1 1 1   31    4   13 o   1190.2    4.2    0.0000   0.0000          ?        ? 14167.5186 100.8864          ?        ?     1190.2        4.2       ?       ? 
1 1 1   31    4   14 o    921.3    3.5    0.0000   0.0000          ?        ?  8489.1455  64.4907          ?        ?      921.3        3.5       ?       ? 
1 1 1   31    4   15 o    490.4    2.5    0.0000   0.0000          ?        ?  2404.6724  24.9023          ?        ?      490.4        2.5       ?       ? 
1 1 1   31    4   16 o    602.6    2.8    0.0000   0.0000          ?        ?  3631.2725  33.2031          ?        ?      602.6        2.8       ?       ? 
1 1 1   31    4   17 o    785.5    3.1    0.0000   0.0000          ?        ?  6170.0342  49.1662          ?        ?      785.5        3.1       ?       ? 
1 1 1   31    4   18 f    559.4    2.7    0.0000   0.0000          ?        ?  3129.3945  30.0105          ?        ?      559.4        2.7       ?       ? 
1 1 1   31    4   19 o    831.3    3.5    0.0000   0.0000          ?        ?  6910.7197  57.4669          ?        ?      831.3        3.5       ?       ? 
1 1 1   31    4   20 o    482.8    2.4    0.0000   0.0000          ?        ?  2330.6040  23.6253          ?        ?      482.8        2.4       ?       ? 
1 1 1   31    4   21 f    609.2    2.9    0.0000   0.0000          ?        ?  3711.0879  35.7572          ?        ?      609.2        2.9       ?       ? 
1 1 1   31    4   22 o    246.2    2.9    0.0000   0.0000          ?        ?   605.9570  14.0475          ?        ?      246.2        2.9       ?       ? 
1 1 1   31    4   23 o    506.6    2.6    0.0000   0.0000          ?        ?  2566.8569  26.1794          ?        ?      506.6        2.6       ?       ? 
1 1 1   31    4   24 o    465.3    2.8    0.0000   0.0000          ?        ?  2165.2268  26.1794          ?        ?      465.3        2.8       ?       ? 
1 1 1   31    4   25 f    184.6    4.0    0.0000   0.0000          ?        ?   340.9706  14.6860          ?        ?      184.6        4.0       ?       ? 
1 1 1   31    4   26 o   1137.9    4.7    0.0000   0.0000          ?        ? 12949.8574 105.9946          ?        ?     1137.9        4.7       ?       ? 
1 1 1   31    4   27 o    620.8    3.0    0.0000   0.0000          ?        ?  3854.7551  37.6728          ?        ?      620.8        3.0       ?       ? 
1 1 1   31    4   28 o    395.8    2.7    0.0000   0.0000          ?        ?  1566.2936  21.0712          ?        ?      395.8        2.7       ?       ? 
1 1 1   31    4   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    4   30 o    902.4    3.6    0.0000   0.0000          ?        ?  8144.9819  65.7677          ?        ?      902.4        3.6       ?       ? 
1 1 1   31    4   31 o    577.9    2.7    0.0000   0.0000          ?        ?  3340.1064  31.2876          ?        ?      577.9        2.7       ?       ? 
1 1 1   31    4   32 f    434.7    2.6    0.0000   0.0000          ?        ?  1890.0240  22.3483          ?        ?      434.7        2.6       ?       ? 
1 1 1   31    4   33 o    243.4    3.4    0.0000   0.0000          ?        ?   592.5481  16.6016          ?        ?      243.4        3.4       ?       ? 
1 1 1   31    4   34 f    460.3    2.6    0.0000   0.0000          ?        ?  2118.6147  24.2638          ?        ?      460.3        2.6       ?       ? 
1 1 1   31    4   35 o     84.1    9.1    0.0000   0.0000          ?        ?    70.8759  15.3245          ?        ?       84.1        9.1       ?       ? 
1 1 1   31    4   36 o    270.8    3.2    0.0000   0.0000          ?        ?   733.6614  17.2401          ?        ?      270.8        3.2       ?       ? 
1 1 1   31    4   37 o    530.4    2.7    0.0000   0.0000          ?        ?  2813.9648  28.7335          ?        ?      530.4        2.7       ?       ? 
1 1 1   31    4   38 o    169.5    5.1    0.0000   0.0000          ?        ?   287.3347  17.2401          ?        ?      169.5        5.1       ?       ? 
1 1 1   31    4   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    4   40 o    248.6    3.6    0.0000   0.0000          ?        ?   618.0889  17.8786          ?        ?      248.6        3.6       ?       ? 
1 1 1   31    4   41 o    281.8    3.1    0.0000   0.0000          ?        ?   794.3209  17.2401          ?        ?      281.8        3.1       ?       ? 
1 1 1   31    4   42 o    294.4    3.3    0.0000   0.0000          ?        ?   867.1124  19.1556          ?        ?      294.4        3.3       ?       ? 
1 1 1   31    4   43 o     18.3    9.2    0.0000   0.0000          ?        ?   -52.3588  15.9630          ?        ?       18.3        9.2       ?       ? 
1 1 1   31    4   44 o     18.9    9.5    0.0000   0.0000          ?        ?   -47.8891  15.9630          ?        ?       18.9        9.5       ?       ? 
1 1 1   31    4   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    4   46 o    543.9    2.8    0.0000   0.0000          ?        ?  2959.5479  30.6490          ?        ?      543.9        2.8       ?       ? 
1 1 1   31    4   47 o     32.9   14.4    0.0000   0.0000          ?        ?    -3.8311  17.8786          ?        ?       32.9       14.4       ?       ? 
1 1 1   31    4   48 o    381.6    2.8    0.0000   0.0000          ?        ?  1456.4679  21.7097          ?        ?      381.6        2.8       ?       ? 
1 1 1   31    4   49 o    238.7    4.0    0.0000   0.0000          ?        ?   570.1998  19.1556          ?        ?      238.7        4.0       ?       ? 
1 1 1   31    4   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    4   51 o    402.9    2.9    0.0000   0.0000          ?        ?  1623.7605  22.9868          ?        ?      402.9        2.9       ?       ? 
1 1 1   31    4   52 o    537.5    2.7    0.0000   0.0000          ?        ?  2890.5874  29.3720          ?        ?      537.5        2.7       ?       ? 
1 1 1   31    4   53 o    340.7    3.1    0.0000   0.0000          ?        ?  1161.4708  21.0712          ?        ?      340.7        3.1       ?       ? 
1 1 1   31    4   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    4   55 o    180.7    5.3    0.0000   0.0000          ?        ?   326.9231  19.1556          ?        ?      180.7        5.3       ?       ? 
1 1 1   31    4   56 o    161.8    5.9    0.0000   0.0000          ?        ?   262.4324  19.1556          ?        ?      161.8        5.9       ?       ? 
1 1 1   31    4   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    4   58 o    174.0    5.3    0.0000   0.0000          ?        ?   303.2978  18.5171          ?        ?      174.0        5.3       ?       ? 
1 1 1   31    4   59 o    320.1    3.4    0.0000   0.0000          ?        ?  1025.4658  21.7097          ?        ?      320.1        3.4       ?       ? 
1 1 1   31    4   60 o    104.4    9.8    0.0000   0.0000          ?        ?   109.8257  20.4327          ?        ?      104.4        9.8       ?       ? 
1 1 1   31    4   61 o    181.1    5.6    0.0000   0.0000          ?        ?   328.8386  20.4327          ?        ?      181.1        5.6       ?       ? 
1 1 1   31    4   62 o    385.5    3.0    0.0000   0.0000          ?        ?  1487.1168  22.9868          ?        ?      385.5        3.0       ?       ? 
1 1 1   31    4   63 o    320.0    3.5    0.0000   0.0000          ?        ?  1025.4658  22.3483          ?        ?      320.0        3.5       ?       ? 
1 1 1   31    4   64 o    238.4    4.4    0.0000   0.0000          ?        ?   569.5613  21.0712          ?        ?      238.4        4.4       ?       ? 
1 1 1   31    4   65 o     25.5   12.4    0.0000   0.0000          ?        ?   -36.3957  20.4327          ?        ?       25.5       12.4       ?       ? 
1 1 1   31    4   66 o    215.9    4.7    0.0000   0.0000          ?        ?   467.3978  20.4327          ?        ?      215.9        4.7       ?       ? 
1 1 1   31    4   67 o    197.0    5.2    0.0000   0.0000          ?        ?   389.4982  20.4327          ?        ?      197.0        5.2       ?       ? 
1 1 1   31    4   68 o    144.0    7.3    0.0000   0.0000          ?        ?   208.7966  21.0712          ?        ?      144.0        7.3       ?       ? 
1 1 1   31    4   69 o    147.8    7.1    0.0000   0.0000          ?        ?   220.2900  21.0712          ?        ?      147.8        7.1       ?       ? 
1 1 1   31    4   70 o     30.7   14.1    0.0000   0.0000          ?        ?   -13.4090  19.7942          ?        ?       30.7       14.1       ?       ? 
1 1 1   31    4   71 o     71.7   15.2    0.0000   0.0000          ?        ?    55.5514  21.0712          ?        ?       71.7       15.2       ?       ? 
1 1 1   31    5    0 o   1190.4    6.0 14172.6270 141.7518 14172.6270 141.7518 14172.6270 141.7518     1190.4      6.0     1190.4        6.0     0.0     0.0 
1 1 1   31    5    1 o    382.7    2.4    0.0000   0.0000          ?        ?  1464.7686  18.5171          ?        ?      382.7        2.4       ?       ? 
1 1 1   31    5    2 o    961.1    3.6    0.0000   0.0000          ?        ?  9237.4922  69.5989          ?        ?      961.1        3.6       ?       ? 
1 1 1   31    5    3 o    925.8    3.5    0.0000   0.0000          ?        ?  8572.1533  65.1292          ?        ?      925.8        3.5       ?       ? 
1 1 1   31    5    4 o    943.8    3.6    0.0000   0.0000          ?        ?  8908.6533  67.0448          ?        ?      943.8        3.6       ?       ? 
1 1 1   31    5    5 o    696.6    2.9    0.0000   0.0000          ?        ?  4852.1260  40.2269          ?        ?      696.6        2.9       ?       ? 
1 1 1   31    5    6 o    381.7    2.6    0.0000   0.0000          ?        ?  1457.1063  19.7942          ?        ?      381.7        2.6       ?       ? 
1 1 1   31    5    7 o   2292.7    7.8    0.0000   0.0000          ?        ? 52581.6211 357.5721          ?        ?     2292.7        7.8       ?       ? 
1 1 1   31    5    8 o    224.6    2.6    0.0000   0.0000          ?        ?   504.4321  11.4934          ?        ?      224.6        2.6       ?       ? 
1 1 1   31    5    9 o    337.3    2.4    0.0000   0.0000          ?        ?  1137.8455  15.9630          ?        ?      337.3        2.4       ?       ? 
1 1 1   31    5   10 f   1162.6    4.3    0.0000   0.0000          ?        ? 13517.5029  98.9709          ?        ?     1162.6        4.3       ?       ? 
1 1 1   31    5   11 o    935.0    3.5    0.0000   0.0000          ?        ?  8741.9990  65.1292          ?        ?      935.0        3.5       ?       ? 
1 1 1   31    5   12 o   1443.7    4.9    0.0000   0.0000          ?        ? 20843.8984 141.1133          ?        ?     1443.7        4.9       ?       ? 
1 1 1   31    5   13 o    991.2    3.7    0.0000   0.0000          ?        ?  9826.2090  73.4300          ?        ?      991.2        3.7       ?       ? 
1 1 1   31    5   14 o    489.8    2.4    0.0000   0.0000          ?        ?  2399.5642  23.6253          ?        ?      489.8        2.4       ?       ? 
1 1 1   31    5   15 o    640.7    2.8    0.0000   0.0000          ?        ?  4105.6938  35.7572          ?        ?      640.7        2.8       ?       ? 
1 1 1   31    5   16 o    711.9    2.9    0.0000   0.0000          ?        ?  5067.9463  40.8654          ?        ?      711.9        2.9       ?       ? 
1 1 1   31    5   17 o    845.2    3.4    0.0000   0.0000          ?        ?  7144.4185  57.4669          ?        ?      845.2        3.4       ?       ? 
1 1 1   31    5   18 f    888.9    3.4    0.0000   0.0000          ?        ?  7902.3433  61.2981          ?        ?      888.9        3.4       ?       ? 
1 1 1   31    5   19 o    571.3    2.7    0.0000   0.0000          ?        ?  3263.4841  31.2876          ?        ?      571.3        2.7       ?       ? 
1 1 1   31    5   20 o    366.0    2.4    0.0000   0.0000          ?        ?  1339.6184  17.8786          ?        ?      366.0        2.4       ?       ? 
1 1 1   31    5   21 o    346.6    2.8    0.0000   0.0000          ?        ?  1201.6976  19.1556          ?        ?      346.6        2.8       ?       ? 
1 1 1   31    5   22 o   1258.6    4.6    0.0000   0.0000          ?        ? 15841.7217 114.9339          ?        ?     1258.6        4.6       ?       ? 
1 1 1   31    5   23 o    151.8    4.2    0.0000   0.0000          ?        ?   230.5063  12.7704          ?        ?      151.8        4.2       ?       ? 
1 1 1   31    5   24 o    989.8    3.8    0.0000   0.0000          ?        ?  9798.7529  75.3456          ?        ?      989.8        3.8       ?       ? 
1 1 1   31    5   25 o    652.3    2.8    0.0000   0.0000          ?        ?  4255.7466  37.0343          ?        ?      652.3        2.8       ?       ? 
1 1 1   31    5   26 o    736.9    3.1    0.0000   0.0000          ?        ?  5430.6265  45.3350          ?        ?      736.9        3.1       ?       ? 
1 1 1   31    5   27 o    412.4    2.6    0.0000   0.0000          ?        ?  1701.0216  21.7097          ?        ?      412.4        2.6       ?       ? 
1 1 1   31    5   28 o    571.6    2.8    0.0000   0.0000          ?        ?  3267.9536  32.5646          ?        ?      571.6        2.8       ?       ? 
1 1 1   31    5   29 o    469.3    2.6    0.0000   0.0000          ?        ?  2202.2610  24.2638          ?        ?      469.3        2.6       ?       ? 
1 1 1   31    5   30 o    908.3    3.8    0.0000   0.0000          ?        ?  8251.6152  68.9603          ?        ?      908.3        3.8       ?       ? 
1 1 1   31    5   31 o    614.3    2.9    0.0000   0.0000          ?        ?  3774.3013  35.1187          ?        ?      614.3        2.9       ?       ? 
1 1 1   31    5   32 o    205.1    3.7    0.0000   0.0000          ?        ?   420.7858  15.3245          ?        ?      205.1        3.7       ?       ? 
1 1 1   31    5   33 o    281.0    3.0    0.0000   0.0000          ?        ?   789.8513  16.6016          ?        ?      281.0        3.0       ?       ? 
1 1 1   31    5   34 o    401.2    2.7    0.0000   0.0000          ?        ?  1609.7130  21.7097          ?        ?      401.2        2.7       ?       ? 
1 1 1   31    5   35 o    810.3    3.2    0.0000   0.0000          ?        ?  6566.5566  52.3588          ?        ?      810.3        3.2       ?       ? 
1 1 1   31    5   36 o    331.6    3.3    0.0000   0.0000          ?        ?  1099.5342  21.7097          ?        ?      331.6        3.3       ?       ? 
1 1 1   31    5   37 o    139.3    5.7    0.0000   0.0000          ?        ?   194.1106  15.9630          ?        ?      139.3        5.7       ?       ? 
1 1 1   31    5   38 o    185.1    4.5    0.0000   0.0000          ?        ?   342.8861  16.6016          ?        ?      185.1        4.5       ?       ? 
1 1 1   31    5   39 o    543.1    2.8    0.0000   0.0000          ?        ?  2950.6084  30.6490          ?        ?      543.1        2.8       ?       ? 
1 1 1   31    5   40 o    392.2    2.8    0.0000   0.0000          ?        ?  1538.1986  21.7097          ?        ?      392.2        2.8       ?       ? 
1 1 1   31    5   41 o    622.9    2.9    0.0000   0.0000          ?        ?  3880.9343  35.7572          ?        ?      622.9        2.9       ?       ? 
1 1 1   31    5   42 o    239.8    3.9    0.0000   0.0000          ?        ?   575.3080  18.5171          ?        ?      239.8        3.9       ?       ? 
1 1 1   31    5   43 o     43.0   15.6    0.0000   0.0000          ?        ?    15.3245  17.2401          ?        ?       43.0       15.6       ?       ? 
1 1 1   31    5   44 o    177.5    4.9    0.0000   0.0000          ?        ?   315.4297  17.2401          ?        ?      177.5        4.9       ?       ? 
1 1 1   31    5   45 o    233.5    3.7    0.0000   0.0000          ?        ?   545.2975  17.2401          ?        ?      233.5        3.7       ?       ? 
1 1 1   31    5   46 o     65.5   13.1    0.0000   0.0000          ?        ?    44.6965  16.6016          ?        ?       65.5       13.1       ?       ? 
1 1 1   31    5   47 o    298.4    3.2    0.0000   0.0000          ?        ?   890.7377  19.1556          ?        ?      298.4        3.2       ?       ? 
1 1 1   31    5   48 o     38.7   15.0    0.0000   0.0000          ?        ?     9.5778  16.6016          ?        ?       38.7       15.0       ?       ? 
1 1 1   31    5   49 o     65.4   13.6    0.0000   0.0000          ?        ?    44.6965  17.2401          ?        ?       65.4       13.6       ?       ? 
1 1 1   31    5   50 o    209.5    4.1    0.0000   0.0000          ?        ?   439.3029  17.2401          ?        ?      209.5        4.1       ?       ? 
1 1 1   31    5   51 o    348.4    3.0    0.0000   0.0000          ?        ?  1214.4681  21.0712          ?        ?      348.4        3.0       ?       ? 
1 1 1   31    5   52 o    117.6    7.3    0.0000   0.0000          ?        ?   138.5592  17.2401          ?        ?      117.6        7.3       ?       ? 
1 1 1   31    5   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    5   54 o    100.5    9.2    0.0000   0.0000          ?        ?   101.5249  18.5171          ?        ?      100.5        9.2       ?       ? 
1 1 1   31    5   55 o    257.8    3.8    0.0000   0.0000          ?        ?   665.3395  19.7942          ?        ?      257.8        3.8       ?       ? 
1 1 1   31    5   56 o    165.7    5.4    0.0000   0.0000          ?        ?   275.2028  17.8786          ?        ?      165.7        5.4       ?       ? 
1 1 1   31    5   57 o    101.7    9.4    0.0000   0.0000          ?        ?   104.0790  19.1556          ?        ?      101.7        9.4       ?       ? 
1 1 1   31    5   58 o     39.0   15.6    0.0000   0.0000          ?        ?     7.6623  18.5171          ?        ?       39.0       15.6       ?       ? 
1 1 1   31    5   59 o    342.9    3.1    0.0000   0.0000          ?        ?  1176.7954  21.0712          ?        ?      342.9        3.1       ?       ? 
1 1 1   31    5   60 o     28.5   13.4    0.0000   0.0000          ?        ?   -19.1556  19.1556          ?        ?       28.5       13.4       ?       ? 
1 1 1   31    5   61 o    366.4    3.1    0.0000   0.0000          ?        ?  1343.4495  22.9868          ?        ?      366.4        3.1       ?       ? 
1 1 1   31    5   62 o     31.8   14.4    0.0000   0.0000          ?        ?   -10.8549  19.7942          ?        ?       31.8       14.4       ?       ? 
1 1 1   31    5   63 o    305.2    3.7    0.0000   0.0000          ?        ?   932.8801  22.3483          ?        ?      305.2        3.7       ?       ? 
1 1 1   31    5   64 o     28.6   13.5    0.0000   0.0000          ?        ?   -22.9868  20.4327          ?        ?       28.6       13.5       ?       ? 
1 1 1   31    5   65 o     35.5   15.3    0.0000   0.0000          ?        ?    -1.2770  19.7942          ?        ?       35.5       15.3       ?       ? 
1 1 1   31    5   66 o    273.0    3.7    0.0000   0.0000          ?        ?   746.4318  20.4327          ?        ?      273.0        3.7       ?       ? 
1 1 1   31    5   67 o     26.0   12.6    0.0000   0.0000          ?        ?   -30.6490  19.7942          ?        ?       26.0       12.6       ?       ? 
1 1 1   31    5   68 o     25.0   12.2    0.0000   0.0000          ?        ?   -35.1187  19.7942          ?        ?       25.0       12.2       ?       ? 
1 1 1   31    5   69 o    101.5    9.7    0.0000   0.0000          ?        ?   104.7175  19.7942          ?        ?      101.5        9.7       ?       ? 
1 1 1   31    5   70 o    164.8    5.8    0.0000   0.0000          ?        ?   273.2873  19.1556          ?        ?      164.8        5.8       ?       ? 
1 1 1   31    5   71 o    134.8    7.6    0.0000   0.0000          ?        ?   183.8942  20.4327          ?        ?      134.8        7.6       ?       ? 
1 1 1   31    6    0 o     11.5    8.6  -41.5039  14.0475   -41.5039  14.0475   -41.5039  14.0475       11.5      8.6       11.5        8.6     0.0     0.0 
1 1 1   31    6    1 o    567.4    2.5    0.0000   0.0000          ?        ?  3219.4260  28.7335          ?        ?      567.4        2.5       ?       ? 
1 1 1   31    6    2 o   1029.0    3.8    0.0000   0.0000          ?        ? 10589.2432  78.5382          ?        ?     1029.0        3.8       ?       ? 
1 1 1   31    6    3 o    941.8    3.5    0.0000   0.0000          ?        ?  8869.7041  66.4062          ?        ?      941.8        3.5       ?       ? 
1 1 1   31    6    4 o    388.9    2.3    0.0000   0.0000          ?        ?  1512.6577  17.8786          ?        ?      388.9        2.3       ?       ? 
1 1 1   31    6    5 o    930.2    3.5    0.0000   0.0000          ?        ?  8653.2451  65.7677          ?        ?      930.2        3.5       ?       ? 
1 1 1   31    6    6 o   1020.9    3.8    0.0000   0.0000          ?        ? 10423.8652  78.5382          ?        ?     1020.9        3.8       ?       ? 
1 1 1   31    6    7 o    526.5    2.7    0.0000   0.0000          ?        ?  2771.8225  28.0950          ?        ?      526.5        2.7       ?       ? 
1 1 1   31    6    8 o    603.0    3.0    0.0000   0.0000          ?        ?  3635.7422  35.7572          ?        ?      603.0        3.0       ?       ? 
1 1 1   31    6    9 o   1341.9    4.7    0.0000   0.0000          ?        ? 18009.5020 126.4273          ?        ?     1341.9        4.7       ?       ? 
1 1 1   31    6   10 o    575.5    2.8    0.0000   0.0000          ?        ?  3312.6501  31.9261          ?        ?      575.5        2.8       ?       ? 
1 1 1   31    6   11 o    671.6    3.0    0.0000   0.0000          ?        ?  4510.5171  40.2269          ?        ?      671.6        3.0       ?       ? 
1 1 1   31    6   12 o   1189.7    4.3    0.0000   0.0000          ?        ? 14156.0244 102.8020          ?        ?     1189.7        4.3       ?       ? 
1 1 1   31    6   13 o    673.1    2.9    0.0000   0.0000          ?        ?  4530.9492  38.9498          ?        ?      673.1        2.9       ?       ? 
1 1 1   31    6   14 o    910.4    3.5    0.0000   0.0000          ?        ?  8289.2871  63.8522          ?        ?      910.4        3.5       ?       ? 
1 1 1   31    6   15 o    986.2    3.7    0.0000   0.0000          ?        ?  9727.2383  73.4300          ?        ?      986.2        3.7       ?       ? 
1 1 1   31    6   16 o    751.8    3.4    0.0000   0.0000          ?        ?  5652.8320  51.7203          ?        ?      751.8        3.4       ?       ? 
1 1 1   31    6   17 o    998.8    3.9    0.0000   0.0000          ?        ?  9976.9004  78.5382          ?        ?      998.8        3.9       ?       ? 
1 1 1   31    6   18 o    336.2    2.9    0.0000   0.0000          ?        ?  1130.1832  19.7942          ?        ?      336.2        2.9       ?       ? 
1 1 1   31    6   19 o    738.7    3.0    0.0000   0.0000          ?        ?  5457.4443  44.6965          ?        ?      738.7        3.0       ?       ? 
1 1 1   31    6   20 o    751.0    3.0    0.0000   0.0000          ?        ?  5640.0615  45.3350          ?        ?      751.0        3.0       ?       ? 
1 1 1   31    6   21 o    498.1    2.6    0.0000   0.0000          ?        ?  2480.6565  25.5409          ?        ?      498.1        2.6       ?       ? 
1 1 1   31    6   22 o   1152.3    4.4    0.0000   0.0000          ?        ? 13278.6963 100.2479          ?        ?     1152.3        4.4       ?       ? 
1 1 1   31    6   23 o    965.7    3.7    0.0000   0.0000          ?        ?  9326.2471  71.5144          ?        ?      965.7        3.7       ?       ? 
1 1 1   31    6   24 o    262.1    2.9    0.0000   0.0000          ?        ?   687.0493  15.3245          ?        ?      262.1        2.9       ?       ? 
1 1 1   31    6   25 o    934.3    3.7    0.0000   0.0000          ?        ?  8730.5068  68.3218          ?        ?      934.3        3.7       ?       ? 
1 1 1   31    6   26 o    651.1    3.0    0.0000   0.0000          ?        ?  4239.7837  38.9498          ?        ?      651.1        3.0       ?       ? 
1 1 1   31    6   27 o     28.8   12.9    0.0000   0.0000          ?        ?    -7.0237  15.3245          ?        ?       28.8       12.9       ?       ? 
1 1 1   31    6   28 o    634.6    2.9    0.0000   0.0000          ?        ?  4027.7944  37.0343          ?        ?      634.6        2.9       ?       ? 
1 1 1   31    6   29 o    131.8    5.6    0.0000   0.0000          ?        ?   173.6779  14.6860          ?        ?      131.8        5.6       ?       ? 
1 1 1   31    6   30 o    300.6    2.7    0.0000   0.0000          ?        ?   903.5081  15.9630          ?        ?      300.6        2.7       ?       ? 
1 1 1   31    6   31 o     36.6   14.4    0.0000   0.0000          ?        ?     7.6623  15.3245          ?        ?       36.6       14.4       ?       ? 
1 1 1   31    6   32 o    403.3    2.5    0.0000   0.0000          ?        ?  1626.9531  19.7942          ?        ?      403.3        2.5       ?       ? 
1 1 1   31    6   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    6   34 o    741.7    3.0    0.0000   0.0000          ?        ?  5501.5020  44.0580          ?        ?      741.7        3.0       ?       ? 
1 1 1   31    6   35 o    388.9    2.6    0.0000   0.0000          ?        ?  1512.6577  20.4327          ?        ?      388.9        2.6       ?       ? 
1 1 1   31    6   36 o    265.1    3.0    0.0000   0.0000          ?        ?   703.0123  15.9630          ?        ?      265.1        3.0       ?       ? 
1 1 1   31    6   37 o     48.2   14.3    0.0000   0.0000          ?        ?    23.6253  14.6860          ?        ?       48.2       14.3       ?       ? 
1 1 1   31    6   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    6   39 o    321.5    2.8    0.0000   0.0000          ?        ?  1033.7665  17.8786          ?        ?      321.5        2.8       ?       ? 
1 1 1   31    6   40 o    158.0    5.1    0.0000   0.0000          ?        ?   249.6619  15.9630          ?        ?      158.0        5.1       ?       ? 
1 1 1   31    6   41 o    423.2    2.7    0.0000   0.0000          ?        ?  1791.0532  22.9868          ?        ?      423.2        2.7       ?       ? 
1 1 1   31    6   42 o    206.6    4.0    0.0000   0.0000          ?        ?   427.1710  16.6016          ?        ?      206.6        4.0       ?       ? 
1 1 1   31    6   43 o    413.9    2.5    0.0000   0.0000          ?        ?  1713.7920  21.0712          ?        ?      413.9        2.5       ?       ? 
1 1 1   31    6   44 o    105.3    7.6    0.0000   0.0000          ?        ?   111.1028  15.9630          ?        ?      105.3        7.6       ?       ? 
1 1 1   31    6   45 o    442.4    2.5    0.0000   0.0000          ?        ?  1957.7074  22.3483          ?        ?      442.4        2.5       ?       ? 
1 1 1   31    6   46 o    254.5    3.3    0.0000   0.0000          ?        ?   648.0994  16.6016          ?        ?      254.5        3.3       ?       ? 
1 1 1   31    6   47 o    428.0    2.6    0.0000   0.0000          ?        ?  1831.9185  22.3483          ?        ?      428.0        2.6       ?       ? 
1 1 1   31    6   48 o    256.1    3.5    0.0000   0.0000          ?        ?   656.4003  17.8786          ?        ?      256.1        3.5       ?       ? 
1 1 1   31    6   49 f    117.3    7.3    0.0000   0.0000          ?        ?   137.9207  17.2401          ?        ?      117.3        7.3       ?       ? 
1 1 1   31    6   50 f    288.4    3.3    0.0000   0.0000          ?        ?   831.9937  19.1556          ?        ?      288.4        3.3       ?       ? 
1 1 1   31    6   51 o    237.2    3.6    0.0000   0.0000          ?        ?   563.1760  17.2401          ?        ?      237.2        3.6       ?       ? 
1 1 1   31    6   52 o     46.4   15.7    0.0000   0.0000          ?        ?    20.4327  17.2401          ?        ?       46.4       15.7       ?       ? 
1 1 1   31    6   53 o    445.1    2.7    0.0000   0.0000          ?        ?  1981.9711  23.6253          ?        ?      445.1        2.7       ?       ? 
1 1 1   31    6   54 f    268.4    3.6    0.0000   0.0000          ?        ?   720.8909  19.1556          ?        ?      268.4        3.6       ?       ? 
1 1 1   31    6   55 o    373.5    2.9    0.0000   0.0000          ?        ?  1395.8083  21.7097          ?        ?      373.5        2.9       ?       ? 
1 1 1   31    6   56 o    289.8    3.4    0.0000   0.0000          ?        ?   840.2945  19.7942          ?        ?      289.8        3.4       ?       ? 
1 1 1   31    6   57 o    163.2    5.9    0.0000   0.0000          ?        ?   266.9020  19.1556          ?        ?      163.2        5.9       ?       ? 
1 1 1   31    6   58 o    186.7    5.1    0.0000   0.0000          ?        ?   349.2713  19.1556          ?        ?      186.7        5.1       ?       ? 
1 1 1   31    6   59 o    201.0    4.8    0.0000   0.0000          ?        ?   404.8227  19.1556          ?        ?      201.0        4.8       ?       ? 
1 1 1   31    6   60 f    134.6    7.1    0.0000   0.0000          ?        ?   181.9787  19.1556          ?        ?      134.6        7.1       ?       ? 
1 1 1   31    6   61 o     30.5   14.0    0.0000   0.0000          ?        ?   -14.6860  19.7942          ?        ?       30.5       14.0       ?       ? 
1 1 1   31    6   62 o    264.7    4.0    0.0000   0.0000          ?        ?   701.7353  21.0712          ?        ?      264.7        4.0       ?       ? 
1 1 1   31    6   63 o    244.6    4.3    0.0000   0.0000          ?        ?   599.5718  21.0712          ?        ?      244.6        4.3       ?       ? 
1 1 1   31    6   64 o    312.0    3.6    0.0000   0.0000          ?        ?   975.0225  22.3483          ?        ?      312.0        3.6       ?       ? 
1 1 1   31    6   65 o    191.1    5.3    0.0000   0.0000          ?        ?   366.5114  20.4327          ?        ?      191.1        5.3       ?       ? 
1 1 1   31    6   66 o     49.2   17.0    0.0000   0.0000          ?        ?    22.9868  20.4327          ?        ?       49.2       17.0       ?       ? 
1 1 1   31    6   67 o    208.8    5.0    0.0000   0.0000          ?        ?   437.3873  21.0712          ?        ?      208.8        5.0       ?       ? 
1 1 1   31    6   68 o    104.6    9.8    0.0000   0.0000          ?        ?   111.1028  20.4327          ?        ?      104.6        9.8       ?       ? 
1 1 1   31    6   69 o    202.3    5.2    0.0000   0.0000          ?        ?   411.2079  21.0712          ?        ?      202.3        5.2       ?       ? 
1 1 1   31    6   70 o     22.5   11.2    0.0000   0.0000          ?        ?   -52.3588  20.4327          ?        ?       22.5       11.2       ?       ? 
1 1 1   31    7    0 o   1040.7    5.3 10831.2422 110.4642 10831.2422 110.4642 10831.2422 110.4642     1040.7      5.3     1040.7        5.3     0.0     0.0 
1 1 1   31    7    1 o    165.1    3.1    0.0000   0.0000          ?        ?   272.6487  10.2163          ?        ?      165.1        3.1       ?       ? 
1 1 1   31    7    2 o    481.2    2.3    0.0000   0.0000          ?        ?  2315.9180  22.3483          ?        ?      481.2        2.3       ?       ? 
1 1 1   31    7    3 o    522.0    2.4    0.0000   0.0000          ?        ?  2724.5718  25.5409          ?        ?      522.0        2.4       ?       ? 
1 1 1   31    7    4 o    902.6    3.5    0.0000   0.0000          ?        ?  8146.8975  63.2136          ?        ?      902.6        3.5       ?       ? 
1 1 1   31    7    5 o    869.6    3.5    0.0000   0.0000          ?        ?  7563.2886  60.6596          ?        ?      869.6        3.5       ?       ? 
1 1 1   31    7    6 f    916.1    3.6    0.0000   0.0000          ?        ?  8392.7285  65.7677          ?        ?      916.1        3.6       ?       ? 
1 1 1   31    7    7 o    800.9    3.2    0.0000   0.0000          ?        ?  6414.5879  51.7203          ?        ?      800.9        3.2       ?       ? 
1 1 1   31    7    8 o   1057.3    4.3    0.0000   0.0000          ?        ? 11180.5137  90.0316          ?        ?     1057.3        4.3       ?       ? 
1 1 1   31    7    9 o   2305.6    8.0    0.0000   0.0000          ?        ? 53172.8867 369.0655          ?        ?     2305.6        8.0       ?       ? 
1 1 1   31    7   10 o    484.5    3.1    0.0000   0.0000          ?        ?  2347.2056  30.0105          ?        ?      484.5        3.1       ?       ? 
1 1 1   31    7   11 f   2589.3    9.9    0.0000   0.0000          ?        ? 67076.6953 513.3714          ?        ?     2589.3        9.9       ?       ? 
1 1 1   31    7   12 o    584.1    2.7    0.0000   0.0000          ?        ?  3411.6211  31.9261          ?        ?      584.1        2.7       ?       ? 
1 1 1   31    7   13 o   1329.0    5.0    0.0000   0.0000          ?        ? 17665.9766 132.8125          ?        ?     1329.0        5.0       ?       ? 
1 1 1   31    7   14 o    751.5    3.1    0.0000   0.0000          ?        ?  5647.7236  46.6121          ?        ?      751.5        3.1       ?       ? 
1 1 1   31    7   15 o    772.4    3.4    0.0000   0.0000          ?        ?  5965.7075  52.3588          ?        ?      772.4        3.4       ?       ? 
1 1 1   31    7   16 o   1457.2    5.1    0.0000   0.0000          ?        ? 21237.2285 150.0526          ?        ?     1457.2        5.1       ?       ? 
1 1 1   31    7   17 o    856.7    3.5    0.0000   0.0000          ?        ?  7340.4443  59.3825          ?        ?      856.7        3.5       ?       ? 
1 1 1   31    7   18 o   1040.2    3.8    0.0000   0.0000          ?        ? 10821.0254  79.8152          ?        ?     1040.2        3.8       ?       ? 
1 1 1   31    7   19 o    617.8    2.8    0.0000   0.0000          ?        ?  3817.0823  35.1187          ?        ?      617.8        2.8       ?       ? 
1 1 1   31    7   20 o    352.1    2.4    0.0000   0.0000          ?        ?  1240.0090  16.6016          ?        ?      352.1        2.4       ?       ? 
1 1 1   31    7   21 o    458.1    2.4    0.0000   0.0000          ?        ?  2098.1821  21.7097          ?        ?      458.1        2.4       ?       ? 
1 1 1   31    7   22 o    392.3    2.4    0.0000   0.0000          ?        ?  1538.8372  19.1556          ?        ?      392.3        2.4       ?       ? 
1 1 1   31    7   23 o    361.0    2.5    0.0000   0.0000          ?        ?  1303.2227  17.8786          ?        ?      361.0        2.5       ?       ? 
1 1 1   31    7   24 o    182.0    3.9    0.0000   0.0000          ?        ?   331.3927  14.0475          ?        ?      182.0        3.9       ?       ? 
1 1 1   31    7   25 o   1181.0    4.3    0.0000   0.0000          ?        ? 13949.1445 102.1635          ?        ?     1181.0        4.3       ?       ? 
1 1 1   31    7   26 o    389.3    2.7    0.0000   0.0000          ?        ?  1515.8503  21.0712          ?        ?      389.3        2.7       ?       ? 
1 1 1   31    7   27 o    335.9    2.6    0.0000   0.0000          ?        ?  1128.2677  17.2401          ?        ?      335.9        2.6       ?       ? 
1 1 1   31    7   28 o    799.0    3.3    0.0000   0.0000          ?        ?  6385.2163  52.9973          ?        ?      799.0        3.3       ?       ? 
1 1 1   31    7   29 o   1449.9    4.8    0.0000   0.0000          ?        ? 21027.7930 140.4748          ?        ?     1449.9        4.8       ?       ? 
1 1 1   31    7   30 o    490.9    2.5    0.0000   0.0000          ?        ?  2409.7805  24.9023          ?        ?      490.9        2.5       ?       ? 
1 1 1   31    7   31 o    682.3    2.9    0.0000   0.0000          ?        ?  4655.4609  38.9498          ?        ?      682.3        2.9       ?       ? 
1 1 1   31    7   32 o    697.5    2.9    0.0000   0.0000          ?        ?  4865.5347  40.2269          ?        ?      697.5        2.9       ?       ? 
1 1 1   31    7   33 o    120.9    6.1    0.0000   0.0000          ?        ?   146.2215  14.6860          ?        ?      120.9        6.1       ?       ? 
1 1 1   31    7   34 o    353.6    2.5    0.0000   0.0000          ?        ?  1250.2253  17.8786          ?        ?      353.6        2.5       ?       ? 
1 1 1   31    7   35 o    764.3    3.0    0.0000   0.0000          ?        ?  5842.4727  46.6121          ?        ?      764.3        3.0       ?       ? 
1 1 1   31    7   36 o    624.8    2.7    0.0000   0.0000          ?        ?  3903.9214  33.8416          ?        ?      624.8        2.7       ?       ? 
1 1 1   31    7   37 o    645.8    2.7    0.0000   0.0000          ?        ?  4170.8232  35.1187          ?        ?      645.8        2.7       ?       ? 
1 1 1   31    7   38 o    226.5    3.5    0.0000   0.0000          ?        ?   513.3714  15.9630          ?        ?      226.5        3.5       ?       ? 
1 1 1   31    7   39 o    248.3    3.2    0.0000   0.0000          ?        ?   616.8119  15.9630          ?        ?      248.3        3.2       ?       ? 
1 1 1   31    7   40 o    653.5    2.8    0.0000   0.0000          ?        ?  4271.7095  37.0343          ?        ?      653.5        2.8       ?       ? 
1 1 1   31    7   41 o    414.6    2.5    0.0000   0.0000          ?        ?  1718.9003  21.0712          ?        ?      414.6        2.5       ?       ? 
1 1 1   31    7   42 o    335.6    2.9    0.0000   0.0000          ?        ?  1126.3521  19.1556          ?        ?      335.6        2.9       ?       ? 
1 1 1   31    7   43 o     94.4    8.5    0.0000   0.0000          ?        ?    89.3930  15.9630          ?        ?       94.4        8.5       ?       ? 
1 1 1   31    7   44 o    576.5    2.7    0.0000   0.0000          ?        ?  3324.1433  30.6490          ?        ?      576.5        2.7       ?       ? 
1 1 1   31    7   45 o    237.1    3.6    0.0000   0.0000          ?        ?   562.5375  17.2401          ?        ?      237.1        3.6       ?       ? 
1 1 1   31    7   46 o     22.8   11.0    0.0000   0.0000          ?        ?   -24.9023  15.3245          ?        ?       22.8       11.0       ?       ? 
1 1 1   31    7   47 o    225.8    4.0    0.0000   0.0000          ?        ?   510.1788  17.8786          ?        ?      225.8        4.0       ?       ? 
1 1 1   31    7   48 o     23.1   11.3    0.0000   0.0000          ?        ?   -32.5646  17.2401          ?        ?       23.1       11.3       ?       ? 
1 1 1   31    7   49 o    207.7    4.2    0.0000   0.0000          ?        ?   431.6406  17.2401          ?        ?      207.7        4.2       ?       ? 
1 1 1   31    7   50 o    149.0    5.4    0.0000   0.0000          ?        ?   222.2055  15.9630          ?        ?      149.0        5.4       ?       ? 
1 1 1   31    7   51 o    229.4    3.9    0.0000   0.0000          ?        ?   526.7803  17.8786          ?        ?      229.4        3.9       ?       ? 
1 1 1   31    7   52 o    573.3    2.7    0.0000   0.0000          ?        ?  3288.3865  31.2876          ?        ?      573.3        2.7       ?       ? 
1 1 1   31    7   53 o    139.8    6.4    0.0000   0.0000          ?        ?   196.0261  17.8786          ?        ?      139.8        6.4       ?       ? 
1 1 1   31    7   54 o    119.9    7.5    0.0000   0.0000          ?        ?   144.3059  17.8786          ?        ?      119.9        7.5       ?       ? 
1 1 1   31    7   55 o    122.3    7.3    0.0000   0.0000          ?        ?   150.0526  17.8786          ?        ?      122.3        7.3       ?       ? 
1 1 1   31    7   56 o    204.2    4.5    0.0000   0.0000          ?        ?   417.5931  18.5171          ?        ?      204.2        4.5       ?       ? 
1 1 1   31    7   57 o    220.7    4.3    0.0000   0.0000          ?        ?   487.8305  19.1556          ?        ?      220.7        4.3       ?       ? 
1 1 1   31    7   58 o    413.5    3.0    0.0000   0.0000          ?        ?  1711.2379  24.9023          ?        ?      413.5        3.0       ?       ? 
1 1 1   31    7   59 o     82.2   11.6    0.0000   0.0000          ?        ?    68.3218  19.1556          ?        ?       82.2       11.6       ?       ? 
1 1 1   31    7   60 o     25.6   12.4    0.0000   0.0000          ?        ?   -33.2031  19.7942          ?        ?       25.6       12.4       ?       ? 
1 1 1   31    7   61 o    376.2    3.1    0.0000   0.0000          ?        ?  1416.2410  23.6253          ?        ?      376.2        3.1       ?       ? 
1 1 1   31    7   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    7   63 o     66.1   15.7    0.0000   0.0000          ?        ?    46.6121  20.4327          ?        ?       66.1       15.7       ?       ? 
1 1 1   31    7   64 o    105.5    9.1    0.0000   0.0000          ?        ?   112.3798  19.1556          ?        ?      105.5        9.1       ?       ? 
1 1 1   31    7   65 o    143.0    6.9    0.0000   0.0000          ?        ?   205.6040  19.7942          ?        ?      143.0        6.9       ?       ? 
1 1 1   31    7   66 f     38.9   16.1    0.0000   0.0000          ?        ?     5.1082  20.4327          ?        ?       38.9       16.1       ?       ? 
1 1 1   31    7   67 o     38.5   15.7    0.0000   0.0000          ?        ?     6.3852  19.1556          ?        ?       38.5       15.7       ?       ? 
1 1 1   31    7   68 o     49.5   16.8    0.0000   0.0000          ?        ?    24.2638  19.7942          ?        ?       49.5       16.8       ?       ? 
1 1 1   31    7   69 o     86.6   11.1    0.0000   0.0000          ?        ?    76.6226  19.1556          ?        ?       86.6       11.1       ?       ? 
1 1 1   31    7   70 o    116.6    8.5    0.0000   0.0000          ?        ?   137.9207  19.7942          ?        ?      116.6        8.5       ?       ? 
1 1 1   31    8    0 f    946.7    5.3 8964.2051 100.2479  8964.2051 100.2479  8964.2051 100.2479      946.7      5.3      946.7        5.3     0.0     0.0 
1 1 1   31    8    1 o    155.4    3.3    0.0000   0.0000          ?        ?   241.3612  10.2163          ?        ?      155.4        3.3       ?       ? 
1 1 1   31    8    2 o    689.0    3.0    0.0000   0.0000          ?        ?  4747.4082  41.5039          ?        ?      689.0        3.0       ?       ? 
1 1 1   31    8    3 o    607.9    2.7    0.0000   0.0000          ?        ?  3695.1248  33.2031          ?        ?      607.9        2.7       ?       ? 
1 1 1   31    8    4 o    348.7    2.5    0.0000   0.0000          ?        ?  1215.7451  17.2401          ?        ?      348.7        2.5       ?       ? 
1 1 1   31    8    5 o    605.3    2.8    0.0000   0.0000          ?        ?  3663.8369  33.8416          ?        ?      605.3        2.8       ?       ? 
1 1 1   31    8    6 o    932.6    3.9    0.0000   0.0000          ?        ?  8697.3027  72.7915          ?        ?      932.6        3.9       ?       ? 
1 1 1   31    8    7 o    293.8    2.6    0.0000   0.0000          ?        ?   863.2812  15.3245          ?        ?      293.8        2.6       ?       ? 
1 1 1   31    8    8 o   1198.1    4.3    0.0000   0.0000          ?        ? 14355.8818 104.0790          ?        ?     1198.1        4.3       ?       ? 
1 1 1   31    8    9 o    228.8    3.2    0.0000   0.0000          ?        ?   523.5877  14.6860          ?        ?      228.8        3.2       ?       ? 
1 1 1   31    8   10 o    739.2    3.1    0.0000   0.0000          ?        ?  5464.4678  45.3350          ?        ?      739.2        3.1       ?       ? 
1 1 1   31    8   11 o    367.6    2.8    0.0000   0.0000          ?        ?  1351.1118  20.4327          ?        ?      367.6        2.8       ?       ? 
1 1 1   31    8   12 o     24.4   11.1    0.0000   0.0000          ?        ?    -8.3008  12.1319          ?        ?       24.4       11.1       ?       ? 
1 1 1   31    8   13 o    203.6    3.3    0.0000   0.0000          ?        ?   414.4005  13.4090          ?        ?      203.6        3.3       ?       ? 
1 1 1   31    8   14 o    341.8    2.7    0.0000   0.0000          ?        ?  1168.4946  18.5171          ?        ?      341.8        2.7       ?       ? 
1 1 1   31    8   15 o   1857.4    6.5    0.0000   0.0000          ?        ? 34509.5391 243.2767          ?        ?     1857.4        6.5       ?       ? 
1 1 1   31    8   16 o    709.1    2.9    0.0000   0.0000          ?        ?  5028.3579  41.5039          ?        ?      709.1        2.9       ?       ? 
1 1 1   31    8   17 o    439.4    2.7    0.0000   0.0000          ?        ?  1930.8894  23.6253          ?        ?      439.4        2.7       ?       ? 
1 1 1   31    8   18 o    607.2    2.7    0.0000   0.0000          ?        ?  3686.8240  32.5646          ?        ?      607.2        2.7       ?       ? 
1 1 1   31    8   19 o    684.7    2.9    0.0000   0.0000          ?        ?  4688.6641  39.5883          ?        ?      684.7        2.9       ?       ? 
1 1 1   31    8   20 o    428.1    2.4    0.0000   0.0000          ?        ?  1832.5571  20.4327          ?        ?      428.1        2.4       ?       ? 
1 1 1   31    8   21 o    477.2    2.5    0.0000   0.0000          ?        ?  2276.9683  24.2638          ?        ?      477.2        2.5       ?       ? 
1 1 1   31    8   22 o    353.8    2.5    0.0000   0.0000          ?        ?  1252.1410  17.8786          ?        ?      353.8        2.5       ?       ? 
1 1 1   31    8   23 o    995.8    3.8    0.0000   0.0000          ?        ?  9917.5176  75.3456          ?        ?      995.8        3.8       ?       ? 
1 1 1   31    8   24 o   1136.5    4.2    0.0000   0.0000          ?        ? 12919.2080  96.4168          ?        ?     1136.5        4.2       ?       ? 
1 1 1   31    8   25 o    314.8    2.7    0.0000   0.0000          ?        ?   990.9855  17.2401          ?        ?      314.8        2.7       ?       ? 
1 1 1   31    8   26 o    538.6    2.6    0.0000   0.0000          ?        ?  2901.4421  28.0950          ?        ?      538.6        2.6       ?       ? 
1 1 1   31    8   27 o    173.2    4.1    0.0000   0.0000          ?        ?   300.1052  14.0475          ?        ?      173.2        4.1       ?       ? 
1 1 1   31    8   28 o    633.7    2.7    0.0000   0.0000          ?        ?  4015.6626  34.4802          ?        ?      633.7        2.7       ?       ? 
1 1 1   31    8   29 o    295.0    2.8    0.0000   0.0000          ?        ?   870.3050  16.6016          ?        ?      295.0        2.8       ?       ? 
1 1 1   31    8   30 o    628.4    2.7    0.0000   0.0000          ?        ?  3949.2563  33.8416          ?        ?      628.4        2.7       ?       ? 
1 1 1   31    8   31 o    459.2    2.6    0.0000   0.0000          ?        ?  2109.0369  24.2638          ?        ?      459.2        2.6       ?       ? 
1 1 1   31    8   32 o    256.7    2.9    0.0000   0.0000          ?        ?   658.9543  14.6860          ?        ?      256.7        2.9       ?       ? 
1 1 1   31    8   33 o    297.5    2.8    0.0000   0.0000          ?        ?   884.9910  16.6016          ?        ?      297.5        2.8       ?       ? 
1 1 1   31    8   34 o    380.1    2.5    0.0000   0.0000          ?        ?  1444.9745  19.1556          ?        ?      380.1        2.5       ?       ? 
1 1 1   31    8   35 o    539.2    2.6    0.0000   0.0000          ?        ?  2907.8274  28.0950          ?        ?      539.2        2.6       ?       ? 
1 1 1   31    8   36 o    412.3    2.5    0.0000   0.0000          ?        ?  1699.7446  20.4327          ?        ?      412.3        2.5       ?       ? 
1 1 1   31    8   37 o    102.6    7.5    0.0000   0.0000          ?        ?   105.3561  15.3245          ?        ?      102.6        7.5       ?       ? 
1 1 1   31    8   38 f    358.3    2.9    0.0000   0.0000          ?        ?  1284.0670  20.4327          ?        ?      358.3        2.9       ?       ? 
1 1 1   31    8   39 f    443.9    2.5    0.0000   0.0000          ?        ?  1970.4778  22.3483          ?        ?      443.9        2.5       ?       ? 
1 1 1   31    8   40 o    583.3    2.6    0.0000   0.0000          ?        ?  3403.3203  30.6490          ?        ?      583.3        2.6       ?       ? 
1 1 1   31    8   41 o    720.9    3.0    0.0000   0.0000          ?        ?  5198.8433  42.7809          ?        ?      720.9        3.0       ?       ? 
1 1 1   31    8   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    8   43 o    276.5    3.2    0.0000   0.0000          ?        ?   764.9489  17.8786          ?        ?      276.5        3.2       ?       ? 
1 1 1   31    8   44 o    247.7    3.5    0.0000   0.0000          ?        ?   613.6193  17.2401          ?        ?      247.7        3.5       ?       ? 
1 1 1   31    8   45 o    580.5    2.6    0.0000   0.0000          ?        ?  3370.7559  30.6490          ?        ?      580.5        2.6       ?       ? 
1 1 1   31    8   46 o     37.2   14.8    0.0000   0.0000          ?        ?     7.0237  16.6016          ?        ?       37.2       14.8       ?       ? 
1 1 1   31    8   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    8   48 o     80.9    9.9    0.0000   0.0000          ?        ?    65.7677  15.9630          ?        ?       80.9        9.9       ?       ? 
1 1 1   31    8   49 o     76.4   10.4    0.0000   0.0000          ?        ?    58.7440  15.9630          ?        ?       76.4       10.4       ?       ? 
1 1 1   31    8   50 o     69.3   12.4    0.0000   0.0000          ?        ?    49.8047  16.6016          ?        ?       69.3       12.4       ?       ? 
1 1 1   31    8   51 o    174.2    4.8    0.0000   0.0000          ?        ?   303.9363  16.6016          ?        ?      174.2        4.8       ?       ? 
1 1 1   31    8   52 o    317.6    3.1    0.0000   0.0000          ?        ?  1009.5027  19.7942          ?        ?      317.6        3.1       ?       ? 
1 1 1   31    8   53 o    172.9    5.0    0.0000   0.0000          ?        ?   299.4666  17.2401          ?        ?      172.9        5.0       ?       ? 
1 1 1   31    8   54 o     81.2   10.6    0.0000   0.0000          ?        ?    66.4062  17.2401          ?        ?       81.2       10.6       ?       ? 
1 1 1   31    8   55 f    126.9    6.8    0.0000   0.0000          ?        ?   161.5460  17.2401          ?        ?      126.9        6.8       ?       ? 
1 1 1   31    8   56 o    336.7    3.2    0.0000   0.0000          ?        ?  1134.6530  21.7097          ?        ?      336.7        3.2       ?       ? 
1 1 1   31    8   57 o    291.4    3.5    0.0000   0.0000          ?        ?   849.8723  20.4327          ?        ?      291.4        3.5       ?       ? 
1 1 1   31    8   58 o     32.8   14.5    0.0000   0.0000          ?        ?    -5.1082  18.5171          ?        ?       32.8       14.5       ?       ? 
1 1 1   31    8   59 o     27.1   12.9    0.0000   0.0000          ?        ?   -24.2638  19.1556          ?        ?       27.1       12.9       ?       ? 
1 1 1   31    8   60 o     74.0   13.9    0.0000   0.0000          ?        ?    57.4669  19.7942          ?        ?       74.0       13.9       ?       ? 
1 1 1   31    8   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    8   62 o    365.8    3.2    0.0000   0.0000          ?        ?  1339.6184  23.6253          ?        ?      365.8        3.2       ?       ? 
1 1 1   31    8   63 o    283.1    3.7    0.0000   0.0000          ?        ?   802.6216  21.0712          ?        ?      283.1        3.7       ?       ? 
1 1 1   31    8   64 o    279.4    3.9    0.0000   0.0000          ?        ?   782.1890  21.7097          ?        ?      279.4        3.9       ?       ? 
1 1 1   31    8   65 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    8   66 o     28.4   13.4    0.0000   0.0000          ?        ?   -23.6253  20.4327          ?        ?       28.4       13.4       ?       ? 
1 1 1   31    8   67 o    207.8    4.9    0.0000   0.0000          ?        ?   433.5562  20.4327          ?        ?      207.8        4.9       ?       ? 
1 1 1   31    8   68 o    150.0    6.6    0.0000   0.0000          ?        ?   226.6752  19.7942          ?        ?      150.0        6.6       ?       ? 
1 1 1   31    8   69 o    111.2    9.2    0.0000   0.0000          ?        ?   125.7888  20.4327          ?        ?      111.2        9.2       ?       ? 
1 1 1   31    9    0 o   1120.0    6.6 12546.3115 146.8600 12546.3115 146.8600 12546.3115 146.8600     1120.0      6.6     1120.0        6.6     0.0     0.0 
1 1 1   31    9    1 o   1272.8    4.6    0.0000   0.0000          ?        ? 16201.2100 116.8494          ?        ?     1272.8        4.6       ?       ? 
1 1 1   31    9    2 o    809.8    3.4    0.0000   0.0000          ?        ?  6558.2554  54.2743          ?        ?      809.8        3.4       ?       ? 
1 1 1   31    9    3 o   1062.1    4.0    0.0000   0.0000          ?        ? 11282.0391  85.5619          ?        ?     1062.1        4.0       ?       ? 
1 1 1   31    9    4 f   1140.2    4.2    0.0000   0.0000          ?        ? 13002.2158  95.1397          ?        ?     1140.2        4.2       ?       ? 
1 1 1   31    9    5 o   1025.1    3.8    0.0000   0.0000          ?        ? 10508.7891  78.5382          ?        ?     1025.1        3.8       ?       ? 
1 1 1   31    9    6 o    892.3    3.8    0.0000   0.0000          ?        ?  7963.0029  68.3218          ?        ?      892.3        3.8       ?       ? 
1 1 1   31    9    7 o    746.8    3.2    0.0000   0.0000          ?        ?  5577.4863  48.5276          ?        ?      746.8        3.2       ?       ? 
1 1 1   31    9    8 o   1030.0    4.3    0.0000   0.0000          ?        ? 10609.6748  89.3930          ?        ?     1030.0        4.3       ?       ? 
1 1 1   31    9    9 o   1679.0    6.3    0.0000   0.0000          ?        ? 28195.8359 211.3506          ?        ?     1679.0        6.3       ?       ? 
1 1 1   31    9   10 o   1194.9    4.8    0.0000   0.0000          ?        ? 14279.2598 114.9339          ?        ?     1194.9        4.8       ?       ? 
1 1 1   31    9   11 o    538.3    2.7    0.0000   0.0000          ?        ?  2897.6111  28.7335          ?        ?      538.3        2.7       ?       ? 
1 1 1   31    9   12 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    9   13 o    504.5    2.6    0.0000   0.0000          ?        ?  2545.1472  26.1794          ?        ?      504.5        2.6       ?       ? 
1 1 1   31    9   14 o    301.6    2.4    0.0000   0.0000          ?        ?   909.8933  14.6860          ?        ?      301.6        2.4       ?       ? 
1 1 1   31    9   15 f    770.4    3.2    0.0000   0.0000          ?        ?  5935.6968  49.1662          ?        ?      770.4        3.2       ?       ? 
1 1 1   31    9   16 o    396.2    2.4    0.0000   0.0000          ?        ?  1570.1246  19.1556          ?        ?      396.2        2.4       ?       ? 
1 1 1   31    9   17 o   1146.5    4.2    0.0000   0.0000          ?        ? 13145.8838  97.0553          ?        ?     1146.5        4.2       ?       ? 
1 1 1   31    9   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    9   19 o    625.9    3.0    0.0000   0.0000          ?        ?  3917.9685  37.0343          ?        ?      625.9        3.0       ?       ? 
1 1 1   31    9   20 o    449.6    2.7    0.0000   0.0000          ?        ?  2021.5594  24.2638          ?        ?      449.6        2.7       ?       ? 
1 1 1   31    9   21 o    414.7    2.5    0.0000   0.0000          ?        ?  1719.5387  20.4327          ?        ?      414.7        2.5       ?       ? 
1 1 1   31    9   22 o   1225.3    4.4    0.0000   0.0000          ?        ? 15016.1123 108.5487          ?        ?     1225.3        4.4       ?       ? 
1 1 1   31    9   23 o    692.7    2.9    0.0000   0.0000          ?        ?  4799.1284  40.2269          ?        ?      692.7        2.9       ?       ? 
1 1 1   31    9   24 o   1348.6    4.7    0.0000   0.0000          ?        ? 18190.8418 125.7888          ?        ?     1348.6        4.7       ?       ? 
1 1 1   31    9   25 o    287.8    2.8    0.0000   0.0000          ?        ?   828.1625  15.9630          ?        ?      287.8        2.8       ?       ? 
1 1 1   31    9   26 o    137.9    5.3    0.0000   0.0000          ?        ?   190.2794  14.6860          ?        ?      137.9        5.3       ?       ? 
1 1 1   31    9   27 o    561.9    2.7    0.0000   0.0000          ?        ?  3158.1279  30.0105          ?        ?      561.9        2.7       ?       ? 
1 1 1   31    9   28 o    735.9    3.0    0.0000   0.0000          ?        ?  5415.9404  43.4195          ?        ?      735.9        3.0       ?       ? 
1 1 1   31    9   29 o    871.2    3.4    0.0000   0.0000          ?        ?  7591.3838  59.3825          ?        ?      871.2        3.4       ?       ? 
1 1 1   31    9   30 o     24.4   11.2    0.0000   0.0000          ?        ?   -10.2163  12.7704          ?        ?       24.4       11.2       ?       ? 
1 1 1   31    9   31 o    355.8    2.6    0.0000   0.0000          ?        ?  1266.1884  18.5171          ?        ?      355.8        2.6       ?       ? 
1 1 1   31    9   32 o    289.2    2.9    0.0000   0.0000          ?        ?   836.4633  16.6016          ?        ?      289.2        2.9       ?       ? 
1 1 1   31    9   33 o    261.0    3.2    0.0000   0.0000          ?        ?   681.3026  16.6016          ?        ?      261.0        3.2       ?       ? 
1 1 1   31    9   34 o     92.1    8.0    0.0000   0.0000          ?        ?    84.9234  14.6860          ?        ?       92.1        8.0       ?       ? 
1 1 1   31    9   35 o    422.0    2.6    0.0000   0.0000          ?        ?  1780.8368  21.7097          ?        ?      422.0        2.6       ?       ? 
1 1 1   31    9   36 o    864.7    3.2    0.0000   0.0000          ?        ?  7479.6426  54.9129          ?        ?      864.7        3.2       ?       ? 
1 1 1   31    9   37 o    307.7    2.9    0.0000   0.0000          ?        ?   946.9276  17.8786          ?        ?      307.7        2.9       ?       ? 
1 1 1   31    9   38 o    224.8    3.5    0.0000   0.0000          ?        ?   505.7091  15.9630          ?        ?      224.8        3.5       ?       ? 
1 1 1   31    9   39 o    338.1    2.6    0.0000   0.0000          ?        ?  1143.5923  17.8786          ?        ?      338.1        2.6       ?       ? 
1 1 1   31    9   40 o    354.8    2.7    0.0000   0.0000          ?        ?  1259.1647  19.1556          ?        ?      354.8        2.7       ?       ? 
1 1 1   31    9   41 o    124.5    6.2    0.0000   0.0000          ?        ?   155.1608  15.3245          ?        ?      124.5        6.2       ?       ? 
1 1 1   31    9   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    9   43 o    194.5    4.1    0.0000   0.0000          ?        ?   378.6433  15.9630          ?        ?      194.5        4.1       ?       ? 
1 1 1   31    9   44 o    673.6    2.8    0.0000   0.0000          ?        ?  4537.9731  37.6728          ?        ?      673.6        2.8       ?       ? 
1 1 1   31    9   45 o    282.0    3.3    0.0000   0.0000          ?        ?   795.5980  18.5171          ?        ?      282.0        3.3       ?       ? 
1 1 1   31    9   46 o     24.4   11.7    0.0000   0.0000          ?        ?   -21.7097  15.9630          ?        ?       24.4       11.7       ?       ? 
1 1 1   31    9   47 o    346.5    2.8    0.0000   0.0000          ?        ?  1201.0592  19.1556          ?        ?      346.5        2.8       ?       ? 
1 1 1   31    9   48 o    405.6    2.8    0.0000   0.0000          ?        ?  1645.4703  22.3483          ?        ?      405.6        2.8       ?       ? 
1 1 1   31    9   49 o    357.5    2.9    0.0000   0.0000          ?        ?  1278.3203  20.4327          ?        ?      357.5        2.9       ?       ? 
1 1 1   31    9   50 o    119.4    6.9    0.0000   0.0000          ?        ?   143.0288  16.6016          ?        ?      119.4        6.9       ?       ? 
1 1 1   31    9   51 o     20.5   10.2    0.0000   0.0000          ?        ?   -46.6121  17.2401          ?        ?       20.5       10.2       ?       ? 
1 1 1   31    9   52 o    166.2    5.0    0.0000   0.0000          ?        ?   276.4799  16.6016          ?        ?      166.2        5.0       ?       ? 
1 1 1   31    9   53 o    170.5    5.2    0.0000   0.0000          ?        ?   291.1659  17.8786          ?        ?      170.5        5.2       ?       ? 
1 1 1   31    9   54 o     54.3   15.6    0.0000   0.0000          ?        ?    30.6490  17.8786          ?        ?       54.3       15.6       ?       ? 
1 1 1   31    9   55 o    198.0    4.7    0.0000   0.0000          ?        ?   392.6908  18.5171          ?        ?      198.0        4.7       ?       ? 
1 1 1   31    9   56 o    149.9    6.2    0.0000   0.0000          ?        ?   225.3981  18.5171          ?        ?      149.9        6.2       ?       ? 
1 1 1   31    9   57 o    231.0    4.3    0.0000   0.0000          ?        ?   534.4426  19.7942          ?        ?      231.0        4.3       ?       ? 
1 1 1   31    9   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31    9   59 o    432.1    3.0    0.0000   0.0000          ?        ?  1868.3143  26.1794          ?        ?      432.1        3.0       ?       ? 
1 1 1   31    9   60 o     24.9   12.1    0.0000   0.0000          ?        ?   -36.3957  19.7942          ?        ?       24.9       12.1       ?       ? 
1 1 1   31    9   61 o     32.3   14.4    0.0000   0.0000          ?        ?    -7.6623  19.1556          ?        ?       32.3       14.4       ?       ? 
1 1 1   31    9   62 o    176.4    5.6    0.0000   0.0000          ?        ?   312.2371  19.7942          ?        ?      176.4        5.6       ?       ? 
1 1 1   31    9   63 o    122.3    8.4    0.0000   0.0000          ?        ?   150.6911  20.4327          ?        ?      122.3        8.4       ?       ? 
1 1 1   31    9   64 o    183.3    5.4    0.0000   0.0000          ?        ?   337.1394  19.7942          ?        ?      183.3        5.4       ?       ? 
1 1 1   31    9   65 o    335.6    3.3    0.0000   0.0000          ?        ?  1128.2677  22.3483          ?        ?      335.6        3.3       ?       ? 
1 1 1   31    9   66 o    136.0    7.5    0.0000   0.0000          ?        ?   186.4483  20.4327          ?        ?      136.0        7.5       ?       ? 
1 1 1   31    9   67 o     29.4   13.6    0.0000   0.0000          ?        ?   -15.3245  19.1556          ?        ?       29.4       13.6       ?       ? 
1 1 1   31    9   68 o     50.9   17.0    0.0000   0.0000          ?        ?    26.1794  20.4327          ?        ?       50.9       17.0       ?       ? 
1 1 1   31    9   69 o     54.6   16.6    0.0000   0.0000          ?        ?    31.9261  19.7942          ?        ?       54.6       16.6       ?       ? 
1 1 1   31   10    0 o    291.3    3.8  849.2338  22.3483   849.2338  22.3483   849.2338  22.3483      291.3      3.8      291.3        3.8     0.0     0.0 
1 1 1   31   10    1 o   1395.6    5.4    0.0000   0.0000          ?        ? 19479.3789 150.6911          ?        ?     1395.6        5.4       ?       ? 
1 1 1   31   10    2 o    498.0    2.8    0.0000   0.0000          ?        ?  2480.0181  27.4564          ?        ?      498.0        2.8       ?       ? 
1 1 1   31   10    3 f   1040.7    4.1    0.0000   0.0000          ?        ? 10831.2422  85.5619          ?        ?     1040.7        4.1       ?       ? 
1 1 1   31   10    4 o   1679.0    6.0    0.0000   0.0000          ?        ? 28195.2012 201.7728          ?        ?     1679.0        6.0       ?       ? 
1 1 1   31   10    5 o    296.6    2.7    0.0000   0.0000          ?        ?   879.8828  15.9630          ?        ?      296.6        2.7       ?       ? 
1 1 1   31   10    6 o    619.4    2.7    0.0000   0.0000          ?        ?  3836.8767  33.8416          ?        ?      619.4        2.7       ?       ? 
1 1 1   31   10    7 o    509.2    2.6    0.0000   0.0000          ?        ?  2593.0364  26.1794          ?        ?      509.2        2.6       ?       ? 
1 1 1   31   10    8 o    927.1    3.5    0.0000   0.0000          ?        ?  8595.7773  65.7677          ?        ?      927.1        3.5       ?       ? 
1 1 1   31   10    9 o    679.8    3.0    0.0000   0.0000          ?        ?  4620.9810  40.8654          ?        ?      679.8        3.0       ?       ? 
1 1 1   31   10   10 o   1266.9    5.0    0.0000   0.0000          ?        ? 16052.4336 127.0658          ?        ?     1266.9        5.0       ?       ? 
1 1 1   31   10   11 f    620.7    2.9    0.0000   0.0000          ?        ?  3852.8396  36.3957          ?        ?      620.7        2.9       ?       ? 
1 1 1   31   10   12 f    439.3    2.4    0.0000   0.0000          ?        ?  1930.2509  21.0712          ?        ?      439.3        2.4       ?       ? 
1 1 1   31   10   13 o    951.3    3.7    0.0000   0.0000          ?        ?  9049.7676  70.8759          ?        ?      951.3        3.7       ?       ? 
1 1 1   31   10   14 o    475.9    2.4    0.0000   0.0000          ?        ?  2264.8362  22.9868          ?        ?      475.9        2.4       ?       ? 
1 1 1   31   10   15 o    729.1    3.1    0.0000   0.0000          ?        ?  5315.6924  44.6965          ?        ?      729.1        3.1       ?       ? 
1 1 1   31   10   16 o    436.3    2.5    0.0000   0.0000          ?        ?  1904.0715  21.7097          ?        ?      436.3        2.5       ?       ? 
1 1 1   31   10   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   10   18 o    632.6    2.7    0.0000   0.0000          ?        ?  4001.6150  34.4802          ?        ?      632.6        2.7       ?       ? 
1 1 1   31   10   19 o   1002.4    3.6    0.0000   0.0000          ?        ? 10049.0537  72.7915          ?        ?     1002.4        3.6       ?       ? 
1 1 1   31   10   20 o   1127.9    4.2    0.0000   0.0000          ?        ? 12723.8203  93.8627          ?        ?     1127.9        4.2       ?       ? 
1 1 1   31   10   21 o    388.5    2.5    0.0000   0.0000          ?        ?  1509.4651  19.7942          ?        ?      388.5        2.5       ?       ? 
1 1 1   31   10   22 o    562.5    2.6    0.0000   0.0000          ?        ?  3163.8748  28.7335          ?        ?      562.5        2.6       ?       ? 
1 1 1   31   10   23 o    888.3    3.4    0.0000   0.0000          ?        ?  7891.4888  60.0210          ?        ?      888.3        3.4       ?       ? 
1 1 1   31   10   24 o    563.8    2.7    0.0000   0.0000          ?        ?  3178.5605  30.6490          ?        ?      563.8        2.7       ?       ? 
1 1 1   31   10   25 o    365.8    2.5    0.0000   0.0000          ?        ?  1338.3413  18.5171          ?        ?      365.8        2.5       ?       ? 
1 1 1   31   10   26 o    672.7    2.8    0.0000   0.0000          ?        ?  4525.2026  37.6728          ?        ?      672.7        2.8       ?       ? 
1 1 1   31   10   27 o    588.7    2.6    0.0000   0.0000          ?        ?  3465.8953  30.6490          ?        ?      588.7        2.6       ?       ? 
1 1 1   31   10   28 o    207.9    3.5    0.0000   0.0000          ?        ?   432.2791  14.6860          ?        ?      207.9        3.5       ?       ? 
1 1 1   31   10   29 o     48.4   14.6    0.0000   0.0000          ?        ?    23.6253  15.3245          ?        ?       48.4       14.6       ?       ? 
1 1 1   31   10   30 o    110.7    6.3    0.0000   0.0000          ?        ?   122.5962  14.0475          ?        ?      110.7        6.3       ?       ? 
1 1 1   31   10   31 o    552.0    2.7    0.0000   0.0000          ?        ?  3047.6636  30.0105          ?        ?      552.0        2.7       ?       ? 
1 1 1   31   10   32 o    680.3    2.9    0.0000   0.0000          ?        ?  4629.2817  38.9498          ?        ?      680.3        2.9       ?       ? 
1 1 1   31   10   33 o    208.5    3.7    0.0000   0.0000          ?        ?   434.8332  15.3245          ?        ?      208.5        3.7       ?       ? 
1 1 1   31   10   34 o    570.9    2.6    0.0000   0.0000          ?        ?  3260.2915  29.3720          ?        ?      570.9        2.6       ?       ? 
1 1 1   31   10   35 o    809.5    3.2    0.0000   0.0000          ?        ?  6555.0630  51.0817          ?        ?      809.5        3.2       ?       ? 
1 1 1   31   10   36 o    361.9    2.6    0.0000   0.0000          ?        ?  1309.6079  19.1556          ?        ?      361.9        2.6       ?       ? 
1 1 1   31   10   37 o     50.9   14.0    0.0000   0.0000          ?        ?    26.8179  14.6860          ?        ?       50.9       14.0       ?       ? 
1 1 1   31   10   38 o    198.9    3.9    0.0000   0.0000          ?        ?   395.8834  15.3245          ?        ?      198.9        3.9       ?       ? 
1 1 1   31   10   39 o     65.3   11.7    0.0000   0.0000          ?        ?    44.0580  14.6860          ?        ?       65.3       11.7       ?       ? 
1 1 1   31   10   40 o    580.2    2.7    0.0000   0.0000          ?        ?  3366.9246  31.2876          ?        ?      580.2        2.7       ?       ? 
1 1 1   31   10   41 o     19.8    9.9    0.0000   0.0000          ?        ?   -42.7809  15.9630          ?        ?       19.8        9.9       ?       ? 
1 1 1   31   10   42 o    251.6    3.4    0.0000   0.0000          ?        ?   633.4135  17.2401          ?        ?      251.6        3.4       ?       ? 
1 1 1   31   10   43 o     29.0   12.9    0.0000   0.0000          ?        ?    -6.3852  15.3245          ?        ?       29.0       12.9       ?       ? 
1 1 1   31   10   44 o    287.2    3.1    0.0000   0.0000          ?        ?   824.9699  17.8786          ?        ?      287.2        3.1       ?       ? 
1 1 1   31   10   45 o    176.8    4.5    0.0000   0.0000          ?        ?   312.8756  15.9630          ?        ?      176.8        4.5       ?       ? 
1 1 1   31   10   46 o    350.8    2.8    0.0000   0.0000          ?        ?  1231.0697  19.7942          ?        ?      350.8        2.8       ?       ? 
1 1 1   31   10   47 o    128.2    6.5    0.0000   0.0000          ?        ?   164.7386  16.6016          ?        ?      128.2        6.5       ?       ? 
1 1 1   31   10   48 o    182.1    4.6    0.0000   0.0000          ?        ?   332.0312  16.6016          ?        ?      182.1        4.6       ?       ? 
1 1 1   31   10   49 o    132.8    6.5    0.0000   0.0000          ?        ?   176.8705  17.2401          ?        ?      132.8        6.5       ?       ? 
1 1 1   31   10   50 o    295.9    3.1    0.0000   0.0000          ?        ?   876.0516  18.5171          ?        ?      295.9        3.1       ?       ? 
1 1 1   31   10   51 o     63.9   13.4    0.0000   0.0000          ?        ?    42.7809  16.6016          ?        ?       63.9       13.4       ?       ? 
1 1 1   31   10   52 o    121.8    7.3    0.0000   0.0000          ?        ?   148.7755  17.8786          ?        ?      121.8        7.3       ?       ? 
1 1 1   31   10   53 o     18.8    9.5    0.0000   0.0000          ?        ?   -62.5751  17.8786          ?        ?       18.8        9.5       ?       ? 
1 1 1   31   10   54 f    199.2    4.6    0.0000   0.0000          ?        ?   397.1605  18.5171          ?        ?      199.2        4.6       ?       ? 
1 1 1   31   10   55 o     18.5    9.4    0.0000   0.0000          ?        ?   -65.7677  17.8786          ?        ?       18.5        9.4       ?       ? 
1 1 1   31   10   56 o    201.2    4.8    0.0000   0.0000          ?        ?   405.4612  19.1556          ?        ?      201.2        4.8       ?       ? 
1 1 1   31   10   57 o    351.5    3.2    0.0000   0.0000          ?        ?  1236.8164  22.3483          ?        ?      351.5        3.2       ?       ? 
1 1 1   31   10   58 o    254.4    4.0    0.0000   0.0000          ?        ?   648.0994  20.4327          ?        ?      254.4        4.0       ?       ? 
1 1 1   31   10   59 o    255.5    4.2    0.0000   0.0000          ?        ?   653.8461  21.7097          ?        ?      255.5        4.2       ?       ? 
1 1 1   31   10   60 o    380.6    3.0    0.0000   0.0000          ?        ?  1450.0826  22.9868          ?        ?      380.6        3.0       ?       ? 
1 1 1   31   10   61 f    120.2    8.2    0.0000   0.0000          ?        ?   145.5829  19.7942          ?        ?      120.2        8.2       ?       ? 
1 1 1   31   10   62 o     63.8   15.2    0.0000   0.0000          ?        ?    43.4195  19.1556          ?        ?       63.8       15.2       ?       ? 
1 1 1   31   10   63 o     22.6   11.2    0.0000   0.0000          ?        ?   -48.5276  19.7942          ?        ?       22.6       11.2       ?       ? 
1 1 1   31   10   64 o    199.9    5.1    0.0000   0.0000          ?        ?   400.9916  20.4327          ?        ?      199.9        5.1       ?       ? 
1 1 1   31   10   65 o    113.5    9.0    0.0000   0.0000          ?        ?   130.2584  20.4327          ?        ?      113.5        9.0       ?       ? 
1 1 1   31   10   66 o    253.1    3.9    0.0000   0.0000          ?        ?   642.3527  19.7942          ?        ?      253.1        3.9       ?       ? 
1 1 1   31   10   67 o     50.1   16.5    0.0000   0.0000          ?        ?    25.5409  19.1556          ?        ?       50.1       16.5       ?       ? 
1 1 1   31   10   68 o     81.9   12.1    0.0000   0.0000          ?        ?    68.9603  19.7942          ?        ?       81.9       12.1       ?       ? 
1 1 1   31   11    0 o    174.2    4.2  303.9363  14.6860   303.9363  14.6860   303.9363  14.6860      174.2      4.2      174.2        4.2     0.0     0.0 
1 1 1   31   11    1 o    526.7    2.7    0.0000   0.0000          ?        ?  2773.7378  28.7335          ?        ?      526.7        2.7       ?       ? 
1 1 1   31   11    2 o    127.8    4.0    0.0000   0.0000          ?        ?   163.4615  10.2163          ?        ?      127.8        4.0       ?       ? 
1 1 1   31   11    3 o    800.4    3.2    0.0000   0.0000          ?        ?  6407.5645  51.0817          ?        ?      800.4        3.2       ?       ? 
1 1 1   31   11    4 o    913.2    3.7    0.0000   0.0000          ?        ?  8339.7305  67.6833          ?        ?      913.2        3.7       ?       ? 
1 1 1   31   11    5 o    424.3    2.3    0.0000   0.0000          ?        ?  1800.6310  19.7942          ?        ?      424.3        2.3       ?       ? 
1 1 1   31   11    6 o    768.5    3.3    0.0000   0.0000          ?        ?  5906.9634  50.4432          ?        ?      768.5        3.3       ?       ? 
1 1 1   31   11    7 o    703.0    3.0    0.0000   0.0000          ?        ?  4942.7959  41.5039          ?        ?      703.0        3.0       ?       ? 
1 1 1   31   11    8 o    813.6    3.4    0.0000   0.0000          ?        ?  6620.1924  55.5514          ?        ?      813.6        3.4       ?       ? 
1 1 1   31   11    9 o    837.1    3.5    0.0000   0.0000          ?        ?  7007.7749  58.1055          ?        ?      837.1        3.5       ?       ? 
1 1 1   31   11   10 o    756.9    3.2    0.0000   0.0000          ?        ?  5728.8159  49.1662          ?        ?      756.9        3.2       ?       ? 
1 1 1   31   11   11 o    452.2    2.6    0.0000   0.0000          ?        ?  2045.1847  23.6253          ?        ?      452.2        2.6       ?       ? 
1 1 1   31   11   12 o    773.4    3.2    0.0000   0.0000          ?        ?  5982.3091  49.8047          ?        ?      773.4        3.2       ?       ? 
1 1 1   31   11   13 o    950.6    3.6    0.0000   0.0000          ?        ?  9036.3574  68.9603          ?        ?      950.6        3.6       ?       ? 
1 1 1   31   11   14 o    414.7    2.4    0.0000   0.0000          ?        ?  1719.5387  19.7942          ?        ?      414.7        2.4       ?       ? 
1 1 1   31   11   15 o    330.4    2.5    0.0000   0.0000          ?        ?  1091.8719  16.6016          ?        ?      330.4        2.5       ?       ? 
1 1 1   31   11   16 o    199.8    3.0    0.0000   0.0000          ?        ?   399.0760  12.1319          ?        ?      199.8        3.0       ?       ? 
1 1 1   31   11   17 o    241.7    2.9    0.0000   0.0000          ?        ?   584.2473  14.0475          ?        ?      241.7        2.9       ?       ? 
1 1 1   31   11   18 o   1106.7    4.1    0.0000   0.0000          ?        ? 12250.6758  90.6701          ?        ?     1106.7        4.1       ?       ? 
1 1 1   31   11   19 o     21.2   10.5    0.0000   0.0000          ?        ?   -38.9498  16.6016          ?        ?       21.2       10.5       ?       ? 
1 1 1   31   11   20 o    214.5    3.6    0.0000   0.0000          ?        ?   460.3741  15.3245          ?        ?      214.5        3.6       ?       ? 
1 1 1   31   11   21 o    387.4    2.5    0.0000   0.0000          ?        ?  1501.1644  19.1556          ?        ?      387.4        2.5       ?       ? 
1 1 1   31   11   22 o    599.8    2.6    0.0000   0.0000          ?        ?  3598.0693  31.2876          ?        ?      599.8        2.6       ?       ? 
1 1 1   31   11   23 o    573.1    2.6    0.0000   0.0000          ?        ?  3285.1938  30.0105          ?        ?      573.1        2.6       ?       ? 
1 1 1   31   11   24 o    582.2    2.6    0.0000   0.0000          ?        ?  3389.2727  30.0105          ?        ?      582.2        2.6       ?       ? 
1 1 1   31   11   25 o    625.1    2.7    0.0000   0.0000          ?        ?  3908.3906  33.2031          ?        ?      625.1        2.7       ?       ? 
1 1 1   31   11   26 o    403.6    2.4    0.0000   0.0000          ?        ?  1628.8687  19.1556          ?        ?      403.6        2.4       ?       ? 
1 1 1   31   11   27 o    558.0    2.6    0.0000   0.0000          ?        ?  3113.4314  29.3720          ?        ?      558.0        2.6       ?       ? 
1 1 1   31   11   28 o    472.2    2.5    0.0000   0.0000          ?        ?  2229.7175  23.6253          ?        ?      472.2        2.5       ?       ? 
1 1 1   31   11   29 o    589.4    2.6    0.0000   0.0000          ?        ?  3474.8347  30.6490          ?        ?      589.4        2.6       ?       ? 
1 1 1   31   11   30 o    315.2    2.6    0.0000   0.0000          ?        ?   993.5397  16.6016          ?        ?      315.2        2.6       ?       ? 
1 1 1   31   11   31 o    393.6    2.5    0.0000   0.0000          ?        ?  1549.6920  19.7942          ?        ?      393.6        2.5       ?       ? 
1 1 1   31   11   32 o    588.2    2.6    0.0000   0.0000          ?        ?  3460.7871  30.6490          ?        ?      588.2        2.6       ?       ? 
1 1 1   31   11   33 o    465.1    2.5    0.0000   0.0000          ?        ?  2163.3113  23.6253          ?        ?      465.1        2.5       ?       ? 
1 1 1   31   11   34 o    160.4    4.8    0.0000   0.0000          ?        ?   257.3242  15.3245          ?        ?      160.4        4.8       ?       ? 
1 1 1   31   11   35 o     27.3   12.4    0.0000   0.0000          ?        ?    -8.9393  14.6860          ?        ?       27.3       12.4       ?       ? 
1 1 1   31   11   36 o    574.4    2.7    0.0000   0.0000          ?        ?  3299.8796  30.6490          ?        ?      574.4        2.7       ?       ? 
1 1 1   31   11   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   11   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   11   39 o    621.2    2.6    0.0000   0.0000          ?        ?  3859.8633  32.5646          ?        ?      621.2        2.6       ?       ? 
1 1 1   31   11   40 o    151.3    5.1    0.0000   0.0000          ?        ?   229.2293  15.3245          ?        ?      151.3        5.1       ?       ? 
1 1 1   31   11   41 o    259.7    3.2    0.0000   0.0000          ?        ?   674.9174  16.6016          ?        ?      259.7        3.2       ?       ? 
1 1 1   31   11   42 o    194.2    4.3    0.0000   0.0000          ?        ?   377.3663  16.6016          ?        ?      194.2        4.3       ?       ? 
1 1 1   31   11   43 o    393.8    2.7    0.0000   0.0000          ?        ?  1550.9690  21.0712          ?        ?      393.8        2.7       ?       ? 
1 1 1   31   11   44 o    345.3    2.8    0.0000   0.0000          ?        ?  1192.7584  19.1556          ?        ?      345.3        2.8       ?       ? 
1 1 1   31   11   45 o     62.0   13.3    0.0000   0.0000          ?        ?    40.2269  15.9630          ?        ?       62.0       13.3       ?       ? 
1 1 1   31   11   46 o    150.9    5.3    0.0000   0.0000          ?        ?   227.9522  15.9630          ?        ?      150.9        5.3       ?       ? 
1 1 1   31   11   47 o    328.8    3.1    0.0000   0.0000          ?        ?  1081.6556  20.4327          ?        ?      328.8        3.1       ?       ? 
1 1 1   31   11   48 f    103.1    8.4    0.0000   0.0000          ?        ?   106.6331  17.2401          ?        ?      103.1        8.4       ?       ? 
1 1 1   31   11   49 o    193.3    4.5    0.0000   0.0000          ?        ?   374.1737  17.2401          ?        ?      193.3        4.5       ?       ? 
1 1 1   31   11   50 o    240.7    3.6    0.0000   0.0000          ?        ?   579.7776  17.2401          ?        ?      240.7        3.6       ?       ? 
1 1 1   31   11   51 o    142.1    5.8    0.0000   0.0000          ?        ?   202.4114  16.6016          ?        ?      142.1        5.8       ?       ? 
1 1 1   31   11   52 o     52.9   15.7    0.0000   0.0000          ?        ?    28.7335  17.8786          ?        ?       52.9       15.7       ?       ? 
1 1 1   31   11   53 f    307.9    3.2    0.0000   0.0000          ?        ?   948.8432  19.7942          ?        ?      307.9        3.2       ?       ? 
1 1 1   31   11   54 o    176.9    5.2    0.0000   0.0000          ?        ?   313.5141  18.5171          ?        ?      176.9        5.2       ?       ? 
1 1 1   31   11   55 f     24.5   11.8    0.0000   0.0000          ?        ?   -29.3720  17.8786          ?        ?       24.5       11.8       ?       ? 
1 1 1   31   11   56 o    181.9    5.1    0.0000   0.0000          ?        ?   331.3927  18.5171          ?        ?      181.9        5.1       ?       ? 
1 1 1   31   11   57 o    110.1    8.7    0.0000   0.0000          ?        ?   121.9576  19.1556          ?        ?      110.1        8.7       ?       ? 
1 1 1   31   11   58 o     26.6   12.8    0.0000   0.0000          ?        ?   -28.7335  19.7942          ?        ?       26.6       12.8       ?       ? 
1 1 1   31   11   59 o    208.0    5.1    0.0000   0.0000          ?        ?   433.5562  21.0712          ?        ?      208.0        5.1       ?       ? 
1 1 1   31   11   60 o     98.0   10.1    0.0000   0.0000          ?        ?    97.0553  19.7942          ?        ?       98.0       10.1       ?       ? 
1 1 1   31   11   61 o    160.1    6.0    0.0000   0.0000          ?        ?   257.3242  19.1556          ?        ?      160.1        6.0       ?       ? 
1 1 1   31   11   62 o    172.6    5.6    0.0000   0.0000          ?        ?   298.8281  19.1556          ?        ?      172.6        5.6       ?       ? 
1 1 1   31   11   63 o    161.0    6.1    0.0000   0.0000          ?        ?   260.5168  19.7942          ?        ?      161.0        6.1       ?       ? 
1 1 1   31   11   64 o    242.4    4.3    0.0000   0.0000          ?        ?   589.3555  21.0712          ?        ?      242.4        4.3       ?       ? 
1 1 1   31   11   65 o     67.2   15.5    0.0000   0.0000          ?        ?    48.5276  20.4327          ?        ?       67.2       15.5       ?       ? 
1 1 1   31   11   66 o    187.8    5.4    0.0000   0.0000          ?        ?   354.3795  20.4327          ?        ?      187.8        5.4       ?       ? 
1 1 1   31   11   67 o     98.2   10.4    0.0000   0.0000          ?        ?    98.3323  20.4327          ?        ?       98.2       10.4       ?       ? 
1 1 1   31   11   68 o    108.6    9.1    0.0000   0.0000          ?        ?   120.0421  19.7942          ?        ?      108.6        9.1       ?       ? 
1 1 1   31   12    0 o   1572.8    8.2 24745.2656 258.6013 24745.2656 258.6013 24745.2656 258.6013     1572.8      8.2     1572.8        8.2     0.0     0.0 
1 1 1   31   12    1 o    442.4    2.8    0.0000   0.0000          ?        ?  1957.0687  24.9023          ?        ?      442.4        2.8       ?       ? 
1 1 1   31   12    2 o    324.0    2.7    0.0000   0.0000          ?        ?  1049.7295  17.2401          ?        ?      324.0        2.7       ?       ? 
1 1 1   31   12    3 o    661.2    3.0    0.0000   0.0000          ?        ?  4372.5962  39.5883          ?        ?      661.2        3.0       ?       ? 
1 1 1   31   12    4 o   1050.3    4.1    0.0000   0.0000          ?        ? 11032.3770  86.8389          ?        ?     1050.3        4.1       ?       ? 
1 1 1   31   12    5 o   1225.6    4.4    0.0000   0.0000          ?        ? 15023.1367 108.5487          ?        ?     1225.6        4.4       ?       ? 
1 1 1   31   12    6 o   1061.7    4.4    0.0000   0.0000          ?        ? 11273.0996  93.2242          ?        ?     1061.7        4.4       ?       ? 
1 1 1   31   12    7 o   1446.5    5.1    0.0000   0.0000          ?        ? 20928.1855 148.7755          ?        ?     1446.5        5.1       ?       ? 
1 1 1   31   12    8 o    451.7    2.6    0.0000   0.0000          ?        ?  2040.7152  23.6253          ?        ?      451.7        2.6       ?       ? 
1 1 1   31   12    9 o    657.8    2.8    0.0000   0.0000          ?        ?  4327.8994  37.0343          ?        ?      657.8        2.8       ?       ? 
1 1 1   31   12   10 o    597.4    2.7    0.0000   0.0000          ?        ?  3568.6975  31.9261          ?        ?      597.4        2.7       ?       ? 
1 1 1   31   12   11 o    880.0    3.4    0.0000   0.0000          ?        ?  7745.2671  60.6596          ?        ?      880.0        3.4       ?       ? 
1 1 1   31   12   12 o    618.7    2.7    0.0000   0.0000          ?        ?  3827.9373  33.2031          ?        ?      618.7        2.7       ?       ? 
1 1 1   31   12   13 o   1071.2    4.0    0.0000   0.0000          ?        ? 11476.1494  86.2004          ?        ?     1071.2        4.0       ?       ? 
1 1 1   31   12   14 o    332.1    2.4    0.0000   0.0000          ?        ?  1102.7268  15.9630          ?        ?      332.1        2.4       ?       ? 
1 1 1   31   12   15 o    396.0    2.3    0.0000   0.0000          ?        ?  1568.2091  18.5171          ?        ?      396.0        2.3       ?       ? 
1 1 1   31   12   16 o    601.9    2.7    0.0000   0.0000          ?        ?  3623.6104  32.5646          ?        ?      601.9        2.7       ?       ? 
1 1 1   31   12   17 o    402.4    2.5    0.0000   0.0000          ?        ?  1619.2909  19.7942          ?        ?      402.4        2.5       ?       ? 
1 1 1   31   12   18 o    565.1    2.7    0.0000   0.0000          ?        ?  3193.8853  30.0105          ?        ?      565.1        2.7       ?       ? 
1 1 1   31   12   19 o    561.4    2.7    0.0000   0.0000          ?        ?  3152.3813  30.6490          ?        ?      561.4        2.7       ?       ? 
1 1 1   31   12   20 f   1039.4    3.8    0.0000   0.0000          ?        ? 10804.4238  78.5382          ?        ?     1039.4        3.8       ?       ? 
1 1 1   31   12   21 o    310.8    2.5    0.0000   0.0000          ?        ?   966.0833  15.3245          ?        ?      310.8        2.5       ?       ? 
1 1 1   31   12   22 o    561.4    2.6    0.0000   0.0000          ?        ?  3152.3813  28.7335          ?        ?      561.4        2.6       ?       ? 
1 1 1   31   12   23 o    263.3    2.8    0.0000   0.0000          ?        ?   693.4344  14.6860          ?        ?      263.3        2.8       ?       ? 
1 1 1   31   12   24 o    212.5    3.3    0.0000   0.0000          ?        ?   451.4348  14.0475          ?        ?      212.5        3.3       ?       ? 
1 1 1   31   12   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   12   26 o    129.8    4.9    0.0000   0.0000          ?        ?   168.5697  12.7704          ?        ?      129.8        4.9       ?       ? 
1 1 1   31   12   27 o    586.2    2.6    0.0000   0.0000          ?        ?  3437.1619  30.0105          ?        ?      586.2        2.6       ?       ? 
1 1 1   31   12   28 o     89.3    7.9    0.0000   0.0000          ?        ?    79.8152  14.0475          ?        ?       89.3        7.9       ?       ? 
1 1 1   31   12   29 o    267.3    2.9    0.0000   0.0000          ?        ?   714.5057  15.3245          ?        ?      267.3        2.9       ?       ? 
1 1 1   31   12   30 o    308.2    2.6    0.0000   0.0000          ?        ?   950.1202  15.9630          ?        ?      308.2        2.6       ?       ? 
1 1 1   31   12   31 o    340.3    2.5    0.0000   0.0000          ?        ?  1158.2782  17.2401          ?        ?      340.3        2.5       ?       ? 
1 1 1   31   12   32 o    513.9    2.5    0.0000   0.0000          ?        ?  2641.5640  26.1794          ?        ?      513.9        2.5       ?       ? 
1 1 1   31   12   33 f    332.8    2.6    0.0000   0.0000          ?        ?  1107.8350  17.2401          ?        ?      332.8        2.6       ?       ? 
1 1 1   31   12   34 o    329.0    2.7    0.0000   0.0000          ?        ?  1082.2942  17.8786          ?        ?      329.0        2.7       ?       ? 
1 1 1   31   12   35 o    135.6    5.2    0.0000   0.0000          ?        ?   183.8942  14.0475          ?        ?      135.6        5.2       ?       ? 
1 1 1   31   12   36 o    186.8    4.1    0.0000   0.0000          ?        ?   349.2713  15.3245          ?        ?      186.8        4.1       ?       ? 
1 1 1   31   12   37 o    206.5    3.7    0.0000   0.0000          ?        ?   426.5325  15.3245          ?        ?      206.5        3.7       ?       ? 
1 1 1   31   12   38 o    318.8    3.0    0.0000   0.0000          ?        ?  1016.5264  19.1556          ?        ?      318.8        3.0       ?       ? 
1 1 1   31   12   39 o    311.0    3.0    0.0000   0.0000          ?        ?   967.3603  18.5171          ?        ?      311.0        3.0       ?       ? 
1 1 1   31   12   40 o    557.9    2.6    0.0000   0.0000          ?        ?  3113.4314  29.3720          ?        ?      557.9        2.6       ?       ? 
1 1 1   31   12   41 o    277.0    3.1    0.0000   0.0000          ?        ?   767.5030  17.2401          ?        ?      277.0        3.1       ?       ? 
1 1 1   31   12   42 o     48.3   14.6    0.0000   0.0000          ?        ?    23.6253  15.3245          ?        ?       48.3       14.6       ?       ? 
1 1 1   31   12   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   12   44 o    516.7    2.5    0.0000   0.0000          ?        ?  2670.2976  26.1794          ?        ?      516.7        2.5       ?       ? 
1 1 1   31   12   45 o     27.2   12.6    0.0000   0.0000          ?        ?   -12.7704  15.9630          ?        ?       27.2       12.6       ?       ? 
1 1 1   31   12   46 o    168.5    5.1    0.0000   0.0000          ?        ?   284.1421  17.2401          ?        ?      168.5        5.1       ?       ? 
1 1 1   31   12   47 o    455.0    2.7    0.0000   0.0000          ?        ?  2071.3640  24.2638          ?        ?      455.0        2.7       ?       ? 
1 1 1   31   12   48 o    331.0    2.9    0.0000   0.0000          ?        ?  1096.3416  19.1556          ?        ?      331.0        2.9       ?       ? 
1 1 1   31   12   49 o    214.0    4.0    0.0000   0.0000          ?        ?   458.4586  17.2401          ?        ?      214.0        4.0       ?       ? 
1 1 1   31   12   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   12   51 o    107.0    8.1    0.0000   0.0000          ?        ?   114.9339  17.2401          ?        ?      107.0        8.1       ?       ? 
1 1 1   31   12   52 o    214.6    4.2    0.0000   0.0000          ?        ?   461.0126  17.8786          ?        ?      214.6        4.2       ?       ? 
1 1 1   31   12   53 o     89.7   10.3    0.0000   0.0000          ?        ?    81.0922  18.5171          ?        ?       89.7       10.3       ?       ? 
1 1 1   31   12   54 o    294.5    3.5    0.0000   0.0000          ?        ?   867.7509  20.4327          ?        ?      294.5        3.5       ?       ? 
1 1 1   31   12   55 o    345.2    3.0    0.0000   0.0000          ?        ?  1192.7584  20.4327          ?        ?      345.2        3.0       ?       ? 
1 1 1   31   12   56 o     72.0   13.4    0.0000   0.0000          ?        ?    54.2743  18.5171          ?        ?       72.0       13.4       ?       ? 
1 1 1   31   12   57 o     63.5   15.7    0.0000   0.0000          ?        ?    42.7809  19.7942          ?        ?       63.5       15.7       ?       ? 
1 1 1   31   12   58 o     19.4    9.8    0.0000   0.0000          ?        ?   -62.5751  18.5171          ?        ?       19.4        9.8       ?       ? 
1 1 1   31   12   59 o    116.2    8.5    0.0000   0.0000          ?        ?   136.0051  19.7942          ?        ?      116.2        8.5       ?       ? 
1 1 1   31   12   60 o     56.6   16.1    0.0000   0.0000          ?        ?    33.8416  19.1556          ?        ?       56.6       16.1       ?       ? 
1 1 1   31   12   61 o    124.4    7.7    0.0000   0.0000          ?        ?   155.7993  19.1556          ?        ?      124.4        7.7       ?       ? 
1 1 1   31   12   62 o    208.7    4.7    0.0000   0.0000          ?        ?   436.7488  19.7942          ?        ?      208.7        4.7       ?       ? 
1 1 1   31   12   63 o    174.1    5.7    0.0000   0.0000          ?        ?   304.5748  19.7942          ?        ?      174.1        5.7       ?       ? 
1 1 1   31   12   64 o     71.4   14.4    0.0000   0.0000          ?        ?    54.2743  19.7942          ?        ?       71.4       14.4       ?       ? 
1 1 1   31   12   65 o    267.1    3.9    0.0000   0.0000          ?        ?   715.1442  21.0712          ?        ?      267.1        3.9       ?       ? 
1 1 1   31   12   66 o     68.4   14.9    0.0000   0.0000          ?        ?    50.4432  19.7942          ?        ?       68.4       14.9       ?       ? 
1 1 1   31   12   67 f     78.3   12.2    0.0000   0.0000          ?        ?    63.2136  19.1556          ?        ?       78.3       12.2       ?       ? 
1 1 1   31   13    0 o     19.3   13.5  -16.6016  18.5171   -16.6016  18.5171   -16.6016  18.5171       19.3     13.5       19.3       13.5     0.0     0.0 
1 1 1   31   13    1 f    613.9    3.1    0.0000   0.0000          ?        ?  3768.5547  38.3113          ?        ?      613.9        3.1       ?       ? 
1 1 1   31   13    2 o    584.3    2.8    0.0000   0.0000          ?        ?  3414.8135  33.2031          ?        ?      584.3        2.8       ?       ? 
1 1 1   31   13    3 o    346.6    2.5    0.0000   0.0000          ?        ?  1201.0592  17.2401          ?        ?      346.6        2.5       ?       ? 
1 1 1   31   13    4 o    576.4    2.8    0.0000   0.0000          ?        ?  3322.2280  31.9261          ?        ?      576.4        2.8       ?       ? 
1 1 1   31   13    5 o    766.4    3.1    0.0000   0.0000          ?        ?  5874.3989  47.8891          ?        ?      766.4        3.1       ?       ? 
1 1 1   31   13    6 o   1307.7    4.6    0.0000   0.0000          ?        ? 17104.7168 120.0421          ?        ?     1307.7        4.6       ?       ? 
1 1 1   31   13    7 o    568.9    2.7    0.0000   0.0000          ?        ?  3236.6660  31.2876          ?        ?      568.9        2.7       ?       ? 
1 1 1   31   13    8 o    591.0    2.6    0.0000   0.0000          ?        ?  3492.7134  31.2876          ?        ?      591.0        2.6       ?       ? 
1 1 1   31   13    9 o    484.1    2.4    0.0000   0.0000          ?        ?  2344.0129  23.6253          ?        ?      484.1        2.4       ?       ? 
1 1 1   31   13   10 f    247.4    2.5    0.0000   0.0000          ?        ?   612.3422  12.1319          ?        ?      247.4        2.5       ?       ? 
1 1 1   31   13   11 o    245.5    2.6    0.0000   0.0000          ?        ?   602.7644  12.7704          ?        ?      245.5        2.6       ?       ? 
1 1 1   31   13   12 o    449.0    2.4    0.0000   0.0000          ?        ?  2016.4512  21.7097          ?        ?      449.0        2.4       ?       ? 
1 1 1   31   13   13 o    743.9    3.1    0.0000   0.0000          ?        ?  5534.7056  46.6121          ?        ?      743.9        3.1       ?       ? 
1 1 1   31   13   14 o    263.2    2.5    0.0000   0.0000          ?        ?   692.7960  13.4090          ?        ?      263.2        2.5       ?       ? 
1 1 1   31   13   15 o    190.1    3.4    0.0000   0.0000          ?        ?   361.4032  12.7704          ?        ?      190.1        3.4       ?       ? 
1 1 1   31   13   16 o    496.6    2.7    0.0000   0.0000          ?        ?  2465.9707  26.8179          ?        ?      496.6        2.7       ?       ? 
1 1 1   31   13   17 o    187.6    3.6    0.0000   0.0000          ?        ?   351.8254  13.4090          ?        ?      187.6        3.6       ?       ? 
1 1 1   31   13   18 o    332.1    2.5    0.0000   0.0000          ?        ?  1102.7268  16.6016          ?        ?      332.1        2.5       ?       ? 
1 1 1   31   13   19 o    557.2    2.6    0.0000   0.0000          ?        ?  3104.4922  28.7335          ?        ?      557.2        2.6       ?       ? 
1 1 1   31   13   20 o    546.8    2.5    0.0000   0.0000          ?        ?  2990.1968  27.4564          ?        ?      546.8        2.5       ?       ? 
1 1 1   31   13   21 o     61.9    9.3    0.0000   0.0000          ?        ?    38.3113  11.4934          ?        ?       61.9        9.3       ?       ? 
1 1 1   31   13   22 o    824.2    3.2    0.0000   0.0000          ?        ?  6794.5083  52.3588          ?        ?      824.2        3.2       ?       ? 
1 1 1   31   13   23 o    654.2    2.7    0.0000   0.0000          ?        ?  4280.0103  35.1187          ?        ?      654.2        2.7       ?       ? 
1 1 1   31   13   24 o    231.3    2.9    0.0000   0.0000          ?        ?   535.0811  13.4090          ?        ?      231.3        2.9       ?       ? 
1 1 1   31   13   25 o    367.2    2.3    0.0000   0.0000          ?        ?  1348.5576  17.2401          ?        ?      367.2        2.3       ?       ? 
1 1 1   31   13   26 o    121.4    5.0    0.0000   0.0000          ?        ?   147.4985  12.1319          ?        ?      121.4        5.0       ?       ? 
1 1 1   31   13   27 o     31.7   12.9    0.0000   0.0000          ?        ?     3.8311  12.7704          ?        ?       31.7       12.9       ?       ? 
1 1 1   31   13   28 o     61.4   11.4    0.0000   0.0000          ?        ?    38.9498  13.4090          ?        ?       61.4       11.4       ?       ? 
1 1 1   31   13   29 o    240.9    3.0    0.0000   0.0000          ?        ?   580.4161  14.6860          ?        ?      240.9        3.0       ?       ? 
1 1 1   31   13   30 o    218.8    3.4    0.0000   0.0000          ?        ?   478.8912  14.6860          ?        ?      218.8        3.4       ?       ? 
1 1 1   31   13   31 o    190.7    3.7    0.0000   0.0000          ?        ?   363.9573  14.0475          ?        ?      190.7        3.7       ?       ? 
1 1 1   31   13   32 o    411.9    2.6    0.0000   0.0000          ?        ?  1696.5520  21.0712          ?        ?      411.9        2.6       ?       ? 
1 1 1   31   13   33 o    387.5    2.6    0.0000   0.0000          ?        ?  1501.8029  20.4327          ?        ?      387.5        2.6       ?       ? 
1 1 1   31   13   34 o    242.7    3.3    0.0000   0.0000          ?        ?   589.3555  15.9630          ?        ?      242.7        3.3       ?       ? 
1 1 1   31   13   35 o    398.9    2.5    0.0000   0.0000          ?        ?  1591.8345  19.7942          ?        ?      398.9        2.5       ?       ? 
1 1 1   31   13   36 o     77.8    9.0    0.0000   0.0000          ?        ?    60.6596  14.0475          ?        ?       77.8        9.0       ?       ? 
1 1 1   31   13   37 o    228.5    3.2    0.0000   0.0000          ?        ?   522.3107  14.6860          ?        ?      228.5        3.2       ?       ? 
1 1 1   31   13   38 o    447.7    2.5    0.0000   0.0000          ?        ?  2004.3193  22.3483          ?        ?      447.7        2.5       ?       ? 
1 1 1   31   13   39 o    281.8    3.1    0.0000   0.0000          ?        ?   794.3209  17.2401          ?        ?      281.8        3.1       ?       ? 
1 1 1   31   13   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   13   41 o    214.1    3.6    0.0000   0.0000          ?        ?   458.4586  15.3245          ?        ?      214.1        3.6       ?       ? 
1 1 1   31   13   42 o    418.0    2.6    0.0000   0.0000          ?        ?  1747.6338  21.7097          ?        ?      418.0        2.6       ?       ? 
1 1 1   31   13   43 o    261.1    3.3    0.0000   0.0000          ?        ?   681.9411  17.2401          ?        ?      261.1        3.3       ?       ? 
1 1 1   31   13   44 o    452.8    2.6    0.0000   0.0000          ?        ?  2050.9316  23.6253          ?        ?      452.8        2.6       ?       ? 
1 1 1   31   13   45 o    200.5    4.3    0.0000   0.0000          ?        ?   402.2686  17.2401          ?        ?      200.5        4.3       ?       ? 
1 1 1   31   13   46 o     96.4    8.9    0.0000   0.0000          ?        ?    93.2242  17.2401          ?        ?       96.4        8.9       ?       ? 
1 1 1   31   13   47 o     67.4   12.3    0.0000   0.0000          ?        ?    47.2506  15.9630          ?        ?       67.4       12.3       ?       ? 
1 1 1   31   13   48 o    266.6    3.5    0.0000   0.0000          ?        ?   711.3131  18.5171          ?        ?      266.6        3.5       ?       ? 
1 1 1   31   13   49 o    177.5    5.0    0.0000   0.0000          ?        ?   315.4297  17.8786          ?        ?      177.5        5.0       ?       ? 
1 1 1   31   13   50 o    258.8    3.5    0.0000   0.0000          ?        ?   670.4477  17.8786          ?        ?      258.8        3.5       ?       ? 
1 1 1   31   13   51 o    339.4    3.0    0.0000   0.0000          ?        ?  1152.5315  20.4327          ?        ?      339.4        3.0       ?       ? 
1 1 1   31   13   52 o     19.7    9.9    0.0000   0.0000          ?        ?   -56.1899  17.8786          ?        ?       19.7        9.9       ?       ? 
1 1 1   31   13   53 o    287.3    3.6    0.0000   0.0000          ?        ?   826.2469  20.4327          ?        ?      287.3        3.6       ?       ? 
1 1 1   31   13   54 o    126.6    7.6    0.0000   0.0000          ?        ?   160.9075  19.1556          ?        ?      126.6        7.6       ?       ? 
1 1 1   31   13   55 o    380.8    3.0    0.0000   0.0000          ?        ?  1451.3596  22.9868          ?        ?      380.8        3.0       ?       ? 
1 1 1   31   13   56 o    165.1    5.8    0.0000   0.0000          ?        ?   273.2873  19.1556          ?        ?      165.1        5.8       ?       ? 
1 1 1   31   13   57 o     79.8   12.0    0.0000   0.0000          ?        ?    64.4907  19.1556          ?        ?       79.8       12.0       ?       ? 
1 1 1   31   13   58 o     65.4   14.5    0.0000   0.0000          ?        ?    45.3350  18.5171          ?        ?       65.4       14.5       ?       ? 
1 1 1   31   13   59 o     70.6   13.6    0.0000   0.0000          ?        ?    52.3588  18.5171          ?        ?       70.6       13.6       ?       ? 
1 1 1   31   13   60 o    124.1    7.7    0.0000   0.0000          ?        ?   155.1608  19.1556          ?        ?      124.1        7.7       ?       ? 
1 1 1   31   13   61 o     69.2   15.2    0.0000   0.0000          ?        ?    51.0817  20.4327          ?        ?       69.2       15.2       ?       ? 
1 1 1   31   13   62 o    183.3    5.4    0.0000   0.0000          ?        ?   337.1394  19.7942          ?        ?      183.3        5.4       ?       ? 
1 1 1   31   13   63 o     88.9   11.1    0.0000   0.0000          ?        ?    80.4537  19.7942          ?        ?       88.9       11.1       ?       ? 
1 1 1   31   13   64 o     53.0   16.4    0.0000   0.0000          ?        ?    29.3720  19.1556          ?        ?       53.0       16.4       ?       ? 
1 1 1   31   13   65 o     57.6   15.7    0.0000   0.0000          ?        ?    35.7572  18.5171          ?        ?       57.6       15.7       ?       ? 
1 1 1   31   13   66 f    157.4    6.3    0.0000   0.0000          ?        ?   249.6619  19.7942          ?        ?      157.4        6.3       ?       ? 
1 1 1   31   14    0 o    291.8    3.8  851.7878  22.3483   851.7878  22.3483   851.7878  22.3483      291.8      3.8      291.8        3.8     0.0     0.0 
1 1 1   31   14    1 o    385.1    2.7    0.0000   0.0000          ?        ?  1483.2858  20.4327          ?        ?      385.1        2.7       ?       ? 
1 1 1   31   14    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   14    3 o    614.8    3.0    0.0000   0.0000          ?        ?  3780.0481  36.3957          ?        ?      614.8        3.0       ?       ? 
1 1 1   31   14    4 o    857.9    3.6    0.0000   0.0000          ?        ?  7360.2383  61.9366          ?        ?      857.9        3.6       ?       ? 
1 1 1   31   14    5 o    603.7    2.7    0.0000   0.0000          ?        ?  3645.3201  33.2031          ?        ?      603.7        2.7       ?       ? 
1 1 1   31   14    6 o    609.8    2.9    0.0000   0.0000          ?        ?  3719.3884  35.7572          ?        ?      609.8        2.9       ?       ? 
1 1 1   31   14    7 o    629.1    2.8    0.0000   0.0000          ?        ?  3958.1958  35.7572          ?        ?      629.1        2.8       ?       ? 
1 1 1   31   14    8 o    743.0    3.1    0.0000   0.0000          ?        ?  5521.2964  45.9736          ?        ?      743.0        3.1       ?       ? 
1 1 1   31   14    9 o   1139.2    4.3    0.0000   0.0000          ?        ? 12979.8682  97.6938          ?        ?     1139.2        4.3       ?       ? 
1 1 1   31   14   10 o   1164.3    4.3    0.0000   0.0000          ?        ? 13558.3672 100.8864          ?        ?     1164.3        4.3       ?       ? 
1 1 1   31   14   11 o    600.3    2.6    0.0000   0.0000          ?        ?  3603.8162  31.2876          ?        ?      600.3        2.6       ?       ? 
1 1 1   31   14   12 o    621.0    2.7    0.0000   0.0000          ?        ?  3857.3091  33.2031          ?        ?      621.0        2.7       ?       ? 
1 1 1   31   14   13 o    776.3    3.0    0.0000   0.0000          ?        ?  6027.6440  47.2506          ?        ?      776.3        3.0       ?       ? 
1 1 1   31   14   14 o   1071.1    3.9    0.0000   0.0000          ?        ? 11474.8721  84.2849          ?        ?     1071.1        3.9       ?       ? 
1 1 1   31   14   15 f    642.5    2.9    0.0000   0.0000          ?        ?  4128.6807  37.0343          ?        ?      642.5        2.9       ?       ? 
1 1 1   31   14   16 o    695.3    2.9    0.0000   0.0000          ?        ?  4834.8857  40.8654          ?        ?      695.3        2.9       ?       ? 
1 1 1   31   14   17 o    410.2    2.3    0.0000   0.0000          ?        ?  1683.1431  19.1556          ?        ?      410.2        2.3       ?       ? 
1 1 1   31   14   18 o    674.1    2.8    0.0000   0.0000          ?        ?  4544.9971  38.3113          ?        ?      674.1        2.8       ?       ? 
1 1 1   31   14   19 o    607.5    2.7    0.0000   0.0000          ?        ?  3690.6550  33.2031          ?        ?      607.5        2.7       ?       ? 
1 1 1   31   14   20 o    560.8    2.5    0.0000   0.0000          ?        ?  3144.7190  28.0950          ?        ?      560.8        2.5       ?       ? 
1 1 1   31   14   21 o     38.9   13.1    0.0000   0.0000          ?        ?    14.0475  12.1319          ?        ?       38.9       13.1       ?       ? 
1 1 1   31   14   22 o    299.9    2.6    0.0000   0.0000          ?        ?   899.6769  15.3245          ?        ?      299.9        2.6       ?       ? 
1 1 1   31   14   23 o    917.3    3.4    0.0000   0.0000          ?        ?  8415.7148  63.2136          ?        ?      917.3        3.4       ?       ? 
1 1 1   31   14   24 o     23.5   11.1    0.0000   0.0000          ?        ?   -14.6860  13.4090          ?        ?       23.5       11.1       ?       ? 
1 1 1   31   14   25 o     17.2    8.7    0.0000   0.0000          ?        ?   -45.9736  14.0475          ?        ?       17.2        8.7       ?       ? 
1 1 1   31   14   26 o    464.1    2.5    0.0000   0.0000          ?        ?  2153.7334  23.6253          ?        ?      464.1        2.5       ?       ? 
1 1 1   31   14   27 o    547.8    2.5    0.0000   0.0000          ?        ?  3001.0518  27.4564          ?        ?      547.8        2.5       ?       ? 
1 1 1   31   14   28 o    379.1    2.4    0.0000   0.0000          ?        ?  1437.3123  18.5171          ?        ?      379.1        2.4       ?       ? 
1 1 1   31   14   29 o    479.2    2.5    0.0000   0.0000          ?        ?  2296.7625  23.6253          ?        ?      479.2        2.5       ?       ? 
1 1 1   31   14   30 o    364.8    2.5    0.0000   0.0000          ?        ?  1330.6791  17.8786          ?        ?      364.8        2.5       ?       ? 
1 1 1   31   14   31 o    514.4    2.5    0.0000   0.0000          ?        ?  2646.0337  26.1794          ?        ?      514.4        2.5       ?       ? 
1 1 1   31   14   32 o    358.8    2.6    0.0000   0.0000          ?        ?  1287.2596  18.5171          ?        ?      358.8        2.6       ?       ? 
1 1 1   31   14   33 o    323.9    2.7    0.0000   0.0000          ?        ?  1049.0911  17.2401          ?        ?      323.9        2.7       ?       ? 
1 1 1   31   14   34 o    661.9    2.7    0.0000   0.0000          ?        ?  4381.5356  36.3957          ?        ?      661.9        2.7       ?       ? 
1 1 1   31   14   35 o     66.7   11.0    0.0000   0.0000          ?        ?    44.6965  14.6860          ?        ?       66.7       11.0       ?       ? 
1 1 1   31   14   36 o    469.7    2.5    0.0000   0.0000          ?        ?  2206.7307  23.6253          ?        ?      469.7        2.5       ?       ? 
1 1 1   31   14   37 o    106.5    6.9    0.0000   0.0000          ?        ?   113.6568  14.6860          ?        ?      106.5        6.9       ?       ? 
1 1 1   31   14   38 o    252.0    3.3    0.0000   0.0000          ?        ?   635.3290  16.6016          ?        ?      252.0        3.3       ?       ? 
1 1 1   31   14   39 o    357.7    2.7    0.0000   0.0000          ?        ?  1279.5973  19.1556          ?        ?      357.7        2.7       ?       ? 
1 1 1   31   14   40 o    204.6    3.7    0.0000   0.0000          ?        ?   418.8702  15.3245          ?        ?      204.6        3.7       ?       ? 
1 1 1   31   14   41 o    297.4    2.9    0.0000   0.0000          ?        ?   884.9910  17.2401          ?        ?      297.4        2.9       ?       ? 
1 1 1   31   14   42 o    196.3    4.1    0.0000   0.0000          ?        ?   385.6671  15.9630          ?        ?      196.3        4.1       ?       ? 
1 1 1   31   14   43 o    364.0    2.7    0.0000   0.0000          ?        ?  1325.5709  19.7942          ?        ?      364.0        2.7       ?       ? 
1 1 1   31   14   44 o     52.0   14.7    0.0000   0.0000          ?        ?    28.0950  15.9630          ?        ?       52.0       14.7       ?       ? 
1 1 1   31   14   45 o    234.5    3.4    0.0000   0.0000          ?        ?   550.4056  15.9630          ?        ?      234.5        3.4       ?       ? 
1 1 1   31   14   46 f    304.5    2.8    0.0000   0.0000          ?        ?   927.7720  17.2401          ?        ?      304.5        2.8       ?       ? 
1 1 1   31   14   47 o    199.8    4.2    0.0000   0.0000          ?        ?   399.7145  16.6016          ?        ?      199.8        4.2       ?       ? 
1 1 1   31   14   48 o     24.8   11.9    0.0000   0.0000          ?        ?   -25.5409  17.2401          ?        ?       24.8       11.9       ?       ? 
1 1 1   31   14   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   14   50 o    469.2    2.7    0.0000   0.0000          ?        ?  2202.2610  24.9023          ?        ?      469.2        2.7       ?       ? 
1 1 1   31   14   51 o    309.1    3.3    0.0000   0.0000          ?        ?   955.8669  20.4327          ?        ?      309.1        3.3       ?       ? 
1 1 1   31   14   52 o     25.4   12.1    0.0000   0.0000          ?        ?   -22.9868  17.2401          ?        ?       25.4       12.1       ?       ? 
1 1 1   31   14   53 o    132.3    6.5    0.0000   0.0000          ?        ?   175.5934  17.2401          ?        ?      132.3        6.5       ?       ? 
1 1 1   31   14   54 o     18.4    9.3    0.0000   0.0000          ?        ?   -61.2981  17.2401          ?        ?       18.4        9.3       ?       ? 
1 1 1   31   14   55 o     35.1   15.1    0.0000   0.0000          ?        ?    -1.2770  19.1556          ?        ?       35.1       15.1       ?       ? 
1 1 1   31   14   56 o    215.0    4.6    0.0000   0.0000          ?        ?   462.9282  19.7942          ?        ?      215.0        4.6       ?       ? 
1 1 1   31   14   57 o    199.6    4.8    0.0000   0.0000          ?        ?   399.0760  19.1556          ?        ?      199.6        4.8       ?       ? 
1 1 1   31   14   58 o    224.8    4.4    0.0000   0.0000          ?        ?   506.3477  19.7942          ?        ?      224.8        4.4       ?       ? 
1 1 1   31   14   59 o    169.6    5.6    0.0000   0.0000          ?        ?   288.6118  19.1556          ?        ?      169.6        5.6       ?       ? 
1 1 1   31   14   60 o    121.5    7.9    0.0000   0.0000          ?        ?   148.7755  19.1556          ?        ?      121.5        7.9       ?       ? 
1 1 1   31   14   61 f    134.2    7.1    0.0000   0.0000          ?        ?   181.3401  19.1556          ?        ?      134.2        7.1       ?       ? 
1 1 1   31   14   62 o    137.9    6.9    0.0000   0.0000          ?        ?   191.5565  19.1556          ?        ?      137.9        6.9       ?       ? 
1 1 1   31   14   63 o    203.8    4.9    0.0000   0.0000          ?        ?   416.9547  19.7942          ?        ?      203.8        4.9       ?       ? 
1 1 1   31   14   64 o     81.3   11.8    0.0000   0.0000          ?        ?    67.6833  19.1556          ?        ?       81.3       11.8       ?       ? 
1 1 1   31   14   65 o     34.1   15.0    0.0000   0.0000          ?        ?    -3.8311  19.7942          ?        ?       34.1       15.0       ?       ? 
1 1 1   31   14   66 o     37.3   15.4    0.0000   0.0000          ?        ?     5.7467  18.5171          ?        ?       37.3       15.4       ?       ? 
1 1 1   31   15    0 o     99.2    9.2  100.8864  17.8786   100.8864  17.8786   100.8864  17.8786       99.2      9.2       99.2        9.2     0.0     0.0 
1 1 1   31   15    1 o    380.0    2.6    0.0000   0.0000          ?        ?  1444.3359  19.7942          ?        ?      380.0        2.6       ?       ? 
1 1 1   31   15    2 o    558.0    2.9    0.0000   0.0000          ?        ?  3114.0701  32.5646          ?        ?      558.0        2.9       ?       ? 
1 1 1   31   15    3 o    563.7    2.8    0.0000   0.0000          ?        ?  3177.9221  31.2876          ?        ?      563.7        2.8       ?       ? 
1 1 1   31   15    4 o    450.9    2.8    0.0000   0.0000          ?        ?  2033.6914  24.9023          ?        ?      450.9        2.8       ?       ? 
1 1 1   31   15    5 o    829.1    3.4    0.0000   0.0000          ?        ?  6874.9619  56.8284          ?        ?      829.1        3.4       ?       ? 
1 1 1   31   15    6 o    393.1    2.4    0.0000   0.0000          ?        ?  1545.2223  19.1556          ?        ?      393.1        2.4       ?       ? 
1 1 1   31   15    7 o    485.9    2.6    0.0000   0.0000          ?        ?  2361.2529  24.9023          ?        ?      485.9        2.6       ?       ? 
1 1 1   31   15    8 o    482.0    2.5    0.0000   0.0000          ?        ?  2322.9417  23.6253          ?        ?      482.0        2.5       ?       ? 
1 1 1   31   15    9 o    248.2    2.2    0.0000   0.0000          ?        ?   616.1733  10.8549          ?        ?      248.2        2.2       ?       ? 
1 1 1   31   15   10 o    515.1    2.5    0.0000   0.0000          ?        ?  2653.0574  25.5409          ?        ?      515.1        2.5       ?       ? 
1 1 1   31   15   11 o    306.8    2.4    0.0000   0.0000          ?        ?   941.1808  14.6860          ?        ?      306.8        2.4       ?       ? 
1 1 1   31   15   12 f    148.0    3.9    0.0000   0.0000          ?        ?   219.0129  11.4934          ?        ?      148.0        3.9       ?       ? 
1 1 1   31   15   13 o    578.1    2.7    0.0000   0.0000          ?        ?  3342.6606  30.6490          ?        ?      578.1        2.7       ?       ? 
1 1 1   31   15   14 o    658.8    2.8    0.0000   0.0000          ?        ?  4340.0317  36.3957          ?        ?      658.8        2.8       ?       ? 
1 1 1   31   15   15 o    351.3    2.5    0.0000   0.0000          ?        ?  1234.2623  17.8786          ?        ?      351.3        2.5       ?       ? 
1 1 1   31   15   16 f    402.0    2.4    0.0000   0.0000          ?        ?  1616.0983  19.1556          ?        ?      402.0        2.4       ?       ? 
1 1 1   31   15   17 o    239.6    2.8    0.0000   0.0000          ?        ?   574.0309  13.4090          ?        ?      239.6        2.8       ?       ? 
1 1 1   31   15   18 o    326.5    2.3    0.0000   0.0000          ?        ?  1066.3312  15.3245          ?        ?      326.5        2.3       ?       ? 
1 1 1   31   15   19 o    778.1    3.1    0.0000   0.0000          ?        ?  6055.7393  47.8891          ?        ?      778.1        3.1       ?       ? 
1 1 1   31   15   20 f    256.3    2.7    0.0000   0.0000          ?        ?   657.0388  14.0475          ?        ?      256.3        2.7       ?       ? 
1 1 1   31   15   21 o    585.9    2.6    0.0000   0.0000          ?        ?  3432.6921  30.6490          ?        ?      585.9        2.6       ?       ? 
1 1 1   31   15   22 o    624.3    2.7    0.0000   0.0000          ?        ?  3898.1746  33.2031          ?        ?      624.3        2.7       ?       ? 
1 1 1   31   15   23 o    454.7    2.4    0.0000   0.0000          ?        ?  2067.5330  21.7097          ?        ?      454.7        2.4       ?       ? 
1 1 1   31   15   24 f    416.8    2.4    0.0000   0.0000          ?        ?  1737.4174  19.7942          ?        ?      416.8        2.4       ?       ? 
1 1 1   31   15   25 o   1002.4    3.7    0.0000   0.0000          ?        ? 10051.6074  74.7070          ?        ?     1002.4        3.7       ?       ? 
1 1 1   31   15   26 o    457.8    2.5    0.0000   0.0000          ?        ?  2096.2664  22.9868          ?        ?      457.8        2.5       ?       ? 
1 1 1   31   15   27 o    832.4    3.2    0.0000   0.0000          ?        ?  6931.1523  52.9973          ?        ?      832.4        3.2       ?       ? 
1 1 1   31   15   28 o    118.7    5.6    0.0000   0.0000          ?        ?   141.1133  13.4090          ?        ?      118.7        5.6       ?       ? 
1 1 1   31   15   29 o    258.5    2.8    0.0000   0.0000          ?        ?   668.5321  14.6860          ?        ?      258.5        2.8       ?       ? 
1 1 1   31   15   30 o    312.0    2.7    0.0000   0.0000          ?        ?   973.7455  16.6016          ?        ?      312.0        2.7       ?       ? 
1 1 1   31   15   31 f    241.5    3.0    0.0000   0.0000          ?        ?   583.6088  14.6860          ?        ?      241.5        3.0       ?       ? 
1 1 1   31   15   32 o    610.3    2.7    0.0000   0.0000          ?        ?  3725.1353  33.2031          ?        ?      610.3        2.7       ?       ? 
1 1 1   31   15   33 f    590.6    2.6    0.0000   0.0000          ?        ?  3488.8823  31.2876          ?        ?      590.6        2.6       ?       ? 
1 1 1   31   15   34 o    426.2    2.5    0.0000   0.0000          ?        ?  1817.2325  21.7097          ?        ?      426.2        2.5       ?       ? 
1 1 1   31   15   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   15   36 o    676.6    2.9    0.0000   0.0000          ?        ?  4578.8384  38.9498          ?        ?      676.6        2.9       ?       ? 
1 1 1   31   15   37 o    274.8    3.0    0.0000   0.0000          ?        ?   755.3711  16.6016          ?        ?      274.8        3.0       ?       ? 
1 1 1   31   15   38 o    555.5    2.6    0.0000   0.0000          ?        ?  3086.6135  28.7335          ?        ?      555.5        2.6       ?       ? 
1 1 1   31   15   39 o    214.7    3.6    0.0000   0.0000          ?        ?   461.0126  15.3245          ?        ?      214.7        3.6       ?       ? 
1 1 1   31   15   40 f    266.3    3.1    0.0000   0.0000          ?        ?   709.3975  16.6016          ?        ?      266.3        3.1       ?       ? 
1 1 1   31   15   41 o    265.9    3.1    0.0000   0.0000          ?        ?   707.4820  16.6016          ?        ?      265.9        3.1       ?       ? 
1 1 1   31   15   42 o    309.6    2.9    0.0000   0.0000          ?        ?   959.0594  17.8786          ?        ?      309.6        2.9       ?       ? 
1 1 1   31   15   43 o    289.0    3.0    0.0000   0.0000          ?        ?   835.8248  17.2401          ?        ?      289.0        3.0       ?       ? 
1 1 1   31   15   44 o    241.5    3.6    0.0000   0.0000          ?        ?   583.6088  17.2401          ?        ?      241.5        3.6       ?       ? 
1 1 1   31   15   45 o     55.2   14.7    0.0000   0.0000          ?        ?    31.9261  16.6016          ?        ?       55.2       14.7       ?       ? 
1 1 1   31   15   46 o     34.7   14.3    0.0000   0.0000          ?        ?     3.8311  15.9630          ?        ?       34.7       14.3       ?       ? 
1 1 1   31   15   47 o     97.0    8.2    0.0000   0.0000          ?        ?    94.5012  15.9630          ?        ?       97.0        8.2       ?       ? 
1 1 1   31   15   48 o     71.2   11.7    0.0000   0.0000          ?        ?    51.0817  16.6016          ?        ?       71.2       11.7       ?       ? 
1 1 1   31   15   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   15   50 o    308.7    3.2    0.0000   0.0000          ?        ?   953.3128  19.7942          ?        ?      308.7        3.2       ?       ? 
1 1 1   31   15   51 o    416.2    2.8    0.0000   0.0000          ?        ?  1732.9476  23.6253          ?        ?      416.2        2.8       ?       ? 
1 1 1   31   15   52 o    208.7    4.7    0.0000   0.0000          ?        ?   436.1103  19.7942          ?        ?      208.7        4.7       ?       ? 
1 1 1   31   15   53 o    104.8    9.1    0.0000   0.0000          ?        ?   110.4642  19.1556          ?        ?      104.8        9.1       ?       ? 
1 1 1   31   15   54 o    228.5    4.2    0.0000   0.0000          ?        ?   522.9492  19.1556          ?        ?      228.5        4.2       ?       ? 
1 1 1   31   15   55 o    188.7    4.7    0.0000   0.0000          ?        ?   356.9336  17.8786          ?        ?      188.7        4.7       ?       ? 
1 1 1   31   15   56 o    220.1    4.5    0.0000   0.0000          ?        ?   485.2764  19.7942          ?        ?      220.1        4.5       ?       ? 
1 1 1   31   15   57 o    173.5    5.5    0.0000   0.0000          ?        ?   302.0207  19.1556          ?        ?      173.5        5.5       ?       ? 
1 1 1   31   15   58 o     23.5   11.6    0.0000   0.0000          ?        ?   -43.4195  19.7942          ?        ?       23.5       11.6       ?       ? 
1 1 1   31   15   59 o    345.8    3.1    0.0000   0.0000          ?        ?  1197.2280  21.7097          ?        ?      345.8        3.1       ?       ? 
1 1 1   31   15   60 o    121.5    7.9    0.0000   0.0000          ?        ?   148.7755  19.1556          ?        ?      121.5        7.9       ?       ? 
1 1 1   31   15   61 o    116.0    8.5    0.0000   0.0000          ?        ?   136.0051  19.7942          ?        ?      116.0        8.5       ?       ? 
1 1 1   31   15   62 o     99.4    9.6    0.0000   0.0000          ?        ?   100.2479  19.1556          ?        ?       99.4        9.6       ?       ? 
1 1 1   31   15   63 o     19.3    9.8    0.0000   0.0000          ?        ?   -67.6833  19.1556          ?        ?       19.3        9.8       ?       ? 
1 1 1   31   15   64 o     85.9   10.8    0.0000   0.0000          ?        ?    75.3456  18.5171          ?        ?       85.9       10.8       ?       ? 
1 1 1   31   15   65 o    142.1    6.7    0.0000   0.0000          ?        ?   203.6884  19.1556          ?        ?      142.1        6.7       ?       ? 
1 1 1   31   16    0 o   1304.0    7.5 17012.1328 195.3876 17012.1328 195.3876 17012.1328 195.3876     1304.0      7.5     1304.0        7.5     0.0     0.0 
1 1 1   31   16    1 o    281.1    3.1    0.0000   0.0000          ?        ?   790.4898  17.2401          ?        ?      281.1        3.1       ?       ? 
1 1 1   31   16    2 o    222.2    3.2    0.0000   0.0000          ?        ?   493.5772  14.0475          ?        ?      222.2        3.2       ?       ? 
1 1 1   31   16    3 o    707.9    3.2    0.0000   0.0000          ?        ?  5011.7563  45.9736          ?        ?      707.9        3.2       ?       ? 
1 1 1   31   16    4 o    892.6    3.7    0.0000   0.0000          ?        ?  7969.3882  65.7677          ?        ?      892.6        3.7       ?       ? 
1 1 1   31   16    5 o    401.8    2.9    0.0000   0.0000          ?        ?  1614.8212  23.6253          ?        ?      401.8        2.9       ?       ? 
1 1 1   31   16    6 o    409.5    2.6    0.0000   0.0000          ?        ?  1676.7578  21.0712          ?        ?      409.5        2.6       ?       ? 
1 1 1   31   16    7 o    371.6    2.3    0.0000   0.0000          ?        ?  1381.1223  17.2401          ?        ?      371.6        2.3       ?       ? 
1 1 1   31   16    8 o    589.6    2.6    0.0000   0.0000          ?        ?  3476.1118  30.6490          ?        ?      589.6        2.6       ?       ? 
1 1 1   31   16    9 o    207.6    2.8    0.0000   0.0000          ?        ?   431.0021  11.4934          ?        ?      207.6        2.8       ?       ? 
1 1 1   31   16   10 o    311.6    2.3    0.0000   0.0000          ?        ?   971.1914  14.0475          ?        ?      311.6        2.3       ?       ? 
1 1 1   31   16   11 o    454.3    2.3    0.0000   0.0000          ?        ?  2064.3403  21.0712          ?        ?      454.3        2.3       ?       ? 
1 1 1   31   16   12 o    885.8    3.4    0.0000   0.0000          ?        ?  7846.7925  60.6596          ?        ?      885.8        3.4       ?       ? 
1 1 1   31   16   13 o    498.9    2.6    0.0000   0.0000          ?        ?  2489.5957  25.5409          ?        ?      498.9        2.6       ?       ? 
1 1 1   31   16   14 f    395.8    2.4    0.0000   0.0000          ?        ?  1566.9320  19.1556          ?        ?      395.8        2.4       ?       ? 
1 1 1   31   16   15 o    916.4    3.7    0.0000   0.0000          ?        ?  8399.7520  67.6833          ?        ?      916.4        3.7       ?       ? 
1 1 1   31   16   16 o    476.0    2.6    0.0000   0.0000          ?        ?  2266.1133  24.9023          ?        ?      476.0        2.6       ?       ? 
1 1 1   31   16   17 o     54.4   10.3    0.0000   0.0000          ?        ?    30.6490  10.8549          ?        ?       54.4       10.3       ?       ? 
1 1 1   31   16   18 o    378.8    2.3    0.0000   0.0000          ?        ?  1434.7581  17.2401          ?        ?      378.8        2.3       ?       ? 
1 1 1   31   16   19 o    634.7    2.7    0.0000   0.0000          ?        ?  4029.0715  33.8416          ?        ?      634.7        2.7       ?       ? 
1 1 1   31   16   20 o    219.1    2.9    0.0000   0.0000          ?        ?   480.1682  12.7704          ?        ?      219.1        2.9       ?       ? 
1 1 1   31   16   21 o    574.7    2.6    0.0000   0.0000          ?        ?  3303.7109  30.0105          ?        ?      574.7        2.6       ?       ? 
1 1 1   31   16   22 o    411.7    2.3    0.0000   0.0000          ?        ?  1695.2749  19.1556          ?        ?      411.7        2.3       ?       ? 
1 1 1   31   16   23 o    314.8    2.4    0.0000   0.0000          ?        ?   990.9855  15.3245          ?        ?      314.8        2.4       ?       ? 
1 1 1   31   16   24 o    238.6    3.1    0.0000   0.0000          ?        ?   569.5613  14.6860          ?        ?      238.6        3.1       ?       ? 
1 1 1   31   16   25 o    678.1    2.9    0.0000   0.0000          ?        ?  4599.2710  38.9498          ?        ?      678.1        2.9       ?       ? 
1 1 1   31   16   26 o   1072.8    3.8    0.0000   0.0000          ?        ? 11511.9062  82.3693          ?        ?     1072.8        3.8       ?       ? 
1 1 1   31   16   27 o    208.6    3.7    0.0000   0.0000          ?        ?   435.4717  15.3245          ?        ?      208.6        3.7       ?       ? 
1 1 1   31   16   28 o    369.0    2.4    0.0000   0.0000          ?        ?  1361.9667  17.8786          ?        ?      369.0        2.4       ?       ? 
1 1 1   31   16   29 o    165.1    4.1    0.0000   0.0000          ?        ?   272.6487  13.4090          ?        ?      165.1        4.1       ?       ? 
1 1 1   31   16   30 o    157.4    4.5    0.0000   0.0000          ?        ?   247.7464  14.0475          ?        ?      157.4        4.5       ?       ? 
1 1 1   31   16   31 o    340.4    2.5    0.0000   0.0000          ?        ?  1158.9167  17.2401          ?        ?      340.4        2.5       ?       ? 
1 1 1   31   16   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   16   33 o    143.6    4.9    0.0000   0.0000          ?        ?   206.2425  14.0475          ?        ?      143.6        4.9       ?       ? 
1 1 1   31   16   34 o    252.5    3.3    0.0000   0.0000          ?        ?   637.8831  16.6016          ?        ?      252.5        3.3       ?       ? 
1 1 1   31   16   35 o    233.5    3.4    0.0000   0.0000          ?        ?   545.2975  15.9630          ?        ?      233.5        3.4       ?       ? 
1 1 1   31   16   36 o    387.2    2.6    0.0000   0.0000          ?        ?  1499.8872  20.4327          ?        ?      387.2        2.6       ?       ? 
1 1 1   31   16   37 o    528.2    2.7    0.0000   0.0000          ?        ?  2790.9780  28.7335          ?        ?      528.2        2.7       ?       ? 
1 1 1   31   16   38 o    177.4    4.5    0.0000   0.0000          ?        ?   314.7912  15.9630          ?        ?      177.4        4.5       ?       ? 
1 1 1   31   16   39 o    302.7    2.8    0.0000   0.0000          ?        ?   916.2786  17.2401          ?        ?      302.7        2.8       ?       ? 
1 1 1   31   16   40 f    166.0    4.6    0.0000   0.0000          ?        ?   275.8413  15.3245          ?        ?      166.0        4.6       ?       ? 
1 1 1   31   16   41 o    294.0    2.9    0.0000   0.0000          ?        ?   864.5582  17.2401          ?        ?      294.0        2.9       ?       ? 
1 1 1   31   16   42 o    298.5    3.0    0.0000   0.0000          ?        ?   891.3762  17.8786          ?        ?      298.5        3.0       ?       ? 
1 1 1   31   16   43 o    166.6    4.8    0.0000   0.0000          ?        ?   277.7569  15.9630          ?        ?      166.6        4.8       ?       ? 
1 1 1   31   16   44 o    170.2    4.7    0.0000   0.0000          ?        ?   289.8888  15.9630          ?        ?      170.2        4.7       ?       ? 
1 1 1   31   16   45 o    474.9    2.6    0.0000   0.0000          ?        ?  2255.8967  24.2638          ?        ?      474.9        2.6       ?       ? 
1 1 1   31   16   46 o    170.9    4.9    0.0000   0.0000          ?        ?   292.4429  16.6016          ?        ?      170.9        4.9       ?       ? 
1 1 1   31   16   47 o    186.4    4.8    0.0000   0.0000          ?        ?   347.9943  17.8786          ?        ?      186.4        4.8       ?       ? 
1 1 1   31   16   48 o    136.4    6.3    0.0000   0.0000          ?        ?   186.4483  17.2401          ?        ?      136.4        6.3       ?       ? 
1 1 1   31   16   49 o     85.0   10.1    0.0000   0.0000          ?        ?    72.7915  17.2401          ?        ?       85.0       10.1       ?       ? 
1 1 1   31   16   50 o     43.6   15.8    0.0000   0.0000          ?        ?    15.9630  17.8786          ?        ?       43.6       15.8       ?       ? 
1 1 1   31   16   51 o    454.6    2.8    0.0000   0.0000          ?        ?  2068.1716  25.5409          ?        ?      454.6        2.8       ?       ? 
1 1 1   31   16   52 o    218.4    4.4    0.0000   0.0000          ?        ?   477.6142  19.1556          ?        ?      218.4        4.4       ?       ? 
1 1 1   31   16   53 o    430.5    2.9    0.0000   0.0000          ?        ?  1854.2667  24.9023          ?        ?      430.5        2.9       ?       ? 
1 1 1   31   16   54 o     64.5   14.7    0.0000   0.0000          ?        ?    44.0580  18.5171          ?        ?       64.5       14.7       ?       ? 
1 1 1   31   16   55 o     96.5    9.6    0.0000   0.0000          ?        ?    93.8627  18.5171          ?        ?       96.5        9.6       ?       ? 
1 1 1   31   16   56 o    216.0    4.4    0.0000   0.0000          ?        ?   467.3978  19.1556          ?        ?      216.0        4.4       ?       ? 
1 1 1   31   16   57 f    150.7    6.4    0.0000   0.0000          ?        ?   227.9522  19.1556          ?        ?      150.7        6.4       ?       ? 
1 1 1   31   16   58 o    230.7    4.3    0.0000   0.0000          ?        ?   533.1656  19.7942          ?        ?      230.7        4.3       ?       ? 
1 1 1   31   16   59 o    180.3    5.7    0.0000   0.0000          ?        ?   326.2845  20.4327          ?        ?      180.3        5.7       ?       ? 
1 1 1   31   16   60 o    257.3    4.0    0.0000   0.0000          ?        ?   663.4240  20.4327          ?        ?      257.3        4.0       ?       ? 
1 1 1   31   16   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   16   62 o     19.7   10.0    0.0000   0.0000          ?        ?   -68.9603  19.7942          ?        ?       19.7       10.0       ?       ? 
1 1 1   31   16   63 o    217.3    4.6    0.0000   0.0000          ?        ?   473.7830  19.7942          ?        ?      217.3        4.6       ?       ? 
1 1 1   31   16   64 o    166.3    5.6    0.0000   0.0000          ?        ?   278.3954  18.5171          ?        ?      166.3        5.6       ?       ? 
1 1 1   31   17    0 o    229.4    4.3  526.7803  19.7942   526.7803  19.7942   526.7803  19.7942      229.4      4.3      229.4        4.3     0.0     0.0 
1 1 1   31   17    1 f    461.6    2.8    0.0000   0.0000          ?        ?  2130.7468  25.5409          ?        ?      461.6        2.8       ?       ? 
1 1 1   31   17    2 o    953.4    3.9    0.0000   0.0000          ?        ?  9090.6318  74.7070          ?        ?      953.4        3.9       ?       ? 
1 1 1   31   17    3 o    745.9    3.3    0.0000   0.0000          ?        ?  5564.7158  49.1662          ?        ?      745.9        3.3       ?       ? 
1 1 1   31   17    4 o    808.4    3.5    0.0000   0.0000          ?        ?  6535.9072  56.1899          ?        ?      808.4        3.5       ?       ? 
1 1 1   31   17    5 o     68.7    9.3    0.0000   0.0000          ?        ?    47.2506  12.7704          ?        ?       68.7        9.3       ?       ? 
1 1 1   31   17    6 o    624.7    2.9    0.0000   0.0000          ?        ?  3903.2827  35.7572          ?        ?      624.7        2.9       ?       ? 
1 1 1   31   17    7 o    397.7    2.2    0.0000   0.0000          ?        ?  1581.6180  17.8786          ?        ?      397.7        2.2       ?       ? 
1 1 1   31   17    8 f    459.3    2.5    0.0000   0.0000          ?        ?  2109.6753  22.9868          ?        ?      459.3        2.5       ?       ? 
1 1 1   31   17    9 o     84.9    6.0    0.0000   0.0000          ?        ?    72.1529  10.2163          ?        ?       84.9        6.0       ?       ? 
1 1 1   31   17   10 o    273.9    2.6    0.0000   0.0000          ?        ?   750.2629  14.0475          ?        ?      273.9        2.6       ?       ? 
1 1 1   31   17   11 o    594.5    2.5    0.0000   0.0000          ?        ?  3534.2173  30.0105          ?        ?      594.5        2.5       ?       ? 
1 1 1   31   17   12 f    490.0    2.3    0.0000   0.0000          ?        ?  2400.8413  22.9868          ?        ?      490.0        2.3       ?       ? 
1 1 1   31   17   13 o    210.5    2.7    0.0000   0.0000          ?        ?   443.1340  11.4934          ?        ?      210.5        2.7       ?       ? 
1 1 1   31   17   14 o    201.5    2.7    0.0000   0.0000          ?        ?   406.0997  10.8549          ?        ?      201.5        2.7       ?       ? 
1 1 1   31   17   15 o    604.4    2.7    0.0000   0.0000          ?        ?  3653.6208  32.5646          ?        ?      604.4        2.7       ?       ? 
1 1 1   31   17   16 o    229.9    3.5    0.0000   0.0000          ?        ?   528.6959  15.9630          ?        ?      229.9        3.5       ?       ? 
1 1 1   31   17   17 o    745.7    3.1    0.0000   0.0000          ?        ?  5560.8848  46.6121          ?        ?      745.7        3.1       ?       ? 
1 1 1   31   17   18 o    326.9    2.5    0.0000   0.0000          ?        ?  1068.8851  16.6016          ?        ?      326.9        2.5       ?       ? 
1 1 1   31   17   19 o    635.6    2.7    0.0000   0.0000          ?        ?  4039.9265  33.8416          ?        ?      635.6        2.7       ?       ? 
1 1 1   31   17   20 f    166.8    3.6    0.0000   0.0000          ?        ?   278.3954  12.1319          ?        ?      166.8        3.6       ?       ? 
1 1 1   31   17   21 o    410.6    2.4    0.0000   0.0000          ?        ?  1686.3357  19.7942          ?        ?      410.6        2.4       ?       ? 
1 1 1   31   17   22 f     15.9    8.0    0.0000   0.0000          ?        ?   -40.2269  12.1319          ?        ?       15.9        8.0       ?       ? 
1 1 1   31   17   23 o    429.0    2.4    0.0000   0.0000          ?        ?  1840.8578  20.4327          ?        ?      429.0        2.4       ?       ? 
1 1 1   31   17   24 o    448.6    2.4    0.0000   0.0000          ?        ?  2012.6202  21.7097          ?        ?      448.6        2.4       ?       ? 
1 1 1   31   17   25 o    706.4    2.8    0.0000   0.0000          ?        ?  4991.3237  40.2269          ?        ?      706.4        2.8       ?       ? 
1 1 1   31   17   26 o    693.2    2.9    0.0000   0.0000          ?        ?  4806.7905  40.2269          ?        ?      693.2        2.9       ?       ? 
1 1 1   31   17   27 o    939.4    3.6    0.0000   0.0000          ?        ?  8827.5615  67.0448          ?        ?      939.4        3.6       ?       ? 
1 1 1   31   17   28 o    272.8    2.8    0.0000   0.0000          ?        ?   744.5162  15.3245          ?        ?      272.8        2.8       ?       ? 
1 1 1   31   17   29 o    112.9    5.9    0.0000   0.0000          ?        ?   127.7043  13.4090          ?        ?      112.9        5.9       ?       ? 
1 1 1   31   17   30 o    220.5    3.2    0.0000   0.0000          ?        ?   486.5535  14.0475          ?        ?      220.5        3.2       ?       ? 
1 1 1   31   17   31 o    343.0    2.4    0.0000   0.0000          ?        ?  1176.7954  16.6016          ?        ?      343.0        2.4       ?       ? 
1 1 1   31   17   32 o    574.2    2.7    0.0000   0.0000          ?        ?  3297.9641  30.6490          ?        ?      574.2        2.7       ?       ? 
1 1 1   31   17   33 o    543.3    2.7    0.0000   0.0000          ?        ?  2952.5239  29.3720          ?        ?      543.3        2.7       ?       ? 
1 1 1   31   17   34 o    552.9    2.6    0.0000   0.0000          ?        ?  3057.8801  28.7335          ?        ?      552.9        2.6       ?       ? 
1 1 1   31   17   35 o    132.7    6.5    0.0000   0.0000          ?        ?   176.2320  17.2401          ?        ?      132.7        6.5       ?       ? 
1 1 1   31   17   36 o    254.5    3.3    0.0000   0.0000          ?        ?   648.0994  16.6016          ?        ?      254.5        3.3       ?       ? 
1 1 1   31   17   37 o    376.6    2.8    0.0000   0.0000          ?        ?  1418.7950  21.0712          ?        ?      376.6        2.8       ?       ? 
1 1 1   31   17   38 o    411.9    2.5    0.0000   0.0000          ?        ?  1697.1904  20.4327          ?        ?      411.9        2.5       ?       ? 
1 1 1   31   17   39 o    271.6    3.2    0.0000   0.0000          ?        ?   738.1310  17.2401          ?        ?      271.6        3.2       ?       ? 
1 1 1   31   17   40 o    206.8    3.7    0.0000   0.0000          ?        ?   427.8095  15.3245          ?        ?      206.8        3.7       ?       ? 
1 1 1   31   17   41 o     36.2   14.5    0.0000   0.0000          ?        ?     6.3852  15.9630          ?        ?       36.2       14.5       ?       ? 
1 1 1   31   17   42 o     51.5   14.7    0.0000   0.0000          ?        ?    27.4564  15.9630          ?        ?       51.5       14.7       ?       ? 
1 1 1   31   17   43 o     70.3   11.4    0.0000   0.0000          ?        ?    49.8047  15.9630          ?        ?       70.3       11.4       ?       ? 
1 1 1   31   17   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   17   45 o    463.8    2.7    0.0000   0.0000          ?        ?  2151.8179  24.9023          ?        ?      463.8        2.7       ?       ? 
1 1 1   31   17   46 o    158.3    5.2    0.0000   0.0000          ?        ?   250.9390  16.6016          ?        ?      158.3        5.2       ?       ? 
1 1 1   31   17   47 o     92.3    8.6    0.0000   0.0000          ?        ?    85.5619  15.9630          ?        ?       92.3        8.6       ?       ? 
1 1 1   31   17   48 o     79.6   10.8    0.0000   0.0000          ?        ?    63.8522  17.2401          ?        ?       79.6       10.8       ?       ? 
1 1 1   31   17   49 o    199.8    4.5    0.0000   0.0000          ?        ?   399.7145  17.8786          ?        ?      199.8        4.5       ?       ? 
1 1 1   31   17   50 o    315.5    3.2    0.0000   0.0000          ?        ?   996.0938  20.4327          ?        ?      315.5        3.2       ?       ? 
1 1 1   31   17   51 o    162.2    5.5    0.0000   0.0000          ?        ?   263.7094  17.8786          ?        ?      162.2        5.5       ?       ? 
1 1 1   31   17   52 f    239.6    4.1    0.0000   0.0000          ?        ?   574.6694  19.7942          ?        ?      239.6        4.1       ?       ? 
1 1 1   31   17   53 o    232.7    4.1    0.0000   0.0000          ?        ?   542.1049  19.1556          ?        ?      232.7        4.1       ?       ? 
1 1 1   31   17   54 o    179.2    5.3    0.0000   0.0000          ?        ?   321.8149  19.1556          ?        ?      179.2        5.3       ?       ? 
1 1 1   31   17   55 o    178.8    5.4    0.0000   0.0000          ?        ?   320.5379  19.1556          ?        ?      178.8        5.4       ?       ? 
1 1 1   31   17   56 o    200.6    4.9    0.0000   0.0000          ?        ?   403.5457  19.7942          ?        ?      200.6        4.9       ?       ? 
1 1 1   31   17   57 o     56.5   15.4    0.0000   0.0000          ?        ?    33.8416  17.8786          ?        ?       56.5       15.4       ?       ? 
1 1 1   31   17   58 o    234.2    4.1    0.0000   0.0000          ?        ?   549.7671  19.1556          ?        ?      234.2        4.1       ?       ? 
1 1 1   31   17   59 o    209.3    4.9    0.0000   0.0000          ?        ?   439.3029  20.4327          ?        ?      209.3        4.9       ?       ? 
1 1 1   31   17   60 o    152.0    6.7    0.0000   0.0000          ?        ?   232.4219  20.4327          ?        ?      152.0        6.7       ?       ? 
1 1 1   31   17   61 o    245.8    4.2    0.0000   0.0000          ?        ?   605.9570  20.4327          ?        ?      245.8        4.2       ?       ? 
1 1 1   31   17   62 o    267.1    3.9    0.0000   0.0000          ?        ?   715.1442  21.0712          ?        ?      267.1        3.9       ?       ? 
1 1 1   31   17   63 o    363.6    3.2    0.0000   0.0000          ?        ?  1324.2938  22.9868          ?        ?      363.6        3.2       ?       ? 
1 1 1   31   17   64 o     19.4    9.8    0.0000   0.0000          ?        ?   -66.4062  19.1556          ?        ?       19.4        9.8       ?       ? 
1 1 1   31   18    0 o    114.5    7.3  132.8125  16.6016   132.8125  16.6016   132.8125  16.6016      114.5      7.3      114.5        7.3     0.0     0.0 
1 1 1   31   18    1 o     46.3   14.7    0.0000   0.0000          ?        ?    21.0712  15.3245          ?        ?       46.3       14.7       ?       ? 
1 1 1   31   18    2 o    450.7    2.7    0.0000   0.0000          ?        ?  2031.7759  24.2638          ?        ?      450.7        2.7       ?       ? 
1 1 1   31   18    3 o    209.3    3.2    0.0000   0.0000          ?        ?   438.0258  13.4090          ?        ?      209.3        3.2       ?       ? 
1 1 1   31   18    4 o    675.6    3.1    0.0000   0.0000          ?        ?  4564.7915  41.5039          ?        ?      675.6        3.1       ?       ? 
1 1 1   31   18    5 o    593.5    2.9    0.0000   0.0000          ?        ?  3522.7239  33.8416          ?        ?      593.5        2.9       ?       ? 
1 1 1   31   18    6 o   1038.9    4.2    0.0000   0.0000          ?        ? 10796.1240  86.8389          ?        ?     1038.9        4.2       ?       ? 
1 1 1   31   18    7 o    763.0    3.3    0.0000   0.0000          ?        ?  5822.0400  49.8047          ?        ?      763.0        3.3       ?       ? 
1 1 1   31   18    8 o    100.4    5.1    0.0000   0.0000          ?        ?   100.8864  10.2163          ?        ?      100.4        5.1       ?       ? 
1 1 1   31   18    9 o    137.2    4.0    0.0000   0.0000          ?        ?   188.3639  10.8549          ?        ?      137.2        4.0       ?       ? 
1 1 1   31   18   10 o    582.6    2.7    0.0000   0.0000          ?        ?  3394.3809  31.2876          ?        ?      582.6        2.7       ?       ? 
1 1 1   31   18   11 o    823.9    3.3    0.0000   0.0000          ?        ?  6788.7617  54.2743          ?        ?      823.9        3.3       ?       ? 
1 1 1   31   18   12 o    608.7    2.5    0.0000   0.0000          ?        ?  3705.9797  30.6490          ?        ?      608.7        2.5       ?       ? 
1 1 1   31   18   13 o    218.7    2.5    0.0000   0.0000          ?        ?   478.2527  10.8549          ?        ?      218.7        2.5       ?       ? 
1 1 1   31   18   14 o    362.3    2.2    0.0000   0.0000          ?        ?  1312.8005  15.9630          ?        ?      362.3        2.2       ?       ? 
1 1 1   31   18   15 o    365.8    2.5    0.0000   0.0000          ?        ?  1338.3413  18.5171          ?        ?      365.8        2.5       ?       ? 
1 1 1   31   18   16 o   1414.3    4.9    0.0000   0.0000          ?        ? 20010.6289 138.5592          ?        ?     1414.3        4.9       ?       ? 
1 1 1   31   18   17 o    193.6    3.6    0.0000   0.0000          ?        ?   374.8122  14.0475          ?        ?      193.6        3.6       ?       ? 
1 1 1   31   18   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   18   19 o    312.3    2.8    0.0000   0.0000          ?        ?   975.6611  17.2401          ?        ?      312.3        2.8       ?       ? 
1 1 1   31   18   20 o    264.8    2.9    0.0000   0.0000          ?        ?   701.0967  15.3245          ?        ?      264.8        2.9       ?       ? 
1 1 1   31   18   21 o    157.6    4.3    0.0000   0.0000          ?        ?   248.3849  13.4090          ?        ?      157.6        4.3       ?       ? 
1 1 1   31   18   22 o    368.9    2.3    0.0000   0.0000          ?        ?  1361.3281  17.2401          ?        ?      368.9        2.3       ?       ? 
1 1 1   31   18   23 o    248.6    2.7    0.0000   0.0000          ?        ?   618.0889  13.4090          ?        ?      248.6        2.7       ?       ? 
1 1 1   31   18   24 o    506.9    2.4    0.0000   0.0000          ?        ?  2570.0496  24.2638          ?        ?      506.9        2.4       ?       ? 
1 1 1   31   18   25 o    483.1    2.4    0.0000   0.0000          ?        ?  2334.4351  23.6253          ?        ?      483.1        2.4       ?       ? 
1 1 1   31   18   26 o    318.8    2.6    0.0000   0.0000          ?        ?  1016.5264  16.6016          ?        ?      318.8        2.6       ?       ? 
1 1 1   31   18   27 o    228.4    3.4    0.0000   0.0000          ?        ?   521.6721  15.3245          ?        ?      228.4        3.4       ?       ? 
1 1 1   31   18   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   18   29 o    287.1    2.7    0.0000   0.0000          ?        ?   824.3315  15.3245          ?        ?      287.1        2.7       ?       ? 
1 1 1   31   18   30 o    231.6    3.3    0.0000   0.0000          ?        ?   536.3582  15.3245          ?        ?      231.6        3.3       ?       ? 
1 1 1   31   18   31 o    126.5    5.3    0.0000   0.0000          ?        ?   160.2689  13.4090          ?        ?      126.5        5.3       ?       ? 
1 1 1   31   18   32 o    324.4    2.7    0.0000   0.0000          ?        ?  1052.9221  17.2401          ?        ?      324.4        2.7       ?       ? 
1 1 1   31   18   33 o    314.7    2.6    0.0000   0.0000          ?        ?   990.3471  16.6016          ?        ?      314.7        2.6       ?       ? 
1 1 1   31   18   34 f    241.0    3.4    0.0000   0.0000          ?        ?   581.0547  16.6016          ?        ?      241.0        3.4       ?       ? 
1 1 1   31   18   35 o    288.0    3.0    0.0000   0.0000          ?        ?   829.4396  17.2401          ?        ?      288.0        3.0       ?       ? 
1 1 1   31   18   36 o    308.4    2.7    0.0000   0.0000          ?        ?   951.3972  16.6016          ?        ?      308.4        2.7       ?       ? 
1 1 1   31   18   37 o    190.5    4.0    0.0000   0.0000          ?        ?   363.3188  15.3245          ?        ?      190.5        4.0       ?       ? 
1 1 1   31   18   38 o    404.2    2.8    0.0000   0.0000          ?        ?  1633.9768  22.3483          ?        ?      404.2        2.8       ?       ? 
1 1 1   31   18   39 o    186.3    4.3    0.0000   0.0000          ?        ?   347.3558  15.9630          ?        ?      186.3        4.3       ?       ? 
1 1 1   31   18   40 o    556.1    2.6    0.0000   0.0000          ?        ?  3093.6372  28.7335          ?        ?      556.1        2.6       ?       ? 
1 1 1   31   18   41 o     82.5    8.9    0.0000   0.0000          ?        ?    68.3218  14.6860          ?        ?       82.5        8.9       ?       ? 
1 1 1   31   18   42 o    117.3    6.8    0.0000   0.0000          ?        ?   137.9207  15.9630          ?        ?      117.3        6.8       ?       ? 
1 1 1   31   18   43 o    124.7    6.4    0.0000   0.0000          ?        ?   155.7993  15.9630          ?        ?      124.7        6.4       ?       ? 
1 1 1   31   18   44 o    397.5    2.7    0.0000   0.0000          ?        ?  1580.9796  21.0712          ?        ?      397.5        2.7       ?       ? 
1 1 1   31   18   45 o    215.2    4.2    0.0000   0.0000          ?        ?   463.5667  17.8786          ?        ?      215.2        4.2       ?       ? 
1 1 1   31   18   46 o    155.4    5.5    0.0000   0.0000          ?        ?   241.9997  17.2401          ?        ?      155.4        5.5       ?       ? 
1 1 1   31   18   47 o    123.1    7.0    0.0000   0.0000          ?        ?   151.9681  17.2401          ?        ?      123.1        7.0       ?       ? 
1 1 1   31   18   48 o    245.4    3.6    0.0000   0.0000          ?        ?   602.7644  17.8786          ?        ?      245.4        3.6       ?       ? 
1 1 1   31   18   49 o    171.0    5.2    0.0000   0.0000          ?        ?   293.0815  17.8786          ?        ?      171.0        5.2       ?       ? 
1 1 1   31   18   50 o    212.9    4.5    0.0000   0.0000          ?        ?   453.9889  19.1556          ?        ?      212.9        4.5       ?       ? 
1 1 1   31   18   51 o     64.5   15.1    0.0000   0.0000          ?        ?    44.0580  19.1556          ?        ?       64.5       15.1       ?       ? 
1 1 1   31   18   52 o    171.7    5.2    0.0000   0.0000          ?        ?   295.6355  17.8786          ?        ?      171.7        5.2       ?       ? 
1 1 1   31   18   53 o    110.4    8.4    0.0000   0.0000          ?        ?   122.5962  18.5171          ?        ?      110.4        8.4       ?       ? 
1 1 1   31   18   54 o    216.4    4.6    0.0000   0.0000          ?        ?   469.3134  19.7942          ?        ?      216.4        4.6       ?       ? 
1 1 1   31   18   55 o    259.5    3.7    0.0000   0.0000          ?        ?   674.2788  19.1556          ?        ?      259.5        3.7       ?       ? 
1 1 1   31   18   56 o    213.4    4.6    0.0000   0.0000          ?        ?   456.5430  19.7942          ?        ?      213.4        4.6       ?       ? 
1 1 1   31   18   57 o     34.9   14.8    0.0000   0.0000          ?        ?     1.2770  17.8786          ?        ?       34.9       14.8       ?       ? 
1 1 1   31   18   58 o     67.9   14.5    0.0000   0.0000          ?        ?    49.1662  19.1556          ?        ?       67.9       14.5       ?       ? 
1 1 1   31   18   59 o    395.1    3.0    0.0000   0.0000          ?        ?  1563.1010  23.6253          ?        ?      395.1        3.0       ?       ? 
1 1 1   31   18   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   18   61 o     84.0   11.4    0.0000   0.0000          ?        ?    72.1529  19.1556          ?        ?       84.0       11.4       ?       ? 
1 1 1   31   18   62 o    224.4    4.6    0.0000   0.0000          ?        ?   505.7091  20.4327          ?        ?      224.4        4.6       ?       ? 
1 1 1   31   18   63 o    124.8    7.7    0.0000   0.0000          ?        ?   157.7148  19.1556          ?        ?      124.8        7.7       ?       ? 
1 1 1   31   19    0 o     15.1   10.9  -24.2638  15.3245   -24.2638  15.3245   -24.2638  15.3245       15.1     10.9       15.1       10.9     0.0     0.0 
1 1 1   31   19    1 f     29.9   11.7    0.0000   0.0000          ?        ?     5.1082  10.2163          ?        ?       29.9       11.7       ?       ? 
1 1 1   31   19    2 o    415.4    2.5    0.0000   0.0000          ?        ?  1725.9238  21.0712          ?        ?      415.4        2.5       ?       ? 
1 1 1   31   19    3 o    683.1    3.0    0.0000   0.0000          ?        ?  4666.3159  41.5039          ?        ?      683.1        3.0       ?       ? 
1 1 1   31   19    4 o    660.2    3.0    0.0000   0.0000          ?        ?  4359.1870  40.2269          ?        ?      660.2        3.0       ?       ? 
1 1 1   31   19    5 o    691.6    3.1    0.0000   0.0000          ?        ?  4783.1655  42.7809          ?        ?      691.6        3.1       ?       ? 
1 1 1   31   19    6 o    666.9    3.2    0.0000   0.0000          ?        ?  4447.9414  42.7809          ?        ?      666.9        3.2       ?       ? 
1 1 1   31   19    7 o    686.6    3.2    0.0000   0.0000          ?        ?  4714.8438  43.4195          ?        ?      686.6        3.2       ?       ? 
1 1 1   31   19    8 o    947.5    3.6    0.0000   0.0000          ?        ?  8980.1680  68.9603          ?        ?      947.5        3.6       ?       ? 
1 1 1   31   19    9 o    625.1    2.7    0.0000   0.0000          ?        ?  3907.7524  33.8416          ?        ?      625.1        2.7       ?       ? 
1 1 1   31   19   10 o    356.5    2.3    0.0000   0.0000          ?        ?  1271.2966  16.6016          ?        ?      356.5        2.3       ?       ? 
1 1 1   31   19   11 o     26.2   11.1    0.0000   0.0000          ?        ?     0.0000  10.2163          ?        ?       26.2       11.1       ?       ? 
1 1 1   31   19   12 o    456.4    2.2    0.0000   0.0000          ?        ?  2082.8577  20.4327          ?        ?      456.4        2.2       ?       ? 
1 1 1   31   19   13 o    494.5    2.3    0.0000   0.0000          ?        ?  2445.5378  22.3483          ?        ?      494.5        2.3       ?       ? 
1 1 1   31   19   14 o    613.4    2.6    0.0000   0.0000          ?        ?  3762.8079  31.9261          ?        ?      613.4        2.6       ?       ? 
1 1 1   31   19   15 o    711.3    2.8    0.0000   0.0000          ?        ?  5060.2837  39.5883          ?        ?      711.3        2.8       ?       ? 
1 1 1   31   19   16 o    437.6    2.6    0.0000   0.0000          ?        ?  1914.9263  22.3483          ?        ?      437.6        2.6       ?       ? 
1 1 1   31   19   17 o    532.1    2.5    0.0000   0.0000          ?        ?  2831.8435  26.8179          ?        ?      532.1        2.5       ?       ? 
1 1 1   31   19   18 o    167.6    3.4    0.0000   0.0000          ?        ?   280.9495  11.4934          ?        ?      167.6        3.4       ?       ? 
1 1 1   31   19   19 o    699.3    2.9    0.0000   0.0000          ?        ?  4891.0757  40.2269          ?        ?      699.3        2.9       ?       ? 
1 1 1   31   19   20 o    686.0    2.9    0.0000   0.0000          ?        ?  4706.5430  39.5883          ?        ?      686.0        2.9       ?       ? 
1 1 1   31   19   21 o     51.3   11.5    0.0000   0.0000          ?        ?    27.4564  11.4934          ?        ?       51.3       11.5       ?       ? 
1 1 1   31   19   22 o    112.4    5.7    0.0000   0.0000          ?        ?   126.4273  12.7704          ?        ?      112.4        5.7       ?       ? 
1 1 1   31   19   23 o    392.5    2.4    0.0000   0.0000          ?        ?  1540.7527  19.1556          ?        ?      392.5        2.4       ?       ? 
1 1 1   31   19   24 o    453.0    2.5    0.0000   0.0000          ?        ?  2052.8469  22.9868          ?        ?      453.0        2.5       ?       ? 
1 1 1   31   19   25 o    552.9    2.5    0.0000   0.0000          ?        ?  3057.2415  28.0950          ?        ?      552.9        2.5       ?       ? 
1 1 1   31   19   26 o    251.1    2.7    0.0000   0.0000          ?        ?   630.8594  13.4090          ?        ?      251.1        2.7       ?       ? 
1 1 1   31   19   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   19   28 o    549.2    2.6    0.0000   0.0000          ?        ?  3017.0146  28.0950          ?        ?      549.2        2.6       ?       ? 
1 1 1   31   19   29 f    216.5    3.2    0.0000   0.0000          ?        ?   468.6749  14.0475          ?        ?      216.5        3.2       ?       ? 
1 1 1   31   19   30 o    344.6    2.6    0.0000   0.0000          ?        ?  1187.6503  17.8786          ?        ?      344.6        2.6       ?       ? 
1 1 1   31   19   31 o    422.5    2.4    0.0000   0.0000          ?        ?  1785.3065  20.4327          ?        ?      422.5        2.4       ?       ? 
1 1 1   31   19   32 o    334.0    2.6    0.0000   0.0000          ?        ?  1116.1359  17.2401          ?        ?      334.0        2.6       ?       ? 
1 1 1   31   19   33 o     22.3   10.7    0.0000   0.0000          ?        ?   -21.0712  14.0475          ?        ?       22.3       10.7       ?       ? 
1 1 1   31   19   34 o    277.2    2.9    0.0000   0.0000          ?        ?   768.7800  15.9630          ?        ?      277.2        2.9       ?       ? 
1 1 1   31   19   35 o    456.1    2.5    0.0000   0.0000          ?        ?  2080.9419  22.9868          ?        ?      456.1        2.5       ?       ? 
1 1 1   31   19   36 o    122.9    6.0    0.0000   0.0000          ?        ?   151.3296  14.6860          ?        ?      122.9        6.0       ?       ? 
1 1 1   31   19   37 o     71.3   10.3    0.0000   0.0000          ?        ?    51.0817  14.6860          ?        ?       71.3       10.3       ?       ? 
1 1 1   31   19   38 o    492.1    2.5    0.0000   0.0000          ?        ?  2422.5510  24.9023          ?        ?      492.1        2.5       ?       ? 
1 1 1   31   19   39 o    525.7    2.6    0.0000   0.0000          ?        ?  2764.1602  26.8179          ?        ?      525.7        2.6       ?       ? 
1 1 1   31   19   40 o    150.6    5.5    0.0000   0.0000          ?        ?   227.3137  16.6016          ?        ?      150.6        5.5       ?       ? 
1 1 1   31   19   41 o    197.3    4.0    0.0000   0.0000          ?        ?   389.4982  15.9630          ?        ?      197.3        4.0       ?       ? 
1 1 1   31   19   42 o    317.9    2.9    0.0000   0.0000          ?        ?  1011.4182  18.5171          ?        ?      317.9        2.9       ?       ? 
1 1 1   31   19   43 o    290.6    3.1    0.0000   0.0000          ?        ?   844.7642  17.8786          ?        ?      290.6        3.1       ?       ? 
1 1 1   31   19   44 o     18.5    9.4    0.0000   0.0000          ?        ?   -55.5514  16.6016          ?        ?       18.5        9.4       ?       ? 
1 1 1   31   19   45 o    193.5    4.5    0.0000   0.0000          ?        ?   374.8122  17.2401          ?        ?      193.5        4.5       ?       ? 
1 1 1   31   19   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   19   47 o    188.8    4.7    0.0000   0.0000          ?        ?   356.9336  17.8786          ?        ?      188.8        4.7       ?       ? 
1 1 1   31   19   48 o    155.6    5.5    0.0000   0.0000          ?        ?   242.6382  17.2401          ?        ?      155.6        5.5       ?       ? 
1 1 1   31   19   49 o     77.9   11.1    0.0000   0.0000          ?        ?    61.2981  17.2401          ?        ?       77.9       11.1       ?       ? 
1 1 1   31   19   50 o    243.5    3.9    0.0000   0.0000          ?        ?   593.8251  19.1556          ?        ?      243.5        3.9       ?       ? 
1 1 1   31   19   51 o     93.8    9.9    0.0000   0.0000          ?        ?    88.7545  18.5171          ?        ?       93.8        9.9       ?       ? 
1 1 1   31   19   52 o    159.8    6.0    0.0000   0.0000          ?        ?   256.0471  19.1556          ?        ?      159.8        6.0       ?       ? 
1 1 1   31   19   53 o    348.0    3.2    0.0000   0.0000          ?        ?  1212.5525  22.3483          ?        ?      348.0        3.2       ?       ? 
1 1 1   31   19   54 o    210.7    4.5    0.0000   0.0000          ?        ?   445.0496  19.1556          ?        ?      210.7        4.5       ?       ? 
1 1 1   31   19   55 o     89.8   10.7    0.0000   0.0000          ?        ?    81.7308  19.1556          ?        ?       89.8       10.7       ?       ? 
1 1 1   31   19   56 o    184.3    5.4    0.0000   0.0000          ?        ?   340.9706  19.7942          ?        ?      184.3        5.4       ?       ? 
1 1 1   31   19   57 o    189.1    5.4    0.0000   0.0000          ?        ?   358.8492  20.4327          ?        ?      189.1        5.4       ?       ? 
1 1 1   31   19   58 o    179.3    5.7    0.0000   0.0000          ?        ?   323.0919  20.4327          ?        ?      179.3        5.7       ?       ? 
1 1 1   31   19   59 o    133.4    7.4    0.0000   0.0000          ?        ?   179.4246  19.7942          ?        ?      133.4        7.4       ?       ? 
1 1 1   31   19   60 o    100.7    9.2    0.0000   0.0000          ?        ?   102.8020  18.5171          ?        ?      100.7        9.2       ?       ? 
1 1 1   31   19   61 o    256.7    4.0    0.0000   0.0000          ?        ?   660.8699  20.4327          ?        ?      256.7        4.0       ?       ? 
1 1 1   31   19   62 o    244.0    4.2    0.0000   0.0000          ?        ?   597.6562  20.4327          ?        ?      244.0        4.2       ?       ? 
1 1 1   31   20    0 o     27.7   15.8   10.2163  13.4090    10.2163  13.4090    10.2163  13.4090       27.7     15.8       27.7       15.8     0.0     0.0 
1 1 1   31   20    1 o    324.0    2.5    0.0000   0.0000          ?        ?  1049.7295  15.9630          ?        ?      324.0        2.5       ?       ? 
1 1 1   31   20    2 o    523.7    2.6    0.0000   0.0000          ?        ?  2743.0889  26.8179          ?        ?      523.7        2.6       ?       ? 
1 1 1   31   20    3 o    469.3    2.8    0.0000   0.0000          ?        ?  2202.8997  26.1794          ?        ?      469.3        2.8       ?       ? 
1 1 1   31   20    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   20    5 o    428.3    2.6    0.0000   0.0000          ?        ?  1834.4725  22.3483          ?        ?      428.3        2.6       ?       ? 
1 1 1   31   20    6 o    673.8    3.1    0.0000   0.0000          ?        ?  4540.5273  42.1424          ?        ?      673.8        3.1       ?       ? 
1 1 1   31   20    7 o    442.1    2.9    0.0000   0.0000          ?        ?  1954.5148  25.5409          ?        ?      442.1        2.9       ?       ? 
1 1 1   31   20    8 o    161.2    3.2    0.0000   0.0000          ?        ?   259.8783  10.2163          ?        ?      161.2        3.2       ?       ? 
1 1 1   31   20    9 o    229.6    2.5    0.0000   0.0000          ?        ?   527.4188  11.4934          ?        ?      229.6        2.5       ?       ? 
1 1 1   31   20   10 o    664.0    2.9    0.0000   0.0000          ?        ?  4409.6304  38.3113          ?        ?      664.0        2.9       ?       ? 
1 1 1   31   20   11 o    155.7    3.5    0.0000   0.0000          ?        ?   242.6382  10.8549          ?        ?      155.7        3.5       ?       ? 
1 1 1   31   20   12 o    453.0    2.5    0.0000   0.0000          ?        ?  2052.2085  22.3483          ?        ?      453.0        2.5       ?       ? 
1 1 1   31   20   13 o    587.0    2.5    0.0000   0.0000          ?        ?  3446.1013  29.3720          ?        ?      587.0        2.5       ?       ? 
1 1 1   31   20   14 o    565.3    2.5    0.0000   0.0000          ?        ?  3195.8008  28.0950          ?        ?      565.3        2.5       ?       ? 
1 1 1   31   20   15 o    104.5    4.3    0.0000   0.0000          ?        ?   109.1872   8.9393          ?        ?      104.5        4.3       ?       ? 
1 1 1   31   20   16 o    440.9    2.3    0.0000   0.0000          ?        ?  1944.2983  20.4327          ?        ?      440.9        2.3       ?       ? 
1 1 1   31   20   17 o    467.5    2.5    0.0000   0.0000          ?        ?  2186.2981  23.6253          ?        ?      467.5        2.5       ?       ? 
1 1 1   31   20   18 o     21.5   10.0    0.0000   0.0000          ?        ?    -8.9393  10.2163          ?        ?       21.5       10.0       ?       ? 
1 1 1   31   20   19 o    284.7    2.4    0.0000   0.0000          ?        ?   810.9225  13.4090          ?        ?      284.7        2.4       ?       ? 
1 1 1   31   20   20 f    221.6    2.9    0.0000   0.0000          ?        ?   491.0231  12.7704          ?        ?      221.6        2.9       ?       ? 
1 1 1   31   20   21 o    498.9    2.4    0.0000   0.0000          ?        ?  2489.5957  24.2638          ?        ?      498.9        2.4       ?       ? 
1 1 1   31   20   22 o    412.0    2.4    0.0000   0.0000          ?        ?  1697.8290  19.7942          ?        ?      412.0        2.4       ?       ? 
1 1 1   31   20   23 o     35.6   13.0    0.0000   0.0000          ?        ?    10.2163  12.1319          ?        ?       35.6       13.0       ?       ? 
1 1 1   31   20   24 o    696.2    2.9    0.0000   0.0000          ?        ?  4847.6562  40.2269          ?        ?      696.2        2.9       ?       ? 
1 1 1   31   20   25 o    119.0    5.1    0.0000   0.0000          ?        ?   141.7518  12.1319          ?        ?      119.0        5.1       ?       ? 
1 1 1   31   20   26 o    277.5    2.9    0.0000   0.0000          ?        ?   770.0571  15.9630          ?        ?      277.5        2.9       ?       ? 
1 1 1   31   20   27 o    424.4    2.5    0.0000   0.0000          ?        ?  1801.2695  21.0712          ?        ?      424.4        2.5       ?       ? 
1 1 1   31   20   28 o    151.6    4.6    0.0000   0.0000          ?        ?   229.8678  14.0475          ?        ?      151.6        4.6       ?       ? 
1 1 1   31   20   29 o    402.3    2.5    0.0000   0.0000          ?        ?  1618.6523  19.7942          ?        ?      402.3        2.5       ?       ? 
1 1 1   31   20   30 o    301.1    3.0    0.0000   0.0000          ?        ?   906.7007  17.8786          ?        ?      301.1        3.0       ?       ? 
1 1 1   31   20   31 o     81.8    8.2    0.0000   0.0000          ?        ?    67.0448  13.4090          ?        ?       81.8        8.2       ?       ? 
1 1 1   31   20   32 o    495.2    2.5    0.0000   0.0000          ?        ?  2453.2002  24.9023          ?        ?      495.2        2.5       ?       ? 
1 1 1   31   20   33 f    179.3    4.1    0.0000   0.0000          ?        ?   321.8149  14.6860          ?        ?      179.3        4.1       ?       ? 
1 1 1   31   20   34 o    294.3    2.8    0.0000   0.0000          ?        ?   866.4738  16.6016          ?        ?      294.3        2.8       ?       ? 
1 1 1   31   20   35 f    180.2    3.9    0.0000   0.0000          ?        ?   325.0075  14.0475          ?        ?      180.2        3.9       ?       ? 
1 1 1   31   20   36 o    266.4    3.1    0.0000   0.0000          ?        ?   710.0360  16.6016          ?        ?      266.4        3.1       ?       ? 
1 1 1   31   20   37 o    236.0    3.4    0.0000   0.0000          ?        ?   557.4294  15.9630          ?        ?      236.0        3.4       ?       ? 
1 1 1   31   20   38 o    167.5    4.8    0.0000   0.0000          ?        ?   280.9495  15.9630          ?        ?      167.5        4.8       ?       ? 
1 1 1   31   20   39 o    314.2    2.9    0.0000   0.0000          ?        ?   987.7929  18.5171          ?        ?      314.2        2.9       ?       ? 
1 1 1   31   20   40 o    166.2    4.8    0.0000   0.0000          ?        ?   276.4799  15.9630          ?        ?      166.2        4.8       ?       ? 
1 1 1   31   20   41 o    153.2    5.4    0.0000   0.0000          ?        ?   234.9760  16.6016          ?        ?      153.2        5.4       ?       ? 
1 1 1   31   20   42 o    293.5    3.3    0.0000   0.0000          ?        ?   862.0042  19.1556          ?        ?      293.5        3.3       ?       ? 
1 1 1   31   20   43 o    212.4    4.1    0.0000   0.0000          ?        ?   451.4348  17.2401          ?        ?      212.4        4.1       ?       ? 
1 1 1   31   20   44 o    180.2    4.6    0.0000   0.0000          ?        ?   325.0075  16.6016          ?        ?      180.2        4.6       ?       ? 
1 1 1   31   20   45 f    232.2    3.9    0.0000   0.0000          ?        ?   539.5508  17.8786          ?        ?      232.2        3.9       ?       ? 
1 1 1   31   20   46 o    328.3    2.8    0.0000   0.0000          ?        ?  1078.4630  18.5171          ?        ?      328.3        2.8       ?       ? 
1 1 1   31   20   47 o    337.7    3.0    0.0000   0.0000          ?        ?  1141.0381  20.4327          ?        ?      337.7        3.0       ?       ? 
1 1 1   31   20   48 o    260.1    3.7    0.0000   0.0000          ?        ?   677.4714  19.1556          ?        ?      260.1        3.7       ?       ? 
1 1 1   31   20   49 o    268.5    3.7    0.0000   0.0000          ?        ?   721.5294  19.7942          ?        ?      268.5        3.7       ?       ? 
1 1 1   31   20   50 o    122.2    7.3    0.0000   0.0000          ?        ?   150.0526  17.8786          ?        ?      122.2        7.3       ?       ? 
1 1 1   31   20   51 o    392.4    3.0    0.0000   0.0000          ?        ?  1540.7527  23.6253          ?        ?      392.4        3.0       ?       ? 
1 1 1   31   20   52 o     19.9   10.0    0.0000   0.0000          ?        ?   -63.8522  19.1556          ?        ?       19.9       10.0       ?       ? 
1 1 1   31   20   53 o    190.8    5.2    0.0000   0.0000          ?        ?   365.2344  19.7942          ?        ?      190.8        5.2       ?       ? 
1 1 1   31   20   54 o     37.3   15.5    0.0000   0.0000          ?        ?     3.8311  19.1556          ?        ?       37.3       15.5       ?       ? 
1 1 1   31   20   55 o    321.3    3.3    0.0000   0.0000          ?        ?  1033.7665  21.0712          ?        ?      321.3        3.3       ?       ? 
1 1 1   31   20   56 o    112.5    8.2    0.0000   0.0000          ?        ?   127.7043  18.5171          ?        ?      112.5        8.2       ?       ? 
1 1 1   31   20   57 o    207.0    4.6    0.0000   0.0000          ?        ?   429.7251  19.1556          ?        ?      207.0        4.6       ?       ? 
1 1 1   31   20   58 o    266.6    3.8    0.0000   0.0000          ?        ?   712.5901  20.4327          ?        ?      266.6        3.8       ?       ? 
1 1 1   31   20   59 o    102.9    9.0    0.0000   0.0000          ?        ?   107.2716  18.5171          ?        ?      102.9        9.0       ?       ? 
1 1 1   31   20   60 o     29.8   13.7    0.0000   0.0000          ?        ?   -12.1319  18.5171          ?        ?       29.8       13.7       ?       ? 
1 1 1   31   20   61 o    196.1    4.7    0.0000   0.0000          ?        ?   386.3056  18.5171          ?        ?      196.1        4.7       ?       ? 
1 1 1   31   21    0 o    195.1    7.1  382.4745  27.4564   382.4745  27.4564   382.4745  27.4564      195.1      7.1      195.1        7.1     0.0     0.0 
1 1 1   31   21    1 o    805.5    3.4    0.0000   0.0000          ?        ?  6489.9341  54.9129          ?        ?      805.5        3.4       ?       ? 
1 1 1   31   21    2 o    297.9    2.6    0.0000   0.0000          ?        ?   887.5450  15.3245          ?        ?      297.9        2.6       ?       ? 
1 1 1   31   21    3 o    232.1    2.9    0.0000   0.0000          ?        ?   538.9123  13.4090          ?        ?      232.1        2.9       ?       ? 
1 1 1   31   21    4 o    180.3    3.4    0.0000   0.0000          ?        ?   325.0075  12.1319          ?        ?      180.3        3.4       ?       ? 
1 1 1   31   21    5 o    556.7    2.8    0.0000   0.0000          ?        ?  3099.3840  30.6490          ?        ?      556.7        2.8       ?       ? 
1 1 1   31   21    6 o    539.1    2.9    0.0000   0.0000          ?        ?  2906.5505  31.2876          ?        ?      539.1        2.9       ?       ? 
1 1 1   31   21    7 o    163.9    3.7    0.0000   0.0000          ?        ?   268.8176  12.1319          ?        ?      163.9        3.7       ?       ? 
1 1 1   31   21    8 o    254.6    2.6    0.0000   0.0000          ?        ?   648.0994  13.4090          ?        ?      254.6        2.6       ?       ? 
1 1 1   31   21    9 o    114.7    3.9    0.0000   0.0000          ?        ?   131.5355   8.9393          ?        ?      114.7        3.9       ?       ? 
1 1 1   31   21   10 o    453.5    2.4    0.0000   0.0000          ?        ?  2057.3167  21.7097          ?        ?      453.5        2.4       ?       ? 
1 1 1   31   21   11 o    342.3    2.3    0.0000   0.0000          ?        ?  1171.6871  15.9630          ?        ?      342.3        2.3       ?       ? 
1 1 1   31   21   12 o    365.5    2.4    0.0000   0.0000          ?        ?  1336.4258  17.2401          ?        ?      365.5        2.4       ?       ? 
1 1 1   31   21   13 o    615.4    2.7    0.0000   0.0000          ?        ?  3788.3486  33.2031          ?        ?      615.4        2.7       ?       ? 
1 1 1   31   21   14 o    238.4    2.3    0.0000   0.0000          ?        ?   568.2842  10.8549          ?        ?      238.4        2.3       ?       ? 
1 1 1   31   21   15 o    463.3    2.3    0.0000   0.0000          ?        ?  2146.7097  21.0712          ?        ?      463.3        2.3       ?       ? 
1 1 1   31   21   16 o    326.4    2.3    0.0000   0.0000          ?        ?  1065.6925  15.3245          ?        ?      326.4        2.3       ?       ? 
1 1 1   31   21   17 o    281.8    2.5    0.0000   0.0000          ?        ?   794.3209  14.0475          ?        ?      281.8        2.5       ?       ? 
1 1 1   31   21   18 o    369.0    2.2    0.0000   0.0000          ?        ?  1361.9667  16.6016          ?        ?      369.0        2.2       ?       ? 
1 1 1   31   21   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   21   20 o    381.8    2.3    0.0000   0.0000          ?        ?  1457.7449  17.8786          ?        ?      381.8        2.3       ?       ? 
1 1 1   31   21   21 o    188.7    3.2    0.0000   0.0000          ?        ?   356.2951  12.1319          ?        ?      188.7        3.2       ?       ? 
1 1 1   31   21   22 o    338.0    2.5    0.0000   0.0000          ?        ?  1142.9537  16.6016          ?        ?      338.0        2.5       ?       ? 
1 1 1   31   21   23 o     83.0    8.1    0.0000   0.0000          ?        ?    68.9603  13.4090          ?        ?       83.0        8.1       ?       ? 
1 1 1   31   21   24 o    422.2    2.5    0.0000   0.0000          ?        ?  1782.7524  21.0712          ?        ?      422.2        2.5       ?       ? 
1 1 1   31   21   25 o    475.9    2.4    0.0000   0.0000          ?        ?  2264.8362  22.9868          ?        ?      475.9        2.4       ?       ? 
1 1 1   31   21   26 f    516.0    2.5    0.0000   0.0000          ?        ?  2663.2737  25.5409          ?        ?      516.0        2.5       ?       ? 
1 1 1   31   21   27 o    281.6    2.7    0.0000   0.0000          ?        ?   793.0438  15.3245          ?        ?      281.6        2.7       ?       ? 
1 1 1   31   21   28 o    241.1    3.0    0.0000   0.0000          ?        ?   581.6932  14.6860          ?        ?      241.1        3.0       ?       ? 
1 1 1   31   21   29 o    614.5    2.7    0.0000   0.0000          ?        ?  3776.8555  33.2031          ?        ?      614.5        2.7       ?       ? 
1 1 1   31   21   30 o     95.5    7.4    0.0000   0.0000          ?        ?    91.3086  14.0475          ?        ?       95.5        7.4       ?       ? 
1 1 1   31   21   31 o    522.0    2.5    0.0000   0.0000          ?        ?  2725.2102  26.1794          ?        ?      522.0        2.5       ?       ? 
1 1 1   31   21   32 o    310.2    2.8    0.0000   0.0000          ?        ?   962.2521  17.2401          ?        ?      310.2        2.8       ?       ? 
1 1 1   31   21   33 o    235.2    3.3    0.0000   0.0000          ?        ?   553.5982  15.3245          ?        ?      235.2        3.3       ?       ? 
1 1 1   31   21   34 o    224.7    3.6    0.0000   0.0000          ?        ?   505.0706  15.9630          ?        ?      224.7        3.6       ?       ? 
1 1 1   31   21   35 o    474.3    2.6    0.0000   0.0000          ?        ?  2250.1501  24.2638          ?        ?      474.3        2.6       ?       ? 
1 1 1   31   21   36 f    268.7    3.3    0.0000   0.0000          ?        ?   722.1680  17.8786          ?        ?      268.7        3.3       ?       ? 
1 1 1   31   21   37 o    298.2    2.8    0.0000   0.0000          ?        ?   889.4606  16.6016          ?        ?      298.2        2.8       ?       ? 
1 1 1   31   21   38 o    365.8    2.6    0.0000   0.0000          ?        ?  1338.3413  19.1556          ?        ?      365.8        2.6       ?       ? 
1 1 1   31   21   39 o    152.6    5.0    0.0000   0.0000          ?        ?   233.0604  15.3245          ?        ?      152.6        5.0       ?       ? 
1 1 1   31   21   40 o     48.5   15.3    0.0000   0.0000          ?        ?    23.6253  16.6016          ?        ?       48.5       15.3       ?       ? 
1 1 1   31   21   41 o    402.5    2.8    0.0000   0.0000          ?        ?  1621.2064  22.3483          ?        ?      402.5        2.8       ?       ? 
1 1 1   31   21   42 o    277.4    3.3    0.0000   0.0000          ?        ?   770.0571  18.5171          ?        ?      277.4        3.3       ?       ? 
1 1 1   31   21   43 o    282.8    3.3    0.0000   0.0000          ?        ?   800.0676  18.5171          ?        ?      282.8        3.3       ?       ? 
1 1 1   31   21   44 o     19.7    9.9    0.0000   0.0000          ?        ?   -47.2506  16.6016          ?        ?       19.7        9.9       ?       ? 
1 1 1   31   21   45 o    181.7    4.7    0.0000   0.0000          ?        ?   330.7542  17.2401          ?        ?      181.7        4.7       ?       ? 
1 1 1   31   21   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   21   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   21   48 o    160.8    5.6    0.0000   0.0000          ?        ?   259.2398  17.8786          ?        ?      160.8        5.6       ?       ? 
1 1 1   31   21   49 o    223.3    4.3    0.0000   0.0000          ?        ?   499.3239  19.1556          ?        ?      223.3        4.3       ?       ? 
1 1 1   31   21   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   21   51 o    182.1    5.6    0.0000   0.0000          ?        ?   332.6698  20.4327          ?        ?      182.1        5.6       ?       ? 
1 1 1   31   21   52 o    319.1    3.3    0.0000   0.0000          ?        ?  1019.7190  21.0712          ?        ?      319.1        3.3       ?       ? 
1 1 1   31   21   53 o    277.6    3.7    0.0000   0.0000          ?        ?   771.9727  20.4327          ?        ?      277.6        3.7       ?       ? 
1 1 1   31   21   54 o    160.5    6.0    0.0000   0.0000          ?        ?   258.6013  19.1556          ?        ?      160.5        6.0       ?       ? 
1 1 1   31   21   55 o     27.9   13.1    0.0000   0.0000          ?        ?   -18.5171  18.5171          ?        ?       27.9       13.1       ?       ? 
1 1 1   31   21   56 o    131.3    7.0    0.0000   0.0000          ?        ?   173.6779  18.5171          ?        ?      131.3        7.0       ?       ? 
1 1 1   31   21   57 o     20.0   10.1    0.0000   0.0000          ?        ?   -62.5751  19.1556          ?        ?       20.0       10.1       ?       ? 
1 1 1   31   21   58 o    283.7    3.5    0.0000   0.0000          ?        ?   806.4528  19.7942          ?        ?      283.7        3.5       ?       ? 
1 1 1   31   21   59 o     68.6   14.0    0.0000   0.0000          ?        ?    50.4432  18.5171          ?        ?       68.6       14.0       ?       ? 
1 1 1   31   21   60 o    153.1    6.0    0.0000   0.0000          ?        ?   236.2530  18.5171          ?        ?      153.1        6.0       ?       ? 
1 1 1   31   22    0 o    491.3    4.0 2414.8889  38.9498  2414.8889  38.9498  2414.8889  38.9498      491.3      4.0      491.3        4.0     0.0     0.0 
1 1 1   31   22    1 o    217.2    3.1    0.0000   0.0000          ?        ?   471.8675  13.4090          ?        ?      217.2        3.1       ?       ? 
1 1 1   31   22    2 o    279.2    3.1    0.0000   0.0000          ?        ?   779.6349  17.2401          ?        ?      279.2        3.1       ?       ? 
1 1 1   31   22    3 o    317.2    2.7    0.0000   0.0000          ?        ?  1006.3101  17.2401          ?        ?      317.2        2.7       ?       ? 
1 1 1   31   22    4 o    163.5    3.1    0.0000   0.0000          ?        ?   267.5406  10.2163          ?        ?      163.5        3.1       ?       ? 
1 1 1   31   22    5 o    252.4    2.8    0.0000   0.0000          ?        ?   637.2446  14.0475          ?        ?      252.4        2.8       ?       ? 
1 1 1   31   22    6 o    420.1    2.5    0.0000   0.0000          ?        ?  1765.5123  21.0712          ?        ?      420.1        2.5       ?       ? 
1 1 1   31   22    7 o    498.4    2.7    0.0000   0.0000          ?        ?  2484.4878  26.8179          ?        ?      498.4        2.7       ?       ? 
1 1 1   31   22    8 o    405.3    2.5    0.0000   0.0000          ?        ?  1642.9160  20.4327          ?        ?      405.3        2.5       ?       ? 
1 1 1   31   22    9 o     75.3    6.8    0.0000   0.0000          ?        ?    56.8284  10.2163          ?        ?       75.3        6.8       ?       ? 
1 1 1   31   22   10 o    700.8    3.0    0.0000   0.0000          ?        ?  4912.1470  42.1424          ?        ?      700.8        3.0       ?       ? 
1 1 1   31   22   11 o    367.3    2.3    0.0000   0.0000          ?        ?  1349.1962  17.2401          ?        ?      367.3        2.3       ?       ? 
1 1 1   31   22   12 o    403.6    2.4    0.0000   0.0000          ?        ?  1628.8687  19.1556          ?        ?      403.6        2.4       ?       ? 
1 1 1   31   22   13 o    430.0    2.5    0.0000   0.0000          ?        ?  1849.1587  21.0712          ?        ?      430.0        2.5       ?       ? 
1 1 1   31   22   14 o    325.1    2.1    0.0000   0.0000          ?        ?  1056.7533  13.4090          ?        ?      325.1        2.1       ?       ? 
1 1 1   31   22   15 o    394.0    2.2    0.0000   0.0000          ?        ?  1552.8845  17.2401          ?        ?      394.0        2.2       ?       ? 
1 1 1   31   22   16 o    863.3    3.3    0.0000   0.0000          ?        ?  7454.7397  56.8284          ?        ?      863.3        3.3       ?       ? 
1 1 1   31   22   17 o    142.0    4.0    0.0000   0.0000          ?        ?   201.7728  11.4934          ?        ?      142.0        4.0       ?       ? 
1 1 1   31   22   18 o    352.4    2.4    0.0000   0.0000          ?        ?  1241.9246  17.2401          ?        ?      352.4        2.4       ?       ? 
1 1 1   31   22   19 o    630.2    2.7    0.0000   0.0000          ?        ?  3972.2429  33.8416          ?        ?      630.2        2.7       ?       ? 
1 1 1   31   22   20 o    907.5    3.4    0.0000   0.0000          ?        ?  8238.8447  61.9366          ?        ?      907.5        3.4       ?       ? 
1 1 1   31   22   21 o    665.0    2.8    0.0000   0.0000          ?        ?  4423.0396  37.6728          ?        ?      665.0        2.8       ?       ? 
1 1 1   31   22   22 o    102.6    5.6    0.0000   0.0000          ?        ?   105.3561  11.4934          ?        ?      102.6        5.6       ?       ? 
1 1 1   31   22   23 o    205.9    3.3    0.0000   0.0000          ?        ?   423.9784  13.4090          ?        ?      205.9        3.3       ?       ? 
1 1 1   31   22   24 o    457.0    2.4    0.0000   0.0000          ?        ?  2088.6042  22.3483          ?        ?      457.0        2.4       ?       ? 
1 1 1   31   22   25 o    144.0    4.4    0.0000   0.0000          ?        ?   207.5195  12.7704          ?        ?      144.0        4.4       ?       ? 
1 1 1   31   22   26 o    136.0    4.7    0.0000   0.0000          ?        ?   185.1713  12.7704          ?        ?      136.0        4.7       ?       ? 
1 1 1   31   22   27 o    412.9    2.5    0.0000   0.0000          ?        ?  1705.4913  20.4327          ?        ?      412.9        2.5       ?       ? 
1 1 1   31   22   28 o    244.3    3.0    0.0000   0.0000          ?        ?   597.0177  14.6860          ?        ?      244.3        3.0       ?       ? 
1 1 1   31   22   29 o    595.2    2.7    0.0000   0.0000          ?        ?  3543.1567  31.9261          ?        ?      595.2        2.7       ?       ? 
1 1 1   31   22   30 o    240.2    3.2    0.0000   0.0000          ?        ?   577.2236  15.3245          ?        ?      240.2        3.2       ?       ? 
1 1 1   31   22   31 o    320.1    2.7    0.0000   0.0000          ?        ?  1024.8273  17.2401          ?        ?      320.1        2.7       ?       ? 
1 1 1   31   22   32 f    413.1    2.5    0.0000   0.0000          ?        ?  1706.7682  20.4327          ?        ?      413.1        2.5       ?       ? 
1 1 1   31   22   33 o     18.6    9.3    0.0000   0.0000          ?        ?   -37.6728  14.0475          ?        ?       18.6        9.3       ?       ? 
1 1 1   31   22   34 o    454.6    2.5    0.0000   0.0000          ?        ?  2067.5330  22.9868          ?        ?      454.6        2.5       ?       ? 
1 1 1   31   22   35 o    184.9    4.3    0.0000   0.0000          ?        ?   342.2476  15.9630          ?        ?      184.9        4.3       ?       ? 
1 1 1   31   22   36 o    316.2    2.9    0.0000   0.0000          ?        ?  1000.5634  18.5171          ?        ?      316.2        2.9       ?       ? 
1 1 1   31   22   37 o    112.6    7.1    0.0000   0.0000          ?        ?   127.0658  15.9630          ?        ?      112.6        7.1       ?       ? 
1 1 1   31   22   38 o    222.2    3.9    0.0000   0.0000          ?        ?   494.2158  17.2401          ?        ?      222.2        3.9       ?       ? 
1 1 1   31   22   39 o     76.8   10.4    0.0000   0.0000          ?        ?    59.3825  15.9630          ?        ?       76.8       10.4       ?       ? 
1 1 1   31   22   40 o    179.8    4.8    0.0000   0.0000          ?        ?   323.7305  17.2401          ?        ?      179.8        4.8       ?       ? 
1 1 1   31   22   41 o    263.2    3.4    0.0000   0.0000          ?        ?   693.4344  17.8786          ?        ?      263.2        3.4       ?       ? 
1 1 1   31   22   42 f    116.2    6.9    0.0000   0.0000          ?        ?   135.3666  15.9630          ?        ?      116.2        6.9       ?       ? 
1 1 1   31   22   43 o    468.7    2.7    0.0000   0.0000          ?        ?  2197.7915  24.9023          ?        ?      468.7        2.7       ?       ? 
1 1 1   31   22   44 o    168.8    5.1    0.0000   0.0000          ?        ?   285.4192  17.2401          ?        ?      168.8        5.1       ?       ? 
1 1 1   31   22   45 o    249.6    3.7    0.0000   0.0000          ?        ?   623.8356  18.5171          ?        ?      249.6        3.7       ?       ? 
1 1 1   31   22   46 o    179.6    5.2    0.0000   0.0000          ?        ?   323.0919  18.5171          ?        ?      179.6        5.2       ?       ? 
1 1 1   31   22   47 o    207.9    4.3    0.0000   0.0000          ?        ?   432.9177  17.8786          ?        ?      207.9        4.3       ?       ? 
1 1 1   31   22   48 o     25.9   12.3    0.0000   0.0000          ?        ?   -21.0712  17.2401          ?        ?       25.9       12.3       ?       ? 
1 1 1   31   22   49 o    235.0    4.2    0.0000   0.0000          ?        ?   552.9597  19.7942          ?        ?      235.0        4.2       ?       ? 
1 1 1   31   22   50 o    156.3    5.7    0.0000   0.0000          ?        ?   245.1923  17.8786          ?        ?      156.3        5.7       ?       ? 
1 1 1   31   22   51 o    387.6    3.0    0.0000   0.0000          ?        ?  1503.7184  22.9868          ?        ?      387.6        3.0       ?       ? 
1 1 1   31   22   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   22   53 o    405.9    3.0    0.0000   0.0000          ?        ?  1649.3013  24.2638          ?        ?      405.9        3.0       ?       ? 
1 1 1   31   22   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   22   55 f     56.4   16.2    0.0000   0.0000          ?        ?    33.8416  19.1556          ?        ?       56.4       16.2       ?       ? 
1 1 1   31   22   56 o     79.5   11.6    0.0000   0.0000          ?        ?    64.4907  18.5171          ?        ?       79.5       11.6       ?       ? 
1 1 1   31   22   57 o    245.0    4.2    0.0000   0.0000          ?        ?   602.1259  20.4327          ?        ?      245.0        4.2       ?       ? 
1 1 1   31   22   58 o    334.8    3.3    0.0000   0.0000          ?        ?  1123.1595  22.3483          ?        ?      334.8        3.3       ?       ? 
1 1 1   31   22   59 o     20.7   10.4    0.0000   0.0000          ?        ?   -65.7677  20.4327          ?        ?       20.7       10.4       ?       ? 
1 1 1   31   23    0 o    288.3    7.1  833.2708  40.8654   833.2708  40.8654   833.2708  40.8654      288.3      7.1      288.3        7.1     0.0     0.0 
1 1 1   31   23    1 o    897.0    4.0    0.0000   0.0000          ?        ?  8049.2036  70.8759          ?        ?      897.0        4.0       ?       ? 
1 1 1   31   23    2 o    390.0    3.2    0.0000   0.0000          ?        ?  1521.5970  24.9023          ?        ?      390.0        3.2       ?       ? 
1 1 1   31   23    3 o    647.0    3.3    0.0000   0.0000          ?        ?  4187.4248  42.1424          ?        ?      647.0        3.3       ?       ? 
1 1 1   31   23    4 o    193.9    3.5    0.0000   0.0000          ?        ?   376.0892  13.4090          ?        ?      193.9        3.5       ?       ? 
1 1 1   31   23    5 o    235.0    3.1    0.0000   0.0000          ?        ?   552.3212  14.6860          ?        ?      235.0        3.1       ?       ? 
1 1 1   31   23    6 o    358.2    4.4    0.0000   0.0000          ?        ?  1284.0670  31.2876          ?        ?      358.2        4.4       ?       ? 
1 1 1   31   23    7 o   1074.0    4.5    0.0000   0.0000          ?        ? 11540.0020  95.7782          ?        ?     1074.0        4.5       ?       ? 
1 1 1   31   23    8 o    334.1    2.7    0.0000   0.0000          ?        ?  1116.1359  17.8786          ?        ?      334.1        2.7       ?       ? 
1 1 1   31   23    9 o    334.4    2.4    0.0000   0.0000          ?        ?  1118.6898  15.9630          ?        ?      334.4        2.4       ?       ? 
1 1 1   31   23   10 o    279.1    2.3    0.0000   0.0000          ?        ?   778.9964  12.7704          ?        ?      279.1        2.3       ?       ? 
1 1 1   31   23   11 o    276.9    2.3    0.0000   0.0000          ?        ?   766.8644  12.7704          ?        ?      276.9        2.3       ?       ? 
1 1 1   31   23   12 o    199.1    2.9    0.0000   0.0000          ?        ?   396.5219  11.4934          ?        ?      199.1        2.9       ?       ? 
1 1 1   31   23   13 o    222.9    2.9    0.0000   0.0000          ?        ?   496.7698  12.7704          ?        ?      222.9        2.9       ?       ? 
1 1 1   31   23   14 o    126.3    3.0    0.0000   0.0000          ?        ?   159.6304   7.6623          ?        ?      126.3        3.0       ?       ? 
1 1 1   31   23   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   23   16 f    287.1    2.3    0.0000   0.0000          ?        ?   824.3315  13.4090          ?        ?      287.1        2.3       ?       ? 
1 1 1   31   23   17 o    387.6    2.5    0.0000   0.0000          ?        ?  1502.4414  19.1556          ?        ?      387.6        2.5       ?       ? 
1 1 1   31   23   18 o    364.8    2.4    0.0000   0.0000          ?        ?  1331.3176  17.2401          ?        ?      364.8        2.4       ?       ? 
1 1 1   31   23   19 o    228.7    2.7    0.0000   0.0000          ?        ?   522.9492  12.1319          ?        ?      228.7        2.7       ?       ? 
1 1 1   31   23   20 o    505.8    2.5    0.0000   0.0000          ?        ?  2559.1946  24.9023          ?        ?      505.8        2.5       ?       ? 
1 1 1   31   23   21 o    114.1    5.0    0.0000   0.0000          ?        ?   130.2584  11.4934          ?        ?      114.1        5.0       ?       ? 
1 1 1   31   23   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   23   23 o    111.0    5.5    0.0000   0.0000          ?        ?   123.2347  12.1319          ?        ?      111.0        5.5       ?       ? 
1 1 1   31   23   24 f    557.7    2.6    0.0000   0.0000          ?        ?  3110.8774  28.7335          ?        ?      557.7        2.6       ?       ? 
1 1 1   31   23   25 o    519.8    2.5    0.0000   0.0000          ?        ?  2702.2236  26.1794          ?        ?      519.8        2.5       ?       ? 
1 1 1   31   23   26 o     35.6   13.0    0.0000   0.0000          ?        ?    10.2163  12.1319          ?        ?       35.6       13.0       ?       ? 
1 1 1   31   23   27 o     70.5    8.6    0.0000   0.0000          ?        ?    49.8047  12.1319          ?        ?       70.5        8.6       ?       ? 
1 1 1   31   23   28 o    236.3    2.8    0.0000   0.0000          ?        ?   558.7064  13.4090          ?        ?      236.3        2.8       ?       ? 
1 1 1   31   23   29 o    348.4    2.4    0.0000   0.0000          ?        ?  1214.4681  16.6016          ?        ?      348.4        2.4       ?       ? 
1 1 1   31   23   30 o    308.1    2.7    0.0000   0.0000          ?        ?   949.4816  16.6016          ?        ?      308.1        2.7       ?       ? 
1 1 1   31   23   31 f    368.4    2.5    0.0000   0.0000          ?        ?  1357.4971  18.5171          ?        ?      368.4        2.5       ?       ? 
1 1 1   31   23   32 o    178.3    3.9    0.0000   0.0000          ?        ?   317.9838  14.0475          ?        ?      178.3        3.9       ?       ? 
1 1 1   31   23   33 o    188.0    3.9    0.0000   0.0000          ?        ?   353.7410  14.6860          ?        ?      188.0        3.9       ?       ? 
1 1 1   31   23   34 f    183.2    4.0    0.0000   0.0000          ?        ?   335.8624  14.6860          ?        ?      183.2        4.0       ?       ? 
1 1 1   31   23   35 o    376.7    2.5    0.0000   0.0000          ?        ?  1419.4336  19.1556          ?        ?      376.7        2.5       ?       ? 
1 1 1   31   23   36 o    480.0    2.7    0.0000   0.0000          ?        ?  2305.0630  25.5409          ?        ?      480.0        2.7       ?       ? 
1 1 1   31   23   37 o    342.1    2.7    0.0000   0.0000          ?        ?  1171.0486  18.5171          ?        ?      342.1        2.7       ?       ? 
1 1 1   31   23   38 o    144.4    5.5    0.0000   0.0000          ?        ?   208.7966  15.9630          ?        ?      144.4        5.5       ?       ? 
1 1 1   31   23   39 o    353.9    2.8    0.0000   0.0000          ?        ?  1252.7794  19.7942          ?        ?      353.9        2.8       ?       ? 
1 1 1   31   23   40 o    264.1    3.4    0.0000   0.0000          ?        ?   697.9042  17.8786          ?        ?      264.1        3.4       ?       ? 
1 1 1   31   23   41 o    256.2    3.6    0.0000   0.0000          ?        ?   657.0388  18.5171          ?        ?      256.2        3.6       ?       ? 
1 1 1   31   23   42 o    245.5    3.6    0.0000   0.0000          ?        ?   603.4030  17.8786          ?        ?      245.5        3.6       ?       ? 
1 1 1   31   23   43 o    115.6    7.5    0.0000   0.0000          ?        ?   134.0895  17.2401          ?        ?      115.6        7.5       ?       ? 
1 1 1   31   23   44 o    333.3    3.1    0.0000   0.0000          ?        ?  1111.6661  20.4327          ?        ?      333.3        3.1       ?       ? 
1 1 1   31   23   45 o    177.2    5.2    0.0000   0.0000          ?        ?   314.7912  18.5171          ?        ?      177.2        5.2       ?       ? 
1 1 1   31   23   46 o    168.7    5.3    0.0000   0.0000          ?        ?   285.4192  17.8786          ?        ?      168.7        5.3       ?       ? 
1 1 1   31   23   47 f    211.7    4.2    0.0000   0.0000          ?        ?   448.8807  17.8786          ?        ?      211.7        4.2       ?       ? 
1 1 1   31   23   48 o    259.6    3.7    0.0000   0.0000          ?        ?   674.9174  19.1556          ?        ?      259.6        3.7       ?       ? 
1 1 1   31   23   49 o    230.3    4.3    0.0000   0.0000          ?        ?   531.2500  19.7942          ?        ?      230.3        4.3       ?       ? 
1 1 1   31   23   50 o    136.7    6.5    0.0000   0.0000          ?        ?   187.7254  17.8786          ?        ?      136.7        6.5       ?       ? 
1 1 1   31   23   51 o     47.8   15.9    0.0000   0.0000          ?        ?    22.3483  17.8786          ?        ?       47.8       15.9       ?       ? 
1 1 1   31   23   52 o     22.3   11.0    0.0000   0.0000          ?        ?   -39.5883  17.8786          ?        ?       22.3       11.0       ?       ? 
1 1 1   31   23   53 o     19.3    9.7    0.0000   0.0000          ?        ?   -58.7440  17.8786          ?        ?       19.3        9.7       ?       ? 
1 1 1   31   23   54 o    267.0    3.8    0.0000   0.0000          ?        ?   714.5057  20.4327          ?        ?      267.0        3.8       ?       ? 
1 1 1   31   23   55 f    262.7    3.8    0.0000   0.0000          ?        ?   691.5189  19.7942          ?        ?      262.7        3.8       ?       ? 
1 1 1   31   23   56 o     54.6   15.6    0.0000   0.0000          ?        ?    31.9261  17.8786          ?        ?       54.6       15.6       ?       ? 
1 1 1   31   23   57 o    101.3    8.8    0.0000   0.0000          ?        ?   104.0790  17.8786          ?        ?      101.3        8.8       ?       ? 
1 1 1   31   23   58 o    158.3    5.6    0.0000   0.0000          ?        ?   252.2160  17.8786          ?        ?      158.3        5.6       ?       ? 
1 1 1   31   24    0 o    329.3    5.8 1086.1254  38.3113  1086.1254  38.3113  1086.1254  38.3113      329.3      5.8      329.3        5.8     0.0     0.0 
1 1 1   31   24    1 o    840.1    4.0    0.0000   0.0000          ?        ?  7060.7725  67.0448          ?        ?      840.1        4.0       ?       ? 
1 1 1   31   24    2 o    312.5    3.0    0.0000   0.0000          ?        ?   976.9381  18.5171          ?        ?      312.5        3.0       ?       ? 
1 1 1   31   24    3 o    104.4    6.4    0.0000   0.0000          ?        ?   109.1872  13.4090          ?        ?      104.4        6.4       ?       ? 
1 1 1   31   24    4 o     35.2   13.3    0.0000   0.0000          ?        ?     8.9393  12.7704          ?        ?       35.2       13.3       ?       ? 
1 1 1   31   24    5 o    407.6    2.7    0.0000   0.0000          ?        ?  1661.4333  22.3483          ?        ?      407.6        2.7       ?       ? 
1 1 1   31   24    6 o    334.0    2.9    0.0000   0.0000          ?        ?  1116.1359  19.1556          ?        ?      334.0        2.9       ?       ? 
1 1 1   31   24    7 o    411.3    2.8    0.0000   0.0000          ?        ?  1692.0823  22.9868          ?        ?      411.3        2.8       ?       ? 
1 1 1   31   24    8 o    234.2    3.3    0.0000   0.0000          ?        ?   548.4901  15.3245          ?        ?      234.2        3.3       ?       ? 
1 1 1   31   24    9 o    497.5    2.5    0.0000   0.0000          ?        ?  2475.5483  24.9023          ?        ?      497.5        2.5       ?       ? 
1 1 1   31   24   10 o    165.1    2.7    0.0000   0.0000          ?        ?   272.6487   8.9393          ?        ?      165.1        2.7       ?       ? 
1 1 1   31   24   11 o    334.8    2.3    0.0000   0.0000          ?        ?  1121.2440  15.3245          ?        ?      334.8        2.3       ?       ? 
1 1 1   31   24   12 o    308.6    2.4    0.0000   0.0000          ?        ?   952.6743  14.6860          ?        ?      308.6        2.4       ?       ? 
1 1 1   31   24   13 o    360.4    2.4    0.0000   0.0000          ?        ?  1298.7529  17.2401          ?        ?      360.4        2.4       ?       ? 
1 1 1   31   24   14 o    467.5    2.6    0.0000   0.0000          ?        ?  2186.2981  24.2638          ?        ?      467.5        2.6       ?       ? 
1 1 1   31   24   15 o    537.9    2.6    0.0000   0.0000          ?        ?  2894.4185  27.4564          ?        ?      537.9        2.6       ?       ? 
1 1 1   31   24   16 o    549.4    2.5    0.0000   0.0000          ?        ?  3018.9302  27.4564          ?        ?      549.4        2.5       ?       ? 
1 1 1   31   24   17 o    351.7    2.4    0.0000   0.0000          ?        ?  1236.8164  16.6016          ?        ?      351.7        2.4       ?       ? 
1 1 1   31   24   18 o    574.9    2.6    0.0000   0.0000          ?        ?  3305.6265  29.3720          ?        ?      574.9        2.6       ?       ? 
1 1 1   31   24   19 o    168.5    3.4    0.0000   0.0000          ?        ?   284.1421  11.4934          ?        ?      168.5        3.4       ?       ? 
1 1 1   31   24   20 o    477.7    2.5    0.0000   0.0000          ?        ?  2282.7148  23.6253          ?        ?      477.7        2.5       ?       ? 
1 1 1   31   24   21 o    330.7    2.4    0.0000   0.0000          ?        ?  1093.7876  15.9630          ?        ?      330.7        2.4       ?       ? 
1 1 1   31   24   22 o    112.7    5.1    0.0000   0.0000          ?        ?   127.0658  11.4934          ?        ?      112.7        5.1       ?       ? 
1 1 1   31   24   23 o    296.3    2.6    0.0000   0.0000          ?        ?   877.9672  15.3245          ?        ?      296.3        2.6       ?       ? 
1 1 1   31   24   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   24   25 f    276.8    2.9    0.0000   0.0000          ?        ?   766.2260  15.9630          ?        ?      276.8        2.9       ?       ? 
1 1 1   31   24   26 o    128.8    5.2    0.0000   0.0000          ?        ?   166.0156  13.4090          ?        ?      128.8        5.2       ?       ? 
1 1 1   31   24   27 o    312.5    2.6    0.0000   0.0000          ?        ?   976.9381  15.9630          ?        ?      312.5        2.6       ?       ? 
1 1 1   31   24   28 o    336.7    2.6    0.0000   0.0000          ?        ?  1134.0144  17.2401          ?        ?      336.7        2.6       ?       ? 
1 1 1   31   24   29 o    218.8    3.2    0.0000   0.0000          ?        ?   478.8912  14.0475          ?        ?      218.8        3.2       ?       ? 
1 1 1   31   24   30 o    173.2    4.2    0.0000   0.0000          ?        ?   300.1052  14.6860          ?        ?      173.2        4.2       ?       ? 
1 1 1   31   24   31 o    170.4    4.1    0.0000   0.0000          ?        ?   290.5273  14.0475          ?        ?      170.4        4.1       ?       ? 
1 1 1   31   24   32 f    171.1    4.1    0.0000   0.0000          ?        ?   293.0815  14.0475          ?        ?      171.1        4.1       ?       ? 
1 1 1   31   24   33 o    380.7    2.6    0.0000   0.0000          ?        ?  1450.0826  19.7942          ?        ?      380.7        2.6       ?       ? 
1 1 1   31   24   34 o    402.6    2.5    0.0000   0.0000          ?        ?  1621.2064  20.4327          ?        ?      402.6        2.5       ?       ? 
1 1 1   31   24   35 o    197.7    4.0    0.0000   0.0000          ?        ?   391.4138  15.9630          ?        ?      197.7        4.0       ?       ? 
1 1 1   31   24   36 o     30.0   13.3    0.0000   0.0000          ?        ?    -5.7467  15.9630          ?        ?       30.0       13.3       ?       ? 
1 1 1   31   24   37 o     24.0   11.5    0.0000   0.0000          ?        ?   -20.4327  15.3245          ?        ?       24.0       11.5       ?       ? 
1 1 1   31   24   38 o    214.3    4.0    0.0000   0.0000          ?        ?   459.7356  17.2401          ?        ?      214.3        4.0       ?       ? 
1 1 1   31   24   39 o    277.5    3.3    0.0000   0.0000          ?        ?   770.6956  18.5171          ?        ?      277.5        3.3       ?       ? 
1 1 1   31   24   40 o    432.7    2.7    0.0000   0.0000          ?        ?  1872.7838  22.9868          ?        ?      432.7        2.7       ?       ? 
1 1 1   31   24   41 o    102.1    7.8    0.0000   0.0000          ?        ?   104.7175  15.9630          ?        ?      102.1        7.8       ?       ? 
1 1 1   31   24   42 o    306.4    3.1    0.0000   0.0000          ?        ?   939.2654  19.1556          ?        ?      306.4        3.1       ?       ? 
1 1 1   31   24   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   24   44 o    317.2    3.0    0.0000   0.0000          ?        ?  1006.9486  19.1556          ?        ?      317.2        3.0       ?       ? 
1 1 1   31   24   45 o     18.2    9.2    0.0000   0.0000          ?        ?   -57.4669  16.6016          ?        ?       18.2        9.2       ?       ? 
1 1 1   31   24   46 o    110.4    7.8    0.0000   0.0000          ?        ?   122.5962  17.2401          ?        ?      110.4        7.8       ?       ? 
1 1 1   31   24   47 o    107.2    7.7    0.0000   0.0000          ?        ?   115.5724  16.6016          ?        ?      107.2        7.7       ?       ? 
1 1 1   31   24   48 o     59.5   15.0    0.0000   0.0000          ?        ?    37.6728  17.8786          ?        ?       59.5       15.0       ?       ? 
1 1 1   31   24   49 o    123.7    7.2    0.0000   0.0000          ?        ?   153.8837  17.8786          ?        ?      123.7        7.2       ?       ? 
1 1 1   31   24   50 o    244.0    3.9    0.0000   0.0000          ?        ?   596.3792  19.1556          ?        ?      244.0        3.9       ?       ? 
1 1 1   31   24   51 o    234.1    4.2    0.0000   0.0000          ?        ?   549.1286  19.7942          ?        ?      234.1        4.2       ?       ? 
1 1 1   31   24   52 o    321.2    3.4    0.0000   0.0000          ?        ?  1033.1281  21.7097          ?        ?      321.2        3.4       ?       ? 
1 1 1   31   24   53 f    124.0    7.7    0.0000   0.0000          ?        ?   155.1608  19.1556          ?        ?      124.0        7.7       ?       ? 
1 1 1   31   24   54 o    116.9    7.9    0.0000   0.0000          ?        ?   137.9207  18.5171          ?        ?      116.9        7.9       ?       ? 
1 1 1   31   24   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   24   56 o    239.7    4.1    0.0000   0.0000          ?        ?   576.5850  19.7942          ?        ?      239.7        4.1       ?       ? 
1 1 1   31   24   57 o     78.4   11.8    0.0000   0.0000          ?        ?    63.2136  18.5171          ?        ?       78.4       11.8       ?       ? 
1 1 1   31   25    0 o    658.1    4.9 4333.0078  63.8522  4333.0078  63.8522  4333.0078  63.8522      658.1      4.9      658.1        4.9     0.0     0.0 
1 1 1   31   25    1 o    410.4    3.0    0.0000   0.0000          ?        ?  1684.4199  24.9023          ?        ?      410.4        3.0       ?       ? 
1 1 1   31   25    2 o    191.2    4.8    0.0000   0.0000          ?        ?   365.8729  18.5171          ?        ?      191.2        4.8       ?       ? 
1 1 1   31   25    3 o    329.0    3.3    0.0000   0.0000          ?        ?  1082.9327  21.7097          ?        ?      329.0        3.3       ?       ? 
1 1 1   31   25    4 o    419.0    3.0    0.0000   0.0000          ?        ?  1755.9344  24.9023          ?        ?      419.0        3.0       ?       ? 
1 1 1   31   25    5 o    346.2    2.9    0.0000   0.0000          ?        ?  1199.1437  19.7942          ?        ?      346.2        2.9       ?       ? 
1 1 1   31   25    6 o    154.5    3.9    0.0000   0.0000          ?        ?   238.8071  12.1319          ?        ?      154.5        3.9       ?       ? 
1 1 1   31   25    7 o    187.0    3.9    0.0000   0.0000          ?        ?   349.9099  14.6860          ?        ?      187.0        3.9       ?       ? 
1 1 1   31   25    8 o    606.9    3.2    0.0000   0.0000          ?        ?  3684.9082  38.9498          ?        ?      606.9        3.2       ?       ? 
1 1 1   31   25    9 o    266.3    3.0    0.0000   0.0000          ?        ?   709.3975  15.9630          ?        ?      266.3        3.0       ?       ? 
1 1 1   31   25   10 o    204.0    2.2    0.0000   0.0000          ?        ?   416.3161   8.9393          ?        ?      204.0        2.2       ?       ? 
1 1 1   31   25   11 o    561.7    2.6    0.0000   0.0000          ?        ?  3156.2124  28.7335          ?        ?      561.7        2.6       ?       ? 
1 1 1   31   25   12 o    402.6    2.3    0.0000   0.0000          ?        ?  1621.2064  18.5171          ?        ?      402.6        2.3       ?       ? 
1 1 1   31   25   13 o    544.2    2.6    0.0000   0.0000          ?        ?  2962.7402  28.7335          ?        ?      544.2        2.6       ?       ? 
1 1 1   31   25   14 o    274.8    2.7    0.0000   0.0000          ?        ?   755.3711  14.6860          ?        ?      274.8        2.7       ?       ? 
1 1 1   31   25   15 o    248.7    2.2    0.0000   0.0000          ?        ?   618.7275  10.8549          ?        ?      248.7        2.2       ?       ? 
1 1 1   31   25   16 o    433.7    2.3    0.0000   0.0000          ?        ?  1881.0847  19.7942          ?        ?      433.7        2.3       ?       ? 
1 1 1   31   25   17 o    495.6    2.3    0.0000   0.0000          ?        ?  2456.3928  22.9868          ?        ?      495.6        2.3       ?       ? 
1 1 1   31   25   18 o    222.6    2.7    0.0000   0.0000          ?        ?   495.4928  12.1319          ?        ?      222.6        2.7       ?       ? 
1 1 1   31   25   19 o    289.3    2.3    0.0000   0.0000          ?        ?   837.1019  13.4090          ?        ?      289.3        2.3       ?       ? 
1 1 1   31   25   20 o    235.9    2.7    0.0000   0.0000          ?        ?   556.7908  12.7704          ?        ?      235.9        2.7       ?       ? 
1 1 1   31   25   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   25   22 o    445.6    2.4    0.0000   0.0000          ?        ?  1985.8022  21.0712          ?        ?      445.6        2.4       ?       ? 
1 1 1   31   25   23 o    221.7    3.0    0.0000   0.0000          ?        ?   491.6617  13.4090          ?        ?      221.7        3.0       ?       ? 
1 1 1   31   25   24 o    400.8    2.5    0.0000   0.0000          ?        ?  1606.5205  19.7942          ?        ?      400.8        2.5       ?       ? 
1 1 1   31   25   25 o    605.6    2.7    0.0000   0.0000          ?        ?  3668.3066  32.5646          ?        ?      605.6        2.7       ?       ? 
1 1 1   31   25   26 o    335.6    2.5    0.0000   0.0000          ?        ?  1126.3521  16.6016          ?        ?      335.6        2.5       ?       ? 
1 1 1   31   25   27 o    170.4    3.7    0.0000   0.0000          ?        ?   290.5273  12.7704          ?        ?      170.4        3.7       ?       ? 
1 1 1   31   25   28 o    331.5    2.5    0.0000   0.0000          ?        ?  1099.5342  16.6016          ?        ?      331.5        2.5       ?       ? 
1 1 1   31   25   29 o    284.9    2.7    0.0000   0.0000          ?        ?   812.1995  15.3245          ?        ?      284.9        2.7       ?       ? 
1 1 1   31   25   30 o    273.3    2.9    0.0000   0.0000          ?        ?   747.0703  15.9630          ?        ?      273.3        2.9       ?       ? 
1 1 1   31   25   31 o    260.5    3.1    0.0000   0.0000          ?        ?   678.7485  15.9630          ?        ?      260.5        3.1       ?       ? 
1 1 1   31   25   32 o    316.9    2.7    0.0000   0.0000          ?        ?  1004.3945  17.2401          ?        ?      316.9        2.7       ?       ? 
1 1 1   31   25   33 o    257.1    3.1    0.0000   0.0000          ?        ?   661.5084  15.9630          ?        ?      257.1        3.1       ?       ? 
1 1 1   31   25   34 o    384.3    2.7    0.0000   0.0000          ?        ?  1477.5391  20.4327          ?        ?      384.3        2.7       ?       ? 
1 1 1   31   25   35 o    188.1    4.2    0.0000   0.0000          ?        ?   354.3795  15.9630          ?        ?      188.1        4.2       ?       ? 
1 1 1   31   25   36 o     56.2   13.3    0.0000   0.0000          ?        ?    33.2031  14.6860          ?        ?       56.2       13.3       ?       ? 
1 1 1   31   25   37 o    137.1    5.6    0.0000   0.0000          ?        ?   188.3639  15.3245          ?        ?      137.1        5.6       ?       ? 
1 1 1   31   25   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   25   39 f    210.7    3.8    0.0000   0.0000          ?        ?   444.4110  15.9630          ?        ?      210.7        3.8       ?       ? 
1 1 1   31   25   40 o    376.5    2.7    0.0000   0.0000          ?        ?  1418.1566  20.4327          ?        ?      376.5        2.7       ?       ? 
1 1 1   31   25   41 o     44.8   15.1    0.0000   0.0000          ?        ?    19.1556  15.9630          ?        ?       44.8       15.1       ?       ? 
1 1 1   31   25   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   25   43 o    164.7    5.2    0.0000   0.0000          ?        ?   272.0102  17.2401          ?        ?      164.7        5.2       ?       ? 
1 1 1   31   25   44 o    296.9    3.1    0.0000   0.0000          ?        ?   882.4369  18.5171          ?        ?      296.9        3.1       ?       ? 
1 1 1   31   25   45 o    118.5    7.0    0.0000   0.0000          ?        ?   141.1133  16.6016          ?        ?      118.5        7.0       ?       ? 
1 1 1   31   25   46 o    125.5    6.9    0.0000   0.0000          ?        ?   158.3534  17.2401          ?        ?      125.5        6.9       ?       ? 
1 1 1   31   25   47 o     74.0   11.6    0.0000   0.0000          ?        ?    55.5514  17.2401          ?        ?       74.0       11.6       ?       ? 
1 1 1   31   25   48 o    188.3    4.9    0.0000   0.0000          ?        ?   355.6566  18.5171          ?        ?      188.3        4.9       ?       ? 
1 1 1   31   25   49 o    376.6    3.0    0.0000   0.0000          ?        ?  1420.0720  22.3483          ?        ?      376.6        3.0       ?       ? 
1 1 1   31   25   50 o    187.3    4.9    0.0000   0.0000          ?        ?   351.8254  18.5171          ?        ?      187.3        4.9       ?       ? 
1 1 1   31   25   51 o     98.6    9.1    0.0000   0.0000          ?        ?    98.3323  17.8786          ?        ?       98.6        9.1       ?       ? 
1 1 1   31   25   52 o     71.1   14.0    0.0000   0.0000          ?        ?    53.6358  19.1556          ?        ?       71.1       14.0       ?       ? 
1 1 1   31   25   53 o    288.7    3.5    0.0000   0.0000          ?        ?   835.1863  20.4327          ?        ?      288.7        3.5       ?       ? 
1 1 1   31   25   54 o    123.2    7.8    0.0000   0.0000          ?        ?   153.2452  19.1556          ?        ?      123.2        7.8       ?       ? 
1 1 1   31   25   55 o    185.0    5.3    0.0000   0.0000          ?        ?   344.1632  19.7942          ?        ?      185.0        5.3       ?       ? 
1 1 1   31   25   56 o     24.1   11.7    0.0000   0.0000          ?        ?   -30.0105  17.8786          ?        ?       24.1       11.7       ?       ? 
1 1 1   31   26    0 o    248.6    6.2  619.3660  30.6490   619.3660  30.6490   619.3660  30.6490      248.6      6.2      248.6        6.2     0.0     0.0 
1 1 1   31   26    1 o    616.7    3.4    0.0000   0.0000          ?        ?  3804.9504  42.1424          ?        ?      616.7        3.4       ?       ? 
1 1 1   31   26    2 o    150.9    5.9    0.0000   0.0000          ?        ?   227.9522  17.8786          ?        ?      150.9        5.9       ?       ? 
1 1 1   31   26    3 o     51.7   15.1    0.0000   0.0000          ?        ?    27.4564  16.6016          ?        ?       51.7       15.1       ?       ? 
1 1 1   31   26    4 o    358.5    3.3    0.0000   0.0000          ?        ?  1285.3440  23.6253          ?        ?      358.5        3.3       ?       ? 
1 1 1   31   26    5 f    149.8    6.6    0.0000   0.0000          ?        ?   224.7596  19.7942          ?        ?      149.8        6.6       ?       ? 
1 1 1   31   26    6 o    240.6    4.5    0.0000   0.0000          ?        ?   579.1391  21.7097          ?        ?      240.6        4.5       ?       ? 
1 1 1   31   26    7 o    513.3    3.0    0.0000   0.0000          ?        ?  2635.1787  30.6490          ?        ?      513.3        3.0       ?       ? 
1 1 1   31   26    8 o    429.2    2.9    0.0000   0.0000          ?        ?  1842.7734  24.9023          ?        ?      429.2        2.9       ?       ? 
1 1 1   31   26    9 o    290.9    3.1    0.0000   0.0000          ?        ?   846.6797  17.8786          ?        ?      290.9        3.1       ?       ? 
1 1 1   31   26   10 o    249.7    3.2    0.0000   0.0000          ?        ?   623.8356  15.9630          ?        ?      249.7        3.2       ?       ? 
1 1 1   31   26   11 o    375.1    2.5    0.0000   0.0000          ?        ?  1407.3016  18.5171          ?        ?      375.1        2.5       ?       ? 
1 1 1   31   26   12 o    316.3    2.2    0.0000   0.0000          ?        ?  1000.5634  14.0475          ?        ?      316.3        2.2       ?       ? 
1 1 1   31   26   13 o    127.6    4.3    0.0000   0.0000          ?        ?   162.8230  10.8549          ?        ?      127.6        4.3       ?       ? 
1 1 1   31   26   14 f    231.0    2.6    0.0000   0.0000          ?        ?   533.8041  12.1319          ?        ?      231.0        2.6       ?       ? 
1 1 1   31   26   15 o    215.4    2.8    0.0000   0.0000          ?        ?   464.2052  12.1319          ?        ?      215.4        2.8       ?       ? 
1 1 1   31   26   16 o    133.9    3.3    0.0000   0.0000          ?        ?   179.4246   8.9393          ?        ?      133.9        3.3       ?       ? 
1 1 1   31   26   17 o     45.6   10.7    0.0000   0.0000          ?        ?    21.7097   9.5778          ?        ?       45.6       10.7       ?       ? 
1 1 1   31   26   18 o    323.9    2.3    0.0000   0.0000          ?        ?  1049.0911  14.6860          ?        ?      323.9        2.3       ?       ? 
1 1 1   31   26   19 o    271.8    2.6    0.0000   0.0000          ?        ?   738.7695  14.0475          ?        ?      271.8        2.6       ?       ? 
1 1 1   31   26   20 o    241.1    2.6    0.0000   0.0000          ?        ?   581.6932  12.7704          ?        ?      241.1        2.6       ?       ? 
1 1 1   31   26   21 o    629.2    2.6    0.0000   0.0000          ?        ?  3960.1111  33.2031          ?        ?      629.2        2.6       ?       ? 
1 1 1   31   26   22 o    140.0    4.1    0.0000   0.0000          ?        ?   196.0261  11.4934          ?        ?      140.0        4.1       ?       ? 
1 1 1   31   26   23 o    187.5    3.1    0.0000   0.0000          ?        ?   351.8254  11.4934          ?        ?      187.5        3.1       ?       ? 
1 1 1   31   26   24 f     72.7    7.9    0.0000   0.0000          ?        ?    52.9973  11.4934          ?        ?       72.7        7.9       ?       ? 
1 1 1   31   26   25 o    297.2    2.6    0.0000   0.0000          ?        ?   883.7139  15.3245          ?        ?      297.2        2.6       ?       ? 
1 1 1   31   26   26 o    401.8    2.5    0.0000   0.0000          ?        ?  1614.8212  19.7942          ?        ?      401.8        2.5       ?       ? 
1 1 1   31   26   27 o    262.2    2.9    0.0000   0.0000          ?        ?   687.6877  15.3245          ?        ?      262.2        2.9       ?       ? 
1 1 1   31   26   28 f    342.0    2.5    0.0000   0.0000          ?        ?  1169.7716  17.2401          ?        ?      342.0        2.5       ?       ? 
1 1 1   31   26   29 o    236.7    3.1    0.0000   0.0000          ?        ?   560.6220  14.6860          ?        ?      236.7        3.1       ?       ? 
1 1 1   31   26   30 o    411.3    2.6    0.0000   0.0000          ?        ?  1692.7208  21.7097          ?        ?      411.3        2.6       ?       ? 
1 1 1   31   26   31 o    293.4    2.7    0.0000   0.0000          ?        ?   861.3657  15.9630          ?        ?      293.4        2.7       ?       ? 
1 1 1   31   26   32 o    238.3    3.3    0.0000   0.0000          ?        ?   568.2842  15.9630          ?        ?      238.3        3.3       ?       ? 
1 1 1   31   26   33 o     22.7   10.9    0.0000   0.0000          ?        ?   -19.7942  14.0475          ?        ?       22.7       10.9       ?       ? 
1 1 1   31   26   34 o    510.9    2.6    0.0000   0.0000          ?        ?  2611.5535  26.1794          ?        ?      510.9        2.6       ?       ? 
1 1 1   31   26   35 o    206.4    3.9    0.0000   0.0000          ?        ?   426.5325  15.9630          ?        ?      206.4        3.9       ?       ? 
1 1 1   31   26   36 o    173.3    4.6    0.0000   0.0000          ?        ?   300.7437  15.9630          ?        ?      173.3        4.6       ?       ? 
1 1 1   31   26   37 o    224.1    3.7    0.0000   0.0000          ?        ?   502.5165  16.6016          ?        ?      224.1        3.7       ?       ? 
1 1 1   31   26   38 o     19.1    9.5    0.0000   0.0000          ?        ?   -42.7809  15.3245          ?        ?       19.1        9.5       ?       ? 
1 1 1   31   26   39 o    217.1    3.8    0.0000   0.0000          ?        ?   471.8675  16.6016          ?        ?      217.1        3.8       ?       ? 
1 1 1   31   26   40 o     18.1    9.2    0.0000   0.0000          ?        ?   -53.6358  15.9630          ?        ?       18.1        9.2       ?       ? 
1 1 1   31   26   41 o    167.1    4.8    0.0000   0.0000          ?        ?   279.6725  15.9630          ?        ?      167.1        4.8       ?       ? 
1 1 1   31   26   42 o    213.8    4.0    0.0000   0.0000          ?        ?   457.8200  17.2401          ?        ?      213.8        4.0       ?       ? 
1 1 1   31   26   43 o     22.2   10.8    0.0000   0.0000          ?        ?   -30.0105  15.9630          ?        ?       22.2       10.8       ?       ? 
1 1 1   31   26   44 o    276.4    3.2    0.0000   0.0000          ?        ?   764.9489  17.8786          ?        ?      276.4        3.2       ?       ? 
1 1 1   31   26   45 o     27.3   12.6    0.0000   0.0000          ?        ?   -12.1319  15.9630          ?        ?       27.3       12.6       ?       ? 
1 1 1   31   26   46 o    147.1    5.6    0.0000   0.0000          ?        ?   217.0974  16.6016          ?        ?      147.1        5.6       ?       ? 
1 1 1   31   26   47 f    304.6    3.1    0.0000   0.0000          ?        ?   929.0490  19.1556          ?        ?      304.6        3.1       ?       ? 
1 1 1   31   26   48 o    276.8    3.6    0.0000   0.0000          ?        ?   767.5030  19.7942          ?        ?      276.8        3.6       ?       ? 
1 1 1   31   26   49 o    118.4    7.6    0.0000   0.0000          ?        ?   141.1133  17.8786          ?        ?      118.4        7.6       ?       ? 
1 1 1   31   26   50 o     97.3    8.9    0.0000   0.0000          ?        ?    95.7782  17.2401          ?        ?       97.3        8.9       ?       ? 
1 1 1   31   26   51 o    196.1    4.4    0.0000   0.0000          ?        ?   385.6671  17.2401          ?        ?      196.1        4.4       ?       ? 
1 1 1   31   26   52 o     76.6   12.1    0.0000   0.0000          ?        ?    60.0210  18.5171          ?        ?       76.6       12.1       ?       ? 
1 1 1   31   26   53 o    210.9    4.5    0.0000   0.0000          ?        ?   446.3266  19.1556          ?        ?      210.9        4.5       ?       ? 
1 1 1   31   26   54 o     79.4   10.9    0.0000   0.0000          ?        ?    64.4907  17.2401          ?        ?       79.4       10.9       ?       ? 
1 1 1   31   26   55 o     26.9   12.7    0.0000   0.0000          ?        ?   -19.1556  17.8786          ?        ?       26.9       12.7       ?       ? 
1 1 1   31   27    0 o    100.3   11.4  104.7175  22.3483   104.7175  22.3483   104.7175  22.3483      100.3     11.4      100.3       11.4     0.0     0.0 
1 1 1   31   27    1 o    147.9    6.0    0.0000   0.0000          ?        ?   219.0129  17.8786          ?        ?      147.9        6.0       ?       ? 
1 1 1   31   27    2 o    259.8    3.8    0.0000   0.0000          ?        ?   675.5559  19.7942          ?        ?      259.8        3.8       ?       ? 
1 1 1   31   27    3 o    379.6    3.1    0.0000   0.0000          ?        ?  1441.7819  23.6253          ?        ?      379.6        3.1       ?       ? 
1 1 1   31   27    4 o    301.6    3.3    0.0000   0.0000          ?        ?   909.8933  19.7942          ?        ?      301.6        3.3       ?       ? 
1 1 1   31   27    5 o    509.1    3.3    0.0000   0.0000          ?        ?  2593.0364  33.2031          ?        ?      509.1        3.3       ?       ? 
1 1 1   31   27    6 o    175.7    5.3    0.0000   0.0000          ?        ?   309.0445  18.5171          ?        ?      175.7        5.3       ?       ? 
1 1 1   31   27    7 o    425.5    3.1    0.0000   0.0000          ?        ?  1811.4860  26.1794          ?        ?      425.5        3.1       ?       ? 
1 1 1   31   27    8 o    286.0    2.8    0.0000   0.0000          ?        ?   817.9462  15.9630          ?        ?      286.0        2.8       ?       ? 
1 1 1   31   27    9 o    116.8    4.9    0.0000   0.0000          ?        ?   136.6436  11.4934          ?        ?      116.8        4.9       ?       ? 
1 1 1   31   27   10 o     37.1   12.0    0.0000   0.0000          ?        ?    13.4090  10.2163          ?        ?       37.1       12.0       ?       ? 
1 1 1   31   27   11 o    457.9    2.6    0.0000   0.0000          ?        ?  2096.9050  24.2638          ?        ?      457.9        2.6       ?       ? 
1 1 1   31   27   12 o    358.9    2.6    0.0000   0.0000          ?        ?  1288.5366  18.5171          ?        ?      358.9        2.6       ?       ? 
1 1 1   31   27   13 o    203.9    2.5    0.0000   0.0000          ?        ?   415.6776  10.2163          ?        ?      203.9        2.5       ?       ? 
1 1 1   31   27   14 o    288.7    2.4    0.0000   0.0000          ?        ?   833.9093  14.0475          ?        ?      288.7        2.4       ?       ? 
1 1 1   31   27   15 o    484.0    2.8    0.0000   0.0000          ?        ?  2343.3743  26.8179          ?        ?      484.0        2.8       ?       ? 
1 1 1   31   27   16 o    655.5    2.8    0.0000   0.0000          ?        ?  4297.8887  36.3957          ?        ?      655.5        2.8       ?       ? 
1 1 1   31   27   17 o    460.9    2.3    0.0000   0.0000          ?        ?  2124.3616  21.0712          ?        ?      460.9        2.3       ?       ? 
1 1 1   31   27   18 o    387.1    2.2    0.0000   0.0000          ?        ?  1498.6102  17.2401          ?        ?      387.1        2.2       ?       ? 
1 1 1   31   27   19 o    406.9    2.3    0.0000   0.0000          ?        ?  1656.3251  18.5171          ?        ?      406.9        2.3       ?       ? 
1 1 1   31   27   20 o    247.4    2.7    0.0000   0.0000          ?        ?   612.3422  13.4090          ?        ?      247.4        2.7       ?       ? 
1 1 1   31   27   21 o    233.9    2.9    0.0000   0.0000          ?        ?   547.2130  13.4090          ?        ?      233.9        2.9       ?       ? 
1 1 1   31   27   22 o    109.2    5.6    0.0000   0.0000          ?        ?   119.4035  12.1319          ?        ?      109.2        5.6       ?       ? 
1 1 1   31   27   23 o    425.5    2.4    0.0000   0.0000          ?        ?  1810.8474  20.4327          ?        ?      425.5        2.4       ?       ? 
1 1 1   31   27   24 o     53.6   11.1    0.0000   0.0000          ?        ?    30.0105  11.4934          ?        ?       53.6       11.1       ?       ? 
1 1 1   31   27   25 o    134.6    5.0    0.0000   0.0000          ?        ?   181.3401  13.4090          ?        ?      134.6        5.0       ?       ? 
1 1 1   31   27   26 o    161.5    4.2    0.0000   0.0000          ?        ?   261.1554  13.4090          ?        ?      161.5        4.2       ?       ? 
1 1 1   31   27   27 o    149.6    4.7    0.0000   0.0000          ?        ?   224.1211  14.0475          ?        ?      149.6        4.7       ?       ? 
1 1 1   31   27   28 o    222.7    3.3    0.0000   0.0000          ?        ?   496.1313  14.6860          ?        ?      222.7        3.3       ?       ? 
1 1 1   31   27   29 o     23.8   11.4    0.0000   0.0000          ?        ?   -21.0712  15.3245          ?        ?       23.8       11.4       ?       ? 
1 1 1   31   27   30 o    172.9    4.4    0.0000   0.0000          ?        ?   299.4666  15.3245          ?        ?      172.9        4.4       ?       ? 
1 1 1   31   27   31 o     47.8   13.9    0.0000   0.0000          ?        ?    23.6253  14.0475          ?        ?       47.8       13.9       ?       ? 
1 1 1   31   27   32 o    239.0    3.2    0.0000   0.0000          ?        ?   571.4769  15.3245          ?        ?      239.0        3.2       ?       ? 
1 1 1   31   27   33 o     39.8   14.4    0.0000   0.0000          ?        ?    13.4090  14.6860          ?        ?       39.8       14.4       ?       ? 
1 1 1   31   27   34 o     57.2   13.6    0.0000   0.0000          ?        ?    34.4802  15.3245          ?        ?       57.2       13.6       ?       ? 
1 1 1   31   27   35 o    127.9    6.0    0.0000   0.0000          ?        ?   164.1001  15.3245          ?        ?      127.9        6.0       ?       ? 
1 1 1   31   27   36 o    141.7    5.4    0.0000   0.0000          ?        ?   201.1343  15.3245          ?        ?      141.7        5.4       ?       ? 
1 1 1   31   27   37 o    114.2    7.0    0.0000   0.0000          ?        ?   130.8969  15.9630          ?        ?      114.2        7.0       ?       ? 
1 1 1   31   27   38 f    346.2    3.0    0.0000   0.0000          ?        ?  1199.1437  21.0712          ?        ?      346.2        3.0       ?       ? 
1 1 1   31   27   39 o    161.8    4.9    0.0000   0.0000          ?        ?   262.4324  15.9630          ?        ?      161.8        4.9       ?       ? 
1 1 1   31   27   40 o    293.8    3.2    0.0000   0.0000          ?        ?   863.9198  18.5171          ?        ?      293.8        3.2       ?       ? 
1 1 1   31   27   41 o     29.1   13.1    0.0000   0.0000          ?        ?    -7.6623  15.9630          ?        ?       29.1       13.1       ?       ? 
1 1 1   31   27   42 o     29.5   13.3    0.0000   0.0000          ?        ?    -8.3008  16.6016          ?        ?       29.5       13.3       ?       ? 
1 1 1   31   27   43 o    288.6    3.3    0.0000   0.0000          ?        ?   833.9093  19.1556          ?        ?      288.6        3.3       ?       ? 
1 1 1   31   27   44 o    272.2    3.5    0.0000   0.0000          ?        ?   741.9621  19.1556          ?        ?      272.2        3.5       ?       ? 
1 1 1   31   27   45 o     68.8   13.5    0.0000   0.0000          ?        ?    49.8047  17.8786          ?        ?       68.8       13.5       ?       ? 
1 1 1   31   27   46 o     83.3   10.7    0.0000   0.0000          ?        ?    70.2374  17.8786          ?        ?       83.3       10.7       ?       ? 
1 1 1   31   27   47 o    170.3    5.2    0.0000   0.0000          ?        ?   291.1659  17.8786          ?        ?      170.3        5.2       ?       ? 
1 1 1   31   27   48 f     27.6   12.8    0.0000   0.0000          ?        ?   -15.3245  17.2401          ?        ?       27.6       12.8       ?       ? 
1 1 1   31   27   49 o    156.0    5.9    0.0000   0.0000          ?        ?   244.5538  18.5171          ?        ?      156.0        5.9       ?       ? 
1 1 1   31   27   50 o    148.2    6.2    0.0000   0.0000          ?        ?   220.9285  18.5171          ?        ?      148.2        6.2       ?       ? 
1 1 1   31   27   51 o    126.3    7.1    0.0000   0.0000          ?        ?   160.9075  17.8786          ?        ?      126.3        7.1       ?       ? 
1 1 1   31   27   52 o     64.4   14.7    0.0000   0.0000          ?        ?    44.6965  18.5171          ?        ?       64.4       14.7       ?       ? 
1 1 1   31   27   53 o     24.5   11.9    0.0000   0.0000          ?        ?   -28.0950  17.8786          ?        ?       24.5       11.9       ?       ? 
1 1 1   31   27   54 o    167.6    5.7    0.0000   0.0000          ?        ?   282.8651  19.1556          ?        ?      167.6        5.7       ?       ? 
1 1 1   31   28    0 o     65.0   22.0   54.9129  25.5409    54.9129  25.5409    54.9129  25.5409       65.0     22.0       65.0       22.0     0.0     0.0 
1 1 1   31   28    1 o    177.5    5.6    0.0000   0.0000          ?        ?   315.4297  19.7942          ?        ?      177.5        5.6       ?       ? 
1 1 1   31   28    2 o    514.2    3.7    0.0000   0.0000          ?        ?  2645.3950  37.6728          ?        ?      514.2        3.7       ?       ? 
1 1 1   31   28    3 o    209.2    5.3    0.0000   0.0000          ?        ?   438.0258  22.3483          ?        ?      209.2        5.3       ?       ? 
1 1 1   31   28    4 o    146.3    8.7    0.0000   0.0000          ?        ?   214.5433  25.5409          ?        ?      146.3        8.7       ?       ? 
1 1 1   31   28    5 o    255.1    4.1    0.0000   0.0000          ?        ?   651.2921  21.0712          ?        ?      255.1        4.1       ?       ? 
1 1 1   31   28    6 o    326.9    3.5    0.0000   0.0000          ?        ?  1068.8851  22.9868          ?        ?      326.9        3.5       ?       ? 
1 1 1   31   28    7 f     49.7   16.5    0.0000   0.0000          ?        ?    23.6253  19.1556          ?        ?       49.7       16.5       ?       ? 
1 1 1   31   28    8 o    399.6    3.5    0.0000   0.0000          ?        ?  1597.5811  28.0950          ?        ?      399.6        3.5       ?       ? 
1 1 1   31   28    9 o    509.1    3.0    0.0000   0.0000          ?        ?  2593.0364  30.6490          ?        ?      509.1        3.0       ?       ? 
1 1 1   31   28   10 o    212.9    3.0    0.0000   0.0000          ?        ?   453.3503  12.7704          ?        ?      212.9        3.0       ?       ? 
1 1 1   31   28   11 o    442.3    2.7    0.0000   0.0000          ?        ?  1956.4302  23.6253          ?        ?      442.3        2.7       ?       ? 
1 1 1   31   28   12 o    290.6    2.4    0.0000   0.0000          ?        ?   844.7642  14.0475          ?        ?      290.6        2.4       ?       ? 
1 1 1   31   28   13 o    406.3    2.7    0.0000   0.0000          ?        ?  1651.2169  21.7097          ?        ?      406.3        2.7       ?       ? 
1 1 1   31   28   14 o    132.2    3.4    0.0000   0.0000          ?        ?   174.9549   8.9393          ?        ?      132.2        3.4       ?       ? 
1 1 1   31   28   15 o    284.3    2.5    0.0000   0.0000          ?        ?   808.3683  14.0475          ?        ?      284.3        2.5       ?       ? 
1 1 1   31   28   16 o    468.6    2.5    0.0000   0.0000          ?        ?  2196.5144  22.9868          ?        ?      468.6        2.5       ?       ? 
1 1 1   31   28   17 o    169.1    3.0    0.0000   0.0000          ?        ?   286.0577  10.2163          ?        ?      169.1        3.0       ?       ? 
1 1 1   31   28   18 o    435.4    2.3    0.0000   0.0000          ?        ?  1896.4092  19.7942          ?        ?      435.4        2.3       ?       ? 
1 1 1   31   28   19 o    322.0    2.4    0.0000   0.0000          ?        ?  1036.9591  15.3245          ?        ?      322.0        2.4       ?       ? 
1 1 1   31   28   20 o    395.5    2.5    0.0000   0.0000          ?        ?  1564.3779  19.7942          ?        ?      395.5        2.5       ?       ? 
1 1 1   31   28   21 o    270.2    2.7    0.0000   0.0000          ?        ?   730.4688  14.6860          ?        ?      270.2        2.7       ?       ? 
1 1 1   31   28   22 o    119.0    4.6    0.0000   0.0000          ?        ?   141.7518  10.8549          ?        ?      119.0        4.6       ?       ? 
1 1 1   31   28   23 o    312.7    2.5    0.0000   0.0000          ?        ?   978.2151  15.3245          ?        ?      312.7        2.5       ?       ? 
1 1 1   31   28   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   28   25 o    232.2    3.0    0.0000   0.0000          ?        ?   539.5508  14.0475          ?        ?      232.2        3.0       ?       ? 
1 1 1   31   28   26 o    179.3    3.7    0.0000   0.0000          ?        ?   321.8149  13.4090          ?        ?      179.3        3.7       ?       ? 
1 1 1   31   28   27 o    736.0    3.0    0.0000   0.0000          ?        ?  5420.4102  44.6965          ?        ?      736.0        3.0       ?       ? 
1 1 1   31   28   28 o    450.1    2.5    0.0000   0.0000          ?        ?  2026.6676  22.3483          ?        ?      450.1        2.5       ?       ? 
1 1 1   31   28   29 o    126.0    5.6    0.0000   0.0000          ?        ?   158.9919  14.0475          ?        ?      126.0        5.6       ?       ? 
1 1 1   31   28   30 o    516.1    2.6    0.0000   0.0000          ?        ?  2665.1892  26.8179          ?        ?      516.1        2.6       ?       ? 
1 1 1   31   28   31 o    396.2    2.6    0.0000   0.0000          ?        ?  1570.7632  20.4327          ?        ?      396.2        2.6       ?       ? 
1 1 1   31   28   32 o    250.6    3.3    0.0000   0.0000          ?        ?   628.3053  16.6016          ?        ?      250.6        3.3       ?       ? 
1 1 1   31   28   33 o    450.6    2.6    0.0000   0.0000          ?        ?  2031.1373  22.9868          ?        ?      450.6        2.6       ?       ? 
1 1 1   31   28   34 o    128.7    5.7    0.0000   0.0000          ?        ?   166.0156  14.6860          ?        ?      128.7        5.7       ?       ? 
1 1 1   31   28   35 o    115.3    6.4    0.0000   0.0000          ?        ?   133.4510  14.6860          ?        ?      115.3        6.4       ?       ? 
1 1 1   31   28   36 f    362.8    2.7    0.0000   0.0000          ?        ?  1316.6316  19.7942          ?        ?      362.8        2.7       ?       ? 
1 1 1   31   28   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   28   38 o    385.4    2.7    0.0000   0.0000          ?        ?  1486.4784  21.0712          ?        ?      385.4        2.7       ?       ? 
1 1 1   31   28   39 o    255.6    3.5    0.0000   0.0000          ?        ?   653.8461  17.8786          ?        ?      255.6        3.5       ?       ? 
1 1 1   31   28   40 o    273.3    3.3    0.0000   0.0000          ?        ?   747.7088  17.8786          ?        ?      273.3        3.3       ?       ? 
1 1 1   31   28   41 o    203.9    4.1    0.0000   0.0000          ?        ?   416.3161  16.6016          ?        ?      203.9        4.1       ?       ? 
1 1 1   31   28   42 o     52.8   14.6    0.0000   0.0000          ?        ?    29.3720  15.9630          ?        ?       52.8       14.6       ?       ? 
1 1 1   31   28   43 o    263.8    3.4    0.0000   0.0000          ?        ?   696.6271  17.8786          ?        ?      263.8        3.4       ?       ? 
1 1 1   31   28   44 o    258.6    3.6    0.0000   0.0000          ?        ?   669.8092  18.5171          ?        ?      258.6        3.6       ?       ? 
1 1 1   31   28   45 o     37.8   15.1    0.0000   0.0000          ?        ?     7.6623  17.2401          ?        ?       37.8       15.1       ?       ? 
1 1 1   31   28   46 o    318.7    3.0    0.0000   0.0000          ?        ?  1017.1650  19.1556          ?        ?      318.7        3.0       ?       ? 
1 1 1   31   28   47 o     20.1   10.1    0.0000   0.0000          ?        ?   -52.3588  17.8786          ?        ?       20.1       10.1       ?       ? 
1 1 1   31   28   48 o    116.7    7.7    0.0000   0.0000          ?        ?   137.2822  17.8786          ?        ?      116.7        7.7       ?       ? 
1 1 1   31   28   49 o     35.2   14.7    0.0000   0.0000          ?        ?     3.1926  17.2401          ?        ?       35.2       14.7       ?       ? 
1 1 1   31   28   50 o     36.8   14.9    0.0000   0.0000          ?        ?     6.3852  17.2401          ?        ?       36.8       14.9       ?       ? 
1 1 1   31   28   51 o    312.4    3.3    0.0000   0.0000          ?        ?   977.5767  20.4327          ?        ?      312.4        3.3       ?       ? 
1 1 1   31   28   52 o    117.8    7.6    0.0000   0.0000          ?        ?   140.4748  17.8786          ?        ?      117.8        7.6       ?       ? 
1 1 1   31   28   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   29    0 o     92.4   14.7   90.6701  25.5409    90.6701  25.5409    90.6701  25.5409       92.4     14.7       92.4       14.7     0.0     0.0 
1 1 1   31   29    1 o    310.0    3.9    0.0000   0.0000          ?        ?   961.6136  24.2638          ?        ?      310.0        3.9       ?       ? 
1 1 1   31   29    2 o    315.2    4.0    0.0000   0.0000          ?        ?   994.1782  24.9023          ?        ?      315.2        4.0       ?       ? 
1 1 1   31   29    3 o    367.4    3.2    0.0000   0.0000          ?        ?  1350.4733  23.6253          ?        ?      367.4        3.2       ?       ? 
1 1 1   31   29    4 o    263.5    4.0    0.0000   0.0000          ?        ?   694.7115  21.0712          ?        ?      263.5        4.0       ?       ? 
1 1 1   31   29    5 o    350.8    3.5    0.0000   0.0000          ?        ?  1231.0697  24.2638          ?        ?      350.8        3.5       ?       ? 
1 1 1   31   29    6 o    194.0    5.3    0.0000   0.0000          ?        ?   376.7278  20.4327          ?        ?      194.0        5.3       ?       ? 
1 1 1   31   29    7 o    487.6    3.7    0.0000   0.0000          ?        ?  2378.4932  36.3957          ?        ?      487.6        3.7       ?       ? 
1 1 1   31   29    8 o    415.2    3.8    0.0000   0.0000          ?        ?  1725.2855  31.9261          ?        ?      415.2        3.8       ?       ? 
1 1 1   31   29    9 o    860.7    4.5    0.0000   0.0000          ?        ?  7414.5127  77.2611          ?        ?      860.7        4.5       ?       ? 
1 1 1   31   29   10 o    645.5    3.5    0.0000   0.0000          ?        ?  4168.2690  44.6965          ?        ?      645.5        3.5       ?       ? 
1 1 1   31   29   11 o    329.1    2.5    0.0000   0.0000          ?        ?  1083.5712  16.6016          ?        ?      329.1        2.5       ?       ? 
1 1 1   31   29   12 f    179.4    3.2    0.0000   0.0000          ?        ?   321.8149  11.4934          ?        ?      179.4        3.2       ?       ? 
1 1 1   31   29   13 o    554.5    3.1    0.0000   0.0000          ?        ?  3075.7588  34.4802          ?        ?      554.5        3.1       ?       ? 
1 1 1   31   29   14 o    363.2    3.0    0.0000   0.0000          ?        ?  1319.8242  21.7097          ?        ?      363.2        3.0       ?       ? 
1 1 1   31   29   15 o    486.2    2.6    0.0000   0.0000          ?        ?  2364.4456  24.9023          ?        ?      486.2        2.6       ?       ? 
1 1 1   31   29   16 o    330.2    2.3    0.0000   0.0000          ?        ?  1090.5950  15.3245          ?        ?      330.2        2.3       ?       ? 
1 1 1   31   29   17 o    278.0    2.3    0.0000   0.0000          ?        ?   773.2497  12.7704          ?        ?      278.0        2.3       ?       ? 
1 1 1   31   29   18 o    323.2    2.3    0.0000   0.0000          ?        ?  1044.6215  14.6860          ?        ?      323.2        2.3       ?       ? 
1 1 1   31   29   19 o    474.0    2.5    0.0000   0.0000          ?        ?  2247.5962  23.6253          ?        ?      474.0        2.5       ?       ? 
1 1 1   31   29   20 o    129.8    4.2    0.0000   0.0000          ?        ?   168.5697  10.8549          ?        ?      129.8        4.2       ?       ? 
1 1 1   31   29   21 o    389.9    2.3    0.0000   0.0000          ?        ?  1520.3201  17.8786          ?        ?      389.9        2.3       ?       ? 
1 1 1   31   29   22 o    474.8    2.4    0.0000   0.0000          ?        ?  2255.2585  22.3483          ?        ?      474.8        2.4       ?       ? 
1 1 1   31   29   23 o    116.3    5.2    0.0000   0.0000          ?        ?   135.3666  12.1319          ?        ?      116.3        5.2       ?       ? 
1 1 1   31   29   24 o    325.8    2.6    0.0000   0.0000          ?        ?  1061.8615  17.2401          ?        ?      325.8        2.6       ?       ? 
1 1 1   31   29   25 o    471.2    2.5    0.0000   0.0000          ?        ?  2220.7781  23.6253          ?        ?      471.2        2.5       ?       ? 
1 1 1   31   29   26 o    413.0    2.6    0.0000   0.0000          ?        ?  1706.7682  21.0712          ?        ?      413.0        2.6       ?       ? 
1 1 1   31   29   27 o    504.5    2.5    0.0000   0.0000          ?        ?  2546.4241  24.9023          ?        ?      504.5        2.5       ?       ? 
1 1 1   31   29   28 o    211.5    3.6    0.0000   0.0000          ?        ?   447.6036  15.3245          ?        ?      211.5        3.6       ?       ? 
1 1 1   31   29   29 o    130.5    5.4    0.0000   0.0000          ?        ?   170.4853  14.0475          ?        ?      130.5        5.4       ?       ? 
1 1 1   31   29   30 o     34.0   13.6    0.0000   0.0000          ?        ?     5.7467  14.0475          ?        ?       34.0       13.6       ?       ? 
1 1 1   31   29   31 o    200.3    3.7    0.0000   0.0000          ?        ?   401.6301  14.6860          ?        ?      200.3        3.7       ?       ? 
1 1 1   31   29   32 o     34.2   13.8    0.0000   0.0000          ?        ?     5.1082  14.6860          ?        ?       34.2       13.8       ?       ? 
1 1 1   31   29   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   29   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   29   35 o    195.3    3.9    0.0000   0.0000          ?        ?   381.8359  15.3245          ?        ?      195.3        3.9       ?       ? 
1 1 1   31   29   36 o    299.7    3.0    0.0000   0.0000          ?        ?   899.0385  17.8786          ?        ?      299.7        3.0       ?       ? 
1 1 1   31   29   37 o    100.2    8.0    0.0000   0.0000          ?        ?   100.8864  15.9630          ?        ?      100.2        8.0       ?       ? 
1 1 1   31   29   38 o    154.1    5.2    0.0000   0.0000          ?        ?   238.1686  15.9630          ?        ?      154.1        5.2       ?       ? 
1 1 1   31   29   39 o    263.7    3.3    0.0000   0.0000          ?        ?   695.9886  17.2401          ?        ?      263.7        3.3       ?       ? 
1 1 1   31   29   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   29   41 o    179.2    4.6    0.0000   0.0000          ?        ?   321.8149  16.6016          ?        ?      179.2        4.6       ?       ? 
1 1 1   31   29   42 o    120.1    6.9    0.0000   0.0000          ?        ?   144.9444  16.6016          ?        ?      120.1        6.9       ?       ? 
1 1 1   31   29   43 o    113.2    7.3    0.0000   0.0000          ?        ?   128.9814  16.6016          ?        ?      113.2        7.3       ?       ? 
1 1 1   31   29   44 o    150.4    5.9    0.0000   0.0000          ?        ?   227.3137  17.8786          ?        ?      150.4        5.9       ?       ? 
1 1 1   31   29   45 o     69.3   12.4    0.0000   0.0000          ?        ?    50.4432  16.6016          ?        ?       69.3       12.4       ?       ? 
1 1 1   31   29   46 o     32.7   14.2    0.0000   0.0000          ?        ?    -1.9156  17.2401          ?        ?       32.7       14.2       ?       ? 
1 1 1   31   29   47 o    301.1    3.4    0.0000   0.0000          ?        ?   907.9777  20.4327          ?        ?      301.1        3.4       ?       ? 
1 1 1   31   29   48 o    127.8    7.0    0.0000   0.0000          ?        ?   164.7386  17.8786          ?        ?      127.8        7.0       ?       ? 
1 1 1   31   29   49 o     31.0   13.8    0.0000   0.0000          ?        ?    -5.7467  17.2401          ?        ?       31.0       13.8       ?       ? 
1 1 1   31   29   50 o    157.6    5.5    0.0000   0.0000          ?        ?   249.6619  17.2401          ?        ?      157.6        5.5       ?       ? 
1 1 1   31   29   51 o    190.0    4.9    0.0000   0.0000          ?        ?   362.6803  18.5171          ?        ?      190.0        4.9       ?       ? 
1 1 1   31   30    0 o    155.4    9.1  244.5538  28.0950   244.5538  28.0950   244.5538  28.0950      155.4      9.1      155.4        9.1     0.0     0.0 
1 1 1   31   30    1 o    201.9    5.1    0.0000   0.0000          ?        ?   408.0153  20.4327          ?        ?      201.9        5.1       ?       ? 
1 1 1   31   30    2 o    127.2    8.0    0.0000   0.0000          ?        ?   162.1845  20.4327          ?        ?      127.2        8.0       ?       ? 
1 1 1   31   30    3 o    241.6    4.8    0.0000   0.0000          ?        ?   584.2473  22.9868          ?        ?      241.6        4.8       ?       ? 
1 1 1   31   30    4 f    201.2    5.9    0.0000   0.0000          ?        ?   405.4612  23.6253          ?        ?      201.2        5.9       ?       ? 
1 1 1   31   30    5 o    460.9    3.8    0.0000   0.0000          ?        ?  2125.6384  35.1187          ?        ?      460.9        3.8       ?       ? 
1 1 1   31   30    6 f    252.6    4.7    0.0000   0.0000          ?        ?   638.5216  23.6253          ?        ?      252.6        4.7       ?       ? 
1 1 1   31   30    7 o    392.2    3.5    0.0000   0.0000          ?        ?  1538.8372  27.4564          ?        ?      392.2        3.5       ?       ? 
1 1 1   31   30    8 o    265.0    4.1    0.0000   0.0000          ?        ?   703.0123  21.7097          ?        ?      265.0        4.1       ?       ? 
1 1 1   31   30    9 o    106.1    9.0    0.0000   0.0000          ?        ?   113.0183  19.1556          ?        ?      106.1        9.0       ?       ? 
1 1 1   31   30   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   30   11 o    324.2    2.7    0.0000   0.0000          ?        ?  1051.6451  17.2401          ?        ?      324.2        2.7       ?       ? 
1 1 1   31   30   12 o    442.3    3.0    0.0000   0.0000          ?        ?  1957.0687  26.1794          ?        ?      442.3        3.0       ?       ? 
1 1 1   31   30   13 o    234.0    3.0    0.0000   0.0000          ?        ?   547.8516  14.0475          ?        ?      234.0        3.0       ?       ? 
1 1 1   31   30   14 o    173.2    3.7    0.0000   0.0000          ?        ?   300.1052  12.7704          ?        ?      173.2        3.7       ?       ? 
1 1 1   31   30   15 o    166.6    4.0    0.0000   0.0000          ?        ?   277.7569  13.4090          ?        ?      166.6        4.0       ?       ? 
1 1 1   31   30   16 o    436.1    2.6    0.0000   0.0000          ?        ?  1902.1559  22.9868          ?        ?      436.1        2.6       ?       ? 
1 1 1   31   30   17 o     61.8    7.2    0.0000   0.0000          ?        ?    38.3113   8.9393          ?        ?       61.8        7.2       ?       ? 
1 1 1   31   30   18 o    351.4    2.5    0.0000   0.0000          ?        ?  1234.9008  17.2401          ?        ?      351.4        2.5       ?       ? 
1 1 1   31   30   19 o     76.1    6.7    0.0000   0.0000          ?        ?    58.1055  10.2163          ?        ?       76.1        6.7       ?       ? 
1 1 1   31   30   20 o    277.0    2.5    0.0000   0.0000          ?        ?   767.5030  14.0475          ?        ?      277.0        2.5       ?       ? 
1 1 1   31   30   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   30   22 o    225.3    2.8    0.0000   0.0000          ?        ?   507.6247  12.7704          ?        ?      225.3        2.8       ?       ? 
1 1 1   31   30   23 o    152.2    4.0    0.0000   0.0000          ?        ?   231.7833  12.1319          ?        ?      152.2        4.0       ?       ? 
1 1 1   31   30   24 o    139.7    4.3    0.0000   0.0000          ?        ?   195.3876  12.1319          ?        ?      139.7        4.3       ?       ? 
1 1 1   31   30   25 o    206.9    3.4    0.0000   0.0000          ?        ?   428.4480  14.0475          ?        ?      206.9        3.4       ?       ? 
1 1 1   31   30   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   30   27 o     52.3   12.9    0.0000   0.0000          ?        ?    28.7335  13.4090          ?        ?       52.3       12.9       ?       ? 
1 1 1   31   30   28 f    255.3    3.0    0.0000   0.0000          ?        ?   651.9305  15.3245          ?        ?      255.3        3.0       ?       ? 
1 1 1   31   30   29 f    152.8    4.4    0.0000   0.0000          ?        ?   233.6989  13.4090          ?        ?      152.8        4.4       ?       ? 
1 1 1   31   30   30 o     82.0    9.0    0.0000   0.0000          ?        ?    67.6833  14.6860          ?        ?       82.0        9.0       ?       ? 
1 1 1   31   30   31 o    412.7    2.6    0.0000   0.0000          ?        ?  1704.2142  21.0712          ?        ?      412.7        2.6       ?       ? 
1 1 1   31   30   32 o    203.9    3.9    0.0000   0.0000          ?        ?   416.3161  15.9630          ?        ?      203.9        3.9       ?       ? 
1 1 1   31   30   33 o     85.5    8.2    0.0000   0.0000          ?        ?    73.4300  14.0475          ?        ?       85.5        8.2       ?       ? 
1 1 1   31   30   34 o    348.4    2.7    0.0000   0.0000          ?        ?  1214.4681  19.1556          ?        ?      348.4        2.7       ?       ? 
1 1 1   31   30   35 o    291.1    3.1    0.0000   0.0000          ?        ?   847.9567  17.8786          ?        ?      291.1        3.1       ?       ? 
1 1 1   31   30   36 o    190.3    4.0    0.0000   0.0000          ?        ?   362.6803  15.3245          ?        ?      190.3        4.0       ?       ? 
1 1 1   31   30   37 o    202.9    4.1    0.0000   0.0000          ?        ?   412.4850  16.6016          ?        ?      202.9        4.1       ?       ? 
1 1 1   31   30   38 o    158.0    5.5    0.0000   0.0000          ?        ?   250.3005  17.2401          ?        ?      158.0        5.5       ?       ? 
1 1 1   31   30   39 o    229.2    3.9    0.0000   0.0000          ?        ?   526.1418  17.8786          ?        ?      229.2        3.9       ?       ? 
1 1 1   31   30   40 o    245.3    3.6    0.0000   0.0000          ?        ?   602.7644  17.8786          ?        ?      245.3        3.6       ?       ? 
1 1 1   31   30   41 o    108.9    7.6    0.0000   0.0000          ?        ?   119.4035  16.6016          ?        ?      108.9        7.6       ?       ? 
1 1 1   31   30   42 o     59.6   13.7    0.0000   0.0000          ?        ?    37.6728  15.9630          ?        ?       59.6       13.7       ?       ? 
1 1 1   31   30   43 o    137.6    5.8    0.0000   0.0000          ?        ?   190.2794  15.9630          ?        ?      137.6        5.8       ?       ? 
1 1 1   31   30   44 o     72.2   11.1    0.0000   0.0000          ?        ?    52.9973  15.9630          ?        ?       72.2       11.1       ?       ? 
1 1 1   31   30   45 o     85.9    9.7    0.0000   0.0000          ?        ?    74.7070  16.6016          ?        ?       85.9        9.7       ?       ? 
1 1 1   31   30   46 o    321.3    3.0    0.0000   0.0000          ?        ?  1033.7665  19.1556          ?        ?      321.3        3.0       ?       ? 
1 1 1   31   30   47 o     27.6   12.8    0.0000   0.0000          ?        ?   -12.7704  16.6016          ?        ?       27.6       12.8       ?       ? 
1 1 1   31   30   48 o    168.2    4.9    0.0000   0.0000          ?        ?   284.1421  16.6016          ?        ?      168.2        4.9       ?       ? 
1 1 1   31   30   49 o     97.5    8.5    0.0000   0.0000          ?        ?    96.4168  16.6016          ?        ?       97.5        8.5       ?       ? 
1 1 1   31   30   50 o    186.0    4.6    0.0000   0.0000          ?        ?   347.3558  17.2401          ?        ?      186.0        4.6       ?       ? 
1 1 1   31   31    0 o    323.6    9.5 1051.0066  61.2981  1051.0066  61.2981  1051.0066  61.2981      323.6      9.5      323.6        9.5     0.0     0.0 
1 1 1   31   31    1 f    218.9    8.5  482.0838  37.0343   482.0838  37.0343   482.0838  37.0343      218.9      8.5      218.9        8.5     0.0     0.0 
1 1 1   31   31    2 o     37.8   22.1   17.8786  27.4564    17.8786  27.4564    17.8786  27.4564       37.8     22.1       37.8       22.1     0.0     0.0 
1 1 1   31   31    3 o    235.9    6.0  558.0679  28.0950   558.0679  28.0950   558.0679  28.0950      235.9      6.0      235.9        6.0     0.0     0.0 
1 1 1   31   31    4 o    243.6    6.3  595.1021  30.6490   595.1021  30.6490   595.1021  30.6490      243.6      6.3      243.6        6.3     0.0     0.0 
1 1 1   31   31    5 o    359.1    5.7 1291.7292  40.8654  1291.7292  40.8654  1291.7292  40.8654      359.1      5.7      359.1        5.7     0.0     0.0 
1 1 1   31   31    6 o    324.2    6.0 1052.9221  38.9498  1052.9221  38.9498  1052.9221  38.9498      324.2      6.0      324.2        6.0     0.0     0.0 
1 1 1   31   31    7 o     18.2   13.4  -61.2981  28.0950   -61.2981  28.0950   -61.2981  28.0950       18.2     13.4       18.2       13.4     0.0     0.0 
1 1 1   31   31    8 f     14.9   11.1 -101.5249  28.0950  -101.5249  28.0950  -101.5249  28.0950       14.9     11.1       14.9       11.1     0.0     0.0 
1 1 1   31   31    9 o    382.4    5.4 1464.1301  41.5039  1464.1301  41.5039  1464.1301  41.5039      382.4      5.4      382.4        5.4     0.0     0.0 
1 1 1   31   31   10 o    665.0    5.5 4427.5093  73.4300  4427.5093  73.4300  4427.5093  73.4300      665.0      5.5      665.0        5.5     0.0     0.0 
1 1 1   31   31   11 o    552.2    5.5 3052.7720  60.6596  3052.7720  60.6596  3052.7720  60.6596      552.2      5.5      552.2        5.5     0.0     0.0 
1 1 1   31   31   12 o    607.0    4.9 3688.1008  60.0210  3688.1008  60.0210  3688.1008  60.0210      607.0      4.9      607.0        4.9     0.0     0.0 
1 1 1   31   31   13 o    363.0    4.0 1318.5471  28.7335  1318.5471  28.7335  1318.5471  28.7335      363.0      4.0      363.0        4.0     0.0     0.0 
1 1 1   31   31   14 o    234.9    4.1  552.3212  19.1556   552.3212  19.1556   552.3212  19.1556      234.9      4.1      234.9        4.1     0.0     0.0 
1 1 1   31   31   15 o    126.4    7.1  161.5460  17.8786   161.5460  17.8786   161.5460  17.8786      126.4      7.1      126.4        7.1     0.0     0.0 
1 1 1   31   31   16 o     15.9   11.6  -38.9498  19.7942   -38.9498  19.7942   -38.9498  19.7942       15.9     11.6       15.9       11.6     0.0     0.0 
1 1 1   31   31   17 o    275.8    3.1  761.1177  17.2401   761.1177  17.2401   761.1177  17.2401      275.8      3.1      275.8        3.1     0.0     0.0 
1 1 1   31   31   18 o    640.5    4.4 4105.6938  56.1899  4105.6938  56.1899  4105.6938  56.1899      640.5      4.4      640.5        4.4     0.0     0.0 
1 1 1   31   31   19 o    101.3    6.7  104.0790  13.4090   104.0790  13.4090   104.0790  13.4090      101.3      6.7      101.3        6.7     0.0     0.0 
1 1 1   31   31   20 o    286.9    3.3  823.6929  19.1556   823.6929  19.1556   823.6929  19.1556      286.9      3.3      286.9        3.3     0.0     0.0 
1 1 1   31   31   21 o    567.4    3.7 3221.3416  42.1424  3221.3416  42.1424  3221.3416  42.1424      567.4      3.7      567.4        3.7     0.0     0.0 
1 1 1   31   31   22 o     93.7    8.3   90.0316  15.3245    90.0316  15.3245    90.0316  15.3245       93.7      8.3       93.7        8.3     0.0     0.0 
1 1 1   31   31   23 o    198.5    5.0  395.2449  19.7942   395.2449  19.7942   395.2449  19.7942      198.5      5.0      198.5        5.0     0.0     0.0 
1 1 1   31   31   24 o    526.3    3.8 2771.1838  40.2269  2771.1838  40.2269  2771.1838  40.2269      526.3      3.8      526.3        3.8     0.0     0.0 
1 1 1   31   31   25 o     84.4   10.5   74.7070  17.2401    74.7070  17.2401    74.7070  17.2401       84.4     10.5       84.4       10.5     0.0     0.0 
1 1 1   31   31   26 o    224.7    4.6  505.7091  20.4327   505.7091  20.4327   505.7091  20.4327      224.7      4.6      224.7        4.6     0.0     0.0 
1 1 1   31   31   27 o    353.1    3.7 1247.6713  26.1794  1247.6713  26.1794  1247.6713  26.1794      353.1      3.7      353.1        3.7     0.0     0.0 
1 1 1   31   31   28 o    141.0    6.8  200.4958  19.1556   200.4958  19.1556   200.4958  19.1556      141.0      6.8      141.0        6.8     0.0     0.0 
1 1 1   31   31   29 o     83.8   12.3   73.4300  19.7942    73.4300  19.7942    73.4300  19.7942       83.8     12.3       83.8       12.3     0.0     0.0 
1 1 1   31   31   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   31   31 o     82.2   13.3   72.1529  20.4327    72.1529  20.4327    72.1529  20.4327       82.2     13.3       82.2       13.3     0.0     0.0 
1 1 1   31   31   32 o    258.3    4.6  668.5321  23.6253   668.5321  23.6253   668.5321  23.6253      258.3      4.6      258.3        4.6     0.0     0.0 
1 1 1   31   31   33 o     43.3   20.7   28.0950  20.4327    28.0950  20.4327    28.0950  20.4327       43.3     20.7       43.3       20.7     0.0     0.0 
1 1 1   31   31   34 o     33.8   19.4   15.3245  20.4327    15.3245  20.4327    15.3245  20.4327       33.8     19.4       33.8       19.4     0.0     0.0 
1 1 1   31   31   35 o    143.3    7.4  207.5195  21.0712   207.5195  21.0712   207.5195  21.0712      143.3      7.4      143.3        7.4     0.0     0.0 
1 1 1   31   31   36 o    213.0    5.4  455.2659  22.9868   455.2659  22.9868   455.2659  22.9868      213.0      5.4      213.0        5.4     0.0     0.0 
1 1 1   31   31   37 o    414.8    4.0 1722.0929  33.2031  1722.0929  33.2031  1722.0929  33.2031      414.8      4.0      414.8        4.0     0.0     0.0 
1 1 1   31   31   38 o    155.7    7.2  244.5538  22.3483   244.5538  22.3483   244.5538  22.3483      155.7      7.2      155.7        7.2     0.0     0.0 
1 1 1   31   31   39 o    301.8    4.7  912.4474  28.0950   912.4474  28.0950   912.4474  28.0950      301.8      4.7      301.8        4.7     0.0     0.0 
1 1 1   31   31   40 o     87.9   13.9   82.3693  22.9868    82.3693  22.9868    82.3693  22.9868       87.9     13.9       87.9       13.9     0.0     0.0 
1 1 1   31   31   41 o    103.6   11.0  111.7413  22.3483   111.7413  22.3483   111.7413  22.3483      103.6     11.0      103.6       11.0     0.0     0.0 
1 1 1   31   31   42 o    246.3    5.2  608.5111  25.5409   608.5111  25.5409   608.5111  25.5409      246.3      5.2      246.3        5.2     0.0     0.0 
1 1 1   31   31   43 f     27.1   17.8   -0.6385  22.9868    -0.6385  22.9868    -0.6385  22.9868       27.1     17.8       27.1       17.8     0.0     0.0 
1 1 1   31   31   44 o     15.0   11.1  -60.0210  22.3483   -60.0210  22.3483   -60.0210  22.3483       15.0     11.1       15.0       11.1     0.0     0.0 
1 1 1   31   31   45 o     32.0   19.6   10.2163  23.6253    10.2163  23.6253    10.2163  23.6253       32.0     19.6       32.0       19.6     0.0     0.0 
1 1 1   31   31   46 o    102.7   12.1  111.1028  24.2638   111.1028  24.2638   111.1028  24.2638      102.7     12.1      102.7       12.1     0.0     0.0 
1 1 1   31   31   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   31   31   48 o    153.4    8.0  238.8071  24.2638   238.8071  24.2638   238.8071  24.2638      153.4      8.0      153.4        8.0     0.0     0.0 
1 1 1   32    0    0 o    655.3    5.7 4294.6963  74.7070  4294.6963  74.7070  4294.6963  74.7070      655.3      5.7      655.3        5.7     0.0     0.0 
1 1 1   32    0    1 o    621.6    3.7 3864.9714  46.6121  3864.9714  46.6121  3864.9714  46.6121      621.6      3.7      621.6        3.7     0.0     0.0 
1 1 1   32    0    2 o    388.2    3.2 1507.5496  24.9023  1507.5496  24.9023  1507.5496  24.9023      388.2      3.2      388.2        3.2     0.0     0.0 
1 1 1   32    0    3 o   1081.9    5.5 11706.0176 118.1265 11706.0176 118.1265 11706.0176 118.1265     1081.9      5.5     1081.9        5.5     0.0     0.0 
1 1 1   32    0    4 o   1371.1    6.7 18802.5469 183.2557 18802.5469 183.2557 18802.5469 183.2557     1371.1      6.7     1371.1        6.7     0.0     0.0 
1 1 1   32    0    5 o    853.7    4.7 7288.7246  79.8152  7288.7246  79.8152  7288.7246  79.8152      853.7      4.7      853.7        4.7     0.0     0.0 
1 1 1   32    0    6 o   1449.8    7.0 21023.3242 204.3269 21023.3242 204.3269 21023.3242 204.3269     1449.8      7.0     1449.8        7.0     0.0     0.0 
1 1 1   32    0    7 o    433.1    3.6 1875.9764  31.2876  1875.9764  31.2876  1875.9764  31.2876      433.1      3.6      433.1        3.6     0.0     0.0 
1 1 1   32    0    8 o   2265.6   11.5 51346.0781 521.0336 51346.0781 521.0336 51346.0781 521.0336     2265.6     11.5     2265.6       11.5     0.0     0.0 
1 1 1   32    0    9 o    559.7    3.6 3133.2256  40.2269  3133.2256  40.2269  3133.2256  40.2269      559.7      3.6      559.7        3.6     0.0     0.0 
1 1 1   32    0   10 o    578.7    3.9 3349.0459  44.6965  3349.0459  44.6965  3349.0459  44.6965      578.7      3.9      578.7        3.9     0.0     0.0 
1 1 1   32    0   11 o    850.4    4.6 7232.5342  78.5382  7232.5342  78.5382  7232.5342  78.5382      850.4      4.6      850.4        4.6     0.0     0.0 
1 1 1   32    0   12 o   1475.3    7.1 21770.3945 208.1580 21770.3945 208.1580 21770.3945 208.1580     1475.3      7.1     1475.3        7.1     0.0     0.0 
1 1 1   32    0   13 o   1018.8    5.1 10381.7236 104.7175 10381.7236 104.7175 10381.7236 104.7175     1018.8      5.1     1018.8        5.1     0.0     0.0 
1 1 1   32    0   14 o    169.5    4.5  287.9732  15.3245   287.9732  15.3245   287.9732  15.3245      169.5      4.5      169.5        4.5     0.0     0.0 
1 1 1   32    0   15 o   1916.6    8.9 36742.4492 340.3320 36742.4492 340.3320 36742.4492 340.3320     1916.6      8.9     1916.6        8.9     0.0     0.0 
1 1 1   32    0   16 o    361.2    3.4 1305.1382  24.2638  1305.1382  24.2638  1305.1382  24.2638      361.2      3.4      361.2        3.4     0.0     0.0 
1 1 1   32    0   17 o   1620.2    7.7 26254.7305 248.3849 26254.7305 248.3849 26254.7305 248.3849     1620.2      7.7     1620.2        7.7     0.0     0.0 
1 1 1   32    0   18 o    397.8    3.8 1582.8950  30.0105  1582.8950  30.0105  1582.8950  30.0105      397.8      3.8      397.8        3.8     0.0     0.0 
1 1 1   32    0   19 o   1436.5    7.2 20640.2109 207.5195 20640.2109 207.5195 20640.2109 207.5195     1436.5      7.2     1436.5        7.2     0.0     0.0 
1 1 1   32    0   20 o   1064.5    5.4 11332.4824 114.2954 11332.4824 114.2954 11332.4824 114.2954     1064.5      5.4     1064.5        5.4     0.0     0.0 
1 1 1   32    0   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    0   22 o     96.8   12.0   94.5012  23.6253    94.5012  23.6253    94.5012  23.6253       96.8     12.0       96.8       12.0     0.0     0.0 
1 1 1   32    0   23 o    543.5    3.7 2954.4397  40.2269  2954.4397  40.2269  2954.4397  40.2269      543.5      3.7      543.5        3.7     0.0     0.0 
1 1 1   32    0   24 o    769.9    5.1 5928.6733  79.1767  5928.6733  79.1767  5928.6733  79.1767      769.9      5.1      769.9        5.1     0.0     0.0 
1 1 1   32    0   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    0   26 o    299.1    3.8  895.2073  22.9868   895.2073  22.9868   895.2073  22.9868      299.1      3.8      299.1        3.8     0.0     0.0 
1 1 1   32    0   27 o    875.9    5.7 7673.1143  99.6094  7673.1143  99.6094  7673.1143  99.6094      875.9      5.7      875.9        5.7     0.0     0.0 
1 1 1   32    0   28 o    179.5    5.7  323.0919  20.4327   323.0919  20.4327   323.0919  20.4327      179.5      5.7      179.5        5.7     0.0     0.0 
1 1 1   32    0   29 o    567.4    4.2 3220.0645  47.2506  3220.0645  47.2506  3220.0645  47.2506      567.4      4.2      567.4        4.2     0.0     0.0 
1 1 1   32    0   30 o    410.6    3.7 1686.3357  30.6490  1686.3357  30.6490  1686.3357  30.6490      410.6      3.7      410.6        3.7     0.0     0.0 
1 1 1   32    0   31 o   1005.2    5.7 10107.1592 114.9339 10107.1592 114.9339 10107.1592 114.9339     1005.2      5.7     1005.2        5.7     0.0     0.0 
1 1 1   32    0   32 o    287.4    4.9  826.8855  28.0950   826.8855  28.0950   826.8855  28.0950      287.4      4.9      287.4        4.9     0.0     0.0 
1 1 1   32    0   33 o     30.7   19.1    7.0237  22.9868     7.0237  22.9868     7.0237  22.9868       30.7     19.1       30.7       19.1     0.0     0.0 
1 1 1   32    0   34 o    588.5    3.9 3464.6182  45.3350  3464.6182  45.3350  3464.6182  45.3350      588.5      3.9      588.5        3.9     0.0     0.0 
1 1 1   32    0   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    0   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    0   37 o     21.1   14.8  -18.5171  21.7097   -18.5171  21.7097   -18.5171  21.7097       21.1     14.8       21.1       14.8     0.0     0.0 
1 1 1   32    0   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    0   39 o     19.4   14.5 -164.1001  46.6121  -164.1001  46.6121  -164.1001  46.6121       19.4     14.5       19.4       14.5     0.0     0.0 
1 1 1   32    0   40 o    932.0    5.0 8689.6406  93.8627  8689.6406  93.8627  8689.6406  93.8627      932.0      5.0      932.0        5.0     0.0     0.0 
1 1 1   32    0   41 o    870.7    4.8 7583.7212  83.6463  7583.7212  83.6463  7583.7212  83.6463      870.7      4.8      870.7        4.8     0.0     0.0 
1 1 1   32    0   42 o    247.0    5.2  611.0652  25.5409   611.0652  25.5409   611.0652  25.5409      247.0      5.2      247.0        5.2     0.0     0.0 
1 1 1   32    0   43 o    462.3    3.7 2137.7703  34.4802  2137.7703  34.4802  2137.7703  34.4802      462.3      3.7      462.3        3.7     0.0     0.0 
1 1 1   32    0   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    0   45 o    548.9    3.8 3013.8220  41.5039  3013.8220  41.5039  3013.8220  41.5039      548.9      3.8      548.9        3.8     0.0     0.0 
1 1 1   32    0   46 o     17.9   13.0  -45.9736  24.2638   -45.9736  24.2638   -45.9736  24.2638       17.9     13.0       17.9       13.0     0.0     0.0 
1 1 1   32    0   47 o    444.4    3.9 1975.5858  34.4802  1975.5858  34.4802  1975.5858  34.4802      444.4      3.9      444.4        3.9     0.0     0.0 
1 1 1   32    0   48 o    191.5    6.7  368.4270  25.5409   368.4270  25.5409   368.4270  25.5409      191.5      6.7      191.5        6.7     0.0     0.0 
1 1 1   32    0   49 o    244.4    5.4  598.2947  26.1794   598.2947  26.1794   598.2947  26.1794      244.4      5.4      244.4        5.4     0.0     0.0 
1 1 1   32    0   50 o    229.3    5.2  526.7803  23.6253   526.7803  23.6253   526.7803  23.6253      229.3      5.2      229.3        5.2     0.0     0.0 
1 1 1   32    0   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    0   52 o    276.1    5.0  763.6719  27.4564   763.6719  27.4564   763.6719  27.4564      276.1      5.0      276.1        5.0     0.0     0.0 
1 1 1   32    0   53 f    305.4    4.4  933.5186  26.8179   933.5186  26.8179   933.5186  26.8179      305.4      4.4      305.4        4.4     0.0     0.0 
1 1 1   32    0   54 o     71.0   21.2   62.5751  26.1794    62.5751  26.1794    62.5751  26.1794       71.0     21.2       71.0       21.2     0.0     0.0 
1 1 1   32    0   55 o    428.8    4.0 1840.2194  34.4802  1840.2194  34.4802  1840.2194  34.4802      428.8      4.0      428.8        4.0     0.0     0.0 
1 1 1   32    0   56 o    113.4   12.1  133.4510  26.8179   133.4510  26.8179   133.4510  26.8179      113.4     12.1      113.4       12.1     0.0     0.0 
1 1 1   32    0   57 o     18.0   13.2  -60.0210  27.4564   -60.0210  27.4564   -60.0210  27.4564       18.0     13.2       18.0       13.2     0.0     0.0 
1 1 1   32    0   58 f     17.6   13.0  -71.5144  28.7335   -71.5144  28.7335   -71.5144  28.7335       17.6     13.0       17.6       13.0     0.0     0.0 
1 1 1   32    0   59 o    107.0   12.8  120.0421  26.8179   120.0421  26.8179   120.0421  26.8179      107.0     12.8      107.0       12.8     0.0     0.0 
1 1 1   32    0   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    0   61 o    322.4    4.8 1040.7903  30.6490  1040.7903  30.6490  1040.7903  30.6490      322.4      4.8      322.4        4.8     0.0     0.0 
1 1 1   32    0   62 o    272.9    5.4  746.4318  29.3720   746.4318  29.3720   746.4318  29.3720      272.9      5.4      272.9        5.4     0.0     0.0 
1 1 1   32    0   63 o    414.8    4.2 1722.0929  35.1187  1722.0929  35.1187  1722.0929  35.1187      414.8      4.2      414.8        4.2     0.0     0.0 
1 1 1   32    0   64 o     23.1   16.3  -25.5409  27.4564   -25.5409  27.4564   -25.5409  27.4564       23.1     16.3       23.1       16.3     0.0     0.0 
1 1 1   32    0   65 o     31.9   20.4    4.4697  28.0950     4.4697  28.0950     4.4697  28.0950       31.9     20.4       31.9       20.4     0.0     0.0 
1 1 1   32    0   66 o     58.5   24.3   49.1662  28.0950    49.1662  28.0950    49.1662  28.0950       58.5     24.3       58.5       24.3     0.0     0.0 
1 1 1   32    0   67 f     17.3   12.8  -85.5619  30.6490   -85.5619  30.6490   -85.5619  30.6490       17.3     12.8       17.3       12.8     0.0     0.0 
1 1 1   32    0   68 o     92.3   18.3   95.7782  30.0105    95.7782  30.0105    95.7782  30.0105       92.3     18.3       92.3       18.3     0.0     0.0 
1 1 1   32    0   69 o    228.5    6.6  524.8647  30.0105   524.8647  30.0105   524.8647  30.0105      228.5      6.6      228.5        6.6     0.0     0.0 
1 1 1   32    0   70 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    0   71 o    371.7    4.6 1384.9534  34.4802  1384.9534  34.4802  1384.9534  34.4802      371.7      4.6      371.7        4.6     0.0     0.0 
1 1 1   32    0   72 o     29.7   19.6   -1.9156  28.7335    -1.9156  28.7335    -1.9156  28.7335       29.7     19.6       29.7       19.6     0.0     0.0 
1 1 1   32    1    0 f    391.9    3.1 1536.2831  24.2638  1536.2831  24.2638  1536.2831  24.2638      391.9      3.1      391.9        3.1     0.0     0.0 
1 1 1   32    1    1 o    440.9    2.3    0.0000   0.0000          ?        ?  1943.6598  20.4327          ?        ?      440.9        2.3       ?       ? 
1 1 1   32    1    2 o   1112.6    4.0    0.0000   0.0000          ?        ? 12380.2959  89.3930          ?        ?     1112.6        4.0       ?       ? 
1 1 1   32    1    3 o   2022.8    6.7    0.0000   0.0000          ?        ? 40926.6836 270.7332          ?        ?     2022.8        6.7       ?       ? 
1 1 1   32    1    4 o   1496.5    5.1    0.0000   0.0000          ?        ? 22396.7852 152.6067          ?        ?     1496.5        5.1       ?       ? 
1 1 1   32    1    5 o   1099.0    3.9    0.0000   0.0000          ?        ? 12078.2754  86.2004          ?        ?     1099.0        3.9       ?       ? 
1 1 1   32    1    6 o    458.5    2.4    0.0000   0.0000          ?        ?  2102.0132  21.7097          ?        ?      458.5        2.4       ?       ? 
1 1 1   32    1    7 o    775.3    3.0    0.0000   0.0000          ?        ?  6011.6812  45.9736          ?        ?      775.3        3.0       ?       ? 
1 1 1   32    1    8 o    999.8    3.7    0.0000   0.0000          ?        ?  9996.0557  73.4300          ?        ?      999.8        3.7       ?       ? 
1 1 1   32    1    9 o   1120.6    4.0    0.0000   0.0000          ?        ? 12559.0820  88.7545          ?        ?     1120.6        4.0       ?       ? 
1 1 1   32    1   10 f    923.6    3.4    0.0000   0.0000          ?        ?  8530.6494  62.5751          ?        ?      923.6        3.4       ?       ? 
1 1 1   32    1   11 o    476.9    2.3    0.0000   0.0000          ?        ?  2274.4141  22.3483          ?        ?      476.9        2.3       ?       ? 
1 1 1   32    1   12 o    500.4    2.4    0.0000   0.0000          ?        ?  2503.6433  24.2638          ?        ?      500.4        2.4       ?       ? 
1 1 1   32    1   13 o    809.8    3.1    0.0000   0.0000          ?        ?  6558.2554  49.8047          ?        ?      809.8        3.1       ?       ? 
1 1 1   32    1   14 o   1270.5    4.4    0.0000   0.0000          ?        ? 16143.7422 113.0183          ?        ?     1270.5        4.4       ?       ? 
1 1 1   32    1   15 o    505.7    2.5    0.0000   0.0000          ?        ?  2557.2791  25.5409          ?        ?      505.7        2.5       ?       ? 
1 1 1   32    1   16 o   1247.6    4.4    0.0000   0.0000          ?        ? 15566.5186 109.1872          ?        ?     1247.6        4.4       ?       ? 
1 1 1   32    1   17 o    649.7    2.8    0.0000   0.0000          ?        ?  4220.6279  35.7572          ?        ?      649.7        2.8       ?       ? 
1 1 1   32    1   18 o   1108.6    4.0    0.0000   0.0000          ?        ? 12290.9033  88.7545          ?        ?     1108.6        4.0       ?       ? 
1 1 1   32    1   19 o    592.0    2.6    0.0000   0.0000          ?        ?  3504.8455  31.2876          ?        ?      592.0        2.6       ?       ? 
1 1 1   32    1   20 o   1231.4    4.4    0.0000   0.0000          ?        ? 15164.8887 107.9102          ?        ?     1231.4        4.4       ?       ? 
1 1 1   32    1   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    1   22 o   1666.3    5.5    0.0000   0.0000          ?        ? 27768.6660 183.8942          ?        ?     1666.3        5.5       ?       ? 
1 1 1   32    1   23 o   1639.9    5.9    0.0000   0.0000          ?        ? 26896.4453 192.1950          ?        ?     1639.9        5.9       ?       ? 
1 1 1   32    1   24 o    713.6    2.9    0.0000   0.0000          ?        ?  5092.8481  41.5039          ?        ?      713.6        2.9       ?       ? 
1 1 1   32    1   25 o    139.8    5.3    0.0000   0.0000          ?        ?   195.3876  14.6860          ?        ?      139.8        5.3       ?       ? 
1 1 1   32    1   26 o    287.7    2.8    0.0000   0.0000          ?        ?   827.5240  15.9630          ?        ?      287.7        2.8       ?       ? 
1 1 1   32    1   27 o    934.1    3.9    0.0000   0.0000          ?        ?  8726.0361  72.7915          ?        ?      934.1        3.9       ?       ? 
1 1 1   32    1   28 o    136.8    5.6    0.0000   0.0000          ?        ?   187.0868  15.3245          ?        ?      136.8        5.6       ?       ? 
1 1 1   32    1   29 o    288.3    3.0    0.0000   0.0000          ?        ?   831.3552  17.2401          ?        ?      288.3        3.0       ?       ? 
1 1 1   32    1   30 o    377.6    2.7    0.0000   0.0000          ?        ?  1425.8188  20.4327          ?        ?      377.6        2.7       ?       ? 
1 1 1   32    1   31 o    574.4    2.8    0.0000   0.0000          ?        ?  3299.8796  32.5646          ?        ?      574.4        2.8       ?       ? 
1 1 1   32    1   32 o    684.4    2.9    0.0000   0.0000          ?        ?  4684.1943  40.2269          ?        ?      684.4        2.9       ?       ? 
1 1 1   32    1   33 o    514.2    2.6    0.0000   0.0000          ?        ?  2644.1182  26.8179          ?        ?      514.2        2.6       ?       ? 
1 1 1   32    1   34 o    449.9    2.8    0.0000   0.0000          ?        ?  2024.1135  25.5409          ?        ?      449.9        2.8       ?       ? 
1 1 1   32    1   35 o     75.8   10.1    0.0000   0.0000          ?        ?    57.4669  15.3245          ?        ?       75.8       10.1       ?       ? 
1 1 1   32    1   36 o    227.0    3.5    0.0000   0.0000          ?        ?   515.2869  15.9630          ?        ?      227.0        3.5       ?       ? 
1 1 1   32    1   37 o    323.3    3.0    0.0000   0.0000          ?        ?  1045.2599  19.1556          ?        ?      323.3        3.0       ?       ? 
1 1 1   32    1   38 o    624.1    2.8    0.0000   0.0000          ?        ?  3894.9819  34.4802          ?        ?      624.1        2.8       ?       ? 
1 1 1   32    1   39 o    706.9    2.9    0.0000   0.0000          ?        ?  4998.3472  40.8654          ?        ?      706.9        2.9       ?       ? 
1 1 1   32    1   40 o    410.6    2.7    0.0000   0.0000          ?        ?  1686.3357  22.3483          ?        ?      410.6        2.7       ?       ? 
1 1 1   32    1   41 o     24.1   11.5    0.0000   0.0000          ?        ?   -22.9868  15.9630          ?        ?       24.1       11.5       ?       ? 
1 1 1   32    1   42 o    292.1    3.1    0.0000   0.0000          ?        ?   853.7034  17.8786          ?        ?      292.1        3.1       ?       ? 
1 1 1   32    1   43 o    597.9    2.8    0.0000   0.0000          ?        ?  3575.7212  33.2031          ?        ?      597.9        2.8       ?       ? 
1 1 1   32    1   44 o    273.8    3.3    0.0000   0.0000          ?        ?   749.6244  17.8786          ?        ?      273.8        3.3       ?       ? 
1 1 1   32    1   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    1   46 o     25.9   12.2    0.0000   0.0000          ?        ?   -16.6016  15.9630          ?        ?       25.9       12.2       ?       ? 
1 1 1   32    1   47 o    509.6    2.8    0.0000   0.0000          ?        ?  2597.5059  28.0950          ?        ?      509.6        2.8       ?       ? 
1 1 1   32    1   48 f    694.2    3.0    0.0000   0.0000          ?        ?  4820.1997  41.5039          ?        ?      694.2        3.0       ?       ? 
1 1 1   32    1   49 o    329.3    2.9    0.0000   0.0000          ?        ?  1084.8481  19.1556          ?        ?      329.3        2.9       ?       ? 
1 1 1   32    1   50 o     28.7   13.0    0.0000   0.0000          ?        ?    -8.9393  15.9630          ?        ?       28.7       13.0       ?       ? 
1 1 1   32    1   51 o    432.2    2.7    0.0000   0.0000          ?        ?  1868.9529  23.6253          ?        ?      432.2        2.7       ?       ? 
1 1 1   32    1   52 o    408.4    2.7    0.0000   0.0000          ?        ?  1668.4569  22.3483          ?        ?      408.4        2.7       ?       ? 
1 1 1   32    1   53 f    328.0    3.2    0.0000   0.0000          ?        ?  1076.5475  21.0712          ?        ?      328.0        3.2       ?       ? 
1 1 1   32    1   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    1   55 o    140.7    6.6    0.0000   0.0000          ?        ?   198.5802  18.5171          ?        ?      140.7        6.6       ?       ? 
1 1 1   32    1   56 o    148.7    6.2    0.0000   0.0000          ?        ?   221.5670  18.5171          ?        ?      148.7        6.2       ?       ? 
1 1 1   32    1   57 o    267.9    3.8    0.0000   0.0000          ?        ?   718.3369  20.4327          ?        ?      267.9        3.8       ?       ? 
1 1 1   32    1   58 o    244.2    4.2    0.0000   0.0000          ?        ?   597.0177  20.4327          ?        ?      244.2        4.2       ?       ? 
1 1 1   32    1   59 o    457.5    2.9    0.0000   0.0000          ?        ?  2094.3508  26.8179          ?        ?      457.5        2.9       ?       ? 
1 1 1   32    1   60 o     26.9   12.9    0.0000   0.0000          ?        ?   -24.9023  19.1556          ?        ?       26.9       12.9       ?       ? 
1 1 1   32    1   61 o    174.3    5.7    0.0000   0.0000          ?        ?   304.5748  19.7942          ?        ?      174.3        5.7       ?       ? 
1 1 1   32    1   62 o    222.8    4.6    0.0000   0.0000          ?        ?   497.4084  20.4327          ?        ?      222.8        4.6       ?       ? 
1 1 1   32    1   63 o    270.0    3.8    0.0000   0.0000          ?        ?   729.8303  20.4327          ?        ?      270.0        3.8       ?       ? 
1 1 1   32    1   64 o     35.0   15.2    0.0000   0.0000          ?        ?    -2.5541  19.7942          ?        ?       35.0       15.2       ?       ? 
1 1 1   32    1   65 o    129.2    7.7    0.0000   0.0000          ?        ?   167.9312  19.7942          ?        ?      129.2        7.7       ?       ? 
1 1 1   32    1   66 o    197.2    5.2    0.0000   0.0000          ?        ?   390.1367  20.4327          ?        ?      197.2        5.2       ?       ? 
1 1 1   32    1   67 o     87.6   11.3    0.0000   0.0000          ?        ?    77.8996  19.7942          ?        ?       87.6       11.3       ?       ? 
1 1 1   32    1   68 o     57.5   16.4    0.0000   0.0000          ?        ?    35.1187  19.7942          ?        ?       57.5       16.4       ?       ? 
1 1 1   32    1   69 o    178.9    5.9    0.0000   0.0000          ?        ?   321.8149  21.0712          ?        ?      178.9        5.9       ?       ? 
1 1 1   32    1   70 o    410.2    3.0    0.0000   0.0000          ?        ?  1685.0586  24.2638          ?        ?      410.2        3.0       ?       ? 
1 1 1   32    1   71 o     29.9   14.0    0.0000   0.0000          ?        ?   -19.7942  21.0712          ?        ?       29.9       14.0       ?       ? 
1 1 1   32    1   72 o     33.3   14.8    0.0000   0.0000          ?        ?    -5.7467  19.7942          ?        ?       33.3       14.8       ?       ? 
1 1 1   32    2    0 o    805.0    4.5 6480.3560  72.7915  6480.3560  72.7915  6480.3560  72.7915      805.0      4.5      805.0        4.5     0.0     0.0 
1 1 1   32    2    1 o    856.7    3.4    0.0000   0.0000          ?        ?  7340.4443  58.7440          ?        ?      856.7        3.4       ?       ? 
1 1 1   32    2    2 o   1533.2    5.4    0.0000   0.0000          ?        ? 23509.7266 166.0156          ?        ?     1533.2        5.4       ?       ? 
1 1 1   32    2    3 o    955.3    3.7    0.0000   0.0000          ?        ?  9125.7510  70.8759          ?        ?      955.3        3.7       ?       ? 
1 1 1   32    2    4 o    524.3    2.6    0.0000   0.0000          ?        ?  2748.8357  27.4564          ?        ?      524.3        2.6       ?       ? 
1 1 1   32    2    5 o   1158.2    4.2    0.0000   0.0000          ?        ? 13415.3398  97.0553          ?        ?     1158.2        4.2       ?       ? 
1 1 1   32    2    6 o    579.2    2.5    0.0000   0.0000          ?        ?  3354.7927  29.3720          ?        ?      579.2        2.5       ?       ? 
1 1 1   32    2    7 o    678.6    2.8    0.0000   0.0000          ?        ?  4605.0181  38.3113          ?        ?      678.6        2.8       ?       ? 
1 1 1   32    2    8 o    599.4    2.6    0.0000   0.0000          ?        ?  3592.9612  31.2876          ?        ?      599.4        2.6       ?       ? 
1 1 1   32    2    9 o   1362.9    4.8    0.0000   0.0000          ?        ? 18577.1484 130.8969          ?        ?     1362.9        4.8       ?       ? 
1 1 1   32    2   10 o   1501.8    5.1    0.0000   0.0000          ?        ? 22557.6914 152.6067          ?        ?     1501.8        5.1       ?       ? 
1 1 1   32    2   11 o    789.2    3.0    0.0000   0.0000          ?        ?  6229.4170  47.8891          ?        ?      789.2        3.0       ?       ? 
1 1 1   32    2   12 o   1341.0    4.6    0.0000   0.0000          ?        ? 17983.3223 122.5962          ?        ?     1341.0        4.6       ?       ? 
1 1 1   32    2   13 f   1270.5    4.4    0.0000   0.0000          ?        ? 16142.4658 111.7413          ?        ?     1270.5        4.4       ?       ? 
1 1 1   32    2   14 o   1047.1    3.8    0.0000   0.0000          ?        ? 10964.6934  79.1767          ?        ?     1047.1        3.8       ?       ? 
1 1 1   32    2   15 o    787.0    3.0    0.0000   0.0000          ?        ?  6194.2983  46.6121          ?        ?      787.0        3.0       ?       ? 
1 1 1   32    2   16 o    933.2    3.4    0.0000   0.0000          ?        ?  8709.4346  63.2136          ?        ?      933.2        3.4       ?       ? 
1 1 1   32    2   17 o   1154.2    4.1    0.0000   0.0000          ?        ? 13322.7539  95.1397          ?        ?     1154.2        4.1       ?       ? 
1 1 1   32    2   18 o    377.6    2.4    0.0000   0.0000          ?        ?  1425.8188  17.8786          ?        ?      377.6        2.4       ?       ? 
1 1 1   32    2   19 o   1321.1    4.6    0.0000   0.0000          ?        ? 17454.6270 121.9576          ?        ?     1321.1        4.6       ?       ? 
1 1 1   32    2   20 o   1110.2    4.1    0.0000   0.0000          ?        ? 12326.6602  90.6701          ?        ?     1110.2        4.1       ?       ? 
1 1 1   32    2   21 o    881.1    3.4    0.0000   0.0000          ?        ?  7763.7847  60.6596          ?        ?      881.1        3.4       ?       ? 
1 1 1   32    2   22 o    434.7    2.6    0.0000   0.0000          ?        ?  1889.3855  22.9868          ?        ?      434.7        2.6       ?       ? 
1 1 1   32    2   23 o    367.8    2.5    0.0000   0.0000          ?        ?  1353.0273  18.5171          ?        ?      367.8        2.5       ?       ? 
1 1 1   32    2   24 o    689.2    3.1    0.0000   0.0000          ?        ?  4749.9624  42.1424          ?        ?      689.2        3.1       ?       ? 
1 1 1   32    2   25 f    276.2    3.1    0.0000   0.0000          ?        ?   763.0333  17.2401          ?        ?      276.2        3.1       ?       ? 
1 1 1   32    2   26 o    881.0    3.7    0.0000   0.0000          ?        ?  7763.1465  65.7677          ?        ?      881.0        3.7       ?       ? 
1 1 1   32    2   27 o    602.7    2.8    0.0000   0.0000          ?        ?  3633.1880  33.2031          ?        ?      602.7        2.8       ?       ? 
1 1 1   32    2   28 o   1023.7    3.9    0.0000   0.0000          ?        ? 10480.0557  79.1767          ?        ?     1023.7        3.9       ?       ? 
1 1 1   32    2   29 o    198.0    4.0    0.0000   0.0000          ?        ?   392.0523  15.9630          ?        ?      198.0        4.0       ?       ? 
1 1 1   32    2   30 o    252.9    3.5    0.0000   0.0000          ?        ?   639.7986  17.8786          ?        ?      252.9        3.5       ?       ? 
1 1 1   32    2   31 f    633.7    3.1    0.0000   0.0000          ?        ?  4015.6626  38.9498          ?        ?      633.7        3.1       ?       ? 
1 1 1   32    2   32 o    289.4    3.1    0.0000   0.0000          ?        ?   837.7404  17.8786          ?        ?      289.4        3.1       ?       ? 
1 1 1   32    2   33 o    115.8    6.9    0.0000   0.0000          ?        ?   134.0895  15.9630          ?        ?      115.8        6.9       ?       ? 
1 1 1   32    2   34 f    682.6    3.0    0.0000   0.0000          ?        ?  4660.5693  40.8654          ?        ?      682.6        3.0       ?       ? 
1 1 1   32    2   35 o    257.7    3.5    0.0000   0.0000          ?        ?   664.0625  17.8786          ?        ?      257.7        3.5       ?       ? 
1 1 1   32    2   36 o    967.7    3.7    0.0000   0.0000          ?        ?  9367.1123  72.1529          ?        ?      967.7        3.7       ?       ? 
1 1 1   32    2   37 o    432.4    2.7    0.0000   0.0000          ?        ?  1869.5912  22.9868          ?        ?      432.4        2.7       ?       ? 
1 1 1   32    2   38 o    663.2    2.8    0.0000   0.0000          ?        ?  4398.7759  37.0343          ?        ?      663.2        2.8       ?       ? 
1 1 1   32    2   39 o     54.8   14.4    0.0000   0.0000          ?        ?    31.2876  15.9630          ?        ?       54.8       14.4       ?       ? 
1 1 1   32    2   40 o    311.3    2.9    0.0000   0.0000          ?        ?   969.2759  17.8786          ?        ?      311.3        2.9       ?       ? 
1 1 1   32    2   41 o    305.3    2.9    0.0000   0.0000          ?        ?   932.2416  17.8786          ?        ?      305.3        2.9       ?       ? 
1 1 1   32    2   42 o    537.3    2.7    0.0000   0.0000          ?        ?  2887.3948  28.7335          ?        ?      537.3        2.7       ?       ? 
1 1 1   32    2   43 o     25.7   12.1    0.0000   0.0000          ?        ?   -19.7942  16.6016          ?        ?       25.7       12.1       ?       ? 
1 1 1   32    2   44 o    359.5    2.7    0.0000   0.0000          ?        ?  1293.0063  19.1556          ?        ?      359.5        2.7       ?       ? 
1 1 1   32    2   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    2   46 o     74.0   10.8    0.0000   0.0000          ?        ?    54.9129  15.9630          ?        ?       74.0       10.8       ?       ? 
1 1 1   32    2   47 o    568.4    2.6    0.0000   0.0000          ?        ?  3231.5581  30.0105          ?        ?      568.4        2.6       ?       ? 
1 1 1   32    2   48 o    244.4    3.5    0.0000   0.0000          ?        ?   597.6562  17.2401          ?        ?      244.4        3.5       ?       ? 
1 1 1   32    2   49 o    175.9    5.1    0.0000   0.0000          ?        ?   309.6830  17.8786          ?        ?      175.9        5.1       ?       ? 
1 1 1   32    2   50 o    310.1    3.0    0.0000   0.0000          ?        ?   962.2521  18.5171          ?        ?      310.1        3.0       ?       ? 
1 1 1   32    2   51 o    137.4    6.5    0.0000   0.0000          ?        ?   189.0024  17.8786          ?        ?      137.4        6.5       ?       ? 
1 1 1   32    2   52 o    115.4    7.5    0.0000   0.0000          ?        ?   133.4510  17.2401          ?        ?      115.4        7.5       ?       ? 
1 1 1   32    2   53 o    378.6    2.9    0.0000   0.0000          ?        ?  1434.1196  21.7097          ?        ?      378.6        2.9       ?       ? 
1 1 1   32    2   54 o    101.8    9.1    0.0000   0.0000          ?        ?   104.0790  18.5171          ?        ?      101.8        9.1       ?       ? 
1 1 1   32    2   55 o    304.5    3.6    0.0000   0.0000          ?        ?   927.7720  21.7097          ?        ?      304.5        3.6       ?       ? 
1 1 1   32    2   56 o    522.3    2.8    0.0000   0.0000          ?        ?  2729.0415  28.7335          ?        ?      522.3        2.8       ?       ? 
1 1 1   32    2   57 o    367.4    3.0    0.0000   0.0000          ?        ?  1350.4733  21.7097          ?        ?      367.4        3.0       ?       ? 
1 1 1   32    2   58 f    236.4    4.2    0.0000   0.0000          ?        ?   559.3449  19.7942          ?        ?      236.4        4.2       ?       ? 
1 1 1   32    2   59 o     21.3   10.7    0.0000   0.0000          ?        ?   -61.9366  20.4327          ?        ?       21.3       10.7       ?       ? 
1 1 1   32    2   60 o    311.1    3.5    0.0000   0.0000          ?        ?   968.6373  21.7097          ?        ?      311.1        3.5       ?       ? 
1 1 1   32    2   61 o    112.4    9.1    0.0000   0.0000          ?        ?   127.0658  20.4327          ?        ?      112.4        9.1       ?       ? 
1 1 1   32    2   62 o     79.0   12.5    0.0000   0.0000          ?        ?    63.2136  19.7942          ?        ?       79.0       12.5       ?       ? 
1 1 1   32    2   63 o    103.4    9.9    0.0000   0.0000          ?        ?   107.9102  20.4327          ?        ?      103.4        9.9       ?       ? 
1 1 1   32    2   64 o     89.5   11.1    0.0000   0.0000          ?        ?    81.0922  19.7942          ?        ?       89.5       11.1       ?       ? 
1 1 1   32    2   65 o     93.2   11.6    0.0000   0.0000          ?        ?    88.1160  21.7097          ?        ?       93.2       11.6       ?       ? 
1 1 1   32    2   66 o     25.8   12.6    0.0000   0.0000          ?        ?   -37.6728  21.0712          ?        ?       25.8       12.6       ?       ? 
1 1 1   32    2   67 o     32.5   14.8    0.0000   0.0000          ?        ?   -12.1319  21.0712          ?        ?       32.5       14.8       ?       ? 
1 1 1   32    2   68 o    223.5    4.9    0.0000   0.0000          ?        ?   501.2395  21.7097          ?        ?      223.5        4.9       ?       ? 
1 1 1   32    2   69 o     84.7   12.1    0.0000   0.0000          ?        ?    73.4300  20.4327          ?        ?       84.7       12.1       ?       ? 
1 1 1   32    2   70 o    157.2    6.5    0.0000   0.0000          ?        ?   249.0234  20.4327          ?        ?      157.2        6.5       ?       ? 
1 1 1   32    2   71 o    298.4    3.5    0.0000   0.0000          ?        ?   892.6533  21.0712          ?        ?      298.4        3.5       ?       ? 
1 1 1   32    3    0 o    657.1    3.8 4318.3218  49.8047  4318.3218  49.8047  4318.3218  49.8047      657.1      3.8      657.1        3.8     0.0     0.0 
1 1 1   32    3    1 o    935.3    3.4    0.0000   0.0000          ?        ?  8748.3848  64.4907          ?        ?      935.3        3.4       ?       ? 
1 1 1   32    3    2 o    279.3    2.4    0.0000   0.0000          ?        ?   780.2734  13.4090          ?        ?      279.3        2.4       ?       ? 
1 1 1   32    3    3 o   1026.2    3.9    0.0000   0.0000          ?        ? 10531.1377  79.1767          ?        ?     1026.2        3.9       ?       ? 
1 1 1   32    3    4 o   2077.2    6.8    0.0000   0.0000          ?        ? 43157.0391 283.5036          ?        ?     2077.2        6.8       ?       ? 
1 1 1   32    3    5 o   1021.2    3.7    0.0000   0.0000          ?        ? 10428.3350  74.7070          ?        ?     1021.2        3.7       ?       ? 
1 1 1   32    3    6 o    171.9    3.0    0.0000   0.0000          ?        ?   295.6355  10.2163          ?        ?      171.9        3.0       ?       ? 
1 1 1   32    3    7 o    896.8    3.3    0.0000   0.0000          ?        ?  8043.4565  58.7440          ?        ?      896.8        3.3       ?       ? 
1 1 1   32    3    8 o    368.0    2.5    0.0000   0.0000          ?        ?  1354.3044  18.5171          ?        ?      368.0        2.5       ?       ? 
1 1 1   32    3    9 o   1685.4    5.6    0.0000   0.0000          ?        ? 28411.0195 190.2794          ?        ?     1685.4        5.6       ?       ? 
1 1 1   32    3   10 o    293.1    2.5    0.0000   0.0000          ?        ?   858.8116  14.6860          ?        ?      293.1        2.5       ?       ? 
1 1 1   32    3   11 o    453.9    2.4    0.0000   0.0000          ?        ?  2059.8708  21.7097          ?        ?      453.9        2.4       ?       ? 
1 1 1   32    3   12 o    998.3    3.6    0.0000   0.0000          ?        ?  9967.3223  72.1529          ?        ?      998.3        3.6       ?       ? 
1 1 1   32    3   13 o    683.7    3.0    0.0000   0.0000          ?        ?  4675.2554  40.8654          ?        ?      683.7        3.0       ?       ? 
1 1 1   32    3   14 o    223.6    2.9    0.0000   0.0000          ?        ?   499.9625  12.7704          ?        ?      223.6        2.9       ?       ? 
1 1 1   32    3   15 o    857.6    3.3    0.0000   0.0000          ?        ?  7355.1309  56.1899          ?        ?      857.6        3.3       ?       ? 
1 1 1   32    3   16 o    357.8    2.4    0.0000   0.0000          ?        ?  1280.2358  17.2401          ?        ?      357.8        2.4       ?       ? 
1 1 1   32    3   17 o    692.1    2.9    0.0000   0.0000          ?        ?  4790.1895  39.5883          ?        ?      692.1        2.9       ?       ? 
1 1 1   32    3   18 o   1082.4    4.0    0.0000   0.0000          ?        ? 11716.8721  86.8389          ?        ?     1082.4        4.0       ?       ? 
1 1 1   32    3   19 o    432.7    2.4    0.0000   0.0000          ?        ?  1872.1455  21.0712          ?        ?      432.7        2.4       ?       ? 
1 1 1   32    3   20 o    926.5    3.6    0.0000   0.0000          ?        ?  8584.9229  66.4062          ?        ?      926.5        3.6       ?       ? 
1 1 1   32    3   21 f    814.3    3.2    0.0000   0.0000          ?        ?  6631.6855  51.7203          ?        ?      814.3        3.2       ?       ? 
1 1 1   32    3   22 f    768.3    3.1    0.0000   0.0000          ?        ?  5903.7710  47.8891          ?        ?      768.3        3.1       ?       ? 
1 1 1   32    3   23 o    949.9    3.6    0.0000   0.0000          ?        ?  9024.2266  68.9603          ?        ?      949.9        3.6       ?       ? 
1 1 1   32    3   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    3   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    3   26 o    845.9    3.4    0.0000   0.0000          ?        ?  7155.9116  56.8284          ?        ?      845.9        3.4       ?       ? 
1 1 1   32    3   27 o    391.0    2.6    0.0000   0.0000          ?        ?  1529.2593  20.4327          ?        ?      391.0        2.6       ?       ? 
1 1 1   32    3   28 o    639.7    2.8    0.0000   0.0000          ?        ?  4092.9236  36.3957          ?        ?      639.7        2.8       ?       ? 
1 1 1   32    3   29 o    690.4    3.1    0.0000   0.0000          ?        ?  4767.2021  42.7809          ?        ?      690.4        3.1       ?       ? 
1 1 1   32    3   30 o    907.1    3.8    0.0000   0.0000          ?        ?  8229.9053  68.3218          ?        ?      907.1        3.8       ?       ? 
1 1 1   32    3   31 o    282.4    3.1    0.0000   0.0000          ?        ?   797.5135  17.2401          ?        ?      282.4        3.1       ?       ? 
1 1 1   32    3   32 o    476.8    2.6    0.0000   0.0000          ?        ?  2273.7756  24.9023          ?        ?      476.8        2.6       ?       ? 
1 1 1   32    3   33 o    342.9    2.9    0.0000   0.0000          ?        ?  1176.1569  19.7942          ?        ?      342.9        2.9       ?       ? 
1 1 1   32    3   34 o    517.7    2.6    0.0000   0.0000          ?        ?  2680.5137  26.8179          ?        ?      517.7        2.6       ?       ? 
1 1 1   32    3   35 f    408.8    2.7    0.0000   0.0000          ?        ?  1671.0112  22.3483          ?        ?      408.8        2.7       ?       ? 
1 1 1   32    3   36 o     93.1    8.6    0.0000   0.0000          ?        ?    86.8389  15.9630          ?        ?       93.1        8.6       ?       ? 
1 1 1   32    3   37 o    470.9    2.7    0.0000   0.0000          ?        ?  2218.2241  25.5409          ?        ?      470.9        2.7       ?       ? 
1 1 1   32    3   38 o    408.7    2.6    0.0000   0.0000          ?        ?  1670.3726  21.0712          ?        ?      408.7        2.6       ?       ? 
1 1 1   32    3   39 o    776.9    3.2    0.0000   0.0000          ?        ?  6036.5835  49.1662          ?        ?      776.9        3.2       ?       ? 
1 1 1   32    3   40 f    172.1    4.8    0.0000   0.0000          ?        ?   296.2740  16.6016          ?        ?      172.1        4.8       ?       ? 
1 1 1   32    3   41 o    492.8    2.6    0.0000   0.0000          ?        ?  2428.9363  25.5409          ?        ?      492.8        2.6       ?       ? 
1 1 1   32    3   42 o    380.8    2.6    0.0000   0.0000          ?        ?  1450.0826  19.7942          ?        ?      380.8        2.6       ?       ? 
1 1 1   32    3   43 o    338.9    2.8    0.0000   0.0000          ?        ?  1148.7003  19.1556          ?        ?      338.9        2.8       ?       ? 
1 1 1   32    3   44 o    219.8    3.8    0.0000   0.0000          ?        ?   483.3608  16.6016          ?        ?      219.8        3.8       ?       ? 
1 1 1   32    3   45 o    366.3    2.7    0.0000   0.0000          ?        ?  1342.1725  19.7942          ?        ?      366.3        2.7       ?       ? 
1 1 1   32    3   46 o    459.2    2.6    0.0000   0.0000          ?        ?  2109.0369  24.2638          ?        ?      459.2        2.6       ?       ? 
1 1 1   32    3   47 o    384.2    2.8    0.0000   0.0000          ?        ?  1476.2620  21.7097          ?        ?      384.2        2.8       ?       ? 
1 1 1   32    3   48 o    276.4    3.3    0.0000   0.0000          ?        ?   764.3104  18.5171          ?        ?      276.4        3.3       ?       ? 
1 1 1   32    3   49 o    120.5    7.2    0.0000   0.0000          ?        ?   145.5829  17.2401          ?        ?      120.5        7.2       ?       ? 
1 1 1   32    3   50 o    627.1    2.9    0.0000   0.0000          ?        ?  3933.9316  35.7572          ?        ?      627.1        2.9       ?       ? 
1 1 1   32    3   51 o    345.3    3.0    0.0000   0.0000          ?        ?  1192.7584  20.4327          ?        ?      345.3        3.0       ?       ? 
1 1 1   32    3   52 o    307.6    3.2    0.0000   0.0000          ?        ?   946.9276  19.7942          ?        ?      307.6        3.2       ?       ? 
1 1 1   32    3   53 o    344.2    3.0    0.0000   0.0000          ?        ?  1185.0962  20.4327          ?        ?      344.2        3.0       ?       ? 
1 1 1   32    3   54 o    368.4    2.9    0.0000   0.0000          ?        ?  1358.1355  21.0712          ?        ?      368.4        2.9       ?       ? 
1 1 1   32    3   55 o    275.4    3.5    0.0000   0.0000          ?        ?   759.2022  19.1556          ?        ?      275.4        3.5       ?       ? 
1 1 1   32    3   56 o    408.3    3.0    0.0000   0.0000          ?        ?  1667.8186  24.2638          ?        ?      408.3        3.0       ?       ? 
1 1 1   32    3   57 o    126.4    7.8    0.0000   0.0000          ?        ?   160.2689  19.7942          ?        ?      126.4        7.8       ?       ? 
1 1 1   32    3   58 o    132.5    7.5    0.0000   0.0000          ?        ?   176.2320  19.7942          ?        ?      132.5        7.5       ?       ? 
1 1 1   32    3   59 o     20.5   10.3    0.0000   0.0000          ?        ?   -59.3825  19.1556          ?        ?       20.5       10.3       ?       ? 
1 1 1   32    3   60 o    189.9    5.2    0.0000   0.0000          ?        ?   361.4032  19.7942          ?        ?      189.9        5.2       ?       ? 
1 1 1   32    3   61 o     26.5   12.8    0.0000   0.0000          ?        ?   -34.4802  21.0712          ?        ?       26.5       12.8       ?       ? 
1 1 1   32    3   62 o     57.8   16.4    0.0000   0.0000          ?        ?    35.1187  19.7942          ?        ?       57.8       16.4       ?       ? 
1 1 1   32    3   63 o     28.9   13.6    0.0000   0.0000          ?        ?   -19.7942  19.7942          ?        ?       28.9       13.6       ?       ? 
1 1 1   32    3   64 o    231.6    4.7    0.0000   0.0000          ?        ?   537.6352  21.7097          ?        ?      231.6        4.7       ?       ? 
1 1 1   32    3   65 o    145.2    7.0    0.0000   0.0000          ?        ?   211.9892  20.4327          ?        ?      145.2        7.0       ?       ? 
1 1 1   32    3   66 o    166.5    6.1    0.0000   0.0000          ?        ?   278.3954  20.4327          ?        ?      166.5        6.1       ?       ? 
1 1 1   32    3   67 o    170.4    6.2    0.0000   0.0000          ?        ?   291.8044  21.0712          ?        ?      170.4        6.2       ?       ? 
1 1 1   32    3   68 o    194.4    5.3    0.0000   0.0000          ?        ?   379.2819  20.4327          ?        ?      194.4        5.3       ?       ? 
1 1 1   32    3   69 o    142.8    7.2    0.0000   0.0000          ?        ?   205.6040  20.4327          ?        ?      142.8        7.2       ?       ? 
1 1 1   32    3   70 o     44.5   16.6    0.0000   0.0000          ?        ?    16.6016  19.7942          ?        ?       44.5       16.6       ?       ? 
1 1 1   32    3   71 o    222.1    4.6    0.0000   0.0000          ?        ?   495.4928  20.4327          ?        ?      222.1        4.6       ?       ? 
1 1 1   32    4    0 o    921.9    5.0 8500.6387  92.5856  8500.6387  92.5856  8500.6387  92.5856      921.9      5.0      921.9        5.0     0.0     0.0 
1 1 1   32    4    1 o    979.2    3.6    0.0000   0.0000          ?        ?  9589.3184  69.5989          ?        ?      979.2        3.6       ?       ? 
1 1 1   32    4    2 o    580.0    2.6    0.0000   0.0000          ?        ?  3364.3706  30.0105          ?        ?      580.0        2.6       ?       ? 
1 1 1   32    4    3 o    238.1    2.8    0.0000   0.0000          ?        ?   567.0072  13.4090          ?        ?      238.1        2.8       ?       ? 
1 1 1   32    4    4 o    442.0    2.3    0.0000   0.0000          ?        ?  1953.8762  20.4327          ?        ?      442.0        2.3       ?       ? 
1 1 1   32    4    5 o    550.9    2.5    0.0000   0.0000          ?        ?  3035.5317  27.4564          ?        ?      550.9        2.5       ?       ? 
1 1 1   32    4    6 o    928.8    3.4    0.0000   0.0000          ?        ?  8627.0654  63.2136          ?        ?      928.8        3.4       ?       ? 
1 1 1   32    4    7 o    967.5    3.5    0.0000   0.0000          ?        ?  9360.7266  68.3218          ?        ?      967.5        3.5       ?       ? 
1 1 1   32    4    8 o   1113.8    4.1    0.0000   0.0000          ?        ? 12405.8369  91.3086          ?        ?     1113.8        4.1       ?       ? 
1 1 1   32    4    9 o   1230.9    4.3    0.0000   0.0000          ?        ? 15152.7578 105.3561          ?        ?     1230.9        4.3       ?       ? 
1 1 1   32    4   10 o    339.5    2.4    0.0000   0.0000          ?        ?  1152.5315  15.9630          ?        ?      339.5        2.4       ?       ? 
1 1 1   32    4   11 o   1458.5    5.2    0.0000   0.0000          ?        ? 21276.1797 151.3296          ?        ?     1458.5        5.2       ?       ? 
1 1 1   32    4   12 o    327.9    2.3    0.0000   0.0000          ?        ?  1075.2704  15.3245          ?        ?      327.9        2.3       ?       ? 
1 1 1   32    4   13 o    937.6    3.5    0.0000   0.0000          ?        ?  8791.1660  65.1292          ?        ?      937.6        3.5       ?       ? 
1 1 1   32    4   14 o    641.7    2.7    0.0000   0.0000          ?        ?  4117.8262  35.1187          ?        ?      641.7        2.7       ?       ? 
1 1 1   32    4   15 o   1064.1    3.9    0.0000   0.0000          ?        ? 11324.8193  83.6463          ?        ?     1064.1        3.9       ?       ? 
1 1 1   32    4   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    4   17 o    704.8    3.0    0.0000   0.0000          ?        ?  4967.0601  42.7809          ?        ?      704.8        3.0       ?       ? 
1 1 1   32    4   18 o    799.2    3.4    0.0000   0.0000          ?        ?  6387.7705  54.2743          ?        ?      799.2        3.4       ?       ? 
1 1 1   32    4   19 o   2138.3    7.6    0.0000   0.0000          ?        ? 45739.2188 326.9231          ?        ?     2138.3        7.6       ?       ? 
1 1 1   32    4   20 f    992.4    3.8    0.0000   0.0000          ?        ?  9849.1963  75.9841          ?        ?      992.4        3.8       ?       ? 
1 1 1   32    4   21 o    382.5    2.4    0.0000   0.0000          ?        ?  1462.8530  18.5171          ?        ?      382.5        2.4       ?       ? 
1 1 1   32    4   22 o    833.6    3.5    0.0000   0.0000          ?        ?  6949.6694  58.1055          ?        ?      833.6        3.5       ?       ? 
1 1 1   32    4   23 o    461.5    2.5    0.0000   0.0000          ?        ?  2129.4697  22.9868          ?        ?      461.5        2.5       ?       ? 
1 1 1   32    4   24 o    369.9    2.5    0.0000   0.0000          ?        ?  1368.3518  18.5171          ?        ?      369.9        2.5       ?       ? 
1 1 1   32    4   25 o    278.6    3.0    0.0000   0.0000          ?        ?   776.4423  16.6016          ?        ?      278.6        3.0       ?       ? 
1 1 1   32    4   26 o    429.4    2.7    0.0000   0.0000          ?        ?  1844.0504  22.9868          ?        ?      429.4        2.7       ?       ? 
1 1 1   32    4   27 o    536.3    2.7    0.0000   0.0000          ?        ?  2875.9014  28.7335          ?        ?      536.3        2.7       ?       ? 
1 1 1   32    4   28 o    317.6    2.8    0.0000   0.0000          ?        ?  1008.8642  17.8786          ?        ?      317.6        2.8       ?       ? 
1 1 1   32    4   29 o   1035.0    4.2    0.0000   0.0000          ?        ? 10713.7549  87.4775          ?        ?     1035.0        4.2       ?       ? 
1 1 1   32    4   30 o    846.1    3.3    0.0000   0.0000          ?        ?  7159.1040  56.1899          ?        ?      846.1        3.3       ?       ? 
1 1 1   32    4   31 o    190.8    4.2    0.0000   0.0000          ?        ?   363.9573  15.9630          ?        ?      190.8        4.2       ?       ? 
1 1 1   32    4   32 o    369.9    2.8    0.0000   0.0000          ?        ?  1368.3518  21.0712          ?        ?      369.9        2.8       ?       ? 
1 1 1   32    4   33 o    322.4    2.9    0.0000   0.0000          ?        ?  1039.5132  18.5171          ?        ?      322.4        2.9       ?       ? 
1 1 1   32    4   34 o    796.1    3.2    0.0000   0.0000          ?        ?  6339.2427  51.0817          ?        ?      796.1        3.2       ?       ? 
1 1 1   32    4   35 o    446.0    2.6    0.0000   0.0000          ?        ?  1989.6334  22.9868          ?        ?      446.0        2.6       ?       ? 
1 1 1   32    4   36 o    162.7    4.9    0.0000   0.0000          ?        ?   264.9865  15.9630          ?        ?      162.7        4.9       ?       ? 
1 1 1   32    4   37 o    478.3    2.6    0.0000   0.0000          ?        ?  2287.8230  24.9023          ?        ?      478.3        2.6       ?       ? 
1 1 1   32    4   38 o    569.3    2.7    0.0000   0.0000          ?        ?  3241.7744  31.2876          ?        ?      569.3        2.7       ?       ? 
1 1 1   32    4   39 o    490.1    2.8    0.0000   0.0000          ?        ?  2402.1184  27.4564          ?        ?      490.1        2.8       ?       ? 
1 1 1   32    4   40 o    254.4    3.4    0.0000   0.0000          ?        ?   647.4609  17.2401          ?        ?      254.4        3.4       ?       ? 
1 1 1   32    4   41 o    914.3    3.4    0.0000   0.0000          ?        ?  8361.4404  62.5751          ?        ?      914.3        3.4       ?       ? 
1 1 1   32    4   42 o    444.4    2.6    0.0000   0.0000          ?        ?  1975.5858  22.9868          ?        ?      444.4        2.6       ?       ? 
1 1 1   32    4   43 o    328.3    2.9    0.0000   0.0000          ?        ?  1077.8246  19.1556          ?        ?      328.3        2.9       ?       ? 
1 1 1   32    4   44 o    289.8    3.1    0.0000   0.0000          ?        ?   840.2945  17.8786          ?        ?      289.8        3.1       ?       ? 
1 1 1   32    4   45 o    318.6    2.9    0.0000   0.0000          ?        ?  1015.2494  18.5171          ?        ?      318.6        2.9       ?       ? 
1 1 1   32    4   46 o    144.0    5.8    0.0000   0.0000          ?        ?   207.5195  16.6016          ?        ?      144.0        5.8       ?       ? 
1 1 1   32    4   47 o    237.3    3.8    0.0000   0.0000          ?        ?   563.1760  17.8786          ?        ?      237.3        3.8       ?       ? 
1 1 1   32    4   48 o    416.5    2.8    0.0000   0.0000          ?        ?  1734.8633  22.9868          ?        ?      416.5        2.8       ?       ? 
1 1 1   32    4   49 o    275.2    3.4    0.0000   0.0000          ?        ?   757.9252  18.5171          ?        ?      275.2        3.4       ?       ? 
1 1 1   32    4   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    4   51 o    339.4    2.9    0.0000   0.0000          ?        ?  1152.5315  19.7942          ?        ?      339.4        2.9       ?       ? 
1 1 1   32    4   52 o    100.6    8.6    0.0000   0.0000          ?        ?   101.5249  17.2401          ?        ?      100.6        8.6       ?       ? 
1 1 1   32    4   53 o     27.6   12.9    0.0000   0.0000          ?        ?   -17.8786  17.8786          ?        ?       27.6       12.9       ?       ? 
1 1 1   32    4   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    4   55 o     53.0   16.1    0.0000   0.0000          ?        ?    28.7335  18.5171          ?        ?       53.0       16.1       ?       ? 
1 1 1   32    4   56 o    545.8    2.8    0.0000   0.0000          ?        ?  2980.6189  30.6490          ?        ?      545.8        2.8       ?       ? 
1 1 1   32    4   57 o    431.3    3.0    0.0000   0.0000          ?        ?  1861.2905  25.5409          ?        ?      431.3        3.0       ?       ? 
1 1 1   32    4   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    4   59 o    195.5    5.1    0.0000   0.0000          ?        ?   383.1130  19.7942          ?        ?      195.5        5.1       ?       ? 
1 1 1   32    4   60 o     21.2   10.6    0.0000   0.0000          ?        ?   -54.2743  19.1556          ?        ?       21.2       10.6       ?       ? 
1 1 1   32    4   61 o     78.2   11.8    0.0000   0.0000          ?        ?    61.9366  18.5171          ?        ?       78.2       11.8       ?       ? 
1 1 1   32    4   62 o    108.3    8.8    0.0000   0.0000          ?        ?   118.1265  19.1556          ?        ?      108.3        8.8       ?       ? 
1 1 1   32    4   63 o    221.6    4.6    0.0000   0.0000          ?        ?   492.3002  20.4327          ?        ?      221.6        4.6       ?       ? 
1 1 1   32    4   64 o     23.6   11.7    0.0000   0.0000          ?        ?   -49.8047  21.0712          ?        ?       23.6       11.7       ?       ? 
1 1 1   32    4   65 o     45.3   17.1    0.0000   0.0000          ?        ?    15.9630  21.0712          ?        ?       45.3       17.1       ?       ? 
1 1 1   32    4   66 o    102.4    9.7    0.0000   0.0000          ?        ?   105.9946  19.7942          ?        ?      102.4        9.7       ?       ? 
1 1 1   32    4   67 o    175.4    6.0    0.0000   0.0000          ?        ?   309.0445  21.0712          ?        ?      175.4        6.0       ?       ? 
1 1 1   32    4   68 o    174.6    6.0    0.0000   0.0000          ?        ?   306.4904  21.0712          ?        ?      174.6        6.0       ?       ? 
1 1 1   32    4   69 o     26.1   12.6    0.0000   0.0000          ?        ?   -32.5646  20.4327          ?        ?       26.1       12.6       ?       ? 
1 1 1   32    4   70 o     30.6   14.0    0.0000   0.0000          ?        ?   -11.4934  19.1556          ?        ?       30.6       14.0       ?       ? 
1 1 1   32    4   71 o     29.3   13.7    0.0000   0.0000          ?        ?   -17.2401  19.7942          ?        ?       29.3       13.7       ?       ? 
1 1 1   32    5    0 o    802.9    4.4 6447.7915  70.8759  6447.7915  70.8759  6447.7915  70.8759      802.9      4.4      802.9        4.4     0.0     0.0 
1 1 1   32    5    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    5    2 o     77.9    9.4    0.0000   0.0000          ?        ?    60.6596  14.6860          ?        ?       77.9        9.4       ?       ? 
1 1 1   32    5    3 o    241.7    2.5    0.0000   0.0000          ?        ?   584.2473  12.1319          ?        ?      241.7        2.5       ?       ? 
1 1 1   32    5    4 o    548.8    2.5    0.0000   0.0000          ?        ?  3011.9065  27.4564          ?        ?      548.8        2.5       ?       ? 
1 1 1   32    5    5 o    416.8    2.5    0.0000   0.0000          ?        ?  1737.4174  20.4327          ?        ?      416.8        2.5       ?       ? 
1 1 1   32    5    6 o    229.9    3.3    0.0000   0.0000          ?        ?   528.6959  15.3245          ?        ?      229.9        3.3       ?       ? 
1 1 1   32    5    7 o    356.5    2.7    0.0000   0.0000          ?        ?  1271.2966  19.1556          ?        ?      356.5        2.7       ?       ? 
1 1 1   32    5    8 o    499.0    2.5    0.0000   0.0000          ?        ?  2489.5957  24.9023          ?        ?      499.0        2.5       ?       ? 
1 1 1   32    5    9 o     15.5    7.8    0.0000   0.0000          ?        ?   -33.2031  10.8549          ?        ?       15.5        7.8       ?       ? 
1 1 1   32    5   10 o    698.6    2.8    0.0000   0.0000          ?        ?  4880.2207  39.5883          ?        ?      698.6        2.8       ?       ? 
1 1 1   32    5   11 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    5   12 o    882.2    3.4    0.0000   0.0000          ?        ?  7782.9404  59.3825          ?        ?      882.2        3.4       ?       ? 
1 1 1   32    5   13 o   1196.1    4.2    0.0000   0.0000          ?        ? 14307.9932 101.5249          ?        ?     1196.1        4.2       ?       ? 
1 1 1   32    5   14 o    852.7    3.3    0.0000   0.0000          ?        ?  7271.4844  56.1899          ?        ?      852.7        3.3       ?       ? 
1 1 1   32    5   15 o   1420.4    5.3    0.0000   0.0000          ?        ? 20179.1992 150.0526          ?        ?     1420.4        5.3       ?       ? 
1 1 1   32    5   16 o   1137.3    4.2    0.0000   0.0000          ?        ? 12935.1719  94.5012          ?        ?     1137.3        4.2       ?       ? 
1 1 1   32    5   17 o    629.1    2.8    0.0000   0.0000          ?        ?  3958.1958  35.7572          ?        ?      629.1        2.8       ?       ? 
1 1 1   32    5   18 o    776.9    3.1    0.0000   0.0000          ?        ?  6035.9448  48.5276          ?        ?      776.9        3.1       ?       ? 
1 1 1   32    5   19 o    497.2    2.6    0.0000   0.0000          ?        ?  2472.3557  25.5409          ?        ?      497.2        2.6       ?       ? 
1 1 1   32    5   20 o    944.1    3.8    0.0000   0.0000          ?        ?  8913.7617  70.8759          ?        ?      944.1        3.8       ?       ? 
1 1 1   32    5   21 o    330.0    2.5    0.0000   0.0000          ?        ?  1089.3180  16.6016          ?        ?      330.0        2.5       ?       ? 
1 1 1   32    5   22 o    394.5    2.5    0.0000   0.0000          ?        ?  1556.7157  19.7942          ?        ?      394.5        2.5       ?       ? 
1 1 1   32    5   23 o   1150.4    4.2    0.0000   0.0000          ?        ? 13235.9141  97.6938          ?        ?     1150.4        4.2       ?       ? 
1 1 1   32    5   24 o    130.3    5.1    0.0000   0.0000          ?        ?   169.8468  13.4090          ?        ?      130.3        5.1       ?       ? 
1 1 1   32    5   25 o    670.3    2.8    0.0000   0.0000          ?        ?  4493.2769  37.6728          ?        ?      670.3        2.8       ?       ? 
1 1 1   32    5   26 o    438.6    2.5    0.0000   0.0000          ?        ?  1923.8656  21.7097          ?        ?      438.6        2.5       ?       ? 
1 1 1   32    5   27 o    287.3    2.8    0.0000   0.0000          ?        ?   825.6085  15.9630          ?        ?      287.3        2.8       ?       ? 
1 1 1   32    5   28 o    418.9    2.7    0.0000   0.0000          ?        ?  1755.2959  22.3483          ?        ?      418.9        2.7       ?       ? 
1 1 1   32    5   29 o    569.6    2.7    0.0000   0.0000          ?        ?  3244.9670  30.6490          ?        ?      569.6        2.7       ?       ? 
1 1 1   32    5   30 f    410.6    2.6    0.0000   0.0000          ?        ?  1686.3357  21.7097          ?        ?      410.6        2.6       ?       ? 
1 1 1   32    5   31 f    717.7    3.0    0.0000   0.0000          ?        ?  5150.9541  42.7809          ?        ?      717.7        3.0       ?       ? 
1 1 1   32    5   32 o    363.0    2.7    0.0000   0.0000          ?        ?  1317.9086  19.7942          ?        ?      363.0        2.7       ?       ? 
1 1 1   32    5   33 o    243.7    3.3    0.0000   0.0000          ?        ?   593.8251  15.9630          ?        ?      243.7        3.3       ?       ? 
1 1 1   32    5   34 o    235.3    3.4    0.0000   0.0000          ?        ?   553.5982  15.9630          ?        ?      235.3        3.4       ?       ? 
1 1 1   32    5   35 o    322.6    2.9    0.0000   0.0000          ?        ?  1040.7903  18.5171          ?        ?      322.6        2.9       ?       ? 
1 1 1   32    5   36 o    289.5    3.0    0.0000   0.0000          ?        ?   838.3789  17.2401          ?        ?      289.5        3.0       ?       ? 
1 1 1   32    5   37 o    210.0    3.8    0.0000   0.0000          ?        ?   441.2184  15.9630          ?        ?      210.0        3.8       ?       ? 
1 1 1   32    5   38 o    204.3    3.9    0.0000   0.0000          ?        ?   417.5931  15.9630          ?        ?      204.3        3.9       ?       ? 
1 1 1   32    5   39 o    504.3    2.7    0.0000   0.0000          ?        ?  2543.2314  26.8179          ?        ?      504.3        2.7       ?       ? 
1 1 1   32    5   40 o    389.7    2.7    0.0000   0.0000          ?        ?  1519.0430  21.0712          ?        ?      389.7        2.7       ?       ? 
1 1 1   32    5   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    5   42 o    282.1    3.1    0.0000   0.0000          ?        ?   796.2365  17.2401          ?        ?      282.1        3.1       ?       ? 
1 1 1   32    5   43 o    300.2    2.9    0.0000   0.0000          ?        ?   901.5925  17.2401          ?        ?      300.2        2.9       ?       ? 
1 1 1   32    5   44 o    130.0    6.1    0.0000   0.0000          ?        ?   169.2082  15.9630          ?        ?      130.0        6.1       ?       ? 
1 1 1   32    5   45 o    428.6    2.6    0.0000   0.0000          ?        ?  1837.0269  22.3483          ?        ?      428.6        2.6       ?       ? 
1 1 1   32    5   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    5   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    5   48 o    125.0    6.6    0.0000   0.0000          ?        ?   156.4378  16.6016          ?        ?      125.0        6.6       ?       ? 
1 1 1   32    5   49 o    417.0    2.8    0.0000   0.0000          ?        ?  1739.3329  22.9868          ?        ?      417.0        2.8       ?       ? 
1 1 1   32    5   50 o     18.6    9.4    0.0000   0.0000          ?        ?   -59.3825  17.2401          ?        ?       18.6        9.4       ?       ? 
1 1 1   32    5   51 o    259.2    3.7    0.0000   0.0000          ?        ?   672.3633  19.1556          ?        ?      259.2        3.7       ?       ? 
1 1 1   32    5   52 o     28.5   13.3    0.0000   0.0000          ?        ?   -17.2401  18.5171          ?        ?       28.5       13.3       ?       ? 
1 1 1   32    5   53 o    168.4    5.1    0.0000   0.0000          ?        ?   284.1421  17.2401          ?        ?      168.4        5.1       ?       ? 
1 1 1   32    5   54 o    412.3    2.8    0.0000   0.0000          ?        ?  1700.3831  22.9868          ?        ?      412.3        2.8       ?       ? 
1 1 1   32    5   55 o    343.1    3.1    0.0000   0.0000          ?        ?  1178.0724  21.0712          ?        ?      343.1        3.1       ?       ? 
1 1 1   32    5   56 f    254.7    4.0    0.0000   0.0000          ?        ?   649.3765  20.4327          ?        ?      254.7        4.0       ?       ? 
1 1 1   32    5   57 o    164.0    5.8    0.0000   0.0000          ?        ?   269.4561  19.1556          ?        ?      164.0        5.8       ?       ? 
1 1 1   32    5   58 o    182.4    5.4    0.0000   0.0000          ?        ?   333.3083  19.7942          ?        ?      182.4        5.4       ?       ? 
1 1 1   32    5   59 o     64.1   15.2    0.0000   0.0000          ?        ?    43.4195  19.1556          ?        ?       64.1       15.2       ?       ? 
1 1 1   32    5   60 o     19.4    9.8    0.0000   0.0000          ?        ?   -67.6833  19.1556          ?        ?       19.4        9.8       ?       ? 
1 1 1   32    5   61 o    131.4    7.8    0.0000   0.0000          ?        ?   173.6779  20.4327          ?        ?      131.4        7.8       ?       ? 
1 1 1   32    5   62 o    149.2    6.6    0.0000   0.0000          ?        ?   223.4826  19.7942          ?        ?      149.2        6.6       ?       ? 
1 1 1   32    5   63 o    220.6    4.8    0.0000   0.0000          ?        ?   487.8305  21.0712          ?        ?      220.6        4.8       ?       ? 
1 1 1   32    5   64 o    170.9    5.8    0.0000   0.0000          ?        ?   293.0815  19.7942          ?        ?      170.9        5.8       ?       ? 
1 1 1   32    5   65 o    132.3    7.5    0.0000   0.0000          ?        ?   176.2320  19.7942          ?        ?      132.3        7.5       ?       ? 
1 1 1   32    5   66 o    127.8    8.0    0.0000   0.0000          ?        ?   164.7386  20.4327          ?        ?      127.8        8.0       ?       ? 
1 1 1   32    5   67 o    192.0    5.5    0.0000   0.0000          ?        ?   370.3425  21.0712          ?        ?      192.0        5.5       ?       ? 
1 1 1   32    5   68 o     23.7   11.7    0.0000   0.0000          ?        ?   -41.5039  19.7942          ?        ?       23.7       11.7       ?       ? 
1 1 1   32    5   69 o     50.9   17.0    0.0000   0.0000          ?        ?    26.1794  20.4327          ?        ?       50.9       17.0       ?       ? 
1 1 1   32    5   70 f    131.0    7.6    0.0000   0.0000          ?        ?   173.6779  19.7942          ?        ?      131.0        7.6       ?       ? 
1 1 1   32    6    0 o   1098.6    5.6 12069.9746 122.5962 12069.9746 122.5962 12069.9746 122.5962     1098.6      5.6     1098.6        5.6     0.0     0.0 
1 1 1   32    6    1 o    610.2    2.8    0.0000   0.0000          ?        ?  3723.2195  34.4802          ?        ?      610.2        2.8       ?       ? 
1 1 1   32    6    2 o    227.4    2.7    0.0000   0.0000          ?        ?   517.2025  12.1319          ?        ?      227.4        2.7       ?       ? 
1 1 1   32    6    3 o    128.3    3.7    0.0000   0.0000          ?        ?   164.7386   9.5778          ?        ?      128.3        3.7       ?       ? 
1 1 1   32    6    4 o    959.0    3.6    0.0000   0.0000          ?        ?  9197.2656  69.5989          ?        ?      959.0        3.6       ?       ? 
1 1 1   32    6    5 o     93.5    5.5    0.0000   0.0000          ?        ?    87.4775  10.2163          ?        ?       93.5        5.5       ?       ? 
1 1 1   32    6    6 o    494.9    2.5    0.0000   0.0000          ?        ?  2449.3689  24.9023          ?        ?      494.9        2.5       ?       ? 
1 1 1   32    6    7 o    362.4    2.3    0.0000   0.0000          ?        ?  1313.4390  16.6016          ?        ?      362.4        2.3       ?       ? 
1 1 1   32    6    8 f    424.7    2.5    0.0000   0.0000          ?        ?  1803.8236  21.0712          ?        ?      424.7        2.5       ?       ? 
1 1 1   32    6    9 o   1354.4    4.8    0.0000   0.0000          ?        ? 18347.2793 129.6199          ?        ?     1354.4        4.8       ?       ? 
1 1 1   32    6   10 o    258.4    2.5    0.0000   0.0000          ?        ?   667.8936  12.7704          ?        ?      258.4        2.5       ?       ? 
1 1 1   32    6   11 o   1471.1    5.3    0.0000   0.0000          ?        ? 21645.2441 156.4378          ?        ?     1471.1        5.3       ?       ? 
1 1 1   32    6   12 o    252.4    2.7    0.0000   0.0000          ?        ?   637.2446  13.4090          ?        ?      252.4        2.7       ?       ? 
1 1 1   32    6   13 o   1168.0    4.2    0.0000   0.0000          ?        ? 13642.6533  97.6938          ?        ?     1168.0        4.2       ?       ? 
1 1 1   32    6   14 o    597.0    3.0    0.0000   0.0000          ?        ?  3564.2278  35.7572          ?        ?      597.0        3.0       ?       ? 
1 1 1   32    6   15 o    986.9    3.9    0.0000   0.0000          ?        ?  9740.6475  77.8996          ?        ?      986.9        3.9       ?       ? 
1 1 1   32    6   16 o   1025.5    3.9    0.0000   0.0000          ?        ? 10517.0898  79.8152          ?        ?     1025.5        3.9       ?       ? 
1 1 1   32    6   17 o   1336.2    4.7    0.0000   0.0000          ?        ? 17855.6172 125.1502          ?        ?     1336.2        4.7       ?       ? 
1 1 1   32    6   18 o    819.6    3.4    0.0000   0.0000          ?        ?  6717.8857  55.5514          ?        ?      819.6        3.4       ?       ? 
1 1 1   32    6   19 o   1170.5    4.5    0.0000   0.0000          ?        ? 13702.0352 105.3561          ?        ?     1170.5        4.5       ?       ? 
1 1 1   32    6   20 o    328.6    2.6    0.0000   0.0000          ?        ?  1079.7401  17.2401          ?        ?      328.6        2.6       ?       ? 
1 1 1   32    6   21 o    458.6    2.5    0.0000   0.0000          ?        ?  2103.2903  22.9868          ?        ?      458.6        2.5       ?       ? 
1 1 1   32    6   22 o    463.9    2.5    0.0000   0.0000          ?        ?  2152.4565  22.9868          ?        ?      463.9        2.5       ?       ? 
1 1 1   32    6   23 o    514.7    2.7    0.0000   0.0000          ?        ?  2649.2261  28.0950          ?        ?      514.7        2.7       ?       ? 
1 1 1   32    6   24 o    569.6    2.7    0.0000   0.0000          ?        ?  3244.3284  30.6490          ?        ?      569.6        2.7       ?       ? 
1 1 1   32    6   25 o     70.5   10.0    0.0000   0.0000          ?        ?    49.8047  14.0475          ?        ?       70.5       10.0       ?       ? 
1 1 1   32    6   26 o    252.2    3.4    0.0000   0.0000          ?        ?   635.9675  17.2401          ?        ?      252.2        3.4       ?       ? 
1 1 1   32    6   27 o    660.3    3.1    0.0000   0.0000          ?        ?  4360.4644  40.8654          ?        ?      660.3        3.1       ?       ? 
1 1 1   32    6   28 o    378.3    2.5    0.0000   0.0000          ?        ?  1430.9270  19.1556          ?        ?      378.3        2.5       ?       ? 
1 1 1   32    6   29 o    257.6    3.1    0.0000   0.0000          ?        ?   663.4240  15.9630          ?        ?      257.6        3.1       ?       ? 
1 1 1   32    6   30 f    374.9    2.8    0.0000   0.0000          ?        ?  1406.0247  21.0712          ?        ?      374.9        2.8       ?       ? 
1 1 1   32    6   31 o    739.7    3.0    0.0000   0.0000          ?        ?  5472.1304  44.6965          ?        ?      739.7        3.0       ?       ? 
1 1 1   32    6   32 o    361.2    2.7    0.0000   0.0000          ?        ?  1305.1382  19.7942          ?        ?      361.2        2.7       ?       ? 
1 1 1   32    6   33 o    448.1    2.6    0.0000   0.0000          ?        ?  2008.1505  22.9868          ?        ?      448.1        2.6       ?       ? 
1 1 1   32    6   34 o    387.9    2.7    0.0000   0.0000          ?        ?  1504.9955  21.0712          ?        ?      387.9        2.7       ?       ? 
1 1 1   32    6   35 o    233.8    3.6    0.0000   0.0000          ?        ?   546.5745  16.6016          ?        ?      233.8        3.6       ?       ? 
1 1 1   32    6   36 o    406.7    2.7    0.0000   0.0000          ?        ?  1654.4095  21.7097          ?        ?      406.7        2.7       ?       ? 
1 1 1   32    6   37 o    299.4    2.9    0.0000   0.0000          ?        ?   896.4843  17.2401          ?        ?      299.4        2.9       ?       ? 
1 1 1   32    6   38 f    292.9    2.9    0.0000   0.0000          ?        ?   858.1730  17.2401          ?        ?      292.9        2.9       ?       ? 
1 1 1   32    6   39 o    405.8    2.6    0.0000   0.0000          ?        ?  1647.3857  21.0712          ?        ?      405.8        2.6       ?       ? 
1 1 1   32    6   40 o    337.7    2.7    0.0000   0.0000          ?        ?  1140.3997  18.5171          ?        ?      337.7        2.7       ?       ? 
1 1 1   32    6   41 o    245.2    3.5    0.0000   0.0000          ?        ?   601.4874  17.2401          ?        ?      245.2        3.5       ?       ? 
1 1 1   32    6   42 o    660.0    2.8    0.0000   0.0000          ?        ?  4356.6328  37.0343          ?        ?      660.0        2.8       ?       ? 
1 1 1   32    6   43 o     60.0   13.6    0.0000   0.0000          ?        ?    37.6728  15.9630          ?        ?       60.0       13.6       ?       ? 
1 1 1   32    6   44 o    465.0    2.6    0.0000   0.0000          ?        ?  2162.6729  24.2638          ?        ?      465.0        2.6       ?       ? 
1 1 1   32    6   45 o     46.0   15.1    0.0000   0.0000          ?        ?    20.4327  15.9630          ?        ?       46.0       15.1       ?       ? 
1 1 1   32    6   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    6   47 o    739.3    3.0    0.0000   0.0000          ?        ?  5467.6606  44.6965          ?        ?      739.3        3.0       ?       ? 
1 1 1   32    6   48 o    437.3    2.6    0.0000   0.0000          ?        ?  1913.0109  22.9868          ?        ?      437.3        2.6       ?       ? 
1 1 1   32    6   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    6   50 o    535.4    2.6    0.0000   0.0000          ?        ?  2867.6006  28.0950          ?        ?      535.4        2.6       ?       ? 
1 1 1   32    6   51 o    312.0    3.2    0.0000   0.0000          ?        ?   973.7455  19.7942          ?        ?      312.0        3.2       ?       ? 
1 1 1   32    6   52 o     89.5    9.6    0.0000   0.0000          ?        ?    80.4537  17.2401          ?        ?       89.5        9.6       ?       ? 
1 1 1   32    6   53 o    271.1    3.5    0.0000   0.0000          ?        ?   735.5769  19.1556          ?        ?      271.1        3.5       ?       ? 
1 1 1   32    6   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    6   55 o    389.6    3.0    0.0000   0.0000          ?        ?  1518.4044  22.9868          ?        ?      389.6        3.0       ?       ? 
1 1 1   32    6   56 o    206.7    4.5    0.0000   0.0000          ?        ?   427.8095  18.5171          ?        ?      206.7        4.5       ?       ? 
1 1 1   32    6   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    6   58 o    296.0    3.7    0.0000   0.0000          ?        ?   877.3287  21.7097          ?        ?      296.0        3.7       ?       ? 
1 1 1   32    6   59 f    170.4    5.8    0.0000   0.0000          ?        ?   291.1659  19.7942          ?        ?      170.4        5.8       ?       ? 
1 1 1   32    6   60 o    306.7    3.4    0.0000   0.0000          ?        ?   941.8194  21.0712          ?        ?      306.7        3.4       ?       ? 
1 1 1   32    6   61 o     29.9   13.8    0.0000   0.0000          ?        ?   -14.6860  19.1556          ?        ?       29.9       13.8       ?       ? 
1 1 1   32    6   62 o    496.4    2.8    0.0000   0.0000          ?        ?  2465.9707  28.0950          ?        ?      496.4        2.8       ?       ? 
1 1 1   32    6   63 o    141.7    7.2    0.0000   0.0000          ?        ?   201.7728  20.4327          ?        ?      141.7        7.2       ?       ? 
1 1 1   32    6   64 o    193.5    5.3    0.0000   0.0000          ?        ?   375.4507  20.4327          ?        ?      193.5        5.3       ?       ? 
1 1 1   32    6   65 o     31.0   14.3    0.0000   0.0000          ?        ?   -14.6860  20.4327          ?        ?       31.0       14.3       ?       ? 
1 1 1   32    6   66 o     92.4   11.1    0.0000   0.0000          ?        ?    86.8389  20.4327          ?        ?       92.4       11.1       ?       ? 
1 1 1   32    6   67 f     82.5   12.4    0.0000   0.0000          ?        ?    69.5989  20.4327          ?        ?       82.5       12.4       ?       ? 
1 1 1   32    6   68 o    190.3    5.4    0.0000   0.0000          ?        ?   363.9573  20.4327          ?        ?      190.3        5.4       ?       ? 
1 1 1   32    6   69 o     31.1   14.1    0.0000   0.0000          ?        ?   -10.2163  19.1556          ?        ?       31.1       14.1       ?       ? 
1 1 1   32    6   70 o    109.8    9.0    0.0000   0.0000          ?        ?   122.5962  19.7942          ?        ?      109.8        9.0       ?       ? 
1 1 1   32    7    0 o    638.1    4.0 4071.8525  50.4432  4071.8525  50.4432  4071.8525  50.4432      638.1      4.0      638.1        4.0     0.0     0.0 
1 1 1   32    7    1 o    982.1    3.6    0.0000   0.0000          ?        ?  9644.8691  71.5144          ?        ?      982.1        3.6       ?       ? 
1 1 1   32    7    2 o    872.6    3.6    0.0000   0.0000          ?        ?  7614.3706  63.2136          ?        ?      872.6        3.6       ?       ? 
1 1 1   32    7    3 o    337.5    2.3    0.0000   0.0000          ?        ?  1139.1226  15.3245          ?        ?      337.5        2.3       ?       ? 
1 1 1   32    7    4 f    460.3    2.5    0.0000   0.0000          ?        ?  2119.2532  22.9868          ?        ?      460.3        2.5       ?       ? 
1 1 1   32    7    5 o    300.9    2.3    0.0000   0.0000          ?        ?   905.4237  14.0475          ?        ?      300.9        2.3       ?       ? 
1 1 1   32    7    6 o    733.6    3.1    0.0000   0.0000          ?        ?  5382.0991  45.3350          ?        ?      733.6        3.1       ?       ? 
1 1 1   32    7    7 o    585.9    2.9    0.0000   0.0000          ?        ?  3433.3308  33.8416          ?        ?      585.9        2.9       ?       ? 
1 1 1   32    7    8 o   1777.5    6.6    0.0000   0.0000          ?        ? 31602.9883 235.6145          ?        ?     1777.5        6.6       ?       ? 
1 1 1   32    7    9 o   1186.1    4.4    0.0000   0.0000          ?        ? 14070.4629 104.0790          ?        ?     1186.1        4.4       ?       ? 
1 1 1   32    7   10 o    551.7    2.7    0.0000   0.0000          ?        ?  3043.8328  30.0105          ?        ?      551.7        2.7       ?       ? 
1 1 1   32    7   11 o   1449.9    5.2    0.0000   0.0000          ?        ? 21025.8789 150.0526          ?        ?     1449.9        5.2       ?       ? 
1 1 1   32    7   12 o    330.6    2.6    0.0000   0.0000          ?        ?  1093.1490  17.2401          ?        ?      330.6        2.6       ?       ? 
1 1 1   32    7   13 o    683.3    2.9    0.0000   0.0000          ?        ?  4669.5088  40.2269          ?        ?      683.3        2.9       ?       ? 
1 1 1   32    7   14 o    859.6    3.6    0.0000   0.0000          ?        ?  7389.6113  61.9366          ?        ?      859.6        3.6       ?       ? 
1 1 1   32    7   15 o   1609.9    6.1    0.0000   0.0000          ?        ? 25925.2539 195.3876          ?        ?     1609.9        6.1       ?       ? 
1 1 1   32    7   16 o   1261.3    4.7    0.0000   0.0000          ?        ? 15910.0430 118.7650          ?        ?     1261.3        4.7       ?       ? 
1 1 1   32    7   17 o    404.1    2.6    0.0000   0.0000          ?        ?  1632.6998  21.0712          ?        ?      404.1        2.6       ?       ? 
1 1 1   32    7   18 o   1233.8    4.5    0.0000   0.0000          ?        ? 15224.2715 111.7413          ?        ?     1233.8        4.5       ?       ? 
1 1 1   32    7   19 o    612.4    2.9    0.0000   0.0000          ?        ?  3750.6763  35.7572          ?        ?      612.4        2.9       ?       ? 
1 1 1   32    7   20 o    268.1    2.6    0.0000   0.0000          ?        ?   718.9753  14.0475          ?        ?      268.1        2.6       ?       ? 
1 1 1   32    7   21 o    613.0    2.7    0.0000   0.0000          ?        ?  3758.3381  32.5646          ?        ?      613.0        2.7       ?       ? 
1 1 1   32    7   22 o    506.4    2.6    0.0000   0.0000          ?        ?  2564.3030  26.8179          ?        ?      506.4        2.6       ?       ? 
1 1 1   32    7   23 o    781.0    3.4    0.0000   0.0000          ?        ?  6099.7969  52.3588          ?        ?      781.0        3.4       ?       ? 
1 1 1   32    7   24 o    273.4    2.8    0.0000   0.0000          ?        ?   747.7088  15.3245          ?        ?      273.4        2.8       ?       ? 
1 1 1   32    7   25 o    944.8    3.8    0.0000   0.0000          ?        ?  8927.8086  72.1529          ?        ?      944.8        3.8       ?       ? 
1 1 1   32    7   26 o    432.5    2.6    0.0000   0.0000          ?        ?  1870.8684  22.3483          ?        ?      432.5        2.6       ?       ? 
1 1 1   32    7   27 o     88.2    9.0    0.0000   0.0000          ?        ?    77.8996  15.9630          ?        ?       88.2        9.0       ?       ? 
1 1 1   32    7   28 o    457.5    2.9    0.0000   0.0000          ?        ?  2093.0737  26.1794          ?        ?      457.5        2.9       ?       ? 
1 1 1   32    7   29 o    680.7    2.9    0.0000   0.0000          ?        ?  4634.3896  38.9498          ?        ?      680.7        2.9       ?       ? 
1 1 1   32    7   30 o    814.6    3.3    0.0000   0.0000          ?        ?  6636.1558  52.9973          ?        ?      814.6        3.3       ?       ? 
1 1 1   32    7   31 o    681.3    2.8    0.0000   0.0000          ?        ?  4642.0522  38.3113          ?        ?      681.3        2.8       ?       ? 
1 1 1   32    7   32 o    834.8    3.2    0.0000   0.0000          ?        ?  6970.7402  52.9973          ?        ?      834.8        3.2       ?       ? 
1 1 1   32    7   33 o    110.4    6.4    0.0000   0.0000          ?        ?   121.9576  14.0475          ?        ?      110.4        6.4       ?       ? 
1 1 1   32    7   34 o    718.1    3.1    0.0000   0.0000          ?        ?  5157.3394  44.0580          ?        ?      718.1        3.1       ?       ? 
1 1 1   32    7   35 o    262.0    3.2    0.0000   0.0000          ?        ?   686.4108  16.6016          ?        ?      262.0        3.2       ?       ? 
1 1 1   32    7   36 o    356.1    2.9    0.0000   0.0000          ?        ?  1268.1040  20.4327          ?        ?      356.1        2.9       ?       ? 
1 1 1   32    7   37 o    550.3    2.7    0.0000   0.0000          ?        ?  3029.1465  29.3720          ?        ?      550.3        2.7       ?       ? 
1 1 1   32    7   38 o     32.5   14.0    0.0000   0.0000          ?        ?    -1.9156  16.6016          ?        ?       32.5       14.0       ?       ? 
1 1 1   32    7   39 o    374.3    2.8    0.0000   0.0000          ?        ?  1401.5549  21.0712          ?        ?      374.3        2.8       ?       ? 
1 1 1   32    7   40 o     20.1   10.0    0.0000   0.0000          ?        ?   -37.0343  15.3245          ?        ?       20.1       10.0       ?       ? 
1 1 1   32    7   41 o    503.5    2.6    0.0000   0.0000          ?        ?  2535.5693  26.1794          ?        ?      503.5        2.6       ?       ? 
1 1 1   32    7   42 o    206.6    4.0    0.0000   0.0000          ?        ?   427.1710  16.6016          ?        ?      206.6        4.0       ?       ? 
1 1 1   32    7   43 o    537.0    2.7    0.0000   0.0000          ?        ?  2884.2021  28.7335          ?        ?      537.0        2.7       ?       ? 
1 1 1   32    7   44 o    289.3    3.0    0.0000   0.0000          ?        ?   837.1019  17.2401          ?        ?      289.3        3.0       ?       ? 
1 1 1   32    7   45 o    400.1    2.7    0.0000   0.0000          ?        ?  1601.4122  21.7097          ?        ?      400.1        2.7       ?       ? 
1 1 1   32    7   46 o    358.5    2.8    0.0000   0.0000          ?        ?  1285.3440  19.7942          ?        ?      358.5        2.8       ?       ? 
1 1 1   32    7   47 o    369.0    2.8    0.0000   0.0000          ?        ?  1361.9667  20.4327          ?        ?      369.0        2.8       ?       ? 
1 1 1   32    7   48 o    179.8    4.6    0.0000   0.0000          ?        ?   323.7305  16.6016          ?        ?      179.8        4.6       ?       ? 
1 1 1   32    7   49 o    353.0    2.8    0.0000   0.0000          ?        ?  1246.3942  19.7942          ?        ?      353.0        2.8       ?       ? 
1 1 1   32    7   50 o     47.4   15.7    0.0000   0.0000          ?        ?    21.7097  17.2401          ?        ?       47.4       15.7       ?       ? 
1 1 1   32    7   51 f    343.3    3.1    0.0000   0.0000          ?        ?  1179.3494  21.0712          ?        ?      343.3        3.1       ?       ? 
1 1 1   32    7   52 o     57.3   14.9    0.0000   0.0000          ?        ?    34.4802  17.2401          ?        ?       57.3       14.9       ?       ? 
1 1 1   32    7   53 f    125.2    6.9    0.0000   0.0000          ?        ?   157.0763  17.2401          ?        ?      125.2        6.9       ?       ? 
1 1 1   32    7   54 o    215.0    4.5    0.0000   0.0000          ?        ?   462.9282  19.1556          ?        ?      215.0        4.5       ?       ? 
1 1 1   32    7   55 o    184.7    5.2    0.0000   0.0000          ?        ?   341.6091  19.1556          ?        ?      184.7        5.2       ?       ? 
1 1 1   32    7   56 o    245.2    4.0    0.0000   0.0000          ?        ?   602.1259  19.7942          ?        ?      245.2        4.0       ?       ? 
1 1 1   32    7   57 o    154.7    6.2    0.0000   0.0000          ?        ?   240.0841  19.1556          ?        ?      154.7        6.2       ?       ? 
1 1 1   32    7   58 o     56.3   15.8    0.0000   0.0000          ?        ?    33.2031  18.5171          ?        ?       56.3       15.8       ?       ? 
1 1 1   32    7   59 o     28.4   13.4    0.0000   0.0000          ?        ?   -24.2638  20.4327          ?        ?       28.4       13.4       ?       ? 
1 1 1   32    7   60 o    244.3    4.3    0.0000   0.0000          ?        ?   597.6562  21.0712          ?        ?      244.3        4.3       ?       ? 
1 1 1   32    7   61 o    199.4    5.1    0.0000   0.0000          ?        ?   398.4375  20.4327          ?        ?      199.4        5.1       ?       ? 
1 1 1   32    7   62 o     80.1   12.4    0.0000   0.0000          ?        ?    65.1292  19.7942          ?        ?       80.1       12.4       ?       ? 
1 1 1   32    7   63 o    133.7    7.6    0.0000   0.0000          ?        ?   180.0631  20.4327          ?        ?      133.7        7.6       ?       ? 
1 1 1   32    7   64 o     69.3   14.7    0.0000   0.0000          ?        ?    51.0817  19.7942          ?        ?       69.3       14.7       ?       ? 
1 1 1   32    7   65 o    230.3    4.4    0.0000   0.0000          ?        ?   531.8885  20.4327          ?        ?      230.3        4.4       ?       ? 
1 1 1   32    7   66 o    126.3    7.8    0.0000   0.0000          ?        ?   160.9075  19.7942          ?        ?      126.3        7.8       ?       ? 
1 1 1   32    7   67 o     30.7   14.1    0.0000   0.0000          ?        ?   -13.4090  19.7942          ?        ?       30.7       14.1       ?       ? 
1 1 1   32    7   68 o    134.2    7.6    0.0000   0.0000          ?        ?   181.9787  20.4327          ?        ?      134.2        7.6       ?       ? 
1 1 1   32    7   69 o     23.1   11.4    0.0000   0.0000          ?        ?   -44.6965  19.7942          ?        ?       23.1       11.4       ?       ? 
1 1 1   32    8    0 o   1048.6    5.7 10996.6191 118.7650 10996.6191 118.7650 10996.6191 118.7650     1048.6      5.7     1048.6        5.7     0.0     0.0 
1 1 1   32    8    1 o    352.3    2.4    0.0000   0.0000          ?        ?  1241.2860  16.6016          ?        ?      352.3        2.4       ?       ? 
1 1 1   32    8    2 o    139.3    3.7    0.0000   0.0000          ?        ?   194.1106  10.2163          ?        ?      139.3        3.7       ?       ? 
1 1 1   32    8    3 o     52.0   11.9    0.0000   0.0000          ?        ?    28.0950  12.1319          ?        ?       52.0       11.9       ?       ? 
1 1 1   32    8    4 o    639.2    2.8    0.0000   0.0000          ?        ?  4085.9001  35.7572          ?        ?      639.2        2.8       ?       ? 
1 1 1   32    8    5 o    328.0    2.6    0.0000   0.0000          ?        ?  1075.9089  17.2401          ?        ?      328.0        2.6       ?       ? 
1 1 1   32    8    6 o    148.4    4.1    0.0000   0.0000          ?        ?   220.2900  12.1319          ?        ?      148.4        4.1       ?       ? 
1 1 1   32    8    7 o   1148.4    4.2    0.0000   0.0000          ?        ? 13190.5801  97.0553          ?        ?     1148.4        4.2       ?       ? 
1 1 1   32    8    8 o   1101.4    4.3    0.0000   0.0000          ?        ? 12131.9111  95.1397          ?        ?     1101.4        4.3       ?       ? 
1 1 1   32    8    9 o    640.4    2.9    0.0000   0.0000          ?        ?  4101.8633  37.0343          ?        ?      640.4        2.9       ?       ? 
1 1 1   32    8   10 o    871.9    3.6    0.0000   0.0000          ?        ?  7602.8765  62.5751          ?        ?      871.9        3.6       ?       ? 
1 1 1   32    8   11 o   1118.0    4.3    0.0000   0.0000          ?        ? 12499.6992  97.0553          ?        ?     1118.0        4.3       ?       ? 
1 1 1   32    8   12 o    338.3    2.5    0.0000   0.0000          ?        ?  1144.2307  16.6016          ?        ?      338.3        2.5       ?       ? 
1 1 1   32    8   13 o    847.9    3.6    0.0000   0.0000          ?        ?  7189.1152  60.6596          ?        ?      847.9        3.6       ?       ? 
1 1 1   32    8   14 o    186.7    3.6    0.0000   0.0000          ?        ?   348.6328  13.4090          ?        ?      186.7        3.6       ?       ? 
1 1 1   32    8   15 o   1818.0    6.3    0.0000   0.0000          ?        ? 33060.0977 227.9522          ?        ?     1818.0        6.3       ?       ? 
1 1 1   32    8   16 o    328.9    2.9    0.0000   0.0000          ?        ?  1081.6556  19.1556          ?        ?      328.9        2.9       ?       ? 
1 1 1   32    8   17 o   1082.4    4.1    0.0000   0.0000          ?        ? 11717.5098  88.7545          ?        ?     1082.4        4.1       ?       ? 
1 1 1   32    8   18 o    747.6    3.1    0.0000   0.0000          ?        ?  5589.6187  46.6121          ?        ?      747.6        3.1       ?       ? 
1 1 1   32    8   19 o   1470.0    5.0    0.0000   0.0000          ?        ? 21612.6797 148.1370          ?        ?     1470.0        5.0       ?       ? 
1 1 1   32    8   20 o    601.1    2.8    0.0000   0.0000          ?        ?  3614.0325  33.2031          ?        ?      601.1        2.8       ?       ? 
1 1 1   32    8   21 o    444.3    2.4    0.0000   0.0000          ?        ?  1974.3090  21.7097          ?        ?      444.3        2.4       ?       ? 
1 1 1   32    8   22 o     17.7    8.8    0.0000   0.0000          ?        ?   -34.4802  12.7704          ?        ?       17.7        8.8       ?       ? 
1 1 1   32    8   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    8   24 o    622.8    3.0    0.0000   0.0000          ?        ?  3879.0188  37.6728          ?        ?      622.8        3.0       ?       ? 
1 1 1   32    8   25 o    721.4    3.0    0.0000   0.0000          ?        ?  5204.5898  42.7809          ?        ?      721.4        3.0       ?       ? 
1 1 1   32    8   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    8   27 o   1090.5    4.0    0.0000   0.0000          ?        ? 11895.0195  86.2004          ?        ?     1090.5        4.0       ?       ? 
1 1 1   32    8   28 f    684.1    2.9    0.0000   0.0000          ?        ?  4681.0020  39.5883          ?        ?      684.1        2.9       ?       ? 
1 1 1   32    8   29 o    138.1    5.3    0.0000   0.0000          ?        ?   190.9180  14.6860          ?        ?      138.1        5.3       ?       ? 
1 1 1   32    8   30 f    158.4    4.4    0.0000   0.0000          ?        ?   250.9390  14.0475          ?        ?      158.4        4.4       ?       ? 
1 1 1   32    8   31 o     19.7    9.8    0.0000   0.0000          ?        ?   -47.8891  16.6016          ?        ?       19.7        9.8       ?       ? 
1 1 1   32    8   32 o    137.0    5.1    0.0000   0.0000          ?        ?   187.7254  14.0475          ?        ?      137.0        5.1       ?       ? 
1 1 1   32    8   33 f    378.9    2.4    0.0000   0.0000          ?        ?  1436.0352  18.5171          ?        ?      378.9        2.4       ?       ? 
1 1 1   32    8   34 o    414.3    2.5    0.0000   0.0000          ?        ?  1716.9846  21.0712          ?        ?      414.3        2.5       ?       ? 
1 1 1   32    8   35 o    446.3    2.6    0.0000   0.0000          ?        ?  1992.1875  23.6253          ?        ?      446.3        2.6       ?       ? 
1 1 1   32    8   36 o    200.2    3.8    0.0000   0.0000          ?        ?   400.9916  15.3245          ?        ?      200.2        3.8       ?       ? 
1 1 1   32    8   37 o    261.8    3.0    0.0000   0.0000          ?        ?   685.7722  15.9630          ?        ?      261.8        3.0       ?       ? 
1 1 1   32    8   38 o    160.8    4.8    0.0000   0.0000          ?        ?   258.6013  15.3245          ?        ?      160.8        4.8       ?       ? 
1 1 1   32    8   39 o    274.0    3.1    0.0000   0.0000          ?        ?   750.9014  17.2401          ?        ?      274.0        3.1       ?       ? 
1 1 1   32    8   40 o    439.7    2.5    0.0000   0.0000          ?        ?  1934.0819  22.3483          ?        ?      439.7        2.5       ?       ? 
1 1 1   32    8   41 o     23.5   11.3    0.0000   0.0000          ?        ?   -22.3483  15.3245          ?        ?       23.5       11.3       ?       ? 
1 1 1   32    8   42 o    115.2    6.7    0.0000   0.0000          ?        ?   132.8125  15.3245          ?        ?      115.2        6.7       ?       ? 
1 1 1   32    8   43 o    533.7    2.6    0.0000   0.0000          ?        ?  2849.0835  28.0950          ?        ?      533.7        2.6       ?       ? 
1 1 1   32    8   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32    8   45 o    286.6    3.2    0.0000   0.0000          ?        ?   821.7773  18.5171          ?        ?      286.6        3.2       ?       ? 
1 1 1   32    8   46 o    380.9    2.6    0.0000   0.0000          ?        ?  1451.3596  19.7942          ?        ?      380.9        2.6       ?       ? 
1 1 1   32    8   47 o    470.8    2.6    0.0000   0.0000          ?        ?  2217.5854  24.9023          ?        ?      470.8        2.6       ?       ? 
1 1 1   32    8   48 o    392.0    2.8    0.0000   0.0000          ?        ?  1537.5601  21.7097          ?        ?      392.0        2.8       ?       ? 
1 1 1   32    8   49 f    263.2    3.5    0.0000   0.0000          ?        ?   693.4344  18.5171          ?        ?      263.2        3.5       ?       ? 
1 1 1   32    8   50 o     30.0   13.5    0.0000   0.0000          ?        ?    -8.9393  17.2401          ?        ?       30.0       13.5       ?       ? 
1 1 1   32    8   51 o    155.4    5.8    0.0000   0.0000          ?        ?   241.9997  17.8786          ?        ?      155.4        5.8       ?       ? 
1 1 1   32    8   52 o    141.4    6.3    0.0000   0.0000          ?        ?   200.4958  17.8786          ?        ?      141.4        6.3       ?       ? 
1 1 1   32    8   53 o    233.1    4.0    0.0000   0.0000          ?        ?   544.0204  18.5171          ?        ?      233.1        4.0       ?       ? 
1 1 1   32    8   54 o     48.5   15.9    0.0000   0.0000          ?        ?    22.9868  17.8786          ?        ?       48.5       15.9       ?       ? 
1 1 1   32    8   55 o    144.7    6.4    0.0000   0.0000          ?        ?   210.0736  18.5171          ?        ?      144.7        6.4       ?       ? 
1 1 1   32    8   56 o    242.6    3.9    0.0000   0.0000          ?        ?   589.3555  19.1556          ?        ?      242.6        3.9       ?       ? 
1 1 1   32    8   57 o    332.3    3.3    0.0000   0.0000          ?        ?  1105.2810  21.7097          ?        ?      332.3        3.3       ?       ? 
1 1 1   32    8   58 o    231.3    4.4    0.0000   0.0000          ?        ?   535.7197  20.4327          ?        ?      231.3        4.4       ?       ? 
1 1 1   32    8   59 o    436.7    2.9    0.0000   0.0000          ?        ?  1908.5411  24.9023          ?        ?      436.7        2.9       ?       ? 
1 1 1   32    8   60 o     54.0   16.7    0.0000   0.0000          ?        ?    30.0105  19.7942          ?        ?       54.0       16.7       ?       ? 
1 1 1   32    8   61 o    238.8    4.3    0.0000   0.0000          ?        ?   571.4769  20.4327          ?        ?      238.8        4.3       ?       ? 
1 1 1   32    8   62 o    116.1    8.8    0.0000   0.0000          ?        ?   136.0051  20.4327          ?        ?      116.1        8.8       ?       ? 
1 1 1   32    8   63 o    189.9    5.5    0.0000   0.0000          ?        ?   362.0418  21.0712          ?        ?      189.9        5.5       ?       ? 
1 1 1   32    8   64 o     26.4   12.7    0.0000   0.0000          ?        ?   -31.9261  20.4327          ?        ?       26.4       12.7       ?       ? 
1 1 1   32    8   65 o    247.3    4.4    0.0000   0.0000          ?        ?   612.9808  21.7097          ?        ?      247.3        4.4       ?       ? 
1 1 1   32    8   66 o    197.2    5.3    0.0000   0.0000          ?        ?   390.7752  21.0712          ?        ?      197.2        5.3       ?       ? 
1 1 1   32    8   67 o    195.4    5.2    0.0000   0.0000          ?        ?   383.7515  20.4327          ?        ?      195.4        5.2       ?       ? 
1 1 1   32    8   68 o    170.2    6.0    0.0000   0.0000          ?        ?   291.8044  20.4327          ?        ?      170.2        6.0       ?       ? 
1 1 1   32    8   69 o     52.1   16.5    0.0000   0.0000          ?        ?    28.7335  19.1556          ?        ?       52.1       16.5       ?       ? 
1 1 1   32    9    0 o    588.0    3.8 3457.5947  44.6965  3457.5947  44.6965  3457.5947  44.6965      588.0      3.8      588.0        3.8     0.0     0.0 
1 1 1   32    9    1 o    253.1    2.9    0.0000   0.0000          ?        ?   640.4372  14.6860          ?        ?      253.1        2.9       ?       ? 
1 1 1   32    9    2 o    148.8    4.9    0.0000   0.0000          ?        ?   221.5670  14.6860          ?        ?      148.8        4.9       ?       ? 
1 1 1   32    9    3 o   1227.0    4.7    0.0000   0.0000          ?        ? 15058.2559 115.5724          ?        ?     1227.0        4.7       ?       ? 
1 1 1   32    9    4 o    692.6    3.0    0.0000   0.0000          ?        ?  4797.8516  42.1424          ?        ?      692.6        3.0       ?       ? 
1 1 1   32    9    5 o    489.6    3.1    0.0000   0.0000          ?        ?  2397.0103  30.6490          ?        ?      489.6        3.1       ?       ? 
1 1 1   32    9    6 o   1989.7    7.2    0.0000   0.0000          ?        ? 39602.3906 287.3347          ?        ?     1989.7        7.2       ?       ? 
1 1 1   32    9    7 o   1186.0    4.6    0.0000   0.0000          ?        ? 14066.6318 108.5487          ?        ?     1186.0        4.6       ?       ? 
1 1 1   32    9    8 o    732.6    3.2    0.0000   0.0000          ?        ?  5366.7744  46.6121          ?        ?      732.6        3.2       ?       ? 
1 1 1   32    9    9 o    888.8    3.6    0.0000   0.0000          ?        ?  7901.0669  63.2136          ?        ?      888.8        3.6       ?       ? 
1 1 1   32    9   10 o    120.4    5.3    0.0000   0.0000          ?        ?   144.9444  12.7704          ?        ?      120.4        5.3       ?       ? 
1 1 1   32    9   11 o     17.9    8.9    0.0000   0.0000          ?        ?   -29.3720  12.1319          ?        ?       17.9        8.9       ?       ? 
1 1 1   32    9   12 o    153.7    3.7    0.0000   0.0000          ?        ?   236.2530  11.4934          ?        ?      153.7        3.7       ?       ? 
1 1 1   32    9   13 o    971.8    3.9    0.0000   0.0000          ?        ?  9445.0117  76.6226          ?        ?      971.8        3.9       ?       ? 
1 1 1   32    9   14 o   1558.1    5.8    0.0000   0.0000          ?        ? 24282.3379 179.4246          ?        ?     1558.1        5.8       ?       ? 
1 1 1   32    9   15 o    427.8    2.5    0.0000   0.0000          ?        ?  1830.6416  21.7097          ?        ?      427.8        2.5       ?       ? 
1 1 1   32    9   16 o    114.7    5.8    0.0000   0.0000          ?        ?   131.5355  13.4090          ?        ?      114.7        5.8       ?       ? 
1 1 1   32    9   17 o    687.1    3.1    0.0000   0.0000          ?        ?  4721.8672  42.1424          ?        ?      687.1        3.1       ?       ? 
1 1 1   32    9   18 o    764.2    3.3    0.0000   0.0000          ?        ?  5839.9185  49.8047          ?        ?      764.2        3.3       ?       ? 
1 1 1   32    9   19 o   1351.8    4.8    0.0000   0.0000          ?        ? 18276.4043 130.2584          ?        ?     1351.8        4.8       ?       ? 
1 1 1   32    9   20 o    993.7    3.7    0.0000   0.0000          ?        ?  9875.3750  73.4300          ?        ?      993.7        3.7       ?       ? 
1 1 1   32    9   21 o    501.4    2.5    0.0000   0.0000          ?        ?  2514.4980  25.5409          ?        ?      501.4        2.5       ?       ? 
1 1 1   32    9   22 o    190.6    4.5    0.0000   0.0000          ?        ?   363.3188  17.2401          ?        ?      190.6        4.5       ?       ? 
1 1 1   32    9   23 o    653.5    2.8    0.0000   0.0000          ?        ?  4271.0713  37.0343          ?        ?      653.5        2.8       ?       ? 
1 1 1   32    9   24 o    315.0    2.7    0.0000   0.0000          ?        ?   992.2626  17.2401          ?        ?      315.0        2.7       ?       ? 
1 1 1   32    9   25 o    225.9    3.3    0.0000   0.0000          ?        ?   510.1788  14.6860          ?        ?      225.9        3.3       ?       ? 
1 1 1   32    9   26 f   1134.6    4.2    0.0000   0.0000          ?        ? 12875.1504  94.5012          ?        ?     1134.6        4.2       ?       ? 
1 1 1   32    9   27 o    261.4    2.9    0.0000   0.0000          ?        ?   683.2181  15.3245          ?        ?      261.4        2.9       ?       ? 
1 1 1   32    9   28 o    832.8    3.2    0.0000   0.0000          ?        ?  6936.2607  53.6358          ?        ?      832.8        3.2       ?       ? 
1 1 1   32    9   29 o    290.0    2.9    0.0000   0.0000          ?        ?   840.9330  16.6016          ?        ?      290.0        2.9       ?       ? 
1 1 1   32    9   30 o    338.5    2.5    0.0000   0.0000          ?        ?  1146.1464  17.2401          ?        ?      338.5        2.5       ?       ? 
1 1 1   32    9   31 f    367.6    2.5    0.0000   0.0000          ?        ?  1351.1118  18.5171          ?        ?      367.6        2.5       ?       ? 
1 1 1   32    9   32 o    184.5    3.8    0.0000   0.0000          ?        ?   340.3320  14.0475          ?        ?      184.5        3.8       ?       ? 
1 1 1   32    9   33 o    398.0    2.6    0.0000   0.0000          ?        ?  1584.1722  20.4327          ?        ?      398.0        2.6       ?       ? 
1 1 1   32    9   34 o    342.1    2.6    0.0000   0.0000          ?        ?  1170.4102  17.8786          ?        ?      342.1        2.6       ?       ? 
1 1 1   32    9   35 o    638.4    2.7    0.0000   0.0000          ?        ?  4075.6833  34.4802          ?        ?      638.4        2.7       ?       ? 
1 1 1   32    9   36 o     27.0   12.4    0.0000   0.0000          ?        ?   -11.4934  15.3245          ?        ?       27.0       12.4       ?       ? 
1 1 1   32    9   37 o    300.4    3.0    0.0000   0.0000          ?        ?   902.8696  17.8786          ?        ?      300.4        3.0       ?       ? 
1 1 1   32    9   38 o     17.0    8.6    0.0000   0.0000          ?        ?   -52.3588  14.6860          ?        ?       17.0        8.6       ?       ? 
1 1 1   32    9   39 o    313.1    3.0    0.0000   0.0000          ?        ?   980.7693  18.5171          ?        ?      313.1        3.0       ?       ? 
1 1 1   32    9   40 o    282.0    3.1    0.0000   0.0000          ?        ?   795.5980  17.2401          ?        ?      282.0        3.1       ?       ? 
1 1 1   32    9   41 o    219.2    3.8    0.0000   0.0000          ?        ?   480.8068  16.6016          ?        ?      219.2        3.8       ?       ? 
1 1 1   32    9   42 o    122.4    6.3    0.0000   0.0000          ?        ?   150.0526  15.3245          ?        ?      122.4        6.3       ?       ? 
1 1 1   32    9   43 f     22.2   10.8    0.0000   0.0000          ?        ?   -27.4564  15.3245          ?        ?       22.2       10.8       ?       ? 
1 1 1   32    9   44 o     54.2   14.5    0.0000   0.0000          ?        ?    30.6490  15.9630          ?        ?       54.2       14.5       ?       ? 
1 1 1   32    9   45 o    276.7    3.2    0.0000   0.0000          ?        ?   766.2260  17.8786          ?        ?      276.7        3.2       ?       ? 
1 1 1   32    9   46 o    248.7    3.6    0.0000   0.0000          ?        ?   618.7275  17.8786          ?        ?      248.7        3.6       ?       ? 
1 1 1   32    9   47 o     96.4    8.9    0.0000   0.0000          ?        ?    93.2242  17.2401          ?        ?       96.4        8.9       ?       ? 
1 1 1   32    9   48 o    241.6    3.7    0.0000   0.0000          ?        ?   584.2473  17.8786          ?        ?      241.6        3.7       ?       ? 
1 1 1   32    9   49 o    145.0    5.9    0.0000   0.0000          ?        ?   210.7121  17.2401          ?        ?      145.0        5.9       ?       ? 
1 1 1   32    9   50 o    380.0    2.7    0.0000   0.0000          ?        ?  1444.3359  20.4327          ?        ?      380.0        2.7       ?       ? 
1 1 1   32    9   51 o    439.5    2.7    0.0000   0.0000          ?        ?  1932.1665  23.6253          ?        ?      439.5        2.7       ?       ? 
1 1 1   32    9   52 o     49.0   15.9    0.0000   0.0000          ?        ?    23.6253  17.8786          ?        ?       49.0       15.9       ?       ? 
1 1 1   32    9   53 o    265.6    3.6    0.0000   0.0000          ?        ?   706.2049  19.1556          ?        ?      265.6        3.6       ?       ? 
1 1 1   32    9   54 o    120.2    7.4    0.0000   0.0000          ?        ?   144.9444  17.8786          ?        ?      120.2        7.4       ?       ? 
1 1 1   32    9   55 o    195.6    4.7    0.0000   0.0000          ?        ?   383.1130  18.5171          ?        ?      195.6        4.7       ?       ? 
1 1 1   32    9   56 o    167.6    5.5    0.0000   0.0000          ?        ?   281.5880  18.5171          ?        ?      167.6        5.5       ?       ? 
1 1 1   32    9   57 o    123.8    7.7    0.0000   0.0000          ?        ?   153.8837  19.1556          ?        ?      123.8        7.7       ?       ? 
1 1 1   32    9   58 o    149.4    6.4    0.0000   0.0000          ?        ?   224.1211  19.1556          ?        ?      149.4        6.4       ?       ? 
1 1 1   32    9   59 o     39.4   15.9    0.0000   0.0000          ?        ?     7.6623  19.1556          ?        ?       39.4       15.9       ?       ? 
1 1 1   32    9   60 f    333.7    3.3    0.0000   0.0000          ?        ?  1114.8588  21.7097          ?        ?      333.7        3.3       ?       ? 
1 1 1   32    9   61 o     20.9   10.6    0.0000   0.0000          ?        ?   -64.4907  20.4327          ?        ?       20.9       10.6       ?       ? 
1 1 1   32    9   62 o    204.2    5.0    0.0000   0.0000          ?        ?   418.2317  20.4327          ?        ?      204.2        5.0       ?       ? 
1 1 1   32    9   63 o    204.8    4.8    0.0000   0.0000          ?        ?   420.7858  19.7942          ?        ?      204.8        4.8       ?       ? 
1 1 1   32    9   64 o    124.3    8.0    0.0000   0.0000          ?        ?   155.7993  19.7942          ?        ?      124.3        8.0       ?       ? 
1 1 1   32    9   65 o    136.5    7.3    0.0000   0.0000          ?        ?   187.7254  19.7942          ?        ?      136.5        7.3       ?       ? 
1 1 1   32    9   66 o     34.5   15.1    0.0000   0.0000          ?        ?    -3.1926  19.7942          ?        ?       34.5       15.1       ?       ? 
1 1 1   32    9   67 o     83.9   11.8    0.0000   0.0000          ?        ?    72.1529  19.7942          ?        ?       83.9       11.8       ?       ? 
1 1 1   32    9   68 o    210.6    4.9    0.0000   0.0000          ?        ?   445.6881  20.4327          ?        ?      210.6        4.9       ?       ? 
1 1 1   32   10    0 o    689.5    3.9 4755.0708  54.2743  4755.0708  54.2743  4755.0708  54.2743      689.5      3.9      689.5        3.9     0.0     0.0 
1 1 1   32   10    1 o    791.3    3.4    0.0000   0.0000          ?        ?  6262.6201  53.6358          ?        ?      791.3        3.4       ?       ? 
1 1 1   32   10    2 o   2232.7    7.4    0.0000   0.0000          ?        ? 49868.5391 332.6698          ?        ?     2232.7        7.4       ?       ? 
1 1 1   32   10    3 o    660.6    3.1    0.0000   0.0000          ?        ?  4363.6567  40.8654          ?        ?      660.6        3.1       ?       ? 
1 1 1   32   10    4 o    322.1    2.6    0.0000   0.0000          ?        ?  1037.5977  16.6016          ?        ?      322.1        2.6       ?       ? 
1 1 1   32   10    5 o   1466.8    5.5    0.0000   0.0000          ?        ? 21518.1797 160.9075          ?        ?     1466.8        5.5       ?       ? 
1 1 1   32   10    6 o    552.9    2.7    0.0000   0.0000          ?        ?  3057.2415  30.0105          ?        ?      552.9        2.7       ?       ? 
1 1 1   32   10    7 o   1009.5    4.1    0.0000   0.0000          ?        ? 10192.0820  82.3693          ?        ?     1009.5        4.1       ?       ? 
1 1 1   32   10    8 o    580.1    2.9    0.0000   0.0000          ?        ?  3365.6472  33.2031          ?        ?      580.1        2.9       ?       ? 
1 1 1   32   10    9 f    861.7    3.5    0.0000   0.0000          ?        ?  7426.0063  60.6596          ?        ?      861.7        3.5       ?       ? 
1 1 1   32   10   10 o    428.0    2.6    0.0000   0.0000          ?        ?  1831.9185  22.3483          ?        ?      428.0        2.6       ?       ? 
1 1 1   32   10   11 o    917.7    3.7    0.0000   0.0000          ?        ?  8422.1006  67.6833          ?        ?      917.7        3.7       ?       ? 
1 1 1   32   10   12 o    459.6    2.4    0.0000   0.0000          ?        ?  2112.8679  22.3483          ?        ?      459.6        2.4       ?       ? 
1 1 1   32   10   13 o    566.0    2.7    0.0000   0.0000          ?        ?  3203.4631  30.6490          ?        ?      566.0        2.7       ?       ? 
1 1 1   32   10   14 o     34.7   12.7    0.0000   0.0000          ?        ?     9.5778  11.4934          ?        ?       34.7       12.7       ?       ? 
1 1 1   32   10   15 o    634.6    2.6    0.0000   0.0000          ?        ?  4027.1560  33.2031          ?        ?      634.6        2.6       ?       ? 
1 1 1   32   10   16 o    856.8    3.5    0.0000   0.0000          ?        ?  7342.3604  60.6596          ?        ?      856.8        3.5       ?       ? 
1 1 1   32   10   17 o    310.2    2.6    0.0000   0.0000          ?        ?   962.2521  15.9630          ?        ?      310.2        2.6       ?       ? 
1 1 1   32   10   18 o    203.2    3.8    0.0000   0.0000          ?        ?   413.1235  15.3245          ?        ?      203.2        3.8       ?       ? 
1 1 1   32   10   19 o    530.1    2.6    0.0000   0.0000          ?        ?  2810.7722  28.0950          ?        ?      530.1        2.6       ?       ? 
1 1 1   32   10   20 o    363.5    2.7    0.0000   0.0000          ?        ?  1321.1012  19.7942          ?        ?      363.5        2.7       ?       ? 
1 1 1   32   10   21 o    654.0    2.9    0.0000   0.0000          ?        ?  4277.4565  37.6728          ?        ?      654.0        2.9       ?       ? 
1 1 1   32   10   22 o    954.1    3.7    0.0000   0.0000          ?        ?  9105.3184  71.5144          ?        ?      954.1        3.7       ?       ? 
1 1 1   32   10   23 o    525.7    2.7    0.0000   0.0000          ?        ?  2763.5215  28.0950          ?        ?      525.7        2.7       ?       ? 
1 1 1   32   10   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   10   25 o    340.0    2.4    0.0000   0.0000          ?        ?  1156.3627  16.6016          ?        ?      340.0        2.4       ?       ? 
1 1 1   32   10   26 o    562.3    2.6    0.0000   0.0000          ?        ?  3161.9592  29.3720          ?        ?      562.3        2.6       ?       ? 
1 1 1   32   10   27 o     27.3   12.5    0.0000   0.0000          ?        ?   -10.8549  15.3245          ?        ?       27.3       12.5       ?       ? 
1 1 1   32   10   28 o    111.6    6.0    0.0000   0.0000          ?        ?   124.5117  13.4090          ?        ?      111.6        6.0       ?       ? 
1 1 1   32   10   29 o    369.4    2.6    0.0000   0.0000          ?        ?  1364.5208  19.1556          ?        ?      369.4        2.6       ?       ? 
1 1 1   32   10   30 o    247.4    3.0    0.0000   0.0000          ?        ?   612.3422  14.6860          ?        ?      247.4        3.0       ?       ? 
1 1 1   32   10   31 o    456.6    2.5    0.0000   0.0000          ?        ?  2085.4116  22.9868          ?        ?      456.6        2.5       ?       ? 
1 1 1   32   10   32 o    357.3    2.6    0.0000   0.0000          ?        ?  1277.0432  18.5171          ?        ?      357.3        2.6       ?       ? 
1 1 1   32   10   33 o    347.4    2.6    0.0000   0.0000          ?        ?  1206.8059  17.8786          ?        ?      347.4        2.6       ?       ? 
1 1 1   32   10   34 o    266.2    3.2    0.0000   0.0000          ?        ?   708.7590  17.2401          ?        ?      266.2        3.2       ?       ? 
1 1 1   32   10   35 o     61.6   12.9    0.0000   0.0000          ?        ?    39.5883  15.3245          ?        ?       61.6       12.9       ?       ? 
1 1 1   32   10   36 f    484.9    2.6    0.0000   0.0000          ?        ?  2351.6750  24.9023          ?        ?      484.9        2.6       ?       ? 
1 1 1   32   10   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   10   38 o    309.6    3.0    0.0000   0.0000          ?        ?   959.0594  18.5171          ?        ?      309.6        3.0       ?       ? 
1 1 1   32   10   39 o    154.5    5.2    0.0000   0.0000          ?        ?   238.8071  15.9630          ?        ?      154.5        5.2       ?       ? 
1 1 1   32   10   40 o     62.1   12.8    0.0000   0.0000          ?        ?    40.2269  15.3245          ?        ?       62.1       12.8       ?       ? 
1 1 1   32   10   41 o    214.5    3.9    0.0000   0.0000          ?        ?   460.3741  16.6016          ?        ?      214.5        3.9       ?       ? 
1 1 1   32   10   42 f    107.7    7.1    0.0000   0.0000          ?        ?   116.2109  15.3245          ?        ?      107.7        7.1       ?       ? 
1 1 1   32   10   43 o    531.2    2.6    0.0000   0.0000          ?        ?  2822.9041  28.0950          ?        ?      531.2        2.6       ?       ? 
1 1 1   32   10   44 o    314.0    3.0    0.0000   0.0000          ?        ?   986.5159  19.1556          ?        ?      314.0        3.0       ?       ? 
1 1 1   32   10   45 o    183.5    4.3    0.0000   0.0000          ?        ?   337.1394  15.9630          ?        ?      183.5        4.3       ?       ? 
1 1 1   32   10   46 o    420.0    2.7    0.0000   0.0000          ?        ?  1764.2352  22.3483          ?        ?      420.0        2.7       ?       ? 
1 1 1   32   10   47 o    434.9    2.8    0.0000   0.0000          ?        ?  1891.9395  24.2638          ?        ?      434.9        2.8       ?       ? 
1 1 1   32   10   48 o    510.4    2.7    0.0000   0.0000          ?        ?  2605.8069  27.4564          ?        ?      510.4        2.7       ?       ? 
1 1 1   32   10   49 o    379.4    2.8    0.0000   0.0000          ?        ?  1439.8662  21.0712          ?        ?      379.4        2.8       ?       ? 
1 1 1   32   10   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   10   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   10   52 o    366.4    2.9    0.0000   0.0000          ?        ?  1343.4495  21.0712          ?        ?      366.4        2.9       ?       ? 
1 1 1   32   10   53 f    255.2    3.8    0.0000   0.0000          ?        ?   651.9305  19.1556          ?        ?      255.2        3.8       ?       ? 
1 1 1   32   10   54 o     63.7   14.8    0.0000   0.0000          ?        ?    42.7809  18.5171          ?        ?       63.7       14.8       ?       ? 
1 1 1   32   10   55 o    306.7    3.2    0.0000   0.0000          ?        ?   941.1808  19.7942          ?        ?      306.7        3.2       ?       ? 
1 1 1   32   10   56 o    357.5    3.1    0.0000   0.0000          ?        ?  1278.9589  22.3483          ?        ?      357.5        3.1       ?       ? 
1 1 1   32   10   57 o     24.2   11.9    0.0000   0.0000          ?        ?   -36.3957  19.1556          ?        ?       24.2       11.9       ?       ? 
1 1 1   32   10   58 o    137.9    6.9    0.0000   0.0000          ?        ?   190.9180  19.1556          ?        ?      137.9        6.9       ?       ? 
1 1 1   32   10   59 o    326.6    3.3    0.0000   0.0000          ?        ?  1067.6082  21.7097          ?        ?      326.6        3.3       ?       ? 
1 1 1   32   10   60 o     77.2   12.8    0.0000   0.0000          ?        ?    60.6596  19.7942          ?        ?       77.2       12.8       ?       ? 
1 1 1   32   10   61 o    173.1    5.5    0.0000   0.0000          ?        ?   300.7437  19.1556          ?        ?      173.1        5.5       ?       ? 
1 1 1   32   10   62 o    117.5    8.4    0.0000   0.0000          ?        ?   139.1977  19.7942          ?        ?      117.5        8.4       ?       ? 
1 1 1   32   10   63 o     55.1   16.3    0.0000   0.0000          ?        ?    31.9261  19.1556          ?        ?       55.1       16.3       ?       ? 
1 1 1   32   10   64 o    162.7    6.1    0.0000   0.0000          ?        ?   266.2635  19.7942          ?        ?      162.7        6.1       ?       ? 
1 1 1   32   10   65 o     27.6   13.0    0.0000   0.0000          ?        ?   -21.7097  19.1556          ?        ?       27.6       13.0       ?       ? 
1 1 1   32   10   66 o     60.0   16.1    0.0000   0.0000          ?        ?    38.9498  19.7942          ?        ?       60.0       16.1       ?       ? 
1 1 1   32   10   67 o     22.4   11.1    0.0000   0.0000          ?        ?   -45.3350  19.1556          ?        ?       22.4       11.1       ?       ? 
1 1 1   32   11    0 o    386.9    3.2 1497.3333  24.9023  1497.3333  24.9023  1497.3333  24.9023      386.9      3.2      386.9        3.2     0.0     0.0 
1 1 1   32   11    1 o    740.8    3.0    0.0000   0.0000          ?        ?  5488.0933  44.6965          ?        ?      740.8        3.0       ?       ? 
1 1 1   32   11    2 o    638.5    2.7    0.0000   0.0000          ?        ?  4077.5989  35.1187          ?        ?      638.5        2.7       ?       ? 
1 1 1   32   11    3 o   1134.4    4.3    0.0000   0.0000          ?        ? 12870.6797  97.6938          ?        ?     1134.4        4.3       ?       ? 
1 1 1   32   11    4 o    316.7    2.4    0.0000   0.0000          ?        ?  1003.1175  15.3245          ?        ?      316.7        2.4       ?       ? 
1 1 1   32   11    5 o    205.9    4.0    0.0000   0.0000          ?        ?   423.9784  16.6016          ?        ?      205.9        4.0       ?       ? 
1 1 1   32   11    6 o    200.7    3.8    0.0000   0.0000          ?        ?   402.9071  15.3245          ?        ?      200.7        3.8       ?       ? 
1 1 1   32   11    7 o    363.7    2.5    0.0000   0.0000          ?        ?  1323.0168  17.8786          ?        ?      363.7        2.5       ?       ? 
1 1 1   32   11    8 o    862.8    3.5    0.0000   0.0000          ?        ?  7445.1621  60.0210          ?        ?      862.8        3.5       ?       ? 
1 1 1   32   11    9 o     14.3    7.2    0.0000   0.0000          ?        ?   -35.7572  10.2163          ?        ?       14.3        7.2       ?       ? 
1 1 1   32   11   10 o    441.5    2.4    0.0000   0.0000          ?        ?  1949.4065  21.0712          ?        ?      441.5        2.4       ?       ? 
1 1 1   32   11   11 o    154.9    3.5    0.0000   0.0000          ?        ?   240.0841  10.8549          ?        ?      154.9        3.5       ?       ? 
1 1 1   32   11   12 o    519.0    2.5    0.0000   0.0000          ?        ?  2693.2842  26.1794          ?        ?      519.0        2.5       ?       ? 
1 1 1   32   11   13 o   1027.6    4.0    0.0000   0.0000          ?        ? 10561.1475  81.7308          ?        ?     1027.6        4.0       ?       ? 
1 1 1   32   11   14 o    276.5    2.7    0.0000   0.0000          ?        ?   764.3104  14.6860          ?        ?      276.5        2.7       ?       ? 
1 1 1   32   11   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   11   16 o    459.0    2.4    0.0000   0.0000          ?        ?  2107.1213  22.3483          ?        ?      459.0        2.4       ?       ? 
1 1 1   32   11   17 o    624.0    2.7    0.0000   0.0000          ?        ?  3894.3435  33.2031          ?        ?      624.0        2.7       ?       ? 
1 1 1   32   11   18 o    698.4    3.1    0.0000   0.0000          ?        ?  4877.6670  42.7809          ?        ?      698.4        3.1       ?       ? 
1 1 1   32   11   19 o    564.3    2.7    0.0000   0.0000          ?        ?  3184.9458  30.6490          ?        ?      564.3        2.7       ?       ? 
1 1 1   32   11   20 o   1362.8    4.8    0.0000   0.0000          ?        ? 18576.5098 129.6199          ?        ?     1362.8        4.8       ?       ? 
1 1 1   32   11   21 o    493.4    2.6    0.0000   0.0000          ?        ?  2434.6829  25.5409          ?        ?      493.4        2.6       ?       ? 
1 1 1   32   11   22 o   1052.2    3.8    0.0000   0.0000          ?        ? 11073.2422  79.8152          ?        ?     1052.2        3.8       ?       ? 
1 1 1   32   11   23 o    619.9    2.6    0.0000   0.0000          ?        ?  3842.6230  32.5646          ?        ?      619.9        2.6       ?       ? 
1 1 1   32   11   24 o    851.5    3.2    0.0000   0.0000          ?        ?  7251.0513  54.9129          ?        ?      851.5        3.2       ?       ? 
1 1 1   32   11   25 o    538.0    2.7    0.0000   0.0000          ?        ?  2895.0571  28.7335          ?        ?      538.0        2.7       ?       ? 
1 1 1   32   11   26 o    274.5    2.7    0.0000   0.0000          ?        ?   753.4555  14.6860          ?        ?      274.5        2.7       ?       ? 
1 1 1   32   11   27 o    189.7    3.7    0.0000   0.0000          ?        ?   360.1262  14.0475          ?        ?      189.7        3.7       ?       ? 
1 1 1   32   11   28 o    507.3    2.6    0.0000   0.0000          ?        ?  2573.8806  26.1794          ?        ?      507.3        2.6       ?       ? 
1 1 1   32   11   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   11   30 o    261.1    2.9    0.0000   0.0000          ?        ?   681.9411  15.3245          ?        ?      261.1        2.9       ?       ? 
1 1 1   32   11   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   11   32 o    476.1    2.5    0.0000   0.0000          ?        ?  2267.3904  24.2638          ?        ?      476.1        2.5       ?       ? 
1 1 1   32   11   33 o    386.3    2.6    0.0000   0.0000          ?        ?  1492.2250  19.7942          ?        ?      386.3        2.6       ?       ? 
1 1 1   32   11   34 o    307.3    2.8    0.0000   0.0000          ?        ?   944.3735  17.2401          ?        ?      307.3        2.8       ?       ? 
1 1 1   32   11   35 o     25.5   11.8    0.0000   0.0000          ?        ?   -11.4934  14.0475          ?        ?       25.5       11.8       ?       ? 
1 1 1   32   11   36 o    109.5    6.7    0.0000   0.0000          ?        ?   120.0421  14.6860          ?        ?      109.5        6.7       ?       ? 
1 1 1   32   11   37 o    573.5    2.7    0.0000   0.0000          ?        ?  3289.6636  30.6490          ?        ?      573.5        2.7       ?       ? 
1 1 1   32   11   38 o    386.0    2.7    0.0000   0.0000          ?        ?  1490.3094  21.0712          ?        ?      386.0        2.7       ?       ? 
1 1 1   32   11   39 o    160.5    5.0    0.0000   0.0000          ?        ?   257.9627  15.9630          ?        ?      160.5        5.0       ?       ? 
1 1 1   32   11   40 o    384.2    2.7    0.0000   0.0000          ?        ?  1476.2620  21.0712          ?        ?      384.2        2.7       ?       ? 
1 1 1   32   11   41 o    343.9    2.9    0.0000   0.0000          ?        ?  1183.1805  19.7942          ?        ?      343.9        2.9       ?       ? 
1 1 1   32   11   42 o    431.8    2.7    0.0000   0.0000          ?        ?  1865.1217  23.6253          ?        ?      431.8        2.7       ?       ? 
1 1 1   32   11   43 o    201.8    4.0    0.0000   0.0000          ?        ?   407.3768  15.9630          ?        ?      201.8        4.0       ?       ? 
1 1 1   32   11   44 o    540.1    2.7    0.0000   0.0000          ?        ?  2918.0439  28.7335          ?        ?      540.1        2.7       ?       ? 
1 1 1   32   11   45 o    185.8    4.6    0.0000   0.0000          ?        ?   345.4402  17.2401          ?        ?      185.8        4.6       ?       ? 
1 1 1   32   11   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   11   47 o     25.4   12.2    0.0000   0.0000          ?        ?   -22.9868  17.2401          ?        ?       25.4       12.2       ?       ? 
1 1 1   32   11   48 o    224.6    4.1    0.0000   0.0000          ?        ?   505.0706  18.5171          ?        ?      224.6        4.1       ?       ? 
1 1 1   32   11   49 o    316.3    3.1    0.0000   0.0000          ?        ?  1001.2019  19.7942          ?        ?      316.3        3.1       ?       ? 
1 1 1   32   11   50 o     68.2   13.1    0.0000   0.0000          ?        ?    48.5276  17.2401          ?        ?       68.2       13.1       ?       ? 
1 1 1   32   11   51 o     49.0   15.3    0.0000   0.0000          ?        ?    24.2638  16.6016          ?        ?       49.0       15.3       ?       ? 
1 1 1   32   11   52 o    222.2    4.0    0.0000   0.0000          ?        ?   494.2158  17.8786          ?        ?      222.2        4.0       ?       ? 
1 1 1   32   11   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   11   54 o     27.3   12.9    0.0000   0.0000          ?        ?   -21.0712  18.5171          ?        ?       27.3       12.9       ?       ? 
1 1 1   32   11   55 f    218.7    4.4    0.0000   0.0000          ?        ?   478.8912  19.1556          ?        ?      218.7        4.4       ?       ? 
1 1 1   32   11   56 o    184.8    5.2    0.0000   0.0000          ?        ?   342.2476  19.1556          ?        ?      184.8        5.2       ?       ? 
1 1 1   32   11   57 o     34.2   14.8    0.0000   0.0000          ?        ?    -1.9156  18.5171          ?        ?       34.2       14.8       ?       ? 
1 1 1   32   11   58 o    129.5    7.9    0.0000   0.0000          ?        ?   168.5697  20.4327          ?        ?      129.5        7.9       ?       ? 
1 1 1   32   11   59 o    184.6    5.4    0.0000   0.0000          ?        ?   341.6091  19.7942          ?        ?      184.6        5.4       ?       ? 
1 1 1   32   11   60 o     96.0   10.0    0.0000   0.0000          ?        ?    93.2242  19.1556          ?        ?       96.0       10.0       ?       ? 
1 1 1   32   11   61 o    314.0    3.5    0.0000   0.0000          ?        ?   987.1545  21.7097          ?        ?      314.0        3.5       ?       ? 
1 1 1   32   11   62 o     55.2   16.6    0.0000   0.0000          ?        ?    31.9261  19.7942          ?        ?       55.2       16.6       ?       ? 
1 1 1   32   11   63 o    120.1    8.2    0.0000   0.0000          ?        ?   145.5829  19.7942          ?        ?      120.1        8.2       ?       ? 
1 1 1   32   11   64 o     31.9   14.3    0.0000   0.0000          ?        ?    -8.3008  19.1556          ?        ?       31.9       14.3       ?       ? 
1 1 1   32   11   65 o    105.9    8.7    0.0000   0.0000          ?        ?   113.6568  18.5171          ?        ?      105.9        8.7       ?       ? 
1 1 1   32   11   66 o     24.2   11.8    0.0000   0.0000          ?        ?   -35.7572  19.1556          ?        ?       24.2       11.8       ?       ? 
1 1 1   32   11   67 o     87.1   11.4    0.0000   0.0000          ?        ?    77.8996  19.7942          ?        ?       87.1       11.4       ?       ? 
1 1 1   32   12    0 o   1090.7    6.1 11898.2119 132.8125 11898.2119 132.8125 11898.2119 132.8125     1090.7      6.1     1090.7        6.1     0.0     0.0 
1 1 1   32   12    1 o    676.0    3.0    0.0000   0.0000          ?        ?  4570.5376  40.8654          ?        ?      676.0        3.0       ?       ? 
1 1 1   32   12    2 o    156.0    2.9    0.0000   0.0000          ?        ?   243.2767   8.9393          ?        ?      156.0        2.9       ?       ? 
1 1 1   32   12    3 o    398.8    2.4    0.0000   0.0000          ?        ?  1590.5574  19.1556          ?        ?      398.8        2.4       ?       ? 
1 1 1   32   12    4 o    847.2    3.5    0.0000   0.0000          ?        ?  7178.8989  59.3825          ?        ?      847.2        3.5       ?       ? 
1 1 1   32   12    5 o    681.2    3.0    0.0000   0.0000          ?        ?  4640.7749  41.5039          ?        ?      681.2        3.0       ?       ? 
1 1 1   32   12    6 o   1097.5    4.1    0.0000   0.0000          ?        ? 12046.3486  90.0316          ?        ?     1097.5        4.1       ?       ? 
1 1 1   32   12    7 o   1407.7    5.2    0.0000   0.0000          ?        ? 19821.6270 147.4985          ?        ?     1407.7        5.2       ?       ? 
1 1 1   32   12    8 o   1483.7    5.4    0.0000   0.0000          ?        ? 22018.1406 158.9919          ?        ?     1483.7        5.4       ?       ? 
1 1 1   32   12    9 o    605.6    2.8    0.0000   0.0000          ?        ?  3667.6685  34.4802          ?        ?      605.6        2.8       ?       ? 
1 1 1   32   12   10 o    157.0    3.5    0.0000   0.0000          ?        ?   246.4693  10.8549          ?        ?      157.0        3.5       ?       ? 
1 1 1   32   12   11 o    717.9    2.9    0.0000   0.0000          ?        ?  5154.7852  42.1424          ?        ?      717.9        2.9       ?       ? 
1 1 1   32   12   12 o    403.3    2.5    0.0000   0.0000          ?        ?  1626.3146  19.7942          ?        ?      403.3        2.5       ?       ? 
1 1 1   32   12   13 o    181.7    3.2    0.0000   0.0000          ?        ?   330.1157  11.4934          ?        ?      181.7        3.2       ?       ? 
1 1 1   32   12   14 o    184.8    3.3    0.0000   0.0000          ?        ?   341.6091  12.1319          ?        ?      184.8        3.3       ?       ? 
1 1 1   32   12   15 o    170.2    3.8    0.0000   0.0000          ?        ?   289.8888  12.7704          ?        ?      170.2        3.8       ?       ? 
1 1 1   32   12   16 o    342.4    2.4    0.0000   0.0000          ?        ?  1172.3258  16.6016          ?        ?      342.4        2.4       ?       ? 
1 1 1   32   12   17 o    557.7    2.5    0.0000   0.0000          ?        ?  3110.2388  28.0950          ?        ?      557.7        2.5       ?       ? 
1 1 1   32   12   18 o    714.2    3.0    0.0000   0.0000          ?        ?  5101.7876  43.4195          ?        ?      714.2        3.0       ?       ? 
1 1 1   32   12   19 o    962.7    3.7    0.0000   0.0000          ?        ?  9268.7793  71.5144          ?        ?      962.7        3.7       ?       ? 
1 1 1   32   12   20 o    576.0    2.7    0.0000   0.0000          ?        ?  3317.7583  31.2876          ?        ?      576.0        2.7       ?       ? 
1 1 1   32   12   21 o    572.1    2.6    0.0000   0.0000          ?        ?  3273.7004  30.0105          ?        ?      572.1        2.6       ?       ? 
1 1 1   32   12   22 o    194.9    3.4    0.0000   0.0000          ?        ?   379.9204  13.4090          ?        ?      194.9        3.4       ?       ? 
1 1 1   32   12   23 o     23.9   11.0    0.0000   0.0000          ?        ?    -9.5778  12.1319          ?        ?       23.9       11.0       ?       ? 
1 1 1   32   12   24 o    534.3    2.5    0.0000   0.0000          ?        ?  2855.4688  26.8179          ?        ?      534.3        2.5       ?       ? 
1 1 1   32   12   25 o    256.3    2.9    0.0000   0.0000          ?        ?   657.0388  14.6860          ?        ?      256.3        2.9       ?       ? 
1 1 1   32   12   26 o    144.2    4.6    0.0000   0.0000          ?        ?   208.1580  13.4090          ?        ?      144.2        4.6       ?       ? 
1 1 1   32   12   27 o    771.7    3.0    0.0000   0.0000          ?        ?  5955.4912  46.6121          ?        ?      771.7        3.0       ?       ? 
1 1 1   32   12   28 o    398.0    2.5    0.0000   0.0000          ?        ?  1584.1722  19.7942          ?        ?      398.0        2.5       ?       ? 
1 1 1   32   12   29 o    471.0    2.5    0.0000   0.0000          ?        ?  2218.8625  23.6253          ?        ?      471.0        2.5       ?       ? 
1 1 1   32   12   30 o    366.9    2.6    0.0000   0.0000          ?        ?  1346.6421  19.1556          ?        ?      366.9        2.6       ?       ? 
1 1 1   32   12   31 f    419.2    2.4    0.0000   0.0000          ?        ?  1757.8500  20.4327          ?        ?      419.2        2.4       ?       ? 
1 1 1   32   12   32 o    627.6    2.7    0.0000   0.0000          ?        ?  3939.0400  33.8416          ?        ?      627.6        2.7       ?       ? 
1 1 1   32   12   33 o    181.6    4.2    0.0000   0.0000          ?        ?   330.1157  15.3245          ?        ?      181.6        4.2       ?       ? 
1 1 1   32   12   34 o    357.4    2.7    0.0000   0.0000          ?        ?  1277.6818  19.1556          ?        ?      357.4        2.7       ?       ? 
1 1 1   32   12   35 o     97.5    7.5    0.0000   0.0000          ?        ?    95.1397  14.6860          ?        ?       97.5        7.5       ?       ? 
1 1 1   32   12   36 o    196.0    3.9    0.0000   0.0000          ?        ?   384.3900  15.3245          ?        ?      196.0        3.9       ?       ? 
1 1 1   32   12   37 o    180.2    4.4    0.0000   0.0000          ?        ?   325.0075  15.9630          ?        ?      180.2        4.4       ?       ? 
1 1 1   32   12   38 o    212.1    3.8    0.0000   0.0000          ?        ?   450.1577  15.9630          ?        ?      212.1        3.8       ?       ? 
1 1 1   32   12   39 o    492.3    2.6    0.0000   0.0000          ?        ?  2424.4668  25.5409          ?        ?      492.3        2.6       ?       ? 
1 1 1   32   12   40 o    293.5    3.0    0.0000   0.0000          ?        ?   862.0042  17.8786          ?        ?      293.5        3.0       ?       ? 
1 1 1   32   12   41 o    211.7    3.9    0.0000   0.0000          ?        ?   448.2422  16.6016          ?        ?      211.7        3.9       ?       ? 
1 1 1   32   12   42 o    481.7    2.6    0.0000   0.0000          ?        ?  2321.0261  24.9023          ?        ?      481.7        2.6       ?       ? 
1 1 1   32   12   43 o    114.3    6.7    0.0000   0.0000          ?        ?   130.8969  15.3245          ?        ?      114.3        6.7       ?       ? 
1 1 1   32   12   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   12   45 f    333.8    2.9    0.0000   0.0000          ?        ?  1114.8588  19.1556          ?        ?      333.8        2.9       ?       ? 
1 1 1   32   12   46 o     21.9   10.8    0.0000   0.0000          ?        ?   -35.1187  16.6016          ?        ?       21.9       10.8       ?       ? 
1 1 1   32   12   47 o    309.9    3.1    0.0000   0.0000          ?        ?   960.9750  19.1556          ?        ?      309.9        3.1       ?       ? 
1 1 1   32   12   48 o     20.1   10.0    0.0000   0.0000          ?        ?   -44.6965  16.6016          ?        ?       20.1       10.0       ?       ? 
1 1 1   32   12   49 o     76.8   11.2    0.0000   0.0000          ?        ?    59.3825  17.2401          ?        ?       76.8       11.2       ?       ? 
1 1 1   32   12   50 o    143.5    6.0    0.0000   0.0000          ?        ?   206.2425  17.2401          ?        ?      143.5        6.0       ?       ? 
1 1 1   32   12   51 o     26.5   12.5    0.0000   0.0000          ?        ?   -19.1556  17.2401          ?        ?       26.5       12.5       ?       ? 
1 1 1   32   12   52 o     18.6    9.4    0.0000   0.0000          ?        ?   -64.4907  17.8786          ?        ?       18.6        9.4       ?       ? 
1 1 1   32   12   53 o    447.9    2.8    0.0000   0.0000          ?        ?  2007.5120  24.9023          ?        ?      447.9        2.8       ?       ? 
1 1 1   32   12   54 o    124.8    7.2    0.0000   0.0000          ?        ?   156.4378  17.8786          ?        ?      124.8        7.2       ?       ? 
1 1 1   32   12   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   12   56 o    438.7    2.8    0.0000   0.0000          ?        ?  1925.7812  24.9023          ?        ?      438.7        2.8       ?       ? 
1 1 1   32   12   57 o    244.7    4.2    0.0000   0.0000          ?        ?   599.5718  20.4327          ?        ?      244.7        4.2       ?       ? 
1 1 1   32   12   58 o    195.1    5.4    0.0000   0.0000          ?        ?   381.8359  21.0712          ?        ?      195.1        5.4       ?       ? 
1 1 1   32   12   59 o    253.0    3.9    0.0000   0.0000          ?        ?   641.0757  19.7942          ?        ?      253.0        3.9       ?       ? 
1 1 1   32   12   60 o     20.6   10.4    0.0000   0.0000          ?        ?   -62.5751  19.7942          ?        ?       20.6       10.4       ?       ? 
1 1 1   32   12   61 o    169.7    6.0    0.0000   0.0000          ?        ?   289.2503  20.4327          ?        ?      169.7        6.0       ?       ? 
1 1 1   32   12   62 o     23.1   11.4    0.0000   0.0000          ?        ?   -42.1424  19.1556          ?        ?       23.1       11.4       ?       ? 
1 1 1   32   12   63 o    150.1    6.2    0.0000   0.0000          ?        ?   226.6752  18.5171          ?        ?      150.1        6.2       ?       ? 
1 1 1   32   12   64 o    196.0    5.1    0.0000   0.0000          ?        ?   385.6671  19.7942          ?        ?      196.0        5.1       ?       ? 
1 1 1   32   12   65 o    307.4    3.5    0.0000   0.0000          ?        ?   946.9276  21.7097          ?        ?      307.4        3.5       ?       ? 
1 1 1   32   12   66 o     73.6   14.4    0.0000   0.0000          ?        ?    58.1055  20.4327          ?        ?       73.6       14.4       ?       ? 
1 1 1   32   13    0 o    847.6    5.6 7185.9224  95.1397  7185.9224  95.1397  7185.9224  95.1397      847.6      5.6      847.6        5.6     0.0     0.0 
1 1 1   32   13    1 o    557.0    2.8    0.0000   0.0000          ?        ?  3103.2151  31.2876          ?        ?      557.0        2.8       ?       ? 
1 1 1   32   13    2 o    703.4    3.2    0.0000   0.0000          ?        ?  4948.5425  45.3350          ?        ?      703.4        3.2       ?       ? 
1 1 1   32   13    3 o    291.0    2.5    0.0000   0.0000          ?        ?   846.6797  14.6860          ?        ?      291.0        2.5       ?       ? 
1 1 1   32   13    4 o    999.1    4.2    0.0000   0.0000          ?        ?  9984.5625  84.2849          ?        ?      999.1        4.2       ?       ? 
1 1 1   32   13    5 o    377.3    2.5    0.0000   0.0000          ?        ?  1423.2646  18.5171          ?        ?      377.3        2.5       ?       ? 
1 1 1   32   13    6 o   1103.8    4.2    0.0000   0.0000          ?        ? 12186.1855  91.9471          ?        ?     1103.8        4.2       ?       ? 
1 1 1   32   13    7 o    815.1    3.3    0.0000   0.0000          ?        ?  6645.0942  53.6358          ?        ?      815.1        3.3       ?       ? 
1 1 1   32   13    8 o    206.8    2.5    0.0000   0.0000          ?        ?   427.8095  10.2163          ?        ?      206.8        2.5       ?       ? 
1 1 1   32   13    9 o    676.6    2.8    0.0000   0.0000          ?        ?  4577.5615  37.6728          ?        ?      676.6        2.8       ?       ? 
1 1 1   32   13   10 o    511.8    2.5    0.0000   0.0000          ?        ?  2619.2158  25.5409          ?        ?      511.8        2.5       ?       ? 
1 1 1   32   13   11 o   1001.1    3.7    0.0000   0.0000          ?        ? 10023.5127  74.7070          ?        ?     1001.1        3.7       ?       ? 
1 1 1   32   13   12 o    307.2    2.4    0.0000   0.0000          ?        ?   943.7350  14.6860          ?        ?      307.2        2.4       ?       ? 
1 1 1   32   13   13 o    380.3    2.4    0.0000   0.0000          ?        ?  1446.2515  17.8786          ?        ?      380.3        2.4       ?       ? 
1 1 1   32   13   14 o    527.1    2.5    0.0000   0.0000          ?        ?  2778.2075  26.1794          ?        ?      527.1        2.5       ?       ? 
1 1 1   32   13   15 o    935.2    3.4    0.0000   0.0000          ?        ?  8747.1084  63.8522          ?        ?      935.2        3.4       ?       ? 
1 1 1   32   13   16 o    909.0    3.4    0.0000   0.0000          ?        ?  8263.7461  61.2981          ?        ?      909.0        3.4       ?       ? 
1 1 1   32   13   17 o    594.5    2.7    0.0000   0.0000          ?        ?  3534.2173  31.9261          ?        ?      594.5        2.7       ?       ? 
1 1 1   32   13   18 o    412.3    2.4    0.0000   0.0000          ?        ?  1700.3831  19.7942          ?        ?      412.3        2.4       ?       ? 
1 1 1   32   13   19 o    868.5    3.3    0.0000   0.0000          ?        ?  7544.7715  58.1055          ?        ?      868.5        3.3       ?       ? 
1 1 1   32   13   20 o    610.7    2.7    0.0000   0.0000          ?        ?  3730.2434  32.5646          ?        ?      610.7        2.7       ?       ? 
1 1 1   32   13   21 o    142.7    4.3    0.0000   0.0000          ?        ?   203.6884  12.1319          ?        ?      142.7        4.3       ?       ? 
1 1 1   32   13   22 o    260.5    2.9    0.0000   0.0000          ?        ?   678.7485  15.3245          ?        ?      260.5        2.9       ?       ? 
1 1 1   32   13   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   13   24 o    874.9    3.2    0.0000   0.0000          ?        ?  7656.5127  56.8284          ?        ?      874.9        3.2       ?       ? 
1 1 1   32   13   25 o    339.4    2.5    0.0000   0.0000          ?        ?  1151.8929  17.2401          ?        ?      339.4        2.5       ?       ? 
1 1 1   32   13   26 o    710.8    2.8    0.0000   0.0000          ?        ?  5052.6216  40.2269          ?        ?      710.8        2.8       ?       ? 
1 1 1   32   13   27 o     51.9   12.4    0.0000   0.0000          ?        ?    28.0950  12.7704          ?        ?       51.9       12.4       ?       ? 
1 1 1   32   13   28 o    372.4    2.5    0.0000   0.0000          ?        ?  1386.8689  18.5171          ?        ?      372.4        2.5       ?       ? 
1 1 1   32   13   29 o    278.4    2.9    0.0000   0.0000          ?        ?   775.1653  15.9630          ?        ?      278.4        2.9       ?       ? 
1 1 1   32   13   30 o    180.9    4.1    0.0000   0.0000          ?        ?   327.5616  14.6860          ?        ?      180.9        4.1       ?       ? 
1 1 1   32   13   31 o    365.4    2.5    0.0000   0.0000          ?        ?  1335.1488  18.5171          ?        ?      365.4        2.5       ?       ? 
1 1 1   32   13   32 o    198.1    3.7    0.0000   0.0000          ?        ?   392.6908  14.6860          ?        ?      198.1        3.7       ?       ? 
1 1 1   32   13   33 o    707.1    2.9    0.0000   0.0000          ?        ?  5001.5400  41.5039          ?        ?      707.1        2.9       ?       ? 
1 1 1   32   13   34 o    552.2    2.6    0.0000   0.0000          ?        ?  3049.5793  28.7335          ?        ?      552.2        2.6       ?       ? 
1 1 1   32   13   35 o    161.2    4.4    0.0000   0.0000          ?        ?   259.8783  14.0475          ?        ?      161.2        4.4       ?       ? 
1 1 1   32   13   36 o    356.6    2.6    0.0000   0.0000          ?        ?  1271.9351  18.5171          ?        ?      356.6        2.6       ?       ? 
1 1 1   32   13   37 o    296.5    3.0    0.0000   0.0000          ?        ?   879.2443  17.8786          ?        ?      296.5        3.0       ?       ? 
1 1 1   32   13   38 o     57.4   13.6    0.0000   0.0000          ?        ?    34.4802  15.3245          ?        ?       57.4       13.6       ?       ? 
1 1 1   32   13   39 o    187.7    4.3    0.0000   0.0000          ?        ?   352.4639  15.9630          ?        ?      187.7        4.3       ?       ? 
1 1 1   32   13   40 o    674.0    3.0    0.0000   0.0000          ?        ?  4543.7197  40.2269          ?        ?      674.0        3.0       ?       ? 
1 1 1   32   13   41 o    255.4    3.4    0.0000   0.0000          ?        ?   652.5691  17.2401          ?        ?      255.4        3.4       ?       ? 
1 1 1   32   13   42 o    412.8    2.6    0.0000   0.0000          ?        ?  1704.8528  21.7097          ?        ?      412.8        2.6       ?       ? 
1 1 1   32   13   43 o    283.4    3.2    0.0000   0.0000          ?        ?   803.2603  17.8786          ?        ?      283.4        3.2       ?       ? 
1 1 1   32   13   44 o    162.1    5.1    0.0000   0.0000          ?        ?   263.0709  16.6016          ?        ?      162.1        5.1       ?       ? 
1 1 1   32   13   45 o    332.4    3.0    0.0000   0.0000          ?        ?  1105.2810  19.7942          ?        ?      332.4        3.0       ?       ? 
1 1 1   32   13   46 o    188.1    4.6    0.0000   0.0000          ?        ?   354.3795  17.2401          ?        ?      188.1        4.6       ?       ? 
1 1 1   32   13   47 o     90.9    9.1    0.0000   0.0000          ?        ?    83.0078  16.6016          ?        ?       90.9        9.1       ?       ? 
1 1 1   32   13   48 o    145.7    5.7    0.0000   0.0000          ?        ?   212.6277  16.6016          ?        ?      145.7        5.7       ?       ? 
1 1 1   32   13   49 o     73.8   11.7    0.0000   0.0000          ?        ?    54.9129  17.2401          ?        ?       73.8       11.7       ?       ? 
1 1 1   32   13   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   13   51 o    257.2    3.6    0.0000   0.0000          ?        ?   662.1469  18.5171          ?        ?      257.2        3.6       ?       ? 
1 1 1   32   13   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   13   53 o    288.6    3.4    0.0000   0.0000          ?        ?   833.9093  19.7942          ?        ?      288.6        3.4       ?       ? 
1 1 1   32   13   54 o    362.1    3.0    0.0000   0.0000          ?        ?  1312.1620  21.7097          ?        ?      362.1        3.0       ?       ? 
1 1 1   32   13   55 o    240.0    4.0    0.0000   0.0000          ?        ?   576.5850  19.1556          ?        ?      240.0        4.0       ?       ? 
1 1 1   32   13   56 o    239.9    4.1    0.0000   0.0000          ?        ?   576.5850  19.7942          ?        ?      239.9        4.1       ?       ? 
1 1 1   32   13   57 f    194.0    4.9    0.0000   0.0000          ?        ?   377.3663  19.1556          ?        ?      194.0        4.9       ?       ? 
1 1 1   32   13   58 o    191.7    5.2    0.0000   0.0000          ?        ?   368.4270  19.7942          ?        ?      191.7        5.2       ?       ? 
1 1 1   32   13   59 f    167.5    6.1    0.0000   0.0000          ?        ?   281.5880  20.4327          ?        ?      167.5        6.1       ?       ? 
1 1 1   32   13   60 o    387.0    3.0    0.0000   0.0000          ?        ?  1499.2488  22.9868          ?        ?      387.0        3.0       ?       ? 
1 1 1   32   13   61 o    152.9    6.3    0.0000   0.0000          ?        ?   234.9760  19.1556          ?        ?      152.9        6.3       ?       ? 
1 1 1   32   13   62 o     63.0   16.5    0.0000   0.0000          ?        ?    42.7809  21.0712          ?        ?       63.0       16.5       ?       ? 
1 1 1   32   13   63 o     38.1   15.7    0.0000   0.0000          ?        ?     5.7467  19.1556          ?        ?       38.1       15.7       ?       ? 
1 1 1   32   13   64 o     80.1   12.0    0.0000   0.0000          ?        ?    65.7677  19.1556          ?        ?       80.1       12.0       ?       ? 
1 1 1   32   13   65 o     26.2   12.6    0.0000   0.0000          ?        ?   -26.8179  19.1556          ?        ?       26.2       12.6       ?       ? 
1 1 1   32   13   66 o     67.0   14.2    0.0000   0.0000          ?        ?    48.5276  18.5171          ?        ?       67.0       14.2       ?       ? 
1 1 1   32   14    0 o    229.8    4.6  528.6959  21.0712   528.6959  21.0712   528.6959  21.0712      229.8      4.6      229.8        4.6     0.0     0.0 
1 1 1   32   14    1 f     27.3   12.0    0.0000   0.0000          ?        ?    -3.8311  12.7704          ?        ?       27.3       12.0       ?       ? 
1 1 1   32   14    2 o    540.5    3.1    0.0000   0.0000          ?        ?  2921.2363  33.8416          ?        ?      540.5        3.1       ?       ? 
1 1 1   32   14    3 o    117.4    4.1    0.0000   0.0000          ?        ?   137.9207   9.5778          ?        ?      117.4        4.1       ?       ? 
1 1 1   32   14    4 o   1172.3    5.0    0.0000   0.0000          ?        ? 13747.3711 118.1265          ?        ?     1172.3        5.0       ?       ? 
1 1 1   32   14    5 o    269.8    2.8    0.0000   0.0000          ?        ?   727.9147  15.3245          ?        ?      269.8        2.8       ?       ? 
1 1 1   32   14    6 o    517.7    2.7    0.0000   0.0000          ?        ?  2679.8752  27.4564          ?        ?      517.7        2.7       ?       ? 
1 1 1   32   14    7 o    321.0    2.4    0.0000   0.0000          ?        ?  1030.5739  15.3245          ?        ?      321.0        2.4       ?       ? 
1 1 1   32   14    8 o    494.2    2.5    0.0000   0.0000          ?        ?  2442.9839  24.9023          ?        ?      494.2        2.5       ?       ? 
1 1 1   32   14    9 o    477.2    2.4    0.0000   0.0000          ?        ?  2276.9683  22.9868          ?        ?      477.2        2.4       ?       ? 
1 1 1   32   14   10 o    222.6    2.6    0.0000   0.0000          ?        ?   495.4928  11.4934          ?        ?      222.6        2.6       ?       ? 
1 1 1   32   14   11 o     34.8   12.0    0.0000   0.0000          ?        ?    10.8549  10.2163          ?        ?       34.8       12.0       ?       ? 
1 1 1   32   14   12 o    519.1    2.5    0.0000   0.0000          ?        ?  2695.1997  25.5409          ?        ?      519.1        2.5       ?       ? 
1 1 1   32   14   13 o    788.5    3.1    0.0000   0.0000          ?        ?  6217.2852  48.5276          ?        ?      788.5        3.1       ?       ? 
1 1 1   32   14   14 o    301.3    2.4    0.0000   0.0000          ?        ?   907.9777  14.6860          ?        ?      301.3        2.4       ?       ? 
1 1 1   32   14   15 o   1015.2    3.7    0.0000   0.0000          ?        ? 10308.2930  75.3456          ?        ?     1015.2        3.7       ?       ? 
1 1 1   32   14   16 o    362.1    2.6    0.0000   0.0000          ?        ?  1311.5234  18.5171          ?        ?      362.1        2.6       ?       ? 
1 1 1   32   14   17 o    366.0    2.4    0.0000   0.0000          ?        ?  1339.6184  17.2401          ?        ?      366.0        2.4       ?       ? 
1 1 1   32   14   18 o    488.3    2.4    0.0000   0.0000          ?        ?  2384.2397  23.6253          ?        ?      488.3        2.4       ?       ? 
1 1 1   32   14   19 o    528.5    2.5    0.0000   0.0000          ?        ?  2793.5322  26.1794          ?        ?      528.5        2.5       ?       ? 
1 1 1   32   14   20 o    712.3    2.8    0.0000   0.0000          ?        ?  5074.9697  40.2269          ?        ?      712.3        2.8       ?       ? 
1 1 1   32   14   21 o    316.2    2.4    0.0000   0.0000          ?        ?   999.9249  15.3245          ?        ?      316.2        2.4       ?       ? 
1 1 1   32   14   22 o    456.0    2.4    0.0000   0.0000          ?        ?  2079.6650  21.7097          ?        ?      456.0        2.4       ?       ? 
1 1 1   32   14   23 o    389.0    2.3    0.0000   0.0000          ?        ?  1513.2963  17.8786          ?        ?      389.0        2.3       ?       ? 
1 1 1   32   14   24 o    429.0    2.5    0.0000   0.0000          ?        ?  1840.8578  21.7097          ?        ?      429.0        2.5       ?       ? 
1 1 1   32   14   25 o    579.9    2.8    0.0000   0.0000          ?        ?  3363.7319  31.9261          ?        ?      579.9        2.8       ?       ? 
1 1 1   32   14   26 o    707.8    2.9    0.0000   0.0000          ?        ?  5010.4795  40.8654          ?        ?      707.8        2.9       ?       ? 
1 1 1   32   14   27 o    178.1    3.9    0.0000   0.0000          ?        ?   317.3452  14.0475          ?        ?      178.1        3.9       ?       ? 
1 1 1   32   14   28 o    217.2    3.2    0.0000   0.0000          ?        ?   471.8675  14.0475          ?        ?      217.2        3.2       ?       ? 
1 1 1   32   14   29 o    437.1    2.5    0.0000   0.0000          ?        ?  1910.4568  21.7097          ?        ?      437.1        2.5       ?       ? 
1 1 1   32   14   30 o    278.9    2.6    0.0000   0.0000          ?        ?   777.7194  14.6860          ?        ?      278.9        2.6       ?       ? 
1 1 1   32   14   31 o    217.0    3.4    0.0000   0.0000          ?        ?   471.2290  14.6860          ?        ?      217.0        3.4       ?       ? 
1 1 1   32   14   32 o    540.1    2.6    0.0000   0.0000          ?        ?  2918.0439  28.0950          ?        ?      540.1        2.6       ?       ? 
1 1 1   32   14   33 o    306.3    2.9    0.0000   0.0000          ?        ?   938.6268  17.8786          ?        ?      306.3        2.9       ?       ? 
1 1 1   32   14   34 o    758.8    2.9    0.0000   0.0000          ?        ?  5759.4648  44.6965          ?        ?      758.8        2.9       ?       ? 
1 1 1   32   14   35 f    378.1    2.6    0.0000   0.0000          ?        ?  1429.6499  19.7942          ?        ?      378.1        2.6       ?       ? 
1 1 1   32   14   36 o     68.1   10.8    0.0000   0.0000          ?        ?    46.6121  14.6860          ?        ?       68.1       10.8       ?       ? 
1 1 1   32   14   37 o    427.6    2.5    0.0000   0.0000          ?        ?  1828.7260  21.7097          ?        ?      427.6        2.5       ?       ? 
1 1 1   32   14   38 o    390.9    2.8    0.0000   0.0000          ?        ?  1528.6207  21.7097          ?        ?      390.9        2.8       ?       ? 
1 1 1   32   14   39 o    436.7    2.6    0.0000   0.0000          ?        ?  1907.2642  22.3483          ?        ?      436.7        2.6       ?       ? 
1 1 1   32   14   40 o    420.9    2.6    0.0000   0.0000          ?        ?  1771.8975  21.7097          ?        ?      420.9        2.6       ?       ? 
1 1 1   32   14   41 o    252.0    3.4    0.0000   0.0000          ?        ?   635.3290  17.2401          ?        ?      252.0        3.4       ?       ? 
1 1 1   32   14   42 o    160.9    5.0    0.0000   0.0000          ?        ?   259.2398  15.9630          ?        ?      160.9        5.0       ?       ? 
1 1 1   32   14   43 o    128.2    6.2    0.0000   0.0000          ?        ?   164.7386  15.9630          ?        ?      128.2        6.2       ?       ? 
1 1 1   32   14   44 o    283.3    3.2    0.0000   0.0000          ?        ?   803.2603  17.8786          ?        ?      283.3        3.2       ?       ? 
1 1 1   32   14   45 o    225.8    3.7    0.0000   0.0000          ?        ?   510.1788  16.6016          ?        ?      225.8        3.7       ?       ? 
1 1 1   32   14   46 o    323.4    3.0    0.0000   0.0000          ?        ?  1046.5369  19.1556          ?        ?      323.4        3.0       ?       ? 
1 1 1   32   14   47 o    171.1    4.9    0.0000   0.0000          ?        ?   293.0815  16.6016          ?        ?      171.1        4.9       ?       ? 
1 1 1   32   14   48 o    192.2    4.5    0.0000   0.0000          ?        ?   369.7040  17.2401          ?        ?      192.2        4.5       ?       ? 
1 1 1   32   14   49 o    370.0    2.8    0.0000   0.0000          ?        ?  1369.6289  21.0712          ?        ?      370.0        2.8       ?       ? 
1 1 1   32   14   50 o     97.3    8.9    0.0000   0.0000          ?        ?    95.1397  17.2401          ?        ?       97.3        8.9       ?       ? 
1 1 1   32   14   51 o    148.2    6.0    0.0000   0.0000          ?        ?   220.2900  17.8786          ?        ?      148.2        6.0       ?       ? 
1 1 1   32   14   52 o     33.0   14.4    0.0000   0.0000          ?        ?    -3.1926  17.8786          ?        ?       33.0       14.4       ?       ? 
1 1 1   32   14   53 f    157.4    5.7    0.0000   0.0000          ?        ?   248.3849  17.8786          ?        ?      157.4        5.7       ?       ? 
1 1 1   32   14   54 f     94.8    9.8    0.0000   0.0000          ?        ?    90.6701  18.5171          ?        ?       94.8        9.8       ?       ? 
1 1 1   32   14   55 f    150.9    6.1    0.0000   0.0000          ?        ?   228.5907  18.5171          ?        ?      150.9        6.1       ?       ? 
1 1 1   32   14   56 o    150.9    6.3    0.0000   0.0000          ?        ?   228.5907  19.1556          ?        ?      150.9        6.3       ?       ? 
1 1 1   32   14   57 o    231.4    4.0    0.0000   0.0000          ?        ?   536.3582  18.5171          ?        ?      231.4        4.0       ?       ? 
1 1 1   32   14   58 o    177.1    5.6    0.0000   0.0000          ?        ?   314.7912  19.7942          ?        ?      177.1        5.6       ?       ? 
1 1 1   32   14   59 o    105.8    9.1    0.0000   0.0000          ?        ?   113.0183  19.1556          ?        ?      105.8        9.1       ?       ? 
1 1 1   32   14   60 o     63.2   15.3    0.0000   0.0000          ?        ?    42.7809  19.1556          ?        ?       63.2       15.3       ?       ? 
1 1 1   32   14   61 o     94.2   10.5    0.0000   0.0000          ?        ?    90.0316  19.7942          ?        ?       94.2       10.5       ?       ? 
1 1 1   32   14   62 o    133.3    7.7    0.0000   0.0000          ?        ?   179.4246  20.4327          ?        ?      133.3        7.7       ?       ? 
1 1 1   32   14   63 o     26.4   12.7    0.0000   0.0000          ?        ?   -28.7335  19.7942          ?        ?       26.4       12.7       ?       ? 
1 1 1   32   14   64 o     31.1   14.1    0.0000   0.0000          ?        ?   -10.2163  19.1556          ?        ?       31.1       14.1       ?       ? 
1 1 1   32   14   65 o    176.0    5.4    0.0000   0.0000          ?        ?   311.5985  19.1556          ?        ?      176.0        5.4       ?       ? 
1 1 1   32   15    0 o    383.6    4.1 1472.4309  31.2876  1472.4309  31.2876  1472.4309  31.2876      383.6      4.1      383.6        4.1     0.0     0.0 
1 1 1   32   15    1 o    478.5    2.9    0.0000   0.0000          ?        ?  2289.7385  27.4564          ?        ?      478.5        2.9       ?       ? 
1 1 1   32   15    2 o    423.8    2.9    0.0000   0.0000          ?        ?  1796.1613  24.9023          ?        ?      423.8        2.9       ?       ? 
1 1 1   32   15    3 o    885.2    4.0    0.0000   0.0000          ?        ?  7837.8530  71.5144          ?        ?      885.2        4.0       ?       ? 
1 1 1   32   15    4 o    741.9    3.4    0.0000   0.0000          ?        ?  5505.3335  49.8047          ?        ?      741.9        3.4       ?       ? 
1 1 1   32   15    5 o    996.1    4.0    0.0000   0.0000          ?        ?  9923.2646  79.8152          ?        ?      996.1        4.0       ?       ? 
1 1 1   32   15    6 o   1214.4    4.8    0.0000   0.0000          ?        ? 14750.4883 115.5724          ?        ?     1214.4        4.8       ?       ? 
1 1 1   32   15    7 o    710.6    3.2    0.0000   0.0000          ?        ?  5050.7061  45.9736          ?        ?      710.6        3.2       ?       ? 
1 1 1   32   15    8 o    551.3    2.7    0.0000   0.0000          ?        ?  3039.3630  29.3720          ?        ?      551.3        2.7       ?       ? 
1 1 1   32   15    9 o    431.8    2.4    0.0000   0.0000          ?        ?  1864.4832  21.0712          ?        ?      431.8        2.4       ?       ? 
1 1 1   32   15   10 o    693.2    3.0    0.0000   0.0000          ?        ?  4805.5137  41.5039          ?        ?      693.2        3.0       ?       ? 
1 1 1   32   15   11 o    557.3    2.6    0.0000   0.0000          ?        ?  3105.7690  29.3720          ?        ?      557.3        2.6       ?       ? 
1 1 1   32   15   12 o    472.7    2.3    0.0000   0.0000          ?        ?  2234.8257  21.7097          ?        ?      472.7        2.3       ?       ? 
1 1 1   32   15   13 o    230.3    2.5    0.0000   0.0000          ?        ?   530.6115  11.4934          ?        ?      230.3        2.5       ?       ? 
1 1 1   32   15   14 o    326.8    2.4    0.0000   0.0000          ?        ?  1068.2467  15.9630          ?        ?      326.8        2.4       ?       ? 
1 1 1   32   15   15 o    379.1    2.4    0.0000   0.0000          ?        ?  1437.3123  17.8786          ?        ?      379.1        2.4       ?       ? 
1 1 1   32   15   16 o    955.5    3.5    0.0000   0.0000          ?        ?  9130.8594  67.6833          ?        ?      955.5        3.5       ?       ? 
1 1 1   32   15   17 o    744.0    3.0    0.0000   0.0000          ?        ?  5535.9824  44.0580          ?        ?      744.0        3.0       ?       ? 
1 1 1   32   15   18 o    397.8    2.2    0.0000   0.0000          ?        ?  1582.2566  17.8786          ?        ?      397.8        2.2       ?       ? 
1 1 1   32   15   19 o    302.3    2.5    0.0000   0.0000          ?        ?   913.7245  15.3245          ?        ?      302.3        2.5       ?       ? 
1 1 1   32   15   20 o    307.2    2.4    0.0000   0.0000          ?        ?   943.7350  14.6860          ?        ?      307.2        2.4       ?       ? 
1 1 1   32   15   21 o    595.2    2.6    0.0000   0.0000          ?        ?  3543.1567  31.2876          ?        ?      595.2        2.6       ?       ? 
1 1 1   32   15   22 o    250.0    2.7    0.0000   0.0000          ?        ?   625.1127  13.4090          ?        ?      250.0        2.7       ?       ? 
1 1 1   32   15   23 o     50.1   12.7    0.0000   0.0000          ?        ?    26.1794  12.7704          ?        ?       50.1       12.7       ?       ? 
1 1 1   32   15   24 o    398.2    2.5    0.0000   0.0000          ?        ?  1586.0876  19.7942          ?        ?      398.2        2.5       ?       ? 
1 1 1   32   15   25 o    382.1    2.8    0.0000   0.0000          ?        ?  1460.2990  21.0712          ?        ?      382.1        2.8       ?       ? 
1 1 1   32   15   26 o    536.9    2.6    0.0000   0.0000          ?        ?  2883.5637  28.0950          ?        ?      536.9        2.6       ?       ? 
1 1 1   32   15   27 o    442.4    2.5    0.0000   0.0000          ?        ?  1957.0687  21.7097          ?        ?      442.4        2.5       ?       ? 
1 1 1   32   15   28 o     17.6    8.8    0.0000   0.0000          ?        ?   -30.6490  12.1319          ?        ?       17.6        8.8       ?       ? 
1 1 1   32   15   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   15   30 o     16.8    8.5    0.0000   0.0000          ?        ?   -44.0580  13.4090          ?        ?       16.8        8.5       ?       ? 
1 1 1   32   15   31 o     86.0    8.2    0.0000   0.0000          ?        ?    74.0685  14.0475          ?        ?       86.0        8.2       ?       ? 
1 1 1   32   15   32 o    284.5    2.9    0.0000   0.0000          ?        ?   809.6454  16.6016          ?        ?      284.5        2.9       ?       ? 
1 1 1   32   15   33 o    109.5    6.4    0.0000   0.0000          ?        ?   120.0421  14.0475          ?        ?      109.5        6.4       ?       ? 
1 1 1   32   15   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   15   35 o    666.2    3.0    0.0000   0.0000          ?        ?  4439.6406  39.5883          ?        ?      666.2        3.0       ?       ? 
1 1 1   32   15   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   15   37 o    132.9    6.0    0.0000   0.0000          ?        ?   176.8705  15.9630          ?        ?      132.9        6.0       ?       ? 
1 1 1   32   15   38 o     97.7    7.8    0.0000   0.0000          ?        ?    95.7782  15.3245          ?        ?       97.7        7.8       ?       ? 
1 1 1   32   15   39 o    399.5    2.7    0.0000   0.0000          ?        ?  1596.3041  21.7097          ?        ?      399.5        2.7       ?       ? 
1 1 1   32   15   40 o     36.6   14.6    0.0000   0.0000          ?        ?     7.0237  15.9630          ?        ?       36.6       14.6       ?       ? 
1 1 1   32   15   41 o    419.4    2.7    0.0000   0.0000          ?        ?  1759.1271  22.3483          ?        ?      419.4        2.7       ?       ? 
1 1 1   32   15   42 o    301.8    3.0    0.0000   0.0000          ?        ?   911.1703  17.8786          ?        ?      301.8        3.0       ?       ? 
1 1 1   32   15   43 o    135.2    6.1    0.0000   0.0000          ?        ?   183.2557  16.6016          ?        ?      135.2        6.1       ?       ? 
1 1 1   32   15   44 o     34.4   14.2    0.0000   0.0000          ?        ?     3.1926  15.9630          ?        ?       34.4       14.2       ?       ? 
1 1 1   32   15   45 o    286.7    3.1    0.0000   0.0000          ?        ?   822.4159  17.8786          ?        ?      286.7        3.1       ?       ? 
1 1 1   32   15   46 o    121.8    6.8    0.0000   0.0000          ?        ?   148.7755  16.6016          ?        ?      121.8        6.8       ?       ? 
1 1 1   32   15   47 o    250.4    3.6    0.0000   0.0000          ?        ?   627.6667  17.8786          ?        ?      250.4        3.6       ?       ? 
1 1 1   32   15   48 o     90.2    9.2    0.0000   0.0000          ?        ?    81.7308  16.6016          ?        ?       90.2        9.2       ?       ? 
1 1 1   32   15   49 o    341.0    3.0    0.0000   0.0000          ?        ?  1163.3864  20.4327          ?        ?      341.0        3.0       ?       ? 
1 1 1   32   15   50 o    214.4    4.3    0.0000   0.0000          ?        ?   460.3741  18.5171          ?        ?      214.4        4.3       ?       ? 
1 1 1   32   15   51 o    215.0    4.3    0.0000   0.0000          ?        ?   462.9282  18.5171          ?        ?      215.0        4.3       ?       ? 
1 1 1   32   15   52 o     58.7   15.1    0.0000   0.0000          ?        ?    36.3957  17.8786          ?        ?       58.7       15.1       ?       ? 
1 1 1   32   15   53 o     46.6   15.9    0.0000   0.0000          ?        ?    20.4327  17.8786          ?        ?       46.6       15.9       ?       ? 
1 1 1   32   15   54 o    264.1    3.6    0.0000   0.0000          ?        ?   698.5427  19.1556          ?        ?      264.1        3.6       ?       ? 
1 1 1   32   15   55 o     24.2   11.8    0.0000   0.0000          ?        ?   -33.2031  18.5171          ?        ?       24.2       11.8       ?       ? 
1 1 1   32   15   56 o    322.2    3.3    0.0000   0.0000          ?        ?  1039.5132  21.0712          ?        ?      322.2        3.3       ?       ? 
1 1 1   32   15   57 o    301.5    3.4    0.0000   0.0000          ?        ?   909.8933  20.4327          ?        ?      301.5        3.4       ?       ? 
1 1 1   32   15   58 o    160.5    6.2    0.0000   0.0000          ?        ?   258.6013  19.7942          ?        ?      160.5        6.2       ?       ? 
1 1 1   32   15   59 o     97.6   10.1    0.0000   0.0000          ?        ?    96.4168  19.7942          ?        ?       97.6       10.1       ?       ? 
1 1 1   32   15   60 o    307.8    3.4    0.0000   0.0000          ?        ?   948.8432  21.0712          ?        ?      307.8        3.4       ?       ? 
1 1 1   32   15   61 o     26.6   12.7    0.0000   0.0000          ?        ?   -25.5409  19.1556          ?        ?       26.6       12.7       ?       ? 
1 1 1   32   15   62 o    101.9    9.4    0.0000   0.0000          ?        ?   105.3561  19.1556          ?        ?      101.9        9.4       ?       ? 
1 1 1   32   15   63 o    202.7    4.9    0.0000   0.0000          ?        ?   412.4850  19.7942          ?        ?      202.7        4.9       ?       ? 
1 1 1   32   15   64 o    126.6    7.8    0.0000   0.0000          ?        ?   162.1845  19.7942          ?        ?      126.6        7.8       ?       ? 
1 1 1   32   16    0 o    209.1    4.9  438.0258  20.4327   438.0258  20.4327   438.0258  20.4327      209.1      4.9      209.1        4.9     0.0     0.0 
1 1 1   32   16    1 o    166.1    3.8    0.0000   0.0000          ?        ?   275.8413  12.7704          ?        ?      166.1        3.8       ?       ? 
1 1 1   32   16    2 o    423.8    2.8    0.0000   0.0000          ?        ?  1796.1613  23.6253          ?        ?      423.8        2.8       ?       ? 
1 1 1   32   16    3 o    457.8    2.9    0.0000   0.0000          ?        ?  2095.6282  26.1794          ?        ?      457.8        2.9       ?       ? 
1 1 1   32   16    4 o    151.6    4.6    0.0000   0.0000          ?        ?   229.8678  14.0475          ?        ?      151.6        4.6       ?       ? 
1 1 1   32   16    5 o   1131.7    4.5    0.0000   0.0000          ?        ? 12810.6602 102.1635          ?        ?     1131.7        4.5       ?       ? 
1 1 1   32   16    6 o    672.8    3.2    0.0000   0.0000          ?        ?  4527.1182  42.7809          ?        ?      672.8        3.2       ?       ? 
1 1 1   32   16    7 f    428.4    2.5    0.0000   0.0000          ?        ?  1835.1111  21.0712          ?        ?      428.4        2.5       ?       ? 
1 1 1   32   16    8 o    439.8    2.5    0.0000   0.0000          ?        ?  1934.7206  21.7097          ?        ?      439.8        2.5       ?       ? 
1 1 1   32   16    9 o    282.1    2.4    0.0000   0.0000          ?        ?   795.5980  13.4090          ?        ?      282.1        2.4       ?       ? 
1 1 1   32   16   10 o    365.0    2.1    0.0000   0.0000          ?        ?  1332.5946  15.3245          ?        ?      365.0        2.1       ?       ? 
1 1 1   32   16   11 o    161.0    3.2    0.0000   0.0000          ?        ?   259.2398  10.2163          ?        ?      161.0        3.2       ?       ? 
1 1 1   32   16   12 o    246.9    2.7    0.0000   0.0000          ?        ?   609.7881  13.4090          ?        ?      246.9        2.7       ?       ? 
1 1 1   32   16   13 o    850.5    3.3    0.0000   0.0000          ?        ?  7234.4502  56.8284          ?        ?      850.5        3.3       ?       ? 
1 1 1   32   16   14 o    453.4    2.4    0.0000   0.0000          ?        ?  2056.0396  21.7097          ?        ?      453.4        2.4       ?       ? 
1 1 1   32   16   15 f    562.3    2.6    0.0000   0.0000          ?        ?  3161.9592  29.3720          ?        ?      562.3        2.6       ?       ? 
1 1 1   32   16   16 o   1217.6    4.3    0.0000   0.0000          ?        ? 14829.6650 105.3561          ?        ?     1217.6        4.3       ?       ? 
1 1 1   32   16   17 o    293.1    2.4    0.0000   0.0000          ?        ?   859.4501  14.0475          ?        ?      293.1        2.4       ?       ? 
1 1 1   32   16   18 o    256.4    2.5    0.0000   0.0000          ?        ?   657.6772  12.7704          ?        ?      256.4        2.5       ?       ? 
1 1 1   32   16   19 o    324.4    2.4    0.0000   0.0000          ?        ?  1052.2837  15.3245          ?        ?      324.4        2.4       ?       ? 
1 1 1   32   16   20 o    643.8    2.7    0.0000   0.0000          ?        ?  4145.2827  35.1187          ?        ?      643.8        2.7       ?       ? 
1 1 1   32   16   21 o    474.9    2.4    0.0000   0.0000          ?        ?  2255.2585  22.9868          ?        ?      474.9        2.4       ?       ? 
1 1 1   32   16   22 o    592.7    2.5    0.0000   0.0000          ?        ?  3513.7844  30.0105          ?        ?      592.7        2.5       ?       ? 
1 1 1   32   16   23 o    501.7    2.4    0.0000   0.0000          ?        ?  2517.6907  24.2638          ?        ?      501.7        2.4       ?       ? 
1 1 1   32   16   24 o    584.8    2.5    0.0000   0.0000          ?        ?  3419.9216  29.3720          ?        ?      584.8        2.5       ?       ? 
1 1 1   32   16   25 o    494.9    2.5    0.0000   0.0000          ?        ?  2450.0076  24.2638          ?        ?      494.9        2.5       ?       ? 
1 1 1   32   16   26 o    198.6    3.7    0.0000   0.0000          ?        ?   394.6064  14.6860          ?        ?      198.6        3.7       ?       ? 
1 1 1   32   16   27 o    485.0    2.4    0.0000   0.0000          ?        ?  2352.9521  23.6253          ?        ?      485.0        2.4       ?       ? 
1 1 1   32   16   28 o    315.6    2.5    0.0000   0.0000          ?        ?   996.0938  15.9630          ?        ?      315.6        2.5       ?       ? 
1 1 1   32   16   29 o    242.7    3.2    0.0000   0.0000          ?        ?   589.3555  15.3245          ?        ?      242.7        3.2       ?       ? 
1 1 1   32   16   30 o    258.8    3.0    0.0000   0.0000          ?        ?   669.8092  15.3245          ?        ?      258.8        3.0       ?       ? 
1 1 1   32   16   31 o    167.2    4.4    0.0000   0.0000          ?        ?   279.6725  14.6860          ?        ?      167.2        4.4       ?       ? 
1 1 1   32   16   32 o    231.4    3.3    0.0000   0.0000          ?        ?   535.7197  15.3245          ?        ?      231.4        3.3       ?       ? 
1 1 1   32   16   33 o    520.1    2.6    0.0000   0.0000          ?        ?  2706.0547  26.8179          ?        ?      520.1        2.6       ?       ? 
1 1 1   32   16   34 o    716.9    2.9    0.0000   0.0000          ?        ?  5141.3760  41.5039          ?        ?      716.9        2.9       ?       ? 
1 1 1   32   16   35 o    339.0    2.8    0.0000   0.0000          ?        ?  1149.3389  19.1556          ?        ?      339.0        2.8       ?       ? 
1 1 1   32   16   36 o    439.7    2.6    0.0000   0.0000          ?        ?  1933.4434  22.9868          ?        ?      439.7        2.6       ?       ? 
1 1 1   32   16   37 o    716.0    2.9    0.0000   0.0000          ?        ?  5127.9668  42.1424          ?        ?      716.0        2.9       ?       ? 
1 1 1   32   16   38 o     18.9    9.4    0.0000   0.0000          ?        ?   -44.0580  15.3245          ?        ?       18.9        9.4       ?       ? 
1 1 1   32   16   39 o    331.3    2.9    0.0000   0.0000          ?        ?  1098.2572  19.1556          ?        ?      331.3        2.9       ?       ? 
1 1 1   32   16   40 o    229.0    3.5    0.0000   0.0000          ?        ?   524.8647  15.9630          ?        ?      229.0        3.5       ?       ? 
1 1 1   32   16   41 o    226.1    3.7    0.0000   0.0000          ?        ?   511.4558  16.6016          ?        ?      226.1        3.7       ?       ? 
1 1 1   32   16   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   16   43 o    180.2    4.8    0.0000   0.0000          ?        ?   325.0075  17.2401          ?        ?      180.2        4.8       ?       ? 
1 1 1   32   16   44 o    164.2    5.2    0.0000   0.0000          ?        ?   270.0946  17.2401          ?        ?      164.2        5.2       ?       ? 
1 1 1   32   16   45 o    187.8    4.6    0.0000   0.0000          ?        ?   353.1024  17.2401          ?        ?      187.8        4.6       ?       ? 
1 1 1   32   16   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   16   47 o    401.8    2.7    0.0000   0.0000          ?        ?  1614.8212  21.7097          ?        ?      401.8        2.7       ?       ? 
1 1 1   32   16   48 o    233.3    3.7    0.0000   0.0000          ?        ?   544.6590  17.2401          ?        ?      233.3        3.7       ?       ? 
1 1 1   32   16   49 o    130.4    6.6    0.0000   0.0000          ?        ?   170.4853  17.2401          ?        ?      130.4        6.6       ?       ? 
1 1 1   32   16   50 o    492.0    2.7    0.0000   0.0000          ?        ?  2421.9124  26.8179          ?        ?      492.0        2.7       ?       ? 
1 1 1   32   16   51 o    172.9    5.4    0.0000   0.0000          ?        ?   299.4666  18.5171          ?        ?      172.9        5.4       ?       ? 
1 1 1   32   16   52 o    102.0    8.8    0.0000   0.0000          ?        ?   104.7175  17.8786          ?        ?      102.0        8.8       ?       ? 
1 1 1   32   16   53 o     21.3   10.6    0.0000   0.0000          ?        ?   -45.3350  17.8786          ?        ?       21.3       10.6       ?       ? 
1 1 1   32   16   54 o    183.9    5.0    0.0000   0.0000          ?        ?   339.0550  18.5171          ?        ?      183.9        5.0       ?       ? 
1 1 1   32   16   55 o     38.9   15.6    0.0000   0.0000          ?        ?     7.6623  18.5171          ?        ?       38.9       15.6       ?       ? 
1 1 1   32   16   56 o     82.9   11.2    0.0000   0.0000          ?        ?    69.5989  18.5171          ?        ?       82.9       11.2       ?       ? 
1 1 1   32   16   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   16   58 o    172.5    5.7    0.0000   0.0000          ?        ?   298.8281  19.7942          ?        ?      172.5        5.7       ?       ? 
1 1 1   32   16   59 o     97.8   10.1    0.0000   0.0000          ?        ?    97.0553  19.7942          ?        ?       97.8       10.1       ?       ? 
1 1 1   32   16   60 o    242.4    4.2    0.0000   0.0000          ?        ?   589.3555  20.4327          ?        ?      242.4        4.2       ?       ? 
1 1 1   32   16   61 o    128.0    7.7    0.0000   0.0000          ?        ?   165.3771  19.7942          ?        ?      128.0        7.7       ?       ? 
1 1 1   32   16   62 o    249.8    4.2    0.0000   0.0000          ?        ?   625.7512  21.0712          ?        ?      249.8        4.2       ?       ? 
1 1 1   32   16   63 o     22.7   11.3    0.0000   0.0000          ?        ?   -47.2506  19.7942          ?        ?       22.7       11.3       ?       ? 
1 1 1   32   17    0 o    246.4    4.3  607.8726  21.0712   607.8726  21.0712   607.8726  21.0712      246.4      4.3      246.4        4.3     0.0     0.0 
1 1 1   32   17    1 o    232.4    3.0    0.0000   0.0000          ?        ?   540.1893  14.0475          ?        ?      232.4        3.0       ?       ? 
1 1 1   32   17    2 o    300.6    3.0    0.0000   0.0000          ?        ?   903.5081  17.8786          ?        ?      300.6        3.0       ?       ? 
1 1 1   32   17    3 o    499.4    2.8    0.0000   0.0000          ?        ?  2494.0654  28.0950          ?        ?      499.4        2.8       ?       ? 
1 1 1   32   17    4 o    299.1    2.9    0.0000   0.0000          ?        ?   894.5688  17.2401          ?        ?      299.1        2.9       ?       ? 
1 1 1   32   17    5 f    744.4    3.4    0.0000   0.0000          ?        ?  5542.3677  51.0817          ?        ?      744.4        3.4       ?       ? 
1 1 1   32   17    6 o    663.1    3.0    0.0000   0.0000          ?        ?  4397.4985  40.2269          ?        ?      663.1        3.0       ?       ? 
1 1 1   32   17    7 o    380.6    2.4    0.0000   0.0000          ?        ?  1448.8055  18.5171          ?        ?      380.6        2.4       ?       ? 
1 1 1   32   17    8 o    828.7    3.3    0.0000   0.0000          ?        ?  6868.5767  54.2743          ?        ?      828.7        3.3       ?       ? 
1 1 1   32   17    9 o    671.4    2.8    0.0000   0.0000          ?        ?  4507.9629  37.6728          ?        ?      671.4        2.8       ?       ? 
1 1 1   32   17   10 o    485.6    2.4    0.0000   0.0000          ?        ?  2358.6987  23.6253          ?        ?      485.6        2.4       ?       ? 
1 1 1   32   17   11 o    418.5    2.2    0.0000   0.0000          ?        ?  1751.4647  18.5171          ?        ?      418.5        2.2       ?       ? 
1 1 1   32   17   12 o    398.9    2.2    0.0000   0.0000          ?        ?  1591.1959  17.8786          ?        ?      398.9        2.2       ?       ? 
1 1 1   32   17   13 o    287.9    2.2    0.0000   0.0000          ?        ?   828.8011  12.7704          ?        ?      287.9        2.2       ?       ? 
1 1 1   32   17   14 o    451.1    2.4    0.0000   0.0000          ?        ?  2034.9685  21.7097          ?        ?      451.1        2.4       ?       ? 
1 1 1   32   17   15 o    667.0    3.0    0.0000   0.0000          ?        ?  4449.8574  39.5883          ?        ?      667.0        3.0       ?       ? 
1 1 1   32   17   16 o    282.4    2.6    0.0000   0.0000          ?        ?   797.5135  14.6860          ?        ?      282.4        2.6       ?       ? 
1 1 1   32   17   17 o    223.3    2.9    0.0000   0.0000          ?        ?   498.6854  12.7704          ?        ?      223.3        2.9       ?       ? 
1 1 1   32   17   18 o    358.7    2.5    0.0000   0.0000          ?        ?  1286.6211  17.8786          ?        ?      358.7        2.5       ?       ? 
1 1 1   32   17   19 o    101.7    5.3    0.0000   0.0000          ?        ?   103.4405  10.8549          ?        ?      101.7        5.3       ?       ? 
1 1 1   32   17   20 o    677.9    2.7    0.0000   0.0000          ?        ?  4596.0786  37.0343          ?        ?      677.9        2.7       ?       ? 
1 1 1   32   17   21 o     48.2   12.0    0.0000   0.0000          ?        ?    24.2638  11.4934          ?        ?       48.2       12.0       ?       ? 
1 1 1   32   17   22 o    475.6    2.4    0.0000   0.0000          ?        ?  2262.2820  22.9868          ?        ?      475.6        2.4       ?       ? 
1 1 1   32   17   23 o    280.5    2.6    0.0000   0.0000          ?        ?   786.6586  14.6860          ?        ?      280.5        2.6       ?       ? 
1 1 1   32   17   24 o    184.3    3.6    0.0000   0.0000          ?        ?   339.6935  13.4090          ?        ?      184.3        3.6       ?       ? 
1 1 1   32   17   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   17   26 o    327.8    2.5    0.0000   0.0000          ?        ?  1074.6320  16.6016          ?        ?      327.8        2.5       ?       ? 
1 1 1   32   17   27 o     86.0    8.5    0.0000   0.0000          ?        ?    74.0685  14.6860          ?        ?       86.0        8.5       ?       ? 
1 1 1   32   17   28 o     58.6   11.8    0.0000   0.0000          ?        ?    35.7572  13.4090          ?        ?       58.6       11.8       ?       ? 
1 1 1   32   17   29 o    392.2    2.4    0.0000   0.0000          ?        ?  1538.1986  19.1556          ?        ?      392.2        2.4       ?       ? 
1 1 1   32   17   30 o    358.7    2.6    0.0000   0.0000          ?        ?  1286.6211  18.5171          ?        ?      358.7        2.6       ?       ? 
1 1 1   32   17   31 o    355.1    2.6    0.0000   0.0000          ?        ?  1261.0802  18.5171          ?        ?      355.1        2.6       ?       ? 
1 1 1   32   17   32 o    326.4    2.7    0.0000   0.0000          ?        ?  1065.6925  17.8786          ?        ?      326.4        2.7       ?       ? 
1 1 1   32   17   33 o     16.8    8.5    0.0000   0.0000          ?        ?   -48.5276  14.0475          ?        ?       16.8        8.5       ?       ? 
1 1 1   32   17   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   17   35 o    571.2    2.6    0.0000   0.0000          ?        ?  3263.4841  29.3720          ?        ?      571.2        2.6       ?       ? 
1 1 1   32   17   36 o    139.7    5.5    0.0000   0.0000          ?        ?   195.3876  15.3245          ?        ?      139.7        5.5       ?       ? 
1 1 1   32   17   37 o    617.7    2.7    0.0000   0.0000          ?        ?  3816.4438  33.8416          ?        ?      617.7        2.7       ?       ? 
1 1 1   32   17   38 o    339.4    2.6    0.0000   0.0000          ?        ?  1152.5315  17.8786          ?        ?      339.4        2.6       ?       ? 
1 1 1   32   17   39 o    198.9    4.0    0.0000   0.0000          ?        ?   395.8834  15.9630          ?        ?      198.9        4.0       ?       ? 
1 1 1   32   17   40 o     84.4    9.1    0.0000   0.0000          ?        ?    71.5144  15.3245          ?        ?       84.4        9.1       ?       ? 
1 1 1   32   17   41 o    337.2    2.8    0.0000   0.0000          ?        ?  1137.8455  19.1556          ?        ?      337.2        2.8       ?       ? 
1 1 1   32   17   42 o    218.3    3.8    0.0000   0.0000          ?        ?   476.9756  16.6016          ?        ?      218.3        3.8       ?       ? 
1 1 1   32   17   43 o    130.7    6.4    0.0000   0.0000          ?        ?   171.1238  16.6016          ?        ?      130.7        6.4       ?       ? 
1 1 1   32   17   44 o    324.1    2.9    0.0000   0.0000          ?        ?  1051.0066  18.5171          ?        ?      324.1        2.9       ?       ? 
1 1 1   32   17   45 o    210.9    3.9    0.0000   0.0000          ?        ?   445.0496  16.6016          ?        ?      210.9        3.9       ?       ? 
1 1 1   32   17   46 f     72.5   11.4    0.0000   0.0000          ?        ?    52.9973  16.6016          ?        ?       72.5       11.4       ?       ? 
1 1 1   32   17   47 o    190.6    4.5    0.0000   0.0000          ?        ?   363.9573  17.2401          ?        ?      190.6        4.5       ?       ? 
1 1 1   32   17   48 o    390.5    2.8    0.0000   0.0000          ?        ?  1526.0667  21.7097          ?        ?      390.5        2.8       ?       ? 
1 1 1   32   17   49 o    259.9    3.6    0.0000   0.0000          ?        ?   676.1944  18.5171          ?        ?      259.9        3.6       ?       ? 
1 1 1   32   17   50 f     30.7   13.7    0.0000   0.0000          ?        ?    -7.0237  17.2401          ?        ?       30.7       13.7       ?       ? 
1 1 1   32   17   51 o    129.8    6.6    0.0000   0.0000          ?        ?   169.2082  17.2401          ?        ?      129.8        6.6       ?       ? 
1 1 1   32   17   52 o    105.1    8.5    0.0000   0.0000          ?        ?   111.1028  17.8786          ?        ?      105.1        8.5       ?       ? 
1 1 1   32   17   53 o    347.3    3.0    0.0000   0.0000          ?        ?  1207.4445  21.0712          ?        ?      347.3        3.0       ?       ? 
1 1 1   32   17   54 o     21.0   10.5    0.0000   0.0000          ?        ?   -51.0817  18.5171          ?        ?       21.0       10.5       ?       ? 
1 1 1   32   17   55 o    100.0    9.6    0.0000   0.0000          ?        ?   100.8864  19.1556          ?        ?      100.0        9.6       ?       ? 
1 1 1   32   17   56 o     99.7    9.0    0.0000   0.0000          ?        ?   100.2479  17.8786          ?        ?       99.7        9.0       ?       ? 
1 1 1   32   17   57 f    412.1    2.9    0.0000   0.0000          ?        ?  1699.7446  23.6253          ?        ?      412.1        2.9       ?       ? 
1 1 1   32   17   58 o    355.0    3.2    0.0000   0.0000          ?        ?  1262.3572  22.9868          ?        ?      355.0        3.2       ?       ? 
1 1 1   32   17   59 o     24.8   12.1    0.0000   0.0000          ?        ?   -39.5883  20.4327          ?        ?       24.8       12.1       ?       ? 
1 1 1   32   17   60 o    298.4    3.3    0.0000   0.0000          ?        ?   892.0147  19.7942          ?        ?      298.4        3.3       ?       ? 
1 1 1   32   17   61 o    123.7    7.7    0.0000   0.0000          ?        ?   154.5222  19.1556          ?        ?      123.7        7.7       ?       ? 
1 1 1   32   17   62 o    249.4    4.1    0.0000   0.0000          ?        ?   623.8356  20.4327          ?        ?      249.4        4.1       ?       ? 
1 1 1   32   17   63 o     20.8   10.4    0.0000   0.0000          ?        ?   -51.7203  18.5171          ?        ?       20.8       10.4       ?       ? 
1 1 1   32   18    0 o    404.1    4.0 1633.3384  32.5646  1633.3384  32.5646  1633.3384  32.5646      404.1      4.0      404.1        4.0     0.0     0.0 
1 1 1   32   18    1 o    821.1    3.7    0.0000   0.0000          ?        ?  6742.7886  61.2981          ?        ?      821.1        3.7       ?       ? 
1 1 1   32   18    2 o    296.2    2.8    0.0000   0.0000          ?        ?   877.3287  16.6016          ?        ?      296.2        2.8       ?       ? 
1 1 1   32   18    3 o    437.9    2.7    0.0000   0.0000          ?        ?  1918.1189  23.6253          ?        ?      437.9        2.7       ?       ? 
1 1 1   32   18    4 o    459.0    2.8    0.0000   0.0000          ?        ?  2107.1213  25.5409          ?        ?      459.0        2.8       ?       ? 
1 1 1   32   18    5 f    242.1    3.3    0.0000   0.0000          ?        ?   586.1629  15.9630          ?        ?      242.1        3.3       ?       ? 
1 1 1   32   18    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   18    7 o    413.9    2.5    0.0000   0.0000          ?        ?  1713.1534  20.4327          ?        ?      413.9        2.5       ?       ? 
1 1 1   32   18    8 f    580.4    2.6    0.0000   0.0000          ?        ?  3369.4788  30.0105          ?        ?      580.4        2.6       ?       ? 
1 1 1   32   18    9 o    129.8    4.2    0.0000   0.0000          ?        ?   168.5697  10.8549          ?        ?      129.8        4.2       ?       ? 
1 1 1   32   18   10 o    109.8    5.2    0.0000   0.0000          ?        ?   120.6806  11.4934          ?        ?      109.8        5.2       ?       ? 
1 1 1   32   18   11 o    437.6    2.4    0.0000   0.0000          ?        ?  1915.5648  21.0712          ?        ?      437.6        2.4       ?       ? 
1 1 1   32   18   12 o    428.4    2.3    0.0000   0.0000          ?        ?  1835.1111  19.7942          ?        ?      428.4        2.3       ?       ? 
1 1 1   32   18   13 o    122.7    3.6    0.0000   0.0000          ?        ?   150.6911   8.9393          ?        ?      122.7        3.6       ?       ? 
1 1 1   32   18   14 o    306.7    2.2    0.0000   0.0000          ?        ?   940.5424  13.4090          ?        ?      306.7        2.2       ?       ? 
1 1 1   32   18   15 o    263.6    2.5    0.0000   0.0000          ?        ?   694.7115  13.4090          ?        ?      263.6        2.5       ?       ? 
1 1 1   32   18   16 f    398.0    2.3    0.0000   0.0000          ?        ?  1584.1722  18.5171          ?        ?      398.0        2.3       ?       ? 
1 1 1   32   18   17 o    653.3    2.7    0.0000   0.0000          ?        ?  4268.5171  35.7572          ?        ?      653.3        2.7       ?       ? 
1 1 1   32   18   18 o    474.2    2.5    0.0000   0.0000          ?        ?  2248.8733  23.6253          ?        ?      474.2        2.5       ?       ? 
1 1 1   32   18   19 o    287.5    2.6    0.0000   0.0000          ?        ?   826.8855  14.6860          ?        ?      287.5        2.6       ?       ? 
1 1 1   32   18   20 o    257.4    2.7    0.0000   0.0000          ?        ?   662.7855  14.0475          ?        ?      257.4        2.7       ?       ? 
1 1 1   32   18   21 o    252.4    2.8    0.0000   0.0000          ?        ?   637.2446  14.0475          ?        ?      252.4        2.8       ?       ? 
1 1 1   32   18   22 f    284.3    2.6    0.0000   0.0000          ?        ?   808.3683  14.6860          ?        ?      284.3        2.6       ?       ? 
1 1 1   32   18   23 o    601.3    2.7    0.0000   0.0000          ?        ?  3615.9480  31.9261          ?        ?      601.3        2.7       ?       ? 
1 1 1   32   18   24 o    147.7    4.1    0.0000   0.0000          ?        ?   218.3744  12.1319          ?        ?      147.7        4.1       ?       ? 
1 1 1   32   18   25 o    554.1    2.6    0.0000   0.0000          ?        ?  3071.2891  28.7335          ?        ?      554.1        2.6       ?       ? 
1 1 1   32   18   26 o    138.6    4.4    0.0000   0.0000          ?        ?   192.1950  12.1319          ?        ?      138.6        4.4       ?       ? 
1 1 1   32   18   27 o    456.5    2.6    0.0000   0.0000          ?        ?  2084.7732  23.6253          ?        ?      456.5        2.6       ?       ? 
1 1 1   32   18   28 o    461.7    2.4    0.0000   0.0000          ?        ?  2132.0237  22.3483          ?        ?      461.7        2.4       ?       ? 
1 1 1   32   18   29 o    394.5    2.5    0.0000   0.0000          ?        ?  1556.7157  19.7942          ?        ?      394.5        2.5       ?       ? 
1 1 1   32   18   30 o    459.1    2.5    0.0000   0.0000          ?        ?  2108.3984  22.9868          ?        ?      459.1        2.5       ?       ? 
1 1 1   32   18   31 o    278.7    2.9    0.0000   0.0000          ?        ?   777.0808  15.9630          ?        ?      278.7        2.9       ?       ? 
1 1 1   32   18   32 o    301.1    2.8    0.0000   0.0000          ?        ?   906.7007  16.6016          ?        ?      301.1        2.8       ?       ? 
1 1 1   32   18   33 o     98.1    7.2    0.0000   0.0000          ?        ?    96.4168  14.0475          ?        ?       98.1        7.2       ?       ? 
1 1 1   32   18   34 o    257.9    3.1    0.0000   0.0000          ?        ?   665.3395  15.9630          ?        ?      257.9        3.1       ?       ? 
1 1 1   32   18   35 o    376.2    2.6    0.0000   0.0000          ?        ?  1415.6024  19.7942          ?        ?      376.2        2.6       ?       ? 
1 1 1   32   18   36 o    137.2    5.4    0.0000   0.0000          ?        ?   188.3639  14.6860          ?        ?      137.2        5.4       ?       ? 
1 1 1   32   18   37 o     94.1    7.8    0.0000   0.0000          ?        ?    88.7545  14.6860          ?        ?       94.1        7.8       ?       ? 
1 1 1   32   18   38 o    299.9    3.1    0.0000   0.0000          ?        ?   899.6769  18.5171          ?        ?      299.9        3.1       ?       ? 
1 1 1   32   18   39 o    268.7    3.2    0.0000   0.0000          ?        ?   722.1680  17.2401          ?        ?      268.7        3.2       ?       ? 
1 1 1   32   18   40 o    386.9    2.8    0.0000   0.0000          ?        ?  1497.3333  21.7097          ?        ?      386.9        2.8       ?       ? 
1 1 1   32   18   41 o    195.3    4.3    0.0000   0.0000          ?        ?   381.8359  16.6016          ?        ?      195.3        4.3       ?       ? 
1 1 1   32   18   42 o    163.6    4.9    0.0000   0.0000          ?        ?   268.1791  15.9630          ?        ?      163.6        4.9       ?       ? 
1 1 1   32   18   43 f    296.0    3.2    0.0000   0.0000          ?        ?   876.6902  19.1556          ?        ?      296.0        3.2       ?       ? 
1 1 1   32   18   44 o    318.6    3.0    0.0000   0.0000          ?        ?  1015.8879  19.1556          ?        ?      318.6        3.0       ?       ? 
1 1 1   32   18   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   18   46 o     67.8   12.7    0.0000   0.0000          ?        ?    47.8891  16.6016          ?        ?       67.8       12.7       ?       ? 
1 1 1   32   18   47 o    294.1    3.3    0.0000   0.0000          ?        ?   865.8354  19.1556          ?        ?      294.1        3.3       ?       ? 
1 1 1   32   18   48 o    377.6    3.0    0.0000   0.0000          ?        ?  1426.4573  22.3483          ?        ?      377.6        3.0       ?       ? 
1 1 1   32   18   49 o    161.2    5.3    0.0000   0.0000          ?        ?   260.5168  17.2401          ?        ?      161.2        5.3       ?       ? 
1 1 1   32   18   50 o    177.6    5.2    0.0000   0.0000          ?        ?   316.0682  18.5171          ?        ?      177.6        5.2       ?       ? 
1 1 1   32   18   51 o    240.4    4.0    0.0000   0.0000          ?        ?   578.5006  19.1556          ?        ?      240.4        4.0       ?       ? 
1 1 1   32   18   52 o    203.7    4.9    0.0000   0.0000          ?        ?   415.6776  19.7942          ?        ?      203.7        4.9       ?       ? 
1 1 1   32   18   53 o     19.9   10.0    0.0000   0.0000          ?        ?   -58.7440  18.5171          ?        ?       19.9       10.0       ?       ? 
1 1 1   32   18   54 o    120.0    7.7    0.0000   0.0000          ?        ?   144.9444  18.5171          ?        ?      120.0        7.7       ?       ? 
1 1 1   32   18   55 o     50.6   15.9    0.0000   0.0000          ?        ?    26.1794  17.8786          ?        ?       50.6       15.9       ?       ? 
1 1 1   32   18   56 o     46.5   16.4    0.0000   0.0000          ?        ?    19.7942  19.1556          ?        ?       46.5       16.4       ?       ? 
1 1 1   32   18   57 o    236.1    4.3    0.0000   0.0000          ?        ?   558.7064  20.4327          ?        ?      236.1        4.3       ?       ? 
1 1 1   32   18   58 o     71.6   13.9    0.0000   0.0000          ?        ?    54.2743  19.1556          ?        ?       71.6       13.9       ?       ? 
1 1 1   32   18   59 o    229.2    4.2    0.0000   0.0000          ?        ?   526.7803  19.1556          ?        ?      229.2        4.2       ?       ? 
1 1 1   32   18   60 o    174.8    5.7    0.0000   0.0000          ?        ?   307.1289  19.7942          ?        ?      174.8        5.7       ?       ? 
1 1 1   32   18   61 o    207.6    4.8    0.0000   0.0000          ?        ?   432.9177  19.7942          ?        ?      207.6        4.8       ?       ? 
1 1 1   32   18   62 o    245.0    3.9    0.0000   0.0000          ?        ?   602.1259  19.1556          ?        ?      245.0        3.9       ?       ? 
1 1 1   32   19    0 o    122.5    6.6  151.3296  15.9630   151.3296  15.9630   151.3296  15.9630      122.5      6.6      122.5        6.6     0.0     0.0 
1 1 1   32   19    1 o    352.7    2.7    0.0000   0.0000          ?        ?  1244.4786  19.1556          ?        ?      352.7        2.7       ?       ? 
1 1 1   32   19    2 o    181.5    3.3    0.0000   0.0000          ?        ?   329.4771  12.1319          ?        ?      181.5        3.3       ?       ? 
1 1 1   32   19    3 o    747.6    3.5    0.0000   0.0000          ?        ?  5590.2568  51.7203          ?        ?      747.6        3.5       ?       ? 
1 1 1   32   19    4 o    304.7    2.7    0.0000   0.0000          ?        ?   928.4104  16.6016          ?        ?      304.7        2.7       ?       ? 
1 1 1   32   19    5 o    715.2    3.3    0.0000   0.0000          ?        ?  5115.8354  47.2506          ?        ?      715.2        3.3       ?       ? 
1 1 1   32   19    6 o    368.0    2.7    0.0000   0.0000          ?        ?  1354.3044  19.7942          ?        ?      368.0        2.7       ?       ? 
1 1 1   32   19    7 o    316.4    2.9    0.0000   0.0000          ?        ?  1001.2019  18.5171          ?        ?      316.4        2.9       ?       ? 
1 1 1   32   19    8 o    403.2    2.6    0.0000   0.0000          ?        ?  1625.6761  21.0712          ?        ?      403.2        2.6       ?       ? 
1 1 1   32   19    9 o     71.9    7.1    0.0000   0.0000          ?        ?    51.7203  10.2163          ?        ?       71.9        7.1       ?       ? 
1 1 1   32   19   10 o     99.1    5.2    0.0000   0.0000          ?        ?    98.3323  10.2163          ?        ?       99.1        5.2       ?       ? 
1 1 1   32   19   11 o    329.6    2.4    0.0000   0.0000          ?        ?  1086.7638  15.9630          ?        ?      329.6        2.4       ?       ? 
1 1 1   32   19   12 o    559.9    2.6    0.0000   0.0000          ?        ?  3135.7798  29.3720          ?        ?      559.9        2.6       ?       ? 
1 1 1   32   19   13 o    166.8    2.7    0.0000   0.0000          ?        ?   278.3954   8.9393          ?        ?      166.8        2.7       ?       ? 
1 1 1   32   19   14 o    603.2    2.6    0.0000   0.0000          ?        ?  3638.9348  31.2876          ?        ?      603.2        2.6       ?       ? 
1 1 1   32   19   15 o    480.6    2.4    0.0000   0.0000          ?        ?  2310.1711  22.9868          ?        ?      480.6        2.4       ?       ? 
1 1 1   32   19   16 o    957.6    3.5    0.0000   0.0000          ?        ?  9172.3633  67.0448          ?        ?      957.6        3.5       ?       ? 
1 1 1   32   19   17 o    569.6    2.6    0.0000   0.0000          ?        ?  3244.9670  29.3720          ?        ?      569.6        2.6       ?       ? 
1 1 1   32   19   18 o    657.6    2.8    0.0000   0.0000          ?        ?  4325.3457  36.3957          ?        ?      657.6        2.8       ?       ? 
1 1 1   32   19   19 o    493.4    2.5    0.0000   0.0000          ?        ?  2434.6829  24.2638          ?        ?      493.4        2.5       ?       ? 
1 1 1   32   19   20 o    444.9    2.4    0.0000   0.0000          ?        ?  1980.0555  21.0712          ?        ?      444.9        2.4       ?       ? 
1 1 1   32   19   21 o    151.2    3.8    0.0000   0.0000          ?        ?   228.5907  11.4934          ?        ?      151.2        3.8       ?       ? 
1 1 1   32   19   22 o    195.2    3.4    0.0000   0.0000          ?        ?   381.1974  13.4090          ?        ?      195.2        3.4       ?       ? 
1 1 1   32   19   23 o    307.2    2.5    0.0000   0.0000          ?        ?   943.7350  15.3245          ?        ?      307.2        2.5       ?       ? 
1 1 1   32   19   24 o    379.3    2.4    0.0000   0.0000          ?        ?  1439.2277  18.5171          ?        ?      379.3        2.4       ?       ? 
1 1 1   32   19   25 o    139.5    5.0    0.0000   0.0000          ?        ?   194.7491  14.0475          ?        ?      139.5        5.0       ?       ? 
1 1 1   32   19   26 o     87.8    7.3    0.0000   0.0000          ?        ?    77.2611  12.7704          ?        ?       87.8        7.3       ?       ? 
1 1 1   32   19   27 o    245.2    3.0    0.0000   0.0000          ?        ?   601.4874  14.6860          ?        ?      245.2        3.0       ?       ? 
1 1 1   32   19   28 o    171.3    4.1    0.0000   0.0000          ?        ?   293.7199  14.0475          ?        ?      171.3        4.1       ?       ? 
1 1 1   32   19   29 o     78.6    8.5    0.0000   0.0000          ?        ?    61.9366  13.4090          ?        ?       78.6        8.5       ?       ? 
1 1 1   32   19   30 f     78.6    9.3    0.0000   0.0000          ?        ?    61.9366  14.6860          ?        ?       78.6        9.3       ?       ? 
1 1 1   32   19   31 o    191.2    3.8    0.0000   0.0000          ?        ?   365.8729  14.6860          ?        ?      191.2        3.8       ?       ? 
1 1 1   32   19   32 o     93.4    7.2    0.0000   0.0000          ?        ?    87.4775  13.4090          ?        ?       93.4        7.2       ?       ? 
1 1 1   32   19   33 f    275.0    2.9    0.0000   0.0000          ?        ?   756.6481  15.9630          ?        ?      275.0        2.9       ?       ? 
1 1 1   32   19   34 o    455.1    2.5    0.0000   0.0000          ?        ?  2071.3640  22.9868          ?        ?      455.1        2.5       ?       ? 
1 1 1   32   19   35 o    223.0    3.6    0.0000   0.0000          ?        ?   497.4084  15.9630          ?        ?      223.0        3.6       ?       ? 
1 1 1   32   19   36 o    144.2    5.1    0.0000   0.0000          ?        ?   208.1580  14.6860          ?        ?      144.2        5.1       ?       ? 
1 1 1   32   19   37 o    290.4    2.9    0.0000   0.0000          ?        ?   843.4871  16.6016          ?        ?      290.4        2.9       ?       ? 
1 1 1   32   19   38 o     86.6    8.8    0.0000   0.0000          ?        ?    75.3456  15.3245          ?        ?       86.6        8.8       ?       ? 
1 1 1   32   19   39 o    117.8    6.5    0.0000   0.0000          ?        ?   139.1977  15.3245          ?        ?      117.8        6.5       ?       ? 
1 1 1   32   19   40 o    334.8    3.0    0.0000   0.0000          ?        ?  1121.2440  19.7942          ?        ?      334.8        3.0       ?       ? 
1 1 1   32   19   41 o    378.2    2.8    0.0000   0.0000          ?        ?  1430.9270  21.0712          ?        ?      378.2        2.8       ?       ? 
1 1 1   32   19   42 o    309.1    3.1    0.0000   0.0000          ?        ?   955.8669  19.1556          ?        ?      309.1        3.1       ?       ? 
1 1 1   32   19   43 o    255.0    3.8    0.0000   0.0000          ?        ?   650.6536  19.1556          ?        ?      255.0        3.8       ?       ? 
1 1 1   32   19   44 o    196.3    4.6    0.0000   0.0000          ?        ?   385.6671  17.8786          ?        ?      196.3        4.6       ?       ? 
1 1 1   32   19   45 o     28.6   13.0    0.0000   0.0000          ?        ?   -10.8549  16.6016          ?        ?       28.6       13.0       ?       ? 
1 1 1   32   19   46 o    391.5    2.9    0.0000   0.0000          ?        ?  1533.7289  22.3483          ?        ?      391.5        2.9       ?       ? 
1 1 1   32   19   47 o    233.8    3.8    0.0000   0.0000          ?        ?   547.2130  17.8786          ?        ?      233.8        3.8       ?       ? 
1 1 1   32   19   48 o    246.7    3.9    0.0000   0.0000          ?        ?   609.1497  19.1556          ?        ?      246.7        3.9       ?       ? 
1 1 1   32   19   49 o    132.5    6.7    0.0000   0.0000          ?        ?   176.2320  17.8786          ?        ?      132.5        6.7       ?       ? 
1 1 1   32   19   50 o     54.7   15.6    0.0000   0.0000          ?        ?    31.2876  17.8786          ?        ?       54.7       15.6       ?       ? 
1 1 1   32   19   51 o     83.7   11.1    0.0000   0.0000          ?        ?    70.8759  18.5171          ?        ?       83.7       11.1       ?       ? 
1 1 1   32   19   52 o    220.2    4.3    0.0000   0.0000          ?        ?   485.9149  19.1556          ?        ?      220.2        4.3       ?       ? 
1 1 1   32   19   53 o     23.2   11.4    0.0000   0.0000          ?        ?   -35.1187  17.8786          ?        ?       23.2       11.4       ?       ? 
1 1 1   32   19   54 o     99.6    9.3    0.0000   0.0000          ?        ?   100.2479  18.5171          ?        ?       99.6        9.3       ?       ? 
1 1 1   32   19   55 o     25.5   12.2    0.0000   0.0000          ?        ?   -24.9023  17.8786          ?        ?       25.5       12.2       ?       ? 
1 1 1   32   19   56 o     42.5   16.4    0.0000   0.0000          ?        ?    12.7704  19.7942          ?        ?       42.5       16.4       ?       ? 
1 1 1   32   19   57 o     33.7   14.7    0.0000   0.0000          ?        ?    -2.5541  18.5171          ?        ?       33.7       14.7       ?       ? 
1 1 1   32   19   58 o     27.1   12.9    0.0000   0.0000          ?        ?   -23.6253  19.1556          ?        ?       27.1       12.9       ?       ? 
1 1 1   32   19   59 o     27.7   13.1    0.0000   0.0000          ?        ?   -21.0712  19.1556          ?        ?       27.7       13.1       ?       ? 
1 1 1   32   19   60 o    213.1    4.5    0.0000   0.0000          ?        ?   455.9044  19.1556          ?        ?      213.1        4.5       ?       ? 
1 1 1   32   19   61 o    144.7    6.6    0.0000   0.0000          ?        ?   211.3506  19.1556          ?        ?      144.7        6.6       ?       ? 
1 1 1   32   20    0 o    113.3    6.5  129.6199  14.6860   129.6199  14.6860   129.6199  14.6860      113.3      6.5      113.3        6.5     0.0     0.0 
1 1 1   32   20    1 o    419.5    2.6    0.0000   0.0000          ?        ?  1759.7656  21.7097          ?        ?      419.5        2.6       ?       ? 
1 1 1   32   20    2 o    190.6    3.0    0.0000   0.0000          ?        ?   363.3188  11.4934          ?        ?      190.6        3.0       ?       ? 
1 1 1   32   20    3 o    321.9    2.7    0.0000   0.0000          ?        ?  1036.3207  17.2401          ?        ?      321.9        2.7       ?       ? 
1 1 1   32   20    4 o    133.2    4.1    0.0000   0.0000          ?        ?   177.5090  10.8549          ?        ?      133.2        4.1       ?       ? 
1 1 1   32   20    5 o    399.7    2.8    0.0000   0.0000          ?        ?  1598.2196  22.3483          ?        ?      399.7        2.8       ?       ? 
1 1 1   32   20    6 o    142.2    4.5    0.0000   0.0000          ?        ?   202.4114  12.7704          ?        ?      142.2        4.5       ?       ? 
1 1 1   32   20    7 f    775.9    3.6    0.0000   0.0000          ?        ?  6022.5361  56.1899          ?        ?      775.9        3.6       ?       ? 
1 1 1   32   20    8 o    320.5    2.4    0.0000   0.0000          ?        ?  1027.3812  15.3245          ?        ?      320.5        2.4       ?       ? 
1 1 1   32   20    9 o    280.6    2.3    0.0000   0.0000          ?        ?   787.2972  12.7704          ?        ?      280.6        2.3       ?       ? 
1 1 1   32   20   10 o    602.4    2.7    0.0000   0.0000          ?        ?  3629.3572  32.5646          ?        ?      602.4        2.7       ?       ? 
1 1 1   32   20   11 o    373.8    2.4    0.0000   0.0000          ?        ?  1397.0853  17.8786          ?        ?      373.8        2.4       ?       ? 
1 1 1   32   20   12 o     86.4    5.9    0.0000   0.0000          ?        ?    74.7070  10.2163          ?        ?       86.4        5.9       ?       ? 
1 1 1   32   20   13 o    146.0    2.6    0.0000   0.0000          ?        ?   213.2662   7.6623          ?        ?      146.0        2.6       ?       ? 
1 1 1   32   20   14 o    205.1    2.5    0.0000   0.0000          ?        ?   420.7858  10.2163          ?        ?      205.1        2.5       ?       ? 
1 1 1   32   20   15 o    154.9    3.3    0.0000   0.0000          ?        ?   240.0841  10.2163          ?        ?      154.9        3.3       ?       ? 
1 1 1   32   20   16 o    130.3    4.2    0.0000   0.0000          ?        ?   169.8468  10.8549          ?        ?      130.3        4.2       ?       ? 
1 1 1   32   20   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   20   18 o    264.2    2.4    0.0000   0.0000          ?        ?   697.9042  12.7704          ?        ?      264.2        2.4       ?       ? 
1 1 1   32   20   19 o    139.5    3.9    0.0000   0.0000          ?        ?   194.7491  10.8549          ?        ?      139.5        3.9       ?       ? 
1 1 1   32   20   20 o    283.2    2.5    0.0000   0.0000          ?        ?   801.9832  14.0475          ?        ?      283.2        2.5       ?       ? 
1 1 1   32   20   21 o    350.1    2.4    0.0000   0.0000          ?        ?  1225.9615  16.6016          ?        ?      350.1        2.4       ?       ? 
1 1 1   32   20   22 o    246.8    2.7    0.0000   0.0000          ?        ?   609.1497  13.4090          ?        ?      246.8        2.7       ?       ? 
1 1 1   32   20   23 o    308.9    2.7    0.0000   0.0000          ?        ?   954.5898  16.6016          ?        ?      308.9        2.7       ?       ? 
1 1 1   32   20   24 o    142.0    4.5    0.0000   0.0000          ?        ?   201.7728  12.7704          ?        ?      142.0        4.5       ?       ? 
1 1 1   32   20   25 o    149.7    4.3    0.0000   0.0000          ?        ?   224.1211  12.7704          ?        ?      149.7        4.3       ?       ? 
1 1 1   32   20   26 o    149.0    4.5    0.0000   0.0000          ?        ?   222.2055  13.4090          ?        ?      149.0        4.5       ?       ? 
1 1 1   32   20   27 o    138.3    5.1    0.0000   0.0000          ?        ?   191.5565  14.0475          ?        ?      138.3        5.1       ?       ? 
1 1 1   32   20   28 o    361.2    2.6    0.0000   0.0000          ?        ?  1305.1382  18.5171          ?        ?      361.2        2.6       ?       ? 
1 1 1   32   20   29 o    321.3    2.8    0.0000   0.0000          ?        ?  1032.4895  17.8786          ?        ?      321.3        2.8       ?       ? 
1 1 1   32   20   30 o    266.2    3.0    0.0000   0.0000          ?        ?   708.7590  15.9630          ?        ?      266.2        3.0       ?       ? 
1 1 1   32   20   31 o    341.9    2.6    0.0000   0.0000          ?        ?  1169.1332  17.8786          ?        ?      341.9        2.6       ?       ? 
1 1 1   32   20   32 o     93.1    7.9    0.0000   0.0000          ?        ?    86.8389  14.6860          ?        ?       93.1        7.9       ?       ? 
1 1 1   32   20   33 o     24.1   11.3    0.0000   0.0000          ?        ?   -15.3245  14.0475          ?        ?       24.1       11.3       ?       ? 
1 1 1   32   20   34 o     37.1   14.0    0.0000   0.0000          ?        ?    10.2163  14.0475          ?        ?       37.1       14.0       ?       ? 
1 1 1   32   20   35 o    227.8    3.5    0.0000   0.0000          ?        ?   519.1181  15.9630          ?        ?      227.8        3.5       ?       ? 
1 1 1   32   20   36 o    212.8    3.9    0.0000   0.0000          ?        ?   453.3503  16.6016          ?        ?      212.8        3.9       ?       ? 
1 1 1   32   20   37 o    513.0    2.6    0.0000   0.0000          ?        ?  2632.6245  26.1794          ?        ?      513.0        2.6       ?       ? 
1 1 1   32   20   38 o    326.3    2.7    0.0000   0.0000          ?        ?  1065.0541  17.8786          ?        ?      326.3        2.7       ?       ? 
1 1 1   32   20   39 o    409.9    2.6    0.0000   0.0000          ?        ?  1681.2274  21.7097          ?        ?      409.9        2.6       ?       ? 
1 1 1   32   20   40 o     39.4   14.6    0.0000   0.0000          ?        ?    12.1319  15.3245          ?        ?       39.4       14.6       ?       ? 
1 1 1   32   20   41 o    701.1    3.0    0.0000   0.0000          ?        ?  4917.8936  41.5039          ?        ?      701.1        3.0       ?       ? 
1 1 1   32   20   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   20   43 o    231.2    3.9    0.0000   0.0000          ?        ?   535.0811  17.8786          ?        ?      231.2        3.9       ?       ? 
1 1 1   32   20   44 o    339.9    3.0    0.0000   0.0000          ?        ?  1156.3627  20.4327          ?        ?      339.9        3.0       ?       ? 
1 1 1   32   20   45 o    105.5    8.2    0.0000   0.0000          ?        ?   111.7413  17.2401          ?        ?      105.5        8.2       ?       ? 
1 1 1   32   20   46 o    116.1    7.4    0.0000   0.0000          ?        ?   135.3666  17.2401          ?        ?      116.1        7.4       ?       ? 
1 1 1   32   20   47 o    225.4    4.0    0.0000   0.0000          ?        ?   508.9017  17.8786          ?        ?      225.4        4.0       ?       ? 
1 1 1   32   20   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   20   49 f    436.5    2.9    0.0000   0.0000          ?        ?  1906.6256  24.9023          ?        ?      436.5        2.9       ?       ? 
1 1 1   32   20   50 o    296.7    3.6    0.0000   0.0000          ?        ?   881.1599  21.0712          ?        ?      296.7        3.6       ?       ? 
1 1 1   32   20   51 o    449.3    2.9    0.0000   0.0000          ?        ?  2020.2823  26.1794          ?        ?      449.3        2.9       ?       ? 
1 1 1   32   20   52 o    287.1    3.7    0.0000   0.0000          ?        ?   825.6085  21.0712          ?        ?      287.1        3.7       ?       ? 
1 1 1   32   20   53 o    285.6    3.6    0.0000   0.0000          ?        ?   816.6692  20.4327          ?        ?      285.6        3.6       ?       ? 
1 1 1   32   20   54 o    215.3    4.4    0.0000   0.0000          ?        ?   464.8438  19.1556          ?        ?      215.3        4.4       ?       ? 
1 1 1   32   20   55 f     23.9   11.7    0.0000   0.0000          ?        ?   -34.4802  18.5171          ?        ?       23.9       11.7       ?       ? 
1 1 1   32   20   56 o    191.6    4.8    0.0000   0.0000          ?        ?   368.4270  18.5171          ?        ?      191.6        4.8       ?       ? 
1 1 1   32   20   57 o     67.4   14.2    0.0000   0.0000          ?        ?    48.5276  18.5171          ?        ?       67.4       14.2       ?       ? 
1 1 1   32   20   58 o    175.9    5.4    0.0000   0.0000          ?        ?   310.9600  19.1556          ?        ?      175.9        5.4       ?       ? 
1 1 1   32   20   59 o     21.5   10.7    0.0000   0.0000          ?        ?   -47.2506  18.5171          ?        ?       21.5       10.7       ?       ? 
1 1 1   32   20   60 o     38.7   15.6    0.0000   0.0000          ?        ?     8.3008  18.5171          ?        ?       38.7       15.6       ?       ? 
1 1 1   32   21    0 o    515.2    4.0 2654.9729  40.8654  2654.9729  40.8654  2654.9729  40.8654      515.2      4.0      515.2        4.0     0.0     0.0 
1 1 1   32   21    1 o    157.8    3.2    0.0000   0.0000          ?        ?   249.0234  10.2163          ?        ?      157.8        3.2       ?       ? 
1 1 1   32   21    2 o    532.5    2.9    0.0000   0.0000          ?        ?  2835.6746  31.2876          ?        ?      532.5        2.9       ?       ? 
1 1 1   32   21    3 o    154.5    3.9    0.0000   0.0000          ?        ?   238.8071  12.1319          ?        ?      154.5        3.9       ?       ? 
1 1 1   32   21    4 o    341.6    2.8    0.0000   0.0000          ?        ?  1167.2175  19.1556          ?        ?      341.6        2.8       ?       ? 
1 1 1   32   21    5 o    340.7    2.7    0.0000   0.0000          ?        ?  1160.8323  18.5171          ?        ?      340.7        2.7       ?       ? 
1 1 1   32   21    6 o    567.0    2.8    0.0000   0.0000          ?        ?  3214.9563  31.9261          ?        ?      567.0        2.8       ?       ? 
1 1 1   32   21    7 o    864.9    3.6    0.0000   0.0000          ?        ?  7482.8350  62.5751          ?        ?      864.9        3.6       ?       ? 
1 1 1   32   21    8 o    204.2    3.3    0.0000   0.0000          ?        ?   416.9547  13.4090          ?        ?      204.2        3.3       ?       ? 
1 1 1   32   21    9 o    240.2    2.4    0.0000   0.0000          ?        ?   577.2236  11.4934          ?        ?      240.2        2.4       ?       ? 
1 1 1   32   21   10 o     22.5   10.0    0.0000   0.0000          ?        ?    -3.1926   8.9393          ?        ?       22.5       10.0       ?       ? 
1 1 1   32   21   11 o    460.2    2.4    0.0000   0.0000          ?        ?  2117.9763  22.3483          ?        ?      460.2        2.4       ?       ? 
1 1 1   32   21   12 o    459.8    2.5    0.0000   0.0000          ?        ?  2114.7837  22.9868          ?        ?      459.8        2.5       ?       ? 
1 1 1   32   21   13 o    351.8    2.4    0.0000   0.0000          ?        ?  1238.0934  16.6016          ?        ?      351.8        2.4       ?       ? 
1 1 1   32   21   14 o    114.4    3.3    0.0000   0.0000          ?        ?   130.8969   7.6623          ?        ?      114.4        3.3       ?       ? 
1 1 1   32   21   15 o    135.6    3.3    0.0000   0.0000          ?        ?   183.8942   8.9393          ?        ?      135.6        3.3       ?       ? 
1 1 1   32   21   16 o    224.0    2.6    0.0000   0.0000          ?        ?   501.8780  11.4934          ?        ?      224.0        2.6       ?       ? 
1 1 1   32   21   17 o    179.0    3.0    0.0000   0.0000          ?        ?   320.5379  10.8549          ?        ?      179.0        3.0       ?       ? 
1 1 1   32   21   18 o    175.8    3.1    0.0000   0.0000          ?        ?   309.0445  10.8549          ?        ?      175.8        3.1       ?       ? 
1 1 1   32   21   19 o    856.1    3.2    0.0000   0.0000          ?        ?  7330.8667  55.5514          ?        ?      856.1        3.2       ?       ? 
1 1 1   32   21   20 o    327.4    2.4    0.0000   0.0000          ?        ?  1072.0778  15.9630          ?        ?      327.4        2.4       ?       ? 
1 1 1   32   21   21 o    237.3    2.7    0.0000   0.0000          ?        ?   563.1760  12.7704          ?        ?      237.3        2.7       ?       ? 
1 1 1   32   21   22 f    241.3    2.8    0.0000   0.0000          ?        ?   582.3317  13.4090          ?        ?      241.3        2.8       ?       ? 
1 1 1   32   21   23 o    645.0    2.8    0.0000   0.0000          ?        ?  4161.8838  36.3957          ?        ?      645.0        2.8       ?       ? 
1 1 1   32   21   24 o    420.6    2.4    0.0000   0.0000          ?        ?  1769.3435  20.4327          ?        ?      420.6        2.4       ?       ? 
1 1 1   32   21   25 o    151.1    4.2    0.0000   0.0000          ?        ?   228.5907  12.7704          ?        ?      151.1        4.2       ?       ? 
1 1 1   32   21   26 o    238.0    2.8    0.0000   0.0000          ?        ?   566.3687  13.4090          ?        ?      238.0        2.8       ?       ? 
1 1 1   32   21   27 o    369.4    2.5    0.0000   0.0000          ?        ?  1365.1593  18.5171          ?        ?      369.4        2.5       ?       ? 
1 1 1   32   21   28 o    370.6    2.4    0.0000   0.0000          ?        ?  1374.0985  17.8786          ?        ?      370.6        2.4       ?       ? 
1 1 1   32   21   29 o     39.0   13.8    0.0000   0.0000          ?        ?    13.4090  13.4090          ?        ?       39.0       13.8       ?       ? 
1 1 1   32   21   30 o    115.4    6.4    0.0000   0.0000          ?        ?   133.4510  14.6860          ?        ?      115.4        6.4       ?       ? 
1 1 1   32   21   31 f    267.9    2.9    0.0000   0.0000          ?        ?   717.6983  15.3245          ?        ?      267.9        2.9       ?       ? 
1 1 1   32   21   32 o     80.2    9.2    0.0000   0.0000          ?        ?    64.4907  14.6860          ?        ?       80.2        9.2       ?       ? 
1 1 1   32   21   33 o    273.8    3.1    0.0000   0.0000          ?        ?   750.2629  17.2401          ?        ?      273.8        3.1       ?       ? 
1 1 1   32   21   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   21   35 o    257.3    3.0    0.0000   0.0000          ?        ?   662.1469  15.3245          ?        ?      257.3        3.0       ?       ? 
1 1 1   32   21   36 o    431.5    2.6    0.0000   0.0000          ?        ?  1862.5676  22.3483          ?        ?      431.5        2.6       ?       ? 
1 1 1   32   21   37 o    227.3    3.8    0.0000   0.0000          ?        ?   517.2025  17.2401          ?        ?      227.3        3.8       ?       ? 
1 1 1   32   21   38 o    222.8    3.9    0.0000   0.0000          ?        ?   496.7698  17.2401          ?        ?      222.8        3.9       ?       ? 
1 1 1   32   21   39 f    157.5    5.3    0.0000   0.0000          ?        ?   248.3849  16.6016          ?        ?      157.5        5.3       ?       ? 
1 1 1   32   21   40 o     23.2   11.4    0.0000   0.0000          ?        ?   -35.1187  17.8786          ?        ?       23.2       11.4       ?       ? 
1 1 1   32   21   41 o    228.4    3.8    0.0000   0.0000          ?        ?   522.3107  17.2401          ?        ?      228.4        3.8       ?       ? 
1 1 1   32   21   42 o    236.0    3.8    0.0000   0.0000          ?        ?   557.4294  17.8786          ?        ?      236.0        3.8       ?       ? 
1 1 1   32   21   43 o    121.8    7.1    0.0000   0.0000          ?        ?   148.7755  17.2401          ?        ?      121.8        7.1       ?       ? 
1 1 1   32   21   44 o    392.7    2.8    0.0000   0.0000          ?        ?  1542.6683  22.3483          ?        ?      392.7        2.8       ?       ? 
1 1 1   32   21   45 o     25.0   12.0    0.0000   0.0000          ?        ?   -21.7097  16.6016          ?        ?       25.0       12.0       ?       ? 
1 1 1   32   21   46 o    345.6    3.0    0.0000   0.0000          ?        ?  1195.3125  20.4327          ?        ?      345.6        3.0       ?       ? 
1 1 1   32   21   47 o     77.9   10.7    0.0000   0.0000          ?        ?    61.2981  16.6016          ?        ?       77.9       10.7       ?       ? 
1 1 1   32   21   48 o    197.0    4.5    0.0000   0.0000          ?        ?   388.8597  17.8786          ?        ?      197.0        4.5       ?       ? 
1 1 1   32   21   49 o    270.8    3.5    0.0000   0.0000          ?        ?   734.2999  19.1556          ?        ?      270.8        3.5       ?       ? 
1 1 1   32   21   50 o    201.8    4.6    0.0000   0.0000          ?        ?   408.0153  18.5171          ?        ?      201.8        4.6       ?       ? 
1 1 1   32   21   51 o     25.5   12.4    0.0000   0.0000          ?        ?   -33.2031  19.7942          ?        ?       25.5       12.4       ?       ? 
1 1 1   32   21   52 o    247.5    4.1    0.0000   0.0000          ?        ?   613.6193  20.4327          ?        ?      247.5        4.1       ?       ? 
1 1 1   32   21   53 o    150.2    6.2    0.0000   0.0000          ?        ?   226.6752  18.5171          ?        ?      150.2        6.2       ?       ? 
1 1 1   32   21   54 o    147.8    6.3    0.0000   0.0000          ?        ?   219.6514  18.5171          ?        ?      147.8        6.3       ?       ? 
1 1 1   32   21   55 o    106.9    9.0    0.0000   0.0000          ?        ?   115.5724  19.1556          ?        ?      106.9        9.0       ?       ? 
1 1 1   32   21   56 o     72.5   13.3    0.0000   0.0000          ?        ?    55.5514  18.5171          ?        ?       72.5       13.3       ?       ? 
1 1 1   32   21   57 o     20.3   10.2    0.0000   0.0000          ?        ?   -54.9129  18.5171          ?        ?       20.3       10.2       ?       ? 
1 1 1   32   21   58 o    115.9    8.0    0.0000   0.0000          ?        ?   136.0051  18.5171          ?        ?      115.9        8.0       ?       ? 
1 1 1   32   21   59 o     99.9    9.3    0.0000   0.0000          ?        ?   101.5249  18.5171          ?        ?       99.9        9.3       ?       ? 
1 1 1   32   22    0 o    512.8    4.2 2630.7090  42.7809  2630.7090  42.7809  2630.7090  42.7809      512.8      4.2      512.8        4.2     0.0     0.0 
1 1 1   32   22    1 o    289.6    2.6    0.0000   0.0000          ?        ?   839.0174  15.3245          ?        ?      289.6        2.6       ?       ? 
1 1 1   32   22    2 o    541.2    2.9    0.0000   0.0000          ?        ?  2929.5371  31.2876          ?        ?      541.2        2.9       ?       ? 
1 1 1   32   22    3 o    396.1    2.7    0.0000   0.0000          ?        ?  1568.8477  21.0712          ?        ?      396.1        2.7       ?       ? 
1 1 1   32   22    4 o    365.4    2.4    0.0000   0.0000          ?        ?  1335.1488  17.8786          ?        ?      365.4        2.4       ?       ? 
1 1 1   32   22    5 o    587.1    2.9    0.0000   0.0000          ?        ?  3447.3784  33.8416          ?        ?      587.1        2.9       ?       ? 
1 1 1   32   22    6 o    384.4    2.6    0.0000   0.0000          ?        ?  1477.5391  19.7942          ?        ?      384.4        2.6       ?       ? 
1 1 1   32   22    7 o     55.9    9.1    0.0000   0.0000          ?        ?    31.2876  10.2163          ?        ?       55.9        9.1       ?       ? 
1 1 1   32   22    8 o    393.8    2.6    0.0000   0.0000          ?        ?  1550.9690  20.4327          ?        ?      393.8        2.6       ?       ? 
1 1 1   32   22    9 o    639.1    3.0    0.0000   0.0000          ?        ?  4085.2612  38.9498          ?        ?      639.1        3.0       ?       ? 
1 1 1   32   22   10 o    111.8    4.3    0.0000   0.0000          ?        ?   125.1502   9.5778          ?        ?      111.8        4.3       ?       ? 
1 1 1   32   22   11 o     84.5    6.0    0.0000   0.0000          ?        ?    71.5144  10.2163          ?        ?       84.5        6.0       ?       ? 
1 1 1   32   22   12 o    223.0    2.7    0.0000   0.0000          ?        ?   497.4084  12.1319          ?        ?      223.0        2.7       ?       ? 
1 1 1   32   22   13 o    261.1    2.6    0.0000   0.0000          ?        ?   681.9411  13.4090          ?        ?      261.1        2.6       ?       ? 
1 1 1   32   22   14 f    289.0    2.0    0.0000   0.0000          ?        ?   835.1863  11.4934          ?        ?      289.0        2.0       ?       ? 
1 1 1   32   22   15 o    187.0    2.6    0.0000   0.0000          ?        ?   349.9099   9.5778          ?        ?      187.0        2.6       ?       ? 
1 1 1   32   22   16 o    475.8    2.5    0.0000   0.0000          ?        ?  2264.1978  23.6253          ?        ?      475.8        2.5       ?       ? 
1 1 1   32   22   17 o   1300.3    4.9    0.0000   0.0000          ?        ? 16919.5469 126.4273          ?        ?     1300.3        4.9       ?       ? 
1 1 1   32   22   18 o    421.4    2.4    0.0000   0.0000          ?        ?  1775.7286  20.4327          ?        ?      421.4        2.4       ?       ? 
1 1 1   32   22   19 o    311.5    2.6    0.0000   0.0000          ?        ?   970.5529  15.9630          ?        ?      311.5        2.6       ?       ? 
1 1 1   32   22   20 o    108.3    5.6    0.0000   0.0000          ?        ?   117.4880  12.1319          ?        ?      108.3        5.6       ?       ? 
1 1 1   32   22   21 o    561.5    2.4    0.0000   0.0000          ?        ?  3153.0198  27.4564          ?        ?      561.5        2.4       ?       ? 
1 1 1   32   22   22 o    146.9    4.3    0.0000   0.0000          ?        ?   215.8203  12.7704          ?        ?      146.9        4.3       ?       ? 
1 1 1   32   22   23 o     45.8   12.8    0.0000   0.0000          ?        ?    21.7097  12.1319          ?        ?       45.8       12.8       ?       ? 
1 1 1   32   22   24 o    171.0    3.9    0.0000   0.0000          ?        ?   292.4429  13.4090          ?        ?      171.0        3.9       ?       ? 
1 1 1   32   22   25 o    242.7    2.9    0.0000   0.0000          ?        ?   589.3555  14.0475          ?        ?      242.7        2.9       ?       ? 
1 1 1   32   22   26 o    337.9    2.6    0.0000   0.0000          ?        ?  1142.3152  17.2401          ?        ?      337.9        2.6       ?       ? 
1 1 1   32   22   27 o    399.5    2.4    0.0000   0.0000          ?        ?  1596.3041  19.1556          ?        ?      399.5        2.4       ?       ? 
1 1 1   32   22   28 o    499.4    2.6    0.0000   0.0000          ?        ?  2494.7041  25.5409          ?        ?      499.4        2.6       ?       ? 
1 1 1   32   22   29 o    296.8    2.8    0.0000   0.0000          ?        ?   881.1599  16.6016          ?        ?      296.8        2.8       ?       ? 
1 1 1   32   22   30 o    647.3    2.9    0.0000   0.0000          ?        ?  4191.8945  37.0343          ?        ?      647.3        2.9       ?       ? 
1 1 1   32   22   31 o    272.9    2.8    0.0000   0.0000          ?        ?   745.1547  15.3245          ?        ?      272.9        2.8       ?       ? 
1 1 1   32   22   32 o    198.6    3.5    0.0000   0.0000          ?        ?   394.6064  14.0475          ?        ?      198.6        3.5       ?       ? 
1 1 1   32   22   33 o    266.5    3.0    0.0000   0.0000          ?        ?   710.6746  15.9630          ?        ?      266.5        3.0       ?       ? 
1 1 1   32   22   34 o    331.2    2.7    0.0000   0.0000          ?        ?  1097.6187  17.8786          ?        ?      331.2        2.7       ?       ? 
1 1 1   32   22   35 o    158.7    4.8    0.0000   0.0000          ?        ?   252.2160  15.3245          ?        ?      158.7        4.8       ?       ? 
1 1 1   32   22   36 o    196.9    4.4    0.0000   0.0000          ?        ?   388.2211  17.2401          ?        ?      196.9        4.4       ?       ? 
1 1 1   32   22   37 o    362.2    2.7    0.0000   0.0000          ?        ?  1312.8005  19.7942          ?        ?      362.2        2.7       ?       ? 
1 1 1   32   22   38 o    152.7    5.4    0.0000   0.0000          ?        ?   233.6989  16.6016          ?        ?      152.7        5.4       ?       ? 
1 1 1   32   22   39 o    346.8    2.9    0.0000   0.0000          ?        ?  1203.6133  20.4327          ?        ?      346.8        2.9       ?       ? 
1 1 1   32   22   40 o    258.0    3.5    0.0000   0.0000          ?        ?   665.9781  17.8786          ?        ?      258.0        3.5       ?       ? 
1 1 1   32   22   41 o    291.4    3.3    0.0000   0.0000          ?        ?   849.8723  19.1556          ?        ?      291.4        3.3       ?       ? 
1 1 1   32   22   42 o    309.5    3.0    0.0000   0.0000          ?        ?   958.4210  18.5171          ?        ?      309.5        3.0       ?       ? 
1 1 1   32   22   43 o    233.4    4.0    0.0000   0.0000          ?        ?   545.2975  18.5171          ?        ?      233.4        4.0       ?       ? 
1 1 1   32   22   44 o    200.6    4.3    0.0000   0.0000          ?        ?   402.9071  17.2401          ?        ?      200.6        4.3       ?       ? 
1 1 1   32   22   45 o     41.5   15.7    0.0000   0.0000          ?        ?    12.7704  17.8786          ?        ?       41.5       15.7       ?       ? 
1 1 1   32   22   46 o    422.4    2.8    0.0000   0.0000          ?        ?  1785.3065  23.6253          ?        ?      422.4        2.8       ?       ? 
1 1 1   32   22   47 o     77.5   11.1    0.0000   0.0000          ?        ?    60.6596  17.2401          ?        ?       77.5       11.1       ?       ? 
1 1 1   32   22   48 o    167.0    5.2    0.0000   0.0000          ?        ?   279.6725  17.2401          ?        ?      167.0        5.2       ?       ? 
1 1 1   32   22   49 o    189.0    4.7    0.0000   0.0000          ?        ?   358.2106  17.8786          ?        ?      189.0        4.7       ?       ? 
1 1 1   32   22   50 o    204.3    4.7    0.0000   0.0000          ?        ?   418.2317  19.1556          ?        ?      204.3        4.7       ?       ? 
1 1 1   32   22   51 o    381.4    2.9    0.0000   0.0000          ?        ?  1455.8293  22.3483          ?        ?      381.4        2.9       ?       ? 
1 1 1   32   22   52 o    175.1    5.3    0.0000   0.0000          ?        ?   307.7674  18.5171          ?        ?      175.1        5.3       ?       ? 
1 1 1   32   22   53 o    280.7    3.5    0.0000   0.0000          ?        ?   789.2127  19.7942          ?        ?      280.7        3.5       ?       ? 
1 1 1   32   22   54 o    179.9    5.3    0.0000   0.0000          ?        ?   325.0075  19.1556          ?        ?      179.9        5.3       ?       ? 
1 1 1   32   22   55 o     21.7   10.8    0.0000   0.0000          ?        ?   -45.9736  18.5171          ?        ?       21.7       10.8       ?       ? 
1 1 1   32   22   56 o    112.4    8.2    0.0000   0.0000          ?        ?   127.7043  18.5171          ?        ?      112.4        8.2       ?       ? 
1 1 1   32   22   57 o    183.4    5.6    0.0000   0.0000          ?        ?   338.4165  20.4327          ?        ?      183.4        5.6       ?       ? 
1 1 1   32   22   58 o     97.6    9.8    0.0000   0.0000          ?        ?    97.0553  19.1556          ?        ?       97.6        9.8       ?       ? 
1 1 1   32   23    0 o    279.2    5.5  780.9120  30.6490   780.9120  30.6490   780.9120  30.6490      279.2      5.5      279.2        5.5     0.0     0.0 
1 1 1   32   23    1 o    671.6    3.3    0.0000   0.0000          ?        ?  4511.7935  44.0580          ?        ?      671.6        3.3       ?       ? 
1 1 1   32   23    2 o    378.1    2.6    0.0000   0.0000          ?        ?  1429.6499  19.7942          ?        ?      378.1        2.6       ?       ? 
1 1 1   32   23    3 f    262.1    2.3    0.0000   0.0000          ?        ?   687.0493  12.1319          ?        ?      262.1        2.3       ?       ? 
1 1 1   32   23    4 o    216.6    3.4    0.0000   0.0000          ?        ?   469.3134  14.6860          ?        ?      216.6        3.4       ?       ? 
1 1 1   32   23    5 o    104.2    4.0    0.0000   0.0000          ?        ?   108.5487   8.3008          ?        ?      104.2        4.0       ?       ? 
1 1 1   32   23    6 o    369.6    2.6    0.0000   0.0000          ?        ?  1366.4363  19.1556          ?        ?      369.6        2.6       ?       ? 
1 1 1   32   23    7 o    776.2    3.5    0.0000   0.0000          ?        ?  6027.0059  53.6358          ?        ?      776.2        3.5       ?       ? 
1 1 1   32   23    8 o    481.7    3.0    0.0000   0.0000          ?        ?  2321.0261  28.7335          ?        ?      481.7        3.0       ?       ? 
1 1 1   32   23    9 o    240.2    2.9    0.0000   0.0000          ?        ?   577.2236  14.0475          ?        ?      240.2        2.9       ?       ? 
1 1 1   32   23   10 o    321.2    2.4    0.0000   0.0000          ?        ?  1031.8510  15.3245          ?        ?      321.2        2.4       ?       ? 
1 1 1   32   23   11 o    113.0    4.2    0.0000   0.0000          ?        ?   127.7043   9.5778          ?        ?      113.0        4.2       ?       ? 
1 1 1   32   23   12 o    476.1    2.5    0.0000   0.0000          ?        ?  2267.3904  24.2638          ?        ?      476.1        2.5       ?       ? 
1 1 1   32   23   13 o    584.5    2.8    0.0000   0.0000          ?        ?  3416.7290  32.5646          ?        ?      584.5        2.8       ?       ? 
1 1 1   32   23   14 o     58.1    9.3    0.0000   0.0000          ?        ?    33.8416  10.8549          ?        ?       58.1        9.3       ?       ? 
1 1 1   32   23   15 f    338.3    2.1    0.0000   0.0000          ?        ?  1144.8693  14.0475          ?        ?      338.3        2.1       ?       ? 
1 1 1   32   23   16 o    333.8    2.3    0.0000   0.0000          ?        ?  1114.2202  15.3245          ?        ?      333.8        2.3       ?       ? 
1 1 1   32   23   17 o    199.7    2.7    0.0000   0.0000          ?        ?   399.0760  10.8549          ?        ?      199.7        2.7       ?       ? 
1 1 1   32   23   18 o    467.3    2.3    0.0000   0.0000          ?        ?  2183.7439  21.7097          ?        ?      467.3        2.3       ?       ? 
1 1 1   32   23   19 o    489.9    2.5    0.0000   0.0000          ?        ?  2400.8413  24.2638          ?        ?      489.9        2.5       ?       ? 
1 1 1   32   23   20 o    278.4    2.5    0.0000   0.0000          ?        ?   775.1653  14.0475          ?        ?      278.4        2.5       ?       ? 
1 1 1   32   23   21 o    250.1    2.7    0.0000   0.0000          ?        ?   625.7512  13.4090          ?        ?      250.1        2.7       ?       ? 
1 1 1   32   23   22 o    583.0    2.5    0.0000   0.0000          ?        ?  3400.1277  29.3720          ?        ?      583.0        2.5       ?       ? 
1 1 1   32   23   23 o    399.7    2.5    0.0000   0.0000          ?        ?  1598.2196  19.7942          ?        ?      399.7        2.5       ?       ? 
1 1 1   32   23   24 o    796.7    3.0    0.0000   0.0000          ?        ?  6348.8203  48.5276          ?        ?      796.7        3.0       ?       ? 
1 1 1   32   23   25 o    349.0    2.5    0.0000   0.0000          ?        ?  1218.2993  17.2401          ?        ?      349.0        2.5       ?       ? 
1 1 1   32   23   26 f    383.9    2.4    0.0000   0.0000          ?        ?  1474.3464  18.5171          ?        ?      383.9        2.4       ?       ? 
1 1 1   32   23   27 o    342.2    2.5    0.0000   0.0000          ?        ?  1171.0486  17.2401          ?        ?      342.2        2.5       ?       ? 
1 1 1   32   23   28 o    386.2    2.5    0.0000   0.0000          ?        ?  1491.5865  19.1556          ?        ?      386.2        2.5       ?       ? 
1 1 1   32   23   29 o    432.2    2.4    0.0000   0.0000          ?        ?  1868.3143  21.0712          ?        ?      432.2        2.4       ?       ? 
1 1 1   32   23   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   23   31 o     99.0    6.8    0.0000   0.0000          ?        ?    98.3323  13.4090          ?        ?       99.0        6.8       ?       ? 
1 1 1   32   23   32 o    120.3    5.8    0.0000   0.0000          ?        ?   144.9444  14.0475          ?        ?      120.3        5.8       ?       ? 
1 1 1   32   23   33 o    162.3    4.3    0.0000   0.0000          ?        ?   263.7094  14.0475          ?        ?      162.3        4.3       ?       ? 
1 1 1   32   23   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   23   35 o    343.3    2.6    0.0000   0.0000          ?        ?  1179.3494  17.8786          ?        ?      343.3        2.6       ?       ? 
1 1 1   32   23   36 o    240.7    3.4    0.0000   0.0000          ?        ?   579.7776  16.6016          ?        ?      240.7        3.4       ?       ? 
1 1 1   32   23   37 o    496.3    2.5    0.0000   0.0000          ?        ?  2464.0549  24.9023          ?        ?      496.3        2.5       ?       ? 
1 1 1   32   23   38 o    354.7    2.8    0.0000   0.0000          ?        ?  1258.5261  19.7942          ?        ?      354.7        2.8       ?       ? 
1 1 1   32   23   39 o    162.3    5.1    0.0000   0.0000          ?        ?   263.7094  16.6016          ?        ?      162.3        5.1       ?       ? 
1 1 1   32   23   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   23   41 o    462.7    2.8    0.0000   0.0000          ?        ?  2142.2400  25.5409          ?        ?      462.7        2.8       ?       ? 
1 1 1   32   23   42 o    137.7    6.5    0.0000   0.0000          ?        ?   190.2794  17.8786          ?        ?      137.7        6.5       ?       ? 
1 1 1   32   23   43 o    193.6    4.6    0.0000   0.0000          ?        ?   375.4507  17.8786          ?        ?      193.6        4.6       ?       ? 
1 1 1   32   23   44 o    115.8    7.4    0.0000   0.0000          ?        ?   134.7281  17.2401          ?        ?      115.8        7.4       ?       ? 
1 1 1   32   23   45 o    295.2    3.4    0.0000   0.0000          ?        ?   872.2206  19.7942          ?        ?      295.2        3.4       ?       ? 
1 1 1   32   23   46 o     33.3   14.6    0.0000   0.0000          ?        ?    -3.8311  18.5171          ?        ?       33.3       14.6       ?       ? 
1 1 1   32   23   47 o    101.3    9.1    0.0000   0.0000          ?        ?   103.4405  18.5171          ?        ?      101.3        9.1       ?       ? 
1 1 1   32   23   48 o    179.1    5.3    0.0000   0.0000          ?        ?   321.8149  19.1556          ?        ?      179.1        5.3       ?       ? 
1 1 1   32   23   49 o    284.7    3.5    0.0000   0.0000          ?        ?   811.5610  19.7942          ?        ?      284.7        3.5       ?       ? 
1 1 1   32   23   50 o    119.2    7.8    0.0000   0.0000          ?        ?   143.0288  18.5171          ?        ?      119.2        7.8       ?       ? 
1 1 1   32   23   51 o     96.0    9.6    0.0000   0.0000          ?        ?    93.2242  18.5171          ?        ?       96.0        9.6       ?       ? 
1 1 1   32   23   52 o    133.5    7.2    0.0000   0.0000          ?        ?   179.4246  19.1556          ?        ?      133.5        7.2       ?       ? 
1 1 1   32   23   53 o     26.4   12.6    0.0000   0.0000          ?        ?   -23.6253  18.5171          ?        ?       26.4       12.6       ?       ? 
1 1 1   32   23   54 o    105.7    8.8    0.0000   0.0000          ?        ?   113.0183  18.5171          ?        ?      105.7        8.8       ?       ? 
1 1 1   32   23   55 o     38.0   15.6    0.0000   0.0000          ?        ?     5.7467  19.1556          ?        ?       38.0       15.6       ?       ? 
1 1 1   32   23   56 f    346.8    3.0    0.0000   0.0000          ?        ?  1204.8903  21.0712          ?        ?      346.8        3.0       ?       ? 
1 1 1   32   23   57 o     63.4   14.4    0.0000   0.0000          ?        ?    43.4195  17.8786          ?        ?       63.4       14.4       ?       ? 
1 1 1   32   24    0 o     51.8   22.0   38.3113  22.9868    38.3113  22.9868    38.3113  22.9868       51.8     22.0       51.8       22.0     0.0     0.0 
1 1 1   32   24    1 o    223.1    4.0    0.0000   0.0000          ?        ?   498.0469  17.8786          ?        ?      223.1        4.0       ?       ? 
1 1 1   32   24    2 o    296.0    3.3    0.0000   0.0000          ?        ?   876.6902  19.7942          ?        ?      296.0        3.3       ?       ? 
1 1 1   32   24    3 f     36.6   13.4    0.0000   0.0000          ?        ?    10.8549  12.7704          ?        ?       36.6       13.4       ?       ? 
1 1 1   32   24    4 o    320.1    3.4    0.0000   0.0000          ?        ?  1024.8273  21.7097          ?        ?      320.1        3.4       ?       ? 
1 1 1   32   24    5 o     77.8    7.8    0.0000   0.0000          ?        ?    60.6596  12.1319          ?        ?       77.8        7.8       ?       ? 
1 1 1   32   24    6 o    538.7    3.3    0.0000   0.0000          ?        ?  2903.3579  35.7572          ?        ?      538.7        3.3       ?       ? 
1 1 1   32   24    7 o    234.0    3.4    0.0000   0.0000          ?        ?   547.8516  15.9630          ?        ?      234.0        3.4       ?       ? 
1 1 1   32   24    8 o    436.6    2.8    0.0000   0.0000          ?        ?  1906.6256  24.2638          ?        ?      436.6        2.8       ?       ? 
1 1 1   32   24    9 o    309.7    2.7    0.0000   0.0000          ?        ?   959.0594  16.6016          ?        ?      309.7        2.7       ?       ? 
1 1 1   32   24   10 o     77.0    5.4    0.0000   0.0000          ?        ?    59.3825   8.3008          ?        ?       77.0        5.4       ?       ? 
1 1 1   32   24   11 o    380.8    2.4    0.0000   0.0000          ?        ?  1450.0826  18.5171          ?        ?      380.8        2.4       ?       ? 
1 1 1   32   24   12 o    229.6    2.5    0.0000   0.0000          ?        ?   527.4188  11.4934          ?        ?      229.6        2.5       ?       ? 
1 1 1   32   24   13 o    133.2    3.8    0.0000   0.0000          ?        ?   177.5090  10.2163          ?        ?      133.2        3.8       ?       ? 
1 1 1   32   24   14 o    210.9    3.0    0.0000   0.0000          ?        ?   445.0496  12.7704          ?        ?      210.9        3.0       ?       ? 
1 1 1   32   24   15 o    213.6    2.4    0.0000   0.0000          ?        ?   456.5430  10.2163          ?        ?      213.6        2.4       ?       ? 
1 1 1   32   24   16 o    882.9    3.5    0.0000   0.0000          ?        ?  7798.9033  61.9366          ?        ?      882.9        3.5       ?       ? 
1 1 1   32   24   17 o    149.7    3.6    0.0000   0.0000          ?        ?   224.1211  10.8549          ?        ?      149.7        3.6       ?       ? 
1 1 1   32   24   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   24   19 o    209.1    2.7    0.0000   0.0000          ?        ?   437.3873  11.4934          ?        ?      209.1        2.7       ?       ? 
1 1 1   32   24   20 o     38.1   12.4    0.0000   0.0000          ?        ?    14.0475  10.8549          ?        ?       38.1       12.4       ?       ? 
1 1 1   32   24   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   24   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   24   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   24   24 o     24.2   11.3    0.0000   0.0000          ?        ?   -12.7704  13.4090          ?        ?       24.2       11.3       ?       ? 
1 1 1   32   24   25 o    198.4    3.5    0.0000   0.0000          ?        ?   393.9678  14.0475          ?        ?      198.4        3.5       ?       ? 
1 1 1   32   24   26 o    598.6    2.7    0.0000   0.0000          ?        ?  3584.0217  31.9261          ?        ?      598.6        2.7       ?       ? 
1 1 1   32   24   27 f    261.2    2.8    0.0000   0.0000          ?        ?   682.5797  14.6860          ?        ?      261.2        2.8       ?       ? 
1 1 1   32   24   28 o    157.3    4.5    0.0000   0.0000          ?        ?   247.7464  14.0475          ?        ?      157.3        4.5       ?       ? 
1 1 1   32   24   29 o    136.7    5.1    0.0000   0.0000          ?        ?   187.0868  14.0475          ?        ?      136.7        5.1       ?       ? 
1 1 1   32   24   30 o    452.4    2.6    0.0000   0.0000          ?        ?  2047.7389  23.6253          ?        ?      452.4        2.6       ?       ? 
1 1 1   32   24   31 f     99.0    7.1    0.0000   0.0000          ?        ?    98.3323  14.0475          ?        ?       99.0        7.1       ?       ? 
1 1 1   32   24   32 o    398.6    2.6    0.0000   0.0000          ?        ?  1589.2803  21.0712          ?        ?      398.6        2.6       ?       ? 
1 1 1   32   24   33 o     20.3   10.0    0.0000   0.0000          ?        ?   -32.5646  14.6860          ?        ?       20.3       10.0       ?       ? 
1 1 1   32   24   34 o    211.9    3.8    0.0000   0.0000          ?        ?   449.5192  15.9630          ?        ?      211.9        3.8       ?       ? 
1 1 1   32   24   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   24   36 o    310.0    3.0    0.0000   0.0000          ?        ?   961.6136  18.5171          ?        ?      310.0        3.0       ?       ? 
1 1 1   32   24   37 o     26.5   12.2    0.0000   0.0000          ?        ?   -12.7704  15.3245          ?        ?       26.5       12.2       ?       ? 
1 1 1   32   24   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   24   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   24   40 o    403.9    2.6    0.0000   0.0000          ?        ?  1632.0613  21.0712          ?        ?      403.9        2.6       ?       ? 
1 1 1   32   24   41 o     84.3    9.9    0.0000   0.0000          ?        ?    71.5144  16.6016          ?        ?       84.3        9.9       ?       ? 
1 1 1   32   24   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   24   43 o     65.2   13.7    0.0000   0.0000          ?        ?    44.6965  17.2401          ?        ?       65.2       13.7       ?       ? 
1 1 1   32   24   44 o    220.9    3.9    0.0000   0.0000          ?        ?   488.4691  17.2401          ?        ?      220.9        3.9       ?       ? 
1 1 1   32   24   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   24   46 o    172.8    5.2    0.0000   0.0000          ?        ?   299.4666  17.8786          ?        ?      172.8        5.2       ?       ? 
1 1 1   32   24   47 o    279.8    3.5    0.0000   0.0000          ?        ?   784.1046  19.7942          ?        ?      279.8        3.5       ?       ? 
1 1 1   32   24   48 o    151.1    6.3    0.0000   0.0000          ?        ?   229.2293  19.1556          ?        ?      151.1        6.3       ?       ? 
1 1 1   32   24   49 o    299.9    3.5    0.0000   0.0000          ?        ?   900.9540  21.0712          ?        ?      299.9        3.5       ?       ? 
1 1 1   32   24   50 o    170.1    5.4    0.0000   0.0000          ?        ?   290.5273  18.5171          ?        ?      170.1        5.4       ?       ? 
1 1 1   32   24   51 o     95.6   10.0    0.0000   0.0000          ?        ?    92.5856  19.1556          ?        ?       95.6       10.0       ?       ? 
1 1 1   32   24   52 o     30.9   13.9    0.0000   0.0000          ?        ?    -7.6623  17.8786          ?        ?       30.9       13.9       ?       ? 
1 1 1   32   24   53 o    345.8    3.1    0.0000   0.0000          ?        ?  1197.8666  21.7097          ?        ?      345.8        3.1       ?       ? 
1 1 1   32   24   54 o    158.7    6.0    0.0000   0.0000          ?        ?   253.4931  19.1556          ?        ?      158.7        6.0       ?       ? 
1 1 1   32   24   55 o    287.7    3.6    0.0000   0.0000          ?        ?   829.4396  20.4327          ?        ?      287.7        3.6       ?       ? 
1 1 1   32   24   56 o     62.2   15.4    0.0000   0.0000          ?        ?    42.1424  19.1556          ?        ?       62.2       15.4       ?       ? 
1 1 1   32   25    0 o     77.2   17.6   68.3218  23.6253    68.3218  23.6253    68.3218  23.6253       77.2     17.6       77.2       17.6     0.0     0.0 
1 1 1   32   25    1 o    308.5    3.4    0.0000   0.0000          ?        ?   952.0358  21.0712          ?        ?      308.5        3.4       ?       ? 
1 1 1   32   25    2 o    242.6    3.9    0.0000   0.0000          ?        ?   588.7169  19.1556          ?        ?      242.6        3.9       ?       ? 
1 1 1   32   25    3 o    512.7    3.4    0.0000   0.0000          ?        ?  2629.4319  35.1187          ?        ?      512.7        3.4       ?       ? 
1 1 1   32   25    4 o    355.2    3.1    0.0000   0.0000          ?        ?  1261.7188  22.3483          ?        ?      355.2        3.1       ?       ? 
1 1 1   32   25    5 o    362.1    3.1    0.0000   0.0000          ?        ?  1311.5234  22.3483          ?        ?      362.1        3.1       ?       ? 
1 1 1   32   25    6 o    291.0    2.9    0.0000   0.0000          ?        ?   847.3182  16.6016          ?        ?      291.0        2.9       ?       ? 
1 1 1   32   25    7 o     43.6   13.4    0.0000   0.0000          ?        ?    19.1556  12.7704          ?        ?       43.6       13.4       ?       ? 
1 1 1   32   25    8 o    491.5    3.2    0.0000   0.0000          ?        ?  2416.8044  31.9261          ?        ?      491.5        3.2       ?       ? 
1 1 1   32   25    9 o    265.5    3.2    0.0000   0.0000          ?        ?   704.9279  17.2401          ?        ?      265.5        3.2       ?       ? 
1 1 1   32   25   10 f    188.9    2.5    0.0000   0.0000          ?        ?   356.9336   9.5778          ?        ?      188.9        2.5       ?       ? 
1 1 1   32   25   11 o    283.8    2.2    0.0000   0.0000          ?        ?   805.8143  12.7704          ?        ?      283.8        2.2       ?       ? 
1 1 1   32   25   12 o    199.6    3.0    0.0000   0.0000          ?        ?   398.4375  12.1319          ?        ?      199.6        3.0       ?       ? 
1 1 1   32   25   13 o    703.5    2.9    0.0000   0.0000          ?        ?  4950.4580  41.5039          ?        ?      703.5        2.9       ?       ? 
1 1 1   32   25   14 o     62.3    8.2    0.0000   0.0000          ?        ?    38.9498  10.2163          ?        ?       62.3        8.2       ?       ? 
1 1 1   32   25   15 o    360.0    2.5    0.0000   0.0000          ?        ?  1296.1989  17.8786          ?        ?      360.0        2.5       ?       ? 
1 1 1   32   25   16 o    128.3    3.5    0.0000   0.0000          ?        ?   164.7386   8.9393          ?        ?      128.3        3.5       ?       ? 
1 1 1   32   25   17 o    630.0    2.9    0.0000   0.0000          ?        ?  3970.3274  36.3957          ?        ?      630.0        2.9       ?       ? 
1 1 1   32   25   18 o    333.6    2.4    0.0000   0.0000          ?        ?  1112.9432  15.9630          ?        ?      333.6        2.4       ?       ? 
1 1 1   32   25   19 o    408.2    2.5    0.0000   0.0000          ?        ?  1666.5415  20.4327          ?        ?      408.2        2.5       ?       ? 
1 1 1   32   25   20 o     21.1    9.9    0.0000   0.0000          ?        ?   -12.1319  10.8549          ?        ?       21.1        9.9       ?       ? 
1 1 1   32   25   21 o    213.0    2.8    0.0000   0.0000          ?        ?   453.9889  12.1319          ?        ?      213.0        2.8       ?       ? 
1 1 1   32   25   22 o    137.4    4.2    0.0000   0.0000          ?        ?   189.0024  11.4934          ?        ?      137.4        4.2       ?       ? 
1 1 1   32   25   23 o    362.7    2.4    0.0000   0.0000          ?        ?  1315.9932  17.2401          ?        ?      362.7        2.4       ?       ? 
1 1 1   32   25   24 o    355.0    2.4    0.0000   0.0000          ?        ?  1260.4417  17.2401          ?        ?      355.0        2.4       ?       ? 
1 1 1   32   25   25 o     62.3    9.7    0.0000   0.0000          ?        ?    38.9498  12.1319          ?        ?       62.3        9.7       ?       ? 
1 1 1   32   25   26 o    400.8    2.4    0.0000   0.0000          ?        ?  1606.5205  19.1556          ?        ?      400.8        2.4       ?       ? 
1 1 1   32   25   27 o    224.0    3.3    0.0000   0.0000          ?        ?   501.8780  14.6860          ?        ?      224.0        3.3       ?       ? 
1 1 1   32   25   28 o     33.7   13.1    0.0000   0.0000          ?        ?     7.0237  12.7704          ?        ?       33.7       13.1       ?       ? 
1 1 1   32   25   29 o    282.2    2.8    0.0000   0.0000          ?        ?   796.8750  15.9630          ?        ?      282.2        2.8       ?       ? 
1 1 1   32   25   30 o     17.6    8.8    0.0000   0.0000          ?        ?   -38.9498  13.4090          ?        ?       17.6        8.8       ?       ? 
1 1 1   32   25   31 o    209.5    3.7    0.0000   0.0000          ?        ?   439.3029  15.3245          ?        ?      209.5        3.7       ?       ? 
1 1 1   32   25   32 o    390.8    2.5    0.0000   0.0000          ?        ?  1527.9823  19.7942          ?        ?      390.8        2.5       ?       ? 
1 1 1   32   25   33 o    280.2    2.8    0.0000   0.0000          ?        ?   785.3816  15.9630          ?        ?      280.2        2.8       ?       ? 
1 1 1   32   25   34 o    259.2    3.1    0.0000   0.0000          ?        ?   672.3633  15.9630          ?        ?      259.2        3.1       ?       ? 
1 1 1   32   25   35 o    566.3    2.7    0.0000   0.0000          ?        ?  3207.9326  30.6490          ?        ?      566.3        2.7       ?       ? 
1 1 1   32   25   36 o    223.4    3.6    0.0000   0.0000          ?        ?   499.3239  15.9630          ?        ?      223.4        3.6       ?       ? 
1 1 1   32   25   37 o    420.6    2.7    0.0000   0.0000          ?        ?  1769.9821  22.3483          ?        ?      420.6        2.7       ?       ? 
1 1 1   32   25   38 o    428.0    2.8    0.0000   0.0000          ?        ?  1833.1957  23.6253          ?        ?      428.0        2.8       ?       ? 
1 1 1   32   25   39 o    691.6    2.9    0.0000   0.0000          ?        ?  4786.3579  40.2269          ?        ?      691.6        2.9       ?       ? 
1 1 1   32   25   40 o    313.3    3.1    0.0000   0.0000          ?        ?   982.0463  19.1556          ?        ?      313.3        3.1       ?       ? 
1 1 1   32   25   41 o    205.8    3.9    0.0000   0.0000          ?        ?   423.9784  15.9630          ?        ?      205.8        3.9       ?       ? 
1 1 1   32   25   42 o    220.6    3.9    0.0000   0.0000          ?        ?   487.1920  17.2401          ?        ?      220.6        3.9       ?       ? 
1 1 1   32   25   43 o    166.3    5.0    0.0000   0.0000          ?        ?   277.1184  16.6016          ?        ?      166.3        5.0       ?       ? 
1 1 1   32   25   44 o    104.1    8.6    0.0000   0.0000          ?        ?   109.1872  17.8786          ?        ?      104.1        8.6       ?       ? 
1 1 1   32   25   45 o     17.9    9.1    0.0000   0.0000          ?        ?   -60.0210  16.6016          ?        ?       17.9        9.1       ?       ? 
1 1 1   32   25   46 o    181.5    4.8    0.0000   0.0000          ?        ?   330.1157  17.2401          ?        ?      181.5        4.8       ?       ? 
1 1 1   32   25   47 o     50.3   16.2    0.0000   0.0000          ?        ?    25.5409  18.5171          ?        ?       50.3       16.2       ?       ? 
1 1 1   32   25   48 o    110.3    8.1    0.0000   0.0000          ?        ?   122.5962  17.8786          ?        ?      110.3        8.1       ?       ? 
1 1 1   32   25   49 o     30.1   13.6    0.0000   0.0000          ?        ?    -8.3008  17.2401          ?        ?       30.1       13.6       ?       ? 
1 1 1   32   25   50 o     25.3   12.2    0.0000   0.0000          ?        ?   -25.5409  17.8786          ?        ?       25.3       12.2       ?       ? 
1 1 1   32   25   51 o    125.3    7.4    0.0000   0.0000          ?        ?   158.3534  18.5171          ?        ?      125.3        7.4       ?       ? 
1 1 1   32   25   52 o     49.6   15.6    0.0000   0.0000          ?        ?    25.5409  17.2401          ?        ?       49.6       15.6       ?       ? 
1 1 1   32   25   53 o    237.0    3.9    0.0000   0.0000          ?        ?   563.1760  18.5171          ?        ?      237.0        3.9       ?       ? 
1 1 1   32   25   54 o    170.1    5.6    0.0000   0.0000          ?        ?   291.1659  19.1556          ?        ?      170.1        5.6       ?       ? 
1 1 1   32   25   55 o     34.0   14.6    0.0000   0.0000          ?        ?     0.0000  17.8786          ?        ?       34.0       14.6       ?       ? 
1 1 1   32   26    0 o     19.2   14.1  -62.5751  30.0105   -62.5751  30.0105   -62.5751  30.0105       19.2     14.1       19.2       14.1     0.0     0.0 
1 1 1   32   26    1 o    130.6    8.6    0.0000   0.0000          ?        ?   171.1238  22.3483          ?        ?      130.6        8.6       ?       ? 
1 1 1   32   26    2 o    335.6    4.6    0.0000   0.0000          ?        ?  1126.9907  30.6490          ?        ?      335.6        4.6       ?       ? 
1 1 1   32   26    3 o    161.5    6.7    0.0000   0.0000          ?        ?   261.1554  21.7097          ?        ?      161.5        6.7       ?       ? 
1 1 1   32   26    4 o     67.6   14.6    0.0000   0.0000          ?        ?    47.8891  19.1556          ?        ?       67.6       14.6       ?       ? 
1 1 1   32   26    5 o    284.8    3.9    0.0000   0.0000          ?        ?   811.5610  22.3483          ?        ?      284.8        3.9       ?       ? 
1 1 1   32   26    6 o    383.3    2.8    0.0000   0.0000          ?        ?  1469.8767  21.7097          ?        ?      383.3        2.8       ?       ? 
1 1 1   32   26    7 o    132.0    4.6    0.0000   0.0000          ?        ?   174.3164  12.1319          ?        ?      132.0        4.6       ?       ? 
1 1 1   32   26    8 o    115.5    5.5    0.0000   0.0000          ?        ?   133.4510  12.7704          ?        ?      115.5        5.5       ?       ? 
1 1 1   32   26    9 o    352.8    3.0    0.0000   0.0000          ?        ?  1245.1172  21.0712          ?        ?      352.8        3.0       ?       ? 
1 1 1   32   26   10 o    198.1    3.7    0.0000   0.0000          ?        ?   392.6908  14.6860          ?        ?      198.1        3.7       ?       ? 
1 1 1   32   26   11 o    170.6    3.2    0.0000   0.0000          ?        ?   291.1659  10.8549          ?        ?      170.6        3.2       ?       ? 
1 1 1   32   26   12 o    535.5    2.6    0.0000   0.0000          ?        ?  2868.8777  28.0950          ?        ?      535.5        2.6       ?       ? 
1 1 1   32   26   13 o    508.9    2.6    0.0000   0.0000          ?        ?  2590.4824  26.1794          ?        ?      508.9        2.6       ?       ? 
1 1 1   32   26   14 o    579.3    2.8    0.0000   0.0000          ?        ?  3357.3467  32.5646          ?        ?      579.3        2.8       ?       ? 
1 1 1   32   26   15 o    169.5    3.6    0.0000   0.0000          ?        ?   287.3347  12.1319          ?        ?      169.5        3.6       ?       ? 
1 1 1   32   26   16 o    235.7    2.3    0.0000   0.0000          ?        ?   555.5138  10.8549          ?        ?      235.7        2.3       ?       ? 
1 1 1   32   26   17 f    358.0    2.3    0.0000   0.0000          ?        ?  1282.1515  16.6016          ?        ?      358.0        2.3       ?       ? 
1 1 1   32   26   18 o    541.2    2.5    0.0000   0.0000          ?        ?  2930.1758  27.4564          ?        ?      541.2        2.5       ?       ? 
1 1 1   32   26   19 o    470.2    2.5    0.0000   0.0000          ?        ?  2211.2002  23.6253          ?        ?      470.2        2.5       ?       ? 
1 1 1   32   26   20 o    139.7    4.1    0.0000   0.0000          ?        ?   195.3876  11.4934          ?        ?      139.7        4.1       ?       ? 
1 1 1   32   26   21 o    344.1    2.4    0.0000   0.0000          ?        ?  1184.4576  16.6016          ?        ?      344.1        2.4       ?       ? 
1 1 1   32   26   22 o    393.9    2.5    0.0000   0.0000          ?        ?  1552.2461  19.7942          ?        ?      393.9        2.5       ?       ? 
1 1 1   32   26   23 o    255.3    2.6    0.0000   0.0000          ?        ?   651.9305  13.4090          ?        ?      255.3        2.6       ?       ? 
1 1 1   32   26   24 o    222.4    3.0    0.0000   0.0000          ?        ?   494.8542  13.4090          ?        ?      222.4        3.0       ?       ? 
1 1 1   32   26   25 o     21.9   10.4    0.0000   0.0000          ?        ?   -14.6860  12.1319          ?        ?       21.9       10.4       ?       ? 
1 1 1   32   26   26 o    102.5    5.9    0.0000   0.0000          ?        ?   105.3561  12.1319          ?        ?      102.5        5.9       ?       ? 
1 1 1   32   26   27 o    221.2    3.2    0.0000   0.0000          ?        ?   489.7461  14.0475          ?        ?      221.2        3.2       ?       ? 
1 1 1   32   26   28 f    143.8    4.4    0.0000   0.0000          ?        ?   206.8810  12.7704          ?        ?      143.8        4.4       ?       ? 
1 1 1   32   26   29 o    209.7    3.3    0.0000   0.0000          ?        ?   439.9414  14.0475          ?        ?      209.7        3.3       ?       ? 
1 1 1   32   26   30 o    208.9    3.7    0.0000   0.0000          ?        ?   436.7488  15.3245          ?        ?      208.9        3.7       ?       ? 
1 1 1   32   26   31 o    289.8    2.9    0.0000   0.0000          ?        ?   840.2945  16.6016          ?        ?      289.8        2.9       ?       ? 
1 1 1   32   26   32 o     19.7    9.7    0.0000   0.0000          ?        ?   -31.9261  14.0475          ?        ?       19.7        9.7       ?       ? 
1 1 1   32   26   33 o    280.3    2.8    0.0000   0.0000          ?        ?   786.0201  15.9630          ?        ?      280.3        2.8       ?       ? 
1 1 1   32   26   34 f    196.9    3.9    0.0000   0.0000          ?        ?   388.2211  15.3245          ?        ?      196.9        3.9       ?       ? 
1 1 1   32   26   35 o    162.5    4.9    0.0000   0.0000          ?        ?   264.3480  15.9630          ?        ?      162.5        4.9       ?       ? 
1 1 1   32   26   36 o    524.5    2.6    0.0000   0.0000          ?        ?  2752.6667  27.4564          ?        ?      524.5        2.6       ?       ? 
1 1 1   32   26   37 o    335.3    3.0    0.0000   0.0000          ?        ?  1125.0751  19.7942          ?        ?      335.3        3.0       ?       ? 
1 1 1   32   26   38 o    376.1    2.7    0.0000   0.0000          ?        ?  1415.6024  20.4327          ?        ?      376.1        2.7       ?       ? 
1 1 1   32   26   39 o    132.5    6.3    0.0000   0.0000          ?        ?   176.2320  16.6016          ?        ?      132.5        6.3       ?       ? 
1 1 1   32   26   40 o    113.6    7.0    0.0000   0.0000          ?        ?   129.6199  15.9630          ?        ?      113.6        7.0       ?       ? 
1 1 1   32   26   41 f    313.4    3.2    0.0000   0.0000          ?        ?   983.3233  19.7942          ?        ?      313.4        3.2       ?       ? 
1 1 1   32   26   42 o    133.2    6.2    0.0000   0.0000          ?        ?   178.1475  16.6016          ?        ?      133.2        6.2       ?       ? 
1 1 1   32   26   43 f     49.3   15.3    0.0000   0.0000          ?        ?    24.9023  16.6016          ?        ?       49.3       15.3       ?       ? 
1 1 1   32   26   44 o    315.3    3.2    0.0000   0.0000          ?        ?   995.4552  20.4327          ?        ?      315.3        3.2       ?       ? 
1 1 1   32   26   45 o     30.1   13.6    0.0000   0.0000          ?        ?    -8.3008  17.2401          ?        ?       30.1       13.6       ?       ? 
1 1 1   32   26   46 o     87.8    9.8    0.0000   0.0000          ?        ?    77.8996  17.2401          ?        ?       87.8        9.8       ?       ? 
1 1 1   32   26   47 o     31.0   13.9    0.0000   0.0000          ?        ?    -7.6623  17.8786          ?        ?       31.0       13.9       ?       ? 
1 1 1   32   26   48 o    221.9    4.2    0.0000   0.0000          ?        ?   493.5772  18.5171          ?        ?      221.9        4.2       ?       ? 
1 1 1   32   26   49 o    173.1    5.0    0.0000   0.0000          ?        ?   300.7437  17.2401          ?        ?      173.1        5.0       ?       ? 
1 1 1   32   26   50 o    155.4    5.8    0.0000   0.0000          ?        ?   242.6382  17.8786          ?        ?      155.4        5.8       ?       ? 
1 1 1   32   26   51 o     61.1   14.8    0.0000   0.0000          ?        ?    40.2269  17.8786          ?        ?       61.1       14.8       ?       ? 
1 1 1   32   26   52 f    186.0    4.8    0.0000   0.0000          ?        ?   347.3558  17.8786          ?        ?      186.0        4.8       ?       ? 
1 1 1   32   26   53 o    148.1    6.0    0.0000   0.0000          ?        ?   220.9285  17.8786          ?        ?      148.1        6.0       ?       ? 
1 1 1   32   26   54 o     30.2   13.7    0.0000   0.0000          ?        ?    -8.9393  17.8786          ?        ?       30.2       13.7       ?       ? 
1 1 1   32   27    0 o    144.0    9.2  210.0736  26.1794   210.0736  26.1794   210.0736  26.1794      144.0      9.2      144.0        9.2     0.0     0.0 
1 1 1   32   27    1 o    391.9    3.5    0.0000   0.0000          ?        ?  1536.9215  27.4564          ?        ?      391.9        3.5       ?       ? 
1 1 1   32   27    2 o    450.1    3.0    0.0000   0.0000          ?        ?  2026.6676  27.4564          ?        ?      450.1        3.0       ?       ? 
1 1 1   32   27    3 o    305.4    3.9    0.0000   0.0000          ?        ?   933.5186  23.6253          ?        ?      305.4        3.9       ?       ? 
1 1 1   32   27    4 o    295.0    4.0    0.0000   0.0000          ?        ?   870.9435  23.6253          ?        ?      295.0        4.0       ?       ? 
1 1 1   32   27    5 o    309.1    3.7    0.0000   0.0000          ?        ?   955.8669  22.9868          ?        ?      309.1        3.7       ?       ? 
1 1 1   32   27    6 o    347.3    3.7    0.0000   0.0000          ?        ?  1206.8059  25.5409          ?        ?      347.3        3.7       ?       ? 
1 1 1   32   27    7 o    189.8    5.6    0.0000   0.0000          ?        ?   360.7647  21.0712          ?        ?      189.8        5.6       ?       ? 
1 1 1   32   27    8 o    378.6    2.6    0.0000   0.0000          ?        ?  1434.1196  19.7942          ?        ?      378.6        2.6       ?       ? 
1 1 1   32   27    9 f    270.9    3.2    0.0000   0.0000          ?        ?   734.2999  17.2401          ?        ?      270.9        3.2       ?       ? 
1 1 1   32   27   10 o    379.6    3.1    0.0000   0.0000          ?        ?  1441.1433  23.6253          ?        ?      379.6        3.1       ?       ? 
1 1 1   32   27   11 o    156.3    3.5    0.0000   0.0000          ?        ?   244.5538  10.8549          ?        ?      156.3        3.5       ?       ? 
1 1 1   32   27   12 o    172.6    3.5    0.0000   0.0000          ?        ?   298.1896  12.1319          ?        ?      172.6        3.5       ?       ? 
1 1 1   32   27   13 o    285.0    2.4    0.0000   0.0000          ?        ?   812.1995  13.4090          ?        ?      285.0        2.4       ?       ? 
1 1 1   32   27   14 o    302.9    2.4    0.0000   0.0000          ?        ?   917.5555  14.6860          ?        ?      302.9        2.4       ?       ? 
1 1 1   32   27   15 o    490.3    2.6    0.0000   0.0000          ?        ?  2404.6724  25.5409          ?        ?      490.3        2.6       ?       ? 
1 1 1   32   27   16 o    328.4    2.5    0.0000   0.0000          ?        ?  1079.1016  16.6016          ?        ?      328.4        2.5       ?       ? 
1 1 1   32   27   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   27   18 o    159.0    3.4    0.0000   0.0000          ?        ?   252.8546  10.8549          ?        ?      159.0        3.4       ?       ? 
1 1 1   32   27   19 o    241.9    2.6    0.0000   0.0000          ?        ?   585.5243  12.7704          ?        ?      241.9        2.6       ?       ? 
1 1 1   32   27   20 o    358.0    2.4    0.0000   0.0000          ?        ?  1282.1515  17.2401          ?        ?      358.0        2.4       ?       ? 
1 1 1   32   27   21 o    190.9    3.2    0.0000   0.0000          ?        ?   364.5958  12.1319          ?        ?      190.9        3.2       ?       ? 
1 1 1   32   27   22 o    432.5    2.4    0.0000   0.0000          ?        ?  1871.5070  21.0712          ?        ?      432.5        2.4       ?       ? 
1 1 1   32   27   23 o    189.5    3.2    0.0000   0.0000          ?        ?   359.4877  12.1319          ?        ?      189.5        3.2       ?       ? 
1 1 1   32   27   24 o    309.5    2.5    0.0000   0.0000          ?        ?   958.4210  15.3245          ?        ?      309.5        2.5       ?       ? 
1 1 1   32   27   25 o    441.4    2.5    0.0000   0.0000          ?        ?  1949.4065  21.7097          ?        ?      441.4        2.5       ?       ? 
1 1 1   32   27   26 o    190.2    3.4    0.0000   0.0000          ?        ?   362.0418  12.7704          ?        ?      190.2        3.4       ?       ? 
1 1 1   32   27   27 o    298.5    2.6    0.0000   0.0000          ?        ?   891.3762  15.3245          ?        ?      298.5        2.6       ?       ? 
1 1 1   32   27   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   27   29 o    521.7    2.6    0.0000   0.0000          ?        ?  2722.6562  27.4564          ?        ?      521.7        2.6       ?       ? 
1 1 1   32   27   30 o    200.8    4.0    0.0000   0.0000          ?        ?   403.5457  15.9630          ?        ?      200.8        4.0       ?       ? 
1 1 1   32   27   31 o    159.1    4.4    0.0000   0.0000          ?        ?   253.4931  14.0475          ?        ?      159.1        4.4       ?       ? 
1 1 1   32   27   32 o    367.1    2.6    0.0000   0.0000          ?        ?  1347.9192  19.1556          ?        ?      367.1        2.6       ?       ? 
1 1 1   32   27   33 o    238.6    3.3    0.0000   0.0000          ?        ?   569.5613  15.9630          ?        ?      238.6        3.3       ?       ? 
1 1 1   32   27   34 f    240.8    3.2    0.0000   0.0000          ?        ?   580.4161  15.3245          ?        ?      240.8        3.2       ?       ? 
1 1 1   32   27   35 o    241.5    3.6    0.0000   0.0000          ?        ?   583.6088  17.2401          ?        ?      241.5        3.6       ?       ? 
1 1 1   32   27   36 o    499.0    2.6    0.0000   0.0000          ?        ?  2490.8728  26.1794          ?        ?      499.0        2.6       ?       ? 
1 1 1   32   27   37 o    253.8    3.3    0.0000   0.0000          ?        ?   644.9069  16.6016          ?        ?      253.8        3.3       ?       ? 
1 1 1   32   27   38 o    236.0    3.8    0.0000   0.0000          ?        ?   557.4294  17.8786          ?        ?      236.0        3.8       ?       ? 
1 1 1   32   27   39 o    301.1    3.2    0.0000   0.0000          ?        ?   907.3393  19.1556          ?        ?      301.1        3.2       ?       ? 
1 1 1   32   27   40 o     21.3   10.5    0.0000   0.0000          ?        ?   -34.4802  15.9630          ?        ?       21.3       10.5       ?       ? 
1 1 1   32   27   41 o    314.9    3.0    0.0000   0.0000          ?        ?   992.2626  19.1556          ?        ?      314.9        3.0       ?       ? 
1 1 1   32   27   42 o    289.4    3.3    0.0000   0.0000          ?        ?   838.3789  19.1556          ?        ?      289.4        3.3       ?       ? 
1 1 1   32   27   43 f    438.4    2.8    0.0000   0.0000          ?        ?  1923.8656  24.2638          ?        ?      438.4        2.8       ?       ? 
1 1 1   32   27   44 o    266.6    3.6    0.0000   0.0000          ?        ?   711.9516  19.1556          ?        ?      266.6        3.6       ?       ? 
1 1 1   32   27   45 o    136.0    6.3    0.0000   0.0000          ?        ?   185.8098  17.2401          ?        ?      136.0        6.3       ?       ? 
1 1 1   32   27   46 o    264.8    3.6    0.0000   0.0000          ?        ?   702.3738  19.1556          ?        ?      264.8        3.6       ?       ? 
1 1 1   32   27   47 o    169.6    5.3    0.0000   0.0000          ?        ?   288.6118  17.8786          ?        ?      169.6        5.3       ?       ? 
1 1 1   32   27   48 o    245.0    3.8    0.0000   0.0000          ?        ?   601.4874  18.5171          ?        ?      245.0        3.8       ?       ? 
1 1 1   32   27   49 o    251.2    3.7    0.0000   0.0000          ?        ?   632.1364  18.5171          ?        ?      251.2        3.7       ?       ? 
1 1 1   32   27   50 o     32.9   14.2    0.0000   0.0000          ?        ?    -1.2770  17.2401          ?        ?       32.9       14.2       ?       ? 
1 1 1   32   27   51 o     77.4   11.1    0.0000   0.0000          ?        ?    61.2981  17.2401          ?        ?       77.4       11.1       ?       ? 
1 1 1   32   27   52 o    153.2    5.8    0.0000   0.0000          ?        ?   236.2530  17.8786          ?        ?      153.2        5.8       ?       ? 
1 1 1   32   28    0 o    183.4    7.2  338.4165  26.1794   338.4165  26.1794   338.4165  26.1794      183.4      7.2      183.4        7.2     0.0     0.0 
1 1 1   32   28    1 o    394.7    3.5    0.0000   0.0000          ?        ?  1558.6313  27.4564          ?        ?      394.7        3.5       ?       ? 
1 1 1   32   28    2 o    201.3    4.8    0.0000   0.0000          ?        ?   405.4612  19.1556          ?        ?      201.3        4.8       ?       ? 
1 1 1   32   28    3 o    268.8    3.9    0.0000   0.0000          ?        ?   722.8065  21.0712          ?        ?      268.8        3.9       ?       ? 
1 1 1   32   28    4 o    166.0    6.0    0.0000   0.0000          ?        ?   275.8413  19.7942          ?        ?      166.0        6.0       ?       ? 
1 1 1   32   28    5 o    435.5    3.2    0.0000   0.0000          ?        ?  1897.6864  27.4564          ?        ?      435.5        3.2       ?       ? 
1 1 1   32   28    6 o    338.5    3.7    0.0000   0.0000          ?        ?  1146.1464  24.9023          ?        ?      338.5        3.7       ?       ? 
1 1 1   32   28    7 o    399.0    3.7    0.0000   0.0000          ?        ?  1593.1115  29.3720          ?        ?      399.0        3.7       ?       ? 
1 1 1   32   28    8 o    433.2    3.5    0.0000   0.0000          ?        ?  1877.2535  30.6490          ?        ?      433.2        3.5       ?       ? 
1 1 1   32   28    9 o    252.6    3.0    0.0000   0.0000          ?        ?   638.5216  15.3245          ?        ?      252.6        3.0       ?       ? 
1 1 1   32   28   10 o     24.4   11.4    0.0000   0.0000          ?        ?   -12.1319  13.4090          ?        ?       24.4       11.4       ?       ? 
1 1 1   32   28   11 o    205.2    3.3    0.0000   0.0000          ?        ?   421.4243  13.4090          ?        ?      205.2        3.3       ?       ? 
1 1 1   32   28   12 o    287.5    3.1    0.0000   0.0000          ?        ?   826.8855  17.8786          ?        ?      287.5        3.1       ?       ? 
1 1 1   32   28   13 o    361.1    2.7    0.0000   0.0000          ?        ?  1304.4998  19.7942          ?        ?      361.1        2.7       ?       ? 
1 1 1   32   28   14 f    115.2    3.9    0.0000   0.0000          ?        ?   132.8125   8.9393          ?        ?      115.2        3.9       ?       ? 
1 1 1   32   28   15 o    168.0    3.2    0.0000   0.0000          ?        ?   282.2266  10.8549          ?        ?      168.0        3.2       ?       ? 
1 1 1   32   28   16 o    602.5    2.9    0.0000   0.0000          ?        ?  3631.2725  34.4802          ?        ?      602.5        2.9       ?       ? 
1 1 1   32   28   17 o    133.4    3.1    0.0000   0.0000          ?        ?   178.1475   8.3008          ?        ?      133.4        3.1       ?       ? 
1 1 1   32   28   18 o    287.3    2.3    0.0000   0.0000          ?        ?   825.6085  13.4090          ?        ?      287.3        2.3       ?       ? 
1 1 1   32   28   19 o    124.8    4.1    0.0000   0.0000          ?        ?   155.7993  10.2163          ?        ?      124.8        4.1       ?       ? 
1 1 1   32   28   20 o    118.4    4.9    0.0000   0.0000          ?        ?   140.4748  11.4934          ?        ?      118.4        4.9       ?       ? 
1 1 1   32   28   21 o    244.8    2.7    0.0000   0.0000          ?        ?   599.5718  13.4090          ?        ?      244.8        2.7       ?       ? 
1 1 1   32   28   22 o    234.6    2.9    0.0000   0.0000          ?        ?   550.4056  13.4090          ?        ?      234.6        2.9       ?       ? 
1 1 1   32   28   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   28   24 o    166.8    3.6    0.0000   0.0000          ?        ?   278.3954  12.1319          ?        ?      166.8        3.6       ?       ? 
1 1 1   32   28   25 o     98.1    6.2    0.0000   0.0000          ?        ?    96.4168  12.1319          ?        ?       98.1        6.2       ?       ? 
1 1 1   32   28   26 o    242.6    2.9    0.0000   0.0000          ?        ?   588.7169  14.0475          ?        ?      242.6        2.9       ?       ? 
1 1 1   32   28   27 o     61.7   11.3    0.0000   0.0000          ?        ?    39.5883  13.4090          ?        ?       61.7       11.3       ?       ? 
1 1 1   32   28   28 f    225.1    3.3    0.0000   0.0000          ?        ?   506.9862  14.6860          ?        ?      225.1        3.3       ?       ? 
1 1 1   32   28   29 o     63.7   11.4    0.0000   0.0000          ?        ?    42.1424  14.0475          ?        ?       63.7       11.4       ?       ? 
1 1 1   32   28   30 o    234.0    3.4    0.0000   0.0000          ?        ?   547.8516  15.9630          ?        ?      234.0        3.4       ?       ? 
1 1 1   32   28   31 o    268.5    3.1    0.0000   0.0000          ?        ?   721.5294  16.6016          ?        ?      268.5        3.1       ?       ? 
1 1 1   32   28   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   28   33 o     21.2   10.4    0.0000   0.0000          ?        ?   -28.0950  14.6860          ?        ?       21.2       10.4       ?       ? 
1 1 1   32   28   34 o    399.0    2.6    0.0000   0.0000          ?        ?  1593.1115  20.4327          ?        ?      399.0        2.6       ?       ? 
1 1 1   32   28   35 o    210.1    4.0    0.0000   0.0000          ?        ?   441.8569  16.6016          ?        ?      210.1        4.0       ?       ? 
1 1 1   32   28   36 o    231.1    3.6    0.0000   0.0000          ?        ?   534.4426  16.6016          ?        ?      231.1        3.6       ?       ? 
1 1 1   32   28   37 o    199.9    4.3    0.0000   0.0000          ?        ?   400.3531  17.2401          ?        ?      199.9        4.3       ?       ? 
1 1 1   32   28   38 o    116.9    7.1    0.0000   0.0000          ?        ?   137.2822  16.6016          ?        ?      116.9        7.1       ?       ? 
1 1 1   32   28   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   28   40 o    431.9    2.7    0.0000   0.0000          ?        ?  1866.3987  22.9868          ?        ?      431.9        2.7       ?       ? 
1 1 1   32   28   41 o     93.5    8.9    0.0000   0.0000          ?        ?    88.1160  16.6016          ?        ?       93.5        8.9       ?       ? 
1 1 1   32   28   42 o    310.8    3.1    0.0000   0.0000          ?        ?   966.7217  19.1556          ?        ?      310.8        3.1       ?       ? 
1 1 1   32   28   43 o    113.8    7.3    0.0000   0.0000          ?        ?   130.2584  16.6016          ?        ?      113.8        7.3       ?       ? 
1 1 1   32   28   44 o    260.5    3.4    0.0000   0.0000          ?        ?   679.3870  17.8786          ?        ?      260.5        3.4       ?       ? 
1 1 1   32   28   45 o    331.5    3.2    0.0000   0.0000          ?        ?  1100.1727  21.0712          ?        ?      331.5        3.2       ?       ? 
1 1 1   32   28   46 o     30.9   13.9    0.0000   0.0000          ?        ?    -7.6623  17.8786          ?        ?       30.9       13.9       ?       ? 
1 1 1   32   28   47 f    264.3    3.5    0.0000   0.0000          ?        ?   699.8197  18.5171          ?        ?      264.3        3.5       ?       ? 
1 1 1   32   28   48 o    103.3    8.3    0.0000   0.0000          ?        ?   107.9102  17.2401          ?        ?      103.3        8.3       ?       ? 
1 1 1   32   28   49 o     19.0    9.6    0.0000   0.0000          ?        ?   -55.5514  17.2401          ?        ?       19.0        9.6       ?       ? 
1 1 1   32   28   50 o    306.8    3.3    0.0000   0.0000          ?        ?   943.0964  20.4327          ?        ?      306.8        3.3       ?       ? 
1 1 1   32   28   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   29    0 o     96.0   14.7   97.0553  26.8179    97.0553  26.8179    97.0553  26.8179       96.0     14.7       96.0       14.7     0.0     0.0 
1 1 1   32   29    1 o    182.8    5.8    0.0000   0.0000          ?        ?   334.5853  21.0712          ?        ?      182.8        5.8       ?       ? 
1 1 1   32   29    2 o    339.0    3.5    0.0000   0.0000          ?        ?  1149.9775  23.6253          ?        ?      339.0        3.5       ?       ? 
1 1 1   32   29    3 o     39.8   16.1    0.0000   0.0000          ?        ?     7.0237  19.7942          ?        ?       39.8       16.1       ?       ? 
1 1 1   32   29    4 f     71.7   14.3    0.0000   0.0000          ?        ?    53.6358  19.7942          ?        ?       71.7       14.3       ?       ? 
1 1 1   32   29    5 o     24.2   11.9    0.0000   0.0000          ?        ?   -43.4195  20.4327          ?        ?       24.2       11.9       ?       ? 
1 1 1   32   29    6 o    385.2    3.7    0.0000   0.0000          ?        ?  1484.5627  28.7335          ?        ?      385.2        3.7       ?       ? 
1 1 1   32   29    7 f    192.0    5.7    0.0000   0.0000          ?        ?   369.0655  21.7097          ?        ?      192.0        5.7       ?       ? 
1 1 1   32   29    8 o     26.1   12.7    0.0000   0.0000          ?        ?   -40.2269  21.7097          ?        ?       26.1       12.7       ?       ? 
1 1 1   32   29    9 o    162.9    4.3    0.0000   0.0000          ?        ?   265.6250  14.0475          ?        ?      162.9        4.3       ?       ? 
1 1 1   32   29   10 o    549.9    3.4    0.0000   0.0000          ?        ?  3025.3154  37.6728          ?        ?      549.9        3.4       ?       ? 
1 1 1   32   29   11 o    194.0    3.3    0.0000   0.0000          ?        ?   376.7278  12.7704          ?        ?      194.0        3.3       ?       ? 
1 1 1   32   29   12 o    216.1    3.0    0.0000   0.0000          ?        ?   467.3978  12.7704          ?        ?      216.1        3.0       ?       ? 
1 1 1   32   29   13 o    458.1    2.8    0.0000   0.0000          ?        ?  2099.4590  25.5409          ?        ?      458.1        2.8       ?       ? 
1 1 1   32   29   14 o    338.0    2.8    0.0000   0.0000          ?        ?  1142.9537  19.1556          ?        ?      338.0        2.8       ?       ? 
1 1 1   32   29   15 o    267.0    2.5    0.0000   0.0000          ?        ?   713.2286  13.4090          ?        ?      267.0        2.5       ?       ? 
1 1 1   32   29   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   29   17 o    421.2    2.4    0.0000   0.0000          ?        ?  1774.4515  20.4327          ?        ?      421.2        2.4       ?       ? 
1 1 1   32   29   18 o     26.7   11.0    0.0000   0.0000          ?        ?     1.9156   9.5778          ?        ?       26.7       11.0       ?       ? 
1 1 1   32   29   19 o    156.9    3.5    0.0000   0.0000          ?        ?   246.4693  10.8549          ?        ?      156.9        3.5       ?       ? 
1 1 1   32   29   20 o    127.5    4.3    0.0000   0.0000          ?        ?   162.8230  10.8549          ?        ?      127.5        4.3       ?       ? 
1 1 1   32   29   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   29   22 o    192.5    3.3    0.0000   0.0000          ?        ?   370.9810  12.7704          ?        ?      192.5        3.3       ?       ? 
1 1 1   32   29   23 f     25.3   11.2    0.0000   0.0000          ?        ?    -4.4697  11.4934          ?        ?       25.3       11.2       ?       ? 
1 1 1   32   29   24 o    554.0    2.5    0.0000   0.0000          ?        ?  3070.0120  28.0950          ?        ?      554.0        2.5       ?       ? 
1 1 1   32   29   25 f     56.0   10.7    0.0000   0.0000          ?        ?    32.5646  11.4934          ?        ?       56.0       10.7       ?       ? 
1 1 1   32   29   26 o    273.1    2.7    0.0000   0.0000          ?        ?   746.4318  14.6860          ?        ?      273.1        2.7       ?       ? 
1 1 1   32   29   27 o    171.3    3.9    0.0000   0.0000          ?        ?   293.7199  13.4090          ?        ?      171.3        3.9       ?       ? 
1 1 1   32   29   28 o    687.2    2.9    0.0000   0.0000          ?        ?  4724.4219  39.5883          ?        ?      687.2        2.9       ?       ? 
1 1 1   32   29   29 o    307.9    2.8    0.0000   0.0000          ?        ?   948.8432  17.2401          ?        ?      307.9        2.8       ?       ? 
1 1 1   32   29   30 o    134.5    5.5    0.0000   0.0000          ?        ?   181.3401  14.6860          ?        ?      134.5        5.5       ?       ? 
1 1 1   32   29   31 o    261.5    2.9    0.0000   0.0000          ?        ?   684.4952  15.3245          ?        ?      261.5        2.9       ?       ? 
1 1 1   32   29   32 o    202.4    3.8    0.0000   0.0000          ?        ?   409.9309  15.3245          ?        ?      202.4        3.8       ?       ? 
1 1 1   32   29   33 o    393.8    2.6    0.0000   0.0000          ?        ?  1551.6075  20.4327          ?        ?      393.8        2.6       ?       ? 
1 1 1   32   29   34 o    124.1    6.2    0.0000   0.0000          ?        ?   154.5222  15.3245          ?        ?      124.1        6.2       ?       ? 
1 1 1   32   29   35 o    273.7    3.1    0.0000   0.0000          ?        ?   749.6244  17.2401          ?        ?      273.7        3.1       ?       ? 
1 1 1   32   29   36 o    275.5    3.2    0.0000   0.0000          ?        ?   759.8408  17.8786          ?        ?      275.5        3.2       ?       ? 
1 1 1   32   29   37 o     35.5   14.6    0.0000   0.0000          ?        ?     4.4697  16.6016          ?        ?       35.5       14.6       ?       ? 
1 1 1   32   29   38 f    319.8    3.0    0.0000   0.0000          ?        ?  1023.5502  19.1556          ?        ?      319.8        3.0       ?       ? 
1 1 1   32   29   39 o    409.3    2.8    0.0000   0.0000          ?        ?  1676.7578  22.9868          ?        ?      409.3        2.8       ?       ? 
1 1 1   32   29   40 o    177.0    4.7    0.0000   0.0000          ?        ?   314.1526  16.6016          ?        ?      177.0        4.7       ?       ? 
1 1 1   32   29   41 o     30.5   13.5    0.0000   0.0000          ?        ?    -5.7467  16.6016          ?        ?       30.5       13.5       ?       ? 
1 1 1   32   29   42 o     30.5   13.5    0.0000   0.0000          ?        ?    -5.7467  16.6016          ?        ?       30.5       13.5       ?       ? 
1 1 1   32   29   43 o    256.0    3.7    0.0000   0.0000          ?        ?   656.4003  19.1556          ?        ?      256.0        3.7       ?       ? 
1 1 1   32   29   44 o    208.4    4.4    0.0000   0.0000          ?        ?   435.4717  18.5171          ?        ?      208.4        4.4       ?       ? 
1 1 1   32   29   45 o    321.7    3.2    0.0000   0.0000          ?        ?  1036.3207  20.4327          ?        ?      321.7        3.2       ?       ? 
1 1 1   32   29   46 o     73.3   11.8    0.0000   0.0000          ?        ?    54.9129  17.2401          ?        ?       73.3       11.8       ?       ? 
1 1 1   32   29   47 o     71.9   12.0    0.0000   0.0000          ?        ?    52.9973  17.2401          ?        ?       71.9       12.0       ?       ? 
1 1 1   32   29   48 o    134.1    6.7    0.0000   0.0000          ?        ?   181.3401  17.8786          ?        ?      134.1        6.7       ?       ? 
1 1 1   32   29   49 o    347.1    3.0    0.0000   0.0000          ?        ?  1206.8059  21.0712          ?        ?      347.1        3.0       ?       ? 
1 1 1   32   29   50 o     44.7   15.6    0.0000   0.0000          ?        ?    19.1556  17.2401          ?        ?       44.7       15.6       ?       ? 
1 1 1   32   30    0 o     54.0   24.4   42.7809  28.0950    42.7809  28.0950    42.7809  28.0950       54.0     24.4       54.0       24.4     0.0     0.0 
1 1 1   32   30    1 o    242.0    5.0    0.0000   0.0000          ?        ?   586.1629  24.2638          ?        ?      242.0        5.0       ?       ? 
1 1 1   32   30    2 o    203.5    6.3    0.0000   0.0000          ?        ?   415.0391  25.5409          ?        ?      203.5        6.3       ?       ? 
1 1 1   32   30    3 o    574.1    4.2    0.0000   0.0000          ?        ?  3299.2412  47.8891          ?        ?      574.1        4.2       ?       ? 
1 1 1   32   30    4 o    326.9    3.8    0.0000   0.0000          ?        ?  1069.5237  24.9023          ?        ?      326.9        3.8       ?       ? 
1 1 1   32   30    5 o    143.9    7.3    0.0000   0.0000          ?        ?   207.5195  21.0712          ?        ?      143.9        7.3       ?       ? 
1 1 1   32   30    6 o    361.6    3.6    0.0000   0.0000          ?        ?  1308.3308  26.1794          ?        ?      361.6        3.6       ?       ? 
1 1 1   32   30    7 o    274.1    4.3    0.0000   0.0000          ?        ?   752.1785  23.6253          ?        ?      274.1        4.3       ?       ? 
1 1 1   32   30    8 o    314.0    4.4    0.0000   0.0000          ?        ?   987.1545  27.4564          ?        ?      314.0        4.4       ?       ? 
1 1 1   32   30    9 o    322.5    4.6    0.0000   0.0000          ?        ?  1041.4288  29.3720          ?        ?      322.5        4.6       ?       ? 
1 1 1   32   30   10 o    553.6    3.8    0.0000   0.0000          ?        ?  3066.8193  42.1424          ?        ?      553.6        3.8       ?       ? 
1 1 1   32   30   11 o    366.5    2.9    0.0000   0.0000          ?        ?  1344.0880  21.0712          ?        ?      366.5        2.9       ?       ? 
1 1 1   32   30   12 o    355.3    2.7    0.0000   0.0000          ?        ?  1262.9958  19.1556          ?        ?      355.3        2.7       ?       ? 
1 1 1   32   30   13 f    136.0    4.5    0.0000   0.0000          ?        ?   185.1713  12.1319          ?        ?      136.0        4.5       ?       ? 
1 1 1   32   30   14 o     52.9   11.8    0.0000   0.0000          ?        ?    29.3720  12.1319          ?        ?       52.9       11.8       ?       ? 
1 1 1   32   30   15 o    207.5    3.4    0.0000   0.0000          ?        ?   431.0021  14.0475          ?        ?      207.5        3.4       ?       ? 
1 1 1   32   30   16 o    404.6    2.8    0.0000   0.0000          ?        ?  1637.8080  22.3483          ?        ?      404.6        2.8       ?       ? 
1 1 1   32   30   17 o    551.6    3.2    0.0000   0.0000          ?        ?  3044.4709  35.1187          ?        ?      551.6        3.2       ?       ? 
1 1 1   32   30   18 o    234.2    2.5    0.0000   0.0000          ?        ?   548.4901  11.4934          ?        ?      234.2        2.5       ?       ? 
1 1 1   32   30   19 o    337.2    2.4    0.0000   0.0000          ?        ?  1137.2070  15.9630          ?        ?      337.2        2.4       ?       ? 
1 1 1   32   30   20 o    324.7    2.4    0.0000   0.0000          ?        ?  1054.8376  15.3245          ?        ?      324.7        2.4       ?       ? 
1 1 1   32   30   21 o    399.6    2.5    0.0000   0.0000          ?        ?  1597.5811  19.7942          ?        ?      399.6        2.5       ?       ? 
1 1 1   32   30   22 o    166.8    3.6    0.0000   0.0000          ?        ?   278.3954  12.1319          ?        ?      166.8        3.6       ?       ? 
1 1 1   32   30   23 o    362.7    2.4    0.0000   0.0000          ?        ?  1315.9932  17.2401          ?        ?      362.7        2.4       ?       ? 
1 1 1   32   30   24 f    221.2    2.9    0.0000   0.0000          ?        ?   489.7461  12.7704          ?        ?      221.2        2.9       ?       ? 
1 1 1   32   30   25 o    136.5    4.2    0.0000   0.0000          ?        ?   186.4483  11.4934          ?        ?      136.5        4.2       ?       ? 
1 1 1   32   30   26 o    212.2    3.3    0.0000   0.0000          ?        ?   450.7963  14.0475          ?        ?      212.2        3.3       ?       ? 
1 1 1   32   30   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   30   28 o    273.2    2.9    0.0000   0.0000          ?        ?   747.0703  15.9630          ?        ?      273.2        2.9       ?       ? 
1 1 1   32   30   29 o    285.3    2.9    0.0000   0.0000          ?        ?   814.7536  16.6016          ?        ?      285.3        2.9       ?       ? 
1 1 1   32   30   30 o    128.2    5.7    0.0000   0.0000          ?        ?   164.7386  14.6860          ?        ?      128.2        5.7       ?       ? 
1 1 1   32   30   31 o    145.5    5.0    0.0000   0.0000          ?        ?   211.9892  14.6860          ?        ?      145.5        5.0       ?       ? 
1 1 1   32   30   32 o    171.3    4.3    0.0000   0.0000          ?        ?   293.7199  14.6860          ?        ?      171.3        4.3       ?       ? 
1 1 1   32   30   33 o    331.7    2.9    0.0000   0.0000          ?        ?  1100.8113  19.1556          ?        ?      331.7        2.9       ?       ? 
1 1 1   32   30   34 o    198.4    3.9    0.0000   0.0000          ?        ?   393.9678  15.3245          ?        ?      198.4        3.9       ?       ? 
1 1 1   32   30   35 o     97.3    7.9    0.0000   0.0000          ?        ?    95.1397  15.3245          ?        ?       97.3        7.9       ?       ? 
1 1 1   32   30   36 o    180.6    4.6    0.0000   0.0000          ?        ?   326.9231  16.6016          ?        ?      180.6        4.6       ?       ? 
1 1 1   32   30   37 o     65.1   13.2    0.0000   0.0000          ?        ?    44.6965  16.6016          ?        ?       65.1       13.2       ?       ? 
1 1 1   32   30   38 o    135.8    5.9    0.0000   0.0000          ?        ?   185.1713  15.9630          ?        ?      135.8        5.9       ?       ? 
1 1 1   32   30   39 o     86.3   10.0    0.0000   0.0000          ?        ?    75.3456  17.2401          ?        ?       86.3       10.0       ?       ? 
1 1 1   32   30   40 o    145.7    6.1    0.0000   0.0000          ?        ?   213.2662  17.8786          ?        ?      145.7        6.1       ?       ? 
1 1 1   32   30   41 o     93.8    8.5    0.0000   0.0000          ?        ?    88.7545  15.9630          ?        ?       93.8        8.5       ?       ? 
1 1 1   32   30   42 o    157.1    5.5    0.0000   0.0000          ?        ?   247.7464  17.2401          ?        ?      157.1        5.5       ?       ? 
1 1 1   32   30   43 o    290.0    3.3    0.0000   0.0000          ?        ?   842.2100  19.1556          ?        ?      290.0        3.3       ?       ? 
1 1 1   32   30   44 o     86.6    9.2    0.0000   0.0000          ?        ?    75.9841  15.9630          ?        ?       86.6        9.2       ?       ? 
1 1 1   32   30   45 f    190.3    4.7    0.0000   0.0000          ?        ?   363.3188  17.8786          ?        ?      190.3        4.7       ?       ? 
1 1 1   32   30   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   30   47 o     29.2   13.2    0.0000   0.0000          ?        ?    -8.3008  16.6016          ?        ?       29.2       13.2       ?       ? 
1 1 1   32   30   48 o    117.1    7.4    0.0000   0.0000          ?        ?   138.5592  17.2401          ?        ?      117.1        7.4       ?       ? 
1 1 1   32   31    0 o    254.9    6.9  651.9305  35.1187   651.9305  35.1187   651.9305  35.1187      254.9      6.9      254.9        6.9     0.0     0.0 
1 1 1   32   31    1 o    625.3    3.8    0.0000   0.0000          ?        ?  3913.4993  47.8891          ?        ?      625.3        3.8       ?       ? 
1 1 1   32   31    2 o    409.0    3.7    0.0000   0.0000          ?        ?  1674.2037  30.6490          ?        ?      409.0        3.7       ?       ? 
1 1 1   32   31    3 o    250.1    5.0    0.0000   0.0000          ?        ?   626.3897  24.9023          ?        ?      250.1        5.0       ?       ? 
1 1 1   32   31    4 o    567.1    4.8    0.0000   0.0000          ?        ?  3220.7031  54.2743          ?        ?      567.1        4.8       ?       ? 
1 1 1   32   31    5 o    648.4    5.3    0.0000   0.0000          ?        ?  4211.0503  68.3218          ?        ?      648.4        5.3       ?       ? 
1 1 1   32   31    6 o    425.1    4.1    0.0000   0.0000          ?        ?  1808.9316  35.1187          ?        ?      425.1        4.1       ?       ? 
1 1 1   32   31    7 o    482.5    4.1    0.0000   0.0000          ?        ?  2329.9653  39.5883          ?        ?      482.5        4.1       ?       ? 
1 1 1   32   31    8 o    280.1    5.7    0.0000   0.0000          ?        ?   786.0201  31.9261          ?        ?      280.1        5.7       ?       ? 
1 1 1   32   31    9 f    278.9    6.1    0.0000   0.0000          ?        ?   779.6349  33.8416          ?        ?      278.9        6.1       ?       ? 
1 1 1   32   31   10 o    239.4    8.8    0.0000   0.0000          ?        ?   575.9465  42.1424          ?        ?      239.4        8.8       ?       ? 
1 1 1   32   31   11 o    183.7    4.7    0.0000   0.0000          ?        ?   337.7780  17.2401          ?        ?      183.7        4.7       ?       ? 
1 1 1   32   31   12 o    263.8    2.8    0.0000   0.0000          ?        ?   695.9886  14.6860          ?        ?      263.8        2.8       ?       ? 
1 1 1   32   31   13 o    312.7    3.0    0.0000   0.0000          ?        ?   978.2151  18.5171          ?        ?      312.7        3.0       ?       ? 
1 1 1   32   31   14 o     15.5    7.8    0.0000   0.0000          ?        ?   -42.7809  12.1319          ?        ?       15.5        7.8       ?       ? 
1 1 1   32   31   15 o    117.3    5.4    0.0000   0.0000          ?        ?   137.9207  12.7704          ?        ?      117.3        5.4       ?       ? 
1 1 1   32   31   16 o    190.7    3.9    0.0000   0.0000          ?        ?   363.9573  14.6860          ?        ?      190.7        3.9       ?       ? 
1 1 1   32   31   17 o    105.0    4.6    0.0000   0.0000          ?        ?   110.4642   9.5778          ?        ?      105.0        4.6       ?       ? 
1 1 1   32   31   18 o    421.2    2.4    0.0000   0.0000          ?        ?  1774.4515  20.4327          ?        ?      421.2        2.4       ?       ? 
1 1 1   32   31   19 o    267.9    2.4    0.0000   0.0000          ?        ?   717.6983  12.7704          ?        ?      267.9        2.4       ?       ? 
1 1 1   32   31   20 o    193.7    3.0    0.0000   0.0000          ?        ?   375.4507  11.4934          ?        ?      193.7        3.0       ?       ? 
1 1 1   32   31   21 o    252.0    2.7    0.0000   0.0000          ?        ?   635.3290  13.4090          ?        ?      252.0        2.7       ?       ? 
1 1 1   32   31   22 o    202.4    3.2    0.0000   0.0000          ?        ?   409.9309  12.7704          ?        ?      202.4        3.2       ?       ? 
1 1 1   32   31   23 o    261.3    2.6    0.0000   0.0000          ?        ?   683.2181  13.4090          ?        ?      261.3        2.6       ?       ? 
1 1 1   32   31   24 o     66.7    8.6    0.0000   0.0000          ?        ?    44.6965  11.4934          ?        ?       66.7        8.6       ?       ? 
1 1 1   32   31   25 o    182.5    3.5    0.0000   0.0000          ?        ?   333.3083  12.7704          ?        ?      182.5        3.5       ?       ? 
1 1 1   32   31   26 o    206.9    3.4    0.0000   0.0000          ?        ?   428.4480  14.0475          ?        ?      206.9        3.4       ?       ? 
1 1 1   32   31   27 o     18.9    9.4    0.0000   0.0000          ?        ?   -35.7572  14.0475          ?        ?       18.9        9.4       ?       ? 
1 1 1   32   31   28 o     99.0    6.8    0.0000   0.0000          ?        ?    98.3323  13.4090          ?        ?       99.0        6.8       ?       ? 
1 1 1   32   31   29 o    352.8    2.7    0.0000   0.0000          ?        ?  1245.1172  19.1556          ?        ?      352.8        2.7       ?       ? 
1 1 1   32   31   30 o    300.5    2.9    0.0000   0.0000          ?        ?   903.5081  17.2401          ?        ?      300.5        2.9       ?       ? 
1 1 1   32   31   31 o    322.9    2.7    0.0000   0.0000          ?        ?  1043.3442  17.2401          ?        ?      322.9        2.7       ?       ? 
1 1 1   32   31   32 o     64.4   12.3    0.0000   0.0000          ?        ?    43.4195  15.3245          ?        ?       64.4       12.3       ?       ? 
1 1 1   32   31   33 o    366.6    2.7    0.0000   0.0000          ?        ?  1344.7266  19.7942          ?        ?      366.6        2.7       ?       ? 
1 1 1   32   31   34 o    307.9    2.9    0.0000   0.0000          ?        ?   948.8432  17.8786          ?        ?      307.9        2.9       ?       ? 
1 1 1   32   31   35 o    129.6    5.7    0.0000   0.0000          ?        ?   168.5697  14.6860          ?        ?      129.6        5.7       ?       ? 
1 1 1   32   31   36 o     24.1   11.5    0.0000   0.0000          ?        ?   -19.7942  15.3245          ?        ?       24.1       11.5       ?       ? 
1 1 1   32   31   37 o    140.8    6.1    0.0000   0.0000          ?        ?   199.2188  17.2401          ?        ?      140.8        6.1       ?       ? 
1 1 1   32   31   38 o    293.4    3.0    0.0000   0.0000          ?        ?   862.0042  17.8786          ?        ?      293.4        3.0       ?       ? 
1 1 1   32   31   39 o    118.7    7.0    0.0000   0.0000          ?        ?   141.7518  16.6016          ?        ?      118.7        7.0       ?       ? 
1 1 1   32   31   40 o     18.5    9.3    0.0000   0.0000          ?        ?   -50.4432  15.9630          ?        ?       18.5        9.3       ?       ? 
1 1 1   32   31   41 o     53.1   14.6    0.0000   0.0000          ?        ?    30.0105  15.9630          ?        ?       53.1       14.6       ?       ? 
1 1 1   32   31   42 o    253.2    3.5    0.0000   0.0000          ?        ?   642.3527  17.8786          ?        ?      253.2        3.5       ?       ? 
1 1 1   32   31   43 o    314.8    3.1    0.0000   0.0000          ?        ?   992.2626  19.7942          ?        ?      314.8        3.1       ?       ? 
1 1 1   32   31   44 o     36.3   14.7    0.0000   0.0000          ?        ?     6.3852  16.6016          ?        ?       36.3       14.7       ?       ? 
1 1 1   32   31   45 o    139.1    6.2    0.0000   0.0000          ?        ?   194.7491  17.2401          ?        ?      139.1        6.2       ?       ? 
1 1 1   32   31   46 o     74.4   11.6    0.0000   0.0000          ?        ?    56.8284  17.2401          ?        ?       74.4       11.6       ?       ? 
1 1 1   32   31   47 o     61.1   13.9    0.0000   0.0000          ?        ?    40.2269  16.6016          ?        ?       61.1       13.9       ?       ? 
1 1 1   32   32    0 o    683.9    8.5 4684.1943 116.8494  4684.1943 116.8494  4684.1943 116.8494      683.9      8.5      683.9        8.5     0.0     0.0 
1 1 1   32   32    1 o    311.7    6.0  973.7455  37.6728   973.7455  37.6728   973.7455  37.6728      311.7      6.0      311.7        6.0     0.0     0.0 
1 1 1   32   32    2 o    348.3    6.6 1215.7451  45.9736  1215.7451  45.9736  1215.7451  45.9736      348.3      6.6      348.3        6.6     0.0     0.0 
1 1 1   32   32    3 o     21.6   15.7  -61.9366  34.4802   -61.9366  34.4802   -61.9366  34.4802       21.6     15.7       21.6       15.7     0.0     0.0 
1 1 1   32   32    4 o    141.3   10.7  203.6884  30.0105   203.6884  30.0105   203.6884  30.0105      141.3     10.7      141.3       10.7     0.0     0.0 
1 1 1   32   32    5 o    579.1    6.1 3358.6238  70.8759  3358.6238  70.8759  3358.6238  70.8759      579.1      6.1      579.1        6.1     0.0     0.0 
1 1 1   32   32    6 o    143.6   12.6  211.9892  35.7572   211.9892  35.7572   211.9892  35.7572      143.6     12.6      143.6       12.6     0.0     0.0 
1 1 1   32   32    7 o    235.9    8.7  559.9835  40.8654   559.9835  40.8654   559.9835  40.8654      235.9      8.7      235.9        8.7     0.0     0.0 
1 1 1   32   32    8 o    681.9    6.3 4656.7383  85.5619  4656.7383  85.5619  4656.7383  85.5619      681.9      6.3      681.9        6.3     0.0     0.0 
1 1 1   32   32    9 o    230.0    8.9  532.5270  40.8654   532.5270  40.8654   532.5270  40.8654      230.0      8.9      230.0        8.9     0.0     0.0 
1 1 1   32   32   10 o    479.4    6.5 2302.5090  62.5751  2302.5090  62.5751  2302.5090  62.5751      479.4      6.5      479.4        6.5     0.0     0.0 
1 1 1   32   32   11 o     33.9   22.4   -4.4697  37.6728    -4.4697  37.6728    -4.4697  37.6728       33.9     22.4       33.9       22.4     0.0     0.0 
1 1 1   32   32   12 o     47.8   15.8   29.3720  13.4090    29.3720  13.4090    29.3720  13.4090       47.8     15.8       47.8       15.8     0.0     0.0 
1 1 1   32   32   13 o    221.2    4.8  490.3846  21.0712   490.3846  21.0712   490.3846  21.0712      221.2      4.8      221.2        4.8     0.0     0.0 
1 1 1   32   32   14 o    142.6    6.5  204.9654  18.5171   204.9654  18.5171   204.9654  18.5171      142.6      6.5      142.6        6.5     0.0     0.0 
1 1 1   32   32   15 o    422.7    3.8 1787.8606  31.9261  1787.8606  31.9261  1787.8606  31.9261      422.7      3.8      422.7        3.8     0.0     0.0 
1 1 1   32   32   16 o    117.3    8.0  139.8362  18.5171   139.8362  18.5171   139.8362  18.5171      117.3      8.0      117.3        8.0     0.0     0.0 
1 1 1   32   32   17 o    257.7    5.1  665.3395  26.1794   665.3395  26.1794   665.3395  26.1794      257.7      5.1      257.7        5.1     0.0     0.0 
1 1 1   32   32   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   32   32   19 o     34.1   16.4   17.2401  12.7704    17.2401  12.7704    17.2401  12.7704       34.1     16.4       34.1       16.4     0.0     0.0 
1 1 1   32   32   20 o    103.4    7.2  108.5487  14.6860   108.5487  14.6860   108.5487  14.6860      103.4      7.2      103.4        7.2     0.0     0.0 
1 1 1   32   32   21 o    262.7    3.6  690.8804  19.1556   690.8804  19.1556   690.8804  19.1556      262.7      3.6      262.7        3.6     0.0     0.0 
1 1 1   32   32   22 o     37.0   18.2   20.4327  15.9630    20.4327  15.9630    20.4327  15.9630       37.0     18.2       37.0       18.2     0.0     0.0 
1 1 1   32   32   23 o     13.1    9.6  -36.3957  15.3245   -36.3957  15.3245   -36.3957  15.3245       13.1      9.6       13.1        9.6     0.0     0.0 
1 1 1   32   32   24 o    326.7    3.4 1068.2467  22.3483  1068.2467  22.3483  1068.2467  22.3483      326.7      3.4      326.7        3.4     0.0     0.0 
1 1 1   32   32   25 o    203.0    4.7  413.1235  19.1556   413.1235  19.1556   413.1235  19.1556      203.0      4.7      203.0        4.7     0.0     0.0 
1 1 1   32   32   26 o    142.8    6.7  205.6040  19.1556   205.6040  19.1556   205.6040  19.1556      142.8      6.7      142.8        6.7     0.0     0.0 
1 1 1   32   32   27 o     98.1    8.9   98.9709  17.2401    98.9709  17.2401    98.9709  17.2401       98.1      8.9       98.1        8.9     0.0     0.0 
1 1 1   32   32   28 o    295.2    3.9  872.2206  22.9868   872.2206  22.9868   872.2206  22.9868      295.2      3.9      295.2        3.9     0.0     0.0 
1 1 1   32   32   29 o    340.8    3.7 1162.7479  25.5409  1162.7479  25.5409  1162.7479  25.5409      340.8      3.7      340.8        3.7     0.0     0.0 
1 1 1   32   32   30 o    146.3    7.7  216.4588  22.3483   216.4588  22.3483   216.4588  22.3483      146.3      7.7      146.3        7.7     0.0     0.0 
1 1 1   32   32   31 o    260.7    4.4  680.6641  22.9868   680.6641  22.9868   680.6641  22.9868      260.7      4.4      260.7        4.4     0.0     0.0 
1 1 1   32   32   32 o    243.9    4.7  596.3792  22.9868   596.3792  22.9868   596.3792  22.9868      243.9      4.7      243.9        4.7     0.0     0.0 
1 1 1   32   32   33 o    279.4    4.3  782.1890  24.2638   782.1890  24.2638   782.1890  24.2638      279.4      4.3      279.4        4.3     0.0     0.0 
1 1 1   32   32   34 f    185.1    5.9  344.1632  21.7097   344.1632  21.7097   344.1632  21.7097      185.1      5.9      185.1        5.9     0.0     0.0 
1 1 1   32   32   35 o     31.1   18.7   10.8549  20.4327    10.8549  20.4327    10.8549  20.4327       31.1     18.7       31.1       18.7     0.0     0.0 
1 1 1   32   32   36 o    291.3    4.3  849.8723  24.9023   849.8723  24.9023   849.8723  24.9023      291.3      4.3      291.3        4.3     0.0     0.0 
1 1 1   32   32   37 o     16.3   12.0  -51.7203  22.9868   -51.7203  22.9868   -51.7203  22.9868       16.3     12.0       16.3       12.0     0.0     0.0 
1 1 1   32   32   38 o     20.4   14.4  -21.0712  21.7097   -21.0712  21.7097   -21.0712  21.7097       20.4     14.4       20.4       14.4     0.0     0.0 
1 1 1   32   32   39 o     26.3   17.3   -1.9156  22.3483    -1.9156  22.3483    -1.9156  22.3483       26.3     17.3       26.3       17.3     0.0     0.0 
1 1 1   32   32   40 o    104.0   10.6  112.3798  21.7097   112.3798  21.7097   112.3798  21.7097      104.0     10.6      104.0       10.6     0.0     0.0 
1 1 1   32   32   41 o     21.0   14.9  -23.6253  23.6253   -23.6253  23.6253   -23.6253  23.6253       21.0     14.9       21.0       14.9     0.0     0.0 
1 1 1   32   32   42 o     16.6   12.2  -48.5276  22.9868   -48.5276  22.9868   -48.5276  22.9868       16.6     12.2       16.6       12.2     0.0     0.0 
1 1 1   32   32   43 o    109.4   11.0  124.5117  23.6253   124.5117  23.6253   124.5117  23.6253      109.4     11.0      109.4       11.0     0.0     0.0 
1 1 1   32   32   44 o     21.7   15.2  -18.5171  22.9868   -18.5171  22.9868   -18.5171  22.9868       21.7     15.2       21.7       15.2     0.0     0.0 
1 1 1   32   32   45 o     17.8   12.9  -37.0343  22.3483   -37.0343  22.3483   -37.0343  22.3483       17.8     12.9       17.8       12.9     0.0     0.0 
1 1 1   33    0    0 o   1382.0    9.6 19103.9277 264.9865 19103.9277 264.9865 19103.9277 264.9865     1382.0      9.6     1382.0        9.6     0.0     0.0 
1 1 1   33    0    1 o   1299.1    6.4 16878.0430 167.2927 16878.0430 167.2927 16878.0430 167.2927     1299.1      6.4     1299.1        6.4     0.0     0.0 
1 1 1   33    0    2 o    486.9    3.4 2371.4692  33.2031  2371.4692  33.2031  2371.4692  33.2031      486.9      3.4      486.9        3.4     0.0     0.0 
1 1 1   33    0    3 o    867.5    5.1 7527.5317  88.7545  7527.5317  88.7545  7527.5317  88.7545      867.5      5.1      867.5        5.1     0.0     0.0 
1 1 1   33    0    4 o    553.5    3.6 3063.6267  40.2269  3063.6267  40.2269  3063.6267  40.2269      553.5      3.6      553.5        3.6     0.0     0.0 
1 1 1   33    0    5 o   1202.9    6.1 14470.8164 146.8600 14470.8164 146.8600 14470.8164 146.8600     1202.9      6.1     1202.9        6.1     0.0     0.0 
1 1 1   33    0    6 o    167.4    4.4  280.9495  14.6860   280.9495  14.6860   280.9495  14.6860      167.4      4.4      167.4        4.4     0.0     0.0 
1 1 1   33    0    7 f   1354.2    6.6 18342.1738 179.4246 18342.1738 179.4246 18342.1738 179.4246     1354.2      6.6     1354.2        6.6     0.0     0.0 
1 1 1   33    0    8 o   2508.4   11.5 62942.2695 574.6694 62942.2695 574.6694 62942.2695 574.6694     2508.4     11.5     2508.4       11.5     0.0     0.0 
1 1 1   33    0    9 o    455.5    3.3 2075.1953  30.0105  2075.1953  30.0105  2075.1953  30.0105      455.5      3.3      455.5        3.3     0.0     0.0 
1 1 1   33    0   10 o    814.0    4.4 6626.5776  71.5144  6626.5776  71.5144  6626.5776  71.5144      814.0      4.4      814.0        4.4     0.0     0.0 
1 1 1   33    0   11 o   1116.1    5.7 12457.5566 126.4273 12457.5566 126.4273 12457.5566 126.4273     1116.1      5.7     1116.1        5.7     0.0     0.0 
1 1 1   33    0   12 f    470.7    3.3 2216.3086  30.6490  2216.3086  30.6490  2216.3086  30.6490      470.7      3.3      470.7        3.3     0.0     0.0 
1 1 1   33    0   13 o    340.3    3.5 1158.2782  23.6253  1158.2782  23.6253  1158.2782  23.6253      340.3      3.5      340.3        3.5     0.0     0.0 
1 1 1   33    0   14 o   1146.5    5.6 13147.1602 128.3428 13147.1602 128.3428 13147.1602 128.3428     1146.5      5.6     1146.5        5.6     0.0     0.0 
1 1 1   33    0   15 o   1201.2    6.5 14431.2275 155.1608 14431.2275 155.1608 14431.2275 155.1608     1201.2      6.5     1201.2        6.5     0.0     0.0 
1 1 1   33    0   16 o   1011.9    5.7 10240.6104 115.5724 10240.6104 115.5724 10240.6104 115.5724     1011.9      5.7     1011.9        5.7     0.0     0.0 
1 1 1   33    0   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    0   18 o    375.0    4.1 1406.6632  30.6490  1406.6632  30.6490  1406.6632  30.6490      375.0      4.1      375.0        4.1     0.0     0.0 
1 1 1   33    0   19 o    149.4    7.3  224.7596  21.7097   224.7596  21.7097   224.7596  21.7097      149.4      7.3      149.4        7.3     0.0     0.0 
1 1 1   33    0   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    0   21 o    546.8    3.7 2990.1968  40.2269  2990.1968  40.2269  2990.1968  40.2269      546.8      3.7      546.8        3.7     0.0     0.0 
1 1 1   33    0   22 o   1084.9    5.7 11771.1465 123.8732 11771.1465 123.8732 11771.1465 123.8732     1084.9      5.7     1084.9        5.7     0.0     0.0 
1 1 1   33    0   23 o    710.5    4.3 5049.4287  60.6596  5049.4287  60.6596  5049.4287  60.6596      710.5      4.3      710.5        4.3     0.0     0.0 
1 1 1   33    0   24 o   1331.6    7.5 17737.4922 198.5802 17737.4922 198.5802 17737.4922 198.5802     1331.6      7.5     1331.6        7.5     0.0     0.0 
1 1 1   33    0   25 o    219.7    4.5  483.3608  19.7942   483.3608  19.7942   483.3608  19.7942      219.7      4.5      219.7        4.5     0.0     0.0 
1 1 1   33    0   26 o    546.4    3.7 2986.3657  40.8654  2986.3657  40.8654  2986.3657  40.8654      546.4      3.7      546.4        3.7     0.0     0.0 
1 1 1   33    0   27 o    135.1    6.9  183.8942  18.5171   183.8942  18.5171   183.8942  18.5171      135.1      6.9      135.1        6.9     0.0     0.0 
1 1 1   33    0   28 f    204.3    5.6  418.2317  22.9868   418.2317  22.9868   418.2317  22.9868      204.3      5.6      204.3        5.6     0.0     0.0 
1 1 1   33    0   29 o    411.9    3.9 1697.1904  31.9261  1697.1904  31.9261  1697.1904  31.9261      411.9      3.9      411.9        3.9     0.0     0.0 
1 1 1   33    0   30 o    996.4    6.2 9932.2041 124.5117  9932.2041 124.5117  9932.2041 124.5117      996.4      6.2      996.4        6.2     0.0     0.0 
1 1 1   33    0   31 o    195.7    6.2  384.3900  24.2638   384.3900  24.2638   384.3900  24.2638      195.7      6.2      195.7        6.2     0.0     0.0 
1 1 1   33    0   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    0   33 o    289.7    4.9  840.2945  28.0950   840.2945  28.0950   840.2945  28.0950      289.7      4.9      289.7        4.9     0.0     0.0 
1 1 1   33    0   34 o   1078.8    5.8 11642.8037 124.5117 11642.8037 124.5117 11642.8037 124.5117     1078.8      5.8     1078.8        5.8     0.0     0.0 
1 1 1   33    0   35 o    537.5    4.4 2890.5874  47.2506  2890.5874  47.2506  2890.5874  47.2506      537.5      4.4      537.5        4.4     0.0     0.0 
1 1 1   33    0   36 o   1179.0    6.3 13905.7246 149.4141 13905.7246 149.4141 13905.7246 149.4141     1179.0      6.3     1179.0        6.3     0.0     0.0 
1 1 1   33    0   37 o    550.4    3.8 3030.4236  41.5039  3030.4236  41.5039  3030.4236  41.5039      550.4      3.8      550.4        3.8     0.0     0.0 
1 1 1   33    0   38 o    882.7    4.9 7793.7949  86.2004  7793.7949  86.2004  7793.7949  86.2004      882.7      4.9      882.7        4.9     0.0     0.0 
1 1 1   33    0   39 o    451.1    3.8 2035.6068  33.8416  2035.6068  33.8416  2035.6068  33.8416      451.1      3.8      451.1        3.8     0.0     0.0 
1 1 1   33    0   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    0   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    0   42 o    504.5    3.6 2546.4241  36.3957  2546.4241  36.3957  2546.4241  36.3957      504.5      3.6      504.5        3.6     0.0     0.0 
1 1 1   33    0   43 o    222.8    5.2  497.4084  22.9868   497.4084  22.9868   497.4084  22.9868      222.8      5.2      222.8        5.2     0.0     0.0 
1 1 1   33    0   44 o    564.7    3.7 3189.4155  42.1424  3189.4155  42.1424  3189.4155  42.1424      564.7      3.7      564.7        3.7     0.0     0.0 
1 1 1   33    0   45 o    389.0    3.7 1513.9348  28.7335  1513.9348  28.7335  1513.9348  28.7335      389.0      3.7      389.0        3.7     0.0     0.0 
1 1 1   33    0   46 o    411.6    3.8 1694.6364  31.2876  1694.6364  31.2876  1694.6364  31.2876      411.6      3.8      411.6        3.8     0.0     0.0 
1 1 1   33    0   47 o    318.1    4.2 1012.6953  26.8179  1012.6953  26.8179  1012.6953  26.8179      318.1      4.2      318.1        4.2     0.0     0.0 
1 1 1   33    0   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    0   49 o    387.6    3.8 1503.0798  29.3720  1503.0798  29.3720  1503.0798  29.3720      387.6      3.8      387.6        3.8     0.0     0.0 
1 1 1   33    0   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    0   51 o    110.6   10.3  125.7888  22.3483   125.7888  22.3483   125.7888  22.3483      110.6     10.3      110.6       10.3     0.0     0.0 
1 1 1   33    0   52 o     15.7   11.6  -65.1292  24.2638   -65.1292  24.2638   -65.1292  24.2638       15.7     11.6       15.7       11.6     0.0     0.0 
1 1 1   33    0   53 o    119.6   10.6  146.8600  24.9023   146.8600  24.9023   146.8600  24.9023      119.6     10.6      119.6       10.6     0.0     0.0 
1 1 1   33    0   54 f     14.7   11.0  -81.0922  24.9023   -81.0922  24.9023   -81.0922  24.9023       14.7     11.0       14.7       11.0     0.0     0.0 
1 1 1   33    0   55 o    375.6    4.3 1412.4098  32.5646  1412.4098  32.5646  1412.4098  32.5646      375.6      4.3      375.6        4.3     0.0     0.0 
1 1 1   33    0   56 o    620.1    4.3 3847.7312  52.9973  3847.7312  52.9973  3847.7312  52.9973      620.1      4.3      620.1        4.3     0.0     0.0 
1 1 1   33    0   57 o    580.0    4.0 3365.6472  45.9736  3365.6472  45.9736  3365.6472  45.9736      580.0      4.0      580.0        4.0     0.0     0.0 
1 1 1   33    0   58 o    514.4    4.4 2648.5876  45.3350  2648.5876  45.3350  2648.5876  45.3350      514.4      4.4      514.4        4.4     0.0     0.0 
1 1 1   33    0   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    0   60 o    617.7    4.1 3818.3594  50.4432  3818.3594  50.4432  3818.3594  50.4432      617.7      4.1      617.7        4.1     0.0     0.0 
1 1 1   33    0   61 o    110.9   13.3  128.9814  28.7335   128.9814  28.7335   128.9814  28.7335      110.9     13.3      110.9       13.3     0.0     0.0 
1 1 1   33    0   62 o    430.9    4.2 1858.7365  36.3957  1858.7365  36.3957  1858.7365  36.3957      430.9      4.2      430.9        4.2     0.0     0.0 
1 1 1   33    0   63 o    192.5    7.8  373.5352  30.0105   373.5352  30.0105   373.5352  30.0105      192.5      7.8      192.5        7.8     0.0     0.0 
1 1 1   33    0   64 o     58.0   24.3   48.5276  28.0950    48.5276  28.0950    48.5276  28.0950       58.0     24.3       58.0       24.3     0.0     0.0 
1 1 1   33    0   65 o    131.4   11.1  177.5090  28.7335   177.5090  28.7335   177.5090  28.7335      131.4     11.1      131.4       11.1     0.0     0.0 
1 1 1   33    0   66 o    195.1    7.7  383.7515  30.0105   383.7515  30.0105   383.7515  30.0105      195.1      7.7      195.1        7.7     0.0     0.0 
1 1 1   33    0   67 o    109.9   13.1  127.0658  28.0950   127.0658  28.0950   127.0658  28.0950      109.9     13.1      109.9       13.1     0.0     0.0 
1 1 1   33    0   68 o    119.5   12.3  148.7755  28.7335   148.7755  28.7335   148.7755  28.7335      119.5     12.3      119.5       12.3     0.0     0.0 
1 1 1   33    0   69 o     23.6   16.7  -30.0105  30.0105   -30.0105  30.0105   -30.0105  30.0105       23.6     16.7       23.6       16.7     0.0     0.0 
1 1 1   33    0   70 o    155.5    9.5  246.4693  29.3720   246.4693  29.3720   246.4693  29.3720      155.5      9.5      155.5        9.5     0.0     0.0 
1 1 1   33    0   71 o    117.9   11.9  144.9444  27.4564   144.9444  27.4564   144.9444  27.4564      117.9     11.9      117.9       11.9     0.0     0.0 
1 1 1   33    1    0 o     22.8   14.0    4.4697  12.1319     4.4697  12.1319     4.4697  12.1319       22.8     14.0       22.8       14.0     0.0     0.0 
1 1 1   33    1    1 o    523.9    2.6    0.0000   0.0000          ?        ?  2744.3660  26.8179          ?        ?      523.9        2.6       ?       ? 
1 1 1   33    1    2 o   1535.5    5.6    0.0000   0.0000          ?        ? 23580.6035 171.7623          ?        ?     1535.5        5.6       ?       ? 
1 1 1   33    1    3 o   1587.1    5.6    0.0000   0.0000          ?        ? 25192.8711 177.5090          ?        ?     1587.1        5.6       ?       ? 
1 1 1   33    1    4 o    113.0    4.8    0.0000   0.0000          ?        ?   127.7043  10.8549          ?        ?      113.0        4.8       ?       ? 
1 1 1   33    1    5 o    488.7    2.5    0.0000   0.0000          ?        ?  2388.0708  24.2638          ?        ?      488.7        2.5       ?       ? 
1 1 1   33    1    6 o    117.7    4.1    0.0000   0.0000          ?        ?   138.5592   9.5778          ?        ?      117.7        4.1       ?       ? 
1 1 1   33    1    7 o    419.7    2.4    0.0000   0.0000          ?        ?  1761.6812  19.7942          ?        ?      419.7        2.4       ?       ? 
1 1 1   33    1    8 o   1014.1    3.7    0.0000   0.0000          ?        ? 10284.0293  75.3456          ?        ?     1014.1        3.7       ?       ? 
1 1 1   33    1    9 o    557.8    2.5    0.0000   0.0000          ?        ?  3111.5159  27.4564          ?        ?      557.8        2.5       ?       ? 
1 1 1   33    1   10 o    418.9    2.4    0.0000   0.0000          ?        ?  1754.6573  20.4327          ?        ?      418.9        2.4       ?       ? 
1 1 1   33    1   11 o   1590.1    5.3    0.0000   0.0000          ?        ? 25288.0098 169.8468          ?        ?     1590.1        5.3       ?       ? 
1 1 1   33    1   12 o    513.8    2.4    0.0000   0.0000          ?        ?  2640.2869  24.2638          ?        ?      513.8        2.4       ?       ? 
1 1 1   33    1   13 o    336.8    2.2    0.0000   0.0000          ?        ?  1134.6530  14.6860          ?        ?      336.8        2.2       ?       ? 
1 1 1   33    1   14 o    733.4    2.9    0.0000   0.0000          ?        ?  5378.9062  42.1424          ?        ?      733.4        2.9       ?       ? 
1 1 1   33    1   15 o   1064.1    3.8    0.0000   0.0000          ?        ? 11322.9043  80.4537          ?        ?     1064.1        3.8       ?       ? 
1 1 1   33    1   16 o    581.9    2.6    0.0000   0.0000          ?        ?  3386.0801  30.0105          ?        ?      581.9        2.6       ?       ? 
1 1 1   33    1   17 o    123.8    4.6    0.0000   0.0000          ?        ?   153.2452  11.4934          ?        ?      123.8        4.6       ?       ? 
1 1 1   33    1   18 o    560.9    2.6    0.0000   0.0000          ?        ?  3145.9961  28.7335          ?        ?      560.9        2.6       ?       ? 
1 1 1   33    1   19 o   1283.8    4.9    0.0000   0.0000          ?        ? 16484.0742 125.1502          ?        ?     1283.8        4.9       ?       ? 
1 1 1   33    1   20 o    490.4    2.5    0.0000   0.0000          ?        ?  2404.6724  24.2638          ?        ?      490.4        2.5       ?       ? 
1 1 1   33    1   21 o    918.2    3.5    0.0000   0.0000          ?        ?  8431.6777  63.8522          ?        ?      918.2        3.5       ?       ? 
1 1 1   33    1   22 o   1349.3    5.0    0.0000   0.0000          ?        ? 18208.0840 134.0895          ?        ?     1349.3        5.0       ?       ? 
1 1 1   33    1   23 o   1106.6    4.4    0.0000   0.0000          ?        ? 12248.1211  96.4168          ?        ?     1106.6        4.4       ?       ? 
1 1 1   33    1   24 o     27.3   12.6    0.0000   0.0000          ?        ?   -12.7704  15.9630          ?        ?       27.3       12.6       ?       ? 
1 1 1   33    1   25 f    441.3    2.4    0.0000   0.0000          ?        ?  1947.4910  21.0712          ?        ?      441.3        2.4       ?       ? 
1 1 1   33    1   26 o    323.7    2.5    0.0000   0.0000          ?        ?  1047.8141  15.9630          ?        ?      323.7        2.5       ?       ? 
1 1 1   33    1   27 o    206.1    3.7    0.0000   0.0000          ?        ?   424.6169  15.3245          ?        ?      206.1        3.7       ?       ? 
1 1 1   33    1   28 o    354.2    2.8    0.0000   0.0000          ?        ?  1254.6949  19.7942          ?        ?      354.2        2.8       ?       ? 
1 1 1   33    1   29 o    741.3    3.1    0.0000   0.0000          ?        ?  5496.3940  45.3350          ?        ?      741.3        3.1       ?       ? 
1 1 1   33    1   30 o    527.6    2.7    0.0000   0.0000          ?        ?  2783.9543  28.0950          ?        ?      527.6        2.7       ?       ? 
1 1 1   33    1   31 f    404.3    2.6    0.0000   0.0000          ?        ?  1634.6154  21.0712          ?        ?      404.3        2.6       ?       ? 
1 1 1   33    1   32 f   1241.7    4.5    0.0000   0.0000          ?        ? 15422.8506 112.3798          ?        ?     1241.7        4.5       ?       ? 
1 1 1   33    1   33 o    867.4    3.4    0.0000   0.0000          ?        ?  7524.3389  59.3825          ?        ?      867.4        3.4       ?       ? 
1 1 1   33    1   34 o    636.4    2.8    0.0000   0.0000          ?        ?  4050.7812  35.7572          ?        ?      636.4        2.8       ?       ? 
1 1 1   33    1   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    1   36 o    526.2    2.6    0.0000   0.0000          ?        ?  2769.2683  27.4564          ?        ?      526.2        2.6       ?       ? 
1 1 1   33    1   37 o    520.7    2.6    0.0000   0.0000          ?        ?  2711.1628  26.8179          ?        ?      520.7        2.6       ?       ? 
1 1 1   33    1   38 o    624.7    2.8    0.0000   0.0000          ?        ?  3903.2827  34.4802          ?        ?      624.7        2.8       ?       ? 
1 1 1   33    1   39 o    163.1    4.9    0.0000   0.0000          ?        ?   266.2635  15.9630          ?        ?      163.1        4.9       ?       ? 
1 1 1   33    1   40 o     45.0   14.4    0.0000   0.0000          ?        ?    19.7942  14.6860          ?        ?       45.0       14.4       ?       ? 
1 1 1   33    1   41 o    473.3    2.4    0.0000   0.0000          ?        ?  2240.5723  22.9868          ?        ?      473.3        2.4       ?       ? 
1 1 1   33    1   42 o     16.9    8.6    0.0000   0.0000          ?        ?   -52.9973  14.6860          ?        ?       16.9        8.6       ?       ? 
1 1 1   33    1   43 o    533.5    2.7    0.0000   0.0000          ?        ?  2846.5293  28.7335          ?        ?      533.5        2.7       ?       ? 
1 1 1   33    1   44 o    227.2    3.9    0.0000   0.0000          ?        ?   516.5640  17.8786          ?        ?      227.2        3.9       ?       ? 
1 1 1   33    1   45 o    239.1    3.6    0.0000   0.0000          ?        ?   572.1154  17.2401          ?        ?      239.1        3.6       ?       ? 
1 1 1   33    1   46 o    705.8    3.1    0.0000   0.0000          ?        ?  4983.6611  43.4195          ?        ?      705.8        3.1       ?       ? 
1 1 1   33    1   47 o    512.2    2.7    0.0000   0.0000          ?        ?  2624.3240  27.4564          ?        ?      512.2        2.7       ?       ? 
1 1 1   33    1   48 o    449.1    2.6    0.0000   0.0000          ?        ?  2017.7284  23.6253          ?        ?      449.1        2.6       ?       ? 
1 1 1   33    1   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    1   50 o    520.4    2.6    0.0000   0.0000          ?        ?  2708.6089  27.4564          ?        ?      520.4        2.6       ?       ? 
1 1 1   33    1   51 o     33.1   14.3    0.0000   0.0000          ?        ?    -1.9156  17.2401          ?        ?       33.1       14.3       ?       ? 
1 1 1   33    1   52 o    421.2    2.7    0.0000   0.0000          ?        ?  1774.4515  22.9868          ?        ?      421.2        2.7       ?       ? 
1 1 1   33    1   53 o    432.0    2.7    0.0000   0.0000          ?        ?  1867.0372  22.9868          ?        ?      432.0        2.7       ?       ? 
1 1 1   33    1   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    1   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    1   56 o    464.2    2.9    0.0000   0.0000          ?        ?  2156.2876  26.8179          ?        ?      464.2        2.9       ?       ? 
1 1 1   33    1   57 o    285.5    3.6    0.0000   0.0000          ?        ?   816.0306  20.4327          ?        ?      285.5        3.6       ?       ? 
1 1 1   33    1   58 o    113.3    8.5    0.0000   0.0000          ?        ?   128.9814  19.1556          ?        ?      113.3        8.5       ?       ? 
1 1 1   33    1   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    1   60 o    305.7    3.4    0.0000   0.0000          ?        ?   935.4342  21.0712          ?        ?      305.7        3.4       ?       ? 
1 1 1   33    1   61 o     72.8   13.7    0.0000   0.0000          ?        ?    55.5514  19.1556          ?        ?       72.8       13.7       ?       ? 
1 1 1   33    1   62 o    305.1    3.7    0.0000   0.0000          ?        ?   932.2416  22.3483          ?        ?      305.1        3.7       ?       ? 
1 1 1   33    1   63 o    133.1    7.4    0.0000   0.0000          ?        ?   178.1475  19.7942          ?        ?      133.1        7.4       ?       ? 
1 1 1   33    1   64 o     88.7   11.5    0.0000   0.0000          ?        ?    79.8152  20.4327          ?        ?       88.7       11.5       ?       ? 
1 1 1   33    1   65 o    356.5    3.4    0.0000   0.0000          ?        ?  1272.5736  24.2638          ?        ?      356.5        3.4       ?       ? 
1 1 1   33    1   66 o    110.7    9.2    0.0000   0.0000          ?        ?   123.8732  20.4327          ?        ?      110.7        9.2       ?       ? 
1 1 1   33    1   67 o     27.9   13.3    0.0000   0.0000          ?        ?   -25.5409  20.4327          ?        ?       27.9       13.3       ?       ? 
1 1 1   33    1   68 o    164.8    6.4    0.0000   0.0000          ?        ?   273.2873  21.0712          ?        ?      164.8        6.4       ?       ? 
1 1 1   33    1   69 o    134.2    7.8    0.0000   0.0000          ?        ?   181.9787  21.0712          ?        ?      134.2        7.8       ?       ? 
1 1 1   33    1   70 o     19.9   10.1    0.0000   0.0000          ?        ?   -77.2611  21.0712          ?        ?       19.9       10.1       ?       ? 
1 1 1   33    1   71 f     96.1   10.6    0.0000   0.0000          ?        ?    94.5012  20.4327          ?        ?       96.1       10.6       ?       ? 
1 1 1   33    2    0 o    942.6    5.0 8886.9443  93.8627  8886.9443  93.8627  8886.9443  93.8627      942.6      5.0      942.6        5.0     0.0     0.0 
1 1 1   33    2    1 o    357.8    2.3    0.0000   0.0000          ?        ?  1280.2358  16.6016          ?        ?      357.8        2.3       ?       ? 
1 1 1   33    2    2 o   1125.8    4.1    0.0000   0.0000          ?        ? 12675.2930  91.3086          ?        ?     1125.8        4.1       ?       ? 
1 1 1   33    2    3 o    373.7    2.3    0.0000   0.0000          ?        ?  1396.4468  17.2401          ?        ?      373.7        2.3       ?       ? 
1 1 1   33    2    4 o    846.4    3.2    0.0000   0.0000          ?        ?  7164.8511  54.2743          ?        ?      846.4        3.2       ?       ? 
1 1 1   33    2    5 o    711.7    2.8    0.0000   0.0000          ?        ?  5064.7534  40.2269          ?        ?      711.7        2.8       ?       ? 
1 1 1   33    2    6 f   1239.7    4.3    0.0000   0.0000          ?        ? 15369.2158 106.6331          ?        ?     1239.7        4.3       ?       ? 
1 1 1   33    2    7 o    408.0    2.3    0.0000   0.0000          ?        ?  1664.6260  19.1556          ?        ?      408.0        2.3       ?       ? 
1 1 1   33    2    8 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    2    9 o    578.5    2.8    0.0000   0.0000          ?        ?  3347.1304  31.9261          ?        ?      578.5        2.8       ?       ? 
1 1 1   33    2   10 o   1058.4    3.9    0.0000   0.0000          ?        ? 11202.8623  81.7308          ?        ?     1058.4        3.9       ?       ? 
1 1 1   33    2   11 o    531.1    2.6    0.0000   0.0000          ?        ?  2820.3501  27.4564          ?        ?      531.1        2.6       ?       ? 
1 1 1   33    2   12 o   1143.4    4.1    0.0000   0.0000          ?        ? 13075.0068  93.8627          ?        ?     1143.4        4.1       ?       ? 
1 1 1   33    2   13 o    441.9    2.5    0.0000   0.0000          ?        ?  1952.5990  21.7097          ?        ?      441.9        2.5       ?       ? 
1 1 1   33    2   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    2   15 o     99.8    6.1    0.0000   0.0000          ?        ?    99.6094  12.1319          ?        ?       99.8        6.1       ?       ? 
1 1 1   33    2   16 o    748.7    2.9    0.0000   0.0000          ?        ?  5606.2197  43.4195          ?        ?      748.7        2.9       ?       ? 
1 1 1   33    2   17 o    700.7    3.0    0.0000   0.0000          ?        ?  4910.2314  41.5039          ?        ?      700.7        3.0       ?       ? 
1 1 1   33    2   18 o    715.8    2.9    0.0000   0.0000          ?        ?  5123.4976  42.1424          ?        ?      715.8        2.9       ?       ? 
1 1 1   33    2   19 o    607.4    2.7    0.0000   0.0000          ?        ?  3690.0166  32.5646          ?        ?      607.4        2.7       ?       ? 
1 1 1   33    2   20 o    852.6    3.4    0.0000   0.0000          ?        ?  7270.2070  58.7440          ?        ?      852.6        3.4       ?       ? 
1 1 1   33    2   21 o    569.9    2.9    0.0000   0.0000          ?        ?  3247.5210  32.5646          ?        ?      569.9        2.9       ?       ? 
1 1 1   33    2   22 o    212.0    3.3    0.0000   0.0000          ?        ?   449.5192  14.0475          ?        ?      212.0        3.3       ?       ? 
1 1 1   33    2   23 o   1288.1    4.6    0.0000   0.0000          ?        ? 16593.9004 117.4880          ?        ?     1288.1        4.6       ?       ? 
1 1 1   33    2   24 o    343.9    2.9    0.0000   0.0000          ?        ?  1182.5420  19.7942          ?        ?      343.9        2.9       ?       ? 
1 1 1   33    2   25 o    645.6    2.7    0.0000   0.0000          ?        ?  4167.6309  34.4802          ?        ?      645.6        2.7       ?       ? 
1 1 1   33    2   26 o    487.6    2.6    0.0000   0.0000          ?        ?  2377.8545  24.9023          ?        ?      487.6        2.6       ?       ? 
1 1 1   33    2   27 o   1110.1    4.1    0.0000   0.0000          ?        ? 12326.0215  91.9471          ?        ?     1110.1        4.1       ?       ? 
1 1 1   33    2   28 f    392.9    2.8    0.0000   0.0000          ?        ?  1543.9453  21.7097          ?        ?      392.9        2.8       ?       ? 
1 1 1   33    2   29 o    714.0    3.0    0.0000   0.0000          ?        ?  5097.9570  43.4195          ?        ?      714.0        3.0       ?       ? 
1 1 1   33    2   30 o    343.1    2.8    0.0000   0.0000          ?        ?  1177.4338  19.1556          ?        ?      343.1        2.8       ?       ? 
1 1 1   33    2   31 o    681.4    3.0    0.0000   0.0000          ?        ?  4643.3291  40.2269          ?        ?      681.4        3.0       ?       ? 
1 1 1   33    2   32 o    108.1    7.1    0.0000   0.0000          ?        ?   116.8494  15.3245          ?        ?      108.1        7.1       ?       ? 
1 1 1   33    2   33 o    345.6    2.9    0.0000   0.0000          ?        ?  1194.6740  19.7942          ?        ?      345.6        2.9       ?       ? 
1 1 1   33    2   34 o    490.2    2.5    0.0000   0.0000          ?        ?  2402.7568  24.9023          ?        ?      490.2        2.5       ?       ? 
1 1 1   33    2   35 o    116.6    6.8    0.0000   0.0000          ?        ?   136.0051  15.9630          ?        ?      116.6        6.8       ?       ? 
1 1 1   33    2   36 o    724.5    3.0    0.0000   0.0000          ?        ?  5250.5635  44.0580          ?        ?      724.5        3.0       ?       ? 
1 1 1   33    2   37 o    179.4    4.5    0.0000   0.0000          ?        ?   321.8149  15.9630          ?        ?      179.4        4.5       ?       ? 
1 1 1   33    2   38 o    168.0    4.8    0.0000   0.0000          ?        ?   282.2266  15.9630          ?        ?      168.0        4.8       ?       ? 
1 1 1   33    2   39 o    353.6    2.9    0.0000   0.0000          ?        ?  1250.8638  20.4327          ?        ?      353.6        2.9       ?       ? 
1 1 1   33    2   40 o    246.4    3.2    0.0000   0.0000          ?        ?   607.2341  15.9630          ?        ?      246.4        3.2       ?       ? 
1 1 1   33    2   41 o     20.4   10.1    0.0000   0.0000          ?        ?   -31.9261  14.6860          ?        ?       20.4       10.1       ?       ? 
1 1 1   33    2   42 o    386.6    2.6    0.0000   0.0000          ?        ?  1494.7792  20.4327          ?        ?      386.6        2.6       ?       ? 
1 1 1   33    2   43 o    544.1    2.6    0.0000   0.0000          ?        ?  2960.8250  28.7335          ?        ?      544.1        2.6       ?       ? 
1 1 1   33    2   44 o    171.9    4.6    0.0000   0.0000          ?        ?   295.6355  15.9630          ?        ?      171.9        4.6       ?       ? 
1 1 1   33    2   45 o    265.2    3.3    0.0000   0.0000          ?        ?   703.6508  17.2401          ?        ?      265.2        3.3       ?       ? 
1 1 1   33    2   46 o    147.9    5.6    0.0000   0.0000          ?        ?   219.0129  16.6016          ?        ?      147.9        5.6       ?       ? 
1 1 1   33    2   47 o    276.2    3.2    0.0000   0.0000          ?        ?   763.0333  17.8786          ?        ?      276.2        3.2       ?       ? 
1 1 1   33    2   48 o    301.4    3.1    0.0000   0.0000          ?        ?   908.6163  18.5171          ?        ?      301.4        3.1       ?       ? 
1 1 1   33    2   49 o     45.4   15.1    0.0000   0.0000          ?        ?    19.7942  15.9630          ?        ?       45.4       15.1       ?       ? 
1 1 1   33    2   50 o     34.7   14.4    0.0000   0.0000          ?        ?     2.5541  16.6016          ?        ?       34.7       14.4       ?       ? 
1 1 1   33    2   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    2   52 o    407.8    2.7    0.0000   0.0000          ?        ?  1663.3489  22.3483          ?        ?      407.8        2.7       ?       ? 
1 1 1   33    2   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    2   54 o    274.5    3.5    0.0000   0.0000          ?        ?   754.0941  19.1556          ?        ?      274.5        3.5       ?       ? 
1 1 1   33    2   55 o    165.7    5.6    0.0000   0.0000          ?        ?   275.2028  18.5171          ?        ?      165.7        5.6       ?       ? 
1 1 1   33    2   56 o    326.8    3.2    0.0000   0.0000          ?        ?  1068.8851  21.0712          ?        ?      326.8        3.2       ?       ? 
1 1 1   33    2   57 o    506.7    2.6    0.0000   0.0000          ?        ?  2568.7725  26.8179          ?        ?      506.7        2.6       ?       ? 
1 1 1   33    2   58 f    198.3    5.0    0.0000   0.0000          ?        ?   393.9678  19.7942          ?        ?      198.3        5.0       ?       ? 
1 1 1   33    2   59 o    279.5    3.7    0.0000   0.0000          ?        ?   782.1890  20.4327          ?        ?      279.5        3.7       ?       ? 
1 1 1   33    2   60 o    287.2    3.7    0.0000   0.0000          ?        ?   825.6085  21.0712          ?        ?      287.2        3.7       ?       ? 
1 1 1   33    2   61 o     99.1   10.0    0.0000   0.0000          ?        ?    98.9709  19.7942          ?        ?       99.1       10.0       ?       ? 
1 1 1   33    2   62 o    233.7    4.2    0.0000   0.0000          ?        ?   547.2130  19.7942          ?        ?      233.7        4.2       ?       ? 
1 1 1   33    2   63 o     36.2   15.3    0.0000   0.0000          ?        ?     1.2770  19.1556          ?        ?       36.2       15.3       ?       ? 
1 1 1   33    2   64 o    362.4    3.3    0.0000   0.0000          ?        ?  1314.7159  23.6253          ?        ?      362.4        3.3       ?       ? 
1 1 1   33    2   65 o     53.0   16.7    0.0000   0.0000          ?        ?    28.7335  19.7942          ?        ?       53.0       16.7       ?       ? 
1 1 1   33    2   66 o    103.8   10.5    0.0000   0.0000          ?        ?   109.1872  21.7097          ?        ?      103.8       10.5       ?       ? 
1 1 1   33    2   67 o     21.9   10.9    0.0000   0.0000          ?        ?   -49.1662  19.1556          ?        ?       21.9       10.9       ?       ? 
1 1 1   33    2   68 o    219.6    4.7    0.0000   0.0000          ?        ?   483.9994  20.4327          ?        ?      219.6        4.7       ?       ? 
1 1 1   33    2   69 o    210.5    5.0    0.0000   0.0000          ?        ?   445.0496  21.0712          ?        ?      210.5        5.0       ?       ? 
1 1 1   33    2   70 o    155.2    6.4    0.0000   0.0000          ?        ?   242.6382  19.7942          ?        ?      155.2        6.4       ?       ? 
1 1 1   33    2   71 o    232.6    4.4    0.0000   0.0000          ?        ?   543.3819  20.4327          ?        ?      232.6        4.4       ?       ? 
1 1 1   33    3    0 o    519.0    3.4 2693.9226  35.7572  2693.9226  35.7572  2693.9226  35.7572      519.0      3.4      519.0        3.4     0.0     0.0 
1 1 1   33    3    1 o    911.2    3.5    0.0000   0.0000          ?        ?  8302.6973  63.8522          ?        ?      911.2        3.5       ?       ? 
1 1 1   33    3    2 o   1584.3    5.5    0.0000   0.0000          ?        ? 25102.2012 173.6779          ?        ?     1584.3        5.5       ?       ? 
1 1 1   33    3    3 o   1441.7    5.0    0.0000   0.0000          ?        ? 20788.3477 144.9444          ?        ?     1441.7        5.0       ?       ? 
1 1 1   33    3    4 o   1159.2    4.1    0.0000   0.0000          ?        ? 13438.9648  95.1397          ?        ?     1159.2        4.1       ?       ? 
1 1 1   33    3    5 o    418.9    2.2    0.0000   0.0000          ?        ?  1754.6573  18.5171          ?        ?      418.9        2.2       ?       ? 
1 1 1   33    3    6 f    613.8    2.7    0.0000   0.0000          ?        ?  3767.9160  33.2031          ?        ?      613.8        2.7       ?       ? 
1 1 1   33    3    7 o   1067.7    3.8    0.0000   0.0000          ?        ? 11401.4424  81.7308          ?        ?     1067.7        3.8       ?       ? 
1 1 1   33    3    8 o   1342.9    4.7    0.0000   0.0000          ?        ? 18034.4043 125.1502          ?        ?     1342.9        4.7       ?       ? 
1 1 1   33    3    9 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    3   10 o    503.4    2.5    0.0000   0.0000          ?        ?  2534.2922  25.5409          ?        ?      503.4        2.5       ?       ? 
1 1 1   33    3   11 o   1144.4    4.0    0.0000   0.0000          ?        ? 13097.3555  92.5856          ?        ?     1144.4        4.0       ?       ? 
1 1 1   33    3   12 o    933.4    3.8    0.0000   0.0000          ?        ?  8713.9043  70.8759          ?        ?      933.4        3.8       ?       ? 
1 1 1   33    3   13 o   1983.1    6.5    0.0000   0.0000          ?        ? 39334.2109 257.9627          ?        ?     1983.1        6.5       ?       ? 
1 1 1   33    3   14 o   1105.7    3.9    0.0000   0.0000          ?        ? 12226.4121  86.8389          ?        ?     1105.7        3.9       ?       ? 
1 1 1   33    3   15 o   1896.1    6.4    0.0000   0.0000          ?        ? 35961.5391 242.6382          ?        ?     1896.1        6.4       ?       ? 
1 1 1   33    3   16 o    900.6    3.5    0.0000   0.0000          ?        ?  8111.7788  62.5751          ?        ?      900.6        3.5       ?       ? 
1 1 1   33    3   17 f    752.9    3.0    0.0000   0.0000          ?        ?  5668.1567  45.3350          ?        ?      752.9        3.0       ?       ? 
1 1 1   33    3   18 o    173.0    3.7    0.0000   0.0000          ?        ?   299.4666  12.7704          ?        ?      173.0        3.7       ?       ? 
1 1 1   33    3   19 o    536.6    2.6    0.0000   0.0000          ?        ?  2879.0940  28.0950          ?        ?      536.6        2.6       ?       ? 
1 1 1   33    3   20 o    265.9    2.9    0.0000   0.0000          ?        ?   706.8434  15.3245          ?        ?      265.9        2.9       ?       ? 
1 1 1   33    3   21 o    381.0    2.5    0.0000   0.0000          ?        ?  1451.9982  19.1556          ?        ?      381.0        2.5       ?       ? 
1 1 1   33    3   22 f    436.3    2.5    0.0000   0.0000          ?        ?  1904.0715  21.7097          ?        ?      436.3        2.5       ?       ? 
1 1 1   33    3   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    3   24 o    112.1    5.7    0.0000   0.0000          ?        ?   125.7888  12.7704          ?        ?      112.1        5.7       ?       ? 
1 1 1   33    3   25 o    875.0    3.5    0.0000   0.0000          ?        ?  7657.7900  61.2981          ?        ?      875.0        3.5       ?       ? 
1 1 1   33    3   26 o     92.5    7.2    0.0000   0.0000          ?        ?    85.5619  13.4090          ?        ?       92.5        7.2       ?       ? 
1 1 1   33    3   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    3   28 o    532.8    2.6    0.0000   0.0000          ?        ?  2838.8672  27.4564          ?        ?      532.8        2.6       ?       ? 
1 1 1   33    3   29 o    774.9    3.2    0.0000   0.0000          ?        ?  6005.9341  49.1662          ?        ?      774.9        3.2       ?       ? 
1 1 1   33    3   30 o    582.7    2.8    0.0000   0.0000          ?        ?  3395.6580  32.5646          ?        ?      582.7        2.8       ?       ? 
1 1 1   33    3   31 o    645.2    2.8    0.0000   0.0000          ?        ?  4163.7993  36.3957          ?        ?      645.2        2.8       ?       ? 
1 1 1   33    3   32 o    356.7    2.5    0.0000   0.0000          ?        ?  1272.5736  17.8786          ?        ?      356.7        2.5       ?       ? 
1 1 1   33    3   33 o    261.0    3.2    0.0000   0.0000          ?        ?   681.3026  16.6016          ?        ?      261.0        3.2       ?       ? 
1 1 1   33    3   34 o    161.6    4.9    0.0000   0.0000          ?        ?   261.1554  15.9630          ?        ?      161.6        4.9       ?       ? 
1 1 1   33    3   35 o    212.3    3.5    0.0000   0.0000          ?        ?   450.7963  14.6860          ?        ?      212.3        3.5       ?       ? 
1 1 1   33    3   36 o    447.2    2.7    0.0000   0.0000          ?        ?  1999.8499  24.2638          ?        ?      447.2        2.7       ?       ? 
1 1 1   33    3   37 o    470.5    2.6    0.0000   0.0000          ?        ?  2214.3928  24.2638          ?        ?      470.5        2.6       ?       ? 
1 1 1   33    3   38 o    227.5    3.6    0.0000   0.0000          ?        ?   517.8410  16.6016          ?        ?      227.5        3.6       ?       ? 
1 1 1   33    3   39 o    236.6    3.8    0.0000   0.0000          ?        ?   559.9835  17.8786          ?        ?      236.6        3.8       ?       ? 
1 1 1   33    3   40 o     32.4   13.9    0.0000   0.0000          ?        ?    -0.6385  15.9630          ?        ?       32.4       13.9       ?       ? 
1 1 1   33    3   41 o    227.2    3.5    0.0000   0.0000          ?        ?   516.5640  15.9630          ?        ?      227.2        3.5       ?       ? 
1 1 1   33    3   42 o    247.9    3.3    0.0000   0.0000          ?        ?   614.8964  16.6016          ?        ?      247.9        3.3       ?       ? 
1 1 1   33    3   43 f    170.0    4.9    0.0000   0.0000          ?        ?   289.2503  16.6016          ?        ?      170.0        4.9       ?       ? 
1 1 1   33    3   44 o    462.0    2.6    0.0000   0.0000          ?        ?  2135.2163  24.2638          ?        ?      462.0        2.6       ?       ? 
1 1 1   33    3   45 f    117.1    6.8    0.0000   0.0000          ?        ?   137.2822  15.9630          ?        ?      117.1        6.8       ?       ? 
1 1 1   33    3   46 o     91.7    8.7    0.0000   0.0000          ?        ?    84.2849  15.9630          ?        ?       91.7        8.7       ?       ? 
1 1 1   33    3   47 o    160.3    5.2    0.0000   0.0000          ?        ?   257.3242  16.6016          ?        ?      160.3        5.2       ?       ? 
1 1 1   33    3   48 o    221.7    3.7    0.0000   0.0000          ?        ?   491.6617  16.6016          ?        ?      221.7        3.7       ?       ? 
1 1 1   33    3   49 o    189.0    4.6    0.0000   0.0000          ?        ?   357.5721  17.2401          ?        ?      189.0        4.6       ?       ? 
1 1 1   33    3   50 o    118.4    7.0    0.0000   0.0000          ?        ?   140.4748  16.6016          ?        ?      118.4        7.0       ?       ? 
1 1 1   33    3   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    3   52 o     39.9   15.3    0.0000   0.0000          ?        ?    10.8549  17.2401          ?        ?       39.9       15.3       ?       ? 
1 1 1   33    3   53 o    264.1    3.5    0.0000   0.0000          ?        ?   697.9042  18.5171          ?        ?      264.1        3.5       ?       ? 
1 1 1   33    3   54 o    203.3    4.9    0.0000   0.0000          ?        ?   413.7620  19.7942          ?        ?      203.3        4.9       ?       ? 
1 1 1   33    3   55 o    458.6    2.7    0.0000   0.0000          ?        ?  2103.9287  24.9023          ?        ?      458.6        2.7       ?       ? 
1 1 1   33    3   56 o    399.7    2.8    0.0000   0.0000          ?        ?  1598.2196  22.3483          ?        ?      399.7        2.8       ?       ? 
1 1 1   33    3   57 o     53.9   17.0    0.0000   0.0000          ?        ?    29.3720  20.4327          ?        ?       53.9       17.0       ?       ? 
1 1 1   33    3   58 o    410.2    2.9    0.0000   0.0000          ?        ?  1683.7816  23.6253          ?        ?      410.2        2.9       ?       ? 
1 1 1   33    3   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    3   60 o     20.4   10.3    0.0000   0.0000          ?        ?   -60.0210  19.1556          ?        ?       20.4       10.3       ?       ? 
1 1 1   33    3   61 o    335.9    3.3    0.0000   0.0000          ?        ?  1129.5447  22.3483          ?        ?      335.9        3.3       ?       ? 
1 1 1   33    3   62 o     48.7   16.8    0.0000   0.0000          ?        ?    22.3483  19.7942          ?        ?       48.7       16.8       ?       ? 
1 1 1   33    3   63 o    284.3    3.7    0.0000   0.0000          ?        ?   809.6454  21.0712          ?        ?      284.3        3.7       ?       ? 
1 1 1   33    3   64 o    147.4    6.9    0.0000   0.0000          ?        ?   218.3744  20.4327          ?        ?      147.4        6.9       ?       ? 
1 1 1   33    3   65 o     40.7   16.0    0.0000   0.0000          ?        ?    10.2163  19.1556          ?        ?       40.7       16.0       ?       ? 
1 1 1   33    3   66 o     84.6   11.7    0.0000   0.0000          ?        ?    72.7915  19.7942          ?        ?       84.6       11.7       ?       ? 
1 1 1   33    3   67 o    163.7    6.0    0.0000   0.0000          ?        ?   269.4561  19.7942          ?        ?      163.7        6.0       ?       ? 
1 1 1   33    3   68 o    210.4    5.0    0.0000   0.0000          ?        ?   444.4110  21.0712          ?        ?      210.4        5.0       ?       ? 
1 1 1   33    3   69 o     33.0   14.8    0.0000   0.0000          ?        ?    -8.3008  20.4327          ?        ?       33.0       14.8       ?       ? 
1 1 1   33    3   70 o    130.6    7.6    0.0000   0.0000          ?        ?   172.4008  19.7942          ?        ?      130.6        7.6       ?       ? 
1 1 1   33    4    0 o    552.9    3.8 3057.8801  42.1424  3057.8801  42.1424  3057.8801  42.1424      552.9      3.8      552.9        3.8     0.0     0.0 
1 1 1   33    4    1 o   1356.3    4.8    0.0000   0.0000          ?        ? 18398.3613 130.8969          ?        ?     1356.3        4.8       ?       ? 
1 1 1   33    4    2 f    983.9    3.7    0.0000   0.0000          ?        ?  9680.6260  72.7915          ?        ?      983.9        3.7       ?       ? 
1 1 1   33    4    3 o    789.9    3.0    0.0000   0.0000          ?        ?  6238.9946  47.8891          ?        ?      789.9        3.0       ?       ? 
1 1 1   33    4    4 o    889.6    3.4    0.0000   0.0000          ?        ?  7915.1138  61.2981          ?        ?      889.6        3.4       ?       ? 
1 1 1   33    4    5 o    244.7    2.7    0.0000   0.0000          ?        ?   598.9333  13.4090          ?        ?      244.7        2.7       ?       ? 
1 1 1   33    4    6 o   1725.2    5.8    0.0000   0.0000          ?        ? 29768.5176 201.7728          ?        ?     1725.2        5.8       ?       ? 
1 1 1   33    4    7 o   1117.0    4.0    0.0000   0.0000          ?        ? 12478.6289  90.0316          ?        ?     1117.0        4.0       ?       ? 
1 1 1   33    4    8 o    978.9    3.7    0.0000   0.0000          ?        ?  9583.5713  71.5144          ?        ?      978.9        3.7       ?       ? 
1 1 1   33    4    9 o    552.2    2.5    0.0000   0.0000          ?        ?  3048.9407  28.0950          ?        ?      552.2        2.5       ?       ? 
1 1 1   33    4   10 o    884.1    3.3    0.0000   0.0000          ?        ?  7816.1431  58.1055          ?        ?      884.1        3.3       ?       ? 
1 1 1   33    4   11 o   1431.0    5.0    0.0000   0.0000          ?        ? 20480.5820 143.6674          ?        ?     1431.0        5.0       ?       ? 
1 1 1   33    4   12 o   1253.1    4.4    0.0000   0.0000          ?        ? 15703.7998 109.8257          ?        ?     1253.1        4.4       ?       ? 
1 1 1   33    4   13 o   1142.4    4.2    0.0000   0.0000          ?        ? 13052.6592  95.1397          ?        ?     1142.4        4.2       ?       ? 
1 1 1   33    4   14 o    694.9    3.0    0.0000   0.0000          ?        ?  4829.1392  41.5039          ?        ?      694.9        3.0       ?       ? 
1 1 1   33    4   15 o    612.6    2.7    0.0000   0.0000          ?        ?  3752.5918  32.5646          ?        ?      612.6        2.7       ?       ? 
1 1 1   33    4   16 o   1152.9    4.2    0.0000   0.0000          ?        ? 13292.7432  97.0553          ?        ?     1152.9        4.2       ?       ? 
1 1 1   33    4   17 o    504.4    2.4    0.0000   0.0000          ?        ?  2543.8701  24.2638          ?        ?      504.4        2.4       ?       ? 
1 1 1   33    4   18 o    190.6    3.4    0.0000   0.0000          ?        ?   363.3188  12.7704          ?        ?      190.6        3.4       ?       ? 
1 1 1   33    4   19 o    224.2    3.6    0.0000   0.0000          ?        ?   502.5165  15.9630          ?        ?      224.2        3.6       ?       ? 
1 1 1   33    4   20 o    518.8    2.6    0.0000   0.0000          ?        ?  2692.0073  26.8179          ?        ?      518.8        2.6       ?       ? 
1 1 1   33    4   21 o    418.1    2.4    0.0000   0.0000          ?        ?  1748.2721  19.7942          ?        ?      418.1        2.4       ?       ? 
1 1 1   33    4   22 o    558.4    2.7    0.0000   0.0000          ?        ?  3118.5396  30.6490          ?        ?      558.4        2.7       ?       ? 
1 1 1   33    4   23 o    327.5    2.6    0.0000   0.0000          ?        ?  1072.7163  17.2401          ?        ?      327.5        2.6       ?       ? 
1 1 1   33    4   24 o    259.5    3.1    0.0000   0.0000          ?        ?   673.6403  15.9630          ?        ?      259.5        3.1       ?       ? 
1 1 1   33    4   25 o    600.8    2.9    0.0000   0.0000          ?        ?  3609.5627  34.4802          ?        ?      600.8        2.9       ?       ? 
1 1 1   33    4   26 o    214.3    3.6    0.0000   0.0000          ?        ?   459.0970  15.3245          ?        ?      214.3        3.6       ?       ? 
1 1 1   33    4   27 o    239.0    3.3    0.0000   0.0000          ?        ?   571.4769  15.9630          ?        ?      239.0        3.3       ?       ? 
1 1 1   33    4   28 o    806.0    3.2    0.0000   0.0000          ?        ?  6497.5957  51.0817          ?        ?      806.0        3.2       ?       ? 
1 1 1   33    4   29 o    375.3    2.6    0.0000   0.0000          ?        ?  1408.5787  19.7942          ?        ?      375.3        2.6       ?       ? 
1 1 1   33    4   30 o     20.1   10.0    0.0000   0.0000          ?        ?   -37.0343  15.3245          ?        ?       20.1       10.0       ?       ? 
1 1 1   33    4   31 o    404.8    2.5    0.0000   0.0000          ?        ?  1638.4465  20.4327          ?        ?      404.8        2.5       ?       ? 
1 1 1   33    4   32 o    604.3    2.6    0.0000   0.0000          ?        ?  3651.7053  31.9261          ?        ?      604.3        2.6       ?       ? 
1 1 1   33    4   33 o    520.5    2.6    0.0000   0.0000          ?        ?  2709.8857  26.8179          ?        ?      520.5        2.6       ?       ? 
1 1 1   33    4   34 o    423.7    2.5    0.0000   0.0000          ?        ?  1795.5229  21.0712          ?        ?      423.7        2.5       ?       ? 
1 1 1   33    4   35 o    148.8    4.7    0.0000   0.0000          ?        ?   221.5670  14.0475          ?        ?      148.8        4.7       ?       ? 
1 1 1   33    4   36 o    223.7    3.4    0.0000   0.0000          ?        ?   500.6010  15.3245          ?        ?      223.7        3.4       ?       ? 
1 1 1   33    4   37 o    554.3    2.6    0.0000   0.0000          ?        ?  3073.2046  28.7335          ?        ?      554.3        2.6       ?       ? 
1 1 1   33    4   38 o    437.6    2.5    0.0000   0.0000          ?        ?  1915.5648  21.7097          ?        ?      437.6        2.5       ?       ? 
1 1 1   33    4   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    4   40 o    314.1    2.8    0.0000   0.0000          ?        ?   986.5159  17.8786          ?        ?      314.1        2.8       ?       ? 
1 1 1   33    4   41 o     76.1   10.5    0.0000   0.0000          ?        ?    58.1055  15.9630          ?        ?       76.1       10.5       ?       ? 
1 1 1   33    4   42 o    154.3    5.4    0.0000   0.0000          ?        ?   238.1686  16.6016          ?        ?      154.3        5.4       ?       ? 
1 1 1   33    4   43 o    606.3    2.6    0.0000   0.0000          ?        ?  3677.2461  31.9261          ?        ?      606.3        2.6       ?       ? 
1 1 1   33    4   44 o    478.1    2.6    0.0000   0.0000          ?        ?  2286.5459  24.9023          ?        ?      478.1        2.6       ?       ? 
1 1 1   33    4   45 o    216.4    3.7    0.0000   0.0000          ?        ?   468.6749  15.9630          ?        ?      216.4        3.7       ?       ? 
1 1 1   33    4   46 o    308.3    3.1    0.0000   0.0000          ?        ?   950.7587  19.1556          ?        ?      308.3        3.1       ?       ? 
1 1 1   33    4   47 o    120.8    6.3    0.0000   0.0000          ?        ?   146.2215  15.3245          ?        ?      120.8        6.3       ?       ? 
1 1 1   33    4   48 o    284.9    3.2    0.0000   0.0000          ?        ?   812.1995  18.5171          ?        ?      284.9        3.2       ?       ? 
1 1 1   33    4   49 o     36.0   14.7    0.0000   0.0000          ?        ?     5.1082  16.6016          ?        ?       36.0       14.7       ?       ? 
1 1 1   33    4   50 o    151.1    5.7    0.0000   0.0000          ?        ?   228.5907  17.2401          ?        ?      151.1        5.7       ?       ? 
1 1 1   33    4   51 o    383.9    2.7    0.0000   0.0000          ?        ?  1474.3464  21.0712          ?        ?      383.9        2.7       ?       ? 
1 1 1   33    4   52 o    202.7    4.3    0.0000   0.0000          ?        ?   411.2079  17.2401          ?        ?      202.7        4.3       ?       ? 
1 1 1   33    4   53 o     27.2   12.8    0.0000   0.0000          ?        ?   -19.1556  17.8786          ?        ?       27.2       12.8       ?       ? 
1 1 1   33    4   54 o    185.2    4.8    0.0000   0.0000          ?        ?   343.5246  17.8786          ?        ?      185.2        4.8       ?       ? 
1 1 1   33    4   55 o    316.2    3.2    0.0000   0.0000          ?        ?  1000.5634  20.4327          ?        ?      316.2        3.2       ?       ? 
1 1 1   33    4   56 o    459.9    2.8    0.0000   0.0000          ?        ?  2116.0605  25.5409          ?        ?      459.9        2.8       ?       ? 
1 1 1   33    4   57 o    250.1    4.2    0.0000   0.0000          ?        ?   626.3897  21.0712          ?        ?      250.1        4.2       ?       ? 
1 1 1   33    4   58 o    228.9    4.3    0.0000   0.0000          ?        ?   524.8647  19.7942          ?        ?      228.9        4.3       ?       ? 
1 1 1   33    4   59 o    209.4    4.7    0.0000   0.0000          ?        ?   439.3029  19.7942          ?        ?      209.4        4.7       ?       ? 
1 1 1   33    4   60 o    207.1    4.8    0.0000   0.0000          ?        ?   429.7251  19.7942          ?        ?      207.1        4.8       ?       ? 
1 1 1   33    4   61 o    112.1    8.5    0.0000   0.0000          ?        ?   126.4273  19.1556          ?        ?      112.1        8.5       ?       ? 
1 1 1   33    4   62 o     25.9   12.5    0.0000   0.0000          ?        ?   -28.7335  19.1556          ?        ?       25.9       12.5       ?       ? 
1 1 1   33    4   63 o    249.3    4.1    0.0000   0.0000          ?        ?   622.5586  20.4327          ?        ?      249.3        4.1       ?       ? 
1 1 1   33    4   64 o    173.1    5.9    0.0000   0.0000          ?        ?   300.7437  20.4327          ?        ?      173.1        5.9       ?       ? 
1 1 1   33    4   65 o    205.3    5.1    0.0000   0.0000          ?        ?   422.7013  21.0712          ?        ?      205.3        5.1       ?       ? 
1 1 1   33    4   66 o    231.0    4.6    0.0000   0.0000          ?        ?   535.0811  21.0712          ?        ?      231.0        4.6       ?       ? 
1 1 1   33    4   67 o     21.0   10.6    0.0000   0.0000          ?        ?   -58.7440  19.7942          ?        ?       21.0       10.6       ?       ? 
1 1 1   33    4   68 o     38.3   16.1    0.0000   0.0000          ?        ?     3.1926  21.0712          ?        ?       38.3       16.1       ?       ? 
1 1 1   33    4   69 o     61.3   16.0    0.0000   0.0000          ?        ?    40.8654  19.7942          ?        ?       61.3       16.0       ?       ? 
1 1 1   33    4   70 o    138.4    6.9    0.0000   0.0000          ?        ?   193.4720  19.1556          ?        ?      138.4        6.9       ?       ? 
1 1 1   33    5    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    5    1 o    345.9    2.5    0.0000   0.0000          ?        ?  1196.5895  17.2401          ?        ?      345.9        2.5       ?       ? 
1 1 1   33    5    2 o    774.0    3.1    0.0000   0.0000          ?        ?  5990.6099  48.5276          ?        ?      774.0        3.1       ?       ? 
1 1 1   33    5    3 o    488.5    2.4    0.0000   0.0000          ?        ?  2386.1555  22.9868          ?        ?      488.5        2.4       ?       ? 
1 1 1   33    5    4 o    802.8    3.2    0.0000   0.0000          ?        ?  6444.5986  51.0817          ?        ?      802.8        3.2       ?       ? 
1 1 1   33    5    5 o    874.0    3.4    0.0000   0.0000          ?        ?  7639.9111  58.7440          ?        ?      874.0        3.4       ?       ? 
1 1 1   33    5    6 o    639.2    2.8    0.0000   0.0000          ?        ?  4086.5383  35.7572          ?        ?      639.2        2.8       ?       ? 
1 1 1   33    5    7 o    736.7    2.9    0.0000   0.0000          ?        ?  5428.0723  42.7809          ?        ?      736.7        2.9       ?       ? 
1 1 1   33    5    8 o   1016.3    3.7    0.0000   0.0000          ?        ? 10328.7256  75.9841          ?        ?     1016.3        3.7       ?       ? 
1 1 1   33    5    9 o    906.8    3.4    0.0000   0.0000          ?        ?  8224.1582  61.2981          ?        ?      906.8        3.4       ?       ? 
1 1 1   33    5   10 o    889.0    3.5    0.0000   0.0000          ?        ?  7902.9819  61.9366          ?        ?      889.0        3.5       ?       ? 
1 1 1   33    5   11 o    613.7    2.7    0.0000   0.0000          ?        ?  3766.6392  33.2031          ?        ?      613.7        2.7       ?       ? 
1 1 1   33    5   12 o    203.1    3.3    0.0000   0.0000          ?        ?   412.4850  13.4090          ?        ?      203.1        3.3       ?       ? 
1 1 1   33    5   13 o    584.4    2.9    0.0000   0.0000          ?        ?  3414.8135  33.8416          ?        ?      584.4        2.9       ?       ? 
1 1 1   33    5   14 o    429.6    2.4    0.0000   0.0000          ?        ?  1845.3275  20.4327          ?        ?      429.6        2.4       ?       ? 
1 1 1   33    5   15 o    563.3    2.5    0.0000   0.0000          ?        ?  3173.4524  28.0950          ?        ?      563.3        2.5       ?       ? 
1 1 1   33    5   16 o   1028.6    3.8    0.0000   0.0000          ?        ? 10581.5801  79.1767          ?        ?     1028.6        3.8       ?       ? 
1 1 1   33    5   17 o   1114.5    4.0    0.0000   0.0000          ?        ? 12423.0762  89.3930          ?        ?     1114.5        4.0       ?       ? 
1 1 1   33    5   18 o    544.9    2.7    0.0000   0.0000          ?        ?  2969.1255  29.3720          ?        ?      544.9        2.7       ?       ? 
1 1 1   33    5   19 o    341.9    2.4    0.0000   0.0000          ?        ?  1169.1332  16.6016          ?        ?      341.9        2.4       ?       ? 
1 1 1   33    5   20 o    731.0    3.0    0.0000   0.0000          ?        ?  5343.7876  44.0580          ?        ?      731.0        3.0       ?       ? 
1 1 1   33    5   21 o    512.3    2.5    0.0000   0.0000          ?        ?  2624.3240  25.5409          ?        ?      512.3        2.5       ?       ? 
1 1 1   33    5   22 o    724.5    3.0    0.0000   0.0000          ?        ?  5249.9248  44.0580          ?        ?      724.5        3.0       ?       ? 
1 1 1   33    5   23 o   1043.8    3.9    0.0000   0.0000          ?        ? 10896.3711  82.3693          ?        ?     1043.8        3.9       ?       ? 
1 1 1   33    5   24 o   1047.6    4.0    0.0000   0.0000          ?        ? 10975.5488  84.2849          ?        ?     1047.6        4.0       ?       ? 
1 1 1   33    5   25 o    245.2    3.4    0.0000   0.0000          ?        ?   601.4874  16.6016          ?        ?      245.2        3.4       ?       ? 
1 1 1   33    5   26 o    656.3    3.0    0.0000   0.0000          ?        ?  4308.1055  39.5883          ?        ?      656.3        3.0       ?       ? 
1 1 1   33    5   27 o    965.4    3.7    0.0000   0.0000          ?        ?  9322.4160  71.5144          ?        ?      965.4        3.7       ?       ? 
1 1 1   33    5   28 o    394.5    2.8    0.0000   0.0000          ?        ?  1556.0771  21.7097          ?        ?      394.5        2.8       ?       ? 
1 1 1   33    5   29 o    407.5    2.5    0.0000   0.0000          ?        ?  1660.7948  20.4327          ?        ?      407.5        2.5       ?       ? 
1 1 1   33    5   30 o    646.5    2.9    0.0000   0.0000          ?        ?  4179.7622  37.0343          ?        ?      646.5        2.9       ?       ? 
1 1 1   33    5   31 o    404.0    2.4    0.0000   0.0000          ?        ?  1632.6998  19.7942          ?        ?      404.0        2.4       ?       ? 
1 1 1   33    5   32 f    624.8    2.7    0.0000   0.0000          ?        ?  3903.9214  33.2031          ?        ?      624.8        2.7       ?       ? 
1 1 1   33    5   33 o    792.1    3.1    0.0000   0.0000          ?        ?  6275.3906  49.1662          ?        ?      792.1        3.1       ?       ? 
1 1 1   33    5   34 o    116.3    6.3    0.0000   0.0000          ?        ?   135.3666  14.6860          ?        ?      116.3        6.3       ?       ? 
1 1 1   33    5   35 o    488.3    2.6    0.0000   0.0000          ?        ?  2384.2397  24.9023          ?        ?      488.3        2.6       ?       ? 
1 1 1   33    5   36 o    502.1    2.5    0.0000   0.0000          ?        ?  2521.5220  25.5409          ?        ?      502.1        2.5       ?       ? 
1 1 1   33    5   37 o    346.1    2.6    0.0000   0.0000          ?        ?  1197.8666  17.8786          ?        ?      346.1        2.6       ?       ? 
1 1 1   33    5   38 o    436.5    2.7    0.0000   0.0000          ?        ?  1905.3485  23.6253          ?        ?      436.5        2.7       ?       ? 
1 1 1   33    5   39 o    280.3    3.0    0.0000   0.0000          ?        ?   786.0201  16.6016          ?        ?      280.3        3.0       ?       ? 
1 1 1   33    5   40 o    503.4    2.5    0.0000   0.0000          ?        ?  2534.2922  24.9023          ?        ?      503.4        2.5       ?       ? 
1 1 1   33    5   41 o     20.6   10.2    0.0000   0.0000          ?        ?   -38.3113  15.9630          ?        ?       20.6       10.2       ?       ? 
1 1 1   33    5   42 f    366.3    2.7    0.0000   0.0000          ?        ?  1342.1725  19.7942          ?        ?      366.3        2.7       ?       ? 
1 1 1   33    5   43 o    156.3    5.1    0.0000   0.0000          ?        ?   244.5538  15.9630          ?        ?      156.3        5.1       ?       ? 
1 1 1   33    5   44 o    219.7    3.6    0.0000   0.0000          ?        ?   482.7224  15.9630          ?        ?      219.7        3.6       ?       ? 
1 1 1   33    5   45 o    170.8    4.7    0.0000   0.0000          ?        ?   291.8044  15.9630          ?        ?      170.8        4.7       ?       ? 
1 1 1   33    5   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    5   47 o    210.7    3.8    0.0000   0.0000          ?        ?   444.4110  15.9630          ?        ?      210.7        3.8       ?       ? 
1 1 1   33    5   48 o    273.3    3.4    0.0000   0.0000          ?        ?   747.0703  18.5171          ?        ?      273.3        3.4       ?       ? 
1 1 1   33    5   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    5   50 o    383.1    2.8    0.0000   0.0000          ?        ?  1467.9612  21.0712          ?        ?      383.1        2.8       ?       ? 
1 1 1   33    5   51 o     60.3   14.5    0.0000   0.0000          ?        ?    38.3113  17.2401          ?        ?       60.3       14.5       ?       ? 
1 1 1   33    5   52 o    104.3    8.3    0.0000   0.0000          ?        ?   109.1872  17.2401          ?        ?      104.3        8.3       ?       ? 
1 1 1   33    5   53 o    340.8    3.0    0.0000   0.0000          ?        ?  1162.1094  20.4327          ?        ?      340.8        3.0       ?       ? 
1 1 1   33    5   54 o    197.1    4.7    0.0000   0.0000          ?        ?   388.8597  18.5171          ?        ?      197.1        4.7       ?       ? 
1 1 1   33    5   55 o    353.8    3.1    0.0000   0.0000          ?        ?  1252.7794  21.7097          ?        ?      353.8        3.1       ?       ? 
1 1 1   33    5   56 o    203.7    4.7    0.0000   0.0000          ?        ?   415.6776  19.1556          ?        ?      203.7        4.7       ?       ? 
1 1 1   33    5   57 o     26.6   12.7    0.0000   0.0000          ?        ?   -23.6253  18.5171          ?        ?       26.6       12.7       ?       ? 
1 1 1   33    5   58 o    250.1    4.0    0.0000   0.0000          ?        ?   626.3897  19.7942          ?        ?      250.1        4.0       ?       ? 
1 1 1   33    5   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    5   60 o    290.5    3.6    0.0000   0.0000          ?        ?   844.7642  21.0712          ?        ?      290.5        3.6       ?       ? 
1 1 1   33    5   61 o    261.3    3.9    0.0000   0.0000          ?        ?   683.8566  20.4327          ?        ?      261.3        3.9       ?       ? 
1 1 1   33    5   62 o    168.5    5.9    0.0000   0.0000          ?        ?   284.7806  19.7942          ?        ?      168.5        5.9       ?       ? 
1 1 1   33    5   63 o    176.0    5.8    0.0000   0.0000          ?        ?   310.9600  20.4327          ?        ?      176.0        5.8       ?       ? 
1 1 1   33    5   64 o    104.2    9.5    0.0000   0.0000          ?        ?   109.8257  19.7942          ?        ?      104.2        9.5       ?       ? 
1 1 1   33    5   65 o     29.2   13.7    0.0000   0.0000          ?        ?   -18.5171  19.7942          ?        ?       29.2       13.7       ?       ? 
1 1 1   33    5   66 o    225.8    4.7    0.0000   0.0000          ?        ?   511.4558  21.0712          ?        ?      225.8        4.7       ?       ? 
1 1 1   33    5   67 o     30.7   14.1    0.0000   0.0000          ?        ?   -13.4090  19.7942          ?        ?       30.7       14.1       ?       ? 
1 1 1   33    5   68 o    122.3    8.4    0.0000   0.0000          ?        ?   151.3296  20.4327          ?        ?      122.3        8.4       ?       ? 
1 1 1   33    5   69 o     92.3   10.0    0.0000   0.0000          ?        ?    86.8389  18.5171          ?        ?       92.3       10.0       ?       ? 
1 1 1   33    6    0 o    424.4    4.1 1801.9081  34.4802  1801.9081  34.4802  1801.9081  34.4802      424.4      4.1      424.4        4.1     0.0     0.0 
1 1 1   33    6    1 o   1913.3    6.5    0.0000   0.0000          ?        ? 36616.6602 247.1079          ?        ?     1913.3        6.5       ?       ? 
1 1 1   33    6    2 o   1218.0    4.3    0.0000   0.0000          ?        ? 14836.0498 104.0790          ?        ?     1218.0        4.3       ?       ? 
1 1 1   33    6    3 o    768.8    3.0    0.0000   0.0000          ?        ?  5910.7949  46.6121          ?        ?      768.8        3.0       ?       ? 
1 1 1   33    6    4 o   1356.6    4.8    0.0000   0.0000          ?        ? 18405.3867 129.6199          ?        ?     1356.6        4.8       ?       ? 
1 1 1   33    6    5 o   1010.8    3.8    0.0000   0.0000          ?        ? 10218.2617  75.9841          ?        ?     1010.8        3.8       ?       ? 
1 1 1   33    6    6 o    521.3    2.8    0.0000   0.0000          ?        ?  2717.5481  29.3720          ?        ?      521.3        2.8       ?       ? 
1 1 1   33    6    7 f    582.2    2.7    0.0000   0.0000          ?        ?  3389.9114  31.2876          ?        ?      582.2        2.7       ?       ? 
1 1 1   33    6    8 o    934.6    3.7    0.0000   0.0000          ?        ?  8735.6143  68.9603          ?        ?      934.6        3.7       ?       ? 
1 1 1   33    6    9 o   1011.4    3.9    0.0000   0.0000          ?        ? 10230.3936  79.8152          ?        ?     1011.4        3.9       ?       ? 
1 1 1   33    6   10 o    877.7    3.5    0.0000   0.0000          ?        ?  7704.4019  60.6596          ?        ?      877.7        3.5       ?       ? 
1 1 1   33    6   11 o    628.4    2.8    0.0000   0.0000          ?        ?  3948.6179  35.1187          ?        ?      628.4        2.8       ?       ? 
1 1 1   33    6   12 o    778.5    3.2    0.0000   0.0000          ?        ?  6060.8472  49.1662          ?        ?      778.5        3.2       ?       ? 
1 1 1   33    6   13 o    674.4    3.1    0.0000   0.0000          ?        ?  4548.1895  41.5039          ?        ?      674.4        3.1       ?       ? 
1 1 1   33    6   14 o   1271.7    4.4    0.0000   0.0000          ?        ? 16173.7529 111.7413          ?        ?     1271.7        4.4       ?       ? 
1 1 1   33    6   15 f   1182.2    4.2    0.0000   0.0000          ?        ? 13977.8779 100.2479          ?        ?     1182.2        4.2       ?       ? 
1 1 1   33    6   16 o    409.0    2.6    0.0000   0.0000          ?        ?  1672.9266  21.0712          ?        ?      409.0        2.6       ?       ? 
1 1 1   33    6   17 o    244.3    2.9    0.0000   0.0000          ?        ?   597.0177  14.0475          ?        ?      244.3        2.9       ?       ? 
1 1 1   33    6   18 o    943.0    3.7    0.0000   0.0000          ?        ?  8893.3291  70.2374          ?        ?      943.0        3.7       ?       ? 
1 1 1   33    6   19 o   1879.0    6.3    0.0000   0.0000          ?        ? 35319.1836 237.5300          ?        ?     1879.0        6.3       ?       ? 
1 1 1   33    6   20 o    569.5    2.6    0.0000   0.0000          ?        ?  3243.0513  29.3720          ?        ?      569.5        2.6       ?       ? 
1 1 1   33    6   21 o    428.9    2.5    0.0000   0.0000          ?        ?  1839.5808  21.0712          ?        ?      428.9        2.5       ?       ? 
1 1 1   33    6   22 o    385.9    2.7    0.0000   0.0000          ?        ?  1489.6710  21.0712          ?        ?      385.9        2.7       ?       ? 
1 1 1   33    6   23 o    294.3    2.9    0.0000   0.0000          ?        ?   866.4738  17.2401          ?        ?      294.3        2.9       ?       ? 
1 1 1   33    6   24 o    344.1    2.6    0.0000   0.0000          ?        ?  1184.4576  17.8786          ?        ?      344.1        2.6       ?       ? 
1 1 1   33    6   25 o    418.9    2.5    0.0000   0.0000          ?        ?  1754.6573  21.0712          ?        ?      418.9        2.5       ?       ? 
1 1 1   33    6   26 f    800.8    3.3    0.0000   0.0000          ?        ?  6413.9497  52.9973          ?        ?      800.8        3.3       ?       ? 
1 1 1   33    6   27 o   1203.1    4.6    0.0000   0.0000          ?        ? 14479.1172 111.7413          ?        ?     1203.1        4.6       ?       ? 
1 1 1   33    6   28 o   1008.7    3.7    0.0000   0.0000          ?        ? 10176.1191  74.0685          ?        ?     1008.7        3.7       ?       ? 
1 1 1   33    6   29 o    535.7    2.5    0.0000   0.0000          ?        ?  2870.1548  26.8179          ?        ?      535.7        2.5       ?       ? 
1 1 1   33    6   30 o    781.8    3.3    0.0000   0.0000          ?        ?  6112.5674  51.7203          ?        ?      781.8        3.3       ?       ? 
1 1 1   33    6   31 o    586.9    2.7    0.0000   0.0000          ?        ?  3445.4626  31.2876          ?        ?      586.9        2.7       ?       ? 
1 1 1   33    6   32 o    361.7    2.6    0.0000   0.0000          ?        ?  1308.3308  19.1556          ?        ?      361.7        2.6       ?       ? 
1 1 1   33    6   33 o    730.0    3.0    0.0000   0.0000          ?        ?  5330.3784  43.4195          ?        ?      730.0        3.0       ?       ? 
1 1 1   33    6   34 o    297.1    2.9    0.0000   0.0000          ?        ?   883.0754  17.2401          ?        ?      297.1        2.9       ?       ? 
1 1 1   33    6   35 o    813.4    3.1    0.0000   0.0000          ?        ?  6618.2769  51.0817          ?        ?      813.4        3.1       ?       ? 
1 1 1   33    6   36 f    685.9    2.8    0.0000   0.0000          ?        ?  4705.9043  38.9498          ?        ?      685.9        2.8       ?       ? 
1 1 1   33    6   37 o    593.1    2.7    0.0000   0.0000          ?        ?  3518.2542  31.9261          ?        ?      593.1        2.7       ?       ? 
1 1 1   33    6   38 o    256.3    3.2    0.0000   0.0000          ?        ?   657.0388  16.6016          ?        ?      256.3        3.2       ?       ? 
1 1 1   33    6   39 o    368.1    2.5    0.0000   0.0000          ?        ?  1354.9429  18.5171          ?        ?      368.1        2.5       ?       ? 
1 1 1   33    6   40 o    287.5    3.0    0.0000   0.0000          ?        ?   826.8855  17.2401          ?        ?      287.5        3.0       ?       ? 
1 1 1   33    6   41 o    145.8    5.5    0.0000   0.0000          ?        ?   212.6277  15.9630          ?        ?      145.8        5.5       ?       ? 
1 1 1   33    6   42 o    407.6    2.5    0.0000   0.0000          ?        ?  1661.4333  20.4327          ?        ?      407.6        2.5       ?       ? 
1 1 1   33    6   43 o    142.9    5.4    0.0000   0.0000          ?        ?   204.3269  15.3245          ?        ?      142.9        5.4       ?       ? 
1 1 1   33    6   44 o    426.4    2.6    0.0000   0.0000          ?        ?  1818.5095  22.3483          ?        ?      426.4        2.6       ?       ? 
1 1 1   33    6   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    6   46 o     74.3   11.2    0.0000   0.0000          ?        ?    55.5514  16.6016          ?        ?       74.3       11.2       ?       ? 
1 1 1   33    6   47 o    138.3    6.2    0.0000   0.0000          ?        ?   191.5565  17.2401          ?        ?      138.3        6.2       ?       ? 
1 1 1   33    6   48 f    129.5    6.7    0.0000   0.0000          ?        ?   167.9312  17.2401          ?        ?      129.5        6.7       ?       ? 
1 1 1   33    6   49 f    378.8    2.7    0.0000   0.0000          ?        ?  1435.3966  20.4327          ?        ?      378.8        2.7       ?       ? 
1 1 1   33    6   50 o    250.9    3.7    0.0000   0.0000          ?        ?   630.2208  18.5171          ?        ?      250.9        3.7       ?       ? 
1 1 1   33    6   51 o    189.5    4.5    0.0000   0.0000          ?        ?   359.4877  17.2401          ?        ?      189.5        4.5       ?       ? 
1 1 1   33    6   52 o     25.9   12.4    0.0000   0.0000          ?        ?   -23.6253  17.8786          ?        ?       25.9       12.4       ?       ? 
1 1 1   33    6   53 o    252.3    3.8    0.0000   0.0000          ?        ?   637.2446  19.1556          ?        ?      252.3        3.8       ?       ? 
1 1 1   33    6   54 o    145.0    6.2    0.0000   0.0000          ?        ?   210.7121  17.8786          ?        ?      145.0        6.2       ?       ? 
1 1 1   33    6   55 o    179.4    5.2    0.0000   0.0000          ?        ?   322.4534  18.5171          ?        ?      179.4        5.2       ?       ? 
1 1 1   33    6   56 o    285.8    3.5    0.0000   0.0000          ?        ?   817.3077  19.7942          ?        ?      285.8        3.5       ?       ? 
1 1 1   33    6   57 o    413.2    2.7    0.0000   0.0000          ?        ?  1708.6840  22.3483          ?        ?      413.2        2.7       ?       ? 
1 1 1   33    6   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    6   59 o     99.7   10.2    0.0000   0.0000          ?        ?   100.2479  20.4327          ?        ?       99.7       10.2       ?       ? 
1 1 1   33    6   60 o     47.1   16.5    0.0000   0.0000          ?        ?    20.4327  19.1556          ?        ?       47.1       16.5       ?       ? 
1 1 1   33    6   61 o    165.8    6.0    0.0000   0.0000          ?        ?   275.8413  19.7942          ?        ?      165.8        6.0       ?       ? 
1 1 1   33    6   62 o    305.3    3.6    0.0000   0.0000          ?        ?   933.5186  21.7097          ?        ?      305.3        3.6       ?       ? 
1 1 1   33    6   63 o     32.9   14.7    0.0000   0.0000          ?        ?    -7.6623  19.7942          ?        ?       32.9       14.7       ?       ? 
1 1 1   33    6   64 o    171.6    5.8    0.0000   0.0000          ?        ?   295.6355  19.7942          ?        ?      171.6        5.8       ?       ? 
1 1 1   33    6   65 o    158.4    6.5    0.0000   0.0000          ?        ?   252.2160  20.4327          ?        ?      158.4        6.5       ?       ? 
1 1 1   33    6   66 o    102.3    9.4    0.0000   0.0000          ?        ?   105.9946  19.1556          ?        ?      102.3        9.4       ?       ? 
1 1 1   33    6   67 o     84.8   11.3    0.0000   0.0000          ?        ?    73.4300  19.1556          ?        ?       84.8       11.3       ?       ? 
1 1 1   33    6   68 o    179.0    5.7    0.0000   0.0000          ?        ?   322.4534  20.4327          ?        ?      179.0        5.7       ?       ? 
1 1 1   33    6   69 o    105.4    9.1    0.0000   0.0000          ?        ?   113.0183  19.1556          ?        ?      105.4        9.1       ?       ? 
1 1 1   33    7    0 o    174.7    4.2  305.8519  14.6860   305.8519  14.6860   305.8519  14.6860      174.7      4.2      174.7        4.2     0.0     0.0 
1 1 1   33    7    1 f    273.0    2.6    0.0000   0.0000          ?        ?   745.1547  14.0475          ?        ?      273.0        2.6       ?       ? 
1 1 1   33    7    2 o    541.6    2.7    0.0000   0.0000          ?        ?  2933.3684  28.7335          ?        ?      541.6        2.7       ?       ? 
1 1 1   33    7    3 o    585.8    3.0    0.0000   0.0000          ?        ?  3431.4153  35.1187          ?        ?      585.8        3.0       ?       ? 
1 1 1   33    7    4 o   1651.5    5.8    0.0000   0.0000          ?        ? 27278.9219 191.5565          ?        ?     1651.5        5.8       ?       ? 
1 1 1   33    7    5 o    416.6    2.8    0.0000   0.0000          ?        ?  1735.5017  22.9868          ?        ?      416.6        2.8       ?       ? 
1 1 1   33    7    6 o    990.5    4.0    0.0000   0.0000          ?        ?  9812.1611  79.1767          ?        ?      990.5        4.0       ?       ? 
1 1 1   33    7    7 f   1120.4    4.2    0.0000   0.0000          ?        ? 12554.6123  95.1397          ?        ?     1120.4        4.2       ?       ? 
1 1 1   33    7    8 o   1275.2    4.7    0.0000   0.0000          ?        ? 16263.7852 120.6806          ?        ?     1275.2        4.7       ?       ? 
1 1 1   33    7    9 o    483.1    2.7    0.0000   0.0000          ?        ?  2333.7966  26.1794          ?        ?      483.1        2.7       ?       ? 
1 1 1   33    7   10 o   1171.5    4.3    0.0000   0.0000          ?        ? 13726.2988 100.8864          ?        ?     1171.5        4.3       ?       ? 
1 1 1   33    7   11 o    596.9    2.8    0.0000   0.0000          ?        ?  3563.5891  33.2031          ?        ?      596.9        2.8       ?       ? 
1 1 1   33    7   12 o     54.8   12.0    0.0000   0.0000          ?        ?    31.2876  12.7704          ?        ?       54.8       12.0       ?       ? 
1 1 1   33    7   13 o    626.0    2.8    0.0000   0.0000          ?        ?  3919.2456  34.4802          ?        ?      626.0        2.8       ?       ? 
1 1 1   33    7   14 o    940.3    3.6    0.0000   0.0000          ?        ?  8841.6084  67.0448          ?        ?      940.3        3.6       ?       ? 
1 1 1   33    7   15 o    722.7    3.1    0.0000   0.0000          ?        ?  5223.1069  44.6965          ?        ?      722.7        3.1       ?       ? 
1 1 1   33    7   16 o   1430.2    5.1    0.0000   0.0000          ?        ? 20458.8711 146.2215          ?        ?     1430.2        5.1       ?       ? 
1 1 1   33    7   17 o    451.2    2.5    0.0000   0.0000          ?        ?  2035.6068  22.3483          ?        ?      451.2        2.5       ?       ? 
1 1 1   33    7   18 o    567.6    2.8    0.0000   0.0000          ?        ?  3221.9802  31.2876          ?        ?      567.6        2.8       ?       ? 
1 1 1   33    7   19 o    952.4    3.5    0.0000   0.0000          ?        ?  9070.8379  66.4062          ?        ?      952.4        3.5       ?       ? 
1 1 1   33    7   20 o    883.6    3.5    0.0000   0.0000          ?        ?  7807.8428  61.2981          ?        ?      883.6        3.5       ?       ? 
1 1 1   33    7   21 o    296.7    2.8    0.0000   0.0000          ?        ?   880.5213  16.6016          ?        ?      296.7        2.8       ?       ? 
1 1 1   33    7   22 o    451.7    2.5    0.0000   0.0000          ?        ?  2040.7152  22.3483          ?        ?      451.7        2.5       ?       ? 
1 1 1   33    7   23 o    461.3    2.7    0.0000   0.0000          ?        ?  2128.1924  24.9023          ?        ?      461.3        2.7       ?       ? 
1 1 1   33    7   24 o    688.2    2.9    0.0000   0.0000          ?        ?  4737.1919  40.2269          ?        ?      688.2        2.9       ?       ? 
1 1 1   33    7   25 o    255.2    3.3    0.0000   0.0000          ?        ?   651.2921  16.6016          ?        ?      255.2        3.3       ?       ? 
1 1 1   33    7   26 o    376.1    2.8    0.0000   0.0000          ?        ?  1414.9640  21.0712          ?        ?      376.1        2.8       ?       ? 
1 1 1   33    7   27 o    455.4    2.8    0.0000   0.0000          ?        ?  2073.9182  25.5409          ?        ?      455.4        2.8       ?       ? 
1 1 1   33    7   28 o    846.0    3.4    0.0000   0.0000          ?        ?  7159.1040  58.1055          ?        ?      846.0        3.4       ?       ? 
1 1 1   33    7   29 o    286.3    2.8    0.0000   0.0000          ?        ?   819.8618  15.9630          ?        ?      286.3        2.8       ?       ? 
1 1 1   33    7   30 o    967.2    3.7    0.0000   0.0000          ?        ?  9356.2578  71.5144          ?        ?      967.2        3.7       ?       ? 
1 1 1   33    7   31 o    700.4    2.9    0.0000   0.0000          ?        ?  4906.4004  40.8654          ?        ?      700.4        2.9       ?       ? 
1 1 1   33    7   32 o    645.6    2.9    0.0000   0.0000          ?        ?  4168.2690  37.0343          ?        ?      645.6        2.9       ?       ? 
1 1 1   33    7   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    7   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    7   35 o    352.1    2.5    0.0000   0.0000          ?        ?  1240.0090  17.8786          ?        ?      352.1        2.5       ?       ? 
1 1 1   33    7   36 f    169.3    4.3    0.0000   0.0000          ?        ?   286.6962  14.6860          ?        ?      169.3        4.3       ?       ? 
1 1 1   33    7   37 f    394.4    2.5    0.0000   0.0000          ?        ?  1556.0771  19.7942          ?        ?      394.4        2.5       ?       ? 
1 1 1   33    7   38 f    341.0    2.7    0.0000   0.0000          ?        ?  1163.3864  18.5171          ?        ?      341.0        2.7       ?       ? 
1 1 1   33    7   39 o    501.4    2.5    0.0000   0.0000          ?        ?  2514.4980  25.5409          ?        ?      501.4        2.5       ?       ? 
1 1 1   33    7   40 o    327.8    2.7    0.0000   0.0000          ?        ?  1074.6320  17.8786          ?        ?      327.8        2.7       ?       ? 
1 1 1   33    7   41 o    378.7    2.6    0.0000   0.0000          ?        ?  1434.7581  19.7942          ?        ?      378.7        2.6       ?       ? 
1 1 1   33    7   42 o     34.5   14.1    0.0000   0.0000          ?        ?     4.4697  15.3245          ?        ?       34.5       14.1       ?       ? 
1 1 1   33    7   43 o     23.5   11.3    0.0000   0.0000          ?        ?   -22.3483  15.3245          ?        ?       23.5       11.3       ?       ? 
1 1 1   33    7   44 o    235.4    3.8    0.0000   0.0000          ?        ?   554.2368  17.8786          ?        ?      235.4        3.8       ?       ? 
1 1 1   33    7   45 o    169.6    4.9    0.0000   0.0000          ?        ?   287.9732  16.6016          ?        ?      169.6        4.9       ?       ? 
1 1 1   33    7   46 o    130.0    6.4    0.0000   0.0000          ?        ?   169.2082  16.6016          ?        ?      130.0        6.4       ?       ? 
1 1 1   33    7   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    7   48 f    393.5    2.6    0.0000   0.0000          ?        ?  1549.0535  20.4327          ?        ?      393.5        2.6       ?       ? 
1 1 1   33    7   49 o    305.7    3.0    0.0000   0.0000          ?        ?   934.7956  18.5171          ?        ?      305.7        3.0       ?       ? 
1 1 1   33    7   50 o    260.4    3.4    0.0000   0.0000          ?        ?   678.7485  17.8786          ?        ?      260.4        3.4       ?       ? 
1 1 1   33    7   51 o    168.2    5.1    0.0000   0.0000          ?        ?   283.5036  17.2401          ?        ?      168.2        5.1       ?       ? 
1 1 1   33    7   52 o    246.6    3.6    0.0000   0.0000          ?        ?   608.5111  17.8786          ?        ?      246.6        3.6       ?       ? 
1 1 1   33    7   53 o    277.6    3.3    0.0000   0.0000          ?        ?   771.3342  18.5171          ?        ?      277.6        3.3       ?       ? 
1 1 1   33    7   54 o    255.8    3.7    0.0000   0.0000          ?        ?   655.1232  19.1556          ?        ?      255.8        3.7       ?       ? 
1 1 1   33    7   55 o    188.8    5.1    0.0000   0.0000          ?        ?   356.9336  19.1556          ?        ?      188.8        5.1       ?       ? 
1 1 1   33    7   56 o    196.7    4.7    0.0000   0.0000          ?        ?   387.5826  18.5171          ?        ?      196.7        4.7       ?       ? 
1 1 1   33    7   57 o     70.2   14.1    0.0000   0.0000          ?        ?    51.7203  19.1556          ?        ?       70.2       14.1       ?       ? 
1 1 1   33    7   58 o     24.7   12.0    0.0000   0.0000          ?        ?   -31.2876  18.5171          ?        ?       24.7       12.0       ?       ? 
1 1 1   33    7   59 o    229.3    4.2    0.0000   0.0000          ?        ?   526.7803  19.1556          ?        ?      229.3        4.2       ?       ? 
1 1 1   33    7   60 f    183.0    5.4    0.0000   0.0000          ?        ?   335.8624  19.7942          ?        ?      183.0        5.4       ?       ? 
1 1 1   33    7   61 o    288.7    3.8    0.0000   0.0000          ?        ?   834.5477  21.7097          ?        ?      288.7        3.8       ?       ? 
1 1 1   33    7   62 o    105.8    9.7    0.0000   0.0000          ?        ?   113.0183  20.4327          ?        ?      105.8        9.7       ?       ? 
1 1 1   33    7   63 o    132.3    7.2    0.0000   0.0000          ?        ?   176.2320  19.1556          ?        ?      132.3        7.2       ?       ? 
1 1 1   33    7   64 o     39.2   15.8    0.0000   0.0000          ?        ?     7.6623  19.1556          ?        ?       39.2       15.8       ?       ? 
1 1 1   33    7   65 o    198.9    5.0    0.0000   0.0000          ?        ?   397.1605  19.7942          ?        ?      198.9        5.0       ?       ? 
1 1 1   33    7   66 o     57.3   16.4    0.0000   0.0000          ?        ?    35.1187  19.7942          ?        ?       57.3       16.4       ?       ? 
1 1 1   33    7   67 o     99.5   10.3    0.0000   0.0000          ?        ?   100.8864  20.4327          ?        ?       99.5       10.3       ?       ? 
1 1 1   33    7   68 o     31.4   14.1    0.0000   0.0000          ?        ?    -7.6623  18.5171          ?        ?       31.4       14.1       ?       ? 
1 1 1   33    8    0 o    113.0    6.3  128.9814  14.0475   128.9814  14.0475   128.9814  14.0475      113.0      6.3      113.0        6.3     0.0     0.0 
1 1 1   33    8    1 o   1066.6    3.9    0.0000   0.0000          ?        ? 11376.5391  82.3693          ?        ?     1066.6        3.9       ?       ? 
1 1 1   33    8    2 o    705.6    3.2    0.0000   0.0000          ?        ?  4978.5532  45.3350          ?        ?      705.6        3.2       ?       ? 
1 1 1   33    8    3 o   1146.2    4.2    0.0000   0.0000          ?        ? 13138.8594  95.7782          ?        ?     1146.2        4.2       ?       ? 
1 1 1   33    8    4 o    301.4    2.6    0.0000   0.0000          ?        ?   908.6163  15.9630          ?        ?      301.4        2.6       ?       ? 
1 1 1   33    8    5 o   1487.4    5.7    0.0000   0.0000          ?        ? 22129.2441 169.8468          ?        ?     1487.4        5.7       ?       ? 
1 1 1   33    8    6 f    763.7    3.3    0.0000   0.0000          ?        ?  5833.5332  51.0817          ?        ?      763.7        3.3       ?       ? 
1 1 1   33    8    7 o    712.2    3.2    0.0000   0.0000          ?        ?  5072.4160  45.3350          ?        ?      712.2        3.2       ?       ? 
1 1 1   33    8    8 o    858.1    3.7    0.0000   0.0000          ?        ?  7363.4312  63.2136          ?        ?      858.1        3.7       ?       ? 
1 1 1   33    8    9 o    402.2    2.5    0.0000   0.0000          ?        ?  1618.0138  19.7942          ?        ?      402.2        2.5       ?       ? 
1 1 1   33    8   10 o    611.1    2.8    0.0000   0.0000          ?        ?  3734.0745  33.8416          ?        ?      611.1        2.8       ?       ? 
1 1 1   33    8   11 o    522.1    2.6    0.0000   0.0000          ?        ?  2726.4873  27.4564          ?        ?      522.1        2.6       ?       ? 
1 1 1   33    8   12 o    215.9    2.7    0.0000   0.0000          ?        ?   466.1208  11.4934          ?        ?      215.9        2.7       ?       ? 
1 1 1   33    8   13 o    570.0    2.6    0.0000   0.0000          ?        ?  3249.4365  30.0105          ?        ?      570.0        2.6       ?       ? 
1 1 1   33    8   14 o    739.7    2.9    0.0000   0.0000          ?        ?  5472.1304  43.4195          ?        ?      739.7        2.9       ?       ? 
1 1 1   33    8   15 o    138.4    5.3    0.0000   0.0000          ?        ?   191.5565  14.6860          ?        ?      138.4        5.3       ?       ? 
1 1 1   33    8   16 f    598.5    2.8    0.0000   0.0000          ?        ?  3582.1064  33.8416          ?        ?      598.5        2.8       ?       ? 
1 1 1   33    8   17 o    413.4    2.5    0.0000   0.0000          ?        ?  1709.3225  20.4327          ?        ?      413.4        2.5       ?       ? 
1 1 1   33    8   18 f    741.0    3.0    0.0000   0.0000          ?        ?  5491.2861  44.0580          ?        ?      741.0        3.0       ?       ? 
1 1 1   33    8   19 o    276.0    3.1    0.0000   0.0000          ?        ?   761.7563  17.2401          ?        ?      276.0        3.1       ?       ? 
1 1 1   33    8   20 o     35.6   14.0    0.0000   0.0000          ?        ?     7.0237  14.6860          ?        ?       35.6       14.0       ?       ? 
1 1 1   33    8   21 o   1074.4    3.8    0.0000   0.0000          ?        ? 11545.7480  82.3693          ?        ?     1074.4        3.8       ?       ? 
1 1 1   33    8   22 o    663.3    2.9    0.0000   0.0000          ?        ?  4400.0522  38.3113          ?        ?      663.3        2.9       ?       ? 
1 1 1   33    8   23 o   1100.1    4.1    0.0000   0.0000          ?        ? 12103.8154  89.3930          ?        ?     1100.1        4.1       ?       ? 
1 1 1   33    8   24 o    614.3    2.8    0.0000   0.0000          ?        ?  3774.3013  34.4802          ?        ?      614.3        2.8       ?       ? 
1 1 1   33    8   25 o    710.0    3.0    0.0000   0.0000          ?        ?  5041.7666  42.1424          ?        ?      710.0        3.0       ?       ? 
1 1 1   33    8   26 o    241.0    3.0    0.0000   0.0000          ?        ?   581.0547  14.6860          ?        ?      241.0        3.0       ?       ? 
1 1 1   33    8   27 o    378.8    2.6    0.0000   0.0000          ?        ?  1435.3966  19.7942          ?        ?      378.8        2.6       ?       ? 
1 1 1   33    8   28 o    197.3    4.0    0.0000   0.0000          ?        ?   389.4982  15.9630          ?        ?      197.3        4.0       ?       ? 
1 1 1   33    8   29 o    424.2    2.4    0.0000   0.0000          ?        ?  1799.3539  20.4327          ?        ?      424.2        2.4       ?       ? 
1 1 1   33    8   30 o    413.6    2.6    0.0000   0.0000          ?        ?  1710.5994  21.7097          ?        ?      413.6        2.6       ?       ? 
1 1 1   33    8   31 o    272.4    2.9    0.0000   0.0000          ?        ?   741.9621  15.9630          ?        ?      272.4        2.9       ?       ? 
1 1 1   33    8   32 o    564.7    2.6    0.0000   0.0000          ?        ?  3188.7769  29.3720          ?        ?      564.7        2.6       ?       ? 
1 1 1   33    8   33 o    265.8    3.1    0.0000   0.0000          ?        ?   706.8434  16.6016          ?        ?      265.8        3.1       ?       ? 
1 1 1   33    8   34 f    405.9    2.4    0.0000   0.0000          ?        ?  1647.3857  19.7942          ?        ?      405.9        2.4       ?       ? 
1 1 1   33    8   35 f    622.0    2.8    0.0000   0.0000          ?        ?  3869.4412  34.4802          ?        ?      622.0        2.8       ?       ? 
1 1 1   33    8   36 o    342.5    2.6    0.0000   0.0000          ?        ?  1173.6028  17.8786          ?        ?      342.5        2.6       ?       ? 
1 1 1   33    8   37 o    236.2    3.2    0.0000   0.0000          ?        ?   558.0679  15.3245          ?        ?      236.2        3.2       ?       ? 
1 1 1   33    8   38 o    382.5    2.7    0.0000   0.0000          ?        ?  1463.4916  20.4327          ?        ?      382.5        2.7       ?       ? 
1 1 1   33    8   39 o    433.3    2.5    0.0000   0.0000          ?        ?  1877.8921  21.7097          ?        ?      433.3        2.5       ?       ? 
1 1 1   33    8   40 o    358.4    2.7    0.0000   0.0000          ?        ?  1284.7054  19.1556          ?        ?      358.4        2.7       ?       ? 
1 1 1   33    8   41 f    247.7    3.4    0.0000   0.0000          ?        ?   613.6193  16.6016          ?        ?      247.7        3.4       ?       ? 
1 1 1   33    8   42 o    218.2    3.7    0.0000   0.0000          ?        ?   476.3371  15.9630          ?        ?      218.2        3.7       ?       ? 
1 1 1   33    8   43 o    490.2    2.6    0.0000   0.0000          ?        ?  2403.3953  25.5409          ?        ?      490.2        2.6       ?       ? 
1 1 1   33    8   44 o    332.9    2.9    0.0000   0.0000          ?        ?  1108.4736  19.1556          ?        ?      332.9        2.9       ?       ? 
1 1 1   33    8   45 o    334.6    2.9    0.0000   0.0000          ?        ?  1119.9669  19.1556          ?        ?      334.6        2.9       ?       ? 
1 1 1   33    8   46 o    186.8    4.4    0.0000   0.0000          ?        ?   349.2713  16.6016          ?        ?      186.8        4.4       ?       ? 
1 1 1   33    8   47 o    612.1    2.7    0.0000   0.0000          ?        ?  3747.4836  33.2031          ?        ?      612.1        2.7       ?       ? 
1 1 1   33    8   48 o    214.0    4.0    0.0000   0.0000          ?        ?   458.4586  17.2401          ?        ?      214.0        4.0       ?       ? 
1 1 1   33    8   49 o    366.5    2.8    0.0000   0.0000          ?        ?  1343.4495  20.4327          ?        ?      366.5        2.8       ?       ? 
1 1 1   33    8   50 o    229.1    3.8    0.0000   0.0000          ?        ?   525.5033  17.2401          ?        ?      229.1        3.8       ?       ? 
1 1 1   33    8   51 o    172.7    5.0    0.0000   0.0000          ?        ?   298.8281  17.2401          ?        ?      172.7        5.0       ?       ? 
1 1 1   33    8   52 o    128.7    6.7    0.0000   0.0000          ?        ?   166.0156  17.2401          ?        ?      128.7        6.7       ?       ? 
1 1 1   33    8   53 o    213.1    4.3    0.0000   0.0000          ?        ?   454.6274  18.5171          ?        ?      213.1        4.3       ?       ? 
1 1 1   33    8   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    8   55 o    326.8    3.1    0.0000   0.0000          ?        ?  1068.8851  20.4327          ?        ?      326.8        3.1       ?       ? 
1 1 1   33    8   56 o    189.2    5.1    0.0000   0.0000          ?        ?   358.8492  19.1556          ?        ?      189.2        5.1       ?       ? 
1 1 1   33    8   57 o    150.3    6.4    0.0000   0.0000          ?        ?   226.6752  19.1556          ?        ?      150.3        6.4       ?       ? 
1 1 1   33    8   58 o    123.5    7.2    0.0000   0.0000          ?        ?   153.2452  17.8786          ?        ?      123.5        7.2       ?       ? 
1 1 1   33    8   59 o    162.3    5.7    0.0000   0.0000          ?        ?   264.3480  18.5171          ?        ?      162.3        5.7       ?       ? 
1 1 1   33    8   60 o     28.8   13.5    0.0000   0.0000          ?        ?   -17.8786  19.1556          ?        ?       28.8       13.5       ?       ? 
1 1 1   33    8   61 o    117.3    8.2    0.0000   0.0000          ?        ?   138.5592  19.1556          ?        ?      117.3        8.2       ?       ? 
1 1 1   33    8   62 o    248.4    4.0    0.0000   0.0000          ?        ?   618.0889  19.7942          ?        ?      248.4        4.0       ?       ? 
1 1 1   33    8   63 o     31.3   14.2    0.0000   0.0000          ?        ?   -12.1319  19.7942          ?        ?       31.3       14.2       ?       ? 
1 1 1   33    8   64 o     95.2   10.4    0.0000   0.0000          ?        ?    91.9471  19.7942          ?        ?       95.2       10.4       ?       ? 
1 1 1   33    8   65 f     91.7   10.8    0.0000   0.0000          ?        ?    85.5619  19.7942          ?        ?       91.7       10.8       ?       ? 
1 1 1   33    8   66 o     20.8   10.5    0.0000   0.0000          ?        ?   -55.5514  19.1556          ?        ?       20.8       10.5       ?       ? 
1 1 1   33    8   67 o    132.3    7.5    0.0000   0.0000          ?        ?   176.8705  19.7942          ?        ?      132.3        7.5       ?       ? 
1 1 1   33    8   68 o     87.9   10.9    0.0000   0.0000          ?        ?    79.1767  19.1556          ?        ?       87.9       10.9       ?       ? 
1 1 1   33    9    0 o    800.2    4.5 6404.3721  72.7915  6404.3721  72.7915  6404.3721  72.7915      800.2      4.5      800.2        4.5     0.0     0.0 
1 1 1   33    9    1 o    492.5    2.5    0.0000   0.0000          ?        ?  2425.7437  24.9023          ?        ?      492.5        2.5       ?       ? 
1 1 1   33    9    2 o    705.6    3.0    0.0000   0.0000          ?        ?  4978.5532  42.7809          ?        ?      705.6        3.0       ?       ? 
1 1 1   33    9    3 o    907.5    3.6    0.0000   0.0000          ?        ?  8235.6523  64.4907          ?        ?      907.5        3.6       ?       ? 
1 1 1   33    9    4 o    330.1    2.5    0.0000   0.0000          ?        ?  1089.9564  16.6016          ?        ?      330.1        2.5       ?       ? 
1 1 1   33    9    5 o    157.8    3.8    0.0000   0.0000          ?        ?   249.0234  12.1319          ?        ?      157.8        3.8       ?       ? 
1 1 1   33    9    6 o    836.2    3.4    0.0000   0.0000          ?        ?  6992.4502  56.8284          ?        ?      836.2        3.4       ?       ? 
1 1 1   33    9    7 o    394.8    2.3    0.0000   0.0000          ?        ?  1558.6313  18.5171          ?        ?      394.8        2.3       ?       ? 
1 1 1   33    9    8 o    669.3    2.9    0.0000   0.0000          ?        ?  4479.8677  38.3113          ?        ?      669.3        2.9       ?       ? 
1 1 1   33    9    9 o    444.5    2.4    0.0000   0.0000          ?        ?  1975.5858  21.0712          ?        ?      444.5        2.4       ?       ? 
1 1 1   33    9   10 o    410.0    2.4    0.0000   0.0000          ?        ?  1681.2274  19.7942          ?        ?      410.0        2.4       ?       ? 
1 1 1   33    9   11 o   1185.5    4.4    0.0000   0.0000          ?        ? 14055.7773 104.0790          ?        ?     1185.5        4.4       ?       ? 
1 1 1   33    9   12 o    918.2    3.5    0.0000   0.0000          ?        ?  8431.6777  63.8522          ?        ?      918.2        3.5       ?       ? 
1 1 1   33    9   13 o   1356.9    4.8    0.0000   0.0000          ?        ? 18416.2402 131.5355          ?        ?     1356.9        4.8       ?       ? 
1 1 1   33    9   14 o    491.3    2.5    0.0000   0.0000          ?        ?  2413.6118  24.9023          ?        ?      491.3        2.5       ?       ? 
1 1 1   33    9   15 o    280.1    2.7    0.0000   0.0000          ?        ?   784.7431  15.3245          ?        ?      280.1        2.7       ?       ? 
1 1 1   33    9   16 o   1046.5    4.0    0.0000   0.0000          ?        ? 10953.8389  84.2849          ?        ?     1046.5        4.0       ?       ? 
1 1 1   33    9   17 o    635.4    2.8    0.0000   0.0000          ?        ?  4038.0110  35.1187          ?        ?      635.4        2.8       ?       ? 
1 1 1   33    9   18 o    921.1    3.5    0.0000   0.0000          ?        ?  8485.3145  63.8522          ?        ?      921.1        3.5       ?       ? 
1 1 1   33    9   19 f    277.4    3.0    0.0000   0.0000          ?        ?   769.4186  16.6016          ?        ?      277.4        3.0       ?       ? 
1 1 1   33    9   20 o   1092.9    4.0    0.0000   0.0000          ?        ? 11947.3779  88.1160          ?        ?     1092.9        4.0       ?       ? 
1 1 1   33    9   21 f    671.3    2.9    0.0000   0.0000          ?        ?  4506.6855  38.9498          ?        ?      671.3        2.9       ?       ? 
1 1 1   33    9   22 o    809.6    3.1    0.0000   0.0000          ?        ?  6555.7012  50.4432          ?        ?      809.6        3.1       ?       ? 
1 1 1   33    9   23 o    290.0    3.1    0.0000   0.0000          ?        ?   840.9330  17.8786          ?        ?      290.0        3.1       ?       ? 
1 1 1   33    9   24 o    389.1    2.5    0.0000   0.0000          ?        ?  1513.9348  19.7942          ?        ?      389.1        2.5       ?       ? 
1 1 1   33    9   25 o    441.5    2.5    0.0000   0.0000          ?        ?  1949.4065  22.3483          ?        ?      441.5        2.5       ?       ? 
1 1 1   33    9   26 o    593.1    2.7    0.0000   0.0000          ?        ?  3518.2542  32.5646          ?        ?      593.1        2.7       ?       ? 
1 1 1   33    9   27 o    744.5    3.1    0.0000   0.0000          ?        ?  5543.6450  46.6121          ?        ?      744.5        3.1       ?       ? 
1 1 1   33    9   28 o    651.9    2.8    0.0000   0.0000          ?        ?  4250.6387  37.0343          ?        ?      651.9        2.8       ?       ? 
1 1 1   33    9   29 o    636.9    2.8    0.0000   0.0000          ?        ?  4057.1665  35.1187          ?        ?      636.9        2.8       ?       ? 
1 1 1   33    9   30 o    237.2    3.0    0.0000   0.0000          ?        ?   562.5375  14.0475          ?        ?      237.2        3.0       ?       ? 
1 1 1   33    9   31 o    216.0    3.4    0.0000   0.0000          ?        ?   466.7593  14.6860          ?        ?      216.0        3.4       ?       ? 
1 1 1   33    9   32 o    298.4    2.8    0.0000   0.0000          ?        ?   890.7377  16.6016          ?        ?      298.4        2.8       ?       ? 
1 1 1   33    9   33 o    444.9    2.6    0.0000   0.0000          ?        ?  1980.0555  22.9868          ?        ?      444.9        2.6       ?       ? 
1 1 1   33    9   34 o    172.8    4.4    0.0000   0.0000          ?        ?   298.8281  15.3245          ?        ?      172.8        4.4       ?       ? 
1 1 1   33    9   35 o    168.3    4.6    0.0000   0.0000          ?        ?   283.5036  15.3245          ?        ?      168.3        4.6       ?       ? 
1 1 1   33    9   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    9   37 o    185.3    4.1    0.0000   0.0000          ?        ?   343.5246  15.3245          ?        ?      185.3        4.1       ?       ? 
1 1 1   33    9   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33    9   39 o    327.3    2.8    0.0000   0.0000          ?        ?  1071.4393  18.5171          ?        ?      327.3        2.8       ?       ? 
1 1 1   33    9   40 o     28.8   12.9    0.0000   0.0000          ?        ?    -7.0237  15.3245          ?        ?       28.8       12.9       ?       ? 
1 1 1   33    9   41 o    200.2    4.0    0.0000   0.0000          ?        ?   400.9916  15.9630          ?        ?      200.2        4.0       ?       ? 
1 1 1   33    9   42 o    186.1    4.3    0.0000   0.0000          ?        ?   346.7172  15.9630          ?        ?      186.1        4.3       ?       ? 
1 1 1   33    9   43 o    435.4    2.6    0.0000   0.0000          ?        ?  1896.4092  22.9868          ?        ?      435.4        2.6       ?       ? 
1 1 1   33    9   44 o    197.1    4.2    0.0000   0.0000          ?        ?   388.8597  16.6016          ?        ?      197.1        4.2       ?       ? 
1 1 1   33    9   45 o     17.6    8.9    0.0000   0.0000          ?        ?   -57.4669  15.9630          ?        ?       17.6        8.9       ?       ? 
1 1 1   33    9   46 o    209.7    4.4    0.0000   0.0000          ?        ?   439.9414  18.5171          ?        ?      209.7        4.4       ?       ? 
1 1 1   33    9   47 o    278.0    3.2    0.0000   0.0000          ?        ?   773.2497  17.8786          ?        ?      278.0        3.2       ?       ? 
1 1 1   33    9   48 o    299.7    3.3    0.0000   0.0000          ?        ?   899.0385  19.7942          ?        ?      299.7        3.3       ?       ? 
1 1 1   33    9   49 o    125.1    7.1    0.0000   0.0000          ?        ?   157.0763  17.8786          ?        ?      125.1        7.1       ?       ? 
1 1 1   33    9   50 f    285.0    3.4    0.0000   0.0000          ?        ?   812.8381  19.1556          ?        ?      285.0        3.4       ?       ? 
1 1 1   33    9   51 o    206.2    4.5    0.0000   0.0000          ?        ?   425.8939  18.5171          ?        ?      206.2        4.5       ?       ? 
1 1 1   33    9   52 o    345.7    3.0    0.0000   0.0000          ?        ?  1195.9510  21.0712          ?        ?      345.7        3.0       ?       ? 
1 1 1   33    9   53 o    221.7    4.3    0.0000   0.0000          ?        ?   492.3002  19.1556          ?        ?      221.7        4.3       ?       ? 
1 1 1   33    9   54 o     69.8   13.7    0.0000   0.0000          ?        ?    51.0817  18.5171          ?        ?       69.8       13.7       ?       ? 
1 1 1   33    9   55 o    244.2    4.1    0.0000   0.0000          ?        ?   597.0177  19.7942          ?        ?      244.2        4.1       ?       ? 
1 1 1   33    9   56 o    161.6    5.9    0.0000   0.0000          ?        ?   261.7939  19.1556          ?        ?      161.6        5.9       ?       ? 
1 1 1   33    9   57 o    122.4    7.8    0.0000   0.0000          ?        ?   150.6911  19.1556          ?        ?      122.4        7.8       ?       ? 
1 1 1   33    9   58 o    255.2    3.9    0.0000   0.0000          ?        ?   651.9305  19.7942          ?        ?      255.2        3.9       ?       ? 
1 1 1   33    9   59 o    127.0    7.5    0.0000   0.0000          ?        ?   162.1845  19.1556          ?        ?      127.0        7.5       ?       ? 
1 1 1   33    9   60 o     62.9   15.3    0.0000   0.0000          ?        ?    42.1424  19.1556          ?        ?       62.9       15.3       ?       ? 
1 1 1   33    9   61 o     29.6   13.8    0.0000   0.0000          ?        ?   -17.2401  19.7942          ?        ?       29.6       13.8       ?       ? 
1 1 1   33    9   62 o    132.3    7.7    0.0000   0.0000          ?        ?   176.2320  20.4327          ?        ?      132.3        7.7       ?       ? 
1 1 1   33    9   63 o    157.0    6.3    0.0000   0.0000          ?        ?   247.7464  19.7942          ?        ?      157.0        6.3       ?       ? 
1 1 1   33    9   64 o     88.9   10.8    0.0000   0.0000          ?        ?    80.4537  19.1556          ?        ?       88.9       10.8       ?       ? 
1 1 1   33    9   65 o    136.2    7.3    0.0000   0.0000          ?        ?   187.0868  19.7942          ?        ?      136.2        7.3       ?       ? 
1 1 1   33    9   66 f    123.6    8.0    0.0000   0.0000          ?        ?   154.5222  19.7942          ?        ?      123.6        8.0       ?       ? 
1 1 1   33    9   67 o    107.2    9.2    0.0000   0.0000          ?        ?   116.8494  19.7942          ?        ?      107.2        9.2       ?       ? 
1 1 1   33   10    0 o    497.6    4.4 2476.8254  43.4195  2476.8254  43.4195  2476.8254  43.4195      497.6      4.4      497.6        4.4     0.0     0.0 
1 1 1   33   10    1 o   1633.8    5.9    0.0000   0.0000          ?        ? 26698.5039 191.5565          ?        ?     1633.8        5.9       ?       ? 
1 1 1   33   10    2 o    144.3    4.6    0.0000   0.0000          ?        ?   208.1580  13.4090          ?        ?      144.3        4.6       ?       ? 
1 1 1   33   10    3 o    466.2    2.6    0.0000   0.0000          ?        ?  2173.5276  24.2638          ?        ?      466.2        2.6       ?       ? 
1 1 1   33   10    4 o    831.6    3.4    0.0000   0.0000          ?        ?  6916.4658  56.1899          ?        ?      831.6        3.4       ?       ? 
1 1 1   33   10    5 o   1065.3    4.1    0.0000   0.0000          ?        ? 11349.7217  88.1160          ?        ?     1065.3        4.1       ?       ? 
1 1 1   33   10    6 o    914.7    3.6    0.0000   0.0000          ?        ?  8367.8262  65.7677          ?        ?      914.7        3.6       ?       ? 
1 1 1   33   10    7 o    714.7    3.0    0.0000   0.0000          ?        ?  5108.8115  42.7809          ?        ?      714.7        3.0       ?       ? 
1 1 1   33   10    8 o    863.7    3.4    0.0000   0.0000          ?        ?  7461.1250  59.3825          ?        ?      863.7        3.4       ?       ? 
1 1 1   33   10    9 o    103.9    5.2    0.0000   0.0000          ?        ?   107.9102  10.8549          ?        ?      103.9        5.2       ?       ? 
1 1 1   33   10   10 o   1136.4    4.1    0.0000   0.0000          ?        ? 12915.3770  93.2242          ?        ?     1136.4        4.1       ?       ? 
1 1 1   33   10   11 o    498.2    2.6    0.0000   0.0000          ?        ?  2482.5720  25.5409          ?        ?      498.2        2.6       ?       ? 
1 1 1   33   10   12 o    643.5    2.7    0.0000   0.0000          ?        ?  4140.8130  34.4802          ?        ?      643.5        2.7       ?       ? 
1 1 1   33   10   13 o    533.7    2.5    0.0000   0.0000          ?        ?  2848.4451  26.8179          ?        ?      533.7        2.5       ?       ? 
1 1 1   33   10   14 o   1066.3    4.0    0.0000   0.0000          ?        ? 11372.7090  84.9234          ?        ?     1066.3        4.0       ?       ? 
1 1 1   33   10   15 o    382.8    2.3    0.0000   0.0000          ?        ?  1465.4071  17.8786          ?        ?      382.8        2.3       ?       ? 
1 1 1   33   10   16 o    196.7    3.2    0.0000   0.0000          ?        ?   386.9441  12.7704          ?        ?      196.7        3.2       ?       ? 
1 1 1   33   10   17 o    417.6    2.4    0.0000   0.0000          ?        ?  1743.8026  19.7942          ?        ?      417.6        2.4       ?       ? 
1 1 1   33   10   18 o    367.3    2.4    0.0000   0.0000          ?        ?  1349.1962  17.8786          ?        ?      367.3        2.4       ?       ? 
1 1 1   33   10   19 o    752.2    3.1    0.0000   0.0000          ?        ?  5657.9399  45.9736          ?        ?      752.2        3.1       ?       ? 
1 1 1   33   10   20 o    491.3    2.5    0.0000   0.0000          ?        ?  2413.6118  24.2638          ?        ?      491.3        2.5       ?       ? 
1 1 1   33   10   21 o    243.5    3.0    0.0000   0.0000          ?        ?   593.1866  14.6860          ?        ?      243.5        3.0       ?       ? 
1 1 1   33   10   22 o    408.0    2.4    0.0000   0.0000          ?        ?  1664.6260  19.7942          ?        ?      408.0        2.4       ?       ? 
1 1 1   33   10   23 o    927.7    3.5    0.0000   0.0000          ?        ?  8607.9102  64.4907          ?        ?      927.7        3.5       ?       ? 
1 1 1   33   10   24 o     66.3   10.6    0.0000   0.0000          ?        ?    44.0580  14.0475          ?        ?       66.3       10.6       ?       ? 
1 1 1   33   10   25 o    369.4    2.5    0.0000   0.0000          ?        ?  1364.5208  18.5171          ?        ?      369.4        2.5       ?       ? 
1 1 1   33   10   26 o    174.5    4.0    0.0000   0.0000          ?        ?   304.5748  14.0475          ?        ?      174.5        4.0       ?       ? 
1 1 1   33   10   27 o    268.5    3.1    0.0000   0.0000          ?        ?   720.8909  16.6016          ?        ?      268.5        3.1       ?       ? 
1 1 1   33   10   28 o    629.8    2.7    0.0000   0.0000          ?        ?  3966.4963  34.4802          ?        ?      629.8        2.7       ?       ? 
1 1 1   33   10   29 o    625.1    2.9    0.0000   0.0000          ?        ?  3908.3906  35.7572          ?        ?      625.1        2.9       ?       ? 
1 1 1   33   10   30 o    694.3    2.9    0.0000   0.0000          ?        ?  4821.4766  40.8654          ?        ?      694.3        2.9       ?       ? 
1 1 1   33   10   31 o    266.0    2.9    0.0000   0.0000          ?        ?   707.4820  15.3245          ?        ?      266.0        2.9       ?       ? 
1 1 1   33   10   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   10   33 o    651.9    2.7    0.0000   0.0000          ?        ?  4250.6387  35.7572          ?        ?      651.9        2.7       ?       ? 
1 1 1   33   10   34 o    547.0    2.6    0.0000   0.0000          ?        ?  2992.7510  28.0950          ?        ?      547.0        2.6       ?       ? 
1 1 1   33   10   35 o    397.0    2.5    0.0000   0.0000          ?        ?  1576.5099  19.7942          ?        ?      397.0        2.5       ?       ? 
1 1 1   33   10   36 o     16.7    8.5    0.0000   0.0000          ?        ?   -49.1662  14.0475          ?        ?       16.7        8.5       ?       ? 
1 1 1   33   10   37 o    137.6    5.6    0.0000   0.0000          ?        ?   189.6409  15.3245          ?        ?      137.6        5.6       ?       ? 
1 1 1   33   10   38 f    781.0    3.0    0.0000   0.0000          ?        ?  6101.7124  47.2506          ?        ?      781.0        3.0       ?       ? 
1 1 1   33   10   39 o    528.3    2.6    0.0000   0.0000          ?        ?  2791.6167  27.4564          ?        ?      528.3        2.6       ?       ? 
1 1 1   33   10   40 o    236.2    3.4    0.0000   0.0000          ?        ?   558.0679  15.9630          ?        ?      236.2        3.4       ?       ? 
1 1 1   33   10   41 o    284.8    3.3    0.0000   0.0000          ?        ?   811.5610  18.5171          ?        ?      284.8        3.3       ?       ? 
1 1 1   33   10   42 f    301.9    3.0    0.0000   0.0000          ?        ?   911.8089  17.8786          ?        ?      301.9        3.0       ?       ? 
1 1 1   33   10   43 o    433.9    2.6    0.0000   0.0000          ?        ?  1883.0002  22.9868          ?        ?      433.9        2.6       ?       ? 
1 1 1   33   10   44 o    187.7    4.6    0.0000   0.0000          ?        ?   352.4639  17.2401          ?        ?      187.7        4.6       ?       ? 
1 1 1   33   10   45 o    204.7    4.1    0.0000   0.0000          ?        ?   419.5087  16.6016          ?        ?      204.7        4.1       ?       ? 
1 1 1   33   10   46 o    294.2    3.3    0.0000   0.0000          ?        ?   865.8354  19.1556          ?        ?      294.2        3.3       ?       ? 
1 1 1   33   10   47 o    120.5    7.2    0.0000   0.0000          ?        ?   145.5829  17.2401          ?        ?      120.5        7.2       ?       ? 
1 1 1   33   10   48 o    174.8    4.9    0.0000   0.0000          ?        ?   305.8519  17.2401          ?        ?      174.8        4.9       ?       ? 
1 1 1   33   10   49 o    502.0    2.7    0.0000   0.0000          ?        ?  2521.5220  27.4564          ?        ?      502.0        2.7       ?       ? 
1 1 1   33   10   50 o    100.9    8.5    0.0000   0.0000          ?        ?   102.1635  17.2401          ?        ?      100.9        8.5       ?       ? 
1 1 1   33   10   51 o    337.7    3.1    0.0000   0.0000          ?        ?  1141.0381  21.0712          ?        ?      337.7        3.1       ?       ? 
1 1 1   33   10   52 o    198.8    4.7    0.0000   0.0000          ?        ?   395.8834  18.5171          ?        ?      198.8        4.7       ?       ? 
1 1 1   33   10   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   10   54 o    185.7    5.0    0.0000   0.0000          ?        ?   345.4402  18.5171          ?        ?      185.7        5.0       ?       ? 
1 1 1   33   10   55 o     24.9   12.1    0.0000   0.0000          ?        ?   -33.2031  19.1556          ?        ?       24.9       12.1       ?       ? 
1 1 1   33   10   56 o     43.1   16.1    0.0000   0.0000          ?        ?    14.6860  18.5171          ?        ?       43.1       16.1       ?       ? 
1 1 1   33   10   57 o     65.0   14.1    0.0000   0.0000          ?        ?    44.6965  17.8786          ?        ?       65.0       14.1       ?       ? 
1 1 1   33   10   58 o    210.0    4.7    0.0000   0.0000          ?        ?   441.8569  19.7942          ?        ?      210.0        4.7       ?       ? 
1 1 1   33   10   59 o    109.1    9.1    0.0000   0.0000          ?        ?   120.0421  19.7942          ?        ?      109.1        9.1       ?       ? 
1 1 1   33   10   60 o     53.3   16.4    0.0000   0.0000          ?        ?    29.3720  19.1556          ?        ?       53.3       16.4       ?       ? 
1 1 1   33   10   61 o     61.8   16.3    0.0000   0.0000          ?        ?    40.8654  20.4327          ?        ?       61.8       16.3       ?       ? 
1 1 1   33   10   62 o    119.9    8.3    0.0000   0.0000          ?        ?   144.9444  19.7942          ?        ?      119.9        8.3       ?       ? 
1 1 1   33   10   63 o     26.9   12.9    0.0000   0.0000          ?        ?   -26.8179  19.7942          ?        ?       26.9       12.9       ?       ? 
1 1 1   33   10   64 o    292.4    3.6    0.0000   0.0000          ?        ?   856.8960  21.0712          ?        ?      292.4        3.6       ?       ? 
1 1 1   33   10   65 o     44.5   16.6    0.0000   0.0000          ?        ?    16.6016  19.7942          ?        ?       44.5       16.6       ?       ? 
1 1 1   33   10   66 o     24.6   12.0    0.0000   0.0000          ?        ?   -33.8416  19.1556          ?        ?       24.6       12.0       ?       ? 
1 1 1   33   10   67 o    121.1    8.2    0.0000   0.0000          ?        ?   148.7755  19.7942          ?        ?      121.1        8.2       ?       ? 
1 1 1   33   11    0 o    241.0    3.6  581.0547  17.2401   581.0547  17.2401   581.0547  17.2401      241.0      3.6      241.0        3.6     0.0     0.0 
1 1 1   33   11    1 f    596.6    2.8    0.0000   0.0000          ?        ?  3559.1196  33.2031          ?        ?      596.6        2.8       ?       ? 
1 1 1   33   11    2 o    632.1    2.7    0.0000   0.0000          ?        ?  3995.2300  33.8416          ?        ?      632.1        2.7       ?       ? 
1 1 1   33   11    3 o    645.9    2.8    0.0000   0.0000          ?        ?  4172.7388  35.7572          ?        ?      645.9        2.8       ?       ? 
1 1 1   33   11    4 o    309.8    2.3    0.0000   0.0000          ?        ?   959.6980  14.0475          ?        ?      309.8        2.3       ?       ? 
1 1 1   33   11    5 o    791.3    3.3    0.0000   0.0000          ?        ?  6262.6201  51.7203          ?        ?      791.3        3.3       ?       ? 
1 1 1   33   11    6 o    974.5    3.8    0.0000   0.0000          ?        ?  9498.0088  74.0685          ?        ?      974.5        3.8       ?       ? 
1 1 1   33   11    7 o    482.6    2.6    0.0000   0.0000          ?        ?  2328.6885  25.5409          ?        ?      482.6        2.6       ?       ? 
1 1 1   33   11    8 o   1075.1    4.0    0.0000   0.0000          ?        ? 11559.7959  86.8389          ?        ?     1075.1        4.0       ?       ? 
1 1 1   33   11    9 o    216.9    2.5    0.0000   0.0000          ?        ?   470.5904  10.8549          ?        ?      216.9        2.5       ?       ? 
1 1 1   33   11   10 o    105.1    4.9    0.0000   0.0000          ?        ?   110.4642  10.2163          ?        ?      105.1        4.9       ?       ? 
1 1 1   33   11   11 f    459.2    2.5    0.0000   0.0000          ?        ?  2109.0369  22.9868          ?        ?      459.2        2.5       ?       ? 
1 1 1   33   11   12 o    372.2    2.4    0.0000   0.0000          ?        ?  1385.5919  17.8786          ?        ?      372.2        2.4       ?       ? 
1 1 1   33   11   13 o    339.2    2.4    0.0000   0.0000          ?        ?  1150.6160  15.9630          ?        ?      339.2        2.4       ?       ? 
1 1 1   33   11   14 o    758.4    3.1    0.0000   0.0000          ?        ?  5752.4414  46.6121          ?        ?      758.4        3.1       ?       ? 
1 1 1   33   11   15 o    816.1    3.2    0.0000   0.0000          ?        ?  6661.0571  52.3588          ?        ?      816.1        3.2       ?       ? 
1 1 1   33   11   16 o    179.6    3.2    0.0000   0.0000          ?        ?   322.4534  11.4934          ?        ?      179.6        3.2       ?       ? 
1 1 1   33   11   17 o    560.7    2.7    0.0000   0.0000          ?        ?  3144.0806  30.0105          ?        ?      560.7        2.7       ?       ? 
1 1 1   33   11   18 f    450.5    2.5    0.0000   0.0000          ?        ?  2029.8602  22.3483          ?        ?      450.5        2.5       ?       ? 
1 1 1   33   11   19 o    736.1    2.9    0.0000   0.0000          ?        ?  5419.1333  43.4195          ?        ?      736.1        2.9       ?       ? 
1 1 1   33   11   20 o     37.2   13.7    0.0000   0.0000          ?        ?    10.8549  13.4090          ?        ?       37.2       13.7       ?       ? 
1 1 1   33   11   21 o    320.9    2.7    0.0000   0.0000          ?        ?  1029.9354  17.2401          ?        ?      320.9        2.7       ?       ? 
1 1 1   33   11   22 o    263.6    2.8    0.0000   0.0000          ?        ?   694.7115  14.6860          ?        ?      263.6        2.8       ?       ? 
1 1 1   33   11   23 o    430.1    2.4    0.0000   0.0000          ?        ?  1850.4355  21.0712          ?        ?      430.1        2.4       ?       ? 
1 1 1   33   11   24 o    339.7    2.5    0.0000   0.0000          ?        ?  1153.8086  17.2401          ?        ?      339.7        2.5       ?       ? 
1 1 1   33   11   25 o    195.7    3.6    0.0000   0.0000          ?        ?   383.1130  14.0475          ?        ?      195.7        3.6       ?       ? 
1 1 1   33   11   26 o    380.4    2.4    0.0000   0.0000          ?        ?  1446.8900  18.5171          ?        ?      380.4        2.4       ?       ? 
1 1 1   33   11   27 o    454.3    2.5    0.0000   0.0000          ?        ?  2064.3403  22.3483          ?        ?      454.3        2.5       ?       ? 
1 1 1   33   11   28 o    454.1    2.5    0.0000   0.0000          ?        ?  2062.4248  22.3483          ?        ?      454.1        2.5       ?       ? 
1 1 1   33   11   29 o    296.9    2.9    0.0000   0.0000          ?        ?   881.7984  17.2401          ?        ?      296.9        2.9       ?       ? 
1 1 1   33   11   30 o    866.3    3.3    0.0000   0.0000          ?        ?  7507.0986  57.4669          ?        ?      866.3        3.3       ?       ? 
1 1 1   33   11   31 o     40.0   14.1    0.0000   0.0000          ?        ?    14.0475  14.0475          ?        ?       40.0       14.1       ?       ? 
1 1 1   33   11   32 o    845.0    3.3    0.0000   0.0000          ?        ?  7142.5029  55.5514          ?        ?      845.0        3.3       ?       ? 
1 1 1   33   11   33 o    460.2    2.4    0.0000   0.0000          ?        ?  2117.9763  22.3483          ?        ?      460.2        2.4       ?       ? 
1 1 1   33   11   34 o     82.9    8.9    0.0000   0.0000          ?        ?    68.9603  14.6860          ?        ?       82.9        8.9       ?       ? 
1 1 1   33   11   35 o    415.5    2.5    0.0000   0.0000          ?        ?  1726.5625  21.0712          ?        ?      415.5        2.5       ?       ? 
1 1 1   33   11   36 o     47.0   14.3    0.0000   0.0000          ?        ?    22.3483  14.6860          ?        ?       47.0       14.3       ?       ? 
1 1 1   33   11   37 o    201.0    3.7    0.0000   0.0000          ?        ?   404.1842  14.6860          ?        ?      201.0        3.7       ?       ? 
1 1 1   33   11   38 o    469.9    2.5    0.0000   0.0000          ?        ?  2208.6462  23.6253          ?        ?      469.9        2.5       ?       ? 
1 1 1   33   11   39 o    430.9    2.6    0.0000   0.0000          ?        ?  1856.8208  22.3483          ?        ?      430.9        2.6       ?       ? 
1 1 1   33   11   40 o    332.4    2.7    0.0000   0.0000          ?        ?  1105.2810  17.8786          ?        ?      332.4        2.7       ?       ? 
1 1 1   33   11   41 o    253.4    3.3    0.0000   0.0000          ?        ?   642.3527  16.6016          ?        ?      253.4        3.3       ?       ? 
1 1 1   33   11   42 o     20.8   10.3    0.0000   0.0000          ?        ?   -37.0343  15.9630          ?        ?       20.8       10.3       ?       ? 
1 1 1   33   11   43 o     18.1    9.1    0.0000   0.0000          ?        ?   -54.2743  15.9630          ?        ?       18.1        9.1       ?       ? 
1 1 1   33   11   44 o    382.0    2.7    0.0000   0.0000          ?        ?  1459.6605  20.4327          ?        ?      382.0        2.7       ?       ? 
1 1 1   33   11   45 o    502.2    2.6    0.0000   0.0000          ?        ?  2522.7991  26.1794          ?        ?      502.2        2.6       ?       ? 
1 1 1   33   11   46 o    161.3    5.3    0.0000   0.0000          ?        ?   260.5168  17.2401          ?        ?      161.3        5.3       ?       ? 
1 1 1   33   11   47 o    143.9    5.8    0.0000   0.0000          ?        ?   207.5195  16.6016          ?        ?      143.9        5.8       ?       ? 
1 1 1   33   11   48 o     30.4   13.8    0.0000   0.0000          ?        ?    -9.5778  17.8786          ?        ?       30.4       13.8       ?       ? 
1 1 1   33   11   49 o    424.5    2.8    0.0000   0.0000          ?        ?  1802.5465  23.6253          ?        ?      424.5        2.8       ?       ? 
1 1 1   33   11   50 o    259.6    3.6    0.0000   0.0000          ?        ?   674.2788  18.5171          ?        ?      259.6        3.6       ?       ? 
1 1 1   33   11   51 o     97.3    9.2    0.0000   0.0000          ?        ?    95.1397  17.8786          ?        ?       97.3        9.2       ?       ? 
1 1 1   33   11   52 o     61.8   13.8    0.0000   0.0000          ?        ?    40.2269  16.6016          ?        ?       61.8       13.8       ?       ? 
1 1 1   33   11   53 o     95.3    9.4    0.0000   0.0000          ?        ?    91.3086  17.8786          ?        ?       95.3        9.4       ?       ? 
1 1 1   33   11   54 o    314.3    3.4    0.0000   0.0000          ?        ?   988.4315  21.0712          ?        ?      314.3        3.4       ?       ? 
1 1 1   33   11   55 o    314.5    3.2    0.0000   0.0000          ?        ?   989.7085  20.4327          ?        ?      314.5        3.2       ?       ? 
1 1 1   33   11   56 o    395.0    3.0    0.0000   0.0000          ?        ?  1561.1854  23.6253          ?        ?      395.0        3.0       ?       ? 
1 1 1   33   11   57 o    110.1    8.4    0.0000   0.0000          ?        ?   121.9576  18.5171          ?        ?      110.1        8.4       ?       ? 
1 1 1   33   11   58 o    245.4    4.2    0.0000   0.0000          ?        ?   603.4030  20.4327          ?        ?      245.4        4.2       ?       ? 
1 1 1   33   11   59 o    206.9    4.8    0.0000   0.0000          ?        ?   429.0865  19.7942          ?        ?      206.9        4.8       ?       ? 
1 1 1   33   11   60 o    110.2    9.0    0.0000   0.0000          ?        ?   122.5962  19.7942          ?        ?      110.2        9.0       ?       ? 
1 1 1   33   11   61 o    187.6    5.3    0.0000   0.0000          ?        ?   353.1024  19.7942          ?        ?      187.6        5.3       ?       ? 
1 1 1   33   11   62 o     24.1   11.9    0.0000   0.0000          ?        ?   -43.4195  20.4327          ?        ?       24.1       11.9       ?       ? 
1 1 1   33   11   63 o    179.7    5.5    0.0000   0.0000          ?        ?   324.3690  19.7942          ?        ?      179.7        5.5       ?       ? 
1 1 1   33   11   64 o    101.2    9.8    0.0000   0.0000          ?        ?   104.0790  19.7942          ?        ?      101.2        9.8       ?       ? 
1 1 1   33   11   65 o     26.2   12.6    0.0000   0.0000          ?        ?   -26.8179  19.1556          ?        ?       26.2       12.6       ?       ? 
1 1 1   33   11   66 o     21.9   10.9    0.0000   0.0000          ?        ?   -44.6965  18.5171          ?        ?       21.9       10.9       ?       ? 
1 1 1   33   12    0 o    464.4    4.0 2156.9260  37.0343  2156.9260  37.0343  2156.9260  37.0343      464.4      4.0      464.4        4.0     0.0     0.0 
1 1 1   33   12    1 f   1025.7    3.9    0.0000   0.0000          ?        ? 10522.8359  80.4537          ?        ?     1025.7        3.9       ?       ? 
1 1 1   33   12    2 o    554.0    2.5    0.0000   0.0000          ?        ?  3069.3735  28.0950          ?        ?      554.0        2.5       ?       ? 
1 1 1   33   12    3 o    198.3    2.7    0.0000   0.0000          ?        ?   393.3293  10.8549          ?        ?      198.3        2.7       ?       ? 
1 1 1   33   12    4 o    616.4    2.8    0.0000   0.0000          ?        ?  3799.2036  34.4802          ?        ?      616.4        2.8       ?       ? 
1 1 1   33   12    5 o     68.3    7.0    0.0000   0.0000          ?        ?    46.6121   9.5778          ?        ?       68.3        7.0       ?       ? 
1 1 1   33   12    6 o   1161.7    4.3    0.0000   0.0000          ?        ? 13498.9863 100.2479          ?        ?     1161.7        4.3       ?       ? 
1 1 1   33   12    7 o    777.9    3.3    0.0000   0.0000          ?        ?  6051.9077  51.0817          ?        ?      777.9        3.3       ?       ? 
1 1 1   33   12    8 o    885.0    3.4    0.0000   0.0000          ?        ?  7834.0220  60.0210          ?        ?      885.0        3.4       ?       ? 
1 1 1   33   12    9 o    366.0    2.4    0.0000   0.0000          ?        ?  1339.6184  17.2401          ?        ?      366.0        2.4       ?       ? 
1 1 1   33   12   10 o    908.7    3.4    0.0000   0.0000          ?        ?  8258.6387  61.9366          ?        ?      908.7        3.4       ?       ? 
1 1 1   33   12   11 o    556.2    2.6    0.0000   0.0000          ?        ?  3094.2759  28.7335          ?        ?      556.2        2.6       ?       ? 
1 1 1   33   12   12 o    783.0    3.1    0.0000   0.0000          ?        ?  6131.0850  47.8891          ?        ?      783.0        3.1       ?       ? 
1 1 1   33   12   13 o    531.4    2.4    0.0000   0.0000          ?        ?  2823.5427  25.5409          ?        ?      531.4        2.4       ?       ? 
1 1 1   33   12   14 o    268.1    2.5    0.0000   0.0000          ?        ?   718.9753  13.4090          ?        ?      268.1        2.5       ?       ? 
1 1 1   33   12   15 o    712.4    3.0    0.0000   0.0000          ?        ?  5076.2471  42.1424          ?        ?      712.4        3.0       ?       ? 
1 1 1   33   12   16 o    695.8    2.8    0.0000   0.0000          ?        ?  4842.5483  38.9498          ?        ?      695.8        2.8       ?       ? 
1 1 1   33   12   17 o    729.6    2.8    0.0000   0.0000          ?        ?  5323.9932  41.5039          ?        ?      729.6        2.8       ?       ? 
1 1 1   33   12   18 o    415.3    2.5    0.0000   0.0000          ?        ?  1724.6470  20.4327          ?        ?      415.3        2.5       ?       ? 
1 1 1   33   12   19 o    668.0    2.9    0.0000   0.0000          ?        ?  4462.6279  38.3113          ?        ?      668.0        2.9       ?       ? 
1 1 1   33   12   20 o     91.1    6.7    0.0000   0.0000          ?        ?    83.0078  12.1319          ?        ?       91.1        6.7       ?       ? 
1 1 1   33   12   21 o    499.5    2.5    0.0000   0.0000          ?        ?  2495.3425  24.9023          ?        ?      499.5        2.5       ?       ? 
1 1 1   33   12   22 o    406.8    2.4    0.0000   0.0000          ?        ?  1655.0481  19.1556          ?        ?      406.8        2.4       ?       ? 
1 1 1   33   12   23 o    398.3    2.4    0.0000   0.0000          ?        ?  1586.7262  19.1556          ?        ?      398.3        2.4       ?       ? 
1 1 1   33   12   24 o    184.3    3.5    0.0000   0.0000          ?        ?   339.6935  12.7704          ?        ?      184.3        3.5       ?       ? 
1 1 1   33   12   25 o    221.3    3.2    0.0000   0.0000          ?        ?   489.7461  14.0475          ?        ?      221.3        3.2       ?       ? 
1 1 1   33   12   26 o    546.3    2.7    0.0000   0.0000          ?        ?  2984.4500  29.3720          ?        ?      546.3        2.7       ?       ? 
1 1 1   33   12   27 o    386.1    2.6    0.0000   0.0000          ?        ?  1490.9480  20.4327          ?        ?      386.1        2.6       ?       ? 
1 1 1   33   12   28 o    393.3    2.6    0.0000   0.0000          ?        ?  1547.1379  20.4327          ?        ?      393.3        2.6       ?       ? 
1 1 1   33   12   29 o    769.6    3.2    0.0000   0.0000          ?        ?  5924.2036  49.1662          ?        ?      769.6        3.2       ?       ? 
1 1 1   33   12   30 o     26.5   12.0    0.0000   0.0000          ?        ?    -7.0237  13.4090          ?        ?       26.5       12.0       ?       ? 
1 1 1   33   12   31 o    378.4    2.7    0.0000   0.0000          ?        ?  1432.2040  20.4327          ?        ?      378.4        2.7       ?       ? 
1 1 1   33   12   32 o    357.3    2.9    0.0000   0.0000          ?        ?  1277.0432  20.4327          ?        ?      357.3        2.9       ?       ? 
1 1 1   33   12   33 o    228.1    3.5    0.0000   0.0000          ?        ?   520.3951  15.9630          ?        ?      228.1        3.5       ?       ? 
1 1 1   33   12   34 o    360.4    2.7    0.0000   0.0000          ?        ?  1299.3915  19.1556          ?        ?      360.4        2.7       ?       ? 
1 1 1   33   12   35 o    731.7    2.9    0.0000   0.0000          ?        ?  5355.9194  42.7809          ?        ?      731.7        2.9       ?       ? 
1 1 1   33   12   36 o     19.6    9.8    0.0000   0.0000          ?        ?   -35.7572  14.6860          ?        ?       19.6        9.8       ?       ? 
1 1 1   33   12   37 o    150.3    5.1    0.0000   0.0000          ?        ?   226.0367  15.3245          ?        ?      150.3        5.1       ?       ? 
1 1 1   33   12   38 o    362.8    2.6    0.0000   0.0000          ?        ?  1316.6316  18.5171          ?        ?      362.8        2.6       ?       ? 
1 1 1   33   12   39 o    317.7    2.8    0.0000   0.0000          ?        ?  1009.5027  17.8786          ?        ?      317.7        2.8       ?       ? 
1 1 1   33   12   40 o     64.1   12.9    0.0000   0.0000          ?        ?    42.7809  15.9630          ?        ?       64.1       12.9       ?       ? 
1 1 1   33   12   41 o    383.7    2.6    0.0000   0.0000          ?        ?  1472.4309  19.7942          ?        ?      383.7        2.6       ?       ? 
1 1 1   33   12   42 o     23.7   11.3    0.0000   0.0000          ?        ?   -21.7097  15.3245          ?        ?       23.7       11.3       ?       ? 
1 1 1   33   12   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   12   44 o    507.6    2.6    0.0000   0.0000          ?        ?  2577.0732  26.1794          ?        ?      507.6        2.6       ?       ? 
1 1 1   33   12   45 o    339.0    2.9    0.0000   0.0000          ?        ?  1149.9775  19.7942          ?        ?      339.0        2.9       ?       ? 
1 1 1   33   12   46 f    210.4    4.1    0.0000   0.0000          ?        ?   443.1340  17.2401          ?        ?      210.4        4.1       ?       ? 
1 1 1   33   12   47 o    140.3    5.9    0.0000   0.0000          ?        ?   197.3032  16.6016          ?        ?      140.3        5.9       ?       ? 
1 1 1   33   12   48 o    258.7    3.6    0.0000   0.0000          ?        ?   669.8092  18.5171          ?        ?      258.7        3.6       ?       ? 
1 1 1   33   12   49 o    511.8    2.6    0.0000   0.0000          ?        ?  2620.4927  26.8179          ?        ?      511.8        2.6       ?       ? 
1 1 1   33   12   50 o    112.8    7.9    0.0000   0.0000          ?        ?   127.7043  17.8786          ?        ?      112.8        7.9       ?       ? 
1 1 1   33   12   51 o    178.2    4.8    0.0000   0.0000          ?        ?   317.9838  17.2401          ?        ?      178.2        4.8       ?       ? 
1 1 1   33   12   52 f    143.6    6.2    0.0000   0.0000          ?        ?   206.8810  17.8786          ?        ?      143.6        6.2       ?       ? 
1 1 1   33   12   53 o    411.0    3.0    0.0000   0.0000          ?        ?  1690.1669  24.2638          ?        ?      411.0        3.0       ?       ? 
1 1 1   33   12   54 o    242.7    3.9    0.0000   0.0000          ?        ?   589.9940  19.1556          ?        ?      242.7        3.9       ?       ? 
1 1 1   33   12   55 o    288.6    3.5    0.0000   0.0000          ?        ?   833.9093  20.4327          ?        ?      288.6        3.5       ?       ? 
1 1 1   33   12   56 o     91.8    9.7    0.0000   0.0000          ?        ?    84.9234  17.8786          ?        ?       91.8        9.7       ?       ? 
1 1 1   33   12   57 f    244.3    4.1    0.0000   0.0000          ?        ?   597.6562  19.7942          ?        ?      244.3        4.1       ?       ? 
1 1 1   33   12   58 o     25.3   12.2    0.0000   0.0000          ?        ?   -31.2876  19.1556          ?        ?       25.3       12.2       ?       ? 
1 1 1   33   12   59 o    238.0    4.3    0.0000   0.0000          ?        ?   567.6458  20.4327          ?        ?      238.0        4.3       ?       ? 
1 1 1   33   12   60 o     20.6   10.4    0.0000   0.0000          ?        ?   -62.5751  19.7942          ?        ?       20.6       10.4       ?       ? 
1 1 1   33   12   61 o    243.9    4.1    0.0000   0.0000          ?        ?   596.3792  19.7942          ?        ?      243.9        4.1       ?       ? 
1 1 1   33   12   62 o    102.2   10.0    0.0000   0.0000          ?        ?   105.9946  20.4327          ?        ?      102.2       10.0       ?       ? 
1 1 1   33   12   63 o    149.4    6.8    0.0000   0.0000          ?        ?   224.7596  20.4327          ?        ?      149.4        6.8       ?       ? 
1 1 1   33   12   64 f     24.1   11.8    0.0000   0.0000          ?        ?   -39.5883  19.7942          ?        ?       24.1       11.8       ?       ? 
1 1 1   33   12   65 o     97.7    9.5    0.0000   0.0000          ?        ?    97.0553  18.5171          ?        ?       97.7        9.5       ?       ? 
1 1 1   33   13    0 f    783.3    4.9 6136.8311  75.9841  6136.8311  75.9841  6136.8311  75.9841      783.3      4.9      783.3        4.9     0.0     0.0 
1 1 1   33   13    1 o     42.6   13.4    0.0000   0.0000          ?        ?    17.8786  12.7704          ?        ?       42.6       13.4       ?       ? 
1 1 1   33   13    2 o    564.8    2.8    0.0000   0.0000          ?        ?  3190.0542  31.2876          ?        ?      564.8        2.8       ?       ? 
1 1 1   33   13    3 o    264.0    2.7    0.0000   0.0000          ?        ?   697.2656  14.0475          ?        ?      264.0        2.7       ?       ? 
1 1 1   33   13    4 o   1149.6    4.2    0.0000   0.0000          ?        ? 13218.6748  97.0553          ?        ?     1149.6        4.2       ?       ? 
1 1 1   33   13    5 o    813.4    3.3    0.0000   0.0000          ?        ?  6616.3608  54.2743          ?        ?      813.4        3.3       ?       ? 
1 1 1   33   13    6 f    251.7    2.5    0.0000   0.0000          ?        ?   633.4135  12.7704          ?        ?      251.7        2.5       ?       ? 
1 1 1   33   13    7 o    596.3    2.7    0.0000   0.0000          ?        ?  3555.9270  31.9261          ?        ?      596.3        2.7       ?       ? 
1 1 1   33   13    8 o    496.7    2.4    0.0000   0.0000          ?        ?  2467.2476  24.2638          ?        ?      496.7        2.4       ?       ? 
1 1 1   33   13    9 o    630.0    2.6    0.0000   0.0000          ?        ?  3969.0503  32.5646          ?        ?      630.0        2.6       ?       ? 
1 1 1   33   13   10 o    259.5    2.3    0.0000   0.0000          ?        ?   673.6403  12.1319          ?        ?      259.5        2.3       ?       ? 
1 1 1   33   13   11 o    559.4    2.6    0.0000   0.0000          ?        ?  3130.0332  28.7335          ?        ?      559.4        2.6       ?       ? 
1 1 1   33   13   12 o    499.2    2.4    0.0000   0.0000          ?        ?  2492.1499  24.2638          ?        ?      499.2        2.4       ?       ? 
1 1 1   33   13   13 o    221.6    2.7    0.0000   0.0000          ?        ?   491.0231  12.1319          ?        ?      221.6        2.7       ?       ? 
1 1 1   33   13   14 o    580.3    2.5    0.0000   0.0000          ?        ?  3367.5632  28.7335          ?        ?      580.3        2.5       ?       ? 
1 1 1   33   13   15 o    539.7    2.6    0.0000   0.0000          ?        ?  2912.9358  28.0950          ?        ?      539.7        2.6       ?       ? 
1 1 1   33   13   16 o    343.4    2.4    0.0000   0.0000          ?        ?  1179.3494  16.6016          ?        ?      343.4        2.4       ?       ? 
1 1 1   33   13   17 o    177.4    4.0    0.0000   0.0000          ?        ?   314.7912  14.0475          ?        ?      177.4        4.0       ?       ? 
1 1 1   33   13   18 o    497.1    2.6    0.0000   0.0000          ?        ?  2471.0786  25.5409          ?        ?      497.1        2.6       ?       ? 
1 1 1   33   13   19 o    583.0    2.7    0.0000   0.0000          ?        ?  3399.4893  31.2876          ?        ?      583.0        2.7       ?       ? 
1 1 1   33   13   20 o    170.2    3.6    0.0000   0.0000          ?        ?   289.8888  12.1319          ?        ?      170.2        3.6       ?       ? 
1 1 1   33   13   21 o    397.4    2.4    0.0000   0.0000          ?        ?  1579.7025  19.1556          ?        ?      397.4        2.4       ?       ? 
1 1 1   33   13   22 o    154.9    4.3    0.0000   0.0000          ?        ?   240.0841  13.4090          ?        ?      154.9        4.3       ?       ? 
1 1 1   33   13   23 o    397.0    2.4    0.0000   0.0000          ?        ?  1576.5099  19.1556          ?        ?      397.0        2.4       ?       ? 
1 1 1   33   13   24 o    852.6    3.3    0.0000   0.0000          ?        ?  7270.2070  55.5514          ?        ?      852.6        3.3       ?       ? 
1 1 1   33   13   25 o    237.2    3.1    0.0000   0.0000          ?        ?   562.5375  14.6860          ?        ?      237.2        3.1       ?       ? 
1 1 1   33   13   26 o    748.4    3.0    0.0000   0.0000          ?        ?  5601.7500  45.3350          ?        ?      748.4        3.0       ?       ? 
1 1 1   33   13   27 o    469.4    2.6    0.0000   0.0000          ?        ?  2204.1768  24.2638          ?        ?      469.4        2.6       ?       ? 
1 1 1   33   13   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   13   29 o    165.7    4.6    0.0000   0.0000          ?        ?   274.5643  15.3245          ?        ?      165.7        4.6       ?       ? 
1 1 1   33   13   30 o    378.6    2.6    0.0000   0.0000          ?        ?  1433.4811  19.7942          ?        ?      378.6        2.6       ?       ? 
1 1 1   33   13   31 o     65.3   10.8    0.0000   0.0000          ?        ?    42.7809  14.0475          ?        ?       65.3       10.8       ?       ? 
1 1 1   33   13   32 o    603.4    2.9    0.0000   0.0000          ?        ?  3642.1274  34.4802          ?        ?      603.4        2.9       ?       ? 
1 1 1   33   13   33 o    124.0    5.9    0.0000   0.0000          ?        ?   153.8837  14.6860          ?        ?      124.0        5.9       ?       ? 
1 1 1   33   13   34 o    560.8    2.6    0.0000   0.0000          ?        ?  3145.9961  29.3720          ?        ?      560.8        2.6       ?       ? 
1 1 1   33   13   35 o    360.2    2.7    0.0000   0.0000          ?        ?  1298.1145  19.7942          ?        ?      360.2        2.7       ?       ? 
1 1 1   33   13   36 o     34.5   14.1    0.0000   0.0000          ?        ?     4.4697  15.3245          ?        ?       34.5       14.1       ?       ? 
1 1 1   33   13   37 o    383.8    2.5    0.0000   0.0000          ?        ?  1473.0693  19.1556          ?        ?      383.8        2.5       ?       ? 
1 1 1   33   13   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   13   39 o    345.5    2.7    0.0000   0.0000          ?        ?  1194.0354  18.5171          ?        ?      345.5        2.7       ?       ? 
1 1 1   33   13   40 o    257.6    3.2    0.0000   0.0000          ?        ?   664.0625  16.6016          ?        ?      257.6        3.2       ?       ? 
1 1 1   33   13   41 o    255.0    3.3    0.0000   0.0000          ?        ?   650.6536  16.6016          ?        ?      255.0        3.3       ?       ? 
1 1 1   33   13   42 o    145.5    5.5    0.0000   0.0000          ?        ?   211.9892  15.9630          ?        ?      145.5        5.5       ?       ? 
1 1 1   33   13   43 o    457.2    2.7    0.0000   0.0000          ?        ?  2091.1584  24.2638          ?        ?      457.2        2.7       ?       ? 
1 1 1   33   13   44 o    106.1    7.5    0.0000   0.0000          ?        ?   113.0183  15.9630          ?        ?      106.1        7.5       ?       ? 
1 1 1   33   13   45 o    412.7    2.6    0.0000   0.0000          ?        ?  1704.2142  21.7097          ?        ?      412.7        2.6       ?       ? 
1 1 1   33   13   46 o     43.3   15.3    0.0000   0.0000          ?        ?    16.6016  16.6016          ?        ?       43.3       15.3       ?       ? 
1 1 1   33   13   47 o    186.6    4.4    0.0000   0.0000          ?        ?   348.6328  16.6016          ?        ?      186.6        4.4       ?       ? 
1 1 1   33   13   48 o     81.6   10.6    0.0000   0.0000          ?        ?    67.0448  17.2401          ?        ?       81.6       10.6       ?       ? 
1 1 1   33   13   49 o    135.7    6.4    0.0000   0.0000          ?        ?   184.5327  17.2401          ?        ?      135.7        6.4       ?       ? 
1 1 1   33   13   50 o    221.6    3.9    0.0000   0.0000          ?        ?   491.6617  17.2401          ?        ?      221.6        3.9       ?       ? 
1 1 1   33   13   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   13   52 f    351.2    3.0    0.0000   0.0000          ?        ?  1234.2623  21.0712          ?        ?      351.2        3.0       ?       ? 
1 1 1   33   13   53 o    161.6    5.7    0.0000   0.0000          ?        ?   261.7939  18.5171          ?        ?      161.6        5.7       ?       ? 
1 1 1   33   13   54 o    172.7    5.4    0.0000   0.0000          ?        ?   298.8281  18.5171          ?        ?      172.7        5.4       ?       ? 
1 1 1   33   13   55 o     46.8   16.2    0.0000   0.0000          ?        ?    20.4327  18.5171          ?        ?       46.8       16.2       ?       ? 
1 1 1   33   13   56 f    319.1    3.2    0.0000   0.0000          ?        ?  1019.0806  20.4327          ?        ?      319.1        3.2       ?       ? 
1 1 1   33   13   57 o    174.8    5.7    0.0000   0.0000          ?        ?   306.4904  19.7942          ?        ?      174.8        5.7       ?       ? 
1 1 1   33   13   58 o    100.2    9.9    0.0000   0.0000          ?        ?   101.5249  19.7942          ?        ?      100.2        9.9       ?       ? 
1 1 1   33   13   59 o    205.8    5.0    0.0000   0.0000          ?        ?   424.6169  20.4327          ?        ?      205.8        5.0       ?       ? 
1 1 1   33   13   60 o     83.8   12.2    0.0000   0.0000          ?        ?    71.5144  20.4327          ?        ?       83.8       12.2       ?       ? 
1 1 1   33   13   61 o    124.5    7.9    0.0000   0.0000          ?        ?   156.4378  19.7942          ?        ?      124.5        7.9       ?       ? 
1 1 1   33   13   62 o    260.5    3.9    0.0000   0.0000          ?        ?   680.0255  20.4327          ?        ?      260.5        3.9       ?       ? 
1 1 1   33   13   63 o    119.9    8.3    0.0000   0.0000          ?        ?   145.5829  19.7942          ?        ?      119.9        8.3       ?       ? 
1 1 1   33   13   64 o     83.9   11.4    0.0000   0.0000          ?        ?    72.1529  19.1556          ?        ?       83.9       11.4       ?       ? 
1 1 1   33   13   65 o     35.4   15.2    0.0000   0.0000          ?        ?     0.6385  19.1556          ?        ?       35.4       15.2       ?       ? 
1 1 1   33   14    0 o    116.1    7.8  136.6436  17.8786   136.6436  17.8786   136.6436  17.8786      116.1      7.8      116.1        7.8     0.0     0.0 
1 1 1   33   14    1 o    739.0    3.5    0.0000   0.0000          ?        ?  5461.2754  51.0817          ?        ?      739.0        3.5       ?       ? 
1 1 1   33   14    2 o    499.9    2.7    0.0000   0.0000          ?        ?  2499.1736  26.8179          ?        ?      499.9        2.7       ?       ? 
1 1 1   33   14    3 o    612.9    3.0    0.0000   0.0000          ?        ?  3757.0615  36.3957          ?        ?      612.9        3.0       ?       ? 
1 1 1   33   14    4 o    485.2    2.7    0.0000   0.0000          ?        ?  2354.2292  26.1794          ?        ?      485.2        2.7       ?       ? 
1 1 1   33   14    5 o    824.4    3.4    0.0000   0.0000          ?        ?  6797.7012  55.5514          ?        ?      824.4        3.4       ?       ? 
1 1 1   33   14    6 f    826.2    3.4    0.0000   0.0000          ?        ?  6827.7119  55.5514          ?        ?      826.2        3.4       ?       ? 
1 1 1   33   14    7 o    856.2    3.3    0.0000   0.0000          ?        ?  7331.5049  56.1899          ?        ?      856.2        3.3       ?       ? 
1 1 1   33   14    8 o     42.9   11.1    0.0000   0.0000          ?        ?    19.1556   9.5778          ?        ?       42.9       11.1       ?       ? 
1 1 1   33   14    9 o    237.0    2.3    0.0000   0.0000          ?        ?   561.8990  10.8549          ?        ?      237.0        2.3       ?       ? 
1 1 1   33   14   10 o     60.3    6.9    0.0000   0.0000          ?        ?    36.3957   8.3008          ?        ?       60.3        6.9       ?       ? 
1 1 1   33   14   11 o    423.6    2.3    0.0000   0.0000          ?        ?  1794.2457  19.7942          ?        ?      423.6        2.3       ?       ? 
1 1 1   33   14   12 o    822.0    3.1    0.0000   0.0000          ?        ?  6757.4746  51.7203          ?        ?      822.0        3.1       ?       ? 
1 1 1   33   14   13 o    132.3    3.9    0.0000   0.0000          ?        ?   174.9549  10.2163          ?        ?      132.3        3.9       ?       ? 
1 1 1   33   14   14 f    451.1    2.4    0.0000   0.0000          ?        ?  2034.9685  21.7097          ?        ?      451.1        2.4       ?       ? 
1 1 1   33   14   15 o    609.5    2.7    0.0000   0.0000          ?        ?  3714.9187  33.2031          ?        ?      609.5        2.7       ?       ? 
1 1 1   33   14   16 f    335.7    2.6    0.0000   0.0000          ?        ?  1126.9907  17.2401          ?        ?      335.7        2.6       ?       ? 
1 1 1   33   14   17 o    820.1    3.3    0.0000   0.0000          ?        ?  6726.1870  53.6358          ?        ?      820.1        3.3       ?       ? 
1 1 1   33   14   18 o    138.1    4.9    0.0000   0.0000          ?        ?   190.9180  13.4090          ?        ?      138.1        4.9       ?       ? 
1 1 1   33   14   19 o   1164.2    4.1    0.0000   0.0000          ?        ? 13557.0908  95.1397          ?        ?     1164.2        4.1       ?       ? 
1 1 1   33   14   20 o    404.0    2.4    0.0000   0.0000          ?        ?  1632.0613  19.7942          ?        ?      404.0        2.4       ?       ? 
1 1 1   33   14   21 o    453.2    2.4    0.0000   0.0000          ?        ?  2054.1243  21.7097          ?        ?      453.2        2.4       ?       ? 
1 1 1   33   14   22 o    395.4    2.3    0.0000   0.0000          ?        ?  1563.7394  17.8786          ?        ?      395.4        2.3       ?       ? 
1 1 1   33   14   23 o    374.2    2.4    0.0000   0.0000          ?        ?  1400.2780  17.8786          ?        ?      374.2        2.4       ?       ? 
1 1 1   33   14   24 o    293.3    2.6    0.0000   0.0000          ?        ?   860.0886  15.3245          ?        ?      293.3        2.6       ?       ? 
1 1 1   33   14   25 o    805.2    3.1    0.0000   0.0000          ?        ?  6484.1870  49.8047          ?        ?      805.2        3.1       ?       ? 
1 1 1   33   14   26 o    366.8    2.5    0.0000   0.0000          ?        ?  1345.3650  18.5171          ?        ?      366.8        2.5       ?       ? 
1 1 1   33   14   27 o     97.8    6.9    0.0000   0.0000          ?        ?    95.7782  13.4090          ?        ?       97.8        6.9       ?       ? 
1 1 1   33   14   28 o    638.2    2.8    0.0000   0.0000          ?        ?  4074.4062  35.7572          ?        ?      638.2        2.8       ?       ? 
1 1 1   33   14   29 o    208.8    3.7    0.0000   0.0000          ?        ?   436.1103  15.3245          ?        ?      208.8        3.7       ?       ? 
1 1 1   33   14   30 o    182.5    3.8    0.0000   0.0000          ?        ?   333.3083  14.0475          ?        ?      182.5        3.8       ?       ? 
1 1 1   33   14   31 o    230.2    3.2    0.0000   0.0000          ?        ?   529.9730  14.6860          ?        ?      230.2        3.2       ?       ? 
1 1 1   33   14   32 o     22.7   10.9    0.0000   0.0000          ?        ?   -22.3483  14.6860          ?        ?       22.7       10.9       ?       ? 
1 1 1   33   14   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   14   34 o    244.4    3.4    0.0000   0.0000          ?        ?   597.6562  16.6016          ?        ?      244.4        3.4       ?       ? 
1 1 1   33   14   35 o    472.2    2.6    0.0000   0.0000          ?        ?  2230.3560  24.2638          ?        ?      472.2        2.6       ?       ? 
1 1 1   33   14   36 o    159.0    4.6    0.0000   0.0000          ?        ?   252.8546  14.6860          ?        ?      159.0        4.6       ?       ? 
1 1 1   33   14   37 o    717.0    3.0    0.0000   0.0000          ?        ?  5142.0146  42.7809          ?        ?      717.0        3.0       ?       ? 
1 1 1   33   14   38 o     20.6   10.2    0.0000   0.0000          ?        ?   -34.4802  15.3245          ?        ?       20.6       10.2       ?       ? 
1 1 1   33   14   39 o    415.5    2.7    0.0000   0.0000          ?        ?  1727.2010  22.3483          ?        ?      415.5        2.7       ?       ? 
1 1 1   33   14   40 o     99.0    8.1    0.0000   0.0000          ?        ?    98.3323  15.9630          ?        ?       99.0        8.1       ?       ? 
1 1 1   33   14   41 o    474.1    2.7    0.0000   0.0000          ?        ?  2248.8733  25.5409          ?        ?      474.1        2.7       ?       ? 
1 1 1   33   14   42 o     42.5   15.0    0.0000   0.0000          ?        ?    15.9630  15.9630          ?        ?       42.5       15.0       ?       ? 
1 1 1   33   14   43 o    210.4    3.9    0.0000   0.0000          ?        ?   443.1340  16.6016          ?        ?      210.4        3.9       ?       ? 
1 1 1   33   14   44 f    217.0    3.8    0.0000   0.0000          ?        ?   471.2290  16.6016          ?        ?      217.0        3.8       ?       ? 
1 1 1   33   14   45 o    116.4    7.1    0.0000   0.0000          ?        ?   136.0051  16.6016          ?        ?      116.4        7.1       ?       ? 
1 1 1   33   14   46 o    259.3    3.4    0.0000   0.0000          ?        ?   673.0018  17.8786          ?        ?      259.3        3.4       ?       ? 
1 1 1   33   14   47 o     19.3    9.7    0.0000   0.0000          ?        ?   -49.8047  16.6016          ?        ?       19.3        9.7       ?       ? 
1 1 1   33   14   48 o     75.5   11.0    0.0000   0.0000          ?        ?    57.4669  16.6016          ?        ?       75.5       11.0       ?       ? 
1 1 1   33   14   49 o    223.9    4.1    0.0000   0.0000          ?        ?   501.8780  18.5171          ?        ?      223.9        4.1       ?       ? 
1 1 1   33   14   50 o    402.9    2.8    0.0000   0.0000          ?        ?  1624.3989  22.3483          ?        ?      402.9        2.8       ?       ? 
1 1 1   33   14   51 o     57.2   15.3    0.0000   0.0000          ?        ?    34.4802  17.8786          ?        ?       57.2       15.3       ?       ? 
1 1 1   33   14   52 o     65.6   14.0    0.0000   0.0000          ?        ?    45.3350  17.8786          ?        ?       65.6       14.0       ?       ? 
1 1 1   33   14   53 o    454.6    2.7    0.0000   0.0000          ?        ?  2067.5330  24.9023          ?        ?      454.6        2.7       ?       ? 
1 1 1   33   14   54 o    283.0    3.5    0.0000   0.0000          ?        ?   801.9832  19.7942          ?        ?      283.0        3.5       ?       ? 
1 1 1   33   14   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   14   56 o    342.2    3.2    0.0000   0.0000          ?        ?  1172.3258  21.7097          ?        ?      342.2        3.2       ?       ? 
1 1 1   33   14   57 o    163.1    5.7    0.0000   0.0000          ?        ?   266.9020  18.5171          ?        ?      163.1        5.7       ?       ? 
1 1 1   33   14   58 o    204.5    4.8    0.0000   0.0000          ?        ?   419.5087  19.7942          ?        ?      204.5        4.8       ?       ? 
1 1 1   33   14   59 o    362.2    3.1    0.0000   0.0000          ?        ?  1313.4390  22.3483          ?        ?      362.2        3.1       ?       ? 
1 1 1   33   14   60 o    286.3    3.8    0.0000   0.0000          ?        ?   821.1389  21.7097          ?        ?      286.3        3.8       ?       ? 
1 1 1   33   14   61 o    176.5    5.6    0.0000   0.0000          ?        ?   312.8756  19.7942          ?        ?      176.5        5.6       ?       ? 
1 1 1   33   14   62 o    126.2    7.6    0.0000   0.0000          ?        ?   160.9075  19.1556          ?        ?      126.2        7.6       ?       ? 
1 1 1   33   14   63 o     70.5   13.6    0.0000   0.0000          ?        ?    52.9973  18.5171          ?        ?       70.5       13.6       ?       ? 
1 1 1   33   14   64 o     55.9   15.8    0.0000   0.0000          ?        ?    33.8416  18.5171          ?        ?       55.9       15.8       ?       ? 
1 1 1   33   15    0 o    908.8    5.3 8261.8311  96.4168  8261.8311  96.4168  8261.8311  96.4168      908.8      5.3      908.8        5.3     0.0     0.0 
1 1 1   33   15    1 o    568.2    2.8    0.0000   0.0000          ?        ?  3229.0039  31.9261          ?        ?      568.2        2.8       ?       ? 
1 1 1   33   15    2 o    334.3    2.7    0.0000   0.0000          ?        ?  1117.4128  17.8786          ?        ?      334.3        2.7       ?       ? 
1 1 1   33   15    3 o    344.7    2.6    0.0000   0.0000          ?        ?  1188.2888  17.8786          ?        ?      344.7        2.6       ?       ? 
1 1 1   33   15    4 o    238.5    2.9    0.0000   0.0000          ?        ?   568.9227  14.0475          ?        ?      238.5        2.9       ?       ? 
1 1 1   33   15    5 o    291.1    2.5    0.0000   0.0000          ?        ?   847.3182  14.6860          ?        ?      291.1        2.5       ?       ? 
1 1 1   33   15    6 o    693.6    3.1    0.0000   0.0000          ?        ?  4811.8989  43.4195          ?        ?      693.6        3.1       ?       ? 
1 1 1   33   15    7 o   1594.2    5.7    0.0000   0.0000          ?        ? 25425.2930 182.6172          ?        ?     1594.2        5.7       ?       ? 
1 1 1   33   15    8 o    896.1    3.9    0.0000   0.0000          ?        ?  8031.3252  70.2374          ?        ?      896.1        3.9       ?       ? 
1 1 1   33   15    9 o    452.9    2.4    0.0000   0.0000          ?        ?  2051.5698  21.7097          ?        ?      452.9        2.4       ?       ? 
1 1 1   33   15   10 o    300.5    2.3    0.0000   0.0000          ?        ?   902.8696  14.0475          ?        ?      300.5        2.3       ?       ? 
1 1 1   33   15   11 o    901.1    3.5    0.0000   0.0000          ?        ?  8120.7183  63.2136          ?        ?      901.1        3.5       ?       ? 
1 1 1   33   15   12 o    277.6    2.4    0.0000   0.0000          ?        ?   770.6956  13.4090          ?        ?      277.6        2.4       ?       ? 
1 1 1   33   15   13 o    320.4    2.2    0.0000   0.0000          ?        ?  1026.7428  14.0475          ?        ?      320.4        2.2       ?       ? 
1 1 1   33   15   14 o    637.1    2.7    0.0000   0.0000          ?        ?  4059.7205  34.4802          ?        ?      637.1        2.7       ?       ? 
1 1 1   33   15   15 o    330.6    2.5    0.0000   0.0000          ?        ?  1093.1490  16.6016          ?        ?      330.6        2.5       ?       ? 
1 1 1   33   15   16 o    319.4    2.6    0.0000   0.0000          ?        ?  1020.3576  16.6016          ?        ?      319.4        2.6       ?       ? 
1 1 1   33   15   17 o    207.3    3.2    0.0000   0.0000          ?        ?   429.7251  13.4090          ?        ?      207.3        3.2       ?       ? 
1 1 1   33   15   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   15   19 o    359.7    2.3    0.0000   0.0000          ?        ?  1294.2833  16.6016          ?        ?      359.7        2.3       ?       ? 
1 1 1   33   15   20 o    488.7    2.4    0.0000   0.0000          ?        ?  2388.7095  22.9868          ?        ?      488.7        2.4       ?       ? 
1 1 1   33   15   21 f    563.0    2.6    0.0000   0.0000          ?        ?  3170.2598  29.3720          ?        ?      563.0        2.6       ?       ? 
1 1 1   33   15   22 o    398.2    2.4    0.0000   0.0000          ?        ?  1585.4492  19.1556          ?        ?      398.2        2.4       ?       ? 
1 1 1   33   15   23 o     99.4    5.8    0.0000   0.0000          ?        ?    98.9709  11.4934          ?        ?       99.4        5.8       ?       ? 
1 1 1   33   15   24 o    457.9    2.4    0.0000   0.0000          ?        ?  2096.9050  21.7097          ?        ?      457.9        2.4       ?       ? 
1 1 1   33   15   25 o    912.5    3.4    0.0000   0.0000          ?        ?  8329.5146  61.2981          ?        ?      912.5        3.4       ?       ? 
1 1 1   33   15   26 o    232.8    3.2    0.0000   0.0000          ?        ?   542.1049  14.6860          ?        ?      232.8        3.2       ?       ? 
1 1 1   33   15   27 o    172.6    4.1    0.0000   0.0000          ?        ?   298.1896  14.0475          ?        ?      172.6        4.1       ?       ? 
1 1 1   33   15   28 o    208.9    3.5    0.0000   0.0000          ?        ?   436.7488  14.6860          ?        ?      208.9        3.5       ?       ? 
1 1 1   33   15   29 o    147.9    4.5    0.0000   0.0000          ?        ?   219.0129  13.4090          ?        ?      147.9        4.5       ?       ? 
1 1 1   33   15   30 o    391.4    2.4    0.0000   0.0000          ?        ?  1532.4519  19.1556          ?        ?      391.4        2.4       ?       ? 
1 1 1   33   15   31 o    444.6    2.7    0.0000   0.0000          ?        ?  1976.8630  23.6253          ?        ?      444.6        2.7       ?       ? 
1 1 1   33   15   32 o    722.1    3.0    0.0000   0.0000          ?        ?  5216.0835  43.4195          ?        ?      722.1        3.0       ?       ? 
1 1 1   33   15   33 o    280.3    3.1    0.0000   0.0000          ?        ?   786.0201  17.2401          ?        ?      280.3        3.1       ?       ? 
1 1 1   33   15   34 o    233.1    3.4    0.0000   0.0000          ?        ?   543.3819  15.9630          ?        ?      233.1        3.4       ?       ? 
1 1 1   33   15   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   15   36 o    230.3    3.5    0.0000   0.0000          ?        ?   530.6115  15.9630          ?        ?      230.3        3.5       ?       ? 
1 1 1   33   15   37 o    255.4    3.4    0.0000   0.0000          ?        ?   652.5691  17.2401          ?        ?      255.4        3.4       ?       ? 
1 1 1   33   15   38 o    541.2    2.7    0.0000   0.0000          ?        ?  2929.5371  29.3720          ?        ?      541.2        2.7       ?       ? 
1 1 1   33   15   39 o    198.6    4.0    0.0000   0.0000          ?        ?   394.6064  15.9630          ?        ?      198.6        4.0       ?       ? 
1 1 1   33   15   40 o    217.7    3.8    0.0000   0.0000          ?        ?   474.4216  16.6016          ?        ?      217.7        3.8       ?       ? 
1 1 1   33   15   41 o     62.9   13.6    0.0000   0.0000          ?        ?    41.5039  16.6016          ?        ?       62.9       13.6       ?       ? 
1 1 1   33   15   42 o    413.0    2.7    0.0000   0.0000          ?        ?  1706.1299  22.3483          ?        ?      413.0        2.7       ?       ? 
1 1 1   33   15   43 o    345.1    2.9    0.0000   0.0000          ?        ?  1191.4814  19.7942          ?        ?      345.1        2.9       ?       ? 
1 1 1   33   15   44 o    242.5    3.6    0.0000   0.0000          ?        ?   588.7169  17.2401          ?        ?      242.5        3.6       ?       ? 
1 1 1   33   15   45 o    517.9    2.7    0.0000   0.0000          ?        ?  2683.7063  28.0950          ?        ?      517.9        2.7       ?       ? 
1 1 1   33   15   46 o    172.9    4.8    0.0000   0.0000          ?        ?   299.4666  16.6016          ?        ?      172.9        4.8       ?       ? 
1 1 1   33   15   47 o    263.2    3.8    0.0000   0.0000          ?        ?   693.4344  19.7942          ?        ?      263.2        3.8       ?       ? 
1 1 1   33   15   48 o    287.5    3.3    0.0000   0.0000          ?        ?   826.8855  19.1556          ?        ?      287.5        3.3       ?       ? 
1 1 1   33   15   49 o    165.9    5.2    0.0000   0.0000          ?        ?   275.8413  17.2401          ?        ?      165.9        5.2       ?       ? 
1 1 1   33   15   50 f    256.5    3.6    0.0000   0.0000          ?        ?   658.3158  18.5171          ?        ?      256.5        3.6       ?       ? 
1 1 1   33   15   51 o    262.8    3.6    0.0000   0.0000          ?        ?   691.5189  19.1556          ?        ?      262.8        3.6       ?       ? 
1 1 1   33   15   52 o    241.5    4.2    0.0000   0.0000          ?        ?   584.2473  20.4327          ?        ?      241.5        4.2       ?       ? 
1 1 1   33   15   53 o    287.4    3.6    0.0000   0.0000          ?        ?   826.8855  20.4327          ?        ?      287.4        3.6       ?       ? 
1 1 1   33   15   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   15   55 o     22.5   11.1    0.0000   0.0000          ?        ?   -42.1424  18.5171          ?        ?       22.5       11.1       ?       ? 
1 1 1   33   15   56 o     60.0   15.4    0.0000   0.0000          ?        ?    38.3113  18.5171          ?        ?       60.0       15.4       ?       ? 
1 1 1   33   15   57 o    239.6    4.1    0.0000   0.0000          ?        ?   575.3080  19.7942          ?        ?      239.6        4.1       ?       ? 
1 1 1   33   15   58 o    263.4    3.9    0.0000   0.0000          ?        ?   695.3500  20.4327          ?        ?      263.4        3.9       ?       ? 
1 1 1   33   15   59 o    425.2    2.9    0.0000   0.0000          ?        ?  1810.2089  24.2638          ?        ?      425.2        2.9       ?       ? 
1 1 1   33   15   60 o     19.4    9.8    0.0000   0.0000          ?        ?   -67.0448  19.1556          ?        ?       19.4        9.8       ?       ? 
1 1 1   33   15   61 o    220.4    4.2    0.0000   0.0000          ?        ?   487.1920  18.5171          ?        ?      220.4        4.2       ?       ? 
1 1 1   33   15   62 o     68.5   14.4    0.0000   0.0000          ?        ?    50.4432  19.1556          ?        ?       68.5       14.4       ?       ? 
1 1 1   33   15   63 o     34.9   15.0    0.0000   0.0000          ?        ?    -0.6385  19.1556          ?        ?       34.9       15.0       ?       ? 
1 1 1   33   16    0 o    482.5    3.9 2328.6885  37.6728  2328.6885  37.6728  2328.6885  37.6728      482.5      3.9      482.5        3.9     0.0     0.0 
1 1 1   33   16    1 o    526.5    2.7    0.0000   0.0000          ?        ?  2771.8225  28.7335          ?        ?      526.5        2.7       ?       ? 
1 1 1   33   16    2 o     85.3    6.4    0.0000   0.0000          ?        ?    72.7915  10.8549          ?        ?       85.3        6.4       ?       ? 
1 1 1   33   16    3 o    215.0    3.3    0.0000   0.0000          ?        ?   462.2897  14.0475          ?        ?      215.0        3.3       ?       ? 
1 1 1   33   16    4 o    361.7    2.6    0.0000   0.0000          ?        ?  1308.3308  19.1556          ?        ?      361.7        2.6       ?       ? 
1 1 1   33   16    5 o    449.2    2.8    0.0000   0.0000          ?        ?  2018.3669  24.9023          ?        ?      449.2        2.8       ?       ? 
1 1 1   33   16    6 o    487.1    2.6    0.0000   0.0000          ?        ?  2372.7463  24.9023          ?        ?      487.1        2.6       ?       ? 
1 1 1   33   16    7 o    601.5    2.7    0.0000   0.0000          ?        ?  3617.8633  32.5646          ?        ?      601.5        2.7       ?       ? 
1 1 1   33   16    8 o    406.0    2.4    0.0000   0.0000          ?        ?  1648.6630  19.7942          ?        ?      406.0        2.4       ?       ? 
1 1 1   33   16    9 o    212.8    2.9    0.0000   0.0000          ?        ?   452.7119  12.1319          ?        ?      212.8        2.9       ?       ? 
1 1 1   33   16   10 o    297.6    2.3    0.0000   0.0000          ?        ?   885.6295  13.4090          ?        ?      297.6        2.3       ?       ? 
1 1 1   33   16   11 o    734.9    2.9    0.0000   0.0000          ?        ?  5401.8931  42.7809          ?        ?      734.9        2.9       ?       ? 
1 1 1   33   16   12 o    583.1    2.6    0.0000   0.0000          ?        ?  3400.7661  30.0105          ?        ?      583.1        2.6       ?       ? 
1 1 1   33   16   13 o    427.2    2.5    0.0000   0.0000          ?        ?  1824.8948  21.0712          ?        ?      427.2        2.5       ?       ? 
1 1 1   33   16   14 o    630.7    2.9    0.0000   0.0000          ?        ?  3977.9897  37.0343          ?        ?      630.7        2.9       ?       ? 
1 1 1   33   16   15 o   1091.9    3.9    0.0000   0.0000          ?        ? 11925.6680  86.2004          ?        ?     1091.9        3.9       ?       ? 
1 1 1   33   16   16 o    579.9    2.7    0.0000   0.0000          ?        ?  3363.0935  31.2876          ?        ?      579.9        2.7       ?       ? 
1 1 1   33   16   17 o    274.6    2.4    0.0000   0.0000          ?        ?   754.0941  13.4090          ?        ?      274.6        2.4       ?       ? 
1 1 1   33   16   18 o     19.3    9.3    0.0000   0.0000          ?        ?   -17.2401  10.8549          ?        ?       19.3        9.3       ?       ? 
1 1 1   33   16   19 o    408.0    2.4    0.0000   0.0000          ?        ?  1664.6260  19.7942          ?        ?      408.0        2.4       ?       ? 
1 1 1   33   16   20 o    253.4    2.6    0.0000   0.0000          ?        ?   642.3527  13.4090          ?        ?      253.4        2.6       ?       ? 
1 1 1   33   16   21 o    674.6    2.8    0.0000   0.0000          ?        ?  4552.0210  37.6728          ?        ?      674.6        2.8       ?       ? 
1 1 1   33   16   22 o     15.9    8.0    0.0000   0.0000          ?        ?   -40.2269  12.1319          ?        ?       15.9        8.0       ?       ? 
1 1 1   33   16   23 o    413.9    2.4    0.0000   0.0000          ?        ?  1713.7920  19.7942          ?        ?      413.9        2.4       ?       ? 
1 1 1   33   16   24 o    231.4    2.8    0.0000   0.0000          ?        ?   535.7197  12.7704          ?        ?      231.4        2.8       ?       ? 
1 1 1   33   16   25 o    387.7    2.3    0.0000   0.0000          ?        ?  1503.0798  17.8786          ?        ?      387.7        2.3       ?       ? 
1 1 1   33   16   26 f    674.1    2.8    0.0000   0.0000          ?        ?  4544.9971  37.6728          ?        ?      674.1        2.8       ?       ? 
1 1 1   33   16   27 o     65.8   10.7    0.0000   0.0000          ?        ?    43.4195  14.0475          ?        ?       65.8       10.7       ?       ? 
1 1 1   33   16   28 o    302.2    2.7    0.0000   0.0000          ?        ?   913.7245  16.6016          ?        ?      302.2        2.7       ?       ? 
1 1 1   33   16   29 o    286.2    2.9    0.0000   0.0000          ?        ?   819.2233  16.6016          ?        ?      286.2        2.9       ?       ? 
1 1 1   33   16   30 o    448.7    2.7    0.0000   0.0000          ?        ?  2013.8972  24.2638          ?        ?      448.7        2.7       ?       ? 
1 1 1   33   16   31 o    384.1    2.7    0.0000   0.0000          ?        ?  1475.6235  21.0712          ?        ?      384.1        2.7       ?       ? 
1 1 1   33   16   32 o    312.6    2.9    0.0000   0.0000          ?        ?   977.5767  17.8786          ?        ?      312.6        2.9       ?       ? 
1 1 1   33   16   33 o    334.1    2.7    0.0000   0.0000          ?        ?  1116.7743  17.8786          ?        ?      334.1        2.7       ?       ? 
1 1 1   33   16   34 o    262.1    3.2    0.0000   0.0000          ?        ?   687.0493  16.6016          ?        ?      262.1        3.2       ?       ? 
1 1 1   33   16   35 o    114.6    6.7    0.0000   0.0000          ?        ?   131.5355  15.3245          ?        ?      114.6        6.7       ?       ? 
1 1 1   33   16   36 o    233.6    3.6    0.0000   0.0000          ?        ?   545.9360  16.6016          ?        ?      233.6        3.6       ?       ? 
1 1 1   33   16   37 o    177.2    4.5    0.0000   0.0000          ?        ?   314.1526  15.9630          ?        ?      177.2        4.5       ?       ? 
1 1 1   33   16   38 o    226.7    3.5    0.0000   0.0000          ?        ?   514.0099  15.9630          ?        ?      226.7        3.5       ?       ? 
1 1 1   33   16   39 o    428.2    2.7    0.0000   0.0000          ?        ?  1834.4725  22.9868          ?        ?      428.2        2.7       ?       ? 
1 1 1   33   16   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   16   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   16   42 o    108.8    7.0    0.0000   0.0000          ?        ?   118.7650  15.3245          ?        ?      108.8        7.0       ?       ? 
1 1 1   33   16   43 o    249.7    3.5    0.0000   0.0000          ?        ?   623.8356  17.2401          ?        ?      249.7        3.5       ?       ? 
1 1 1   33   16   44 o     50.4   14.8    0.0000   0.0000          ?        ?    26.1794  15.9630          ?        ?       50.4       14.8       ?       ? 
1 1 1   33   16   45 o    338.6    2.9    0.0000   0.0000          ?        ?  1146.7849  19.7942          ?        ?      338.6        2.9       ?       ? 
1 1 1   33   16   46 o    180.1    4.8    0.0000   0.0000          ?        ?   325.0075  17.2401          ?        ?      180.1        4.8       ?       ? 
1 1 1   33   16   47 o     67.7   13.2    0.0000   0.0000          ?        ?    47.8891  17.2401          ?        ?       67.7       13.2       ?       ? 
1 1 1   33   16   48 o    364.8    3.0    0.0000   0.0000          ?        ?  1331.3176  21.7097          ?        ?      364.8        3.0       ?       ? 
1 1 1   33   16   49 o    337.7    3.1    0.0000   0.0000          ?        ?  1141.0381  21.0712          ?        ?      337.7        3.1       ?       ? 
1 1 1   33   16   50 o    230.1    4.2    0.0000   0.0000          ?        ?   529.9730  19.1556          ?        ?      230.1        4.2       ?       ? 
1 1 1   33   16   51 o     34.7   14.8    0.0000   0.0000          ?        ?     0.6385  17.8786          ?        ?       34.7       14.8       ?       ? 
1 1 1   33   16   52 o    192.1    4.8    0.0000   0.0000          ?        ?   369.7040  18.5171          ?        ?      192.1        4.8       ?       ? 
1 1 1   33   16   53 o     20.2   10.1    0.0000   0.0000          ?        ?   -52.3588  17.8786          ?        ?       20.2       10.1       ?       ? 
1 1 1   33   16   54 o     26.4   12.7    0.0000   0.0000          ?        ?   -26.8179  19.1556          ?        ?       26.4       12.7       ?       ? 
1 1 1   33   16   55 o     45.4   16.4    0.0000   0.0000          ?        ?    17.8786  19.1556          ?        ?       45.4       16.4       ?       ? 
1 1 1   33   16   56 o     31.8   14.1    0.0000   0.0000          ?        ?    -5.7467  17.8786          ?        ?       31.8       14.1       ?       ? 
1 1 1   33   16   57 o    155.6    6.6    0.0000   0.0000          ?        ?   243.2767  20.4327          ?        ?      155.6        6.6       ?       ? 
1 1 1   33   16   58 o    160.0    6.2    0.0000   0.0000          ?        ?   257.3242  19.7942          ?        ?      160.0        6.2       ?       ? 
1 1 1   33   16   59 f     20.2   10.2    0.0000   0.0000          ?        ?   -65.7677  19.7942          ?        ?       20.2       10.2       ?       ? 
1 1 1   33   16   60 f    142.8    6.9    0.0000   0.0000          ?        ?   205.6040  19.7942          ?        ?      142.8        6.9       ?       ? 
1 1 1   33   16   61 o    154.6    6.2    0.0000   0.0000          ?        ?   240.7227  19.1556          ?        ?      154.6        6.2       ?       ? 
1 1 1   33   16   62 o    156.0    6.1    0.0000   0.0000          ?        ?   245.1923  19.1556          ?        ?      156.0        6.1       ?       ? 
1 1 1   33   17    0 o    204.7    4.5  419.5087  18.5171   419.5087  18.5171   419.5087  18.5171      204.7      4.5      204.7        4.5     0.0     0.0 
1 1 1   33   17    1 o    593.0    2.9    0.0000   0.0000          ?        ?  3516.9771  34.4802          ?        ?      593.0        2.9       ?       ? 
1 1 1   33   17    2 o    387.7    2.6    0.0000   0.0000          ?        ?  1503.0798  19.7942          ?        ?      387.7        2.6       ?       ? 
1 1 1   33   17    3 o    488.3    2.9    0.0000   0.0000          ?        ?  2384.8782  28.7335          ?        ?      488.3        2.9       ?       ? 
1 1 1   33   17    4 o   1068.3    4.2    0.0000   0.0000          ?        ? 11416.1279  89.3930          ?        ?     1068.3        4.2       ?       ? 
1 1 1   33   17    5 o    652.0    3.3    0.0000   0.0000          ?        ?  4251.2769  42.7809          ?        ?      652.0        3.3       ?       ? 
1 1 1   33   17    6 o    747.5    3.2    0.0000   0.0000          ?        ?  5588.3413  48.5276          ?        ?      747.5        3.2       ?       ? 
1 1 1   33   17    7 o     76.2    5.9    0.0000   0.0000          ?        ?    58.1055   8.9393          ?        ?       76.2        5.9       ?       ? 
1 1 1   33   17    8 o    199.3    2.9    0.0000   0.0000          ?        ?   397.1605  11.4934          ?        ?      199.3        2.9       ?       ? 
1 1 1   33   17    9 o    455.7    2.5    0.0000   0.0000          ?        ?  2077.1108  22.3483          ?        ?      455.7        2.5       ?       ? 
1 1 1   33   17   10 o    157.0    4.5    0.0000   0.0000          ?        ?   246.4693  14.0475          ?        ?      157.0        4.5       ?       ? 
1 1 1   33   17   11 o     18.8    8.7    0.0000   0.0000          ?        ?    -6.3852   7.6623          ?        ?       18.8        8.7       ?       ? 
1 1 1   33   17   12 o    722.2    3.1    0.0000   0.0000          ?        ?  5216.7217  44.0580          ?        ?      722.2        3.1       ?       ? 
1 1 1   33   17   13 o    616.8    2.6    0.0000   0.0000          ?        ?  3804.9504  32.5646          ?        ?      616.8        2.6       ?       ? 
1 1 1   33   17   14 o    142.9    3.6    0.0000   0.0000          ?        ?   204.3269  10.2163          ?        ?      142.9        3.6       ?       ? 
1 1 1   33   17   15 o    653.8    2.8    0.0000   0.0000          ?        ?  4275.5405  37.0343          ?        ?      653.8        2.8       ?       ? 
1 1 1   33   17   16 o    698.3    2.8    0.0000   0.0000          ?        ?  4876.3896  39.5883          ?        ?      698.3        2.8       ?       ? 
1 1 1   33   17   17 o    422.3    2.5    0.0000   0.0000          ?        ?  1784.0294  21.0712          ?        ?      422.3        2.5       ?       ? 
1 1 1   33   17   18 o    423.9    2.4    0.0000   0.0000          ?        ?  1796.7998  20.4327          ?        ?      423.9        2.4       ?       ? 
1 1 1   33   17   19 o    113.0    5.1    0.0000   0.0000          ?        ?   127.7043  11.4934          ?        ?      113.0        5.1       ?       ? 
1 1 1   33   17   20 o    320.5    2.5    0.0000   0.0000          ?        ?  1027.3812  15.9630          ?        ?      320.5        2.5       ?       ? 
1 1 1   33   17   21 o    272.7    2.7    0.0000   0.0000          ?        ?   743.8777  14.6860          ?        ?      272.7        2.7       ?       ? 
1 1 1   33   17   22 o    377.9    2.4    0.0000   0.0000          ?        ?  1428.3728  17.8786          ?        ?      377.9        2.4       ?       ? 
1 1 1   33   17   23 o    261.5    2.7    0.0000   0.0000          ?        ?   683.8566  14.0475          ?        ?      261.5        2.7       ?       ? 
1 1 1   33   17   24 o    258.5    2.7    0.0000   0.0000          ?        ?   668.5321  14.0475          ?        ?      258.5        2.7       ?       ? 
1 1 1   33   17   25 o    336.9    2.5    0.0000   0.0000          ?        ?  1135.2915  16.6016          ?        ?      336.9        2.5       ?       ? 
1 1 1   33   17   26 o    387.5    2.6    0.0000   0.0000          ?        ?  1501.8029  20.4327          ?        ?      387.5        2.6       ?       ? 
1 1 1   33   17   27 o    766.6    3.0    0.0000   0.0000          ?        ?  5878.2300  46.6121          ?        ?      766.6        3.0       ?       ? 
1 1 1   33   17   28 o    178.5    3.9    0.0000   0.0000          ?        ?   318.6223  14.0475          ?        ?      178.5        3.9       ?       ? 
1 1 1   33   17   29 o    311.3    2.9    0.0000   0.0000          ?        ?   969.2759  17.8786          ?        ?      311.3        2.9       ?       ? 
1 1 1   33   17   30 o    865.1    3.5    0.0000   0.0000          ?        ?  7487.9429  60.6596          ?        ?      865.1        3.5       ?       ? 
1 1 1   33   17   31 o    332.5    2.7    0.0000   0.0000          ?        ?  1105.9194  17.8786          ?        ?      332.5        2.7       ?       ? 
1 1 1   33   17   32 o    235.8    3.4    0.0000   0.0000          ?        ?   556.1523  15.9630          ?        ?      235.8        3.4       ?       ? 
1 1 1   33   17   33 o     32.8   13.6    0.0000   0.0000          ?        ?     2.5541  14.6860          ?        ?       32.8       13.6       ?       ? 
1 1 1   33   17   34 o    212.1    3.6    0.0000   0.0000          ?        ?   450.1577  15.3245          ?        ?      212.1        3.6       ?       ? 
1 1 1   33   17   35 o    202.6    3.8    0.0000   0.0000          ?        ?   410.5694  15.3245          ?        ?      202.6        3.8       ?       ? 
1 1 1   33   17   36 o    114.3    6.4    0.0000   0.0000          ?        ?   130.8969  14.6860          ?        ?      114.3        6.4       ?       ? 
1 1 1   33   17   37 o    283.0    3.0    0.0000   0.0000          ?        ?   801.3447  17.2401          ?        ?      283.0        3.0       ?       ? 
1 1 1   33   17   38 o    188.5    4.1    0.0000   0.0000          ?        ?   355.6566  15.3245          ?        ?      188.5        4.1       ?       ? 
1 1 1   33   17   39 o    135.0    5.7    0.0000   0.0000          ?        ?   182.6172  15.3245          ?        ?      135.0        5.7       ?       ? 
1 1 1   33   17   40 o    315.9    2.9    0.0000   0.0000          ?        ?   998.6478  18.5171          ?        ?      315.9        2.9       ?       ? 
1 1 1   33   17   41 o    178.6    4.5    0.0000   0.0000          ?        ?   319.2608  15.9630          ?        ?      178.6        4.5       ?       ? 
1 1 1   33   17   42 o    482.0    2.6    0.0000   0.0000          ?        ?  2324.2188  25.5409          ?        ?      482.0        2.6       ?       ? 
1 1 1   33   17   43 o    284.8    3.1    0.0000   0.0000          ?        ?   811.5610  17.8786          ?        ?      284.8        3.1       ?       ? 
1 1 1   33   17   44 o    221.8    3.9    0.0000   0.0000          ?        ?   492.3002  17.2401          ?        ?      221.8        3.9       ?       ? 
1 1 1   33   17   45 o    145.0    5.7    0.0000   0.0000          ?        ?   210.7121  16.6016          ?        ?      145.0        5.7       ?       ? 
1 1 1   33   17   46 o    150.6    5.7    0.0000   0.0000          ?        ?   227.3137  17.2401          ?        ?      150.6        5.7       ?       ? 
1 1 1   33   17   47 o     19.1    9.7    0.0000   0.0000          ?        ?   -60.6596  17.8786          ?        ?       19.1        9.7       ?       ? 
1 1 1   33   17   48 o    338.0    3.1    0.0000   0.0000          ?        ?  1143.5923  21.0712          ?        ?      338.0        3.1       ?       ? 
1 1 1   33   17   49 o    446.5    2.8    0.0000   0.0000          ?        ?  1994.7416  24.9023          ?        ?      446.5        2.8       ?       ? 
1 1 1   33   17   50 o     24.7   12.0    0.0000   0.0000          ?        ?   -28.0950  17.8786          ?        ?       24.7       12.0       ?       ? 
1 1 1   33   17   51 o    301.3    3.4    0.0000   0.0000          ?        ?   908.6163  20.4327          ?        ?      301.3        3.4       ?       ? 
1 1 1   33   17   52 o    163.9    5.6    0.0000   0.0000          ?        ?   269.4561  18.5171          ?        ?      163.9        5.6       ?       ? 
1 1 1   33   17   53 o    237.1    4.2    0.0000   0.0000          ?        ?   563.1760  19.7942          ?        ?      237.1        4.2       ?       ? 
1 1 1   33   17   54 o     20.5   10.3    0.0000   0.0000          ?        ?   -54.2743  18.5171          ?        ?       20.5       10.3       ?       ? 
1 1 1   33   17   55 o    126.7    7.8    0.0000   0.0000          ?        ?   161.5460  19.7942          ?        ?      126.7        7.8       ?       ? 
1 1 1   33   17   56 f    123.3    8.0    0.0000   0.0000          ?        ?   153.2452  19.7942          ?        ?      123.3        8.0       ?       ? 
1 1 1   33   17   57 o     77.5   12.4    0.0000   0.0000          ?        ?    61.2981  19.1556          ?        ?       77.5       12.4       ?       ? 
1 1 1   33   17   58 o     24.3   11.9    0.0000   0.0000          ?        ?   -38.9498  19.7942          ?        ?       24.3       11.9       ?       ? 
1 1 1   33   17   59 o     43.1   16.5    0.0000   0.0000          ?        ?    14.0475  19.7942          ?        ?       43.1       16.5       ?       ? 
1 1 1   33   17   60 o    123.4    7.8    0.0000   0.0000          ?        ?   153.8837  19.1556          ?        ?      123.4        7.8       ?       ? 
1 1 1   33   17   61 o    217.5    4.4    0.0000   0.0000          ?        ?   475.0601  19.1556          ?        ?      217.5        4.4       ?       ? 
1 1 1   33   17   62 o    108.7    8.8    0.0000   0.0000          ?        ?   120.0421  19.1556          ?        ?      108.7        8.8       ?       ? 
1 1 1   33   18    0 o    543.7    3.9 2956.9937  42.1424  2956.9937  42.1424  2956.9937  42.1424      543.7      3.9      543.7        3.9     0.0     0.0 
1 1 1   33   18    1 o    437.1    2.7    0.0000   0.0000          ?        ?  1911.0951  23.6253          ?        ?      437.1        2.7       ?       ? 
1 1 1   33   18    2 o    272.6    2.7    0.0000   0.0000          ?        ?   743.2392  14.6860          ?        ?      272.6        2.7       ?       ? 
1 1 1   33   18    3 o    264.9    3.0    0.0000   0.0000          ?        ?   701.7353  15.9630          ?        ?      264.9        3.0       ?       ? 
1 1 1   33   18    4 o    244.4    3.0    0.0000   0.0000          ?        ?   597.6562  14.6860          ?        ?      244.4        3.0       ?       ? 
1 1 1   33   18    5 o    149.7    4.1    0.0000   0.0000          ?        ?   224.1211  12.1319          ?        ?      149.7        4.1       ?       ? 
1 1 1   33   18    6 o    743.0    3.3    0.0000   0.0000          ?        ?  5521.2964  48.5276          ?        ?      743.0        3.3       ?       ? 
1 1 1   33   18    7 o    316.7    2.4    0.0000   0.0000          ?        ?  1003.1175  15.3245          ?        ?      316.7        2.4       ?       ? 
1 1 1   33   18    8 o    476.7    2.5    0.0000   0.0000          ?        ?  2273.1370  23.6253          ?        ?      476.7        2.5       ?       ? 
1 1 1   33   18    9 o    720.3    3.0    0.0000   0.0000          ?        ?  5189.9038  43.4195          ?        ?      720.3        3.0       ?       ? 
1 1 1   33   18   10 o    695.7    2.9    0.0000   0.0000          ?        ?  4841.2710  40.8654          ?        ?      695.7        2.9       ?       ? 
1 1 1   33   18   11 o    940.1    3.8    0.0000   0.0000          ?        ?  8840.3320  70.8759          ?        ?      940.1        3.8       ?       ? 
1 1 1   33   18   12 f    138.2    3.0    0.0000   0.0000          ?        ?   190.9180   8.3008          ?        ?      138.2        3.0       ?       ? 
1 1 1   33   18   13 o    243.8    2.4    0.0000   0.0000          ?        ?   594.4636  11.4934          ?        ?      243.8        2.4       ?       ? 
1 1 1   33   18   14 o    386.8    2.1    0.0000   0.0000          ?        ?  1496.0562  16.6016          ?        ?      386.8        2.1       ?       ? 
1 1 1   33   18   15 o    167.8    3.2    0.0000   0.0000          ?        ?   281.5880  10.8549          ?        ?      167.8        3.2       ?       ? 
1 1 1   33   18   16 o    483.7    2.4    0.0000   0.0000          ?        ?  2340.1816  23.6253          ?        ?      483.7        2.4       ?       ? 
1 1 1   33   18   17 o    775.1    3.0    0.0000   0.0000          ?        ?  6009.7656  46.6121          ?        ?      775.1        3.0       ?       ? 
1 1 1   33   18   18 o    447.4    2.5    0.0000   0.0000          ?        ?  2002.4038  22.3483          ?        ?      447.4        2.5       ?       ? 
1 1 1   33   18   19 o    334.9    2.4    0.0000   0.0000          ?        ?  1121.8824  15.9630          ?        ?      334.9        2.4       ?       ? 
1 1 1   33   18   20 f    250.8    2.7    0.0000   0.0000          ?        ?   628.9438  13.4090          ?        ?      250.8        2.7       ?       ? 
1 1 1   33   18   21 f    633.7    2.7    0.0000   0.0000          ?        ?  4016.9395  33.8416          ?        ?      633.7        2.7       ?       ? 
1 1 1   33   18   22 o    497.0    2.4    0.0000   0.0000          ?        ?  2470.4402  24.2638          ?        ?      497.0        2.4       ?       ? 
1 1 1   33   18   23 o    148.8    4.1    0.0000   0.0000          ?        ?   221.5670  12.1319          ?        ?      148.8        4.1       ?       ? 
1 1 1   33   18   24 o    187.5    3.6    0.0000   0.0000          ?        ?   351.8254  13.4090          ?        ?      187.5        3.6       ?       ? 
1 1 1   33   18   25 o    475.8    2.5    0.0000   0.0000          ?        ?  2264.1978  24.2638          ?        ?      475.8        2.5       ?       ? 
1 1 1   33   18   26 f    602.4    2.7    0.0000   0.0000          ?        ?  3629.3572  31.9261          ?        ?      602.4        2.7       ?       ? 
1 1 1   33   18   27 o    457.2    2.6    0.0000   0.0000          ?        ?  2090.5198  23.6253          ?        ?      457.2        2.6       ?       ? 
1 1 1   33   18   28 o    360.8    2.7    0.0000   0.0000          ?        ?  1301.9456  19.1556          ?        ?      360.8        2.7       ?       ? 
1 1 1   33   18   29 o    413.3    2.6    0.0000   0.0000          ?        ?  1708.6840  21.7097          ?        ?      413.3        2.6       ?       ? 
1 1 1   33   18   30 o     89.6    8.2    0.0000   0.0000          ?        ?    80.4537  14.6860          ?        ?       89.6        8.2       ?       ? 
1 1 1   33   18   31 o    279.8    2.7    0.0000   0.0000          ?        ?   782.8275  15.3245          ?        ?      279.8        2.7       ?       ? 
1 1 1   33   18   32 o    229.7    3.6    0.0000   0.0000          ?        ?   528.0574  16.6016          ?        ?      229.7        3.6       ?       ? 
1 1 1   33   18   33 o    337.9    2.7    0.0000   0.0000          ?        ?  1142.3152  18.5171          ?        ?      337.9        2.7       ?       ? 
1 1 1   33   18   34 o    266.3    3.1    0.0000   0.0000          ?        ?   709.3975  16.6016          ?        ?      266.3        3.1       ?       ? 
1 1 1   33   18   35 o    337.6    2.8    0.0000   0.0000          ?        ?  1140.3997  19.1556          ?        ?      337.6        2.8       ?       ? 
1 1 1   33   18   36 o    351.9    2.6    0.0000   0.0000          ?        ?  1238.7319  18.5171          ?        ?      351.9        2.6       ?       ? 
1 1 1   33   18   37 o    179.0    4.3    0.0000   0.0000          ?        ?   320.5379  15.3245          ?        ?      179.0        4.3       ?       ? 
1 1 1   33   18   38 o    178.9    4.3    0.0000   0.0000          ?        ?   320.5379  15.3245          ?        ?      178.9        4.3       ?       ? 
1 1 1   33   18   39 o    232.2    3.4    0.0000   0.0000          ?        ?   539.5508  15.9630          ?        ?      232.2        3.4       ?       ? 
1 1 1   33   18   40 o    203.9    4.1    0.0000   0.0000          ?        ?   416.3161  16.6016          ?        ?      203.9        4.1       ?       ? 
1 1 1   33   18   41 o     35.4   14.4    0.0000   0.0000          ?        ?     5.1082  15.9630          ?        ?       35.4       14.4       ?       ? 
1 1 1   33   18   42 o    276.5    3.3    0.0000   0.0000          ?        ?   764.9489  18.5171          ?        ?      276.5        3.3       ?       ? 
1 1 1   33   18   43 o    329.7    3.1    0.0000   0.0000          ?        ?  1087.4023  20.4327          ?        ?      329.7        3.1       ?       ? 
1 1 1   33   18   44 o     72.0   12.0    0.0000   0.0000          ?        ?    52.3588  17.2401          ?        ?       72.0       12.0       ?       ? 
1 1 1   33   18   45 o    453.6    2.7    0.0000   0.0000          ?        ?  2058.5938  24.9023          ?        ?      453.6        2.7       ?       ? 
1 1 1   33   18   46 o    343.0    3.0    0.0000   0.0000          ?        ?  1177.4338  20.4327          ?        ?      343.0        3.0       ?       ? 
1 1 1   33   18   47 o    360.9    2.9    0.0000   0.0000          ?        ?  1303.2227  21.0712          ?        ?      360.9        2.9       ?       ? 
1 1 1   33   18   48 o    204.1    4.2    0.0000   0.0000          ?        ?   416.9547  17.2401          ?        ?      204.1        4.2       ?       ? 
1 1 1   33   18   49 o    115.8    7.4    0.0000   0.0000          ?        ?   134.7281  17.2401          ?        ?      115.8        7.4       ?       ? 
1 1 1   33   18   50 o     94.5    9.5    0.0000   0.0000          ?        ?    90.0316  17.8786          ?        ?       94.5        9.5       ?       ? 
1 1 1   33   18   51 o    401.4    3.0    0.0000   0.0000          ?        ?  1612.2671  24.2638          ?        ?      401.4        3.0       ?       ? 
1 1 1   33   18   52 o    362.1    3.1    0.0000   0.0000          ?        ?  1312.1620  22.3483          ?        ?      362.1        3.1       ?       ? 
1 1 1   33   18   53 o    166.3    5.9    0.0000   0.0000          ?        ?   277.7569  19.7942          ?        ?      166.3        5.9       ?       ? 
1 1 1   33   18   54 o    321.8    3.3    0.0000   0.0000          ?        ?  1036.9591  21.0712          ?        ?      321.8        3.3       ?       ? 
1 1 1   33   18   55 f     59.4   15.8    0.0000   0.0000          ?        ?    37.6728  19.1556          ?        ?       59.4       15.8       ?       ? 
1 1 1   33   18   56 o     88.6   11.2    0.0000   0.0000          ?        ?    79.8152  19.7942          ?        ?       88.6       11.2       ?       ? 
1 1 1   33   18   57 o     34.1   15.0    0.0000   0.0000          ?        ?    -4.4697  19.7942          ?        ?       34.1       15.0       ?       ? 
1 1 1   33   18   58 o     29.3   13.6    0.0000   0.0000          ?        ?   -15.9630  19.1556          ?        ?       29.3       13.6       ?       ? 
1 1 1   33   18   59 o    217.7    4.5    0.0000   0.0000          ?        ?   475.6986  19.7942          ?        ?      217.7        4.5       ?       ? 
1 1 1   33   18   60 o    209.8    4.7    0.0000   0.0000          ?        ?   441.8569  19.7942          ?        ?      209.8        4.7       ?       ? 
1 1 1   33   18   61 o    135.5    7.5    0.0000   0.0000          ?        ?   185.8098  20.4327          ?        ?      135.5        7.5       ?       ? 
1 1 1   33   19    0 o     15.3   10.9  -18.5171  14.0475   -18.5171  14.0475   -18.5171  14.0475       15.3     10.9       15.3       10.9     0.0     0.0 
1 1 1   33   19    1 o     70.5    7.2    0.0000   0.0000          ?        ?    49.8047  10.2163          ?        ?       70.5        7.2       ?       ? 
1 1 1   33   19    2 o    300.3    2.7    0.0000   0.0000          ?        ?   902.2311  15.9630          ?        ?      300.3        2.7       ?       ? 
1 1 1   33   19    3 o    734.2    3.2    0.0000   0.0000          ?        ?  5391.0381  46.6121          ?        ?      734.2        3.2       ?       ? 
1 1 1   33   19    4 o    610.1    2.9    0.0000   0.0000          ?        ?  3723.2195  35.7572          ?        ?      610.1        2.9       ?       ? 
1 1 1   33   19    5 o    408.1    2.6    0.0000   0.0000          ?        ?  1665.9028  21.0712          ?        ?      408.1        2.6       ?       ? 
1 1 1   33   19    6 o    738.1    3.2    0.0000   0.0000          ?        ?  5448.5049  47.2506          ?        ?      738.1        3.2       ?       ? 
1 1 1   33   19    7 o    593.1    2.9    0.0000   0.0000          ?        ?  3518.2542  34.4802          ?        ?      593.1        2.9       ?       ? 
1 1 1   33   19    8 o    758.3    3.3    0.0000   0.0000          ?        ?  5751.1646  49.8047          ?        ?      758.3        3.3       ?       ? 
1 1 1   33   19    9 o    340.7    2.4    0.0000   0.0000          ?        ?  1160.8323  16.6016          ?        ?      340.7        2.4       ?       ? 
1 1 1   33   19   10 o    343.1    2.3    0.0000   0.0000          ?        ?  1177.4338  15.9630          ?        ?      343.1        2.3       ?       ? 
1 1 1   33   19   11 o    334.0    2.5    0.0000   0.0000          ?        ?  1115.4973  16.6016          ?        ?      334.0        2.5       ?       ? 
1 1 1   33   19   12 o    401.8    2.4    0.0000   0.0000          ?        ?  1614.8212  19.1556          ?        ?      401.8        2.4       ?       ? 
1 1 1   33   19   13 f    470.7    2.3    0.0000   0.0000          ?        ?  2215.6699  21.7097          ?        ?      470.7        2.3       ?       ? 
1 1 1   33   19   14 o    786.6    3.0    0.0000   0.0000          ?        ?  6188.5518  47.8891          ?        ?      786.6        3.0       ?       ? 
1 1 1   33   19   15 o    664.8    2.7    0.0000   0.0000          ?        ?  4419.8467  35.7572          ?        ?      664.8        2.7       ?       ? 
1 1 1   33   19   16 o    161.0    3.2    0.0000   0.0000          ?        ?   259.2398  10.2163          ?        ?      161.0        3.2       ?       ? 
1 1 1   33   19   17 o    504.0    2.5    0.0000   0.0000          ?        ?  2540.6775  24.9023          ?        ?      504.0        2.5       ?       ? 
1 1 1   33   19   18 o    398.1    2.3    0.0000   0.0000          ?        ?  1584.8107  18.5171          ?        ?      398.1        2.3       ?       ? 
1 1 1   33   19   19 o    214.8    3.0    0.0000   0.0000          ?        ?   461.6512  12.7704          ?        ?      214.8        3.0       ?       ? 
1 1 1   33   19   20 o    205.9    2.9    0.0000   0.0000          ?        ?   423.9784  12.1319          ?        ?      205.9        2.9       ?       ? 
1 1 1   33   19   21 o    456.3    2.5    0.0000   0.0000          ?        ?  2082.2190  22.9868          ?        ?      456.3        2.5       ?       ? 
1 1 1   33   19   22 o    135.8    4.7    0.0000   0.0000          ?        ?   184.5327  12.7704          ?        ?      135.8        4.7       ?       ? 
1 1 1   33   19   23 o    707.3    3.0    0.0000   0.0000          ?        ?  5004.7324  42.1424          ?        ?      707.3        3.0       ?       ? 
1 1 1   33   19   24 o    245.5    3.0    0.0000   0.0000          ?        ?   602.7644  14.6860          ?        ?      245.5        3.0       ?       ? 
1 1 1   33   19   25 o    311.4    2.8    0.0000   0.0000          ?        ?   969.9143  17.2401          ?        ?      311.4        2.8       ?       ? 
1 1 1   33   19   26 o     97.1    6.6    0.0000   0.0000          ?        ?    94.5012  12.7704          ?        ?       97.1        6.6       ?       ? 
1 1 1   33   19   27 o    618.6    2.7    0.0000   0.0000          ?        ?  3827.2988  33.8416          ?        ?      618.6        2.7       ?       ? 
1 1 1   33   19   28 o    331.6    2.6    0.0000   0.0000          ?        ?  1100.1727  17.2401          ?        ?      331.6        2.6       ?       ? 
1 1 1   33   19   29 o    325.3    2.8    0.0000   0.0000          ?        ?  1058.6688  18.5171          ?        ?      325.3        2.8       ?       ? 
1 1 1   33   19   30 o    899.2    3.6    0.0000   0.0000          ?        ?  8089.4307  65.1292          ?        ?      899.2        3.6       ?       ? 
1 1 1   33   19   31 o    174.1    4.2    0.0000   0.0000          ?        ?   303.2978  14.6860          ?        ?      174.1        4.2       ?       ? 
1 1 1   33   19   32 o    323.7    2.8    0.0000   0.0000          ?        ?  1048.4525  17.8786          ?        ?      323.7        2.8       ?       ? 
1 1 1   33   19   33 o    124.5    5.6    0.0000   0.0000          ?        ?   155.1608  14.0475          ?        ?      124.5        5.6       ?       ? 
1 1 1   33   19   34 o    455.4    2.7    0.0000   0.0000          ?        ?  2074.5566  24.2638          ?        ?      455.4        2.7       ?       ? 
1 1 1   33   19   35 f    497.7    2.7    0.0000   0.0000          ?        ?  2478.1025  26.8179          ?        ?      497.7        2.7       ?       ? 
1 1 1   33   19   36 o    195.5    4.1    0.0000   0.0000          ?        ?   382.4745  15.9630          ?        ?      195.5        4.1       ?       ? 
1 1 1   33   19   37 o    240.4    3.3    0.0000   0.0000          ?        ?   578.5006  15.9630          ?        ?      240.4        3.3       ?       ? 
1 1 1   33   19   38 f    279.4    3.2    0.0000   0.0000          ?        ?   780.9120  17.8786          ?        ?      279.4        3.2       ?       ? 
1 1 1   33   19   39 o     17.5    8.9    0.0000   0.0000          ?        ?   -58.7440  15.9630          ?        ?       17.5        8.9       ?       ? 
1 1 1   33   19   40 o    388.9    2.5    0.0000   0.0000          ?        ?  1513.2963  19.7942          ?        ?      388.9        2.5       ?       ? 
1 1 1   33   19   41 o     29.7   13.2    0.0000   0.0000          ?        ?    -6.3852  15.9630          ?        ?       29.7       13.2       ?       ? 
1 1 1   33   19   42 o    337.0    2.8    0.0000   0.0000          ?        ?  1136.5685  19.1556          ?        ?      337.0        2.8       ?       ? 
1 1 1   33   19   43 o    397.4    2.7    0.0000   0.0000          ?        ?  1580.3411  21.7097          ?        ?      397.4        2.7       ?       ? 
1 1 1   33   19   44 o     91.2    9.8    0.0000   0.0000          ?        ?    83.6463  17.8786          ?        ?       91.2        9.8       ?       ? 
1 1 1   33   19   45 o    308.8    3.0    0.0000   0.0000          ?        ?   953.9513  18.5171          ?        ?      308.8        3.0       ?       ? 
1 1 1   33   19   46 o     29.0   13.3    0.0000   0.0000          ?        ?   -13.4090  17.8786          ?        ?       29.0       13.3       ?       ? 
1 1 1   33   19   47 o     42.3   15.8    0.0000   0.0000          ?        ?    14.0475  17.8786          ?        ?       42.3       15.8       ?       ? 
1 1 1   33   19   48 o    366.2    3.0    0.0000   0.0000          ?        ?  1342.1725  21.7097          ?        ?      366.2        3.0       ?       ? 
1 1 1   33   19   49 o    308.3    3.2    0.0000   0.0000          ?        ?   951.3972  19.7942          ?        ?      308.3        3.2       ?       ? 
1 1 1   33   19   50 o    289.6    3.5    0.0000   0.0000          ?        ?   839.6559  20.4327          ?        ?      289.6        3.5       ?       ? 
1 1 1   33   19   51 o    281.0    3.7    0.0000   0.0000          ?        ?   790.4898  21.0712          ?        ?      281.0        3.7       ?       ? 
1 1 1   33   19   52 o    230.1    4.6    0.0000   0.0000          ?        ?   530.6115  21.0712          ?        ?      230.1        4.6       ?       ? 
1 1 1   33   19   53 o    192.0    5.0    0.0000   0.0000          ?        ?   369.7040  19.1556          ?        ?      192.0        5.0       ?       ? 
1 1 1   33   19   54 o    229.1    4.3    0.0000   0.0000          ?        ?   526.1418  19.7942          ?        ?      229.1        4.3       ?       ? 
1 1 1   33   19   55 o    200.3    4.6    0.0000   0.0000          ?        ?   402.2686  18.5171          ?        ?      200.3        4.6       ?       ? 
1 1 1   33   19   56 o     36.3   15.2    0.0000   0.0000          ?        ?     3.1926  18.5171          ?        ?       36.3       15.2       ?       ? 
1 1 1   33   19   57 o    186.3    5.3    0.0000   0.0000          ?        ?   348.6328  19.7942          ?        ?      186.3        5.3       ?       ? 
1 1 1   33   19   58 o     23.6   11.6    0.0000   0.0000          ?        ?   -42.1424  19.7942          ?        ?       23.6       11.6       ?       ? 
1 1 1   33   19   59 o     71.3   13.9    0.0000   0.0000          ?        ?    54.2743  19.1556          ?        ?       71.3       13.9       ?       ? 
1 1 1   33   19   60 o     91.9   10.1    0.0000   0.0000          ?        ?    86.2004  18.5171          ?        ?       91.9       10.1       ?       ? 
1 1 1   33   20    0 o     47.4   16.5   29.3720  14.0475    29.3720  14.0475    29.3720  14.0475       47.4     16.5       47.4       16.5     0.0     0.0 
1 1 1   33   20    1 o    189.7    3.0    0.0000   0.0000          ?        ?   360.1262  11.4934          ?        ?      189.7        3.0       ?       ? 
1 1 1   33   20    2 o    529.9    2.7    0.0000   0.0000          ?        ?  2808.8567  28.0950          ?        ?      529.9        2.7       ?       ? 
1 1 1   33   20    3 o    373.3    2.7    0.0000   0.0000          ?        ?  1393.8927  20.4327          ?        ?      373.3        2.7       ?       ? 
1 1 1   33   20    4 o    718.0    3.2    0.0000   0.0000          ?        ?  5156.7007  45.9736          ?        ?      718.0        3.2       ?       ? 
1 1 1   33   20    5 o    200.4    3.0    0.0000   0.0000          ?        ?   401.6301  12.1319          ?        ?      200.4        3.0       ?       ? 
1 1 1   33   20    6 o    112.1    5.1    0.0000   0.0000          ?        ?   125.7888  11.4934          ?        ?      112.1        5.1       ?       ? 
1 1 1   33   20    7 o    333.3    2.9    0.0000   0.0000          ?        ?  1111.0276  19.1556          ?        ?      333.3        2.9       ?       ? 
1 1 1   33   20    8 o    325.6    2.5    0.0000   0.0000          ?        ?  1060.5845  15.9630          ?        ?      325.6        2.5       ?       ? 
1 1 1   33   20    9 o    204.3    2.8    0.0000   0.0000          ?        ?   417.5931  11.4934          ?        ?      204.3        2.8       ?       ? 
1 1 1   33   20   10 o    196.5    2.9    0.0000   0.0000          ?        ?   386.3056  11.4934          ?        ?      196.5        2.9       ?       ? 
1 1 1   33   20   11 o    513.0    2.7    0.0000   0.0000          ?        ?  2632.6245  27.4564          ?        ?      513.0        2.7       ?       ? 
1 1 1   33   20   12 o    440.6    2.5    0.0000   0.0000          ?        ?  1941.7443  21.7097          ?        ?      440.6        2.5       ?       ? 
1 1 1   33   20   13 o     16.0    8.0    0.0000   0.0000          ?        ?   -35.1187  11.4934          ?        ?       16.0        8.0       ?       ? 
1 1 1   33   20   14 o    193.1    2.6    0.0000   0.0000          ?        ?   372.8966  10.2163          ?        ?      193.1        2.6       ?       ? 
1 1 1   33   20   15 o    123.5    3.6    0.0000   0.0000          ?        ?   152.6067   8.9393          ?        ?      123.5        3.6       ?       ? 
1 1 1   33   20   16 o    355.3    2.2    0.0000   0.0000          ?        ?  1262.3572  15.9630          ?        ?      355.3        2.2       ?       ? 
1 1 1   33   20   17 o    442.6    2.3    0.0000   0.0000          ?        ?  1959.6228  20.4327          ?        ?      442.6        2.3       ?       ? 
1 1 1   33   20   18 o    419.6    2.4    0.0000   0.0000          ?        ?  1761.0426  20.4327          ?        ?      419.6        2.4       ?       ? 
1 1 1   33   20   19 o    489.7    2.5    0.0000   0.0000          ?        ?  2398.2874  24.2638          ?        ?      489.7        2.5       ?       ? 
1 1 1   33   20   20 o    343.6    2.4    0.0000   0.0000          ?        ?  1180.6265  16.6016          ?        ?      343.6        2.4       ?       ? 
1 1 1   33   20   21 o    671.5    2.8    0.0000   0.0000          ?        ?  4510.5171  37.6728          ?        ?      671.5        2.8       ?       ? 
1 1 1   33   20   22 o    175.0    3.6    0.0000   0.0000          ?        ?   306.4904  12.7704          ?        ?      175.0        3.6       ?       ? 
1 1 1   33   20   23 o    160.8    4.2    0.0000   0.0000          ?        ?   258.6013  13.4090          ?        ?      160.8        4.2       ?       ? 
1 1 1   33   20   24 o    369.2    2.4    0.0000   0.0000          ?        ?  1363.2437  17.8786          ?        ?      369.2        2.4       ?       ? 
1 1 1   33   20   25 o    445.3    2.6    0.0000   0.0000          ?        ?  1983.2482  22.9868          ?        ?      445.3        2.6       ?       ? 
1 1 1   33   20   26 o    427.7    2.5    0.0000   0.0000          ?        ?  1829.3645  21.0712          ?        ?      427.7        2.5       ?       ? 
1 1 1   33   20   27 o    245.5    3.3    0.0000   0.0000          ?        ?   602.7644  15.9630          ?        ?      245.5        3.3       ?       ? 
1 1 1   33   20   28 o    305.9    2.8    0.0000   0.0000          ?        ?   936.0728  17.2401          ?        ?      305.9        2.8       ?       ? 
1 1 1   33   20   29 o    104.1    7.1    0.0000   0.0000          ?        ?   108.5487  14.6860          ?        ?      104.1        7.1       ?       ? 
1 1 1   33   20   30 o    441.7    2.7    0.0000   0.0000          ?        ?  1951.3221  24.2638          ?        ?      441.7        2.7       ?       ? 
1 1 1   33   20   31 o    573.8    2.8    0.0000   0.0000          ?        ?  3293.4944  31.9261          ?        ?      573.8        2.8       ?       ? 
1 1 1   33   20   32 o     74.4   10.3    0.0000   0.0000          ?        ?    55.5514  15.3245          ?        ?       74.4       10.3       ?       ? 
1 1 1   33   20   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   20   34 o    310.1    2.8    0.0000   0.0000          ?        ?   962.2521  17.2401          ?        ?      310.1        2.8       ?       ? 
1 1 1   33   20   35 o    115.9    6.3    0.0000   0.0000          ?        ?   134.7281  14.6860          ?        ?      115.9        6.3       ?       ? 
1 1 1   33   20   36 o    170.4    4.5    0.0000   0.0000          ?        ?   290.5273  15.3245          ?        ?      170.4        4.5       ?       ? 
1 1 1   33   20   37 o    166.9    4.6    0.0000   0.0000          ?        ?   279.0340  15.3245          ?        ?      166.9        4.6       ?       ? 
1 1 1   33   20   38 o    511.0    2.7    0.0000   0.0000          ?        ?  2612.8306  28.0950          ?        ?      511.0        2.7       ?       ? 
1 1 1   33   20   39 o    341.9    2.8    0.0000   0.0000          ?        ?  1169.7716  19.1556          ?        ?      341.9        2.8       ?       ? 
1 1 1   33   20   40 o    167.9    4.9    0.0000   0.0000          ?        ?   282.2266  16.6016          ?        ?      167.9        4.9       ?       ? 
1 1 1   33   20   41 o    342.6    2.9    0.0000   0.0000          ?        ?  1174.2412  19.7942          ?        ?      342.6        2.9       ?       ? 
1 1 1   33   20   42 o    185.4    4.3    0.0000   0.0000          ?        ?   344.1632  15.9630          ?        ?      185.4        4.3       ?       ? 
1 1 1   33   20   43 o    152.5    5.2    0.0000   0.0000          ?        ?   233.0604  15.9630          ?        ?      152.5        5.2       ?       ? 
1 1 1   33   20   44 o    240.7    3.6    0.0000   0.0000          ?        ?   579.7776  17.2401          ?        ?      240.7        3.6       ?       ? 
1 1 1   33   20   45 o    240.6    3.8    0.0000   0.0000          ?        ?   579.7776  18.5171          ?        ?      240.6        3.8       ?       ? 
1 1 1   33   20   46 o     42.7   15.6    0.0000   0.0000          ?        ?    15.3245  17.2401          ?        ?       42.7       15.6       ?       ? 
1 1 1   33   20   47 o     80.3   11.1    0.0000   0.0000          ?        ?    65.1292  17.8786          ?        ?       80.3       11.1       ?       ? 
1 1 1   33   20   48 f    288.5    3.4    0.0000   0.0000          ?        ?   833.2708  19.7942          ?        ?      288.5        3.4       ?       ? 
1 1 1   33   20   49 o    122.2    7.6    0.0000   0.0000          ?        ?   150.0526  18.5171          ?        ?      122.2        7.6       ?       ? 
1 1 1   33   20   50 o    213.7    4.5    0.0000   0.0000          ?        ?   457.8200  19.1556          ?        ?      213.7        4.5       ?       ? 
1 1 1   33   20   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   20   52 o     70.0   13.7    0.0000   0.0000          ?        ?    51.7203  18.5171          ?        ?       70.0       13.7       ?       ? 
1 1 1   33   20   53 o     33.4   14.5    0.0000   0.0000          ?        ?    -1.9156  17.8786          ?        ?       33.4       14.5       ?       ? 
1 1 1   33   20   54 o    231.5    4.3    0.0000   0.0000          ?        ?   536.9967  19.7942          ?        ?      231.5        4.3       ?       ? 
1 1 1   33   20   55 o    217.8    4.4    0.0000   0.0000          ?        ?   475.6986  19.1556          ?        ?      217.8        4.4       ?       ? 
1 1 1   33   20   56 o    171.1    5.6    0.0000   0.0000          ?        ?   294.3585  19.1556          ?        ?      171.1        5.6       ?       ? 
1 1 1   33   20   57 o     84.4   11.0    0.0000   0.0000          ?        ?    72.7915  18.5171          ?        ?       84.4       11.0       ?       ? 
1 1 1   33   20   58 o     68.7   15.3    0.0000   0.0000          ?        ?    51.0817  20.4327          ?        ?       68.7       15.3       ?       ? 
1 1 1   33   20   59 o    194.6    4.9    0.0000   0.0000          ?        ?   380.5589  19.1556          ?        ?      194.6        4.9       ?       ? 
1 1 1   33   21    0 o    828.2    4.8 6862.1914  79.8152  6862.1914  79.8152  6862.1914  79.8152      828.2      4.8      828.2        4.8     0.0     0.0 
1 1 1   33   21    1 o    163.1    5.7    0.0000   0.0000          ?        ?   266.2635  18.5171          ?        ?      163.1        5.7       ?       ? 
1 1 1   33   21    2 o    159.2    3.4    0.0000   0.0000          ?        ?   253.4931  10.8549          ?        ?      159.2        3.4       ?       ? 
1 1 1   33   21    3 o    416.9    2.6    0.0000   0.0000          ?        ?  1738.6943  21.7097          ?        ?      416.9        2.6       ?       ? 
1 1 1   33   21    4 o    353.6    2.7    0.0000   0.0000          ?        ?  1250.2253  19.1556          ?        ?      353.6        2.7       ?       ? 
1 1 1   33   21    5 f     45.7   12.3    0.0000   0.0000          ?        ?    21.7097  11.4934          ?        ?       45.7       12.3       ?       ? 
1 1 1   33   21    6 o    299.9    2.9    0.0000   0.0000          ?        ?   899.6769  17.2401          ?        ?      299.9        2.9       ?       ? 
1 1 1   33   21    7 o    335.8    2.7    0.0000   0.0000          ?        ?  1127.6293  17.8786          ?        ?      335.8        2.7       ?       ? 
1 1 1   33   21    8 o    362.0    2.6    0.0000   0.0000          ?        ?  1310.8849  18.5171          ?        ?      362.0        2.6       ?       ? 
1 1 1   33   21    9 o    600.2    2.8    0.0000   0.0000          ?        ?  3603.1775  33.2031          ?        ?      600.2        2.8       ?       ? 
1 1 1   33   21   10 o    259.6    2.5    0.0000   0.0000          ?        ?   674.2788  12.7704          ?        ?      259.6        2.5       ?       ? 
1 1 1   33   21   11 o    202.9    2.8    0.0000   0.0000          ?        ?   411.8464  11.4934          ?        ?      202.9        2.8       ?       ? 
1 1 1   33   21   12 o    284.0    2.6    0.0000   0.0000          ?        ?   806.4528  14.6860          ?        ?      284.0        2.6       ?       ? 
1 1 1   33   21   13 o    352.5    2.4    0.0000   0.0000          ?        ?  1242.5631  16.6016          ?        ?      352.5        2.4       ?       ? 
1 1 1   33   21   14 o    461.4    2.3    0.0000   0.0000          ?        ?  2128.8311  21.0712          ?        ?      461.4        2.3       ?       ? 
1 1 1   33   21   15 f    119.6    3.7    0.0000   0.0000          ?        ?   143.0288   8.9393          ?        ?      119.6        3.7       ?       ? 
1 1 1   33   21   16 o     48.3   10.2    0.0000   0.0000          ?        ?    24.2638   9.5778          ?        ?       48.3       10.2       ?       ? 
1 1 1   33   21   17 o    229.6    2.5    0.0000   0.0000          ?        ?   527.4188  11.4934          ?        ?      229.6        2.5       ?       ? 
1 1 1   33   21   18 o    283.1    2.6    0.0000   0.0000          ?        ?   801.3447  14.6860          ?        ?      283.1        2.6       ?       ? 
1 1 1   33   21   19 o    178.1    3.4    0.0000   0.0000          ?        ?   317.3452  12.1319          ?        ?      178.1        3.4       ?       ? 
1 1 1   33   21   20 o    119.3    4.8    0.0000   0.0000          ?        ?   142.3903  11.4934          ?        ?      119.3        4.8       ?       ? 
1 1 1   33   21   21 o    160.4    4.0    0.0000   0.0000          ?        ?   257.3242  12.7704          ?        ?      160.4        4.0       ?       ? 
1 1 1   33   21   22 o    188.0    3.4    0.0000   0.0000          ?        ?   353.7410  12.7704          ?        ?      188.0        3.4       ?       ? 
1 1 1   33   21   23 o    804.5    3.1    0.0000   0.0000          ?        ?  6474.6094  49.8047          ?        ?      804.5        3.1       ?       ? 
1 1 1   33   21   24 o    187.5    3.4    0.0000   0.0000          ?        ?   351.8254  12.7704          ?        ?      187.5        3.4       ?       ? 
1 1 1   33   21   25 o    484.8    2.4    0.0000   0.0000          ?        ?  2350.3982  23.6253          ?        ?      484.8        2.4       ?       ? 
1 1 1   33   21   26 o    464.6    2.5    0.0000   0.0000          ?        ?  2159.4802  23.6253          ?        ?      464.6        2.5       ?       ? 
1 1 1   33   21   27 o    435.6    2.6    0.0000   0.0000          ?        ?  1898.3247  22.3483          ?        ?      435.6        2.6       ?       ? 
1 1 1   33   21   28 o    634.1    2.9    0.0000   0.0000          ?        ?  4022.6863  36.3957          ?        ?      634.1        2.9       ?       ? 
1 1 1   33   21   29 o    551.0    2.8    0.0000   0.0000          ?        ?  3037.4475  31.2876          ?        ?      551.0        2.8       ?       ? 
1 1 1   33   21   30 o    475.7    3.0    0.0000   0.0000          ?        ?  2263.5591  28.7335          ?        ?      475.7        3.0       ?       ? 
1 1 1   33   21   31 o     66.2   10.6    0.0000   0.0000          ?        ?    44.0580  14.0475          ?        ?       66.2       10.6       ?       ? 
1 1 1   33   21   32 o    339.6    2.9    0.0000   0.0000          ?        ?  1153.8086  19.7942          ?        ?      339.6        2.9       ?       ? 
1 1 1   33   21   33 o    213.1    3.9    0.0000   0.0000          ?        ?   454.6274  16.6016          ?        ?      213.1        3.9       ?       ? 
1 1 1   33   21   34 f    323.8    2.9    0.0000   0.0000          ?        ?  1049.0911  18.5171          ?        ?      323.8        2.9       ?       ? 
1 1 1   33   21   35 o    246.2    3.2    0.0000   0.0000          ?        ?   606.5955  15.9630          ?        ?      246.2        3.2       ?       ? 
1 1 1   33   21   36 o    242.8    3.4    0.0000   0.0000          ?        ?   589.9940  16.6016          ?        ?      242.8        3.4       ?       ? 
1 1 1   33   21   37 o     26.0   12.0    0.0000   0.0000          ?        ?   -12.1319  14.6860          ?        ?       26.0       12.0       ?       ? 
1 1 1   33   21   38 o     24.7   11.8    0.0000   0.0000          ?        ?   -22.9868  16.6016          ?        ?       24.7       11.8       ?       ? 
1 1 1   33   21   39 o    233.0    3.7    0.0000   0.0000          ?        ?   543.3819  17.2401          ?        ?      233.0        3.7       ?       ? 
1 1 1   33   21   40 o    558.8    2.7    0.0000   0.0000          ?        ?  3124.2861  30.0105          ?        ?      558.8        2.7       ?       ? 
1 1 1   33   21   41 o    115.3    7.2    0.0000   0.0000          ?        ?   133.4510  16.6016          ?        ?      115.3        7.2       ?       ? 
1 1 1   33   21   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   21   43 o    160.3    5.2    0.0000   0.0000          ?        ?   257.3242  16.6016          ?        ?      160.3        5.2       ?       ? 
1 1 1   33   21   44 o    159.2    5.6    0.0000   0.0000          ?        ?   254.1316  17.8786          ?        ?      159.2        5.6       ?       ? 
1 1 1   33   21   45 o    197.8    4.5    0.0000   0.0000          ?        ?   392.0523  17.8786          ?        ?      197.8        4.5       ?       ? 
1 1 1   33   21   46 o     62.1   14.6    0.0000   0.0000          ?        ?    40.8654  17.8786          ?        ?       62.1       14.6       ?       ? 
1 1 1   33   21   47 o    152.9    5.6    0.0000   0.0000          ?        ?   234.3374  17.2401          ?        ?      152.9        5.6       ?       ? 
1 1 1   33   21   48 o    249.5    3.8    0.0000   0.0000          ?        ?   623.1971  19.1556          ?        ?      249.5        3.8       ?       ? 
1 1 1   33   21   49 o    172.2    5.4    0.0000   0.0000          ?        ?   297.5511  18.5171          ?        ?      172.2        5.4       ?       ? 
1 1 1   33   21   50 o    209.8    4.6    0.0000   0.0000          ?        ?   441.2184  19.1556          ?        ?      209.8        4.6       ?       ? 
1 1 1   33   21   51 o     99.9    9.6    0.0000   0.0000          ?        ?   100.8864  19.1556          ?        ?       99.9        9.6       ?       ? 
1 1 1   33   21   52 o    170.1    5.6    0.0000   0.0000          ?        ?   290.5273  19.1556          ?        ?      170.1        5.6       ?       ? 
1 1 1   33   21   53 o    207.5    4.5    0.0000   0.0000          ?        ?   431.6406  18.5171          ?        ?      207.5        4.5       ?       ? 
1 1 1   33   21   54 o     28.7   13.3    0.0000   0.0000          ?        ?   -15.9630  18.5171          ?        ?       28.7       13.3       ?       ? 
1 1 1   33   21   55 o    149.7    6.2    0.0000   0.0000          ?        ?   225.3981  18.5171          ?        ?      149.7        6.2       ?       ? 
1 1 1   33   21   56 o    205.7    4.7    0.0000   0.0000          ?        ?   424.6169  19.1556          ?        ?      205.7        4.7       ?       ? 
1 1 1   33   21   57 o    286.5    3.6    0.0000   0.0000          ?        ?   823.0543  20.4327          ?        ?      286.5        3.6       ?       ? 
1 1 1   33   21   58 o    147.8    6.5    0.0000   0.0000          ?        ?   220.2900  19.1556          ?        ?      147.8        6.5       ?       ? 
1 1 1   33   22    0 o    194.9    3.9  380.5589  15.3245   380.5589  15.3245   380.5589  15.3245      194.9      3.9      194.9        3.9     0.0     0.0 
1 1 1   33   22    1 o    261.4    2.4    0.0000   0.0000          ?        ?   683.2181  12.7704          ?        ?      261.4        2.4       ?       ? 
1 1 1   33   22    2 o    494.7    2.7    0.0000   0.0000          ?        ?  2447.4534  26.8179          ?        ?      494.7        2.7       ?       ? 
1 1 1   33   22    3 o    400.5    2.6    0.0000   0.0000          ?        ?  1603.9663  20.4327          ?        ?      400.5        2.6       ?       ? 
1 1 1   33   22    4 o    393.5    2.7    0.0000   0.0000          ?        ?  1549.0535  21.0712          ?        ?      393.5        2.7       ?       ? 
1 1 1   33   22    5 o    443.0    2.7    0.0000   0.0000          ?        ?  1962.8154  23.6253          ?        ?      443.0        2.7       ?       ? 
1 1 1   33   22    6 o    716.1    3.4    0.0000   0.0000          ?        ?  5129.8828  49.1662          ?        ?      716.1        3.4       ?       ? 
1 1 1   33   22    7 o    571.9    2.8    0.0000   0.0000          ?        ?  3271.1462  31.9261          ?        ?      571.9        2.8       ?       ? 
1 1 1   33   22    8 o    401.2    2.6    0.0000   0.0000          ?        ?  1609.7130  21.0712          ?        ?      401.2        2.6       ?       ? 
1 1 1   33   22    9 o    126.8    3.8    0.0000   0.0000          ?        ?   160.9075   9.5778          ?        ?      126.8        3.8       ?       ? 
1 1 1   33   22   10 o    605.2    2.7    0.0000   0.0000          ?        ?  3663.1987  33.2031          ?        ?      605.2        2.7       ?       ? 
1 1 1   33   22   11 o    244.2    2.5    0.0000   0.0000          ?        ?   596.3792  12.1319          ?        ?      244.2        2.5       ?       ? 
1 1 1   33   22   12 o    473.4    2.4    0.0000   0.0000          ?        ?  2241.2109  22.9868          ?        ?      473.4        2.4       ?       ? 
1 1 1   33   22   13 o    210.0    2.7    0.0000   0.0000          ?        ?   441.2184  11.4934          ?        ?      210.0        2.7       ?       ? 
1 1 1   33   22   14 o    238.4    2.7    0.0000   0.0000          ?        ?   568.2842  12.7704          ?        ?      238.4        2.7       ?       ? 
1 1 1   33   22   15 f    272.1    2.2    0.0000   0.0000          ?        ?   740.6851  12.1319          ?        ?      272.1        2.2       ?       ? 
1 1 1   33   22   16 o    250.4    2.4    0.0000   0.0000          ?        ?   627.0282  12.1319          ?        ?      250.4        2.4       ?       ? 
1 1 1   33   22   17 o    414.5    2.5    0.0000   0.0000          ?        ?  1718.2617  20.4327          ?        ?      414.5        2.5       ?       ? 
1 1 1   33   22   18 o    442.2    2.5    0.0000   0.0000          ?        ?  1955.7916  21.7097          ?        ?      442.2        2.5       ?       ? 
1 1 1   33   22   19 o    448.5    2.6    0.0000   0.0000          ?        ?  2011.9817  23.6253          ?        ?      448.5        2.6       ?       ? 
1 1 1   33   22   20 o     74.5    7.7    0.0000   0.0000          ?        ?    55.5514  11.4934          ?        ?       74.5        7.7       ?       ? 
1 1 1   33   22   21 o    258.9    2.6    0.0000   0.0000          ?        ?   670.4477  13.4090          ?        ?      258.9        2.6       ?       ? 
1 1 1   33   22   22 o    396.2    2.4    0.0000   0.0000          ?        ?  1570.1246  19.1556          ?        ?      396.2        2.4       ?       ? 
1 1 1   33   22   23 o    274.1    2.8    0.0000   0.0000          ?        ?   751.5399  15.3245          ?        ?      274.1        2.8       ?       ? 
1 1 1   33   22   24 o    347.3    2.5    0.0000   0.0000          ?        ?  1206.8059  17.2401          ?        ?      347.3        2.5       ?       ? 
1 1 1   33   22   25 o     27.5   11.9    0.0000   0.0000          ?        ?    -1.9156  12.1319          ?        ?       27.5       11.9       ?       ? 
1 1 1   33   22   26 o    261.6    2.8    0.0000   0.0000          ?        ?   684.4952  14.6860          ?        ?      261.6        2.8       ?       ? 
1 1 1   33   22   27 o    102.9    6.5    0.0000   0.0000          ?        ?   105.9946  13.4090          ?        ?      102.9        6.5       ?       ? 
1 1 1   33   22   28 o    140.8    4.8    0.0000   0.0000          ?        ?   198.5802  13.4090          ?        ?      140.8        4.8       ?       ? 
1 1 1   33   22   29 o    331.2    2.6    0.0000   0.0000          ?        ?  1096.9802  17.2401          ?        ?      331.2        2.6       ?       ? 
1 1 1   33   22   30 o    247.4    3.2    0.0000   0.0000          ?        ?   612.3422  15.9630          ?        ?      247.4        3.2       ?       ? 
1 1 1   33   22   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   22   32 o    101.9    7.2    0.0000   0.0000          ?        ?   104.0790  14.6860          ?        ?      101.9        7.2       ?       ? 
1 1 1   33   22   33 o    204.7    3.7    0.0000   0.0000          ?        ?   419.5087  15.3245          ?        ?      204.7        3.7       ?       ? 
1 1 1   33   22   34 o    196.1    3.9    0.0000   0.0000          ?        ?   385.0285  15.3245          ?        ?      196.1        3.9       ?       ? 
1 1 1   33   22   35 o     17.9    9.0    0.0000   0.0000          ?        ?   -50.4432  15.3245          ?        ?       17.9        9.0       ?       ? 
1 1 1   33   22   36 o    215.8    4.0    0.0000   0.0000          ?        ?   466.1208  17.2401          ?        ?      215.8        4.0       ?       ? 
1 1 1   33   22   37 o     87.3    9.1    0.0000   0.0000          ?        ?    76.6226  15.9630          ?        ?       87.3        9.1       ?       ? 
1 1 1   33   22   38 o    297.4    3.2    0.0000   0.0000          ?        ?   884.9910  19.1556          ?        ?      297.4        3.2       ?       ? 
1 1 1   33   22   39 o     41.2   14.7    0.0000   0.0000          ?        ?    14.6860  15.3245          ?        ?       41.2       14.7       ?       ? 
1 1 1   33   22   40 o    187.4    4.8    0.0000   0.0000          ?        ?   351.8254  17.8786          ?        ?      187.4        4.8       ?       ? 
1 1 1   33   22   41 o    312.5    3.0    0.0000   0.0000          ?        ?   976.9381  18.5171          ?        ?      312.5        3.0       ?       ? 
1 1 1   33   22   42 o    264.1    3.5    0.0000   0.0000          ?        ?   697.9042  18.5171          ?        ?      264.1        3.5       ?       ? 
1 1 1   33   22   43 o    189.4    4.7    0.0000   0.0000          ?        ?   359.4877  17.8786          ?        ?      189.4        4.7       ?       ? 
1 1 1   33   22   44 o    135.9    6.3    0.0000   0.0000          ?        ?   185.1713  17.2401          ?        ?      135.9        6.3       ?       ? 
1 1 1   33   22   45 o    267.3    3.6    0.0000   0.0000          ?        ?   715.1442  19.1556          ?        ?      267.3        3.6       ?       ? 
1 1 1   33   22   46 o    192.7    4.6    0.0000   0.0000          ?        ?   372.2581  17.8786          ?        ?      192.7        4.6       ?       ? 
1 1 1   33   22   47 o     34.4   14.5    0.0000   0.0000          ?        ?     1.2770  17.2401          ?        ?       34.4       14.5       ?       ? 
1 1 1   33   22   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   22   49 o    215.2    4.3    0.0000   0.0000          ?        ?   464.2052  18.5171          ?        ?      215.2        4.3       ?       ? 
1 1 1   33   22   50 f    267.7    3.7    0.0000   0.0000          ?        ?   717.6983  19.7942          ?        ?      267.7        3.7       ?       ? 
1 1 1   33   22   51 o    155.4    5.8    0.0000   0.0000          ?        ?   242.6382  17.8786          ?        ?      155.4        5.8       ?       ? 
1 1 1   33   22   52 o    147.1    6.7    0.0000   0.0000          ?        ?   217.7359  19.7942          ?        ?      147.1        6.7       ?       ? 
1 1 1   33   22   53 o    321.0    3.4    0.0000   0.0000          ?        ?  1031.8510  21.7097          ?        ?      321.0        3.4       ?       ? 
1 1 1   33   22   54 o    144.7    6.4    0.0000   0.0000          ?        ?   210.7121  18.5171          ?        ?      144.7        6.4       ?       ? 
1 1 1   33   22   55 o    142.2    6.7    0.0000   0.0000          ?        ?   203.6884  19.1556          ?        ?      142.2        6.7       ?       ? 
1 1 1   33   22   56 o    176.0    5.6    0.0000   0.0000          ?        ?   311.5985  19.7942          ?        ?      176.0        5.6       ?       ? 
1 1 1   33   22   57 o    244.3    4.1    0.0000   0.0000          ?        ?   598.9333  19.7942          ?        ?      244.3        4.1       ?       ? 
1 1 1   33   23    0 o    145.0    5.5  211.3506  15.9630   211.3506  15.9630   211.3506  15.9630      145.0      5.5      145.0        5.5     0.0     0.0 
1 1 1   33   23    1 o    134.9    4.3    0.0000   0.0000          ?        ?   181.9787  11.4934          ?        ?      134.9        4.3       ?       ? 
1 1 1   33   23    2 o    258.5    2.8    0.0000   0.0000          ?        ?   668.5321  14.6860          ?        ?      258.5        2.8       ?       ? 
1 1 1   33   23    3 o    320.7    2.4    0.0000   0.0000          ?        ?  1028.6583  15.3245          ?        ?      320.7        2.4       ?       ? 
1 1 1   33   23    4 o    470.3    2.6    0.0000   0.0000          ?        ?  2211.8389  24.2638          ?        ?      470.3        2.6       ?       ? 
1 1 1   33   23    5 o    454.9    2.5    0.0000   0.0000          ?        ?  2070.0872  22.9868          ?        ?      454.9        2.5       ?       ? 
1 1 1   33   23    6 o    102.3    5.0    0.0000   0.0000          ?        ?   104.7175  10.2163          ?        ?      102.3        5.0       ?       ? 
1 1 1   33   23    7 o    449.6    2.6    0.0000   0.0000          ?        ?  2021.5594  23.6253          ?        ?      449.6        2.6       ?       ? 
1 1 1   33   23    8 o    617.0    3.2    0.0000   0.0000          ?        ?  3808.1431  39.5883          ?        ?      617.0        3.2       ?       ? 
1 1 1   33   23    9 o    826.2    3.6    0.0000   0.0000          ?        ?  6829.6270  59.3825          ?        ?      826.2        3.6       ?       ? 
1 1 1   33   23   10 o    314.2    3.4    0.0000   0.0000          ?        ?   987.7929  21.0712          ?        ?      314.2        3.4       ?       ? 
1 1 1   33   23   11 o    713.8    3.3    0.0000   0.0000          ?        ?  5096.6797  47.2506          ?        ?      713.8        3.3       ?       ? 
1 1 1   33   23   12 o     55.5   10.1    0.0000   0.0000          ?        ?    31.9261  10.8549          ?        ?       55.5       10.1       ?       ? 
1 1 1   33   23   13 o    532.4    2.6    0.0000   0.0000          ?        ?  2835.0361  28.0950          ?        ?      532.4        2.6       ?       ? 
1 1 1   33   23   14 o    176.7    3.3    0.0000   0.0000          ?        ?   312.2371  11.4934          ?        ?      176.7        3.3       ?       ? 
1 1 1   33   23   15 o    262.0    2.2    0.0000   0.0000          ?        ?   686.4108  11.4934          ?        ?      262.0        2.2       ?       ? 
1 1 1   33   23   16 o    385.3    2.3    0.0000   0.0000          ?        ?  1484.5627  17.8786          ?        ?      385.3        2.3       ?       ? 
1 1 1   33   23   17 o    571.6    2.6    0.0000   0.0000          ?        ?  3267.9536  29.3720          ?        ?      571.6        2.6       ?       ? 
1 1 1   33   23   18 o    331.8    2.5    0.0000   0.0000          ?        ?  1101.4498  16.6016          ?        ?      331.8        2.5       ?       ? 
1 1 1   33   23   19 o    226.4    2.8    0.0000   0.0000          ?        ?   512.7329  12.7704          ?        ?      226.4        2.8       ?       ? 
1 1 1   33   23   20 o    421.1    2.6    0.0000   0.0000          ?        ?  1773.8130  21.7097          ?        ?      421.1        2.6       ?       ? 
1 1 1   33   23   21 o    343.7    2.4    0.0000   0.0000          ?        ?  1181.2650  16.6016          ?        ?      343.7        2.4       ?       ? 
1 1 1   33   23   22 o    369.3    2.5    0.0000   0.0000          ?        ?  1363.8822  18.5171          ?        ?      369.3        2.5       ?       ? 
1 1 1   33   23   23 o    102.9    5.6    0.0000   0.0000          ?        ?   105.9946  11.4934          ?        ?      102.9        5.6       ?       ? 
1 1 1   33   23   24 o    455.6    2.5    0.0000   0.0000          ?        ?  2075.8337  22.3483          ?        ?      455.6        2.5       ?       ? 
1 1 1   33   23   25 o    456.7    2.4    0.0000   0.0000          ?        ?  2086.0503  22.3483          ?        ?      456.7        2.4       ?       ? 
1 1 1   33   23   26 o    131.9    5.1    0.0000   0.0000          ?        ?   174.3164  13.4090          ?        ?      131.9        5.1       ?       ? 
1 1 1   33   23   27 o    246.4    3.0    0.0000   0.0000          ?        ?   607.2341  14.6860          ?        ?      246.4        3.0       ?       ? 
1 1 1   33   23   28 o    306.7    2.7    0.0000   0.0000          ?        ?   941.1808  16.6016          ?        ?      306.7        2.7       ?       ? 
1 1 1   33   23   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   23   30 o    317.5    2.7    0.0000   0.0000          ?        ?  1008.2256  17.2401          ?        ?      317.5        2.7       ?       ? 
1 1 1   33   23   31 o    268.7    2.9    0.0000   0.0000          ?        ?   722.1680  15.3245          ?        ?      268.7        2.9       ?       ? 
1 1 1   33   23   32 o    261.8    3.2    0.0000   0.0000          ?        ?   685.7722  16.6016          ?        ?      261.8        3.2       ?       ? 
1 1 1   33   23   33 o    460.3    2.7    0.0000   0.0000          ?        ?  2119.2532  24.9023          ?        ?      460.3        2.7       ?       ? 
1 1 1   33   23   34 o    406.3    2.8    0.0000   0.0000          ?        ?  1651.2169  22.9868          ?        ?      406.3        2.8       ?       ? 
1 1 1   33   23   35 o    331.4    2.9    0.0000   0.0000          ?        ?  1098.8958  19.1556          ?        ?      331.4        2.9       ?       ? 
1 1 1   33   23   36 o    128.5    6.0    0.0000   0.0000          ?        ?   165.3771  15.3245          ?        ?      128.5        6.0       ?       ? 
1 1 1   33   23   37 o    195.5    4.1    0.0000   0.0000          ?        ?   382.4745  15.9630          ?        ?      195.5        4.1       ?       ? 
1 1 1   33   23   38 o    396.6    2.7    0.0000   0.0000          ?        ?  1573.9558  21.7097          ?        ?      396.6        2.7       ?       ? 
1 1 1   33   23   39 o    142.8    5.4    0.0000   0.0000          ?        ?   204.3269  15.3245          ?        ?      142.8        5.4       ?       ? 
1 1 1   33   23   40 o    341.8    3.0    0.0000   0.0000          ?        ?  1169.1332  20.4327          ?        ?      341.8        3.0       ?       ? 
1 1 1   33   23   41 o     95.3    9.0    0.0000   0.0000          ?        ?    91.3086  17.2401          ?        ?       95.3        9.0       ?       ? 
1 1 1   33   23   42 o    117.4    7.6    0.0000   0.0000          ?        ?   138.5592  17.8786          ?        ?      117.4        7.6       ?       ? 
1 1 1   33   23   43 o    363.5    3.1    0.0000   0.0000          ?        ?  1322.3783  22.3483          ?        ?      363.5        3.1       ?       ? 
1 1 1   33   23   44 o    145.3    6.4    0.0000   0.0000          ?        ?   211.9892  18.5171          ?        ?      145.3        6.4       ?       ? 
1 1 1   33   23   45 o     20.2   10.1    0.0000   0.0000          ?        ?   -47.8891  17.2401          ?        ?       20.2       10.1       ?       ? 
1 1 1   33   23   46 o    296.8    3.4    0.0000   0.0000          ?        ?   881.7984  20.4327          ?        ?      296.8        3.4       ?       ? 
1 1 1   33   23   47 o     39.8   15.5    0.0000   0.0000          ?        ?    10.2163  17.8786          ?        ?       39.8       15.5       ?       ? 
1 1 1   33   23   48 o     66.8   13.8    0.0000   0.0000          ?        ?    47.2506  17.8786          ?        ?       66.8       13.8       ?       ? 
1 1 1   33   23   49 o    182.4    5.2    0.0000   0.0000          ?        ?   333.9468  19.1556          ?        ?      182.4        5.2       ?       ? 
1 1 1   33   23   50 o    153.6    5.8    0.0000   0.0000          ?        ?   236.8915  17.8786          ?        ?      153.6        5.8       ?       ? 
1 1 1   33   23   51 f    179.4    5.0    0.0000   0.0000          ?        ?   323.0919  17.8786          ?        ?      179.4        5.0       ?       ? 
1 1 1   33   23   52 o    198.2    4.7    0.0000   0.0000          ?        ?   393.9678  18.5171          ?        ?      198.2        4.7       ?       ? 
1 1 1   33   23   53 o     22.0   10.9    0.0000   0.0000          ?        ?   -40.8654  17.8786          ?        ?       22.0       10.9       ?       ? 
1 1 1   33   23   54 o    302.4    3.6    0.0000   0.0000          ?        ?   916.2786  21.7097          ?        ?      302.4        3.6       ?       ? 
1 1 1   33   23   55 o     40.6   15.8    0.0000   0.0000          ?        ?    11.4934  18.5171          ?        ?       40.6       15.8       ?       ? 
1 1 1   33   23   56 o    197.8    4.8    0.0000   0.0000          ?        ?   393.3293  19.1556          ?        ?      197.8        4.8       ?       ? 
1 1 1   33   24    0 o    106.8   11.3  118.1265  23.6253   118.1265  23.6253   118.1265  23.6253      106.8     11.3      106.8       11.3     0.0     0.0 
1 1 1   33   24    1 o    257.4    3.0    0.0000   0.0000          ?        ?   662.7855  15.3245          ?        ?      257.4        3.0       ?       ? 
1 1 1   33   24    2 o    105.3    8.5    0.0000   0.0000          ?        ?   111.1028  17.8786          ?        ?      105.3        8.5       ?       ? 
1 1 1   33   24    3 o    415.2    2.8    0.0000   0.0000          ?        ?  1724.6470  23.6253          ?        ?      415.2        2.8       ?       ? 
1 1 1   33   24    4 o    318.2    2.8    0.0000   0.0000          ?        ?  1012.6953  17.8786          ?        ?      318.2        2.8       ?       ? 
1 1 1   33   24    5 o    197.8    3.6    0.0000   0.0000          ?        ?   391.4138  14.0475          ?        ?      197.8        3.6       ?       ? 
1 1 1   33   24    6 o    136.3    4.9    0.0000   0.0000          ?        ?   185.8098  13.4090          ?        ?      136.3        4.9       ?       ? 
1 1 1   33   24    7 o    443.9    2.7    0.0000   0.0000          ?        ?  1971.1163  24.2638          ?        ?      443.9        2.7       ?       ? 
1 1 1   33   24    8 o    213.8    2.7    0.0000   0.0000          ?        ?   457.1815  11.4934          ?        ?      213.8        2.7       ?       ? 
1 1 1   33   24    9 f    115.5    4.4    0.0000   0.0000          ?        ?   133.4510  10.2163          ?        ?      115.5        4.4       ?       ? 
1 1 1   33   24   10 o    307.9    2.3    0.0000   0.0000          ?        ?   948.2046  14.0475          ?        ?      307.9        2.3       ?       ? 
1 1 1   33   24   11 o     88.2    5.1    0.0000   0.0000          ?        ?    77.8996   8.9393          ?        ?       88.2        5.1       ?       ? 
1 1 1   33   24   12 o    336.9    2.4    0.0000   0.0000          ?        ?  1135.2915  15.9630          ?        ?      336.9        2.4       ?       ? 
1 1 1   33   24   13 o    215.4    3.0    0.0000   0.0000          ?        ?   464.2052  12.7704          ?        ?      215.4        3.0       ?       ? 
1 1 1   33   24   14 o    537.2    2.7    0.0000   0.0000          ?        ?  2886.7563  29.3720          ?        ?      537.2        2.7       ?       ? 
1 1 1   33   24   15 o    171.5    3.7    0.0000   0.0000          ?        ?   294.3585  12.7704          ?        ?      171.5        3.7       ?       ? 
1 1 1   33   24   16 o    206.0    2.6    0.0000   0.0000          ?        ?   424.6169  10.8549          ?        ?      206.0        2.6       ?       ? 
1 1 1   33   24   17 o    250.6    2.5    0.0000   0.0000          ?        ?   628.3053  12.7704          ?        ?      250.6        2.5       ?       ? 
1 1 1   33   24   18 o    326.3    2.4    0.0000   0.0000          ?        ?  1065.0541  15.9630          ?        ?      326.3        2.4       ?       ? 
1 1 1   33   24   19 o     74.0    7.3    0.0000   0.0000          ?        ?    54.9129  10.8549          ?        ?       74.0        7.3       ?       ? 
1 1 1   33   24   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   24   21 o     99.4    5.5    0.0000   0.0000          ?        ?    98.9709  10.8549          ?        ?       99.4        5.5       ?       ? 
1 1 1   33   24   22 o    298.7    2.5    0.0000   0.0000          ?        ?   892.6533  14.6860          ?        ?      298.7        2.5       ?       ? 
1 1 1   33   24   23 o    295.7    2.6    0.0000   0.0000          ?        ?   874.7747  15.3245          ?        ?      295.7        2.6       ?       ? 
1 1 1   33   24   24 f    461.4    2.5    0.0000   0.0000          ?        ?  2129.4697  22.9868          ?        ?      461.4        2.5       ?       ? 
1 1 1   33   24   25 o    190.6    3.5    0.0000   0.0000          ?        ?   363.3188  13.4090          ?        ?      190.6        3.5       ?       ? 
1 1 1   33   24   26 o    243.2    3.0    0.0000   0.0000          ?        ?   591.9095  14.6860          ?        ?      243.2        3.0       ?       ? 
1 1 1   33   24   27 o    205.5    3.4    0.0000   0.0000          ?        ?   422.7013  14.0475          ?        ?      205.5        3.4       ?       ? 
1 1 1   33   24   28 o    198.6    3.7    0.0000   0.0000          ?        ?   394.6064  14.6860          ?        ?      198.6        3.7       ?       ? 
1 1 1   33   24   29 o    152.2    4.6    0.0000   0.0000          ?        ?   231.7833  14.0475          ?        ?      152.2        4.6       ?       ? 
1 1 1   33   24   30 o    105.9    6.6    0.0000   0.0000          ?        ?   112.3798  14.0475          ?        ?      105.9        6.6       ?       ? 
1 1 1   33   24   31 o     30.0   13.1    0.0000   0.0000          ?        ?    -2.5541  14.6860          ?        ?       30.0       13.1       ?       ? 
1 1 1   33   24   32 o    282.3    3.1    0.0000   0.0000          ?        ?   797.5135  17.2401          ?        ?      282.3        3.1       ?       ? 
1 1 1   33   24   33 o    231.9    3.3    0.0000   0.0000          ?        ?   538.2737  15.3245          ?        ?      231.9        3.3       ?       ? 
1 1 1   33   24   34 o    469.2    2.8    0.0000   0.0000          ?        ?  2202.2610  26.1794          ?        ?      469.2        2.8       ?       ? 
1 1 1   33   24   35 o    326.9    2.8    0.0000   0.0000          ?        ?  1068.8851  18.5171          ?        ?      326.9        2.8       ?       ? 
1 1 1   33   24   36 o    233.3    3.6    0.0000   0.0000          ?        ?   544.6590  16.6016          ?        ?      233.3        3.6       ?       ? 
1 1 1   33   24   37 o    203.8    4.2    0.0000   0.0000          ?        ?   415.6776  17.2401          ?        ?      203.8        4.2       ?       ? 
1 1 1   33   24   38 o    250.2    3.4    0.0000   0.0000          ?        ?   626.3897  17.2401          ?        ?      250.2        3.4       ?       ? 
1 1 1   33   24   39 o    330.0    3.1    0.0000   0.0000          ?        ?  1089.9564  20.4327          ?        ?      330.0        3.1       ?       ? 
1 1 1   33   24   40 f    142.1    5.8    0.0000   0.0000          ?        ?   202.4114  16.6016          ?        ?      142.1        5.8       ?       ? 
1 1 1   33   24   41 o    204.2    4.2    0.0000   0.0000          ?        ?   417.5931  17.2401          ?        ?      204.2        4.2       ?       ? 
1 1 1   33   24   42 o     29.5   13.3    0.0000   0.0000          ?        ?    -8.3008  16.6016          ?        ?       29.5       13.3       ?       ? 
1 1 1   33   24   43 o    221.3    4.2    0.0000   0.0000          ?        ?   490.3846  18.5171          ?        ?      221.3        4.2       ?       ? 
1 1 1   33   24   44 o     47.4   15.9    0.0000   0.0000          ?        ?    21.7097  17.8786          ?        ?       47.4       15.9       ?       ? 
1 1 1   33   24   45 o     36.3   15.0    0.0000   0.0000          ?        ?     3.8311  17.8786          ?        ?       36.3       15.0       ?       ? 
1 1 1   33   24   46 o    339.7    3.1    0.0000   0.0000          ?        ?  1155.0856  21.0712          ?        ?      339.7        3.1       ?       ? 
1 1 1   33   24   47 f    206.1    4.6    0.0000   0.0000          ?        ?   425.8939  19.1556          ?        ?      206.1        4.6       ?       ? 
1 1 1   33   24   48 o    215.5    4.6    0.0000   0.0000          ?        ?   465.4823  19.7942          ?        ?      215.5        4.6       ?       ? 
1 1 1   33   24   49 o     44.5   16.1    0.0000   0.0000          ?        ?    17.2401  18.5171          ?        ?       44.5       16.1       ?       ? 
1 1 1   33   24   50 f    177.8    5.4    0.0000   0.0000          ?        ?   317.3452  19.1556          ?        ?      177.8        5.4       ?       ? 
1 1 1   33   24   51 o    153.0    6.5    0.0000   0.0000          ?        ?   235.6145  19.7942          ?        ?      153.0        6.5       ?       ? 
1 1 1   33   24   52 o    159.0    5.8    0.0000   0.0000          ?        ?   254.1316  18.5171          ?        ?      159.0        5.8       ?       ? 
1 1 1   33   24   53 o     34.1   14.8    0.0000   0.0000          ?        ?    -1.2770  18.5171          ?        ?       34.1       14.8       ?       ? 
1 1 1   33   24   54 o    109.4    8.5    0.0000   0.0000          ?        ?   121.3191  18.5171          ?        ?      109.4        8.5       ?       ? 
1 1 1   33   24   55 o     85.0   10.9    0.0000   0.0000          ?        ?    74.0685  18.5171          ?        ?       85.0       10.9       ?       ? 
1 1 1   33   25    0 o    354.1    4.4 1254.6949  31.2876  1254.6949  31.2876  1254.6949  31.2876      354.1      4.4      354.1        4.4     0.0     0.0 
1 1 1   33   25    1 o    366.2    3.5    0.0000   0.0000          ?        ?  1341.5339  25.5409          ?        ?      366.2        3.5       ?       ? 
1 1 1   33   25    2 o    173.7    5.7    0.0000   0.0000          ?        ?   302.0207  19.7942          ?        ?      173.7        5.7       ?       ? 
1 1 1   33   25    3 o    122.2    4.7    0.0000   0.0000          ?        ?   149.4141  11.4934          ?        ?      122.2        4.7       ?       ? 
1 1 1   33   25    4 o    419.2    3.0    0.0000   0.0000          ?        ?  1757.8500  24.9023          ?        ?      419.2        3.0       ?       ? 
1 1 1   33   25    5 f    160.2    4.6    0.0000   0.0000          ?        ?   256.6857  14.6860          ?        ?      160.2        4.6       ?       ? 
1 1 1   33   25    6 o    431.4    2.9    0.0000   0.0000          ?        ?  1861.9291  24.9023          ?        ?      431.4        2.9       ?       ? 
1 1 1   33   25    7 o    365.2    2.8    0.0000   0.0000          ?        ?  1333.8716  20.4327          ?        ?      365.2        2.8       ?       ? 
1 1 1   33   25    8 o    158.0    4.2    0.0000   0.0000          ?        ?   249.6619  13.4090          ?        ?      158.0        4.2       ?       ? 
1 1 1   33   25    9 o    497.0    2.9    0.0000   0.0000          ?        ?  2470.4402  28.7335          ?        ?      497.0        2.9       ?       ? 
1 1 1   33   25   10 o    415.9    2.6    0.0000   0.0000          ?        ?  1729.7550  21.7097          ?        ?      415.9        2.6       ?       ? 
1 1 1   33   25   11 o    304.3    2.2    0.0000   0.0000          ?        ?   925.8564  13.4090          ?        ?      304.3        2.2       ?       ? 
1 1 1   33   25   12 o    399.1    2.3    0.0000   0.0000          ?        ?  1593.1115  18.5171          ?        ?      399.1        2.3       ?       ? 
1 1 1   33   25   13 o    434.9    2.4    0.0000   0.0000          ?        ?  1891.9395  21.0712          ?        ?      434.9        2.4       ?       ? 
1 1 1   33   25   14 o     82.6    6.6    0.0000   0.0000          ?        ?    68.3218  10.8549          ?        ?       82.6        6.6       ?       ? 
1 1 1   33   25   15 o    230.3    3.0    0.0000   0.0000          ?        ?   530.6115  14.0475          ?        ?      230.3        3.0       ?       ? 
1 1 1   33   25   16 o    428.9    2.5    0.0000   0.0000          ?        ?  1840.2194  21.0712          ?        ?      428.9        2.5       ?       ? 
1 1 1   33   25   17 o    543.7    2.7    0.0000   0.0000          ?        ?  2956.9937  29.3720          ?        ?      543.7        2.7       ?       ? 
1 1 1   33   25   18 o    571.4    2.8    0.0000   0.0000          ?        ?  3266.6768  32.5646          ?        ?      571.4        2.8       ?       ? 
1 1 1   33   25   19 o     20.7    9.7    0.0000   0.0000          ?        ?   -10.8549  10.2163          ?        ?       20.7        9.7       ?       ? 
1 1 1   33   25   20 o    337.0    2.6    0.0000   0.0000          ?        ?  1135.9299  17.2401          ?        ?      337.0        2.6       ?       ? 
1 1 1   33   25   21 o    315.0    2.4    0.0000   0.0000          ?        ?   992.2626  15.3245          ?        ?      315.0        2.4       ?       ? 
1 1 1   33   25   22 o    355.3    2.3    0.0000   0.0000          ?        ?  1262.9958  16.6016          ?        ?      355.3        2.3       ?       ? 
1 1 1   33   25   23 o     90.7    6.3    0.0000   0.0000          ?        ?    82.3693  11.4934          ?        ?       90.7        6.3       ?       ? 
1 1 1   33   25   24 o    155.9    3.9    0.0000   0.0000          ?        ?   243.2767  12.1319          ?        ?      155.9        3.9       ?       ? 
1 1 1   33   25   25 o    246.1    2.9    0.0000   0.0000          ?        ?   605.9570  14.0475          ?        ?      246.1        2.9       ?       ? 
1 1 1   33   25   26 o     17.8    8.9    0.0000   0.0000          ?        ?   -33.8416  12.7704          ?        ?       17.8        8.9       ?       ? 
1 1 1   33   25   27 o    201.5    3.3    0.0000   0.0000          ?        ?   406.0997  13.4090          ?        ?      201.5        3.3       ?       ? 
1 1 1   33   25   28 o    120.8    5.5    0.0000   0.0000          ?        ?   146.2215  13.4090          ?        ?      120.8        5.5       ?       ? 
1 1 1   33   25   29 o    558.9    2.7    0.0000   0.0000          ?        ?  3125.5635  30.0105          ?        ?      558.9        2.7       ?       ? 
1 1 1   33   25   30 o    275.0    3.0    0.0000   0.0000          ?        ?   756.6481  16.6016          ?        ?      275.0        3.0       ?       ? 
1 1 1   33   25   31 o    156.3    4.9    0.0000   0.0000          ?        ?   244.5538  15.3245          ?        ?      156.3        4.9       ?       ? 
1 1 1   33   25   32 f    207.4    3.8    0.0000   0.0000          ?        ?   430.3636  15.9630          ?        ?      207.4        3.8       ?       ? 
1 1 1   33   25   33 o    343.1    2.8    0.0000   0.0000          ?        ?  1177.4338  19.1556          ?        ?      343.1        2.8       ?       ? 
1 1 1   33   25   34 o     41.7   14.4    0.0000   0.0000          ?        ?    15.9630  14.6860          ?        ?       41.7       14.4       ?       ? 
1 1 1   33   25   35 o     67.4   12.3    0.0000   0.0000          ?        ?    47.2506  15.9630          ?        ?       67.4       12.3       ?       ? 
1 1 1   33   25   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   25   37 o    321.3    3.1    0.0000   0.0000          ?        ?  1033.1281  19.7942          ?        ?      321.3        3.1       ?       ? 
1 1 1   33   25   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   25   39 o    111.9    7.7    0.0000   0.0000          ?        ?   125.7888  17.2401          ?        ?      111.9        7.7       ?       ? 
1 1 1   33   25   40 o    137.5    5.8    0.0000   0.0000          ?        ?   189.6409  15.9630          ?        ?      137.5        5.8       ?       ? 
1 1 1   33   25   41 o     96.2    8.6    0.0000   0.0000          ?        ?    93.2242  16.6016          ?        ?       96.2        8.6       ?       ? 
1 1 1   33   25   42 o    150.1    5.5    0.0000   0.0000          ?        ?   226.0367  16.6016          ?        ?      150.1        5.5       ?       ? 
1 1 1   33   25   43 o    279.1    3.2    0.0000   0.0000          ?        ?   779.6349  17.8786          ?        ?      279.1        3.2       ?       ? 
1 1 1   33   25   44 o     20.9   10.4    0.0000   0.0000          ?        ?   -39.5883  16.6016          ?        ?       20.9       10.4       ?       ? 
1 1 1   33   25   45 o    356.1    3.0    0.0000   0.0000          ?        ?  1269.3810  21.0712          ?        ?      356.1        3.0       ?       ? 
1 1 1   33   25   46 o    104.3    8.9    0.0000   0.0000          ?        ?   109.8257  18.5171          ?        ?      104.3        8.9       ?       ? 
1 1 1   33   25   47 o    307.9    3.3    0.0000   0.0000          ?        ?   949.4816  20.4327          ?        ?      307.9        3.3       ?       ? 
1 1 1   33   25   48 o    330.2    3.2    0.0000   0.0000          ?        ?  1091.8719  21.0712          ?        ?      330.2        3.2       ?       ? 
1 1 1   33   25   49 o    187.2    5.1    0.0000   0.0000          ?        ?   351.8254  19.1556          ?        ?      187.2        5.1       ?       ? 
1 1 1   33   25   50 o    203.7    4.5    0.0000   0.0000          ?        ?   416.3161  18.5171          ?        ?      203.7        4.5       ?       ? 
1 1 1   33   25   51 o     74.1   12.1    0.0000   0.0000          ?        ?    56.1899  17.8786          ?        ?       74.1       12.1       ?       ? 
1 1 1   33   25   52 o     28.3   13.1    0.0000   0.0000          ?        ?   -14.6860  17.8786          ?        ?       28.3       13.1       ?       ? 
1 1 1   33   25   53 f    256.8    3.9    0.0000   0.0000          ?        ?   661.5084  19.7942          ?        ?      256.8        3.9       ?       ? 
1 1 1   33   25   54 f     24.4   11.8    0.0000   0.0000          ?        ?   -25.5409  17.2401          ?        ?       24.4       11.8       ?       ? 
1 1 1   33   26    0 o    162.0    8.3  264.9865  26.8179   264.9865  26.8179   264.9865  26.8179      162.0      8.3      162.0        8.3     0.0     0.0 
1 1 1   33   26    1 o    148.7    6.4    0.0000   0.0000          ?        ?   221.5670  19.1556          ?        ?      148.7        6.4       ?       ? 
1 1 1   33   26    2 o    102.2    9.4    0.0000   0.0000          ?        ?   104.7175  19.1556          ?        ?      102.2        9.4       ?       ? 
1 1 1   33   26    3 o    286.4    3.9    0.0000   0.0000          ?        ?   820.5003  22.3483          ?        ?      286.4        3.9       ?       ? 
1 1 1   33   26    4 o    286.4    4.0    0.0000   0.0000          ?        ?   820.5003  22.9868          ?        ?      286.4        4.0       ?       ? 
1 1 1   33   26    5 o    290.5    3.7    0.0000   0.0000          ?        ?   844.1255  21.7097          ?        ?      290.5        3.7       ?       ? 
1 1 1   33   26    6 o     19.5    9.7    0.0000   0.0000          ?        ?   -36.3957  14.6860          ?        ?       19.5        9.7       ?       ? 
1 1 1   33   26    7 o    283.7    3.4    0.0000   0.0000          ?        ?   805.1758  19.1556          ?        ?      283.7        3.4       ?       ? 
1 1 1   33   26    8 o    244.3    3.4    0.0000   0.0000          ?        ?   597.0177  16.6016          ?        ?      244.3        3.4       ?       ? 
1 1 1   33   26    9 o    343.7    3.3    0.0000   0.0000          ?        ?  1181.9036  22.3483          ?        ?      343.7        3.3       ?       ? 
1 1 1   33   26   10 o    187.8    4.1    0.0000   0.0000          ?        ?   353.1024  15.3245          ?        ?      187.8        4.1       ?       ? 
1 1 1   33   26   11 o    203.4    2.8    0.0000   0.0000          ?        ?   413.7620  11.4934          ?        ?      203.4        2.8       ?       ? 
1 1 1   33   26   12 o    429.5    2.6    0.0000   0.0000          ?        ?  1845.3275  22.3483          ?        ?      429.5        2.6       ?       ? 
1 1 1   33   26   13 o    286.3    2.5    0.0000   0.0000          ?        ?   819.8618  14.0475          ?        ?      286.3        2.5       ?       ? 
1 1 1   33   26   14 o     34.7   12.0    0.0000   0.0000          ?        ?    10.8549  10.2163          ?        ?       34.7       12.0       ?       ? 
1 1 1   33   26   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   26   16 o    255.0    2.8    0.0000   0.0000          ?        ?   650.6536  14.0475          ?        ?      255.0        2.8       ?       ? 
1 1 1   33   26   17 o    228.1    2.4    0.0000   0.0000          ?        ?   520.3951  10.8549          ?        ?      228.1        2.4       ?       ? 
1 1 1   33   26   18 o    610.1    2.7    0.0000   0.0000          ?        ?  3723.2195  33.2031          ?        ?      610.1        2.7       ?       ? 
1 1 1   33   26   19 o    209.4    3.0    0.0000   0.0000          ?        ?   438.6643  12.7704          ?        ?      209.4        3.0       ?       ? 
1 1 1   33   26   20 o    313.0    2.7    0.0000   0.0000          ?        ?   980.1307  16.6016          ?        ?      313.0        2.7       ?       ? 
1 1 1   33   26   21 o    345.7    2.3    0.0000   0.0000          ?        ?  1195.3125  15.9630          ?        ?      345.7        2.3       ?       ? 
1 1 1   33   26   22 o    332.7    2.4    0.0000   0.0000          ?        ?  1107.1964  15.9630          ?        ?      332.7        2.4       ?       ? 
1 1 1   33   26   23 o     68.1    8.9    0.0000   0.0000          ?        ?    46.6121  12.1319          ?        ?       68.1        8.9       ?       ? 
1 1 1   33   26   24 o    105.3    5.8    0.0000   0.0000          ?        ?   111.1028  12.1319          ?        ?      105.3        5.8       ?       ? 
1 1 1   33   26   25 o    158.1    4.0    0.0000   0.0000          ?        ?   250.3005  12.7704          ?        ?      158.1        4.0       ?       ? 
1 1 1   33   26   26 o    160.9    4.2    0.0000   0.0000          ?        ?   259.2398  13.4090          ?        ?      160.9        4.2       ?       ? 
1 1 1   33   26   27 o    157.5    4.3    0.0000   0.0000          ?        ?   248.3849  13.4090          ?        ?      157.5        4.3       ?       ? 
1 1 1   33   26   28 o    160.1    4.2    0.0000   0.0000          ?        ?   256.6857  13.4090          ?        ?      160.1        4.2       ?       ? 
1 1 1   33   26   29 o    245.3    3.0    0.0000   0.0000          ?        ?   602.1259  14.6860          ?        ?      245.3        3.0       ?       ? 
1 1 1   33   26   30 f    158.5    4.6    0.0000   0.0000          ?        ?   251.5775  14.6860          ?        ?      158.5        4.6       ?       ? 
1 1 1   33   26   31 o    288.7    3.1    0.0000   0.0000          ?        ?   833.9093  17.8786          ?        ?      288.7        3.1       ?       ? 
1 1 1   33   26   32 o    286.6    3.0    0.0000   0.0000          ?        ?   821.7773  17.2401          ?        ?      286.6        3.0       ?       ? 
1 1 1   33   26   33 o    152.7    5.0    0.0000   0.0000          ?        ?   233.6989  15.3245          ?        ?      152.7        5.0       ?       ? 
1 1 1   33   26   34 o    181.0    4.4    0.0000   0.0000          ?        ?   328.2001  15.9630          ?        ?      181.0        4.4       ?       ? 
1 1 1   33   26   35 o     87.6    9.8    0.0000   0.0000          ?        ?    77.2611  17.2401          ?        ?       87.6        9.8       ?       ? 
1 1 1   33   26   36 o    110.8    6.9    0.0000   0.0000          ?        ?   123.2347  15.3245          ?        ?      110.8        6.9       ?       ? 
1 1 1   33   26   37 o    246.4    3.6    0.0000   0.0000          ?        ?   607.8726  17.8786          ?        ?      246.4        3.6       ?       ? 
1 1 1   33   26   38 o    132.1    6.3    0.0000   0.0000          ?        ?   174.9549  16.6016          ?        ?      132.1        6.3       ?       ? 
1 1 1   33   26   39 o     66.7   12.9    0.0000   0.0000          ?        ?    46.6121  16.6016          ?        ?       66.7       12.9       ?       ? 
1 1 1   33   26   40 o    148.2    5.4    0.0000   0.0000          ?        ?   220.2900  15.9630          ?        ?      148.2        5.4       ?       ? 
1 1 1   33   26   41 o    320.9    3.0    0.0000   0.0000          ?        ?  1030.5739  19.1556          ?        ?      320.9        3.0       ?       ? 
1 1 1   33   26   42 o    158.6    5.4    0.0000   0.0000          ?        ?   252.2160  17.2401          ?        ?      158.6        5.4       ?       ? 
1 1 1   33   26   43 o    396.0    2.8    0.0000   0.0000          ?        ?  1569.4862  22.3483          ?        ?      396.0        2.8       ?       ? 
1 1 1   33   26   44 o     41.7   15.3    0.0000   0.0000          ?        ?    14.6860  16.6016          ?        ?       41.7       15.3       ?       ? 
1 1 1   33   26   45 o     18.5    9.4    0.0000   0.0000          ?        ?   -65.1292  17.8786          ?        ?       18.5        9.4       ?       ? 
1 1 1   33   26   46 o    171.5    5.2    0.0000   0.0000          ?        ?   294.9970  17.8786          ?        ?      171.5        5.2       ?       ? 
1 1 1   33   26   47 o     28.6   13.1    0.0000   0.0000          ?        ?   -12.1319  17.2401          ?        ?       28.6       13.1       ?       ? 
1 1 1   33   26   48 o     75.1   11.5    0.0000   0.0000          ?        ?    57.4669  17.2401          ?        ?       75.1       11.5       ?       ? 
1 1 1   33   26   49 o     76.7   11.7    0.0000   0.0000          ?        ?    60.0210  17.8786          ?        ?       76.7       11.7       ?       ? 
1 1 1   33   26   50 o     99.1    9.0    0.0000   0.0000          ?        ?    99.6094  17.8786          ?        ?       99.1        9.0       ?       ? 
1 1 1   33   26   51 o    409.1    2.9    0.0000   0.0000          ?        ?  1676.1193  23.6253          ?        ?      409.1        2.9       ?       ? 
1 1 1   33   26   52 o     71.9   12.9    0.0000   0.0000          ?        ?    54.9129  17.8786          ?        ?       71.9       12.9       ?       ? 
1 1 1   33   27    0 o    185.5    8.1  346.7172  30.0105   346.7172  30.0105   346.7172  30.0105      185.5      8.1      185.5        8.1     0.0     0.0 
1 1 1   33   27    1 o     80.5   12.3    0.0000   0.0000          ?        ?    65.1292  19.7942          ?        ?       80.5       12.3       ?       ? 
1 1 1   33   27    2 o    399.5    3.6    0.0000   0.0000          ?        ?  1596.9426  28.7335          ?        ?      399.5        3.6       ?       ? 
1 1 1   33   27    3 o    477.3    3.5    0.0000   0.0000          ?        ?  2278.8835  33.2031          ?        ?      477.3        3.5       ?       ? 
1 1 1   33   27    4 o    505.1    3.7    0.0000   0.0000          ?        ?  2552.8093  37.0343          ?        ?      505.1        3.7       ?       ? 
1 1 1   33   27    5 o    174.8    5.8    0.0000   0.0000          ?        ?   305.8519  20.4327          ?        ?      174.8        5.8       ?       ? 
1 1 1   33   27    6 o     43.3   17.1    0.0000   0.0000          ?        ?    10.8549  21.7097          ?        ?       43.3       17.1       ?       ? 
1 1 1   33   27    7 o     30.5   12.5    0.0000   0.0000          ?        ?     3.1926  12.1319          ?        ?       30.5       12.5       ?       ? 
1 1 1   33   27    8 o     87.8    6.2    0.0000   0.0000          ?        ?    77.2611  10.8549          ?        ?       87.8        6.2       ?       ? 
1 1 1   33   27    9 o     93.1    7.2    0.0000   0.0000          ?        ?    86.8389  13.4090          ?        ?       93.1        7.2       ?       ? 
1 1 1   33   27   10 o    412.9    3.2    0.0000   0.0000          ?        ?  1705.4913  26.1794          ?        ?      412.9        3.2       ?       ? 
1 1 1   33   27   11 o    242.5    2.9    0.0000   0.0000          ?        ?   588.0784  14.0475          ?        ?      242.5        2.9       ?       ? 
1 1 1   33   27   12 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   27   13 f     90.4    4.6    0.0000   0.0000          ?        ?    81.7308   8.3008          ?        ?       90.4        4.6       ?       ? 
1 1 1   33   27   14 o    164.1    3.1    0.0000   0.0000          ?        ?   269.4561  10.2163          ?        ?      164.1        3.1       ?       ? 
1 1 1   33   27   15 o    457.6    2.7    0.0000   0.0000          ?        ?  2094.9895  24.2638          ?        ?      457.6        2.7       ?       ? 
1 1 1   33   27   16 o    104.4    5.2    0.0000   0.0000          ?        ?   109.1872  10.8549          ?        ?      104.4        5.2       ?       ? 
1 1 1   33   27   17 o     40.6   10.2    0.0000   0.0000          ?        ?    17.2401   8.3008          ?        ?       40.6       10.2       ?       ? 
1 1 1   33   27   18 o    192.7    2.8    0.0000   0.0000          ?        ?   371.6196  10.8549          ?        ?      192.7        2.8       ?       ? 
1 1 1   33   27   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   27   20 o    421.2    2.6    0.0000   0.0000          ?        ?  1775.0901  21.7097          ?        ?      421.2        2.6       ?       ? 
1 1 1   33   27   21 o    336.9    2.4    0.0000   0.0000          ?        ?  1135.2915  15.9630          ?        ?      336.9        2.4       ?       ? 
1 1 1   33   27   22 o     56.5   10.6    0.0000   0.0000          ?        ?    33.2031  11.4934          ?        ?       56.5       10.6       ?       ? 
1 1 1   33   27   23 o    398.8    2.3    0.0000   0.0000          ?        ?  1591.1959  18.5171          ?        ?      398.8        2.3       ?       ? 
1 1 1   33   27   24 o    398.8    2.5    0.0000   0.0000          ?        ?  1591.1959  19.7942          ?        ?      398.8        2.5       ?       ? 
1 1 1   33   27   25 o    161.3    4.0    0.0000   0.0000          ?        ?   260.5168  12.7704          ?        ?      161.3        4.0       ?       ? 
1 1 1   33   27   26 o    142.2    4.5    0.0000   0.0000          ?        ?   202.4114  12.7704          ?        ?      142.2        4.5       ?       ? 
1 1 1   33   27   27 o     88.8    7.2    0.0000   0.0000          ?        ?    79.1767  12.7704          ?        ?       88.8        7.2       ?       ? 
1 1 1   33   27   28 o    157.9    4.2    0.0000   0.0000          ?        ?   249.6619  13.4090          ?        ?      157.9        4.2       ?       ? 
1 1 1   33   27   29 o     19.5    9.7    0.0000   0.0000          ?        ?   -32.5646  14.0475          ?        ?       19.5        9.7       ?       ? 
1 1 1   33   27   30 o    245.0    3.1    0.0000   0.0000          ?        ?   600.8488  15.3245          ?        ?      245.0        3.1       ?       ? 
1 1 1   33   27   31 o    428.9    2.6    0.0000   0.0000          ?        ?  1840.2194  22.3483          ?        ?      428.9        2.6       ?       ? 
1 1 1   33   27   32 o    256.5    3.2    0.0000   0.0000          ?        ?   658.3158  16.6016          ?        ?      256.5        3.2       ?       ? 
1 1 1   33   27   33 o     64.0   12.4    0.0000   0.0000          ?        ?    42.7809  15.3245          ?        ?       64.0       12.4       ?       ? 
1 1 1   33   27   34 o    348.9    2.7    0.0000   0.0000          ?        ?  1218.2993  19.1556          ?        ?      348.9        2.7       ?       ? 
1 1 1   33   27   35 o    354.4    2.9    0.0000   0.0000          ?        ?  1256.6106  20.4327          ?        ?      354.4        2.9       ?       ? 
1 1 1   33   27   36 o    206.2    4.0    0.0000   0.0000          ?        ?   425.8939  16.6016          ?        ?      206.2        4.0       ?       ? 
1 1 1   33   27   37 f    205.8    4.2    0.0000   0.0000          ?        ?   423.9784  17.2401          ?        ?      205.8        4.2       ?       ? 
1 1 1   33   27   38 o    102.3    8.1    0.0000   0.0000          ?        ?   105.3561  16.6016          ?        ?      102.3        8.1       ?       ? 
1 1 1   33   27   39 o    132.3    6.3    0.0000   0.0000          ?        ?   175.5934  16.6016          ?        ?      132.3        6.3       ?       ? 
1 1 1   33   27   40 o     49.2   14.9    0.0000   0.0000          ?        ?    24.9023  15.9630          ?        ?       49.2       14.9       ?       ? 
1 1 1   33   27   41 o    156.4    5.3    0.0000   0.0000          ?        ?   245.1923  16.6016          ?        ?      156.4        5.3       ?       ? 
1 1 1   33   27   42 o    125.0    6.4    0.0000   0.0000          ?        ?   157.0763  15.9630          ?        ?      125.0        6.4       ?       ? 
1 1 1   33   27   43 o    261.9    3.4    0.0000   0.0000          ?        ?   687.0493  17.8786          ?        ?      261.9        3.4       ?       ? 
1 1 1   33   27   44 o    235.6    3.9    0.0000   0.0000          ?        ?   556.1523  18.5171          ?        ?      235.6        3.9       ?       ? 
1 1 1   33   27   45 o    212.8    4.2    0.0000   0.0000          ?        ?   453.9889  17.8786          ?        ?      212.8        4.2       ?       ? 
1 1 1   33   27   46 o    114.8    7.5    0.0000   0.0000          ?        ?   132.8125  17.2401          ?        ?      114.8        7.5       ?       ? 
1 1 1   33   27   47 o     21.9   10.8    0.0000   0.0000          ?        ?   -37.6728  17.2401          ?        ?       21.9       10.8       ?       ? 
1 1 1   33   27   48 o    278.3    3.4    0.0000   0.0000          ?        ?   775.8038  19.1556          ?        ?      278.3        3.4       ?       ? 
1 1 1   33   27   49 o    173.9    5.3    0.0000   0.0000          ?        ?   303.9363  18.5171          ?        ?      173.9        5.3       ?       ? 
1 1 1   33   27   50 f    309.6    3.3    0.0000   0.0000          ?        ?   960.3365  20.4327          ?        ?      309.6        3.3       ?       ? 
1 1 1   33   27   51 o     22.9   11.3    0.0000   0.0000          ?        ?   -35.7572  17.8786          ?        ?       22.9       11.3       ?       ? 
1 1 1   33   28    0 o    342.8    5.6 1176.7954  38.3113  1176.7954  38.3113  1176.7954  38.3113      342.8      5.6      342.8        5.6     0.0     0.0 
1 1 1   33   28    1 o    312.6    4.3    0.0000   0.0000          ?        ?   978.2151  26.8179          ?        ?      312.6        4.3       ?       ? 
1 1 1   33   28    2 o    219.1    5.7    0.0000   0.0000          ?        ?   480.8068  24.9023          ?        ?      219.1        5.7       ?       ? 
1 1 1   33   28    3 o    289.3    5.3    0.0000   0.0000          ?        ?   837.7404  30.6490          ?        ?      289.3        5.3       ?       ? 
1 1 1   33   28    4 o    256.9    5.1    0.0000   0.0000          ?        ?   660.8699  26.1794          ?        ?      256.9        5.1       ?       ? 
1 1 1   33   28    5 o    418.5    3.5    0.0000   0.0000          ?        ?  1752.1033  29.3720          ?        ?      418.5        3.5       ?       ? 
1 1 1   33   28    6 f    215.3    4.6    0.0000   0.0000          ?        ?   464.2052  19.7942          ?        ?      215.3        4.6       ?       ? 
1 1 1   33   28    7 f    273.7    3.6    0.0000   0.0000          ?        ?   749.6244  19.7942          ?        ?      273.7        3.6       ?       ? 
1 1 1   33   28    8 o    307.2    3.1    0.0000   0.0000          ?        ?   944.3735  19.1556          ?        ?      307.2        3.1       ?       ? 
1 1 1   33   28    9 o    164.4    4.9    0.0000   0.0000          ?        ?   270.7332  15.9630          ?        ?      164.4        4.9       ?       ? 
1 1 1   33   28   10 o    575.9    3.4    0.0000   0.0000          ?        ?  3319.0354  38.9498          ?        ?      575.9        3.4       ?       ? 
1 1 1   33   28   11 o    387.6    3.5    0.0000   0.0000          ?        ?  1503.0798  26.8179          ?        ?      387.6        3.5       ?       ? 
1 1 1   33   28   12 o    237.0    3.0    0.0000   0.0000          ?        ?   561.8990  14.0475          ?        ?      237.0        3.0       ?       ? 
1 1 1   33   28   13 o    247.5    3.1    0.0000   0.0000          ?        ?   612.9808  15.3245          ?        ?      247.5        3.1       ?       ? 
1 1 1   33   28   14 o    399.5    2.6    0.0000   0.0000          ?        ?  1596.9426  20.4327          ?        ?      399.5        2.6       ?       ? 
1 1 1   33   28   15 o    369.7    2.5    0.0000   0.0000          ?        ?  1367.0748  18.5171          ?        ?      369.7        2.5       ?       ? 
1 1 1   33   28   16 o    392.7    2.7    0.0000   0.0000          ?        ?  1542.6683  21.0712          ?        ?      392.7        2.7       ?       ? 
1 1 1   33   28   17 o    421.5    2.7    0.0000   0.0000          ?        ?  1777.0056  22.3483          ?        ?      421.5        2.7       ?       ? 
1 1 1   33   28   18 o    192.6    2.8    0.0000   0.0000          ?        ?   370.9810  10.8549          ?        ?      192.6        2.8       ?       ? 
1 1 1   33   28   19 o    247.0    2.6    0.0000   0.0000          ?        ?   610.4266  12.7704          ?        ?      247.0        2.6       ?       ? 
1 1 1   33   28   20 o    559.1    2.7    0.0000   0.0000          ?        ?  3127.4788  30.6490          ?        ?      559.1        2.7       ?       ? 
1 1 1   33   28   21 o    427.3    2.4    0.0000   0.0000          ?        ?  1826.8104  20.4327          ?        ?      427.3        2.4       ?       ? 
1 1 1   33   28   22 o    328.8    2.4    0.0000   0.0000          ?        ?  1081.6556  15.9630          ?        ?      328.8        2.4       ?       ? 
1 1 1   33   28   23 o    570.4    2.6    0.0000   0.0000          ?        ?  3255.1831  30.0105          ?        ?      570.4        2.6       ?       ? 
1 1 1   33   28   24 o     16.0    8.1    0.0000   0.0000          ?        ?   -39.5883  12.1319          ?        ?       16.0        8.1       ?       ? 
1 1 1   33   28   25 o    331.4    2.5    0.0000   0.0000          ?        ?  1098.8958  16.6016          ?        ?      331.4        2.5       ?       ? 
1 1 1   33   28   26 o    199.2    3.4    0.0000   0.0000          ?        ?   397.1605  13.4090          ?        ?      199.2        3.4       ?       ? 
1 1 1   33   28   27 o    447.2    2.5    0.0000   0.0000          ?        ?  2000.4882  22.3483          ?        ?      447.2        2.5       ?       ? 
1 1 1   33   28   28 o    215.4    3.4    0.0000   0.0000          ?        ?   464.2052  14.6860          ?        ?      215.4        3.4       ?       ? 
1 1 1   33   28   29 o    217.6    3.5    0.0000   0.0000          ?        ?   473.7830  15.3245          ?        ?      217.6        3.5       ?       ? 
1 1 1   33   28   30 o    295.1    2.9    0.0000   0.0000          ?        ?   871.5820  17.2401          ?        ?      295.1        2.9       ?       ? 
1 1 1   33   28   31 o    320.0    2.9    0.0000   0.0000          ?        ?  1024.8273  18.5171          ?        ?      320.0        2.9       ?       ? 
1 1 1   33   28   32 o     99.9    7.3    0.0000   0.0000          ?        ?   100.2479  14.6860          ?        ?       99.9        7.3       ?       ? 
1 1 1   33   28   33 o    167.1    4.6    0.0000   0.0000          ?        ?   279.6725  15.3245          ?        ?      167.1        4.6       ?       ? 
1 1 1   33   28   34 o    262.8    3.4    0.0000   0.0000          ?        ?   691.5189  17.8786          ?        ?      262.8        3.4       ?       ? 
1 1 1   33   28   35 o    201.5    4.0    0.0000   0.0000          ?        ?   406.7383  15.9630          ?        ?      201.5        4.0       ?       ? 
1 1 1   33   28   36 o    224.9    3.8    0.0000   0.0000          ?        ?   506.3477  17.2401          ?        ?      224.9        3.8       ?       ? 
1 1 1   33   28   37 o    279.8    3.3    0.0000   0.0000          ?        ?   783.4660  18.5171          ?        ?      279.8        3.3       ?       ? 
1 1 1   33   28   38 o    313.5    3.1    0.0000   0.0000          ?        ?   983.9619  19.1556          ?        ?      313.5        3.1       ?       ? 
1 1 1   33   28   39 o     27.1   12.5    0.0000   0.0000          ?        ?   -12.7704  15.9630          ?        ?       27.1       12.5       ?       ? 
1 1 1   33   28   40 o     84.5    9.4    0.0000   0.0000          ?        ?    72.1529  15.9630          ?        ?       84.5        9.4       ?       ? 
1 1 1   33   28   41 o     41.3   15.2    0.0000   0.0000          ?        ?    14.0475  16.6016          ?        ?       41.3       15.2       ?       ? 
1 1 1   33   28   42 o     23.6   11.5    0.0000   0.0000          ?        ?   -30.0105  17.2401          ?        ?       23.6       11.5       ?       ? 
1 1 1   33   28   43 o    194.7    4.6    0.0000   0.0000          ?        ?   379.9204  17.8786          ?        ?      194.7        4.6       ?       ? 
1 1 1   33   28   44 o     23.0   11.3    0.0000   0.0000          ?        ?   -35.7572  17.8786          ?        ?       23.0       11.3       ?       ? 
1 1 1   33   28   45 o    184.7    4.7    0.0000   0.0000          ?        ?   342.2476  17.2401          ?        ?      184.7        4.7       ?       ? 
1 1 1   33   28   46 o    138.0    6.2    0.0000   0.0000          ?        ?   191.5565  17.2401          ?        ?      138.0        6.2       ?       ? 
1 1 1   33   28   47 o    125.3    6.9    0.0000   0.0000          ?        ?   158.3534  17.2401          ?        ?      125.3        6.9       ?       ? 
1 1 1   33   28   48 o     37.9   15.1    0.0000   0.0000          ?        ?     8.3008  17.2401          ?        ?       37.9       15.1       ?       ? 
1 1 1   33   28   49 o     42.5   15.8    0.0000   0.0000          ?        ?    15.3245  17.8786          ?        ?       42.5       15.8       ?       ? 
1 1 1   33   28   50 f     46.3   15.9    0.0000   0.0000          ?        ?    21.0712  17.8786          ?        ?       46.3       15.9       ?       ? 
1 1 1   33   29    0 f    478.9    5.1 2296.1238  49.1662  2296.1238  49.1662  2296.1238  49.1662      478.9      5.1      478.9        5.1     0.0     0.0 
1 1 1   33   29    1 o    257.8    4.3    0.0000   0.0000          ?        ?   665.3395  22.3483          ?        ?      257.8        4.3       ?       ? 
1 1 1   33   29    2 o    463.4    3.3    0.0000   0.0000          ?        ?  2148.6252  30.6490          ?        ?      463.4        3.3       ?       ? 
1 1 1   33   29    3 o    177.4    6.7    0.0000   0.0000          ?        ?   315.4297  23.6253          ?        ?      177.4        6.7       ?       ? 
1 1 1   33   29    4 o    340.3    3.8    0.0000   0.0000          ?        ?  1158.9167  25.5409          ?        ?      340.3        3.8       ?       ? 
1 1 1   33   29    5 o    515.1    3.7    0.0000   0.0000          ?        ?  2654.9729  37.6728          ?        ?      515.1        3.7       ?       ? 
1 1 1   33   29    6 o    446.4    4.5    0.0000   0.0000          ?        ?  1994.7416  40.2269          ?        ?      446.4        4.5       ?       ? 
1 1 1   33   29    7 o     94.5   12.5    0.0000   0.0000          ?        ?    90.0316  23.6253          ?        ?       94.5       12.5       ?       ? 
1 1 1   33   29    8 o    252.3    5.7    0.0000   0.0000          ?        ?   637.8831  28.7335          ?        ?      252.3        5.7       ?       ? 
1 1 1   33   29    9 o    605.0    3.7    0.0000   0.0000          ?        ?  3663.1987  44.6965          ?        ?      605.0        3.7       ?       ? 
1 1 1   33   29   10 o    185.1    3.8    0.0000   0.0000          ?        ?   342.8861  14.0475          ?        ?      185.1        3.8       ?       ? 
1 1 1   33   29   11 o    175.7    4.4    0.0000   0.0000          ?        ?   309.0445  15.3245          ?        ?      175.7        4.4       ?       ? 
1 1 1   33   29   12 o     28.8   11.6    0.0000   0.0000          ?        ?     3.8311  10.2163          ?        ?       28.8       11.6       ?       ? 
1 1 1   33   29   13 o    277.4    2.6    0.0000   0.0000          ?        ?   770.0571  14.6860          ?        ?      277.4        2.6       ?       ? 
1 1 1   33   29   14 o    295.7    3.3    0.0000   0.0000          ?        ?   874.7747  19.7942          ?        ?      295.7        3.3       ?       ? 
1 1 1   33   29   15 o    143.1    3.1    0.0000   0.0000          ?        ?   204.9654   8.9393          ?        ?      143.1        3.1       ?       ? 
1 1 1   33   29   16 o    291.4    2.6    0.0000   0.0000          ?        ?   849.2338  15.3245          ?        ?      291.4        2.6       ?       ? 
1 1 1   33   29   17 o     86.3    6.7    0.0000   0.0000          ?        ?    74.7070  11.4934          ?        ?       86.3        6.7       ?       ? 
1 1 1   33   29   18 o    342.3    2.2    0.0000   0.0000          ?        ?  1172.3258  15.3245          ?        ?      342.3        2.2       ?       ? 
1 1 1   33   29   19 o    259.9    2.6    0.0000   0.0000          ?        ?   675.5559  13.4090          ?        ?      259.9        2.6       ?       ? 
1 1 1   33   29   20 o    193.9    3.1    0.0000   0.0000          ?        ?   376.0892  12.1319          ?        ?      193.9        3.1       ?       ? 
1 1 1   33   29   21 o    410.7    2.4    0.0000   0.0000          ?        ?  1687.6125  19.7942          ?        ?      410.7        2.4       ?       ? 
1 1 1   33   29   22 o    121.1    4.7    0.0000   0.0000          ?        ?   146.8600  11.4934          ?        ?      121.1        4.7       ?       ? 
1 1 1   33   29   23 o    363.9    2.5    0.0000   0.0000          ?        ?  1324.9324  17.8786          ?        ?      363.9        2.5       ?       ? 
1 1 1   33   29   24 o    180.4    3.7    0.0000   0.0000          ?        ?   325.6460  13.4090          ?        ?      180.4        3.7       ?       ? 
1 1 1   33   29   25 o    309.7    2.7    0.0000   0.0000          ?        ?   959.6980  16.6016          ?        ?      309.7        2.7       ?       ? 
1 1 1   33   29   26 o    152.6    4.2    0.0000   0.0000          ?        ?   233.0604  12.7704          ?        ?      152.6        4.2       ?       ? 
1 1 1   33   29   27 o    378.3    2.5    0.0000   0.0000          ?        ?  1431.5654  19.1556          ?        ?      378.3        2.5       ?       ? 
1 1 1   33   29   28 o    198.5    3.9    0.0000   0.0000          ?        ?   394.6064  15.3245          ?        ?      198.5        3.9       ?       ? 
1 1 1   33   29   29 o    127.2    5.3    0.0000   0.0000          ?        ?   162.1845  13.4090          ?        ?      127.2        5.3       ?       ? 
1 1 1   33   29   30 o    213.3    3.6    0.0000   0.0000          ?        ?   455.2659  15.3245          ?        ?      213.3        3.6       ?       ? 
1 1 1   33   29   31 o    164.2    4.7    0.0000   0.0000          ?        ?   270.0946  15.3245          ?        ?      164.2        4.7       ?       ? 
1 1 1   33   29   32 o     19.8    9.8    0.0000   0.0000          ?        ?   -34.4802  14.6860          ?        ?       19.8        9.8       ?       ? 
1 1 1   33   29   33 o     80.8    9.5    0.0000   0.0000          ?        ?    65.7677  15.3245          ?        ?       80.8        9.5       ?       ? 
1 1 1   33   29   34 o     21.5   10.5    0.0000   0.0000          ?        ?   -30.0105  15.3245          ?        ?       21.5       10.5       ?       ? 
1 1 1   33   29   35 o    306.3    3.0    0.0000   0.0000          ?        ?   939.2654  18.5171          ?        ?      306.3        3.0       ?       ? 
1 1 1   33   29   36 o    206.7    4.2    0.0000   0.0000          ?        ?   427.8095  17.2401          ?        ?      206.7        4.2       ?       ? 
1 1 1   33   29   37 o    219.2    3.9    0.0000   0.0000          ?        ?   481.4453  17.2401          ?        ?      219.2        3.9       ?       ? 
1 1 1   33   29   38 o     22.2   10.8    0.0000   0.0000          ?        ?   -30.0105  15.9630          ?        ?       22.2       10.8       ?       ? 
1 1 1   33   29   39 o    124.5    6.4    0.0000   0.0000          ?        ?   155.7993  15.9630          ?        ?      124.5        6.4       ?       ? 
1 1 1   33   29   40 o    249.6    3.6    0.0000   0.0000          ?        ?   623.8356  17.8786          ?        ?      249.6        3.6       ?       ? 
1 1 1   33   29   41 o     44.3   14.8    0.0000   0.0000          ?        ?    19.1556  15.3245          ?        ?       44.3       14.8       ?       ? 
1 1 1   33   29   42 o    181.8    4.7    0.0000   0.0000          ?        ?   331.3927  17.2401          ?        ?      181.8        4.7       ?       ? 
1 1 1   33   29   43 o    185.1    4.7    0.0000   0.0000          ?        ?   343.5246  17.2401          ?        ?      185.1        4.7       ?       ? 
1 1 1   33   29   44 o    207.5    4.3    0.0000   0.0000          ?        ?   431.6406  17.8786          ?        ?      207.5        4.3       ?       ? 
1 1 1   33   29   45 o    263.6    3.5    0.0000   0.0000          ?        ?   695.9886  18.5171          ?        ?      263.6        3.5       ?       ? 
1 1 1   33   29   46 o     47.0   15.4    0.0000   0.0000          ?        ?    22.3483  16.6016          ?        ?       47.0       15.4       ?       ? 
1 1 1   33   29   47 o    158.8    5.4    0.0000   0.0000          ?        ?   253.4931  17.2401          ?        ?      158.8        5.4       ?       ? 
1 1 1   33   29   48 o     44.7   15.6    0.0000   0.0000          ?        ?    19.1556  17.2401          ?        ?       44.7       15.6       ?       ? 
1 1 1   33   30    0 o    273.4    6.1  749.6244  33.2031   749.6244  33.2031   749.6244  33.2031      273.4      6.1      273.4        6.1     0.0     0.0 
1 1 1   33   30    1 f    243.1    5.1    0.0000   0.0000          ?        ?   591.9095  24.9023          ?        ?      243.1        5.1       ?       ? 
1 1 1   33   30    2 o    237.4    5.6    0.0000   0.0000          ?        ?   564.4531  26.8179          ?        ?      237.4        5.6       ?       ? 
1 1 1   33   30    3 o    397.9    4.3    0.0000   0.0000          ?        ?  1584.8107  33.8416          ?        ?      397.9        4.3       ?       ? 
1 1 1   33   30    4 o    175.0    6.6    0.0000   0.0000          ?        ?   307.1289  22.9868          ?        ?      175.0        6.6       ?       ? 
1 1 1   33   30    5 o    233.5    4.9    0.0000   0.0000          ?        ?   545.9360  22.9868          ?        ?      233.5        4.9       ?       ? 
1 1 1   33   30    6 o    351.4    4.1    0.0000   0.0000          ?        ?  1236.1779  28.7335          ?        ?      351.4        4.1       ?       ? 
1 1 1   33   30    7 o    436.2    3.7    0.0000   0.0000          ?        ?  1904.0715  32.5646          ?        ?      436.2        3.7       ?       ? 
1 1 1   33   30    8 o    337.7    4.8    0.0000   0.0000          ?        ?  1141.6766  32.5646          ?        ?      337.7        4.8       ?       ? 
1 1 1   33   30    9 o    331.0    5.1    0.0000   0.0000          ?        ?  1097.6187  33.8416          ?        ?      331.0        5.1       ?       ? 
1 1 1   33   30   10 o    397.2    3.9    0.0000   0.0000          ?        ?  1579.0640  30.6490          ?        ?      397.2        3.9       ?       ? 
1 1 1   33   30   11 o    329.4    2.9    0.0000   0.0000          ?        ?  1085.4868  19.1556          ?        ?      329.4        2.9       ?       ? 
1 1 1   33   30   12 o    126.0    4.8    0.0000   0.0000          ?        ?   158.9919  12.1319          ?        ?      126.0        4.8       ?       ? 
1 1 1   33   30   13 o    320.0    2.7    0.0000   0.0000          ?        ?  1024.1886  17.2401          ?        ?      320.0        2.7       ?       ? 
1 1 1   33   30   14 o    117.6    5.4    0.0000   0.0000          ?        ?   138.5592  12.7704          ?        ?      117.6        5.4       ?       ? 
1 1 1   33   30   15 o    192.7    3.8    0.0000   0.0000          ?        ?   371.6196  14.6860          ?        ?      192.7        3.8       ?       ? 
1 1 1   33   30   16 o    441.7    2.5    0.0000   0.0000          ?        ?  1951.9607  21.7097          ?        ?      441.7        2.5       ?       ? 
1 1 1   33   30   17 o    228.6    2.8    0.0000   0.0000          ?        ?   522.9492  12.7704          ?        ?      228.6        2.8       ?       ? 
1 1 1   33   30   18 o    184.4    2.6    0.0000   0.0000          ?        ?   340.3320   9.5778          ?        ?      184.4        2.6       ?       ? 
1 1 1   33   30   19 o    333.3    2.5    0.0000   0.0000          ?        ?  1111.0276  16.6016          ?        ?      333.3        2.5       ?       ? 
1 1 1   33   30   20 o    267.1    2.6    0.0000   0.0000          ?        ?   713.8672  14.0475          ?        ?      267.1        2.6       ?       ? 
1 1 1   33   30   21 o     86.3    6.3    0.0000   0.0000          ?        ?    74.7070  10.8549          ?        ?       86.3        6.3       ?       ? 
1 1 1   33   30   22 o     44.3   12.0    0.0000   0.0000          ?        ?    20.4327  10.8549          ?        ?       44.3       12.0       ?       ? 
1 1 1   33   30   23 o     45.6   12.3    0.0000   0.0000          ?        ?    21.7097  11.4934          ?        ?       45.6       12.3       ?       ? 
1 1 1   33   30   24 o    231.0    2.9    0.0000   0.0000          ?        ?   533.8041  13.4090          ?        ?      231.0        2.9       ?       ? 
1 1 1   33   30   25 o    303.8    2.6    0.0000   0.0000          ?        ?   923.3023  15.9630          ?        ?      303.8        2.6       ?       ? 
1 1 1   33   30   26 o    122.1    5.5    0.0000   0.0000          ?        ?   149.4141  13.4090          ?        ?      122.1        5.5       ?       ? 
1 1 1   33   30   27 o    201.6    3.5    0.0000   0.0000          ?        ?   406.7383  14.0475          ?        ?      201.6        3.5       ?       ? 
1 1 1   33   30   28 o    387.6    2.5    0.0000   0.0000          ?        ?  1503.0798  19.1556          ?        ?      387.6        2.5       ?       ? 
1 1 1   33   30   29 o    217.1    3.4    0.0000   0.0000          ?        ?   471.8675  14.6860          ?        ?      217.1        3.4       ?       ? 
1 1 1   33   30   30 o    108.8    6.8    0.0000   0.0000          ?        ?   118.7650  14.6860          ?        ?      108.8        6.8       ?       ? 
1 1 1   33   30   31 o    266.5    3.2    0.0000   0.0000          ?        ?   710.6746  17.2401          ?        ?      266.5        3.2       ?       ? 
1 1 1   33   30   32 o    240.4    3.5    0.0000   0.0000          ?        ?   578.5006  16.6016          ?        ?      240.4        3.5       ?       ? 
1 1 1   33   30   33 o    146.5    5.2    0.0000   0.0000          ?        ?   215.1818  15.3245          ?        ?      146.5        5.2       ?       ? 
1 1 1   33   30   34 o    208.8    3.8    0.0000   0.0000          ?        ?   436.7488  15.9630          ?        ?      208.8        3.8       ?       ? 
1 1 1   33   30   35 o    152.0    5.2    0.0000   0.0000          ?        ?   231.7833  15.9630          ?        ?      152.0        5.2       ?       ? 
1 1 1   33   30   36 o    158.0    5.1    0.0000   0.0000          ?        ?   250.3005  15.9630          ?        ?      158.0        5.1       ?       ? 
1 1 1   33   30   37 o    163.3    5.1    0.0000   0.0000          ?        ?   267.5406  16.6016          ?        ?      163.3        5.1       ?       ? 
1 1 1   33   30   38 o    162.9    4.9    0.0000   0.0000          ?        ?   266.2635  15.9630          ?        ?      162.9        4.9       ?       ? 
1 1 1   33   30   39 o    255.7    3.6    0.0000   0.0000          ?        ?   655.1232  18.5171          ?        ?      255.7        3.6       ?       ? 
1 1 1   33   30   40 o    234.3    3.7    0.0000   0.0000          ?        ?   549.7671  17.2401          ?        ?      234.3        3.7       ?       ? 
1 1 1   33   30   41 o    278.5    3.4    0.0000   0.0000          ?        ?   777.0808  19.1556          ?        ?      278.5        3.4       ?       ? 
1 1 1   33   30   42 o    232.4    3.8    0.0000   0.0000          ?        ?   541.4664  17.8786          ?        ?      232.4        3.8       ?       ? 
1 1 1   33   30   43 o    279.1    3.2    0.0000   0.0000          ?        ?   780.2734  17.8786          ?        ?      279.1        3.2       ?       ? 
1 1 1   33   30   44 o    130.4    6.4    0.0000   0.0000          ?        ?   171.1238  16.6016          ?        ?      130.4        6.4       ?       ? 
1 1 1   33   30   45 o     19.4    9.7    0.0000   0.0000          ?        ?   -44.0580  15.9630          ?        ?       19.4        9.7       ?       ? 
1 1 1   33   30   46 o    181.0    4.6    0.0000   0.0000          ?        ?   328.8386  16.6016          ?        ?      181.0        4.6       ?       ? 
1 1 1   33   30   47 o     41.7   15.3    0.0000   0.0000          ?        ?    15.3245  16.6016          ?        ?       41.7       15.3       ?       ? 
1 1 1   33   31    0 o     23.4   17.0  -68.9603  39.5883   -68.9603  39.5883   -68.9603  39.5883       23.4     17.0       23.4       17.0     0.0     0.0 
1 1 1   33   31    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   31    2 o    200.5    6.5    0.0000   0.0000          ?        ?   402.9071  26.1794          ?        ?      200.5        6.5       ?       ? 
1 1 1   33   31    3 o    238.9    4.7    0.0000   0.0000          ?        ?   571.4769  22.3483          ?        ?      238.9        4.7       ?       ? 
1 1 1   33   31    4 o    232.6    5.2    0.0000   0.0000          ?        ?   542.1049  24.2638          ?        ?      232.6        5.2       ?       ? 
1 1 1   33   31    5 o    339.8    4.7    0.0000   0.0000          ?        ?  1156.3627  31.9261          ?        ?      339.8        4.7       ?       ? 
1 1 1   33   31    6 o    161.2    9.1    0.0000   0.0000          ?        ?   261.1554  29.3720          ?        ?      161.2        9.1       ?       ? 
1 1 1   33   31    7 o    131.3   11.2    0.0000   0.0000          ?        ?   173.6779  29.3720          ?        ?      131.3       11.2       ?       ? 
1 1 1   33   31    8 o    300.2    4.8    0.0000   0.0000          ?        ?   902.2311  28.7335          ?        ?      300.2        4.8       ?       ? 
1 1 1   33   31    9 o    167.3    8.4    0.0000   0.0000          ?        ?   280.9495  28.0950          ?        ?      167.3        8.4       ?       ? 
1 1 1   33   31   10 o    201.7    8.4    0.0000   0.0000          ?        ?   408.6538  33.8416          ?        ?      201.7        8.4       ?       ? 
1 1 1   33   31   11 o    485.4    4.9    0.0000   0.0000          ?        ?  2359.9761  47.8891          ?        ?      485.4        4.9       ?       ? 
1 1 1   33   31   12 o    278.9    3.0    0.0000   0.0000          ?        ?   778.3578  16.6016          ?        ?      278.9        3.0       ?       ? 
1 1 1   33   31   13 o     97.8    5.6    0.0000   0.0000          ?        ?    95.7782  10.8549          ?        ?       97.8        5.6       ?       ? 
1 1 1   33   31   14 o    154.0    4.4    0.0000   0.0000          ?        ?   237.5300  13.4090          ?        ?      154.0        4.4       ?       ? 
1 1 1   33   31   15 o    185.8    4.1    0.0000   0.0000          ?        ?   345.4402  15.3245          ?        ?      185.8        4.1       ?       ? 
1 1 1   33   31   16 o    151.1    4.9    0.0000   0.0000          ?        ?   228.5907  14.6860          ?        ?      151.1        4.9       ?       ? 
1 1 1   33   31   17 o     70.9    6.3    0.0000   0.0000          ?        ?    50.4432   8.9393          ?        ?       70.9        6.3       ?       ? 
1 1 1   33   31   18 o    265.0    2.9    0.0000   0.0000          ?        ?   702.3738  15.3245          ?        ?      265.0        2.9       ?       ? 
1 1 1   33   31   19 o     46.2   10.0    0.0000   0.0000          ?        ?    22.3483   8.9393          ?        ?       46.2       10.0       ?       ? 
1 1 1   33   31   20 o    222.5    2.7    0.0000   0.0000          ?        ?   495.4928  12.1319          ?        ?      222.5        2.7       ?       ? 
1 1 1   33   31   21 o    390.0    2.4    0.0000   0.0000          ?        ?  1521.5970  18.5171          ?        ?      390.0        2.4       ?       ? 
1 1 1   33   31   22 o    397.4    2.5    0.0000   0.0000          ?        ?  1580.3411  19.7942          ?        ?      397.4        2.5       ?       ? 
1 1 1   33   31   23 o     87.0    6.6    0.0000   0.0000          ?        ?    75.9841  11.4934          ?        ?       87.0        6.6       ?       ? 
1 1 1   33   31   24 o    250.1    2.9    0.0000   0.0000          ?        ?   625.7512  14.6860          ?        ?      250.1        2.9       ?       ? 
1 1 1   33   31   25 o    175.7    3.6    0.0000   0.0000          ?        ?   309.0445  12.7704          ?        ?      175.7        3.6       ?       ? 
1 1 1   33   31   26 o     30.4   12.5    0.0000   0.0000          ?        ?     3.1926  12.1319          ?        ?       30.4       12.5       ?       ? 
1 1 1   33   31   27 o    208.0    3.2    0.0000   0.0000          ?        ?   432.9177  13.4090          ?        ?      208.0        3.2       ?       ? 
1 1 1   33   31   28 o     49.3   13.3    0.0000   0.0000          ?        ?    25.5409  13.4090          ?        ?       49.3       13.3       ?       ? 
1 1 1   33   31   29 o    367.6    2.7    0.0000   0.0000          ?        ?  1352.3888  19.7942          ?        ?      367.6        2.7       ?       ? 
1 1 1   33   31   30 o    181.5    4.2    0.0000   0.0000          ?        ?   330.1157  15.3245          ?        ?      181.5        4.2       ?       ? 
1 1 1   33   31   31 o    187.6    4.1    0.0000   0.0000          ?        ?   352.4639  15.3245          ?        ?      187.6        4.1       ?       ? 
1 1 1   33   31   32 o    290.7    3.0    0.0000   0.0000          ?        ?   846.0411  17.2401          ?        ?      290.7        3.0       ?       ? 
1 1 1   33   31   33 o    173.1    4.4    0.0000   0.0000          ?        ?   300.1052  15.3245          ?        ?      173.1        4.4       ?       ? 
1 1 1   33   31   34 o    175.3    4.4    0.0000   0.0000          ?        ?   307.7674  15.3245          ?        ?      175.3        4.4       ?       ? 
1 1 1   33   31   35 o     89.7    8.5    0.0000   0.0000          ?        ?    81.0922  15.3245          ?        ?       89.7        8.5       ?       ? 
1 1 1   33   31   36 o    201.5    4.0    0.0000   0.0000          ?        ?   406.7383  15.9630          ?        ?      201.5        4.0       ?       ? 
1 1 1   33   31   37 o    126.0    6.6    0.0000   0.0000          ?        ?   159.6304  16.6016          ?        ?      126.0        6.6       ?       ? 
1 1 1   33   31   38 o    196.2    4.2    0.0000   0.0000          ?        ?   385.6671  16.6016          ?        ?      196.2        4.2       ?       ? 
1 1 1   33   31   39 o    154.0    5.2    0.0000   0.0000          ?        ?   238.1686  15.9630          ?        ?      154.0        5.2       ?       ? 
1 1 1   33   31   40 o    112.6    7.1    0.0000   0.0000          ?        ?   127.7043  15.9630          ?        ?      112.6        7.1       ?       ? 
1 1 1   33   31   41 o    145.5    5.5    0.0000   0.0000          ?        ?   212.6277  15.9630          ?        ?      145.5        5.5       ?       ? 
1 1 1   33   31   42 o    138.3    5.8    0.0000   0.0000          ?        ?   192.1950  15.9630          ?        ?      138.3        5.8       ?       ? 
1 1 1   33   31   43 o     79.2   10.1    0.0000   0.0000          ?        ?    63.8522  15.9630          ?        ?       79.2       10.1       ?       ? 
1 1 1   33   31   44 o     33.9   14.1    0.0000   0.0000          ?        ?     3.1926  15.9630          ?        ?       33.9       14.1       ?       ? 
1 1 1   33   31   45 o    188.0    4.4    0.0000   0.0000          ?        ?   355.0180  16.6016          ?        ?      188.0        4.4       ?       ? 
1 1 1   33   32    0 o    199.0    9.3  399.7145  37.0343   399.7145  37.0343   399.7145  37.0343      199.0      9.3      199.0        9.3     0.0     0.0 
1 1 1   33   32    1 o    343.0    3.9    0.0000   0.0000          ?        ?  1177.4338  26.8179          ?        ?      343.0        3.9       ?       ? 
1 1 1   33   32    2 o    308.6    4.3    0.0000   0.0000          ?        ?   953.3128  26.8179          ?        ?      308.6        4.3       ?       ? 
1 1 1   33   32    3 o    440.7    4.1    0.0000   0.0000          ?        ?  1944.2983  36.3957          ?        ?      440.7        4.1       ?       ? 
1 1 1   33   32    4 o    370.2    4.0    0.0000   0.0000          ?        ?  1371.5444  29.3720          ?        ?      370.2        4.0       ?       ? 
1 1 1   33   32    5 o    192.4    5.6    0.0000   0.0000          ?        ?   370.9810  21.7097          ?        ?      192.4        5.6       ?       ? 
1 1 1   33   32    6 o     81.1   13.0    0.0000   0.0000          ?        ?    66.4062  21.0712          ?        ?       81.1       13.0       ?       ? 
1 1 1   33   32    7 o    236.4    5.5    0.0000   0.0000          ?        ?   559.9835  26.1794          ?        ?      236.4        5.5       ?       ? 
1 1 1   33   32    8 f    317.0    4.8    0.0000   0.0000          ?        ?  1006.3101  30.6490          ?        ?      317.0        4.8       ?       ? 
1 1 1   33   32    9 o     41.1   16.9    0.0000   0.0000          ?        ?     5.7467  22.3483          ?        ?       41.1       16.9       ?       ? 
1 1 1   33   32   10 f    165.8    6.7    0.0000   0.0000          ?        ?   275.8413  22.3483          ?        ?      165.8        6.7       ?       ? 
1 1 1   33   32   11 o    172.1    8.9    0.0000   0.0000          ?        ?   297.5511  30.6490          ?        ?      172.1        8.9       ?       ? 
1 1 1   33   32   12 o    168.8    4.3    0.0000   0.0000          ?        ?   285.4192  14.6860          ?        ?      168.8        4.3       ?       ? 
1 1 1   33   32   13 o    339.7    3.2    0.0000   0.0000          ?        ?  1154.4471  21.7097          ?        ?      339.7        3.2       ?       ? 
1 1 1   33   32   14 o    427.7    3.5    0.0000   0.0000          ?        ?  1830.6416  30.0105          ?        ?      427.7        3.5       ?       ? 
1 1 1   33   32   15 f    261.6    3.5    0.0000   0.0000          ?        ?   685.1337  18.5171          ?        ?      261.6        3.5       ?       ? 
1 1 1   33   32   16 o    481.3    3.3    0.0000   0.0000          ?        ?  2317.8335  31.2876          ?        ?      481.3        3.3       ?       ? 
1 1 1   33   32   17 o    183.6    4.9    0.0000   0.0000          ?        ?   337.7780  17.8786          ?        ?      183.6        4.9       ?       ? 
1 1 1   33   32   18 o    560.2    3.4    0.0000   0.0000          ?        ?  3140.8879  37.6728          ?        ?      560.2        3.4       ?       ? 
1 1 1   33   32   19 o    590.0    2.9    0.0000   0.0000          ?        ?  3483.1355  33.8416          ?        ?      590.0        2.9       ?       ? 
1 1 1   33   32   20 o    224.8    2.8    0.0000   0.0000          ?        ?   505.7091  12.7704          ?        ?      224.8        2.8       ?       ? 
1 1 1   33   32   21 o    219.8    2.9    0.0000   0.0000          ?        ?   483.3608  12.7704          ?        ?      219.8        2.9       ?       ? 
1 1 1   33   32   22 o    266.3    2.6    0.0000   0.0000          ?        ?   709.3975  14.0475          ?        ?      266.3        2.6       ?       ? 
1 1 1   33   32   23 o    210.6    3.2    0.0000   0.0000          ?        ?   443.7725  13.4090          ?        ?      210.6        3.2       ?       ? 
1 1 1   33   32   24 o     30.8   12.5    0.0000   0.0000          ?        ?     3.8311  12.1319          ?        ?       30.8       12.5       ?       ? 
1 1 1   33   32   25 o    314.7    2.6    0.0000   0.0000          ?        ?   990.9855  16.6016          ?        ?      314.7        2.6       ?       ? 
1 1 1   33   32   26 o    402.8    2.5    0.0000   0.0000          ?        ?  1623.1219  19.7942          ?        ?      402.8        2.5       ?       ? 
1 1 1   33   32   27 o    212.7    3.3    0.0000   0.0000          ?        ?   452.7119  14.0475          ?        ?      212.7        3.3       ?       ? 
1 1 1   33   32   28 o    259.1    3.0    0.0000   0.0000          ?        ?   671.7247  15.3245          ?        ?      259.1        3.0       ?       ? 
1 1 1   33   32   29 o    279.8    2.7    0.0000   0.0000          ?        ?   783.4660  15.3245          ?        ?      279.8        2.7       ?       ? 
1 1 1   33   32   30 o    395.3    2.7    0.0000   0.0000          ?        ?  1563.7394  21.0712          ?        ?      395.3        2.7       ?       ? 
1 1 1   33   32   31 f    214.9    3.6    0.0000   0.0000          ?        ?   462.2897  15.3245          ?        ?      214.9        3.6       ?       ? 
1 1 1   33   32   32 o     55.5   12.9    0.0000   0.0000          ?        ?    32.5646  14.0475          ?        ?       55.5       12.9       ?       ? 
1 1 1   33   32   33 o     28.6   12.8    0.0000   0.0000          ?        ?    -7.0237  15.3245          ?        ?       28.6       12.8       ?       ? 
1 1 1   33   32   34 o    238.9    3.3    0.0000   0.0000          ?        ?   571.4769  15.9630          ?        ?      238.9        3.3       ?       ? 
1 1 1   33   32   35 o     94.8    8.1    0.0000   0.0000          ?        ?    90.6701  15.3245          ?        ?       94.8        8.1       ?       ? 
1 1 1   33   32   36 o    120.6    6.4    0.0000   0.0000          ?        ?   146.2215  15.3245          ?        ?      120.6        6.4       ?       ? 
1 1 1   33   32   37 o    195.7    4.2    0.0000   0.0000          ?        ?   383.7515  16.6016          ?        ?      195.7        4.2       ?       ? 
1 1 1   33   32   38 o    185.3    4.3    0.0000   0.0000          ?        ?   344.1632  15.9630          ?        ?      185.3        4.3       ?       ? 
1 1 1   33   32   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   32   40 o    100.5    8.3    0.0000   0.0000          ?        ?   102.1635  16.6016          ?        ?      100.5        8.3       ?       ? 
1 1 1   33   32   41 o    359.9    2.8    0.0000   0.0000          ?        ?  1296.8374  19.7942          ?        ?      359.9        2.8       ?       ? 
1 1 1   33   32   42 o    167.0    5.0    0.0000   0.0000          ?        ?   280.3110  16.6016          ?        ?      167.0        5.0       ?       ? 
1 1 1   33   32   43 f     58.6   13.8    0.0000   0.0000          ?        ?    37.0343  15.9630          ?        ?       58.6       13.8       ?       ? 
1 1 1   33   32   44 o    116.8    7.1    0.0000   0.0000          ?        ?   137.9207  16.6016          ?        ?      116.8        7.1       ?       ? 
1 1 1   33   33    0 o    597.5   10.3 3579.5520 123.2347  3579.5520 123.2347  3579.5520 123.2347      597.5     10.3      597.5       10.3     0.0     0.0 
1 1 1   33   33    1 o    151.8   12.6  236.2530  37.6728   236.2530  37.6728   236.2530  37.6728      151.8     12.6      151.8       12.6     0.0     0.0 
1 1 1   33   33    2 o     98.4   24.8  114.9339  42.1424   114.9339  42.1424   114.9339  42.1424       98.4     24.8       98.4       24.8     0.0     0.0 
1 1 1   33   33    3 o    284.0    8.8  810.9225  49.8047   810.9225  49.8047   810.9225  49.8047      284.0      8.8      284.0        8.8     0.0     0.0 
1 1 1   33   33    4 o    252.5    8.4  641.0757  42.1424   641.0757  42.1424   641.0757  42.1424      252.5      8.4      252.5        8.4     0.0     0.0 
1 1 1   33   33    5 o    107.1   19.8  126.4273  38.3113   126.4273  38.3113   126.4273  38.3113      107.1     19.8      107.1       19.8     0.0     0.0 
1 1 1   33   33    6 o    238.1    9.6  571.4769  45.3350   571.4769  45.3350   571.4769  45.3350      238.1      9.6      238.1        9.6     0.0     0.0 
1 1 1   33   33    7 o     26.0   18.8  -59.3825  42.7809   -59.3825  42.7809   -59.3825  42.7809       26.0     18.8       26.0       18.8     0.0     0.0 
1 1 1   33   33    8 o    219.8   10.7  488.4691  46.6121   488.4691  46.6121   488.4691  46.6121      219.8     10.7      219.8       10.7     0.0     0.0 
1 1 1   33   33    9 o    339.7    9.7 1160.1937  65.7677  1160.1937  65.7677  1160.1937  65.7677      339.7      9.7      339.7        9.7     0.0     0.0 
1 1 1   33   33   10 o    155.4   12.3  247.1079  37.6728   247.1079  37.6728   247.1079  37.6728      155.4     12.3      155.4       12.3     0.0     0.0 
1 1 1   33   33   11 o    348.3    6.1 1215.7451  42.7809  1215.7451  42.7809  1215.7451  42.7809      348.3      6.1      348.3        6.1     0.0     0.0 
1 1 1   33   33   12 o    455.4    6.6 2078.3879  60.0210  2078.3879  60.0210  2078.3879  60.0210      455.4      6.6      455.4        6.6     0.0     0.0 
1 1 1   33   33   13 o    143.0    5.6  205.6040  15.9630   205.6040  15.9630   205.6040  15.9630      143.0      5.6      143.0        5.6     0.0     0.0 
1 1 1   33   33   14 o     31.3   18.0   12.7704  17.8786    12.7704  17.8786    12.7704  17.8786       31.3     18.0       31.3       18.0     0.0     0.0 
1 1 1   33   33   15 o    107.0    9.4  117.4880  19.7942   117.4880  19.7942   117.4880  19.7942      107.0      9.4      107.0        9.4     0.0     0.0 
1 1 1   33   33   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   33   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   33   18 o    148.0    9.1  222.2055  26.8179   222.2055  26.8179   222.2055  26.8179      148.0      9.1      148.0        9.1     0.0     0.0 
1 1 1   33   33   19 f    118.4    4.9  141.1133  11.4934   141.1133  11.4934   141.1133  11.4934      118.4      4.9      118.4        4.9     0.0     0.0 
1 1 1   33   33   20 o    540.9    4.0 2927.6216  43.4195  2927.6216  43.4195  2927.6216  43.4195      540.9      4.0      540.9        4.0     0.0     0.0 
1 1 1   33   33   21 f    196.5    4.6  386.9441  17.8786   386.9441  17.8786   386.9441  17.8786      196.5      4.6      196.5        4.6     0.0     0.0 
1 1 1   33   33   22 o     12.2    9.0  -47.8891  15.9630   -47.8891  15.9630   -47.8891  15.9630       12.2      9.0       12.2        9.0     0.0     0.0 
1 1 1   33   33   23 o    151.8    5.7  231.7833  17.2401   231.7833  17.2401   231.7833  17.2401      151.8      5.7      151.8        5.7     0.0     0.0 
1 1 1   33   33   24 o    107.9    8.1  118.7650  17.2401   118.7650  17.2401   118.7650  17.2401      107.9      8.1      107.9        8.1     0.0     0.0 
1 1 1   33   33   25 o    221.6    5.0  492.3002  22.3483   492.3002  22.3483   492.3002  22.3483      221.6      5.0      221.6        5.0     0.0     0.0 
1 1 1   33   33   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   33   27 f    237.5    4.3  565.0916  20.4327   565.0916  20.4327   565.0916  20.4327      237.5      4.3      237.5        4.3     0.0     0.0 
1 1 1   33   33   28 o    182.4    5.3  333.9468  19.1556   333.9468  19.1556   333.9468  19.1556      182.4      5.3      182.4        5.3     0.0     0.0 
1 1 1   33   33   29 o     38.5   19.5   22.3483  18.5171    22.3483  18.5171    22.3483  18.5171       38.5     19.5       38.5       19.5     0.0     0.0 
1 1 1   33   33   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   33   31 o    179.8    5.9  325.0075  21.0712   325.0075  21.0712   325.0075  21.0712      179.8      5.9      179.8        5.9     0.0     0.0 
1 1 1   33   33   32 o    211.5    5.0  448.8807  21.0712   448.8807  21.0712   448.8807  21.0712      211.5      5.0      211.5        5.0     0.0     0.0 
1 1 1   33   33   33 o    330.0    4.1 1090.5950  26.8179  1090.5950  26.8179  1090.5950  26.8179      330.0      4.1      330.0        4.1     0.0     0.0 
1 1 1   33   33   34 o     35.5   19.9   17.8786  21.0712    17.8786  21.0712    17.8786  21.0712       35.5     19.9       35.5       19.9     0.0     0.0 
1 1 1   33   33   35 o    265.9    4.7  708.7590  24.9023   708.7590  24.9023   708.7590  24.9023      265.9      4.7      265.9        4.7     0.0     0.0 
1 1 1   33   33   36 o     41.4   20.8   26.1794  21.0712    26.1794  21.0712    26.1794  21.0712       41.4     20.8       41.4       20.8     0.0     0.0 
1 1 1   33   33   37 o    168.3    6.7  285.4192  22.3483   285.4192  22.3483   285.4192  22.3483      168.3      6.7      168.3        6.7     0.0     0.0 
1 1 1   33   33   38 o     98.9   11.6  102.8020  22.3483   102.8020  22.3483   102.8020  22.3483       98.9     11.6       98.9       11.6     0.0     0.0 
1 1 1   33   33   39 o    398.4    3.9 1589.9188  31.2876  1589.9188  31.2876  1589.9188  31.2876      398.4      3.9      398.4        3.9     0.0     0.0 
1 1 1   33   33   40 o    100.7   11.7  106.6331  22.9868   106.6331  22.9868   106.6331  22.9868      100.7     11.7      100.7       11.7     0.0     0.0 
1 1 1   33   33   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   33   33   42 o     20.0   14.2  -24.2638  22.3483   -24.2638  22.3483   -24.2638  22.3483       20.0     14.2       20.0       14.2     0.0     0.0 
1 1 1   34    0    0 o    877.0    7.5 7692.9087 132.1740  7692.9087 132.1740  7692.9087 132.1740      877.0      7.5      877.0        7.5     0.0     0.0 
1 1 1   34    0    1 o    959.3    5.5 9204.9277 104.7175  9204.9277 104.7175  9204.9277 104.7175      959.3      5.5      959.3        5.5     0.0     0.0 
1 1 1   34    0    2 o   1738.1    9.1 30216.7578 314.7912 30216.7578 314.7912 30216.7578 314.7912     1738.1      9.1     1738.1        9.1     0.0     0.0 
1 1 1   34    0    3 o    607.0    4.2 3685.5469  51.0817  3685.5469  51.0817  3685.5469  51.0817      607.0      4.2      607.0        4.2     0.0     0.0 
1 1 1   34    0    4 o    741.0    4.6 5491.2861  68.3218  5491.2861  68.3218  5491.2861  68.3218      741.0      4.6      741.0        4.6     0.0     0.0 
1 1 1   34    0    5 o    136.8    6.1  188.3639  16.6016   188.3639  16.6016   188.3639  16.6016      136.8      6.1      136.8        6.1     0.0     0.0 
1 1 1   34    0    6 o    159.8    4.4  256.0471  14.0475   256.0471  14.0475   256.0471  14.0475      159.8      4.4      159.8        4.4     0.0     0.0 
1 1 1   34    0    7 o    129.8    6.9  169.8468  17.8786   169.8468  17.8786   169.8468  17.8786      129.8      6.9      129.8        6.9     0.0     0.0 
1 1 1   34    0    8 o    195.4    6.1  383.1130  23.6253   383.1130  23.6253   383.1130  23.6253      195.4      6.1      195.4        6.1     0.0     0.0 
1 1 1   34    0    9 o    650.0    4.0 4225.7358  51.7203  4225.7358  51.7203  4225.7358  51.7203      650.0      4.0      650.0        4.0     0.0     0.0 
1 1 1   34    0   10 o   1667.7    8.0 27819.1094 266.9020 27819.1094 266.9020 27819.1094 266.9020     1667.7      8.0     1667.7        8.0     0.0     0.0 
1 1 1   34    0   11 o   1293.2    6.3 16725.4355 162.8230 16725.4355 162.8230 16725.4355 162.8230     1293.2      6.3     1293.2        6.3     0.0     0.0 
1 1 1   34    0   12 o    216.4    4.3  468.6749  18.5171   468.6749  18.5171   468.6749  18.5171      216.4      4.3      216.4        4.3     0.0     0.0 
1 1 1   34    0   13 o   1081.0    5.5 11687.5000 118.1265 11687.5000 118.1265 11687.5000 118.1265     1081.0      5.5     1081.0        5.5     0.0     0.0 
1 1 1   34    0   14 o    789.2    4.5 6229.4170  70.2374  6229.4170  70.2374  6229.4170  70.2374      789.2      4.5      789.2        4.5     0.0     0.0 
1 1 1   34    0   15 o    521.4    3.4 2719.4636  35.7572  2719.4636  35.7572  2719.4636  35.7572      521.4      3.4      521.4        3.4     0.0     0.0 
1 1 1   34    0   16 o    588.7    3.7 3466.5342  43.4195  3466.5342  43.4195  3466.5342  43.4195      588.7      3.7      588.7        3.7     0.0     0.0 
1 1 1   34    0   17 o    465.6    3.4 2168.4194  31.9261  2168.4194  31.9261  2168.4194  31.9261      465.6      3.4      465.6        3.4     0.0     0.0 
1 1 1   34    0   18 o    427.3    3.4 1826.1719  29.3720  1826.1719  29.3720  1826.1719  29.3720      427.3      3.4      427.3        3.4     0.0     0.0 
1 1 1   34    0   19 o   1167.5    6.1 13632.4365 141.7518 13632.4365 141.7518 13632.4365 141.7518     1167.5      6.1     1167.5        6.1     0.0     0.0 
1 1 1   34    0   20 o    753.3    4.2 5675.1802  62.5751  5675.1802  62.5751  5675.1802  62.5751      753.3      4.2      753.3        4.2     0.0     0.0 
1 1 1   34    0   21 o    455.4    3.6 2073.9182  32.5646  2073.9182  32.5646  2073.9182  32.5646      455.4      3.6      455.4        3.6     0.0     0.0 
1 1 1   34    0   22 o    322.0    3.8 1037.5977  24.2638  1037.5977  24.2638  1037.5977  24.2638      322.0      3.8      322.0        3.8     0.0     0.0 
1 1 1   34    0   23 o    638.0    4.8 4071.8525  60.6596  4071.8525  60.6596  4071.8525  60.6596      638.0      4.8      638.0        4.8     0.0     0.0 
1 1 1   34    0   24 o    333.2    3.7 1111.0276  24.9023  1111.0276  24.9023  1111.0276  24.9023      333.2      3.7      333.2        3.7     0.0     0.0 
1 1 1   34    0   25 o    135.9    7.3  186.4483  19.7942   186.4483  19.7942   186.4483  19.7942      135.9      7.3      135.9        7.3     0.0     0.0 
1 1 1   34    0   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    0   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    0   28 o    189.8    5.6  361.4032  21.0712   361.4032  21.0712   361.4032  21.0712      189.8      5.6      189.8        5.6     0.0     0.0 
1 1 1   34    0   29 o    368.5    3.9 1358.7740  28.7335  1358.7740  28.7335  1358.7740  28.7335      368.5      3.9      368.5        3.9     0.0     0.0 
1 1 1   34    0   30 o    224.3    5.0  503.7936  22.3483   503.7936  22.3483   503.7936  22.3483      224.3      5.0      224.3        5.0     0.0     0.0 
1 1 1   34    0   31 o    500.9    3.6 2510.0286  36.3957  2510.0286  36.3957  2510.0286  36.3957      500.9      3.6      500.9        3.6     0.0     0.0 
1 1 1   34    0   32 o    645.1    4.3 4163.1611  55.5514  4163.1611  55.5514  4163.1611  55.5514      645.1      4.3      645.1        4.3     0.0     0.0 
1 1 1   34    0   33 o   1179.1    6.1 13907.0010 143.6674 13907.0010 143.6674 13907.0010 143.6674     1179.1      6.1     1179.1        6.1     0.0     0.0 
1 1 1   34    0   34 o    192.0    6.8  370.3425  26.1794   370.3425  26.1794   370.3425  26.1794      192.0      6.8      192.0        6.8     0.0     0.0 
1 1 1   34    0   35 o    833.0    4.8 6941.3687  79.8152  6941.3687  79.8152  6941.3687  79.8152      833.0      4.8      833.0        4.8     0.0     0.0 
1 1 1   34    0   36 o    399.6    3.8 1597.5811  30.6490  1597.5811  30.6490  1597.5811  30.6490      399.6      3.8      399.6        3.8     0.0     0.0 
1 1 1   34    0   37 o    690.8    4.2 4773.5874  58.1055  4773.5874  58.1055  4773.5874  58.1055      690.8      4.2      690.8        4.2     0.0     0.0 
1 1 1   34    0   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    0   39 o     98.6   10.9  100.8864  21.0712   100.8864  21.0712   100.8864  21.0712       98.6     10.9       98.6       10.9     0.0     0.0 
1 1 1   34    0   40 o    239.3    4.8  573.3925  22.9868   573.3925  22.9868   573.3925  22.9868      239.3      4.8      239.3        4.8     0.0     0.0 
1 1 1   34    0   41 o    244.3    4.8  597.6562  23.6253   597.6562  23.6253   597.6562  23.6253      244.3      4.8      244.3        4.8     0.0     0.0 
1 1 1   34    0   42 o    262.8    4.9  691.5189  25.5409   691.5189  25.5409   691.5189  25.5409      262.8      4.9      262.8        4.9     0.0     0.0 
1 1 1   34    0   43 o     24.8   16.8   -9.5778  23.6253    -9.5778  23.6253    -9.5778  23.6253       24.8     16.8       24.8       16.8     0.0     0.0 
1 1 1   34    0   44 o    633.6    3.8 4016.3010  48.5276  4016.3010  48.5276  4016.3010  48.5276      633.6      3.8      633.6        3.8     0.0     0.0 
1 1 1   34    0   45 o     44.4   22.4   29.3720  24.2638    29.3720  24.2638    29.3720  24.2638       44.4     22.4       44.4       22.4     0.0     0.0 
1 1 1   34    0   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    0   47 o    185.3    6.6  344.8017  24.2638   344.8017  24.2638   344.8017  24.2638      185.3      6.6      185.3        6.6     0.0     0.0 
1 1 1   34    0   48 o     13.3    9.9  -81.0922  22.3483   -81.0922  22.3483   -81.0922  22.3483       13.3      9.9       13.3        9.9     0.0     0.0 
1 1 1   34    0   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    0   50 o    537.9    3.9 2895.0571  41.5039  2895.0571  41.5039  2895.0571  41.5039      537.9      3.9      537.9        3.9     0.0     0.0 
1 1 1   34    0   51 o    267.1    5.0  714.5057  26.8179   714.5057  26.8179   714.5057  26.8179      267.1      5.0      267.1        5.0     0.0     0.0 
1 1 1   34    0   52 o    211.8    6.2  450.1577  26.1794   450.1577  26.1794   450.1577  26.1794      211.8      6.2      211.8        6.2     0.0     0.0 
1 1 1   34    0   53 o    142.4    9.0  205.6040  25.5409   205.6040  25.5409   205.6040  25.5409      142.4      9.0      142.4        9.0     0.0     0.0 
1 1 1   34    0   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    0   55 o    203.1    6.5  414.4005  26.1794   414.4005  26.1794   414.4005  26.1794      203.1      6.5      203.1        6.5     0.0     0.0 
1 1 1   34    0   56 o    521.8    4.0 2724.5718  42.1424  2724.5718  42.1424  2724.5718  42.1424      521.8      4.0      521.8        4.0     0.0     0.0 
1 1 1   34    0   57 o    206.0    6.8  426.5325  28.0950   426.5325  28.0950   426.5325  28.0950      206.0      6.8      206.0        6.8     0.0     0.0 
1 1 1   34    0   58 o    352.0    5.2 1241.2860  36.3957  1241.2860  36.3957  1241.2860  36.3957      352.0      5.2      352.0        5.2     0.0     0.0 
1 1 1   34    0   59 o    154.6    9.6  242.6382  29.3720   242.6382  29.3720   242.6382  29.3720      154.6      9.6      154.6        9.6     0.0     0.0 
1 1 1   34    0   60 o    434.0    4.3 1885.5543  37.6728  1885.5543  37.6728  1885.5543  37.6728      434.0      4.3      434.0        4.3     0.0     0.0 
1 1 1   34    0   61 o    210.6    6.7  445.6881  28.0950   445.6881  28.0950   445.6881  28.0950      210.6      6.7      210.6        6.7     0.0     0.0 
1 1 1   34    0   62 o     33.7   21.0    8.9393  28.0950     8.9393  28.0950     8.9393  28.0950       33.7     21.0       33.7       21.0     0.0     0.0 
1 1 1   34    0   63 o     28.5   18.9   -4.4697  27.4564    -4.4697  27.4564    -4.4697  27.4564       28.5     18.9       28.5       18.9     0.0     0.0 
1 1 1   34    0   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    0   65 o    288.9    5.5  837.1019  31.9261   837.1019  31.9261   837.1019  31.9261      288.9      5.5      288.9        5.5     0.0     0.0 
1 1 1   34    0   66 o     72.4   24.3   68.9603  31.2876    68.9603  31.2876    68.9603  31.2876       72.4     24.3       72.4       24.3     0.0     0.0 
1 1 1   34    0   67 o    211.6    7.3  450.7963  30.6490   450.7963  30.6490   450.7963  30.6490      211.6      7.3      211.6        7.3     0.0     0.0 
1 1 1   34    0   68 o    110.4   14.3  129.6199  30.6490   129.6199  30.6490   129.6199  30.6490      110.4     14.3      110.4       14.3     0.0     0.0 
1 1 1   34    0   69 o    170.0    9.3  293.7199  31.2876   293.7199  31.2876   293.7199  31.2876      170.0      9.3      170.0        9.3     0.0     0.0 
1 1 1   34    0   70 o     78.6   23.0   77.8996  31.2876    77.8996  31.2876    77.8996  31.2876       78.6     23.0       78.6       23.0     0.0     0.0 
1 1 1   34    0   71 o     29.4   19.7   -5.7467  30.6490    -5.7467  30.6490    -5.7467  30.6490       29.4     19.7       29.4       19.7     0.0     0.0 
1 1 1   34    1    0 o     23.7   15.2    1.2770  15.9630     1.2770  15.9630     1.2770  15.9630       23.7     15.2       23.7       15.2     0.0     0.0 
1 1 1   34    1    1 o    296.8    2.7    0.0000   0.0000          ?        ?   881.1599  15.9630          ?        ?      296.8        2.7       ?       ? 
1 1 1   34    1    2 o    560.1    2.8    0.0000   0.0000          ?        ?  3137.6953  31.2876          ?        ?      560.1        2.8       ?       ? 
1 1 1   34    1    3 o    675.5    2.9    0.0000   0.0000          ?        ?  4563.5142  38.9498          ?        ?      675.5        2.9       ?       ? 
1 1 1   34    1    4 o    626.5    2.9    0.0000   0.0000          ?        ?  3924.9924  36.3957          ?        ?      626.5        2.9       ?       ? 
1 1 1   34    1    5 o   1621.2    5.6    0.0000   0.0000          ?        ? 26287.9355 180.7016          ?        ?     1621.2        5.6       ?       ? 
1 1 1   34    1    6 o    120.4    4.5    0.0000   0.0000          ?        ?   144.9444  10.8549          ?        ?      120.4        4.5       ?       ? 
1 1 1   34    1    7 o    710.7    2.8    0.0000   0.0000          ?        ?  5051.3442  40.2269          ?        ?      710.7        2.8       ?       ? 
1 1 1   34    1    8 o    655.5    2.8    0.0000   0.0000          ?        ?  4297.2505  36.3957          ?        ?      655.5        2.8       ?       ? 
1 1 1   34    1    9 o    367.9    2.3    0.0000   0.0000          ?        ?  1353.6659  17.2401          ?        ?      367.9        2.3       ?       ? 
1 1 1   34    1   10 o    753.4    3.1    0.0000   0.0000          ?        ?  5677.0957  46.6121          ?        ?      753.4        3.1       ?       ? 
1 1 1   34    1   11 o    489.8    2.4    0.0000   0.0000          ?        ?  2399.5642  23.6253          ?        ?      489.8        2.4       ?       ? 
1 1 1   34    1   12 o   1008.3    3.7    0.0000   0.0000          ?        ? 10166.5410  74.0685          ?        ?     1008.3        3.7       ?       ? 
1 1 1   34    1   13 o    705.1    2.9    0.0000   0.0000          ?        ?  4971.5293  40.8654          ?        ?      705.1        2.9       ?       ? 
1 1 1   34    1   14 o    772.9    3.0    0.0000   0.0000          ?        ?  5974.0083  45.9736          ?        ?      772.9        3.0       ?       ? 
1 1 1   34    1   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    1   16 o    635.3    2.7    0.0000   0.0000          ?        ?  4036.7339  33.8416          ?        ?      635.3        2.7       ?       ? 
1 1 1   34    1   17 o    477.6    2.4    0.0000   0.0000          ?        ?  2281.4377  22.9868          ?        ?      477.6        2.4       ?       ? 
1 1 1   34    1   18 o    754.4    3.1    0.0000   0.0000          ?        ?  5691.1431  46.6121          ?        ?      754.4        3.1       ?       ? 
1 1 1   34    1   19 o    388.1    2.4    0.0000   0.0000          ?        ?  1506.2725  18.5171          ?        ?      388.1        2.4       ?       ? 
1 1 1   34    1   20 o    752.4    3.1    0.0000   0.0000          ?        ?  5661.1328  45.9736          ?        ?      752.4        3.1       ?       ? 
1 1 1   34    1   21 o   1209.6    4.4    0.0000   0.0000          ?        ? 14633.0000 105.9946          ?        ?     1209.6        4.4       ?       ? 
1 1 1   34    1   22 o    409.2    2.7    0.0000   0.0000          ?        ?  1674.8422  22.3483          ?        ?      409.2        2.7       ?       ? 
1 1 1   34    1   23 o   1009.5    4.0    0.0000   0.0000          ?        ? 10192.0820  80.4537          ?        ?     1009.5        4.0       ?       ? 
1 1 1   34    1   24 o    731.7    3.0    0.0000   0.0000          ?        ?  5354.0039  43.4195          ?        ?      731.7        3.0       ?       ? 
1 1 1   34    1   25 o    167.0    4.2    0.0000   0.0000          ?        ?   279.0340  14.0475          ?        ?      167.0        4.2       ?       ? 
1 1 1   34    1   26 o    495.0    2.5    0.0000   0.0000          ?        ?  2450.6460  24.2638          ?        ?      495.0        2.5       ?       ? 
1 1 1   34    1   27 o    522.4    2.8    0.0000   0.0000          ?        ?  2729.0415  28.7335          ?        ?      522.4        2.8       ?       ? 
1 1 1   34    1   28 o    619.2    3.1    0.0000   0.0000          ?        ?  3834.3223  38.3113          ?        ?      619.2        3.1       ?       ? 
1 1 1   34    1   29 o    125.6    5.6    0.0000   0.0000          ?        ?   157.7148  14.0475          ?        ?      125.6        5.6       ?       ? 
1 1 1   34    1   30 o    509.3    2.6    0.0000   0.0000          ?        ?  2594.3132  26.1794          ?        ?      509.3        2.6       ?       ? 
1 1 1   34    1   31 o   1117.9    4.3    0.0000   0.0000          ?        ? 12499.6992  95.1397          ?        ?     1117.9        4.3       ?       ? 
1 1 1   34    1   32 o    468.5    2.9    0.0000   0.0000          ?        ?  2195.2373  26.8179          ?        ?      468.5        2.9       ?       ? 
1 1 1   34    1   33 o    400.8    2.9    0.0000   0.0000          ?        ?  1606.5205  22.9868          ?        ?      400.8        2.9       ?       ? 
1 1 1   34    1   34 o    317.1    2.9    0.0000   0.0000          ?        ?  1005.6716  18.5171          ?        ?      317.1        2.9       ?       ? 
1 1 1   34    1   35 o    511.7    2.8    0.0000   0.0000          ?        ?  2618.5771  28.7335          ?        ?      511.7        2.8       ?       ? 
1 1 1   34    1   36 o    522.8    2.6    0.0000   0.0000          ?        ?  2733.5112  27.4564          ?        ?      522.8        2.6       ?       ? 
1 1 1   34    1   37 o    469.3    2.6    0.0000   0.0000          ?        ?  2202.2610  24.2638          ?        ?      469.3        2.6       ?       ? 
1 1 1   34    1   38 o     18.6    9.4    0.0000   0.0000          ?        ?   -54.9129  16.6016          ?        ?       18.6        9.4       ?       ? 
1 1 1   34    1   39 o    506.9    2.6    0.0000   0.0000          ?        ?  2569.4109  26.8179          ?        ?      506.9        2.6       ?       ? 
1 1 1   34    1   40 o    701.9    2.9    0.0000   0.0000          ?        ?  4927.4717  40.8654          ?        ?      701.9        2.9       ?       ? 
1 1 1   34    1   41 o     18.8    9.4    0.0000   0.0000          ?        ?   -40.2269  14.6860          ?        ?       18.8        9.4       ?       ? 
1 1 1   34    1   42 o    146.4    5.2    0.0000   0.0000          ?        ?   214.5433  15.3245          ?        ?      146.4        5.2       ?       ? 
1 1 1   34    1   43 o    310.4    3.0    0.0000   0.0000          ?        ?   963.5291  18.5171          ?        ?      310.4        3.0       ?       ? 
1 1 1   34    1   44 o    782.6    3.2    0.0000   0.0000          ?        ?  6127.2534  49.8047          ?        ?      782.6        3.2       ?       ? 
1 1 1   34    1   45 o    162.5    5.1    0.0000   0.0000          ?        ?   264.3480  16.6016          ?        ?      162.5        5.1       ?       ? 
1 1 1   34    1   46 o    508.7    2.7    0.0000   0.0000          ?        ?  2588.5667  27.4564          ?        ?      508.7        2.7       ?       ? 
1 1 1   34    1   47 o    256.9    3.5    0.0000   0.0000          ?        ?   660.2314  17.8786          ?        ?      256.9        3.5       ?       ? 
1 1 1   34    1   48 o    282.1    3.3    0.0000   0.0000          ?        ?   796.2365  18.5171          ?        ?      282.1        3.3       ?       ? 
1 1 1   34    1   49 o    175.5    4.7    0.0000   0.0000          ?        ?   308.4059  16.6016          ?        ?      175.5        4.7       ?       ? 
1 1 1   34    1   50 o    288.0    3.3    0.0000   0.0000          ?        ?   830.0781  19.1556          ?        ?      288.0        3.3       ?       ? 
1 1 1   34    1   51 o    377.9    2.9    0.0000   0.0000          ?        ?  1429.0115  21.7097          ?        ?      377.9        2.9       ?       ? 
1 1 1   34    1   52 o     65.8   13.6    0.0000   0.0000          ?        ?    45.3350  17.2401          ?        ?       65.8       13.6       ?       ? 
1 1 1   34    1   53 o     78.0   11.0    0.0000   0.0000          ?        ?    61.2981  17.2401          ?        ?       78.0       11.0       ?       ? 
1 1 1   34    1   54 o    406.3    2.7    0.0000   0.0000          ?        ?  1651.8555  22.3483          ?        ?      406.3        2.7       ?       ? 
1 1 1   34    1   55 o    355.0    3.0    0.0000   0.0000          ?        ?  1261.0802  21.0712          ?        ?      355.0        3.0       ?       ? 
1 1 1   34    1   56 o     21.3   10.6    0.0000   0.0000          ?        ?   -53.6358  19.1556          ?        ?       21.3       10.6       ?       ? 
1 1 1   34    1   57 f     19.9   10.0    0.0000   0.0000          ?        ?   -68.9603  19.7942          ?        ?       19.9       10.0       ?       ? 
1 1 1   34    1   58 o     84.6   11.3    0.0000   0.0000          ?        ?    72.1529  19.1556          ?        ?       84.6       11.3       ?       ? 
1 1 1   34    1   59 o    417.5    2.8    0.0000   0.0000          ?        ?  1744.4412  23.6253          ?        ?      417.5        2.8       ?       ? 
1 1 1   34    1   60 o    258.6    4.1    0.0000   0.0000          ?        ?   669.8092  21.0712          ?        ?      258.6        4.1       ?       ? 
1 1 1   34    1   61 o     57.8   16.4    0.0000   0.0000          ?        ?    35.1187  19.7942          ?        ?       57.8       16.4       ?       ? 
1 1 1   34    1   62 o    106.2    9.3    0.0000   0.0000          ?        ?   113.6568  19.7942          ?        ?      106.2        9.3       ?       ? 
1 1 1   34    1   63 o     58.1   16.0    0.0000   0.0000          ?        ?    35.7572  19.1556          ?        ?       58.1       16.0       ?       ? 
1 1 1   34    1   64 o    223.8    4.7    0.0000   0.0000          ?        ?   501.8780  21.0712          ?        ?      223.8        4.7       ?       ? 
1 1 1   34    1   65 o     27.9   13.3    0.0000   0.0000          ?        ?   -25.5409  20.4327          ?        ?       27.9       13.3       ?       ? 
1 1 1   34    1   66 o     20.9   10.5    0.0000   0.0000          ?        ?   -69.5989  21.0712          ?        ?       20.9       10.5       ?       ? 
1 1 1   34    1   67 o    110.3    9.3    0.0000   0.0000          ?        ?   123.2347  20.4327          ?        ?      110.3        9.3       ?       ? 
1 1 1   34    1   68 o    122.0    8.9    0.0000   0.0000          ?        ?   150.6911  21.7097          ?        ?      122.0        8.9       ?       ? 
1 1 1   34    1   69 o    221.1    4.8    0.0000   0.0000          ?        ?   491.0231  21.0712          ?        ?      221.1        4.8       ?       ? 
1 1 1   34    1   70 o    135.7    7.8    0.0000   0.0000          ?        ?   186.4483  21.0712          ?        ?      135.7        7.8       ?       ? 
1 1 1   34    2    0 o   1114.7    5.9 12427.5469 130.8969 12427.5469 130.8969 12427.5469 130.8969     1114.7      5.9     1114.7        5.9     0.0     0.0 
1 1 1   34    2    1 o    989.6    3.9    0.0000   0.0000          ?        ?  9794.2832  76.6226          ?        ?      989.6        3.9       ?       ? 
1 1 1   34    2    2 f   1061.3    4.0    0.0000   0.0000          ?        ? 11265.4375  85.5619          ?        ?     1061.3        4.0       ?       ? 
1 1 1   34    2    3 f    629.9    2.7    0.0000   0.0000          ?        ?  3967.7734  34.4802          ?        ?      629.9        2.7       ?       ? 
1 1 1   34    2    4 o    385.5    2.3    0.0000   0.0000          ?        ?  1486.4784  17.8786          ?        ?      385.5        2.3       ?       ? 
1 1 1   34    2    5 o    155.1    3.9    0.0000   0.0000          ?        ?   240.7227  12.1319          ?        ?      155.1        3.9       ?       ? 
1 1 1   34    2    6 o   1315.4    4.7    0.0000   0.0000          ?        ? 17303.9355 123.2347          ?        ?     1315.4        4.7       ?       ? 
1 1 1   34    2    7 o    179.4    3.2    0.0000   0.0000          ?        ?   321.8149  11.4934          ?        ?      179.4        3.2       ?       ? 
1 1 1   34    2    8 o   1568.8    5.4    0.0000   0.0000          ?        ? 24614.3691 169.8468          ?        ?     1568.8        5.4       ?       ? 
1 1 1   34    2    9 o   1163.9    4.2    0.0000   0.0000          ?        ? 13547.5127  97.6938          ?        ?     1163.9        4.2       ?       ? 
1 1 1   34    2   10 o   1462.9    5.0    0.0000   0.0000          ?        ? 21403.2441 146.2215          ?        ?     1462.9        5.0       ?       ? 
1 1 1   34    2   11 f    900.1    3.4    0.0000   0.0000          ?        ?  8102.8394  61.9366          ?        ?      900.1        3.4       ?       ? 
1 1 1   34    2   12 o    440.6    2.4    0.0000   0.0000          ?        ?  1941.7443  21.0712          ?        ?      440.6        2.4       ?       ? 
1 1 1   34    2   13 o   1140.6    4.0    0.0000   0.0000          ?        ? 13011.1553  91.9471          ?        ?     1140.6        4.0       ?       ? 
1 1 1   34    2   14 o   1155.3    4.2    0.0000   0.0000          ?        ? 13348.9336  97.6938          ?        ?     1155.3        4.2       ?       ? 
1 1 1   34    2   15 o    628.9    2.7    0.0000   0.0000          ?        ?  3955.0032  33.8416          ?        ?      628.9        2.7       ?       ? 
1 1 1   34    2   16 o    446.5    2.5    0.0000   0.0000          ?        ?  1994.1029  22.3483          ?        ?      446.5        2.5       ?       ? 
1 1 1   34    2   17 o    789.4    3.2    0.0000   0.0000          ?        ?  6231.9712  50.4432          ?        ?      789.4        3.2       ?       ? 
1 1 1   34    2   18 o    861.9    3.3    0.0000   0.0000          ?        ?  7428.5605  56.1899          ?        ?      861.9        3.3       ?       ? 
1 1 1   34    2   19 o    928.2    3.4    0.0000   0.0000          ?        ?  8616.8496  63.8522          ?        ?      928.2        3.4       ?       ? 
1 1 1   34    2   20 o    764.1    3.1    0.0000   0.0000          ?        ?  5838.6421  47.8891          ?        ?      764.1        3.1       ?       ? 
1 1 1   34    2   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    2   22 o    531.8    2.5    0.0000   0.0000          ?        ?  2828.6509  26.1794          ?        ?      531.8        2.5       ?       ? 
1 1 1   34    2   23 o    285.9    2.9    0.0000   0.0000          ?        ?   817.3077  16.6016          ?        ?      285.9        2.9       ?       ? 
1 1 1   34    2   24 o    399.9    2.5    0.0000   0.0000          ?        ?  1599.4967  19.7942          ?        ?      399.9        2.5       ?       ? 
1 1 1   34    2   25 o    703.1    3.0    0.0000   0.0000          ?        ?  4944.0728  42.7809          ?        ?      703.1        3.0       ?       ? 
1 1 1   34    2   26 o    653.9    2.9    0.0000   0.0000          ?        ?  4276.8179  38.3113          ?        ?      653.9        2.9       ?       ? 
1 1 1   34    2   27 o   1012.0    4.1    0.0000   0.0000          ?        ? 10242.5254  82.3693          ?        ?     1012.0        4.1       ?       ? 
1 1 1   34    2   28 o     34.0   13.4    0.0000   0.0000          ?        ?     6.3852  13.4090          ?        ?       34.0       13.4       ?       ? 
1 1 1   34    2   29 o    759.6    3.0    0.0000   0.0000          ?        ?  5770.3198  45.3350          ?        ?      759.6        3.0       ?       ? 
1 1 1   34    2   30 o    644.1    2.9    0.0000   0.0000          ?        ?  4149.7524  37.6728          ?        ?      644.1        2.9       ?       ? 
1 1 1   34    2   31 o    183.6    4.2    0.0000   0.0000          ?        ?   337.1394  15.3245          ?        ?      183.6        4.2       ?       ? 
1 1 1   34    2   32 o    306.5    2.8    0.0000   0.0000          ?        ?   939.2654  17.2401          ?        ?      306.5        2.8       ?       ? 
1 1 1   34    2   33 o    773.9    3.0    0.0000   0.0000          ?        ?  5990.6099  46.6121          ?        ?      773.9        3.0       ?       ? 
1 1 1   34    2   34 o    153.7    4.8    0.0000   0.0000          ?        ?   236.2530  14.6860          ?        ?      153.7        4.8       ?       ? 
1 1 1   34    2   35 o    457.5    2.7    0.0000   0.0000          ?        ?  2093.0737  24.2638          ?        ?      457.5        2.7       ?       ? 
1 1 1   34    2   36 o    166.8    4.6    0.0000   0.0000          ?        ?   278.3954  15.3245          ?        ?      166.8        4.6       ?       ? 
1 1 1   34    2   37 o    375.6    2.6    0.0000   0.0000          ?        ?  1411.1328  19.7942          ?        ?      375.6        2.6       ?       ? 
1 1 1   34    2   38 o    485.8    2.6    0.0000   0.0000          ?        ?  2359.9761  24.9023          ?        ?      485.8        2.6       ?       ? 
1 1 1   34    2   39 f    510.0    2.6    0.0000   0.0000          ?        ?  2601.3372  26.1794          ?        ?      510.0        2.6       ?       ? 
1 1 1   34    2   40 o    178.3    4.3    0.0000   0.0000          ?        ?   317.9838  15.3245          ?        ?      178.3        4.3       ?       ? 
1 1 1   34    2   41 o     26.5   12.1    0.0000   0.0000          ?        ?   -10.8549  14.6860          ?        ?       26.5       12.1       ?       ? 
1 1 1   34    2   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    2   43 o    342.2    2.8    0.0000   0.0000          ?        ?  1171.0486  19.1556          ?        ?      342.2        2.8       ?       ? 
1 1 1   34    2   44 o    357.6    2.8    0.0000   0.0000          ?        ?  1278.9589  19.7942          ?        ?      357.6        2.8       ?       ? 
1 1 1   34    2   45 o    583.1    2.7    0.0000   0.0000          ?        ?  3401.4048  31.2876          ?        ?      583.1        2.7       ?       ? 
1 1 1   34    2   46 o     24.2   11.6    0.0000   0.0000          ?        ?   -22.3483  15.9630          ?        ?       24.2       11.6       ?       ? 
1 1 1   34    2   47 o    491.0    2.5    0.0000   0.0000          ?        ?  2411.0576  24.9023          ?        ?      491.0        2.5       ?       ? 
1 1 1   34    2   48 o    101.9    8.1    0.0000   0.0000          ?        ?   104.0790  16.6016          ?        ?      101.9        8.1       ?       ? 
1 1 1   34    2   49 o    188.2    4.6    0.0000   0.0000          ?        ?   354.3795  17.2401          ?        ?      188.2        4.6       ?       ? 
1 1 1   34    2   50 o    233.2    3.8    0.0000   0.0000          ?        ?   544.0204  17.8786          ?        ?      233.2        3.8       ?       ? 
1 1 1   34    2   51 o    183.2    4.7    0.0000   0.0000          ?        ?   335.8624  17.2401          ?        ?      183.2        4.7       ?       ? 
1 1 1   34    2   52 o    452.7    2.8    0.0000   0.0000          ?        ?  2050.2930  25.5409          ?        ?      452.7        2.8       ?       ? 
1 1 1   34    2   53 o    189.5    4.9    0.0000   0.0000          ?        ?   359.4877  18.5171          ?        ?      189.5        4.9       ?       ? 
1 1 1   34    2   54 o    298.6    3.4    0.0000   0.0000          ?        ?   892.0147  20.4327          ?        ?      298.6        3.4       ?       ? 
1 1 1   34    2   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    2   56 o    395.5    2.8    0.0000   0.0000          ?        ?  1565.0166  22.3483          ?        ?      395.5        2.8       ?       ? 
1 1 1   34    2   57 o     47.2   16.7    0.0000   0.0000          ?        ?    19.7942  19.7942          ?        ?       47.2       16.7       ?       ? 
1 1 1   34    2   58 o    238.9    3.9    0.0000   0.0000          ?        ?   571.4769  18.5171          ?        ?      238.9        3.9       ?       ? 
1 1 1   34    2   59 o     31.2   14.2    0.0000   0.0000          ?        ?   -12.7704  19.7942          ?        ?       31.2       14.2       ?       ? 
1 1 1   34    2   60 o     89.6   11.0    0.0000   0.0000          ?        ?    81.0922  19.7942          ?        ?       89.6       11.0       ?       ? 
1 1 1   34    2   61 o    274.3    3.7    0.0000   0.0000          ?        ?   753.4555  20.4327          ?        ?      274.3        3.7       ?       ? 
1 1 1   34    2   62 o    189.5    5.2    0.0000   0.0000          ?        ?   360.1262  19.7942          ?        ?      189.5        5.2       ?       ? 
1 1 1   34    2   63 o     61.9   15.9    0.0000   0.0000          ?        ?    40.8654  19.7942          ?        ?       61.9       15.9       ?       ? 
1 1 1   34    2   64 o    234.4    4.4    0.0000   0.0000          ?        ?   550.4056  20.4327          ?        ?      234.4        4.4       ?       ? 
1 1 1   34    2   65 o     21.7   10.9    0.0000   0.0000          ?        ?   -58.7440  20.4327          ?        ?       21.7       10.9       ?       ? 
1 1 1   34    2   66 o    155.6    6.4    0.0000   0.0000          ?        ?   243.2767  19.7942          ?        ?      155.6        6.4       ?       ? 
1 1 1   34    2   67 o    221.9    4.7    0.0000   0.0000          ?        ?   494.2158  21.0712          ?        ?      221.9        4.7       ?       ? 
1 1 1   34    2   68 o    194.4    5.4    0.0000   0.0000          ?        ?   379.9204  21.0712          ?        ?      194.4        5.4       ?       ? 
1 1 1   34    2   69 o    259.1    4.2    0.0000   0.0000          ?        ?   673.6403  21.7097          ?        ?      259.1        4.2       ?       ? 
1 1 1   34    2   70 o    129.9    8.1    0.0000   0.0000          ?        ?   171.1238  21.0712          ?        ?      129.9        8.1       ?       ? 
1 1 1   34    3    0 o    200.1    4.6  400.9916  18.5171   400.9916  18.5171   400.9916  18.5171      200.1      4.6      200.1        4.6     0.0     0.0 
1 1 1   34    3    1 o   1464.1    5.1    0.0000   0.0000          ?        ? 21437.7246 150.0526          ?        ?     1464.1        5.1       ?       ? 
1 1 1   34    3    2 o    522.4    2.8    0.0000   0.0000          ?        ?  2729.0415  28.7335          ?        ?      522.4        2.8       ?       ? 
1 1 1   34    3    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    3    4 o    642.0    2.9    0.0000   0.0000          ?        ?  4121.6572  37.0343          ?        ?      642.0        2.9       ?       ? 
1 1 1   34    3    5 o     21.5   10.0    0.0000   0.0000          ?        ?    -8.9393  10.2163          ?        ?       21.5       10.0       ?       ? 
1 1 1   34    3    6 o    606.0    2.7    0.0000   0.0000          ?        ?  3672.1377  32.5646          ?        ?      606.0        2.7       ?       ? 
1 1 1   34    3    7 o   1160.1    4.2    0.0000   0.0000          ?        ? 13459.3965  98.3323          ?        ?     1160.1        4.2       ?       ? 
1 1 1   34    3    8 o   1416.6    5.0    0.0000   0.0000          ?        ? 20069.3730 141.1133          ?        ?     1416.6        5.0       ?       ? 
1 1 1   34    3    9 o    940.4    3.7    0.0000   0.0000          ?        ?  8843.5244  68.9603          ?        ?      940.4        3.7       ?       ? 
1 1 1   34    3   10 o    515.9    2.5    0.0000   0.0000          ?        ?  2661.3582  26.1794          ?        ?      515.9        2.5       ?       ? 
1 1 1   34    3   11 o   1079.5    4.1    0.0000   0.0000          ?        ? 11653.6582  87.4775          ?        ?     1079.5        4.1       ?       ? 
1 1 1   34    3   12 o   1127.3    4.1    0.0000   0.0000          ?        ? 12709.1348  91.9471          ?        ?     1127.3        4.1       ?       ? 
1 1 1   34    3   13 o    999.4    3.7    0.0000   0.0000          ?        ?  9989.0322  74.7070          ?        ?      999.4        3.7       ?       ? 
1 1 1   34    3   14 o    676.5    2.9    0.0000   0.0000          ?        ?  4576.2847  38.9498          ?        ?      676.5        2.9       ?       ? 
1 1 1   34    3   15 o    985.7    3.9    0.0000   0.0000          ?        ?  9717.0225  75.9841          ?        ?      985.7        3.9       ?       ? 
1 1 1   34    3   16 f   1426.7    4.7    0.0000   0.0000          ?        ? 20357.3457 135.3666          ?        ?     1426.7        4.7       ?       ? 
1 1 1   34    3   17 o    496.8    2.5    0.0000   0.0000          ?        ?  2467.8860  24.9023          ?        ?      496.8        2.5       ?       ? 
1 1 1   34    3   18 o    166.5    3.6    0.0000   0.0000          ?        ?   277.1184  12.1319          ?        ?      166.5        3.6       ?       ? 
1 1 1   34    3   19 o    954.0    3.6    0.0000   0.0000          ?        ?  9102.7637  68.3218          ?        ?      954.0        3.6       ?       ? 
1 1 1   34    3   20 o    809.1    3.2    0.0000   0.0000          ?        ?  6547.4009  51.0817          ?        ?      809.1        3.2       ?       ? 
1 1 1   34    3   21 o    165.3    3.9    0.0000   0.0000          ?        ?   273.2873  12.7704          ?        ?      165.3        3.9       ?       ? 
1 1 1   34    3   22 o    821.1    3.2    0.0000   0.0000          ?        ?  6742.1499  52.9973          ?        ?      821.1        3.2       ?       ? 
1 1 1   34    3   23 o    164.5    3.9    0.0000   0.0000          ?        ?   270.7332  12.7704          ?        ?      164.5        3.9       ?       ? 
1 1 1   34    3   24 o    107.2    6.3    0.0000   0.0000          ?        ?   114.9339  13.4090          ?        ?      107.2        6.3       ?       ? 
1 1 1   34    3   25 o    204.5    3.4    0.0000   0.0000          ?        ?   418.2317  14.0475          ?        ?      204.5        3.4       ?       ? 
1 1 1   34    3   26 o    448.3    2.6    0.0000   0.0000          ?        ?  2010.0660  23.6253          ?        ?      448.3        2.6       ?       ? 
1 1 1   34    3   27 o    692.4    2.7    0.0000   0.0000          ?        ?  4794.0205  37.6728          ?        ?      692.4        2.7       ?       ? 
1 1 1   34    3   28 o    225.0    3.5    0.0000   0.0000          ?        ?   506.3477  15.9630          ?        ?      225.0        3.5       ?       ? 
1 1 1   34    3   29 o    342.1    2.7    0.0000   0.0000          ?        ?  1170.4102  18.5171          ?        ?      342.1        2.7       ?       ? 
1 1 1   34    3   30 f    653.4    2.8    0.0000   0.0000          ?        ?  4269.7944  36.3957          ?        ?      653.4        2.8       ?       ? 
1 1 1   34    3   31 o    280.3    3.0    0.0000   0.0000          ?        ?   786.0201  16.6016          ?        ?      280.3        3.0       ?       ? 
1 1 1   34    3   32 o    602.4    2.6    0.0000   0.0000          ?        ?  3629.3572  31.9261          ?        ?      602.4        2.6       ?       ? 
1 1 1   34    3   33 o    348.0    2.8    0.0000   0.0000          ?        ?  1211.2755  19.1556          ?        ?      348.0        2.8       ?       ? 
1 1 1   34    3   34 o    386.8    2.5    0.0000   0.0000          ?        ?  1496.6947  19.1556          ?        ?      386.8        2.5       ?       ? 
1 1 1   34    3   35 o    145.6    5.3    0.0000   0.0000          ?        ?   211.9892  15.3245          ?        ?      145.6        5.3       ?       ? 
1 1 1   34    3   36 o     28.0   12.9    0.0000   0.0000          ?        ?   -12.7704  16.6016          ?        ?       28.0       12.9       ?       ? 
1 1 1   34    3   37 f    408.3    2.5    0.0000   0.0000          ?        ?  1667.1801  20.4327          ?        ?      408.3        2.5       ?       ? 
1 1 1   34    3   38 o    155.3    4.9    0.0000   0.0000          ?        ?   241.3612  15.3245          ?        ?      155.3        4.9       ?       ? 
1 1 1   34    3   39 f    422.0    2.6    0.0000   0.0000          ?        ?  1781.4753  22.3483          ?        ?      422.0        2.6       ?       ? 
1 1 1   34    3   40 o    485.6    2.5    0.0000   0.0000          ?        ?  2358.6987  24.2638          ?        ?      485.6        2.5       ?       ? 
1 1 1   34    3   41 o    157.3    4.9    0.0000   0.0000          ?        ?   247.7464  15.3245          ?        ?      157.3        4.9       ?       ? 
1 1 1   34    3   42 o    217.9    3.8    0.0000   0.0000          ?        ?   475.0601  16.6016          ?        ?      217.9        3.8       ?       ? 
1 1 1   34    3   43 o    328.6    2.7    0.0000   0.0000          ?        ?  1079.7401  17.8786          ?        ?      328.6        2.7       ?       ? 
1 1 1   34    3   44 o    474.4    2.6    0.0000   0.0000          ?        ?  2251.4272  24.2638          ?        ?      474.4        2.6       ?       ? 
1 1 1   34    3   45 o    193.9    4.3    0.0000   0.0000          ?        ?   376.0892  16.6016          ?        ?      193.9        4.3       ?       ? 
1 1 1   34    3   46 o    485.1    2.5    0.0000   0.0000          ?        ?  2354.2292  24.2638          ?        ?      485.1        2.5       ?       ? 
1 1 1   34    3   47 o    108.0    7.7    0.0000   0.0000          ?        ?   116.8494  16.6016          ?        ?      108.0        7.7       ?       ? 
1 1 1   34    3   48 o     94.1    8.8    0.0000   0.0000          ?        ?    88.7545  16.6016          ?        ?       94.1        8.8       ?       ? 
1 1 1   34    3   49 o    269.0    3.3    0.0000   0.0000          ?        ?   724.0836  17.8786          ?        ?      269.0        3.3       ?       ? 
1 1 1   34    3   50 o    270.8    3.4    0.0000   0.0000          ?        ?   733.6614  18.5171          ?        ?      270.8        3.4       ?       ? 
1 1 1   34    3   51 o    115.4    7.2    0.0000   0.0000          ?        ?   133.4510  16.6016          ?        ?      115.4        7.2       ?       ? 
1 1 1   34    3   52 f     92.6   10.0    0.0000   0.0000          ?        ?    86.2004  18.5171          ?        ?       92.6       10.0       ?       ? 
1 1 1   34    3   53 o    446.0    2.7    0.0000   0.0000          ?        ?  1989.6334  24.2638          ?        ?      446.0        2.7       ?       ? 
1 1 1   34    3   54 o    252.2    3.8    0.0000   0.0000          ?        ?   636.6060  19.1556          ?        ?      252.2        3.8       ?       ? 
1 1 1   34    3   55 o    298.6    3.4    0.0000   0.0000          ?        ?   892.0147  20.4327          ?        ?      298.6        3.4       ?       ? 
1 1 1   34    3   56 o    256.3    3.9    0.0000   0.0000          ?        ?   657.6772  19.7942          ?        ?      256.3        3.9       ?       ? 
1 1 1   34    3   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    3   58 o     20.0   10.1    0.0000   0.0000          ?        ?   -67.6833  19.7942          ?        ?       20.0       10.1       ?       ? 
1 1 1   34    3   59 o    334.4    3.2    0.0000   0.0000          ?        ?  1119.3285  21.0712          ?        ?      334.4        3.2       ?       ? 
1 1 1   34    3   60 o     29.7   13.7    0.0000   0.0000          ?        ?   -15.3245  19.1556          ?        ?       29.7       13.7       ?       ? 
1 1 1   34    3   61 o    223.5    4.4    0.0000   0.0000          ?        ?   500.6010  19.7942          ?        ?      223.5        4.4       ?       ? 
1 1 1   34    3   62 o     26.1   12.5    0.0000   0.0000          ?        ?   -28.0950  19.1556          ?        ?       26.1       12.5       ?       ? 
1 1 1   34    3   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    3   64 o    246.0    4.3    0.0000   0.0000          ?        ?   606.5955  21.0712          ?        ?      246.0        4.3       ?       ? 
1 1 1   34    3   65 o    269.5    4.0    0.0000   0.0000          ?        ?   727.9147  21.7097          ?        ?      269.5        4.0       ?       ? 
1 1 1   34    3   66 o    291.2    3.7    0.0000   0.0000          ?        ?   849.8723  21.7097          ?        ?      291.2        3.7       ?       ? 
1 1 1   34    3   67 o     26.6   12.8    0.0000   0.0000          ?        ?   -30.6490  20.4327          ?        ?       26.6       12.8       ?       ? 
1 1 1   34    3   68 o    162.8    6.3    0.0000   0.0000          ?        ?   266.9020  20.4327          ?        ?      162.8        6.3       ?       ? 
1 1 1   34    3   69 o    175.4    5.6    0.0000   0.0000          ?        ?   309.6830  19.7942          ?        ?      175.4        5.6       ?       ? 
1 1 1   34    4    0 o   1241.0    6.1 15404.3340 152.6067 15404.3340 152.6067 15404.3340 152.6067     1241.0      6.1     1241.0        6.1     0.0     0.0 
1 1 1   34    4    1 o   1052.7    3.9    0.0000   0.0000          ?        ? 11082.8193  81.7308          ?        ?     1052.7        3.9       ?       ? 
1 1 1   34    4    2 o    686.1    3.0    0.0000   0.0000          ?        ?  4707.1816  40.8654          ?        ?      686.1        3.0       ?       ? 
1 1 1   34    4    3 o    694.2    2.9    0.0000   0.0000          ?        ?  4819.5610  40.2269          ?        ?      694.2        2.9       ?       ? 
1 1 1   34    4    4 o   1124.5    4.2    0.0000   0.0000          ?        ? 12647.1973  93.8627          ?        ?     1124.5        4.2       ?       ? 
1 1 1   34    4    5 f   1491.7    5.3    0.0000   0.0000          ?        ? 22254.3945 158.9919          ?        ?     1491.7        5.3       ?       ? 
1 1 1   34    4    6 o    775.3    3.3    0.0000   0.0000          ?        ?  6011.6812  51.7203          ?        ?      775.3        3.3       ?       ? 
1 1 1   34    4    7 o   1491.6    5.2    0.0000   0.0000          ?        ? 22252.4785 155.7993          ?        ?     1491.6        5.2       ?       ? 
1 1 1   34    4    8 o   1648.2    5.8    0.0000   0.0000          ?        ? 27171.0098 190.2794          ?        ?     1648.2        5.8       ?       ? 
1 1 1   34    4    9 o    566.1    2.8    0.0000   0.0000          ?        ?  3205.3787  31.9261          ?        ?      566.1        2.8       ?       ? 
1 1 1   34    4   10 o   1705.5    6.0    0.0000   0.0000          ?        ? 29092.3242 203.0499          ?        ?     1705.5        6.0       ?       ? 
1 1 1   34    4   11 o    463.7    2.8    0.0000   0.0000          ?        ?  2150.5408  25.5409          ?        ?      463.7        2.8       ?       ? 
1 1 1   34    4   12 o    261.7    2.7    0.0000   0.0000          ?        ?   685.1337  14.0475          ?        ?      261.7        2.7       ?       ? 
1 1 1   34    4   13 f   1215.8    4.3    0.0000   0.0000          ?        ? 14784.3291 105.3561          ?        ?     1215.8        4.3       ?       ? 
1 1 1   34    4   14 o    344.9    2.6    0.0000   0.0000          ?        ?  1189.5658  17.8786          ?        ?      344.9        2.6       ?       ? 
1 1 1   34    4   15 o    195.4    3.3    0.0000   0.0000          ?        ?   381.8359  12.7704          ?        ?      195.4        3.3       ?       ? 
1 1 1   34    4   16 o    798.2    3.2    0.0000   0.0000          ?        ?  6371.1689  51.7203          ?        ?      798.2        3.2       ?       ? 
1 1 1   34    4   17 o    792.2    3.2    0.0000   0.0000          ?        ?  6276.6675  51.0817          ?        ?      792.2        3.2       ?       ? 
1 1 1   34    4   18 o    719.5    2.9    0.0000   0.0000          ?        ?  5177.1333  42.1424          ?        ?      719.5        2.9       ?       ? 
1 1 1   34    4   19 o    642.2    2.9    0.0000   0.0000          ?        ?  4124.2114  37.0343          ?        ?      642.2        2.9       ?       ? 
1 1 1   34    4   20 o    374.4    2.5    0.0000   0.0000          ?        ?  1401.5549  18.5171          ?        ?      374.4        2.5       ?       ? 
1 1 1   34    4   21 o    827.0    3.4    0.0000   0.0000          ?        ?  6839.2051  56.8284          ?        ?      827.0        3.4       ?       ? 
1 1 1   34    4   22 o    547.8    2.6    0.0000   0.0000          ?        ?  3001.0518  28.7335          ?        ?      547.8        2.6       ?       ? 
1 1 1   34    4   23 o    752.4    3.0    0.0000   0.0000          ?        ?  5661.7715  45.3350          ?        ?      752.4        3.0       ?       ? 
1 1 1   34    4   24 o    124.5    5.1    0.0000   0.0000          ?        ?   155.1608  12.7704          ?        ?      124.5        5.1       ?       ? 
1 1 1   34    4   25 o    157.6    4.7    0.0000   0.0000          ?        ?   248.3849  14.6860          ?        ?      157.6        4.7       ?       ? 
1 1 1   34    4   26 o    583.4    2.8    0.0000   0.0000          ?        ?  3403.9587  32.5646          ?        ?      583.4        2.8       ?       ? 
1 1 1   34    4   27 o    356.4    2.7    0.0000   0.0000          ?        ?  1270.6581  19.1556          ?        ?      356.4        2.7       ?       ? 
1 1 1   34    4   28 o    410.7    2.6    0.0000   0.0000          ?        ?  1686.9742  21.7097          ?        ?      410.7        2.6       ?       ? 
1 1 1   34    4   29 o    476.1    2.6    0.0000   0.0000          ?        ?  2266.7517  24.9023          ?        ?      476.1        2.6       ?       ? 
1 1 1   34    4   30 o    221.6    3.6    0.0000   0.0000          ?        ?   491.0231  15.9630          ?        ?      221.6        3.6       ?       ? 
1 1 1   34    4   31 o    263.6    2.9    0.0000   0.0000          ?        ?   694.7115  15.3245          ?        ?      263.6        2.9       ?       ? 
1 1 1   34    4   32 o    349.9    2.6    0.0000   0.0000          ?        ?  1224.6844  18.5171          ?        ?      349.9        2.6       ?       ? 
1 1 1   34    4   33 o    618.8    2.7    0.0000   0.0000          ?        ?  3829.2144  33.8416          ?        ?      618.8        2.7       ?       ? 
1 1 1   34    4   34 o    584.2    2.6    0.0000   0.0000          ?        ?  3412.8982  30.0105          ?        ?      584.2        2.6       ?       ? 
1 1 1   34    4   35 o    233.8    3.8    0.0000   0.0000          ?        ?   546.5745  17.8786          ?        ?      233.8        3.8       ?       ? 
1 1 1   34    4   36 o    470.7    2.5    0.0000   0.0000          ?        ?  2215.6699  23.6253          ?        ?      470.7        2.5       ?       ? 
1 1 1   34    4   37 o    349.7    2.6    0.0000   0.0000          ?        ?  1223.4075  17.8786          ?        ?      349.7        2.6       ?       ? 
1 1 1   34    4   38 o    270.6    3.2    0.0000   0.0000          ?        ?   732.3843  17.2401          ?        ?      270.6        3.2       ?       ? 
1 1 1   34    4   39 o    582.1    2.6    0.0000   0.0000          ?        ?  3388.6343  30.6490          ?        ?      582.1        2.6       ?       ? 
1 1 1   34    4   40 o    269.3    3.3    0.0000   0.0000          ?        ?   725.3605  17.8786          ?        ?      269.3        3.3       ?       ? 
1 1 1   34    4   41 o    159.2    5.0    0.0000   0.0000          ?        ?   253.4931  15.9630          ?        ?      159.2        5.0       ?       ? 
1 1 1   34    4   42 o    392.6    2.7    0.0000   0.0000          ?        ?  1542.0298  21.0712          ?        ?      392.6        2.7       ?       ? 
1 1 1   34    4   43 o     62.5   13.7    0.0000   0.0000          ?        ?    40.8654  16.6016          ?        ?       62.5       13.7       ?       ? 
1 1 1   34    4   44 o    114.0    7.0    0.0000   0.0000          ?        ?   130.2584  15.9630          ?        ?      114.0        7.0       ?       ? 
1 1 1   34    4   45 o    367.4    2.6    0.0000   0.0000          ?        ?  1350.4733  19.1556          ?        ?      367.4        2.6       ?       ? 
1 1 1   34    4   46 o     89.6    8.9    0.0000   0.0000          ?        ?    80.4537  15.9630          ?        ?       89.6        8.9       ?       ? 
1 1 1   34    4   47 o    498.2    2.6    0.0000   0.0000          ?        ?  2482.5720  25.5409          ?        ?      498.2        2.6       ?       ? 
1 1 1   34    4   48 o     67.3   13.3    0.0000   0.0000          ?        ?    47.2506  17.2401          ?        ?       67.3       13.3       ?       ? 
1 1 1   34    4   49 o    311.7    3.1    0.0000   0.0000          ?        ?   971.8299  19.1556          ?        ?      311.7        3.1       ?       ? 
1 1 1   34    4   50 o    112.8    7.6    0.0000   0.0000          ?        ?   127.7043  17.2401          ?        ?      112.8        7.6       ?       ? 
1 1 1   34    4   51 o    244.8    3.7    0.0000   0.0000          ?        ?   599.5718  17.8786          ?        ?      244.8        3.7       ?       ? 
1 1 1   34    4   52 o    284.0    3.4    0.0000   0.0000          ?        ?   807.0914  19.1556          ?        ?      284.0        3.4       ?       ? 
1 1 1   34    4   53 o    186.2    4.8    0.0000   0.0000          ?        ?   347.3558  17.8786          ?        ?      186.2        4.8       ?       ? 
1 1 1   34    4   54 o    119.9    7.5    0.0000   0.0000          ?        ?   144.3059  17.8786          ?        ?      119.9        7.5       ?       ? 
1 1 1   34    4   55 o    446.2    2.6    0.0000   0.0000          ?        ?  1992.1875  23.6253          ?        ?      446.2        2.6       ?       ? 
1 1 1   34    4   56 o    267.5    3.7    0.0000   0.0000          ?        ?   716.4213  19.7942          ?        ?      267.5        3.7       ?       ? 
1 1 1   34    4   57 o    183.1    5.2    0.0000   0.0000          ?        ?   335.8624  19.1556          ?        ?      183.1        5.2       ?       ? 
1 1 1   34    4   58 o     71.7   12.9    0.0000   0.0000          ?        ?    53.6358  17.8786          ?        ?       71.7       12.9       ?       ? 
1 1 1   34    4   59 o     32.8   14.5    0.0000   0.0000          ?        ?    -5.1082  18.5171          ?        ?       32.8       14.5       ?       ? 
1 1 1   34    4   60 o     94.1    9.8    0.0000   0.0000          ?        ?    89.3930  18.5171          ?        ?       94.1        9.8       ?       ? 
1 1 1   34    4   61 o    292.4    3.6    0.0000   0.0000          ?        ?   856.2576  21.0712          ?        ?      292.4        3.6       ?       ? 
1 1 1   34    4   62 f    268.2    3.8    0.0000   0.0000          ?        ?   720.2524  20.4327          ?        ?      268.2        3.8       ?       ? 
1 1 1   34    4   63 o    205.9    5.1    0.0000   0.0000          ?        ?   425.2554  21.0712          ?        ?      205.9        5.1       ?       ? 
1 1 1   34    4   64 o     46.0   16.7    0.0000   0.0000          ?        ?    18.5171  19.7942          ?        ?       46.0       16.7       ?       ? 
1 1 1   34    4   65 o     82.6   12.0    0.0000   0.0000          ?        ?    69.5989  19.7942          ?        ?       82.6       12.0       ?       ? 
1 1 1   34    4   66 o     45.1   16.6    0.0000   0.0000          ?        ?    17.2401  19.7942          ?        ?       45.1       16.6       ?       ? 
1 1 1   34    4   67 o    197.2    5.2    0.0000   0.0000          ?        ?   390.7752  20.4327          ?        ?      197.2        5.2       ?       ? 
1 1 1   34    4   68 f    163.3    6.5    0.0000   0.0000          ?        ?   268.8176  21.0712          ?        ?      163.3        6.5       ?       ? 
1 1 1   34    4   69 o    111.9    8.6    0.0000   0.0000          ?        ?   127.0658  19.1556          ?        ?      111.9        8.6       ?       ? 
1 1 1   34    5    0 f    930.9    5.2 8667.2930  96.4168  8667.2930  96.4168  8667.2930  96.4168      930.9      5.2      930.9        5.2     0.0     0.0 
1 1 1   34    5    1 o   1176.1    4.2    0.0000   0.0000          ?        ? 13833.5713  99.6094          ?        ?     1176.1        4.2       ?       ? 
1 1 1   34    5    2 o    677.9    2.9    0.0000   0.0000          ?        ?  4596.0786  38.9498          ?        ?      677.9        2.9       ?       ? 
1 1 1   34    5    3 o    328.5    2.6    0.0000   0.0000          ?        ?  1079.1016  17.2401          ?        ?      328.5        2.6       ?       ? 
1 1 1   34    5    4 o    509.3    2.5    0.0000   0.0000          ?        ?  2593.6748  25.5409          ?        ?      509.3        2.5       ?       ? 
1 1 1   34    5    5 o   1064.2    4.0    0.0000   0.0000          ?        ? 11326.7354  86.2004          ?        ?     1064.2        4.0       ?       ? 
1 1 1   34    5    6 o   1070.3    3.9    0.0000   0.0000          ?        ? 11456.3545  84.2849          ?        ?     1070.3        3.9       ?       ? 
1 1 1   34    5    7 o    703.4    3.2    0.0000   0.0000          ?        ?  4947.9043  45.3350          ?        ?      703.4        3.2       ?       ? 
1 1 1   34    5    8 o    536.3    2.9    0.0000   0.0000          ?        ?  2876.5400  31.2876          ?        ?      536.3        2.9       ?       ? 
1 1 1   34    5    9 o    625.8    2.8    0.0000   0.0000          ?        ?  3916.6919  35.1187          ?        ?      625.8        2.8       ?       ? 
1 1 1   34    5   10 o    183.4    3.7    0.0000   0.0000          ?        ?   336.5009  13.4090          ?        ?      183.4        3.7       ?       ? 
1 1 1   34    5   11 o    426.9    2.6    0.0000   0.0000          ?        ?  1822.3407  22.3483          ?        ?      426.9        2.6       ?       ? 
1 1 1   34    5   12 o    340.8    2.6    0.0000   0.0000          ?        ?  1161.4708  17.8786          ?        ?      340.8        2.6       ?       ? 
1 1 1   34    5   13 o    936.5    3.6    0.0000   0.0000          ?        ?  8770.7324  67.6833          ?        ?      936.5        3.6       ?       ? 
1 1 1   34    5   14 o    843.2    3.4    0.0000   0.0000          ?        ?  7109.9385  56.8284          ?        ?      843.2        3.4       ?       ? 
1 1 1   34    5   15 o    895.0    3.5    0.0000   0.0000          ?        ?  8010.2539  63.2136          ?        ?      895.0        3.5       ?       ? 
1 1 1   34    5   16 o    267.9    3.0    0.0000   0.0000          ?        ?   717.6983  15.9630          ?        ?      267.9        3.0       ?       ? 
1 1 1   34    5   17 o    341.5    2.6    0.0000   0.0000          ?        ?  1166.5790  17.8786          ?        ?      341.5        2.6       ?       ? 
1 1 1   34    5   18 o    335.0    2.6    0.0000   0.0000          ?        ?  1122.5210  17.2401          ?        ?      335.0        2.6       ?       ? 
1 1 1   34    5   19 o    939.6    3.6    0.0000   0.0000          ?        ?  8829.4775  67.6833          ?        ?      939.6        3.6       ?       ? 
1 1 1   34    5   20 o    221.4    3.2    0.0000   0.0000          ?        ?   490.3846  14.0475          ?        ?      221.4        3.2       ?       ? 
1 1 1   34    5   21 o    518.2    2.5    0.0000   0.0000          ?        ?  2685.6221  26.1794          ?        ?      518.2        2.5       ?       ? 
1 1 1   34    5   22 o   1291.6    4.8    0.0000   0.0000          ?        ? 16685.2090 123.2347          ?        ?     1291.6        4.8       ?       ? 
1 1 1   34    5   23 o   1081.6    4.0    0.0000   0.0000          ?        ? 11700.9092  87.4775          ?        ?     1081.6        4.0       ?       ? 
1 1 1   34    5   24 o    550.3    3.0    0.0000   0.0000          ?        ?  3028.5081  32.5646          ?        ?      550.3        3.0       ?       ? 
1 1 1   34    5   25 o    800.1    3.2    0.0000   0.0000          ?        ?  6401.8179  51.7203          ?        ?      800.1        3.2       ?       ? 
1 1 1   34    5   26 o    679.0    2.9    0.0000   0.0000          ?        ?  4611.4033  39.5883          ?        ?      679.0        2.9       ?       ? 
1 1 1   34    5   27 o    525.0    2.6    0.0000   0.0000          ?        ?  2756.4980  27.4564          ?        ?      525.0        2.6       ?       ? 
1 1 1   34    5   28 o    891.9    3.4    0.0000   0.0000          ?        ?  7956.6177  60.6596          ?        ?      891.9        3.4       ?       ? 
1 1 1   34    5   29 o     79.1    9.3    0.0000   0.0000          ?        ?    62.5751  14.6860          ?        ?       79.1        9.3       ?       ? 
1 1 1   34    5   30 f    352.8    2.4    0.0000   0.0000          ?        ?  1245.1172  17.2401          ?        ?      352.8        2.4       ?       ? 
1 1 1   34    5   31 o    501.7    2.5    0.0000   0.0000          ?        ?  2517.0522  25.5409          ?        ?      501.7        2.5       ?       ? 
1 1 1   34    5   32 o    376.8    2.5    0.0000   0.0000          ?        ?  1420.0720  18.5171          ?        ?      376.8        2.5       ?       ? 
1 1 1   34    5   33 o    343.7    2.7    0.0000   0.0000          ?        ?  1181.2650  18.5171          ?        ?      343.7        2.7       ?       ? 
1 1 1   34    5   34 o    429.9    2.5    0.0000   0.0000          ?        ?  1848.5201  21.7097          ?        ?      429.9        2.5       ?       ? 
1 1 1   34    5   35 o    356.5    2.7    0.0000   0.0000          ?        ?  1271.2966  19.1556          ?        ?      356.5        2.7       ?       ? 
1 1 1   34    5   36 o    415.6    2.5    0.0000   0.0000          ?        ?  1727.2010  21.0712          ?        ?      415.6        2.5       ?       ? 
1 1 1   34    5   37 o    431.5    2.6    0.0000   0.0000          ?        ?  1861.9291  22.3483          ?        ?      431.5        2.6       ?       ? 
1 1 1   34    5   38 o    351.5    2.6    0.0000   0.0000          ?        ?  1235.5393  18.5171          ?        ?      351.5        2.6       ?       ? 
1 1 1   34    5   39 o    453.1    2.5    0.0000   0.0000          ?        ?  2053.4856  22.3483          ?        ?      453.1        2.5       ?       ? 
1 1 1   34    5   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    5   41 o    431.8    2.7    0.0000   0.0000          ?        ?  1865.1217  22.9868          ?        ?      431.8        2.7       ?       ? 
1 1 1   34    5   42 o     40.4   14.7    0.0000   0.0000          ?        ?    13.4090  15.3245          ?        ?       40.4       14.7       ?       ? 
1 1 1   34    5   43 o    122.4    6.3    0.0000   0.0000          ?        ?   150.0526  15.3245          ?        ?      122.4        6.3       ?       ? 
1 1 1   34    5   44 o    250.1    3.3    0.0000   0.0000          ?        ?   625.7512  16.6016          ?        ?      250.1        3.3       ?       ? 
1 1 1   34    5   45 o    298.0    3.0    0.0000   0.0000          ?        ?   888.1836  17.8786          ?        ?      298.0        3.0       ?       ? 
1 1 1   34    5   46 o     73.0   11.4    0.0000   0.0000          ?        ?    53.6358  16.6016          ?        ?       73.0       11.4       ?       ? 
1 1 1   34    5   47 o    268.8    3.4    0.0000   0.0000          ?        ?   722.8065  18.5171          ?        ?      268.8        3.4       ?       ? 
1 1 1   34    5   48 o     58.9   14.2    0.0000   0.0000          ?        ?    36.3957  16.6016          ?        ?       58.9       14.2       ?       ? 
1 1 1   34    5   49 o    241.5    3.8    0.0000   0.0000          ?        ?   583.6088  18.5171          ?        ?      241.5        3.8       ?       ? 
1 1 1   34    5   50 o    210.4    4.2    0.0000   0.0000          ?        ?   443.1340  17.8786          ?        ?      210.4        4.2       ?       ? 
1 1 1   34    5   51 o    254.0    3.5    0.0000   0.0000          ?        ?   645.5453  17.8786          ?        ?      254.0        3.5       ?       ? 
1 1 1   34    5   52 o    312.4    3.2    0.0000   0.0000          ?        ?   976.2995  19.7942          ?        ?      312.4        3.2       ?       ? 
1 1 1   34    5   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    5   54 o    160.3    5.6    0.0000   0.0000          ?        ?   257.3242  17.8786          ?        ?      160.3        5.6       ?       ? 
1 1 1   34    5   55 o     20.6   10.4    0.0000   0.0000          ?        ?   -58.1055  19.1556          ?        ?       20.6       10.4       ?       ? 
1 1 1   34    5   56 o     27.9   13.1    0.0000   0.0000          ?        ?   -19.1556  18.5171          ?        ?       27.9       13.1       ?       ? 
1 1 1   34    5   57 o     23.6   11.5    0.0000   0.0000          ?        ?   -33.2031  17.8786          ?        ?       23.6       11.5       ?       ? 
1 1 1   34    5   58 o    160.6    6.0    0.0000   0.0000          ?        ?   258.6013  19.1556          ?        ?      160.6        6.0       ?       ? 
1 1 1   34    5   59 o    221.0    4.6    0.0000   0.0000          ?        ?   489.1075  20.4327          ?        ?      221.0        4.6       ?       ? 
1 1 1   34    5   60 o    274.2    3.7    0.0000   0.0000          ?        ?   752.8170  20.4327          ?        ?      274.2        3.7       ?       ? 
1 1 1   34    5   61 o    302.0    3.6    0.0000   0.0000          ?        ?   913.0859  21.7097          ?        ?      302.0        3.6       ?       ? 
1 1 1   34    5   62 o    118.3    8.9    0.0000   0.0000          ?        ?   141.1133  21.0712          ?        ?      118.3        8.9       ?       ? 
1 1 1   34    5   63 o     24.9   12.1    0.0000   0.0000          ?        ?   -33.2031  19.1556          ?        ?       24.9       12.1       ?       ? 
1 1 1   34    5   64 o     95.6   10.0    0.0000   0.0000          ?        ?    92.5856  19.1556          ?        ?       95.6       10.0       ?       ? 
1 1 1   34    5   65 o    184.9    5.5    0.0000   0.0000          ?        ?   343.5246  20.4327          ?        ?      184.9        5.5       ?       ? 
1 1 1   34    5   66 o    184.8    5.4    0.0000   0.0000          ?        ?   342.8861  19.7942          ?        ?      184.8        5.4       ?       ? 
1 1 1   34    5   67 o    193.3    5.1    0.0000   0.0000          ?        ?   375.4507  19.7942          ?        ?      193.3        5.1       ?       ? 
1 1 1   34    5   68 o     30.4   14.1    0.0000   0.0000          ?        ?   -15.9630  20.4327          ?        ?       30.4       14.1       ?       ? 
1 1 1   34    5   69 o     29.9   13.9    0.0000   0.0000          ?        ?   -15.3245  19.7942          ?        ?       29.9       13.9       ?       ? 
1 1 1   34    6    0 o    247.1    3.9  611.0652  19.1556   611.0652  19.1556   611.0652  19.1556      247.1      3.9      247.1        3.9     0.0     0.0 
1 1 1   34    6    1 o    297.7    2.6    0.0000   0.0000          ?        ?   886.2681  15.3245          ?        ?      297.7        2.6       ?       ? 
1 1 1   34    6    2 f    279.2    2.9    0.0000   0.0000          ?        ?   779.6349  15.9630          ?        ?      279.2        2.9       ?       ? 
1 1 1   34    6    3 o    661.5    2.9    0.0000   0.0000          ?        ?  4376.4272  38.3113          ?        ?      661.5        2.9       ?       ? 
1 1 1   34    6    4 o   1494.9    5.6    0.0000   0.0000          ?        ? 22350.8105 167.9312          ?        ?     1494.9        5.6       ?       ? 
1 1 1   34    6    5 o    997.3    3.9    0.0000   0.0000          ?        ?  9946.2510  77.8996          ?        ?      997.3        3.9       ?       ? 
1 1 1   34    6    6 o    641.4    3.2    0.0000   0.0000          ?        ?  4113.9946  41.5039          ?        ?      641.4        3.2       ?       ? 
1 1 1   34    6    7 o   1712.3    6.5    0.0000   0.0000          ?        ? 29326.6582 222.2055          ?        ?     1712.3        6.5       ?       ? 
1 1 1   34    6    8 o    325.0    2.8    0.0000   0.0000          ?        ?  1056.1147  18.5171          ?        ?      325.0        2.8       ?       ? 
1 1 1   34    6    9 o   1397.5    5.1    0.0000   0.0000          ?        ? 19534.2930 143.0288          ?        ?     1397.5        5.1       ?       ? 
1 1 1   34    6   10 o    216.2    3.0    0.0000   0.0000          ?        ?   467.3978  12.7704          ?        ?      216.2        3.0       ?       ? 
1 1 1   34    6   11 o     28.6   12.0    0.0000   0.0000          ?        ?     1.2770  11.4934          ?        ?       28.6       12.0       ?       ? 
1 1 1   34    6   12 o    974.2    3.7    0.0000   0.0000          ?        ?  9490.9854  72.7915          ?        ?      974.2        3.7       ?       ? 
1 1 1   34    6   13 o    511.0    2.6    0.0000   0.0000          ?        ?  2610.9148  26.1794          ?        ?      511.0        2.6       ?       ? 
1 1 1   34    6   14 o    934.9    3.5    0.0000   0.0000          ?        ?  8741.9990  65.1292          ?        ?      934.9        3.5       ?       ? 
1 1 1   34    6   15 o    782.5    3.1    0.0000   0.0000          ?        ?  6123.4224  48.5276          ?        ?      782.5        3.1       ?       ? 
1 1 1   34    6   16 o    530.5    2.5    0.0000   0.0000          ?        ?  2813.9648  26.8179          ?        ?      530.5        2.5       ?       ? 
1 1 1   34    6   17 o    403.5    2.5    0.0000   0.0000          ?        ?  1628.2301  20.4327          ?        ?      403.5        2.5       ?       ? 
1 1 1   34    6   18 o    792.6    3.2    0.0000   0.0000          ?        ?  6283.0527  50.4432          ?        ?      792.6        3.2       ?       ? 
1 1 1   34    6   19 o    602.0    2.8    0.0000   0.0000          ?        ?  3624.2485  33.2031          ?        ?      602.0        2.8       ?       ? 
1 1 1   34    6   20 o    674.0    2.8    0.0000   0.0000          ?        ?  4543.0815  38.3113          ?        ?      674.0        2.8       ?       ? 
1 1 1   34    6   21 o    495.0    2.5    0.0000   0.0000          ?        ?  2450.0076  24.2638          ?        ?      495.0        2.5       ?       ? 
1 1 1   34    6   22 o    572.5    2.8    0.0000   0.0000          ?        ?  3277.5315  31.9261          ?        ?      572.5        2.8       ?       ? 
1 1 1   34    6   23 o   1161.8    4.2    0.0000   0.0000          ?        ? 13501.5400  97.0553          ?        ?     1161.8        4.2       ?       ? 
1 1 1   34    6   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    6   25 o     93.5    7.5    0.0000   0.0000          ?        ?    87.4775  14.0475          ?        ?       93.5        7.5       ?       ? 
1 1 1   34    6   26 o    695.7    2.9    0.0000   0.0000          ?        ?  4839.9941  40.2269          ?        ?      695.7        2.9       ?       ? 
1 1 1   34    6   27 o    385.2    2.7    0.0000   0.0000          ?        ?  1483.9242  20.4327          ?        ?      385.2        2.7       ?       ? 
1 1 1   34    6   28 o    268.1    3.2    0.0000   0.0000          ?        ?   718.9753  17.2401          ?        ?      268.1        3.2       ?       ? 
1 1 1   34    6   29 o    508.4    2.6    0.0000   0.0000          ?        ?  2585.3740  26.8179          ?        ?      508.4        2.6       ?       ? 
1 1 1   34    6   30 o    701.9    3.0    0.0000   0.0000          ?        ?  4926.8325  41.5039          ?        ?      701.9        3.0       ?       ? 
1 1 1   34    6   31 o    583.9    2.7    0.0000   0.0000          ?        ?  3409.7056  31.2876          ?        ?      583.9        2.7       ?       ? 
1 1 1   34    6   32 o    358.0    2.7    0.0000   0.0000          ?        ?  1281.5129  19.1556          ?        ?      358.0        2.7       ?       ? 
1 1 1   34    6   33 o    260.1    2.9    0.0000   0.0000          ?        ?   676.8329  15.3245          ?        ?      260.1        2.9       ?       ? 
1 1 1   34    6   34 o    634.1    2.7    0.0000   0.0000          ?        ?  4021.4092  34.4802          ?        ?      634.1        2.7       ?       ? 
1 1 1   34    6   35 o    182.4    4.0    0.0000   0.0000          ?        ?   332.6698  14.6860          ?        ?      182.4        4.0       ?       ? 
1 1 1   34    6   36 o    327.6    2.6    0.0000   0.0000          ?        ?  1073.3549  17.2401          ?        ?      327.6        2.6       ?       ? 
1 1 1   34    6   37 o    244.7    3.3    0.0000   0.0000          ?        ?   598.9333  15.9630          ?        ?      244.7        3.3       ?       ? 
1 1 1   34    6   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    6   39 o    433.0    2.5    0.0000   0.0000          ?        ?  1875.3381  21.7097          ?        ?      433.0        2.5       ?       ? 
1 1 1   34    6   40 o    502.2    2.5    0.0000   0.0000          ?        ?  2522.7991  25.5409          ?        ?      502.2        2.5       ?       ? 
1 1 1   34    6   41 o    288.2    3.0    0.0000   0.0000          ?        ?   830.7167  17.2401          ?        ?      288.2        3.0       ?       ? 
1 1 1   34    6   42 o    268.0    3.1    0.0000   0.0000          ?        ?   718.3369  16.6016          ?        ?      268.0        3.1       ?       ? 
1 1 1   34    6   43 o    125.5    6.1    0.0000   0.0000          ?        ?   157.7148  15.3245          ?        ?      125.5        6.1       ?       ? 
1 1 1   34    6   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    6   45 o    255.3    3.3    0.0000   0.0000          ?        ?   651.9305  16.6016          ?        ?      255.3        3.3       ?       ? 
1 1 1   34    6   46 o    578.6    2.7    0.0000   0.0000          ?        ?  3349.0459  31.2876          ?        ?      578.6        2.7       ?       ? 
1 1 1   34    6   47 o     92.7    8.6    0.0000   0.0000          ?        ?    86.2004  15.9630          ?        ?       92.7        8.6       ?       ? 
1 1 1   34    6   48 o    254.1    3.5    0.0000   0.0000          ?        ?   646.1838  17.8786          ?        ?      254.1        3.5       ?       ? 
1 1 1   34    6   49 o    347.9    2.9    0.0000   0.0000          ?        ?  1210.6371  20.4327          ?        ?      347.9        2.9       ?       ? 
1 1 1   34    6   50 o     25.1   12.0    0.0000   0.0000          ?        ?   -21.7097  16.6016          ?        ?       25.1       12.0       ?       ? 
1 1 1   34    6   51 o     91.6    9.4    0.0000   0.0000          ?        ?    84.2849  17.2401          ?        ?       91.6        9.4       ?       ? 
1 1 1   34    6   52 o     42.0   15.7    0.0000   0.0000          ?        ?    13.4090  17.8786          ?        ?       42.0       15.7       ?       ? 
1 1 1   34    6   53 o     80.8   10.7    0.0000   0.0000          ?        ?    65.7677  17.2401          ?        ?       80.8       10.7       ?       ? 
1 1 1   34    6   54 o    242.8    3.9    0.0000   0.0000          ?        ?   589.9940  19.1556          ?        ?      242.8        3.9       ?       ? 
1 1 1   34    6   55 o    271.7    3.6    0.0000   0.0000          ?        ?   738.7695  19.7942          ?        ?      271.7        3.6       ?       ? 
1 1 1   34    6   56 o     44.0   16.1    0.0000   0.0000          ?        ?    15.9630  18.5171          ?        ?       44.0       16.1       ?       ? 
1 1 1   34    6   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    6   58 o    106.9    8.4    0.0000   0.0000          ?        ?   114.9339  17.8786          ?        ?      106.9        8.4       ?       ? 
1 1 1   34    6   59 o     96.1   10.3    0.0000   0.0000          ?        ?    93.2242  19.7942          ?        ?       96.1       10.3       ?       ? 
1 1 1   34    6   60 o     72.2   14.2    0.0000   0.0000          ?        ?    54.9129  19.7942          ?        ?       72.2       14.2       ?       ? 
1 1 1   34    6   61 o     27.8   13.2    0.0000   0.0000          ?        ?   -23.6253  19.7942          ?        ?       27.8       13.2       ?       ? 
1 1 1   34    6   62 o    126.1    8.1    0.0000   0.0000          ?        ?   160.2689  20.4327          ?        ?      126.1        8.1       ?       ? 
1 1 1   34    6   63 f    109.4    8.5    0.0000   0.0000          ?        ?   120.6806  18.5171          ?        ?      109.4        8.5       ?       ? 
1 1 1   34    6   64 o    250.4    4.1    0.0000   0.0000          ?        ?   628.3053  20.4327          ?        ?      250.4        4.1       ?       ? 
1 1 1   34    6   65 o     27.5   13.2    0.0000   0.0000          ?        ?   -26.8179  20.4327          ?        ?       27.5       13.2       ?       ? 
1 1 1   34    6   66 o     51.7   16.8    0.0000   0.0000          ?        ?    27.4564  19.7942          ?        ?       51.7       16.8       ?       ? 
1 1 1   34    6   67 o     20.6   10.4    0.0000   0.0000          ?        ?   -56.8284  19.1556          ?        ?       20.6       10.4       ?       ? 
1 1 1   34    6   68 o     39.5   15.9    0.0000   0.0000          ?        ?     8.9393  19.1556          ?        ?       39.5       15.9       ?       ? 
1 1 1   34    7    0 o    280.4    3.3  786.6586  18.5171   786.6586  18.5171   786.6586  18.5171      280.4      3.3      280.4        3.3     0.0     0.0 
1 1 1   34    7    1 o    878.7    3.7    0.0000   0.0000          ?        ?  7721.0034  65.1292          ?        ?      878.7        3.7       ?       ? 
1 1 1   34    7    2 o   1571.6    5.5    0.0000   0.0000          ?        ? 24704.4023 171.7623          ?        ?     1571.6        5.5       ?       ? 
1 1 1   34    7    3 o   1219.9    4.6    0.0000   0.0000          ?        ? 14882.6621 113.0183          ?        ?     1219.9        4.6       ?       ? 
1 1 1   34    7    4 o    213.8    3.3    0.0000   0.0000          ?        ?   457.1815  14.0475          ?        ?      213.8        3.3       ?       ? 
1 1 1   34    7    5 o   1400.9    4.9    0.0000   0.0000          ?        ? 19627.5156 137.9207          ?        ?     1400.9        4.9       ?       ? 
1 1 1   34    7    6 o    906.0    3.7    0.0000   0.0000          ?        ?  8208.1953  67.0448          ?        ?      906.0        3.7       ?       ? 
1 1 1   34    7    7 o    789.1    3.4    0.0000   0.0000          ?        ?  6226.8628  53.6358          ?        ?      789.1        3.4       ?       ? 
1 1 1   34    7    8 o    763.8    3.3    0.0000   0.0000          ?        ?  5834.1724  51.0817          ?        ?      763.8        3.3       ?       ? 
1 1 1   34    7    9 o   1141.8    4.3    0.0000   0.0000          ?        ? 13039.2500  97.0553          ?        ?     1141.8        4.3       ?       ? 
1 1 1   34    7   10 o    503.1    2.6    0.0000   0.0000          ?        ?  2531.0996  26.1794          ?        ?      503.1        2.6       ?       ? 
1 1 1   34    7   11 o   1035.1    4.1    0.0000   0.0000          ?        ? 10715.6699  84.2849          ?        ?     1035.1        4.1       ?       ? 
1 1 1   34    7   12 o    107.5    5.3    0.0000   0.0000          ?        ?   115.5724  11.4934          ?        ?      107.5        5.3       ?       ? 
1 1 1   34    7   13 o    725.3    3.1    0.0000   0.0000          ?        ?  5260.7798  44.6965          ?        ?      725.3        3.1       ?       ? 
1 1 1   34    7   14 o    288.8    2.7    0.0000   0.0000          ?        ?   833.9093  15.3245          ?        ?      288.8        2.7       ?       ? 
1 1 1   34    7   15 o    899.8    3.5    0.0000   0.0000          ?        ?  8097.7310  62.5751          ?        ?      899.8        3.5       ?       ? 
1 1 1   34    7   16 o     19.6    9.7    0.0000   0.0000          ?        ?   -36.3957  14.6860          ?        ?       19.6        9.7       ?       ? 
1 1 1   34    7   17 o    771.7    3.1    0.0000   0.0000          ?        ?  5956.1299  47.2506          ?        ?      771.7        3.1       ?       ? 
1 1 1   34    7   18 o    784.9    3.1    0.0000   0.0000          ?        ?  6160.4565  47.8891          ?        ?      784.9        3.1       ?       ? 
1 1 1   34    7   19 o    256.4    3.0    0.0000   0.0000          ?        ?   657.6772  15.3245          ?        ?      256.4        3.0       ?       ? 
1 1 1   34    7   20 o    834.1    3.4    0.0000   0.0000          ?        ?  6958.6089  56.1899          ?        ?      834.1        3.4       ?       ? 
1 1 1   34    7   21 f    701.1    2.9    0.0000   0.0000          ?        ?  4915.9780  40.2269          ?        ?      701.1        2.9       ?       ? 
1 1 1   34    7   22 f    982.2    3.6    0.0000   0.0000          ?        ?  9648.7002  71.5144          ?        ?      982.2        3.6       ?       ? 
1 1 1   34    7   23 o    270.4    2.7    0.0000   0.0000          ?        ?   731.1072  14.6860          ?        ?      270.4        2.7       ?       ? 
1 1 1   34    7   24 o    876.2    3.4    0.0000   0.0000          ?        ?  7678.8608  58.7440          ?        ?      876.2        3.4       ?       ? 
1 1 1   34    7   25 o    286.8    2.7    0.0000   0.0000          ?        ?   822.4159  15.3245          ?        ?      286.8        2.7       ?       ? 
1 1 1   34    7   26 o    450.9    2.5    0.0000   0.0000          ?        ?  2033.6914  22.9868          ?        ?      450.9        2.5       ?       ? 
1 1 1   34    7   27 o    760.5    3.1    0.0000   0.0000          ?        ?  5783.7290  46.6121          ?        ?      760.5        3.1       ?       ? 
1 1 1   34    7   28 o    337.0    2.7    0.0000   0.0000          ?        ?  1135.9299  17.8786          ?        ?      337.0        2.7       ?       ? 
1 1 1   34    7   29 o    141.1    5.0    0.0000   0.0000          ?        ?   199.2188  14.0475          ?        ?      141.1        5.0       ?       ? 
1 1 1   34    7   30 o    438.4    2.7    0.0000   0.0000          ?        ?  1922.5886  23.6253          ?        ?      438.4        2.7       ?       ? 
1 1 1   34    7   31 o    378.8    2.5    0.0000   0.0000          ?        ?  1434.7581  19.1556          ?        ?      378.8        2.5       ?       ? 
1 1 1   34    7   32 o    302.8    2.8    0.0000   0.0000          ?        ?   916.9171  17.2401          ?        ?      302.8        2.8       ?       ? 
1 1 1   34    7   33 o    493.0    2.5    0.0000   0.0000          ?        ?  2430.8518  24.2638          ?        ?      493.0        2.5       ?       ? 
1 1 1   34    7   34 o    448.3    2.6    0.0000   0.0000          ?        ?  2010.0660  23.6253          ?        ?      448.3        2.6       ?       ? 
1 1 1   34    7   35 o     72.7   10.5    0.0000   0.0000          ?        ?    52.9973  15.3245          ?        ?       72.7       10.5       ?       ? 
1 1 1   34    7   36 o    250.6    3.3    0.0000   0.0000          ?        ?   628.3053  16.6016          ?        ?      250.6        3.3       ?       ? 
1 1 1   34    7   37 o     19.3    9.6    0.0000   0.0000          ?        ?   -33.8416  14.0475          ?        ?       19.3        9.6       ?       ? 
1 1 1   34    7   38 o     34.9   13.7    0.0000   0.0000          ?        ?     7.0237  14.0475          ?        ?       34.9       13.7       ?       ? 
1 1 1   34    7   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    7   40 o    323.2    2.7    0.0000   0.0000          ?        ?  1044.6215  17.2401          ?        ?      323.2        2.7       ?       ? 
1 1 1   34    7   41 f    205.7    4.0    0.0000   0.0000          ?        ?   423.3398  16.6016          ?        ?      205.7        4.0       ?       ? 
1 1 1   34    7   42 o    391.3    2.6    0.0000   0.0000          ?        ?  1531.8134  20.4327          ?        ?      391.3        2.6       ?       ? 
1 1 1   34    7   43 o    261.8    3.3    0.0000   0.0000          ?        ?   685.7722  17.2401          ?        ?      261.8        3.3       ?       ? 
1 1 1   34    7   44 o    142.9    5.4    0.0000   0.0000          ?        ?   204.3269  15.3245          ?        ?      142.9        5.4       ?       ? 
1 1 1   34    7   45 o    214.9    3.7    0.0000   0.0000          ?        ?   462.2897  15.9630          ?        ?      214.9        3.7       ?       ? 
1 1 1   34    7   46 o    308.9    3.0    0.0000   0.0000          ?        ?   954.5898  18.5171          ?        ?      308.9        3.0       ?       ? 
1 1 1   34    7   47 o    160.7    5.0    0.0000   0.0000          ?        ?   258.6013  15.9630          ?        ?      160.7        5.0       ?       ? 
1 1 1   34    7   48 o    240.4    3.7    0.0000   0.0000          ?        ?   578.5006  17.8786          ?        ?      240.4        3.7       ?       ? 
1 1 1   34    7   49 o    304.1    3.1    0.0000   0.0000          ?        ?   925.2178  19.1556          ?        ?      304.1        3.1       ?       ? 
1 1 1   34    7   50 o    369.6    2.8    0.0000   0.0000          ?        ?  1366.4363  20.4327          ?        ?      369.6        2.8       ?       ? 
1 1 1   34    7   51 o    428.9    2.8    0.0000   0.0000          ?        ?  1840.2194  23.6253          ?        ?      428.9        2.8       ?       ? 
1 1 1   34    7   52 o    306.4    3.2    0.0000   0.0000          ?        ?   939.2654  19.7942          ?        ?      306.4        3.2       ?       ? 
1 1 1   34    7   53 o    253.3    3.9    0.0000   0.0000          ?        ?   642.3527  19.7942          ?        ?      253.3        3.9       ?       ? 
1 1 1   34    7   54 f    346.4    3.1    0.0000   0.0000          ?        ?  1201.0592  21.7097          ?        ?      346.4        3.1       ?       ? 
1 1 1   34    7   55 o    165.3    5.8    0.0000   0.0000          ?        ?   273.9258  19.1556          ?        ?      165.3        5.8       ?       ? 
1 1 1   34    7   56 o    295.7    3.5    0.0000   0.0000          ?        ?   875.4132  20.4327          ?        ?      295.7        3.5       ?       ? 
1 1 1   34    7   57 o    290.7    3.5    0.0000   0.0000          ?        ?   846.0411  20.4327          ?        ?      290.7        3.5       ?       ? 
1 1 1   34    7   58 o    275.8    3.6    0.0000   0.0000          ?        ?   761.7563  19.7942          ?        ?      275.8        3.6       ?       ? 
1 1 1   34    7   59 o     19.2    9.7    0.0000   0.0000          ?        ?   -60.0210  17.8786          ?        ?       19.2        9.7       ?       ? 
1 1 1   34    7   60 o     32.1   14.4    0.0000   0.0000          ?        ?    -8.3008  19.1556          ?        ?       32.1       14.4       ?       ? 
1 1 1   34    7   61 f     25.2   12.3    0.0000   0.0000          ?        ?   -34.4802  19.7942          ?        ?       25.2       12.3       ?       ? 
1 1 1   34    7   62 o     42.2   16.4    0.0000   0.0000          ?        ?    12.1319  19.7942          ?        ?       42.2       16.4       ?       ? 
1 1 1   34    7   63 o    153.5    6.7    0.0000   0.0000          ?        ?   236.8915  20.4327          ?        ?      153.5        6.7       ?       ? 
1 1 1   34    7   64 o     85.6   11.6    0.0000   0.0000          ?        ?    74.7070  19.7942          ?        ?       85.6       11.6       ?       ? 
1 1 1   34    7   65 o    109.1    9.4    0.0000   0.0000          ?        ?   120.6806  20.4327          ?        ?      109.1        9.4       ?       ? 
1 1 1   34    7   66 o     43.8   16.3    0.0000   0.0000          ?        ?    15.9630  19.1556          ?        ?       43.8       16.3       ?       ? 
1 1 1   34    7   67 o     53.7   16.4    0.0000   0.0000          ?        ?    30.6490  19.1556          ?        ?       53.7       16.4       ?       ? 
1 1 1   34    7   68 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    8    0 o    448.1    4.6 2008.7891  41.5039  2008.7891  41.5039  2008.7891  41.5039      448.1      4.6      448.1        4.6     0.0     0.0 
1 1 1   34    8    1 o   1544.1    5.7    0.0000   0.0000          ?        ? 23848.1445 174.9549          ?        ?     1544.1        5.7       ?       ? 
1 1 1   34    8    2 f    119.6    5.9    0.0000   0.0000          ?        ?   143.0288  14.0475          ?        ?      119.6        5.9       ?       ? 
1 1 1   34    8    3 o   1333.2    4.9    0.0000   0.0000          ?        ? 17776.4414 129.6199          ?        ?     1333.2        4.9       ?       ? 
1 1 1   34    8    4 o   1336.9    5.0    0.0000   0.0000          ?        ? 17877.3281 133.4510          ?        ?     1336.9        5.0       ?       ? 
1 1 1   34    8    5 o    419.2    2.4    0.0000   0.0000          ?        ?  1757.2115  20.4327          ?        ?      419.2        2.4       ?       ? 
1 1 1   34    8    6 o    896.6    3.6    0.0000   0.0000          ?        ?  8038.9873  65.1292          ?        ?      896.6        3.6       ?       ? 
1 1 1   34    8    7 o   1336.4    4.8    0.0000   0.0000          ?        ? 17861.3652 127.7043          ?        ?     1336.4        4.8       ?       ? 
1 1 1   34    8    8 o    371.2    2.4    0.0000   0.0000          ?        ?  1377.9297  17.8786          ?        ?      371.2        2.4       ?       ? 
1 1 1   34    8    9 o    803.6    3.1    0.0000   0.0000          ?        ?  6458.0078  50.4432          ?        ?      803.6        3.1       ?       ? 
1 1 1   34    8   10 o    674.9    2.9    0.0000   0.0000          ?        ?  4555.2134  39.5883          ?        ?      674.9        2.9       ?       ? 
1 1 1   34    8   11 o    655.1    2.9    0.0000   0.0000          ?        ?  4292.1426  37.6728          ?        ?      655.1        2.9       ?       ? 
1 1 1   34    8   12 o   1242.5    4.4    0.0000   0.0000          ?        ? 15440.7295 109.1872          ?        ?     1242.5        4.4       ?       ? 
1 1 1   34    8   13 o    615.5    2.9    0.0000   0.0000          ?        ?  3788.3486  35.7572          ?        ?      615.5        2.9       ?       ? 
1 1 1   34    8   14 o     21.6   10.4    0.0000   0.0000          ?        ?   -21.0712  13.4090          ?        ?       21.6       10.4       ?       ? 
1 1 1   34    8   15 o    968.6    3.8    0.0000   0.0000          ?        ?  9382.4365  74.0685          ?        ?      968.6        3.8       ?       ? 
1 1 1   34    8   16 o    780.7    3.2    0.0000   0.0000          ?        ?  6095.9658  49.8047          ?        ?      780.7        3.2       ?       ? 
1 1 1   34    8   17 o    712.4    2.8    0.0000   0.0000          ?        ?  5076.2471  40.2269          ?        ?      712.4        2.8       ?       ? 
1 1 1   34    8   18 o    371.0    2.4    0.0000   0.0000          ?        ?  1376.6527  17.8786          ?        ?      371.0        2.4       ?       ? 
1 1 1   34    8   19 o    609.2    2.7    0.0000   0.0000          ?        ?  3711.0879  33.2031          ?        ?      609.2        2.7       ?       ? 
1 1 1   34    8   20 o    144.5    4.6    0.0000   0.0000          ?        ?   208.7966  13.4090          ?        ?      144.5        4.6       ?       ? 
1 1 1   34    8   21 o     36.7   13.7    0.0000   0.0000          ?        ?    10.2163  13.4090          ?        ?       36.7       13.7       ?       ? 
1 1 1   34    8   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    8   23 o    737.2    3.2    0.0000   0.0000          ?        ?  5435.0962  47.2506          ?        ?      737.2        3.2       ?       ? 
1 1 1   34    8   24 o    579.6    2.6    0.0000   0.0000          ?        ?  3359.9009  30.0105          ?        ?      579.6        2.6       ?       ? 
1 1 1   34    8   25 o    659.9    2.9    0.0000   0.0000          ?        ?  4354.7173  38.3113          ?        ?      659.9        2.9       ?       ? 
1 1 1   34    8   26 o    440.6    2.5    0.0000   0.0000          ?        ?  1941.1057  22.3483          ?        ?      440.6        2.5       ?       ? 
1 1 1   34    8   27 o    231.3    3.3    0.0000   0.0000          ?        ?   535.0811  15.3245          ?        ?      231.3        3.3       ?       ? 
1 1 1   34    8   28 o    317.3    2.7    0.0000   0.0000          ?        ?  1006.9486  17.2401          ?        ?      317.3        2.7       ?       ? 
1 1 1   34    8   29 o    221.3    3.2    0.0000   0.0000          ?        ?   489.7461  14.0475          ?        ?      221.3        3.2       ?       ? 
1 1 1   34    8   30 o    452.0    2.5    0.0000   0.0000          ?        ?  2043.2692  22.9868          ?        ?      452.0        2.5       ?       ? 
1 1 1   34    8   31 o    540.7    2.6    0.0000   0.0000          ?        ?  2923.7905  28.0950          ?        ?      540.7        2.6       ?       ? 
1 1 1   34    8   32 f    314.0    2.7    0.0000   0.0000          ?        ?   985.8774  17.2401          ?        ?      314.0        2.7       ?       ? 
1 1 1   34    8   33 o    562.1    2.7    0.0000   0.0000          ?        ?  3160.0435  30.0105          ?        ?      562.1        2.7       ?       ? 
1 1 1   34    8   34 o    729.1    2.9    0.0000   0.0000          ?        ?  5316.9697  42.7809          ?        ?      729.1        2.9       ?       ? 
1 1 1   34    8   35 o     52.1   14.7    0.0000   0.0000          ?        ?    28.0950  15.9630          ?        ?       52.1       14.7       ?       ? 
1 1 1   34    8   36 o    305.7    3.0    0.0000   0.0000          ?        ?   934.7956  18.5171          ?        ?      305.7        3.0       ?       ? 
1 1 1   34    8   37 o    181.6    4.0    0.0000   0.0000          ?        ?   330.1157  14.6860          ?        ?      181.6        4.0       ?       ? 
1 1 1   34    8   38 o    234.2    3.5    0.0000   0.0000          ?        ?   548.4901  16.6016          ?        ?      234.2        3.5       ?       ? 
1 1 1   34    8   39 o    132.2    5.8    0.0000   0.0000          ?        ?   174.9549  15.3245          ?        ?      132.2        5.8       ?       ? 
1 1 1   34    8   40 o    175.0    4.2    0.0000   0.0000          ?        ?   306.4904  14.6860          ?        ?      175.0        4.2       ?       ? 
1 1 1   34    8   41 o    222.4    3.6    0.0000   0.0000          ?        ?   494.8542  15.9630          ?        ?      222.4        3.6       ?       ? 
1 1 1   34    8   42 o    160.9    5.2    0.0000   0.0000          ?        ?   259.2398  16.6016          ?        ?      160.9        5.2       ?       ? 
1 1 1   34    8   43 o    293.5    3.0    0.0000   0.0000          ?        ?   862.0042  17.8786          ?        ?      293.5        3.0       ?       ? 
1 1 1   34    8   44 o    218.6    3.8    0.0000   0.0000          ?        ?   478.2527  16.6016          ?        ?      218.6        3.8       ?       ? 
1 1 1   34    8   45 o    199.2    4.3    0.0000   0.0000          ?        ?   397.1605  17.2401          ?        ?      199.2        4.3       ?       ? 
1 1 1   34    8   46 o    371.5    2.8    0.0000   0.0000          ?        ?  1380.4838  21.0712          ?        ?      371.5        2.8       ?       ? 
1 1 1   34    8   47 o    284.8    3.4    0.0000   0.0000          ?        ?   811.5610  19.1556          ?        ?      284.8        3.4       ?       ? 
1 1 1   34    8   48 o    207.0    4.2    0.0000   0.0000          ?        ?   429.0865  17.2401          ?        ?      207.0        4.2       ?       ? 
1 1 1   34    8   49 o    223.1    4.0    0.0000   0.0000          ?        ?   498.0469  17.8786          ?        ?      223.1        4.0       ?       ? 
1 1 1   34    8   50 o    265.1    3.4    0.0000   0.0000          ?        ?   703.0123  17.8786          ?        ?      265.1        3.4       ?       ? 
1 1 1   34    8   51 f    120.2    7.4    0.0000   0.0000          ?        ?   144.9444  17.8786          ?        ?      120.2        7.4       ?       ? 
1 1 1   34    8   52 o    147.0    6.1    0.0000   0.0000          ?        ?   216.4588  17.8786          ?        ?      147.0        6.1       ?       ? 
1 1 1   34    8   53 o    180.8    5.3    0.0000   0.0000          ?        ?   327.5616  19.1556          ?        ?      180.8        5.3       ?       ? 
1 1 1   34    8   54 o    541.6    2.8    0.0000   0.0000          ?        ?  2935.2839  30.0105          ?        ?      541.6        2.8       ?       ? 
1 1 1   34    8   55 o    204.8    4.7    0.0000   0.0000          ?        ?   420.1472  19.1556          ?        ?      204.8        4.7       ?       ? 
1 1 1   34    8   56 o     35.1   15.1    0.0000   0.0000          ?        ?    -1.2770  19.1556          ?        ?       35.1       15.1       ?       ? 
1 1 1   34    8   57 o    171.7    5.6    0.0000   0.0000          ?        ?   295.6355  19.1556          ?        ?      171.7        5.6       ?       ? 
1 1 1   34    8   58 o    138.3    6.7    0.0000   0.0000          ?        ?   192.1950  18.5171          ?        ?      138.3        6.7       ?       ? 
1 1 1   34    8   59 f     87.4   11.0    0.0000   0.0000          ?        ?    77.2611  19.1556          ?        ?       87.4       11.0       ?       ? 
1 1 1   34    8   60 o     23.8   11.7    0.0000   0.0000          ?        ?   -41.5039  19.7942          ?        ?       23.8       11.7       ?       ? 
1 1 1   34    8   61 o    148.7    6.9    0.0000   0.0000          ?        ?   222.2055  20.4327          ?        ?      148.7        6.9       ?       ? 
1 1 1   34    8   62 o    109.4    8.5    0.0000   0.0000          ?        ?   120.6806  18.5171          ?        ?      109.4        8.5       ?       ? 
1 1 1   34    8   63 o     34.6   15.1    0.0000   0.0000          ?        ?    -3.1926  19.7942          ?        ?       34.6       15.1       ?       ? 
1 1 1   34    8   64 o    165.8    6.0    0.0000   0.0000          ?        ?   276.4799  19.7942          ?        ?      165.8        6.0       ?       ? 
1 1 1   34    8   65 o     69.8   15.1    0.0000   0.0000          ?        ?    52.3588  20.4327          ?        ?       69.8       15.1       ?       ? 
1 1 1   34    8   66 o     81.6   11.7    0.0000   0.0000          ?        ?    68.3218  19.1556          ?        ?       81.6       11.7       ?       ? 
1 1 1   34    8   67 o     49.5   16.5    0.0000   0.0000          ?        ?    24.9023  19.1556          ?        ?       49.5       16.5       ?       ? 
1 1 1   34    9    0 o    445.3    3.5 1983.2482  31.2876  1983.2482  31.2876  1983.2482  31.2876      445.3      3.5      445.3        3.5     0.0     0.0 
1 1 1   34    9    1 o    513.2    2.6    0.0000   0.0000          ?        ?  2633.9016  26.1794          ?        ?      513.2        2.6       ?       ? 
1 1 1   34    9    2 f    690.7    3.0    0.0000   0.0000          ?        ?  4771.6719  41.5039          ?        ?      690.7        3.0       ?       ? 
1 1 1   34    9    3 o    825.1    3.4    0.0000   0.0000          ?        ?  6808.5566  56.1899          ?        ?      825.1        3.4       ?       ? 
1 1 1   34    9    4 o   1181.3    4.5    0.0000   0.0000          ?        ? 13956.8057 105.3561          ?        ?     1181.3        4.5       ?       ? 
1 1 1   34    9    5 o   1458.4    5.5    0.0000   0.0000          ?        ? 21274.2637 159.6304          ?        ?     1458.4        5.5       ?       ? 
1 1 1   34    9    6 o    475.5    2.6    0.0000   0.0000          ?        ?  2261.0051  24.9023          ?        ?      475.5        2.6       ?       ? 
1 1 1   34    9    7 o    215.2    2.8    0.0000   0.0000          ?        ?   462.9282  12.1319          ?        ?      215.2        2.8       ?       ? 
1 1 1   34    9    8 o    180.3    3.2    0.0000   0.0000          ?        ?   325.0075  11.4934          ?        ?      180.3        3.2       ?       ? 
1 1 1   34    9    9 o    968.9    3.6    0.0000   0.0000          ?        ?  9389.4609  70.2374          ?        ?      968.9        3.6       ?       ? 
1 1 1   34    9   10 o   1162.8    4.3    0.0000   0.0000          ?        ? 13522.6113  99.6094          ?        ?     1162.8        4.3       ?       ? 
1 1 1   34    9   11 o    311.7    2.5    0.0000   0.0000          ?        ?   971.8299  15.3245          ?        ?      311.7        2.5       ?       ? 
1 1 1   34    9   12 o    582.2    2.7    0.0000   0.0000          ?        ?  3389.9114  31.9261          ?        ?      582.2        2.7       ?       ? 
1 1 1   34    9   13 o    385.1    2.5    0.0000   0.0000          ?        ?  1483.2858  19.1556          ?        ?      385.1        2.5       ?       ? 
1 1 1   34    9   14 o    674.9    2.9    0.0000   0.0000          ?        ?  4555.2134  39.5883          ?        ?      674.9        2.9       ?       ? 
1 1 1   34    9   15 o   1418.6    5.0    0.0000   0.0000          ?        ? 20129.3945 143.0288          ?        ?     1418.6        5.0       ?       ? 
1 1 1   34    9   16 o    185.8    3.6    0.0000   0.0000          ?        ?   345.4402  13.4090          ?        ?      185.8        3.6       ?       ? 
1 1 1   34    9   17 o    661.1    2.8    0.0000   0.0000          ?        ?  4370.6807  37.0343          ?        ?      661.1        2.8       ?       ? 
1 1 1   34    9   18 o    355.0    2.3    0.0000   0.0000          ?        ?  1260.4417  16.6016          ?        ?      355.0        2.3       ?       ? 
1 1 1   34    9   19 o    797.2    3.0    0.0000   0.0000          ?        ?  6355.8442  48.5276          ?        ?      797.2        3.0       ?       ? 
1 1 1   34    9   20 o    245.0    3.0    0.0000   0.0000          ?        ?   600.2103  14.6860          ?        ?      245.0        3.0       ?       ? 
1 1 1   34    9   21 f    781.0    3.0    0.0000   0.0000          ?        ?  6099.7969  47.2506          ?        ?      781.0        3.0       ?       ? 
1 1 1   34    9   22 o    500.7    2.5    0.0000   0.0000          ?        ?  2507.4746  24.9023          ?        ?      500.7        2.5       ?       ? 
1 1 1   34    9   23 f    467.2    2.7    0.0000   0.0000          ?        ?  2183.1055  25.5409          ?        ?      467.2        2.7       ?       ? 
1 1 1   34    9   24 o    755.5    3.0    0.0000   0.0000          ?        ?  5708.3833  45.9736          ?        ?      755.5        3.0       ?       ? 
1 1 1   34    9   25 o    225.9    3.0    0.0000   0.0000          ?        ?   510.1788  13.4090          ?        ?      225.9        3.0       ?       ? 
1 1 1   34    9   26 o    716.3    2.9    0.0000   0.0000          ?        ?  5131.1597  42.1424          ?        ?      716.3        2.9       ?       ? 
1 1 1   34    9   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34    9   28 o    454.3    2.7    0.0000   0.0000          ?        ?  2064.3403  24.2638          ?        ?      454.3        2.7       ?       ? 
1 1 1   34    9   29 o    189.2    3.5    0.0000   0.0000          ?        ?   358.2106  13.4090          ?        ?      189.2        3.5       ?       ? 
1 1 1   34    9   30 o    384.5    2.4    0.0000   0.0000          ?        ?  1478.8162  18.5171          ?        ?      384.5        2.4       ?       ? 
1 1 1   34    9   31 o    516.2    2.5    0.0000   0.0000          ?        ?  2664.5508  26.1794          ?        ?      516.2        2.5       ?       ? 
1 1 1   34    9   32 o    299.1    2.7    0.0000   0.0000          ?        ?   894.5688  15.9630          ?        ?      299.1        2.7       ?       ? 
1 1 1   34    9   33 f    394.3    2.7    0.0000   0.0000          ?        ?  1554.8002  21.0712          ?        ?      394.3        2.7       ?       ? 
1 1 1   34    9   34 o    628.2    2.7    0.0000   0.0000          ?        ?  3946.7019  33.8416          ?        ?      628.2        2.7       ?       ? 
1 1 1   34    9   35 o    791.4    3.1    0.0000   0.0000          ?        ?  6264.5356  49.8047          ?        ?      791.4        3.1       ?       ? 
1 1 1   34    9   36 o    360.3    2.7    0.0000   0.0000          ?        ?  1298.1145  19.7942          ?        ?      360.3        2.7       ?       ? 
1 1 1   34    9   37 o     91.4    8.4    0.0000   0.0000          ?        ?    83.6463  15.3245          ?        ?       91.4        8.4       ?       ? 
1 1 1   34    9   38 o    569.4    2.6    0.0000   0.0000          ?        ?  3242.4128  30.0105          ?        ?      569.4        2.6       ?       ? 
1 1 1   34    9   39 o    306.7    2.8    0.0000   0.0000          ?        ?   941.1808  17.2401          ?        ?      306.7        2.8       ?       ? 
1 1 1   34    9   40 o    568.6    2.6    0.0000   0.0000          ?        ?  3233.4734  29.3720          ?        ?      568.6        2.6       ?       ? 
1 1 1   34    9   41 o     20.7   10.3    0.0000   0.0000          ?        ?   -37.6728  15.9630          ?        ?       20.7       10.3       ?       ? 
1 1 1   34    9   42 o    236.0    3.4    0.0000   0.0000          ?        ?   557.4294  15.9630          ?        ?      236.0        3.4       ?       ? 
1 1 1   34    9   43 o    460.6    2.5    0.0000   0.0000          ?        ?  2122.4458  22.9868          ?        ?      460.6        2.5       ?       ? 
1 1 1   34    9   44 o     79.3    9.7    0.0000   0.0000          ?        ?    63.2136  15.3245          ?        ?       79.3        9.7       ?       ? 
1 1 1   34    9   45 o    270.3    3.2    0.0000   0.0000          ?        ?   731.1072  17.2401          ?        ?      270.3        3.2       ?       ? 
1 1 1   34    9   46 o     38.1   14.7    0.0000   0.0000          ?        ?     9.5778  15.9630          ?        ?       38.1       14.7       ?       ? 
1 1 1   34    9   47 o    204.9    4.2    0.0000   0.0000          ?        ?   420.1472  17.2401          ?        ?      204.9        4.2       ?       ? 
1 1 1   34    9   48 o    252.8    3.5    0.0000   0.0000          ?        ?   639.7986  17.8786          ?        ?      252.8        3.5       ?       ? 
1 1 1   34    9   49 o     82.8   10.0    0.0000   0.0000          ?        ?    68.9603  16.6016          ?        ?       82.8       10.0       ?       ? 
1 1 1   34    9   50 o     38.0   15.1    0.0000   0.0000          ?        ?     7.6623  17.2401          ?        ?       38.0       15.1       ?       ? 
1 1 1   34    9   51 o    322.8    3.2    0.0000   0.0000          ?        ?  1042.7058  20.4327          ?        ?      322.8        3.2       ?       ? 
1 1 1   34    9   52 o     31.0   14.1    0.0000   0.0000          ?        ?   -11.4934  19.1556          ?        ?       31.0       14.1       ?       ? 
1 1 1   34    9   53 o     85.7   10.8    0.0000   0.0000          ?        ?    74.0685  18.5171          ?        ?       85.7       10.8       ?       ? 
1 1 1   34    9   54 o    390.8    2.9    0.0000   0.0000          ?        ?  1528.6207  22.9868          ?        ?      390.8        2.9       ?       ? 
1 1 1   34    9   55 o    194.2    5.1    0.0000   0.0000          ?        ?   378.0048  19.7942          ?        ?      194.2        5.1       ?       ? 
1 1 1   34    9   56 o    141.8    6.8    0.0000   0.0000          ?        ?   201.7728  19.1556          ?        ?      141.8        6.8       ?       ? 
1 1 1   34    9   57 o    128.5    7.5    0.0000   0.0000          ?        ?   166.0156  19.1556          ?        ?      128.5        7.5       ?       ? 
1 1 1   34    9   58 o    177.9    5.4    0.0000   0.0000          ?        ?   317.3452  19.1556          ?        ?      177.9        5.4       ?       ? 
1 1 1   34    9   59 f     20.4   10.3    0.0000   0.0000          ?        ?   -64.4907  19.7942          ?        ?       20.4       10.3       ?       ? 
1 1 1   34    9   60 o    151.3    6.1    0.0000   0.0000          ?        ?   229.8678  18.5171          ?        ?      151.3        6.1       ?       ? 
1 1 1   34    9   61 o    163.4    6.1    0.0000   0.0000          ?        ?   268.1791  19.7942          ?        ?      163.4        6.1       ?       ? 
1 1 1   34    9   62 o     44.4   16.6    0.0000   0.0000          ?        ?    15.9630  19.7942          ?        ?       44.4       16.6       ?       ? 
1 1 1   34    9   63 o    251.5    4.2    0.0000   0.0000          ?        ?   634.0520  21.0712          ?        ?      251.5        4.2       ?       ? 
1 1 1   34    9   64 o     48.4   16.5    0.0000   0.0000          ?        ?    22.9868  19.1556          ?        ?       48.4       16.5       ?       ? 
1 1 1   34    9   65 o     27.3   13.0    0.0000   0.0000          ?        ?   -22.3483  19.1556          ?        ?       27.3       13.0       ?       ? 
1 1 1   34    9   66 o    140.0    6.8    0.0000   0.0000          ?        ?   197.9417  19.1556          ?        ?      140.0        6.8       ?       ? 
1 1 1   34   10    0 o    745.1    4.4 5553.2227  65.1292  5553.2227  65.1292  5553.2227  65.1292      745.1      4.4      745.1        4.4     0.0     0.0 
1 1 1   34   10    1 o    706.7    3.0    0.0000   0.0000          ?        ?  4994.5161  42.1424          ?        ?      706.7        3.0       ?       ? 
1 1 1   34   10    2 o    600.6    2.7    0.0000   0.0000          ?        ?  3607.6472  31.9261          ?        ?      600.6        2.7       ?       ? 
1 1 1   34   10    3 o   1083.7    4.2    0.0000   0.0000          ?        ? 11746.8818  91.3086          ?        ?     1083.7        4.2       ?       ? 
1 1 1   34   10    4 o    688.6    2.8    0.0000   0.0000          ?        ?  4742.3003  38.9498          ?        ?      688.6        2.8       ?       ? 
1 1 1   34   10    5 o    379.6    2.4    0.0000   0.0000          ?        ?  1441.1433  17.8786          ?        ?      379.6        2.4       ?       ? 
1 1 1   34   10    6 o    686.2    2.9    0.0000   0.0000          ?        ?  4708.4585  39.5883          ?        ?      686.2        2.9       ?       ? 
1 1 1   34   10    7 o    234.2    2.5    0.0000   0.0000          ?        ?   548.4901  11.4934          ?        ?      234.2        2.5       ?       ? 
1 1 1   34   10    8 f    114.1    4.5    0.0000   0.0000          ?        ?   130.2584  10.2163          ?        ?      114.1        4.5       ?       ? 
1 1 1   34   10    9 o     57.7   10.9    0.0000   0.0000          ?        ?    34.4802  12.1319          ?        ?       57.7       10.9       ?       ? 
1 1 1   34   10   10 o    465.4    2.6    0.0000   0.0000          ?        ?  2166.5039  24.2638          ?        ?      465.4        2.6       ?       ? 
1 1 1   34   10   11 o    806.4    3.2    0.0000   0.0000          ?        ?  6503.3428  51.7203          ?        ?      806.4        3.2       ?       ? 
1 1 1   34   10   12 o    629.0    2.8    0.0000   0.0000          ?        ?  3956.2798  35.7572          ?        ?      629.0        2.8       ?       ? 
1 1 1   34   10   13 o   1143.5    4.3    0.0000   0.0000          ?        ? 13077.5625  98.9709          ?        ?     1143.5        4.3       ?       ? 
1 1 1   34   10   14 o    638.4    2.9    0.0000   0.0000          ?        ?  4076.3223  37.0343          ?        ?      638.4        2.9       ?       ? 
1 1 1   34   10   15 o     15.1    7.6    0.0000   0.0000          ?        ?   -40.8654  11.4934          ?        ?       15.1        7.6       ?       ? 
1 1 1   34   10   16 o    409.0    2.3    0.0000   0.0000          ?        ?  1672.9266  19.1556          ?        ?      409.0        2.3       ?       ? 
1 1 1   34   10   17 o   1084.6    3.9    0.0000   0.0000          ?        ? 11764.7607  84.9234          ?        ?     1084.6        3.9       ?       ? 
1 1 1   34   10   18 o    660.5    2.8    0.0000   0.0000          ?        ?  4363.6567  36.3957          ?        ?      660.5        2.8       ?       ? 
1 1 1   34   10   19 o     65.9    9.2    0.0000   0.0000          ?        ?    43.4195  12.1319          ?        ?       65.9        9.2       ?       ? 
1 1 1   34   10   20 o    968.8    3.5    0.0000   0.0000          ?        ?  9386.9062  68.3218          ?        ?      968.8        3.5       ?       ? 
1 1 1   34   10   21 o    731.4    3.0    0.0000   0.0000          ?        ?  5350.8110  44.0580          ?        ?      731.4        3.0       ?       ? 
1 1 1   34   10   22 o    201.2    3.6    0.0000   0.0000          ?        ?   404.8227  14.6860          ?        ?      201.2        3.6       ?       ? 
1 1 1   34   10   23 o   1036.1    3.8    0.0000   0.0000          ?        ? 10737.3799  78.5382          ?        ?     1036.1        3.8       ?       ? 
1 1 1   34   10   24 f    628.0    2.7    0.0000   0.0000          ?        ?  3944.1482  33.8416          ?        ?      628.0        2.7       ?       ? 
1 1 1   34   10   25 o    354.6    2.5    0.0000   0.0000          ?        ?  1257.8876  17.8786          ?        ?      354.6        2.5       ?       ? 
1 1 1   34   10   26 o    329.7    2.5    0.0000   0.0000          ?        ?  1087.4023  16.6016          ?        ?      329.7        2.5       ?       ? 
1 1 1   34   10   27 o    271.2    2.7    0.0000   0.0000          ?        ?   735.5769  14.6860          ?        ?      271.2        2.7       ?       ? 
1 1 1   34   10   28 o    275.7    3.0    0.0000   0.0000          ?        ?   760.4792  16.6016          ?        ?      275.7        3.0       ?       ? 
1 1 1   34   10   29 o    450.6    2.5    0.0000   0.0000          ?        ?  2031.1373  22.3483          ?        ?      450.6        2.5       ?       ? 
1 1 1   34   10   30 f    368.4    2.4    0.0000   0.0000          ?        ?  1357.4971  17.8786          ?        ?      368.4        2.4       ?       ? 
1 1 1   34   10   31 o    115.2    6.4    0.0000   0.0000          ?        ?   132.8125  14.6860          ?        ?      115.2        6.4       ?       ? 
1 1 1   34   10   32 o    141.1    5.0    0.0000   0.0000          ?        ?   199.2188  14.0475          ?        ?      141.1        5.0       ?       ? 
1 1 1   34   10   33 o    311.2    2.8    0.0000   0.0000          ?        ?   968.6373  17.2401          ?        ?      311.2        2.8       ?       ? 
1 1 1   34   10   34 o    299.3    2.9    0.0000   0.0000          ?        ?   895.8459  17.2401          ?        ?      299.3        2.9       ?       ? 
1 1 1   34   10   35 o     16.7    8.5    0.0000   0.0000          ?        ?   -54.2743  14.6860          ?        ?       16.7        8.5       ?       ? 
1 1 1   34   10   36 o    271.3    2.9    0.0000   0.0000          ?        ?   736.2155  15.9630          ?        ?      271.3        2.9       ?       ? 
1 1 1   34   10   37 o    419.0    2.6    0.0000   0.0000          ?        ?  1755.9344  21.7097          ?        ?      419.0        2.6       ?       ? 
1 1 1   34   10   38 o    250.1    3.3    0.0000   0.0000          ?        ?   625.7512  16.6016          ?        ?      250.1        3.3       ?       ? 
1 1 1   34   10   39 o    343.6    2.6    0.0000   0.0000          ?        ?  1180.6265  17.8786          ?        ?      343.6        2.6       ?       ? 
1 1 1   34   10   40 o    158.7    4.8    0.0000   0.0000          ?        ?   252.2160  15.3245          ?        ?      158.7        4.8       ?       ? 
1 1 1   34   10   41 o    455.7    2.6    0.0000   0.0000          ?        ?  2077.1108  23.6253          ?        ?      455.7        2.6       ?       ? 
1 1 1   34   10   42 o     84.0    9.5    0.0000   0.0000          ?        ?    70.8759  15.9630          ?        ?       84.0        9.5       ?       ? 
1 1 1   34   10   43 o     19.0    9.6    0.0000   0.0000          ?        ?   -47.2506  15.9630          ?        ?       19.0        9.6       ?       ? 
1 1 1   34   10   44 o    197.3    4.0    0.0000   0.0000          ?        ?   389.4982  15.9630          ?        ?      197.3        4.0       ?       ? 
1 1 1   34   10   45 o     20.4   10.2    0.0000   0.0000          ?        ?   -38.9498  15.9630          ?        ?       20.4       10.2       ?       ? 
1 1 1   34   10   46 o     72.1   11.1    0.0000   0.0000          ?        ?    52.3588  15.9630          ?        ?       72.1       11.1       ?       ? 
1 1 1   34   10   47 o     88.4    9.4    0.0000   0.0000          ?        ?    78.5382  16.6016          ?        ?       88.4        9.4       ?       ? 
1 1 1   34   10   48 o     24.3   11.7    0.0000   0.0000          ?        ?   -27.4564  17.2401          ?        ?       24.3       11.7       ?       ? 
1 1 1   34   10   49 o    133.3    6.2    0.0000   0.0000          ?        ?   178.1475  16.6016          ?        ?      133.3        6.2       ?       ? 
1 1 1   34   10   50 o    172.3    5.4    0.0000   0.0000          ?        ?   297.5511  18.5171          ?        ?      172.3        5.4       ?       ? 
1 1 1   34   10   51 o    329.3    3.0    0.0000   0.0000          ?        ?  1084.8481  19.7942          ?        ?      329.3        3.0       ?       ? 
1 1 1   34   10   52 o    271.7    3.6    0.0000   0.0000          ?        ?   738.7695  19.7942          ?        ?      271.7        3.6       ?       ? 
1 1 1   34   10   53 o    127.1    7.5    0.0000   0.0000          ?        ?   162.1845  19.1556          ?        ?      127.1        7.5       ?       ? 
1 1 1   34   10   54 o    439.0    2.8    0.0000   0.0000          ?        ?  1928.3353  24.2638          ?        ?      439.0        2.8       ?       ? 
1 1 1   34   10   55 o     62.1   15.0    0.0000   0.0000          ?        ?    40.8654  18.5171          ?        ?       62.1       15.0       ?       ? 
1 1 1   34   10   56 o     54.8   15.9    0.0000   0.0000          ?        ?    31.2876  18.5171          ?        ?       54.8       15.9       ?       ? 
1 1 1   34   10   57 o    117.1    8.2    0.0000   0.0000          ?        ?   137.9207  19.1556          ?        ?      117.1        8.2       ?       ? 
1 1 1   34   10   58 o    131.2    7.3    0.0000   0.0000          ?        ?   173.0394  19.1556          ?        ?      131.2        7.3       ?       ? 
1 1 1   34   10   59 o     22.3   11.1    0.0000   0.0000          ?        ?   -46.6121  19.1556          ?        ?       22.3       11.1       ?       ? 
1 1 1   34   10   60 o    381.4    3.0    0.0000   0.0000          ?        ?  1456.4679  22.9868          ?        ?      381.4        3.0       ?       ? 
1 1 1   34   10   61 o    159.2    6.0    0.0000   0.0000          ?        ?   254.7701  19.1556          ?        ?      159.2        6.0       ?       ? 
1 1 1   34   10   62 o     56.9   16.1    0.0000   0.0000          ?        ?    34.4802  19.1556          ?        ?       56.9       16.1       ?       ? 
1 1 1   34   10   63 o    115.7    8.6    0.0000   0.0000          ?        ?   135.3666  19.7942          ?        ?      115.7        8.6       ?       ? 
1 1 1   34   10   64 f     79.2   12.5    0.0000   0.0000          ?        ?    64.4907  19.7942          ?        ?       79.2       12.5       ?       ? 
1 1 1   34   10   65 o    253.8    4.0    0.0000   0.0000          ?        ?   646.1838  20.4327          ?        ?      253.8        4.0       ?       ? 
1 1 1   34   10   66 o    107.8    8.6    0.0000   0.0000          ?        ?   118.1265  18.5171          ?        ?      107.8        8.6       ?       ? 
1 1 1   34   11    0 o    647.4    3.7 4191.8945  47.8891  4191.8945  47.8891  4191.8945  47.8891      647.4      3.7      647.4        3.7     0.0     0.0 
1 1 1   34   11    1 o    238.2    2.5    0.0000   0.0000          ?        ?   567.6458  12.1319          ?        ?      238.2        2.5       ?       ? 
1 1 1   34   11    2 o    425.1    2.4    0.0000   0.0000          ?        ?  1807.0162  20.4327          ?        ?      425.1        2.4       ?       ? 
1 1 1   34   11    3 o    916.7    3.4    0.0000   0.0000          ?        ?  8404.2217  63.2136          ?        ?      916.7        3.4       ?       ? 
1 1 1   34   11    4 o    764.7    3.3    0.0000   0.0000          ?        ?  5848.2197  51.0817          ?        ?      764.7        3.3       ?       ? 
1 1 1   34   11    5 o    826.8    3.4    0.0000   0.0000          ?        ?  6837.2900  55.5514          ?        ?      826.8        3.4       ?       ? 
1 1 1   34   11    6 o    786.5    3.1    0.0000   0.0000          ?        ?  6185.9976  49.1662          ?        ?      786.5        3.1       ?       ? 
1 1 1   34   11    7 o    406.7    2.4    0.0000   0.0000          ?        ?  1654.4095  19.7942          ?        ?      406.7        2.4       ?       ? 
1 1 1   34   11    8 o    244.9    2.7    0.0000   0.0000          ?        ?   599.5718  13.4090          ?        ?      244.9        2.7       ?       ? 
1 1 1   34   11    9 f    915.5    3.6    0.0000   0.0000          ?        ?  8383.1504  65.1292          ?        ?      915.5        3.6       ?       ? 
1 1 1   34   11   10 o    587.3    2.7    0.0000   0.0000          ?        ?  3449.2939  31.9261          ?        ?      587.3        2.7       ?       ? 
1 1 1   34   11   11 o    747.2    3.0    0.0000   0.0000          ?        ?  5583.8716  45.3350          ?        ?      747.2        3.0       ?       ? 
1 1 1   34   11   12 o    459.1    2.5    0.0000   0.0000          ?        ?  2107.7600  22.9868          ?        ?      459.1        2.5       ?       ? 
1 1 1   34   11   13 o    272.1    2.7    0.0000   0.0000          ?        ?   740.6851  14.6860          ?        ?      272.1        2.7       ?       ? 
1 1 1   34   11   14 f    560.0    2.6    0.0000   0.0000          ?        ?  3135.7798  28.7335          ?        ?      560.0        2.6       ?       ? 
1 1 1   34   11   15 o    378.7    2.4    0.0000   0.0000          ?        ?  1434.1196  17.8786          ?        ?      378.7        2.4       ?       ? 
1 1 1   34   11   16 o    257.4    2.9    0.0000   0.0000          ?        ?   662.7855  14.6860          ?        ?      257.4        2.9       ?       ? 
1 1 1   34   11   17 f    262.6    2.7    0.0000   0.0000          ?        ?   689.6033  14.0475          ?        ?      262.6        2.7       ?       ? 
1 1 1   34   11   18 o    447.3    2.4    0.0000   0.0000          ?        ?  2000.4882  21.0712          ?        ?      447.3        2.4       ?       ? 
1 1 1   34   11   19 o    422.1    2.3    0.0000   0.0000          ?        ?  1782.1139  19.7942          ?        ?      422.1        2.3       ?       ? 
1 1 1   34   11   20 o    485.0    2.4    0.0000   0.0000          ?        ?  2352.3137  23.6253          ?        ?      485.0        2.4       ?       ? 
1 1 1   34   11   21 o    552.3    2.5    0.0000   0.0000          ?        ?  3050.8562  28.0950          ?        ?      552.3        2.5       ?       ? 
1 1 1   34   11   22 o    735.7    3.0    0.0000   0.0000          ?        ?  5414.0249  43.4195          ?        ?      735.7        3.0       ?       ? 
1 1 1   34   11   23 o    436.1    2.4    0.0000   0.0000          ?        ?  1902.1559  21.0712          ?        ?      436.1        2.4       ?       ? 
1 1 1   34   11   24 o    387.8    2.5    0.0000   0.0000          ?        ?  1503.7184  19.1556          ?        ?      387.8        2.5       ?       ? 
1 1 1   34   11   25 o    637.3    2.8    0.0000   0.0000          ?        ?  4061.6360  35.1187          ?        ?      637.3        2.8       ?       ? 
1 1 1   34   11   26 o    738.5    3.0    0.0000   0.0000          ?        ?  5455.5288  44.0580          ?        ?      738.5        3.0       ?       ? 
1 1 1   34   11   27 o    148.2    5.0    0.0000   0.0000          ?        ?   219.6514  14.6860          ?        ?      148.2        5.0       ?       ? 
1 1 1   34   11   28 o    725.4    2.9    0.0000   0.0000          ?        ?  5263.3335  42.1424          ?        ?      725.4        2.9       ?       ? 
1 1 1   34   11   29 o    313.7    2.6    0.0000   0.0000          ?        ?   983.9619  16.6016          ?        ?      313.7        2.6       ?       ? 
1 1 1   34   11   30 o    181.1    4.2    0.0000   0.0000          ?        ?   328.2001  15.3245          ?        ?      181.1        4.2       ?       ? 
1 1 1   34   11   31 o    165.3    4.2    0.0000   0.0000          ?        ?   273.2873  14.0475          ?        ?      165.3        4.2       ?       ? 
1 1 1   34   11   32 o    576.2    2.7    0.0000   0.0000          ?        ?  3320.3125  30.6490          ?        ?      576.2        2.7       ?       ? 
1 1 1   34   11   33 o    234.4    3.4    0.0000   0.0000          ?        ?   549.7671  15.9630          ?        ?      234.4        3.4       ?       ? 
1 1 1   34   11   34 o    667.2    2.7    0.0000   0.0000          ?        ?  4452.4111  36.3957          ?        ?      667.2        2.7       ?       ? 
1 1 1   34   11   35 o    177.2    4.1    0.0000   0.0000          ?        ?   314.1526  14.6860          ?        ?      177.2        4.1       ?       ? 
1 1 1   34   11   36 o    635.1    2.8    0.0000   0.0000          ?        ?  4034.1794  35.7572          ?        ?      635.1        2.8       ?       ? 
1 1 1   34   11   37 o    329.5    2.8    0.0000   0.0000          ?        ?  1086.1254  18.5171          ?        ?      329.5        2.8       ?       ? 
1 1 1   34   11   38 o    101.3    7.6    0.0000   0.0000          ?        ?   102.8020  15.3245          ?        ?      101.3        7.6       ?       ? 
1 1 1   34   11   39 o    299.4    2.9    0.0000   0.0000          ?        ?   896.4843  17.2401          ?        ?      299.4        2.9       ?       ? 
1 1 1   34   11   40 o    199.1    3.8    0.0000   0.0000          ?        ?   396.5219  15.3245          ?        ?      199.1        3.8       ?       ? 
1 1 1   34   11   41 o     70.8   11.3    0.0000   0.0000          ?        ?    50.4432  15.9630          ?        ?       70.8       11.3       ?       ? 
1 1 1   34   11   42 o    356.9    2.8    0.0000   0.0000          ?        ?  1274.4893  19.7942          ?        ?      356.9        2.8       ?       ? 
1 1 1   34   11   43 o    386.2    2.6    0.0000   0.0000          ?        ?  1492.2250  20.4327          ?        ?      386.2        2.6       ?       ? 
1 1 1   34   11   44 o    378.5    2.8    0.0000   0.0000          ?        ?  1432.8425  21.0712          ?        ?      378.5        2.8       ?       ? 
1 1 1   34   11   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   11   46 o    395.8    2.7    0.0000   0.0000          ?        ?  1567.5706  21.7097          ?        ?      395.8        2.7       ?       ? 
1 1 1   34   11   47 o    437.6    2.7    0.0000   0.0000          ?        ?  1916.2035  23.6253          ?        ?      437.6        2.7       ?       ? 
1 1 1   34   11   48 o    213.9    4.0    0.0000   0.0000          ?        ?   457.8200  17.2401          ?        ?      213.9        4.0       ?       ? 
1 1 1   34   11   49 o     52.7   15.4    0.0000   0.0000          ?        ?    28.7335  17.2401          ?        ?       52.7       15.4       ?       ? 
1 1 1   34   11   50 o    320.4    3.1    0.0000   0.0000          ?        ?  1027.3812  19.7942          ?        ?      320.4        3.1       ?       ? 
1 1 1   34   11   51 o    123.0    7.5    0.0000   0.0000          ?        ?   151.9681  18.5171          ?        ?      123.0        7.5       ?       ? 
1 1 1   34   11   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   11   53 o     55.2   15.5    0.0000   0.0000          ?        ?    31.9261  17.8786          ?        ?       55.2       15.5       ?       ? 
1 1 1   34   11   54 o    170.4    5.8    0.0000   0.0000          ?        ?   291.1659  19.7942          ?        ?      170.4        5.8       ?       ? 
1 1 1   34   11   55 o    291.0    3.5    0.0000   0.0000          ?        ?   847.9567  20.4327          ?        ?      291.0        3.5       ?       ? 
1 1 1   34   11   56 o     41.9   15.9    0.0000   0.0000          ?        ?    12.7704  18.5171          ?        ?       41.9       15.9       ?       ? 
1 1 1   34   11   57 o    253.4    3.9    0.0000   0.0000          ?        ?   642.9913  19.7942          ?        ?      253.4        3.9       ?       ? 
1 1 1   34   11   58 f    124.2    7.5    0.0000   0.0000          ?        ?   155.1608  18.5171          ?        ?      124.2        7.5       ?       ? 
1 1 1   34   11   59 o     37.6   15.6    0.0000   0.0000          ?        ?     4.4697  19.1556          ?        ?       37.6       15.6       ?       ? 
1 1 1   34   11   60 o    121.8    7.9    0.0000   0.0000          ?        ?   149.4141  19.1556          ?        ?      121.8        7.9       ?       ? 
1 1 1   34   11   61 f    218.2    4.7    0.0000   0.0000          ?        ?   477.6142  20.4327          ?        ?      218.2        4.7       ?       ? 
1 1 1   34   11   62 o    142.7    6.9    0.0000   0.0000          ?        ?   204.9654  19.7942          ?        ?      142.7        6.9       ?       ? 
1 1 1   34   11   63 o     65.4   15.0    0.0000   0.0000          ?        ?    45.9736  19.1556          ?        ?       65.4       15.0       ?       ? 
1 1 1   34   11   64 o    122.8    8.1    0.0000   0.0000          ?        ?   152.6067  19.7942          ?        ?      122.8        8.1       ?       ? 
1 1 1   34   11   65 o     78.3   12.2    0.0000   0.0000          ?        ?    63.2136  19.1556          ?        ?       78.3       12.2       ?       ? 
1 1 1   34   12    0 o    298.1    3.5  888.8221  21.0712   888.8221  21.0712   888.8221  21.0712      298.1      3.5      298.1        3.5     0.0     0.0 
1 1 1   34   12    1 o    507.1    2.5    0.0000   0.0000          ?        ?  2571.9651  25.5409          ?        ?      507.1        2.5       ?       ? 
1 1 1   34   12    2 o    311.5    2.4    0.0000   0.0000          ?        ?   970.5529  14.6860          ?        ?      311.5        2.4       ?       ? 
1 1 1   34   12    3 o   1037.2    3.9    0.0000   0.0000          ?        ? 10760.3662  81.7308          ?        ?     1037.2        3.9       ?       ? 
1 1 1   34   12    4 f   1307.7    4.6    0.0000   0.0000          ?        ? 17104.0781 121.3191          ?        ?     1307.7        4.6       ?       ? 
1 1 1   34   12    5 o    633.3    3.0    0.0000   0.0000          ?        ?  4011.1929  37.6728          ?        ?      633.3        3.0       ?       ? 
1 1 1   34   12    6 o    813.4    3.1    0.0000   0.0000          ?        ?  6617.0000  50.4432          ?        ?      813.4        3.1       ?       ? 
1 1 1   34   12    7 o    406.3    2.4    0.0000   0.0000          ?        ?  1650.5784  19.7942          ?        ?      406.3        2.4       ?       ? 
1 1 1   34   12    8 o    668.8    2.9    0.0000   0.0000          ?        ?  4473.4824  38.3113          ?        ?      668.8        2.9       ?       ? 
1 1 1   34   12    9 o    382.2    2.4    0.0000   0.0000          ?        ?  1460.9375  18.5171          ?        ?      382.2        2.4       ?       ? 
1 1 1   34   12   10 o    165.9    3.5    0.0000   0.0000          ?        ?   275.2028  11.4934          ?        ?      165.9        3.5       ?       ? 
1 1 1   34   12   11 o    635.3    2.8    0.0000   0.0000          ?        ?  4036.0950  35.1187          ?        ?      635.3        2.8       ?       ? 
1 1 1   34   12   12 o    449.7    2.4    0.0000   0.0000          ?        ?  2022.1981  21.7097          ?        ?      449.7        2.4       ?       ? 
1 1 1   34   12   13 o    168.6    3.4    0.0000   0.0000          ?        ?   284.1421  11.4934          ?        ?      168.6        3.4       ?       ? 
1 1 1   34   12   14 o    430.5    2.4    0.0000   0.0000          ?        ?  1853.6282  21.0712          ?        ?      430.5        2.4       ?       ? 
1 1 1   34   12   15 f    259.5    2.6    0.0000   0.0000          ?        ?   673.6403  13.4090          ?        ?      259.5        2.6       ?       ? 
1 1 1   34   12   16 o    717.7    2.9    0.0000   0.0000          ?        ?  5151.5923  42.1424          ?        ?      717.7        2.9       ?       ? 
1 1 1   34   12   17 o    306.4    2.5    0.0000   0.0000          ?        ?   938.6268  15.3245          ?        ?      306.4        2.5       ?       ? 
1 1 1   34   12   18 o    581.1    2.6    0.0000   0.0000          ?        ?  3377.1411  30.0105          ?        ?      581.1        2.6       ?       ? 
1 1 1   34   12   19 o    444.0    2.4    0.0000   0.0000          ?        ?  1971.1163  21.7097          ?        ?      444.0        2.4       ?       ? 
1 1 1   34   12   20 o    373.2    2.4    0.0000   0.0000          ?        ?  1393.2542  17.8786          ?        ?      373.2        2.4       ?       ? 
1 1 1   34   12   21 o    446.6    2.4    0.0000   0.0000          ?        ?  1994.7416  21.7097          ?        ?      446.6        2.4       ?       ? 
1 1 1   34   12   22 o    159.0    4.0    0.0000   0.0000          ?        ?   252.8546  12.7704          ?        ?      159.0        4.0       ?       ? 
1 1 1   34   12   23 o    205.0    3.3    0.0000   0.0000          ?        ?   420.1472  13.4090          ?        ?      205.0        3.3       ?       ? 
1 1 1   34   12   24 o    397.8    2.4    0.0000   0.0000          ?        ?  1582.8950  19.1556          ?        ?      397.8        2.4       ?       ? 
1 1 1   34   12   25 o    478.1    2.5    0.0000   0.0000          ?        ?  2286.5459  24.2638          ?        ?      478.1        2.5       ?       ? 
1 1 1   34   12   26 o    387.7    2.5    0.0000   0.0000          ?        ?  1503.0798  19.1556          ?        ?      387.7        2.5       ?       ? 
1 1 1   34   12   27 o    839.6    3.3    0.0000   0.0000          ?        ?  7051.1948  55.5514          ?        ?      839.6        3.3       ?       ? 
1 1 1   34   12   28 o    229.1    2.9    0.0000   0.0000          ?        ?   524.8647  13.4090          ?        ?      229.1        2.9       ?       ? 
1 1 1   34   12   29 f     19.2    9.5    0.0000   0.0000          ?        ?   -34.4802  14.0475          ?        ?       19.2        9.5       ?       ? 
1 1 1   34   12   30 o    385.4    2.5    0.0000   0.0000          ?        ?  1485.8398  19.1556          ?        ?      385.4        2.5       ?       ? 
1 1 1   34   12   31 o    398.5    2.6    0.0000   0.0000          ?        ?  1588.6418  20.4327          ?        ?      398.5        2.6       ?       ? 
1 1 1   34   12   32 o    662.5    2.8    0.0000   0.0000          ?        ?  4389.8364  37.0343          ?        ?      662.5        2.8       ?       ? 
1 1 1   34   12   33 o    397.0    2.6    0.0000   0.0000          ?        ?  1576.5099  20.4327          ?        ?      397.0        2.6       ?       ? 
1 1 1   34   12   34 o    632.1    2.8    0.0000   0.0000          ?        ?  3996.5071  35.1187          ?        ?      632.1        2.8       ?       ? 
1 1 1   34   12   35 o    438.1    2.6    0.0000   0.0000          ?        ?  1919.3960  22.3483          ?        ?      438.1        2.6       ?       ? 
1 1 1   34   12   36 o    548.7    2.7    0.0000   0.0000          ?        ?  3011.2681  29.3720          ?        ?      548.7        2.7       ?       ? 
1 1 1   34   12   37 o    151.1    4.9    0.0000   0.0000          ?        ?   228.5907  14.6860          ?        ?      151.1        4.9       ?       ? 
1 1 1   34   12   38 o    373.9    2.6    0.0000   0.0000          ?        ?  1398.3623  19.1556          ?        ?      373.9        2.6       ?       ? 
1 1 1   34   12   39 o    191.5    4.0    0.0000   0.0000          ?        ?   367.1499  15.3245          ?        ?      191.5        4.0       ?       ? 
1 1 1   34   12   40 o    350.8    2.6    0.0000   0.0000          ?        ?  1231.0697  18.5171          ?        ?      350.8        2.6       ?       ? 
1 1 1   34   12   41 o    271.7    3.1    0.0000   0.0000          ?        ?   738.7695  16.6016          ?        ?      271.7        3.1       ?       ? 
1 1 1   34   12   42 o    358.5    2.8    0.0000   0.0000          ?        ?  1285.3440  19.7942          ?        ?      358.5        2.8       ?       ? 
1 1 1   34   12   43 o     21.7   10.6    0.0000   0.0000          ?        ?   -29.3720  15.3245          ?        ?       21.7       10.6       ?       ? 
1 1 1   34   12   44 o    269.7    3.3    0.0000   0.0000          ?        ?   727.9147  17.8786          ?        ?      269.7        3.3       ?       ? 
1 1 1   34   12   45 o     25.7   12.1    0.0000   0.0000          ?        ?   -17.2401  15.9630          ?        ?       25.7       12.1       ?       ? 
1 1 1   34   12   46 o    288.2    3.2    0.0000   0.0000          ?        ?   831.3552  18.5171          ?        ?      288.2        3.2       ?       ? 
1 1 1   34   12   47 o    238.4    3.7    0.0000   0.0000          ?        ?   568.9227  17.8786          ?        ?      238.4        3.7       ?       ? 
1 1 1   34   12   48 o    363.0    3.1    0.0000   0.0000          ?        ?  1318.5471  22.3483          ?        ?      363.0        3.1       ?       ? 
1 1 1   34   12   49 o     33.3   14.5    0.0000   0.0000          ?        ?    -2.5541  17.8786          ?        ?       33.3       14.5       ?       ? 
1 1 1   34   12   50 o    113.0    7.9    0.0000   0.0000          ?        ?   128.3428  17.8786          ?        ?      113.0        7.9       ?       ? 
1 1 1   34   12   51 o    128.9    6.7    0.0000   0.0000          ?        ?   166.6541  17.2401          ?        ?      128.9        6.7       ?       ? 
1 1 1   34   12   52 o    189.1    4.7    0.0000   0.0000          ?        ?   358.2106  17.8786          ?        ?      189.1        4.7       ?       ? 
1 1 1   34   12   53 o    104.8    8.8    0.0000   0.0000          ?        ?   110.4642  18.5171          ?        ?      104.8        8.8       ?       ? 
1 1 1   34   12   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   12   55 o    178.8    5.4    0.0000   0.0000          ?        ?   320.5379  19.1556          ?        ?      178.8        5.4       ?       ? 
1 1 1   34   12   56 o    319.8    3.3    0.0000   0.0000          ?        ?  1023.5502  21.0712          ?        ?      319.8        3.3       ?       ? 
1 1 1   34   12   57 o    204.4    4.7    0.0000   0.0000          ?        ?   418.8702  19.1556          ?        ?      204.4        4.7       ?       ? 
1 1 1   34   12   58 o     29.2   13.5    0.0000   0.0000          ?        ?   -14.6860  18.5171          ?        ?       29.2       13.5       ?       ? 
1 1 1   34   12   59 o    158.5    6.0    0.0000   0.0000          ?        ?   252.2160  19.1556          ?        ?      158.5        6.0       ?       ? 
1 1 1   34   12   60 o    165.9    6.0    0.0000   0.0000          ?        ?   276.4799  19.7942          ?        ?      165.9        6.0       ?       ? 
1 1 1   34   12   61 o    122.7    7.8    0.0000   0.0000          ?        ?   151.9681  19.1556          ?        ?      122.7        7.8       ?       ? 
1 1 1   34   12   62 o     48.9   16.5    0.0000   0.0000          ?        ?    23.6253  19.1556          ?        ?       48.9       16.5       ?       ? 
1 1 1   34   12   63 o     21.9   10.9    0.0000   0.0000          ?        ?   -48.5276  19.1556          ?        ?       21.9       10.9       ?       ? 
1 1 1   34   12   64 o     92.6   10.3    0.0000   0.0000          ?        ?    87.4775  19.1556          ?        ?       92.6       10.3       ?       ? 
1 1 1   34   13    0 o    169.2    8.7  288.6118  29.3720   288.6118  29.3720   288.6118  29.3720      169.2      8.7      169.2        8.7     0.0     0.0 
1 1 1   34   13    1 o    864.9    3.6    0.0000   0.0000          ?        ?  7481.5576  61.9366          ?        ?      864.9        3.6       ?       ? 
1 1 1   34   13    2 o    231.3    3.5    0.0000   0.0000          ?        ?   535.0811  15.9630          ?        ?      231.3        3.5       ?       ? 
1 1 1   34   13    3 o    755.6    3.2    0.0000   0.0000          ?        ?  5709.6606  47.8891          ?        ?      755.6        3.2       ?       ? 
1 1 1   34   13    4 o    163.9    4.3    0.0000   0.0000          ?        ?   268.8176  14.0475          ?        ?      163.9        4.3       ?       ? 
1 1 1   34   13    5 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   13    6 o    410.2    2.4    0.0000   0.0000          ?        ?  1682.5045  19.7942          ?        ?      410.2        2.4       ?       ? 
1 1 1   34   13    7 o    425.7    2.4    0.0000   0.0000          ?        ?  1812.7628  20.4327          ?        ?      425.7        2.4       ?       ? 
1 1 1   34   13    8 o    894.2    3.5    0.0000   0.0000          ?        ?  7997.4834  63.2136          ?        ?      894.2        3.5       ?       ? 
1 1 1   34   13    9 o    635.2    2.7    0.0000   0.0000          ?        ?  4034.8184  34.4802          ?        ?      635.2        2.7       ?       ? 
1 1 1   34   13   10 o    119.8    4.0    0.0000   0.0000          ?        ?   143.6674   9.5778          ?        ?      119.8        4.0       ?       ? 
1 1 1   34   13   11 o    440.7    2.4    0.0000   0.0000          ?        ?  1942.3828  21.0712          ?        ?      440.7        2.4       ?       ? 
1 1 1   34   13   12 o    941.3    3.5    0.0000   0.0000          ?        ?  8862.0420  65.7677          ?        ?      941.3        3.5       ?       ? 
1 1 1   34   13   13 o    507.1    2.5    0.0000   0.0000          ?        ?  2571.9651  25.5409          ?        ?      507.1        2.5       ?       ? 
1 1 1   34   13   14 o    159.6    3.4    0.0000   0.0000          ?        ?   254.7701  10.8549          ?        ?      159.6        3.4       ?       ? 
1 1 1   34   13   15 o    225.2    2.7    0.0000   0.0000          ?        ?   506.9862  12.1319          ?        ?      225.2        2.7       ?       ? 
1 1 1   34   13   16 o    834.5    3.2    0.0000   0.0000          ?        ?  6965.6328  53.6358          ?        ?      834.5        3.2       ?       ? 
1 1 1   34   13   17 o    448.5    2.3    0.0000   0.0000          ?        ?  2011.9817  21.0712          ?        ?      448.5        2.3       ?       ? 
1 1 1   34   13   18 o    655.6    2.8    0.0000   0.0000          ?        ?  4299.1660  37.0343          ?        ?      655.6        2.8       ?       ? 
1 1 1   34   13   19 o    573.2    2.7    0.0000   0.0000          ?        ?  3285.8320  30.6490          ?        ?      573.2        2.7       ?       ? 
1 1 1   34   13   20 o    611.8    2.6    0.0000   0.0000          ?        ?  3743.0139  31.9261          ?        ?      611.8        2.6       ?       ? 
1 1 1   34   13   21 o    443.1    2.4    0.0000   0.0000          ?        ?  1963.4540  21.0712          ?        ?      443.1        2.4       ?       ? 
1 1 1   34   13   22 o    498.8    2.4    0.0000   0.0000          ?        ?  2488.3188  24.2638          ?        ?      498.8        2.4       ?       ? 
1 1 1   34   13   23 o    817.2    3.1    0.0000   0.0000          ?        ?  6679.5747  51.0817          ?        ?      817.2        3.1       ?       ? 
1 1 1   34   13   24 o    514.5    2.5    0.0000   0.0000          ?        ?  2647.3108  25.5409          ?        ?      514.5        2.5       ?       ? 
1 1 1   34   13   25 o    159.0    4.2    0.0000   0.0000          ?        ?   252.8546  13.4090          ?        ?      159.0        4.2       ?       ? 
1 1 1   34   13   26 o     50.7   13.1    0.0000   0.0000          ?        ?    26.8179  13.4090          ?        ?       50.7       13.1       ?       ? 
1 1 1   34   13   27 o    546.2    2.7    0.0000   0.0000          ?        ?  2983.8115  29.3720          ?        ?      546.2        2.7       ?       ? 
1 1 1   34   13   28 o    229.2    3.2    0.0000   0.0000          ?        ?   525.5033  14.6860          ?        ?      229.2        3.2       ?       ? 
1 1 1   34   13   29 o    107.7    6.2    0.0000   0.0000          ?        ?   116.2109  13.4090          ?        ?      107.7        6.2       ?       ? 
1 1 1   34   13   30 o    342.1    2.5    0.0000   0.0000          ?        ?  1170.4102  17.2401          ?        ?      342.1        2.5       ?       ? 
1 1 1   34   13   31 o    485.0    2.6    0.0000   0.0000          ?        ?  2352.3137  24.9023          ?        ?      485.0        2.6       ?       ? 
1 1 1   34   13   32 o    474.4    2.5    0.0000   0.0000          ?        ?  2251.4272  23.6253          ?        ?      474.4        2.5       ?       ? 
1 1 1   34   13   33 o    411.6    2.5    0.0000   0.0000          ?        ?  1694.6364  20.4327          ?        ?      411.6        2.5       ?       ? 
1 1 1   34   13   34 o    390.3    2.5    0.0000   0.0000          ?        ?  1523.5127  19.7942          ?        ?      390.3        2.5       ?       ? 
1 1 1   34   13   35 o    260.7    3.1    0.0000   0.0000          ?        ?   680.0255  15.9630          ?        ?      260.7        3.1       ?       ? 
1 1 1   34   13   36 f    289.3    2.9    0.0000   0.0000          ?        ?   837.1019  16.6016          ?        ?      289.3        2.9       ?       ? 
1 1 1   34   13   37 o    142.2    5.4    0.0000   0.0000          ?        ?   202.4114  15.3245          ?        ?      142.2        5.4       ?       ? 
1 1 1   34   13   38 o    218.0    3.7    0.0000   0.0000          ?        ?   475.6986  15.9630          ?        ?      218.0        3.7       ?       ? 
1 1 1   34   13   39 o    292.5    2.8    0.0000   0.0000          ?        ?   855.6190  16.6016          ?        ?      292.5        2.8       ?       ? 
1 1 1   34   13   40 f    102.5    7.2    0.0000   0.0000          ?        ?   105.3561  14.6860          ?        ?      102.5        7.2       ?       ? 
1 1 1   34   13   41 o     29.5   12.9    0.0000   0.0000          ?        ?    -3.8311  14.6860          ?        ?       29.5       12.9       ?       ? 
1 1 1   34   13   42 o    187.0    4.4    0.0000   0.0000          ?        ?   349.9099  16.6016          ?        ?      187.0        4.4       ?       ? 
1 1 1   34   13   43 o     36.2   14.5    0.0000   0.0000          ?        ?     6.3852  15.9630          ?        ?       36.2       14.5       ?       ? 
1 1 1   34   13   44 o    242.5    3.7    0.0000   0.0000          ?        ?   588.7169  17.8786          ?        ?      242.5        3.7       ?       ? 
1 1 1   34   13   45 o     26.5   12.4    0.0000   0.0000          ?        ?   -14.6860  15.9630          ?        ?       26.5       12.4       ?       ? 
1 1 1   34   13   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   13   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   13   48 o    261.5    3.5    0.0000   0.0000          ?        ?   684.4952  18.5171          ?        ?      261.5        3.5       ?       ? 
1 1 1   34   13   49 o    242.2    4.0    0.0000   0.0000          ?        ?   587.4399  19.1556          ?        ?      242.2        4.0       ?       ? 
1 1 1   34   13   50 o    260.8    3.4    0.0000   0.0000          ?        ?   680.6641  17.8786          ?        ?      260.8        3.4       ?       ? 
1 1 1   34   13   51 f    178.5    5.2    0.0000   0.0000          ?        ?   319.2608  18.5171          ?        ?      178.5        5.2       ?       ? 
1 1 1   34   13   52 o    145.6    6.4    0.0000   0.0000          ?        ?   212.6277  18.5171          ?        ?      145.6        6.4       ?       ? 
1 1 1   34   13   53 o    111.6    8.0    0.0000   0.0000          ?        ?   125.1502  17.8786          ?        ?      111.6        8.0       ?       ? 
1 1 1   34   13   54 o     83.0   10.8    0.0000   0.0000          ?        ?    69.5989  17.8786          ?        ?       83.0       10.8       ?       ? 
1 1 1   34   13   55 o     79.4   11.3    0.0000   0.0000          ?        ?    63.8522  17.8786          ?        ?       79.4       11.3       ?       ? 
1 1 1   34   13   56 o    237.9    4.2    0.0000   0.0000          ?        ?   567.0072  19.7942          ?        ?      237.9        4.2       ?       ? 
1 1 1   34   13   57 o    104.6    9.5    0.0000   0.0000          ?        ?   110.4642  19.7942          ?        ?      104.6        9.5       ?       ? 
1 1 1   34   13   58 o    198.5    5.0    0.0000   0.0000          ?        ?   395.2449  19.7942          ?        ?      198.5        5.0       ?       ? 
1 1 1   34   13   59 o     35.8   15.1    0.0000   0.0000          ?        ?     1.9156  18.5171          ?        ?       35.8       15.1       ?       ? 
1 1 1   34   13   60 o    103.8    9.5    0.0000   0.0000          ?        ?   109.1872  19.7942          ?        ?      103.8        9.5       ?       ? 
1 1 1   34   13   61 o    124.5    7.7    0.0000   0.0000          ?        ?   156.4378  19.1556          ?        ?      124.5        7.7       ?       ? 
1 1 1   34   13   62 o     63.9   15.2    0.0000   0.0000          ?        ?    44.0580  19.1556          ?        ?       63.9       15.2       ?       ? 
1 1 1   34   13   63 o    117.8    7.9    0.0000   0.0000          ?        ?   140.4748  18.5171          ?        ?      117.8        7.9       ?       ? 
1 1 1   34   13   64 o    145.1    6.8    0.0000   0.0000          ?        ?   212.6277  19.7942          ?        ?      145.1        6.8       ?       ? 
1 1 1   34   14    0 o     35.6   19.6   17.8786  19.7942    17.8786  19.7942    17.8786  19.7942       35.6     19.6       35.6       19.6     0.0     0.0 
1 1 1   34   14    1 o     60.4   11.0    0.0000   0.0000          ?        ?    37.6728  12.7704          ?        ?       60.4       11.0       ?       ? 
1 1 1   34   14    2 o    631.2    3.0    0.0000   0.0000          ?        ?  3985.0134  38.3113          ?        ?      631.2        3.0       ?       ? 
1 1 1   34   14    3 o    378.4    2.4    0.0000   0.0000          ?        ?  1432.2040  18.5171          ?        ?      378.4        2.4       ?       ? 
1 1 1   34   14    4 o    411.5    2.6    0.0000   0.0000          ?        ?  1693.3594  21.0712          ?        ?      411.5        2.6       ?       ? 
1 1 1   34   14    5 o    522.7    2.6    0.0000   0.0000          ?        ?  2732.2339  26.8179          ?        ?      522.7        2.6       ?       ? 
1 1 1   34   14    6 o    642.0    2.8    0.0000   0.0000          ?        ?  4121.6572  35.7572          ?        ?      642.0        2.8       ?       ? 
1 1 1   34   14    7 o    980.6    3.7    0.0000   0.0000          ?        ?  9617.4121  72.1529          ?        ?      980.6        3.7       ?       ? 
1 1 1   34   14    8 o    577.2    2.7    0.0000   0.0000          ?        ?  3331.8057  30.6490          ?        ?      577.2        2.7       ?       ? 
1 1 1   34   14    9 o    333.0    2.2    0.0000   0.0000          ?        ?  1109.1121  14.6860          ?        ?      333.0        2.2       ?       ? 
1 1 1   34   14   10 o    286.1    2.2    0.0000   0.0000          ?        ?   818.5847  12.7704          ?        ?      286.1        2.2       ?       ? 
1 1 1   34   14   11 o    788.2    3.0    0.0000   0.0000          ?        ?  6213.4536  47.8891          ?        ?      788.2        3.0       ?       ? 
1 1 1   34   14   12 o    304.7    2.4    0.0000   0.0000          ?        ?   928.4104  14.6860          ?        ?      304.7        2.4       ?       ? 
1 1 1   34   14   13 o    265.1    2.4    0.0000   0.0000          ?        ?   703.0123  12.7704          ?        ?      265.1        2.4       ?       ? 
1 1 1   34   14   14 o    520.5    2.5    0.0000   0.0000          ?        ?  2709.8857  25.5409          ?        ?      520.5        2.5       ?       ? 
1 1 1   34   14   15 o    519.7    2.5    0.0000   0.0000          ?        ?  2701.5850  26.1794          ?        ?      519.7        2.5       ?       ? 
1 1 1   34   14   16 o    254.2    2.8    0.0000   0.0000          ?        ?   646.1838  14.0475          ?        ?      254.2        2.8       ?       ? 
1 1 1   34   14   17 o    698.4    3.0    0.0000   0.0000          ?        ?  4878.3052  41.5039          ?        ?      698.4        3.0       ?       ? 
1 1 1   34   14   18 o    502.6    2.5    0.0000   0.0000          ?        ?  2526.6301  25.5409          ?        ?      502.6        2.5       ?       ? 
1 1 1   34   14   19 f    368.1    2.5    0.0000   0.0000          ?        ?  1354.9429  18.5171          ?        ?      368.1        2.5       ?       ? 
1 1 1   34   14   20 o    656.6    2.8    0.0000   0.0000          ?        ?  4311.9365  36.3957          ?        ?      656.6        2.8       ?       ? 
1 1 1   34   14   21 o     26.7   11.9    0.0000   0.0000          ?        ?    -5.1082  12.7704          ?        ?       26.7       11.9       ?       ? 
1 1 1   34   14   22 o    422.0    2.5    0.0000   0.0000          ?        ?  1780.8368  21.0712          ?        ?      422.0        2.5       ?       ? 
1 1 1   34   14   23 o    110.4    5.8    0.0000   0.0000          ?        ?   121.9576  12.7704          ?        ?      110.4        5.8       ?       ? 
1 1 1   34   14   24 o    254.6    2.6    0.0000   0.0000          ?        ?   648.0994  13.4090          ?        ?      254.6        2.6       ?       ? 
1 1 1   34   14   25 o    516.6    2.5    0.0000   0.0000          ?        ?  2669.0205  26.1794          ?        ?      516.6        2.5       ?       ? 
1 1 1   34   14   26 o    588.3    2.6    0.0000   0.0000          ?        ?  3462.0645  30.6490          ?        ?      588.3        2.6       ?       ? 
1 1 1   34   14   27 f    410.8    2.4    0.0000   0.0000          ?        ?  1688.2511  19.7942          ?        ?      410.8        2.4       ?       ? 
1 1 1   34   14   28 o    742.6    3.1    0.0000   0.0000          ?        ?  5516.1885  45.3350          ?        ?      742.6        3.1       ?       ? 
1 1 1   34   14   29 f    599.6    2.7    0.0000   0.0000          ?        ?  3595.5151  31.9261          ?        ?      599.6        2.7       ?       ? 
1 1 1   34   14   30 o     18.3    9.1    0.0000   0.0000          ?        ?   -35.1187  13.4090          ?        ?       18.3        9.1       ?       ? 
1 1 1   34   14   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   14   32 o    493.1    2.5    0.0000   0.0000          ?        ?  2431.4902  24.2638          ?        ?      493.1        2.5       ?       ? 
1 1 1   34   14   33 o    596.6    2.7    0.0000   0.0000          ?        ?  3559.7581  32.5646          ?        ?      596.6        2.7       ?       ? 
1 1 1   34   14   34 o    442.8    2.5    0.0000   0.0000          ?        ?  1961.5386  22.3483          ?        ?      442.8        2.5       ?       ? 
1 1 1   34   14   35 o    356.5    2.6    0.0000   0.0000          ?        ?  1271.2966  18.5171          ?        ?      356.5        2.6       ?       ? 
1 1 1   34   14   36 o    223.7    3.6    0.0000   0.0000          ?        ?   500.6010  15.9630          ?        ?      223.7        3.6       ?       ? 
1 1 1   34   14   37 o     91.3    8.4    0.0000   0.0000          ?        ?    83.6463  15.3245          ?        ?       91.3        8.4       ?       ? 
1 1 1   34   14   38 o    309.2    2.8    0.0000   0.0000          ?        ?   956.5054  17.2401          ?        ?      309.2        2.8       ?       ? 
1 1 1   34   14   39 o     43.1   14.8    0.0000   0.0000          ?        ?    17.2401  15.3245          ?        ?       43.1       14.8       ?       ? 
1 1 1   34   14   40 o    280.2    3.1    0.0000   0.0000          ?        ?   785.3816  17.2401          ?        ?      280.2        3.1       ?       ? 
1 1 1   34   14   41 o    227.2    3.7    0.0000   0.0000          ?        ?   516.5640  16.6016          ?        ?      227.2        3.7       ?       ? 
1 1 1   34   14   42 o    364.2    2.6    0.0000   0.0000          ?        ?  1326.8479  19.1556          ?        ?      364.2        2.6       ?       ? 
1 1 1   34   14   43 o     24.0   11.5    0.0000   0.0000          ?        ?   -22.9868  15.9630          ?        ?       24.0       11.5       ?       ? 
1 1 1   34   14   44 o    183.7    4.7    0.0000   0.0000          ?        ?   337.7780  17.2401          ?        ?      183.7        4.7       ?       ? 
1 1 1   34   14   45 o     86.9    9.5    0.0000   0.0000          ?        ?    75.9841  16.6016          ?        ?       86.9        9.5       ?       ? 
1 1 1   34   14   46 f    208.3    4.1    0.0000   0.0000          ?        ?   434.1947  17.2401          ?        ?      208.3        4.1       ?       ? 
1 1 1   34   14   47 o    307.0    3.1    0.0000   0.0000          ?        ?   943.0964  19.1556          ?        ?      307.0        3.1       ?       ? 
1 1 1   34   14   48 o    148.7    6.0    0.0000   0.0000          ?        ?   221.5670  17.8786          ?        ?      148.7        6.0       ?       ? 
1 1 1   34   14   49 o     75.8   11.8    0.0000   0.0000          ?        ?    58.1055  17.8786          ?        ?       75.8       11.8       ?       ? 
1 1 1   34   14   50 o    388.2    2.9    0.0000   0.0000          ?        ?  1508.1881  22.3483          ?        ?      388.2        2.9       ?       ? 
1 1 1   34   14   51 o    417.9    2.8    0.0000   0.0000          ?        ?  1747.6338  22.9868          ?        ?      417.9        2.8       ?       ? 
1 1 1   34   14   52 o     48.4   15.9    0.0000   0.0000          ?        ?    22.9868  17.8786          ?        ?       48.4       15.9       ?       ? 
1 1 1   34   14   53 o    289.5    3.5    0.0000   0.0000          ?        ?   839.0174  20.4327          ?        ?      289.5        3.5       ?       ? 
1 1 1   34   14   54 o     22.2   11.0    0.0000   0.0000          ?        ?   -40.2269  17.8786          ?        ?       22.2       11.0       ?       ? 
1 1 1   34   14   55 o     88.8   10.8    0.0000   0.0000          ?        ?    79.8152  19.1556          ?        ?       88.8       10.8       ?       ? 
1 1 1   34   14   56 o    271.1    3.7    0.0000   0.0000          ?        ?   736.2155  19.7942          ?        ?      271.1        3.7       ?       ? 
1 1 1   34   14   57 o     83.6   11.1    0.0000   0.0000          ?        ?    70.8759  18.5171          ?        ?       83.6       11.1       ?       ? 
1 1 1   34   14   58 o     35.8   15.1    0.0000   0.0000          ?        ?     1.9156  18.5171          ?        ?       35.8       15.1       ?       ? 
1 1 1   34   14   59 f     20.5   10.3    0.0000   0.0000          ?        ?   -54.2743  18.5171          ?        ?       20.5       10.3       ?       ? 
1 1 1   34   14   60 o     28.6   13.4    0.0000   0.0000          ?        ?   -20.4327  19.7942          ?        ?       28.6       13.4       ?       ? 
1 1 1   34   14   61 o     48.8   16.5    0.0000   0.0000          ?        ?    23.6253  19.1556          ?        ?       48.8       16.5       ?       ? 
1 1 1   34   14   62 o    108.5    8.5    0.0000   0.0000          ?        ?   119.4035  18.5171          ?        ?      108.5        8.5       ?       ? 
1 1 1   34   14   63 o    149.9    6.4    0.0000   0.0000          ?        ?   226.6752  19.1556          ?        ?      149.9        6.4       ?       ? 
1 1 1   34   15    0 o   1410.5    8.0 19906.5508 226.0367 19906.5508 226.0367 19906.5508 226.0367     1410.5      8.0     1410.5        8.0     0.0     0.0 
1 1 1   34   15    1 o    491.4    2.9    0.0000   0.0000          ?        ?  2414.8889  28.0950          ?        ?      491.4        2.9       ?       ? 
1 1 1   34   15    2 o    203.4    3.3    0.0000   0.0000          ?        ?   413.7620  13.4090          ?        ?      203.4        3.3       ?       ? 
1 1 1   34   15    3 o    391.8    2.7    0.0000   0.0000          ?        ?  1535.0060  21.0712          ?        ?      391.8        2.7       ?       ? 
1 1 1   34   15    4 o    798.3    3.4    0.0000   0.0000          ?        ?  6373.7231  54.2743          ?        ?      798.3        3.4       ?       ? 
1 1 1   34   15    5 o    476.8    2.5    0.0000   0.0000          ?        ?  2273.1370  24.2638          ?        ?      476.8        2.5       ?       ? 
1 1 1   34   15    6 o    448.5    2.4    0.0000   0.0000          ?        ?  2011.3431  21.7097          ?        ?      448.5        2.4       ?       ? 
1 1 1   34   15    7 o     30.5   12.7    0.0000   0.0000          ?        ?     1.9156  12.7704          ?        ?       30.5       12.7       ?       ? 
1 1 1   34   15    8 o     16.5    8.3    0.0000   0.0000          ?        ?   -45.9736  13.4090          ?        ?       16.5        8.3       ?       ? 
1 1 1   34   15    9 o    520.4    2.5    0.0000   0.0000          ?        ?  2707.9702  25.5409          ?        ?      520.4        2.5       ?       ? 
1 1 1   34   15   10 o     36.0   12.1    0.0000   0.0000          ?        ?    12.1319  10.2163          ?        ?       36.0       12.1       ?       ? 
1 1 1   34   15   11 o    783.6    3.1    0.0000   0.0000          ?        ?  6140.6626  49.1662          ?        ?      783.6        3.1       ?       ? 
1 1 1   34   15   12 o    344.6    2.2    0.0000   0.0000          ?        ?  1187.6503  15.3245          ?        ?      344.6        2.2       ?       ? 
1 1 1   34   15   13 o    366.6    2.3    0.0000   0.0000          ?        ?  1344.0880  16.6016          ?        ?      366.6        2.3       ?       ? 
1 1 1   34   15   14 o    568.1    2.6    0.0000   0.0000          ?        ?  3227.7268  29.3720          ?        ?      568.1        2.6       ?       ? 
1 1 1   34   15   15 o    346.4    2.5    0.0000   0.0000          ?        ?  1199.7821  17.2401          ?        ?      346.4        2.5       ?       ? 
1 1 1   34   15   16 o    277.9    2.5    0.0000   0.0000          ?        ?   772.6111  14.0475          ?        ?      277.9        2.5       ?       ? 
1 1 1   34   15   17 f    189.4    3.2    0.0000   0.0000          ?        ?   358.8492  12.1319          ?        ?      189.4        3.2       ?       ? 
1 1 1   34   15   18 o     84.5    6.8    0.0000   0.0000          ?        ?    71.5144  11.4934          ?        ?       84.5        6.8       ?       ? 
1 1 1   34   15   19 o    187.7    3.2    0.0000   0.0000          ?        ?   352.4639  12.1319          ?        ?      187.7        3.2       ?       ? 
1 1 1   34   15   20 o    290.5    2.4    0.0000   0.0000          ?        ?   844.1255  14.0475          ?        ?      290.5        2.4       ?       ? 
1 1 1   34   15   21 o    220.6    2.9    0.0000   0.0000          ?        ?   486.5535  12.7704          ?        ?      220.6        2.9       ?       ? 
1 1 1   34   15   22 o    304.5    2.4    0.0000   0.0000          ?        ?   927.1334  14.6860          ?        ?      304.5        2.4       ?       ? 
1 1 1   34   15   23 o    215.7    3.0    0.0000   0.0000          ?        ?   465.4823  12.7704          ?        ?      215.7        3.0       ?       ? 
1 1 1   34   15   24 o    566.5    2.5    0.0000   0.0000          ?        ?  3209.8484  28.7335          ?        ?      566.5        2.5       ?       ? 
1 1 1   34   15   25 o    191.6    3.7    0.0000   0.0000          ?        ?   367.1499  14.0475          ?        ?      191.6        3.7       ?       ? 
1 1 1   34   15   26 o    367.4    2.4    0.0000   0.0000          ?        ?  1349.8347  17.8786          ?        ?      367.4        2.4       ?       ? 
1 1 1   34   15   27 o    356.0    2.4    0.0000   0.0000          ?        ?  1267.4655  17.2401          ?        ?      356.0        2.4       ?       ? 
1 1 1   34   15   28 o    231.7    3.2    0.0000   0.0000          ?        ?   536.9967  14.6860          ?        ?      231.7        3.2       ?       ? 
1 1 1   34   15   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   15   30 o    175.9    4.0    0.0000   0.0000          ?        ?   309.6830  14.0475          ?        ?      175.9        4.0       ?       ? 
1 1 1   34   15   31 o    504.1    2.5    0.0000   0.0000          ?        ?  2541.3162  24.9023          ?        ?      504.1        2.5       ?       ? 
1 1 1   34   15   32 o    454.5    2.5    0.0000   0.0000          ?        ?  2066.2561  22.3483          ?        ?      454.5        2.5       ?       ? 
1 1 1   34   15   33 o    431.6    2.4    0.0000   0.0000          ?        ?  1863.2061  21.0712          ?        ?      431.6        2.4       ?       ? 
1 1 1   34   15   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   15   35 o    126.0    6.1    0.0000   0.0000          ?        ?   158.9919  15.3245          ?        ?      126.0        6.1       ?       ? 
1 1 1   34   15   36 o     18.9    9.5    0.0000   0.0000          ?        ?   -39.5883  14.6860          ?        ?       18.9        9.5       ?       ? 
1 1 1   34   15   37 o     69.9   11.0    0.0000   0.0000          ?        ?    49.1662  15.3245          ?        ?       69.9       11.0       ?       ? 
1 1 1   34   15   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   15   39 o    358.5    2.6    0.0000   0.0000          ?        ?  1285.9825  18.5171          ?        ?      358.5        2.6       ?       ? 
1 1 1   34   15   40 o     86.3    8.9    0.0000   0.0000          ?        ?    74.7070  15.3245          ?        ?       86.3        8.9       ?       ? 
1 1 1   34   15   41 o    268.3    3.2    0.0000   0.0000          ?        ?   720.2524  17.2401          ?        ?      268.3        3.2       ?       ? 
1 1 1   34   15   42 f    247.8    3.5    0.0000   0.0000          ?        ?   614.2578  17.2401          ?        ?      247.8        3.5       ?       ? 
1 1 1   34   15   43 o    251.5    3.4    0.0000   0.0000          ?        ?   632.7749  17.2401          ?        ?      251.5        3.4       ?       ? 
1 1 1   34   15   44 o    172.0    4.8    0.0000   0.0000          ?        ?   296.2740  16.6016          ?        ?      172.0        4.8       ?       ? 
1 1 1   34   15   45 o    497.4    2.6    0.0000   0.0000          ?        ?  2474.9099  26.1794          ?        ?      497.4        2.6       ?       ? 
1 1 1   34   15   46 o    386.3    2.8    0.0000   0.0000          ?        ?  1492.8635  21.7097          ?        ?      386.3        2.8       ?       ? 
1 1 1   34   15   47 o    249.0    3.7    0.0000   0.0000          ?        ?   620.6430  18.5171          ?        ?      249.0        3.7       ?       ? 
1 1 1   34   15   48 o    370.8    2.9    0.0000   0.0000          ?        ?  1376.0142  21.7097          ?        ?      370.8        2.9       ?       ? 
1 1 1   34   15   49 o    110.2    7.8    0.0000   0.0000          ?        ?   121.9576  17.2401          ?        ?      110.2        7.8       ?       ? 
1 1 1   34   15   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   15   51 f     20.3   10.2    0.0000   0.0000          ?        ?   -51.7203  17.8786          ?        ?       20.3       10.2       ?       ? 
1 1 1   34   15   52 o    274.7    3.6    0.0000   0.0000          ?        ?   755.3711  19.7942          ?        ?      274.7        3.6       ?       ? 
1 1 1   34   15   53 o    173.9    5.3    0.0000   0.0000          ?        ?   303.2978  18.5171          ?        ?      173.9        5.3       ?       ? 
1 1 1   34   15   54 o    277.5    3.6    0.0000   0.0000          ?        ?   771.3342  19.7942          ?        ?      277.5        3.6       ?       ? 
1 1 1   34   15   55 o     19.9   10.0    0.0000   0.0000          ?        ?   -54.2743  17.8786          ?        ?       19.9       10.0       ?       ? 
1 1 1   34   15   56 o    119.9    8.0    0.0000   0.0000          ?        ?   144.9444  19.1556          ?        ?      119.9        8.0       ?       ? 
1 1 1   34   15   57 o    246.9    4.0    0.0000   0.0000          ?        ?   611.0652  19.7942          ?        ?      246.9        4.0       ?       ? 
1 1 1   34   15   58 o    100.1    9.6    0.0000   0.0000          ?        ?   101.5249  19.1556          ?        ?      100.1        9.6       ?       ? 
1 1 1   34   15   59 o    155.1    6.4    0.0000   0.0000          ?        ?   241.9997  19.7942          ?        ?      155.1        6.4       ?       ? 
1 1 1   34   15   60 o     28.4   13.4    0.0000   0.0000          ?        ?   -21.0712  19.7942          ?        ?       28.4       13.4       ?       ? 
1 1 1   34   15   61 o    114.0    8.4    0.0000   0.0000          ?        ?   131.5355  19.1556          ?        ?      114.0        8.4       ?       ? 
1 1 1   34   15   62 o     34.6   15.0    0.0000   0.0000          ?        ?    -1.2770  19.1556          ?        ?       34.6       15.0       ?       ? 
1 1 1   34   16    0 o    791.4    4.8 6264.5356  75.9841  6264.5356  75.9841  6264.5356  75.9841      791.4      4.8      791.4        4.8     0.0     0.0 
1 1 1   34   16    1 o    550.2    2.9    0.0000   0.0000          ?        ?  3027.8696  31.9261          ?        ?      550.2        2.9       ?       ? 
1 1 1   34   16    2 o    173.6    3.7    0.0000   0.0000          ?        ?   301.3822  12.7704          ?        ?      173.6        3.7       ?       ? 
1 1 1   34   16    3 o    460.5    2.6    0.0000   0.0000          ?        ?  2121.1689  24.2638          ?        ?      460.5        2.6       ?       ? 
1 1 1   34   16    4 f    569.4    2.8    0.0000   0.0000          ?        ?  3243.0513  31.9261          ?        ?      569.4        2.8       ?       ? 
1 1 1   34   16    5 o    461.9    2.7    0.0000   0.0000          ?        ?  2133.9395  24.9023          ?        ?      461.9        2.7       ?       ? 
1 1 1   34   16    6 o    255.4    2.6    0.0000   0.0000          ?        ?   652.5691  13.4090          ?        ?      255.4        2.6       ?       ? 
1 1 1   34   16    7 o    172.7    3.1    0.0000   0.0000          ?        ?   298.1896  10.8549          ?        ?      172.7        3.1       ?       ? 
1 1 1   34   16    8 o    431.8    2.4    0.0000   0.0000          ?        ?  1865.1217  20.4327          ?        ?      431.8        2.4       ?       ? 
1 1 1   34   16    9 o    130.8    4.4    0.0000   0.0000          ?        ?   171.1238  11.4934          ?        ?      130.8        4.4       ?       ? 
1 1 1   34   16   10 o   1039.2    3.7    0.0000   0.0000          ?        ? 10801.2314  75.9841          ?        ?     1039.2        3.7       ?       ? 
1 1 1   34   16   11 o    215.7    3.0    0.0000   0.0000          ?        ?   465.4823  12.7704          ?        ?      215.7        3.0       ?       ? 
1 1 1   34   16   12 o    791.3    3.3    0.0000   0.0000          ?        ?  6262.6201  51.7203          ?        ?      791.3        3.3       ?       ? 
1 1 1   34   16   13 o    422.1    2.5    0.0000   0.0000          ?        ?  1782.1139  21.0712          ?        ?      422.1        2.5       ?       ? 
1 1 1   34   16   14 o    200.4    3.2    0.0000   0.0000          ?        ?   401.6301  12.7704          ?        ?      200.4        3.2       ?       ? 
1 1 1   34   16   15 o     92.8    6.5    0.0000   0.0000          ?        ?    86.2004  12.1319          ?        ?       92.8        6.5       ?       ? 
1 1 1   34   16   16 o    103.2    5.6    0.0000   0.0000          ?        ?   106.6331  11.4934          ?        ?      103.2        5.6       ?       ? 
1 1 1   34   16   17 o    238.5    2.8    0.0000   0.0000          ?        ?   568.9227  13.4090          ?        ?      238.5        2.8       ?       ? 
1 1 1   34   16   18 o    454.0    2.4    0.0000   0.0000          ?        ?  2061.1477  21.7097          ?        ?      454.0        2.4       ?       ? 
1 1 1   34   16   19 o    547.7    2.5    0.0000   0.0000          ?        ?  3000.4131  27.4564          ?        ?      547.7        2.5       ?       ? 
1 1 1   34   16   20 o    399.7    2.4    0.0000   0.0000          ?        ?  1598.2196  19.1556          ?        ?      399.7        2.4       ?       ? 
1 1 1   34   16   21 o    257.8    2.6    0.0000   0.0000          ?        ?   664.7010  13.4090          ?        ?      257.8        2.6       ?       ? 
1 1 1   34   16   22 o    116.0    5.0    0.0000   0.0000          ?        ?   134.7281  11.4934          ?        ?      116.0        5.0       ?       ? 
1 1 1   34   16   23 o    302.6    2.5    0.0000   0.0000          ?        ?   915.6400  15.3245          ?        ?      302.6        2.5       ?       ? 
1 1 1   34   16   24 o    155.5    4.1    0.0000   0.0000          ?        ?   241.9997  12.7704          ?        ?      155.5        4.1       ?       ? 
1 1 1   34   16   25 o    199.6    3.4    0.0000   0.0000          ?        ?   398.4375  13.4090          ?        ?      199.6        3.4       ?       ? 
1 1 1   34   16   26 o    378.8    2.4    0.0000   0.0000          ?        ?  1435.3966  18.5171          ?        ?      378.8        2.4       ?       ? 
1 1 1   34   16   27 o    180.4    3.7    0.0000   0.0000          ?        ?   325.6460  13.4090          ?        ?      180.4        3.7       ?       ? 
1 1 1   34   16   28 o    763.2    3.0    0.0000   0.0000          ?        ?  5827.1484  45.9736          ?        ?      763.2        3.0       ?       ? 
1 1 1   34   16   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   16   30 o    187.5    3.7    0.0000   0.0000          ?        ?   351.8254  14.0475          ?        ?      187.5        3.7       ?       ? 
1 1 1   34   16   31 o    578.5    2.6    0.0000   0.0000          ?        ?  3347.1304  30.6490          ?        ?      578.5        2.6       ?       ? 
1 1 1   34   16   32 o    300.3    2.9    0.0000   0.0000          ?        ?   902.2311  17.2401          ?        ?      300.3        2.9       ?       ? 
1 1 1   34   16   33 o    503.3    2.5    0.0000   0.0000          ?        ?  2533.6538  25.5409          ?        ?      503.3        2.5       ?       ? 
1 1 1   34   16   34 o    416.6    2.5    0.0000   0.0000          ?        ?  1736.1403  21.0712          ?        ?      416.6        2.5       ?       ? 
1 1 1   34   16   35 o    288.1    3.0    0.0000   0.0000          ?        ?   830.0781  17.2401          ?        ?      288.1        3.0       ?       ? 
1 1 1   34   16   36 o    200.2    3.7    0.0000   0.0000          ?        ?   400.9916  14.6860          ?        ?      200.2        3.7       ?       ? 
1 1 1   34   16   37 o    399.3    2.7    0.0000   0.0000          ?        ?  1595.0271  21.7097          ?        ?      399.3        2.7       ?       ? 
1 1 1   34   16   38 o    226.8    3.5    0.0000   0.0000          ?        ?   514.6484  15.9630          ?        ?      226.8        3.5       ?       ? 
1 1 1   34   16   39 o    301.5    3.0    0.0000   0.0000          ?        ?   909.2548  17.8786          ?        ?      301.5        3.0       ?       ? 
1 1 1   34   16   40 o    292.5    3.1    0.0000   0.0000          ?        ?   856.2576  17.8786          ?        ?      292.5        3.1       ?       ? 
1 1 1   34   16   41 o    328.7    2.8    0.0000   0.0000          ?        ?  1081.0171  18.5171          ?        ?      328.7        2.8       ?       ? 
1 1 1   34   16   42 f     25.7   12.1    0.0000   0.0000          ?        ?   -17.2401  15.9630          ?        ?       25.7       12.1       ?       ? 
1 1 1   34   16   43 o    227.3    3.8    0.0000   0.0000          ?        ?   517.2025  17.2401          ?        ?      227.3        3.8       ?       ? 
1 1 1   34   16   44 o    336.9    2.9    0.0000   0.0000          ?        ?  1135.9299  19.7942          ?        ?      336.9        2.9       ?       ? 
1 1 1   34   16   45 o    296.5    3.2    0.0000   0.0000          ?        ?   879.8828  19.1556          ?        ?      296.5        3.2       ?       ? 
1 1 1   34   16   46 o    330.6    3.0    0.0000   0.0000          ?        ?  1093.7876  19.7942          ?        ?      330.6        3.0       ?       ? 
1 1 1   34   16   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   16   48 o    168.8    5.3    0.0000   0.0000          ?        ?   285.4192  17.8786          ?        ?      168.8        5.3       ?       ? 
1 1 1   34   16   49 o    102.0    8.8    0.0000   0.0000          ?        ?   104.7175  17.8786          ?        ?      102.0        8.8       ?       ? 
1 1 1   34   16   50 o    309.8    3.2    0.0000   0.0000          ?        ?   960.3365  19.7942          ?        ?      309.8        3.2       ?       ? 
1 1 1   34   16   51 o    196.5    4.7    0.0000   0.0000          ?        ?   386.9441  18.5171          ?        ?      196.5        4.7       ?       ? 
1 1 1   34   16   52 o    100.1    8.9    0.0000   0.0000          ?        ?   100.8864  17.8786          ?        ?      100.1        8.9       ?       ? 
1 1 1   34   16   53 o    132.0    6.8    0.0000   0.0000          ?        ?   174.9549  17.8786          ?        ?      132.0        6.8       ?       ? 
1 1 1   34   16   54 o    151.9    6.3    0.0000   0.0000          ?        ?   231.7833  19.1556          ?        ?      151.9        6.3       ?       ? 
1 1 1   34   16   55 o     40.6   15.8    0.0000   0.0000          ?        ?    10.8549  18.5171          ?        ?       40.6       15.8       ?       ? 
1 1 1   34   16   56 o    169.9    5.6    0.0000   0.0000          ?        ?   289.8888  19.1556          ?        ?      169.9        5.6       ?       ? 
1 1 1   34   16   57 o    144.8    6.4    0.0000   0.0000          ?        ?   210.7121  18.5171          ?        ?      144.8        6.4       ?       ? 
1 1 1   34   16   58 f     21.0   10.5    0.0000   0.0000          ?        ?   -50.4432  18.5171          ?        ?       21.0       10.5       ?       ? 
1 1 1   34   16   59 o     72.3   13.7    0.0000   0.0000          ?        ?    55.5514  19.1556          ?        ?       72.3       13.7       ?       ? 
1 1 1   34   16   60 o     32.3   14.4    0.0000   0.0000          ?        ?    -7.0237  19.1556          ?        ?       32.3       14.4       ?       ? 
1 1 1   34   16   61 o    184.4    4.8    0.0000   0.0000          ?        ?   341.6091  17.8786          ?        ?      184.4        4.8       ?       ? 
1 1 1   34   17    0 o     83.7   10.6   73.4300  17.2401    73.4300  17.2401    73.4300  17.2401       83.7     10.6       83.7       10.6     0.0     0.0 
1 1 1   34   17    1 o    472.6    2.6    0.0000   0.0000          ?        ?  2233.5486  24.9023          ?        ?      472.6        2.6       ?       ? 
1 1 1   34   17    2 o    457.3    2.7    0.0000   0.0000          ?        ?  2091.7969  24.2638          ?        ?      457.3        2.7       ?       ? 
1 1 1   34   17    3 o     59.8    9.1    0.0000   0.0000          ?        ?    35.7572  10.8549          ?        ?       59.8        9.1       ?       ? 
1 1 1   34   17    4 o    494.3    2.6    0.0000   0.0000          ?        ?  2443.6223  26.1794          ?        ?      494.3        2.6       ?       ? 
1 1 1   34   17    5 o    271.7    2.9    0.0000   0.0000          ?        ?   738.1310  15.9630          ?        ?      271.7        2.9       ?       ? 
1 1 1   34   17    6 o    122.5    5.0    0.0000   0.0000          ?        ?   150.0526  12.1319          ?        ?      122.5        5.0       ?       ? 
1 1 1   34   17    7 o    297.7    2.3    0.0000   0.0000          ?        ?   886.2681  13.4090          ?        ?      297.7        2.3       ?       ? 
1 1 1   34   17    8 o    320.9    2.4    0.0000   0.0000          ?        ?  1029.9354  15.3245          ?        ?      320.9        2.4       ?       ? 
1 1 1   34   17    9 o    884.3    3.4    0.0000   0.0000          ?        ?  7821.8901  60.6596          ?        ?      884.3        3.4       ?       ? 
1 1 1   34   17   10 o    420.0    2.4    0.0000   0.0000          ?        ?  1764.2352  19.7942          ?        ?      420.0        2.4       ?       ? 
1 1 1   34   17   11 o    394.5    2.3    0.0000   0.0000          ?        ?  1556.7157  18.5171          ?        ?      394.5        2.3       ?       ? 
1 1 1   34   17   12 o    620.3    2.7    0.0000   0.0000          ?        ?  3847.7312  33.2031          ?        ?      620.3        2.7       ?       ? 
1 1 1   34   17   13 o    748.6    3.2    0.0000   0.0000          ?        ?  5604.9429  47.2506          ?        ?      748.6        3.2       ?       ? 
1 1 1   34   17   14 o    505.8    2.4    0.0000   0.0000          ?        ?  2558.5562  24.2638          ?        ?      505.8        2.4       ?       ? 
1 1 1   34   17   15 o     92.8    5.5    0.0000   0.0000          ?        ?    86.2004  10.2163          ?        ?       92.8        5.5       ?       ? 
1 1 1   34   17   16 o    142.7    4.0    0.0000   0.0000          ?        ?   203.6884  11.4934          ?        ?      142.7        4.0       ?       ? 
1 1 1   34   17   17 f    541.7    2.8    0.0000   0.0000          ?        ?  2934.6455  30.0105          ?        ?      541.7        2.8       ?       ? 
1 1 1   34   17   18 f    674.7    2.9    0.0000   0.0000          ?        ?  4553.2974  38.9498          ?        ?      674.7        2.9       ?       ? 
1 1 1   34   17   19 f    333.2    2.5    0.0000   0.0000          ?        ?  1110.3890  16.6016          ?        ?      333.2        2.5       ?       ? 
1 1 1   34   17   20 o    484.4    2.4    0.0000   0.0000          ?        ?  2346.5669  23.6253          ?        ?      484.4        2.4       ?       ? 
1 1 1   34   17   21 o    289.9    2.5    0.0000   0.0000          ?        ?   840.2945  14.6860          ?        ?      289.9        2.5       ?       ? 
1 1 1   34   17   22 o    186.3    3.3    0.0000   0.0000          ?        ?   347.3558  12.1319          ?        ?      186.3        3.3       ?       ? 
1 1 1   34   17   23 o    366.0    2.4    0.0000   0.0000          ?        ?  1339.6184  17.2401          ?        ?      366.0        2.4       ?       ? 
1 1 1   34   17   24 o    107.7    5.6    0.0000   0.0000          ?        ?   116.2109  12.1319          ?        ?      107.7        5.6       ?       ? 
1 1 1   34   17   25 o    246.3    2.7    0.0000   0.0000          ?        ?   606.5955  13.4090          ?        ?      246.3        2.7       ?       ? 
1 1 1   34   17   26 o    482.9    2.4    0.0000   0.0000          ?        ?  2332.5195  23.6253          ?        ?      482.9        2.4       ?       ? 
1 1 1   34   17   27 o    328.4    2.5    0.0000   0.0000          ?        ?  1078.4630  16.6016          ?        ?      328.4        2.5       ?       ? 
1 1 1   34   17   28 o    338.9    2.5    0.0000   0.0000          ?        ?  1148.7003  17.2401          ?        ?      338.9        2.5       ?       ? 
1 1 1   34   17   29 o    386.9    2.5    0.0000   0.0000          ?        ?  1497.3333  19.1556          ?        ?      386.9        2.5       ?       ? 
1 1 1   34   17   30 o    735.3    3.0    0.0000   0.0000          ?        ?  5408.2783  44.0580          ?        ?      735.3        3.0       ?       ? 
1 1 1   34   17   31 o    164.5    4.5    0.0000   0.0000          ?        ?   270.7332  14.6860          ?        ?      164.5        4.5       ?       ? 
1 1 1   34   17   32 o    407.0    2.5    0.0000   0.0000          ?        ?  1656.9636  20.4327          ?        ?      407.0        2.5       ?       ? 
1 1 1   34   17   33 o    251.5    3.0    0.0000   0.0000          ?        ?   632.7749  15.3245          ?        ?      251.5        3.0       ?       ? 
1 1 1   34   17   34 o    139.9    5.2    0.0000   0.0000          ?        ?   196.0261  14.6860          ?        ?      139.9        5.2       ?       ? 
1 1 1   34   17   35 o     37.1   14.0    0.0000   0.0000          ?        ?    10.2163  14.0475          ?        ?       37.1       14.0       ?       ? 
1 1 1   34   17   36 o     32.8   13.6    0.0000   0.0000          ?        ?     2.5541  14.6860          ?        ?       32.8       13.6       ?       ? 
1 1 1   34   17   37 o    215.5    3.7    0.0000   0.0000          ?        ?   464.8438  15.9630          ?        ?      215.5        3.7       ?       ? 
1 1 1   34   17   38 o     25.9   11.9    0.0000   0.0000          ?        ?   -10.2163  14.0475          ?        ?       25.9       11.9       ?       ? 
1 1 1   34   17   39 o    451.6    2.5    0.0000   0.0000          ?        ?  2040.0765  22.3483          ?        ?      451.6        2.5       ?       ? 
1 1 1   34   17   40 o    225.3    3.8    0.0000   0.0000          ?        ?   508.2632  17.2401          ?        ?      225.3        3.8       ?       ? 
1 1 1   34   17   41 o     88.4    8.7    0.0000   0.0000          ?        ?    78.5382  15.3245          ?        ?       88.4        8.7       ?       ? 
1 1 1   34   17   42 o    120.0    6.7    0.0000   0.0000          ?        ?   144.3059  15.9630          ?        ?      120.0        6.7       ?       ? 
1 1 1   34   17   43 o     21.4   10.6    0.0000   0.0000          ?        ?   -37.6728  16.6016          ?        ?       21.4       10.6       ?       ? 
1 1 1   34   17   44 o    302.3    3.3    0.0000   0.0000          ?        ?   914.3630  19.7942          ?        ?      302.3        3.3       ?       ? 
1 1 1   34   17   45 o    129.1    6.7    0.0000   0.0000          ?        ?   167.2927  17.2401          ?        ?      129.1        6.7       ?       ? 
1 1 1   34   17   46 o    190.6    4.5    0.0000   0.0000          ?        ?   363.9573  17.2401          ?        ?      190.6        4.5       ?       ? 
1 1 1   34   17   47 o    255.1    3.6    0.0000   0.0000          ?        ?   651.2921  18.5171          ?        ?      255.1        3.6       ?       ? 
1 1 1   34   17   48 o    134.0    6.4    0.0000   0.0000          ?        ?   180.0631  17.2401          ?        ?      134.0        6.4       ?       ? 
1 1 1   34   17   49 f    103.9    8.6    0.0000   0.0000          ?        ?   108.5487  17.8786          ?        ?      103.9        8.6       ?       ? 
1 1 1   34   17   50 o    164.1    5.4    0.0000   0.0000          ?        ?   270.0946  17.8786          ?        ?      164.1        5.4       ?       ? 
1 1 1   34   17   51 o    113.8    8.1    0.0000   0.0000          ?        ?   130.2584  18.5171          ?        ?      113.8        8.1       ?       ? 
1 1 1   34   17   52 o    274.0    3.6    0.0000   0.0000          ?        ?   751.5399  19.7942          ?        ?      274.0        3.6       ?       ? 
1 1 1   34   17   53 o     91.3   10.1    0.0000   0.0000          ?        ?    84.2849  18.5171          ?        ?       91.3       10.1       ?       ? 
1 1 1   34   17   54 o    340.1    3.2    0.0000   0.0000          ?        ?  1158.2782  21.7097          ?        ?      340.1        3.2       ?       ? 
1 1 1   34   17   55 o     42.1   16.0    0.0000   0.0000          ?        ?    13.4090  18.5171          ?        ?       42.1       16.0       ?       ? 
1 1 1   34   17   56 o    207.8    4.6    0.0000   0.0000          ?        ?   432.9177  19.1556          ?        ?      207.8        4.6       ?       ? 
1 1 1   34   17   57 o    206.6    4.9    0.0000   0.0000          ?        ?   428.4480  20.4327          ?        ?      206.6        4.9       ?       ? 
1 1 1   34   17   58 o    163.3    5.9    0.0000   0.0000          ?        ?   268.1791  19.1556          ?        ?      163.3        5.9       ?       ? 
1 1 1   34   17   59 o     42.6   16.0    0.0000   0.0000          ?        ?    14.6860  18.5171          ?        ?       42.6       16.0       ?       ? 
1 1 1   34   17   60 o    145.2    6.4    0.0000   0.0000          ?        ?   212.6277  18.5171          ?        ?      145.2        6.4       ?       ? 
1 1 1   34   17   61 o     23.5   11.5    0.0000   0.0000          ?        ?   -35.7572  18.5171          ?        ?       23.5       11.5       ?       ? 
1 1 1   34   18    0 o    100.2    7.4  102.1635  14.6860   102.1635  14.6860   102.1635  14.6860      100.2      7.4      100.2        7.4     0.0     0.0 
1 1 1   34   18    1 o    444.7    2.7    0.0000   0.0000          ?        ?  1977.5016  24.2638          ?        ?      444.7        2.7       ?       ? 
1 1 1   34   18    2 o   1009.5    4.0    0.0000   0.0000          ?        ? 10194.6357  81.7308          ?        ?     1009.5        4.0       ?       ? 
1 1 1   34   18    3 o    215.0    5.0    0.0000   0.0000          ?        ?   462.2897  21.7097          ?        ?      215.0        5.0       ?       ? 
1 1 1   34   18    4 o    607.5    2.9    0.0000   0.0000          ?        ?  3691.2935  35.7572          ?        ?      607.5        2.9       ?       ? 
1 1 1   34   18    5 o    531.1    2.8    0.0000   0.0000          ?        ?  2821.6270  30.0105          ?        ?      531.1        2.8       ?       ? 
1 1 1   34   18    6 o    758.3    3.3    0.0000   0.0000          ?        ?  5751.1646  49.8047          ?        ?      758.3        3.3       ?       ? 
1 1 1   34   18    7 o    691.0    3.0    0.0000   0.0000          ?        ?  4775.5034  41.5039          ?        ?      691.0        3.0       ?       ? 
1 1 1   34   18    8 o    488.5    2.4    0.0000   0.0000          ?        ?  2386.1555  23.6253          ?        ?      488.5        2.4       ?       ? 
1 1 1   34   18    9 f    434.2    2.4    0.0000   0.0000          ?        ?  1885.5543  20.4327          ?        ?      434.2        2.4       ?       ? 
1 1 1   34   18   10 o    398.4    2.5    0.0000   0.0000          ?        ?  1587.3647  19.7942          ?        ?      398.4        2.5       ?       ? 
1 1 1   34   18   11 o    548.6    2.7    0.0000   0.0000          ?        ?  3010.6294  30.0105          ?        ?      548.6        2.7       ?       ? 
1 1 1   34   18   12 o    484.3    2.2    0.0000   0.0000          ?        ?  2345.9285  21.7097          ?        ?      484.3        2.2       ?       ? 
1 1 1   34   18   13 o    359.2    2.2    0.0000   0.0000          ?        ?  1290.4523  15.9630          ?        ?      359.2        2.2       ?       ? 
1 1 1   34   18   14 o    245.9    2.3    0.0000   0.0000          ?        ?   604.6799  11.4934          ?        ?      245.9        2.3       ?       ? 
1 1 1   34   18   15 o    171.7    3.0    0.0000   0.0000          ?        ?   294.9970  10.2163          ?        ?      171.7        3.0       ?       ? 
1 1 1   34   18   16 o    399.7    2.5    0.0000   0.0000          ?        ?  1598.2196  19.7942          ?        ?      399.7        2.5       ?       ? 
1 1 1   34   18   17 o    586.7    2.7    0.0000   0.0000          ?        ?  3442.9087  31.2876          ?        ?      586.7        2.7       ?       ? 
1 1 1   34   18   18 o    486.7    2.6    0.0000   0.0000          ?        ?  2369.5537  25.5409          ?        ?      486.7        2.6       ?       ? 
1 1 1   34   18   19 o    316.1    2.5    0.0000   0.0000          ?        ?   999.2863  15.9630          ?        ?      316.1        2.5       ?       ? 
1 1 1   34   18   20 o    245.7    2.9    0.0000   0.0000          ?        ?   604.0414  14.0475          ?        ?      245.7        2.9       ?       ? 
1 1 1   34   18   21 o    298.0    2.7    0.0000   0.0000          ?        ?   888.1836  15.9630          ?        ?      298.0        2.7       ?       ? 
1 1 1   34   18   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   18   23 o    145.8    4.4    0.0000   0.0000          ?        ?   212.6277  12.7704          ?        ?      145.8        4.4       ?       ? 
1 1 1   34   18   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   18   25 o    299.5    2.6    0.0000   0.0000          ?        ?   897.1229  15.3245          ?        ?      299.5        2.6       ?       ? 
1 1 1   34   18   26 o    225.4    3.0    0.0000   0.0000          ?        ?   508.2632  13.4090          ?        ?      225.4        3.0       ?       ? 
1 1 1   34   18   27 o    281.8    2.7    0.0000   0.0000          ?        ?   794.3209  15.3245          ?        ?      281.8        2.7       ?       ? 
1 1 1   34   18   28 o    190.4    3.5    0.0000   0.0000          ?        ?   362.6803  13.4090          ?        ?      190.4        3.5       ?       ? 
1 1 1   34   18   29 o    346.0    2.7    0.0000   0.0000          ?        ?  1197.2280  18.5171          ?        ?      346.0        2.7       ?       ? 
1 1 1   34   18   30 o    504.8    2.7    0.0000   0.0000          ?        ?  2548.9785  26.8179          ?        ?      504.8        2.7       ?       ? 
1 1 1   34   18   31 o    476.7    2.5    0.0000   0.0000          ?        ?  2273.1370  24.2638          ?        ?      476.7        2.5       ?       ? 
1 1 1   34   18   32 o     82.1    8.6    0.0000   0.0000          ?        ?    67.6833  14.0475          ?        ?       82.1        8.6       ?       ? 
1 1 1   34   18   33 o    348.7    2.5    0.0000   0.0000          ?        ?  1216.3837  17.2401          ?        ?      348.7        2.5       ?       ? 
1 1 1   34   18   34 o     43.5   14.1    0.0000   0.0000          ?        ?    18.5171  14.0475          ?        ?       43.5       14.1       ?       ? 
1 1 1   34   18   35 o     99.7    7.0    0.0000   0.0000          ?        ?    99.6094  14.0475          ?        ?       99.7        7.0       ?       ? 
1 1 1   34   18   36 o    403.3    2.6    0.0000   0.0000          ?        ?  1626.9531  21.0712          ?        ?      403.3        2.6       ?       ? 
1 1 1   34   18   37 o    399.1    2.6    0.0000   0.0000          ?        ?  1593.7500  21.0712          ?        ?      399.1        2.6       ?       ? 
1 1 1   34   18   38 o    130.9    5.9    0.0000   0.0000          ?        ?   171.7623  15.3245          ?        ?      130.9        5.9       ?       ? 
1 1 1   34   18   39 o    343.3    2.8    0.0000   0.0000          ?        ?  1179.3494  19.1556          ?        ?      343.3        2.8       ?       ? 
1 1 1   34   18   40 o    287.0    3.1    0.0000   0.0000          ?        ?   824.3315  17.8786          ?        ?      287.0        3.1       ?       ? 
1 1 1   34   18   41 o    152.1    5.0    0.0000   0.0000          ?        ?   231.7833  15.3245          ?        ?      152.1        5.0       ?       ? 
1 1 1   34   18   42 o    240.6    3.5    0.0000   0.0000          ?        ?   579.1391  16.6016          ?        ?      240.6        3.5       ?       ? 
1 1 1   34   18   43 o     26.3   12.3    0.0000   0.0000          ?        ?   -15.3245  15.9630          ?        ?       26.3       12.3       ?       ? 
1 1 1   34   18   44 o     64.8   13.3    0.0000   0.0000          ?        ?    44.0580  16.6016          ?        ?       64.8       13.3       ?       ? 
1 1 1   34   18   45 o    313.6    3.1    0.0000   0.0000          ?        ?   983.9619  19.1556          ?        ?      313.6        3.1       ?       ? 
1 1 1   34   18   46 o    237.2    3.9    0.0000   0.0000          ?        ?   563.1760  18.5171          ?        ?      237.2        3.9       ?       ? 
1 1 1   34   18   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   18   48 o    149.1    6.0    0.0000   0.0000          ?        ?   222.8441  17.8786          ?        ?      149.1        6.0       ?       ? 
1 1 1   34   18   49 f    318.9    3.3    0.0000   0.0000          ?        ?  1017.8034  21.0712          ?        ?      318.9        3.3       ?       ? 
1 1 1   34   18   50 o    262.8    3.6    0.0000   0.0000          ?        ?   691.5189  19.1556          ?        ?      262.8        3.6       ?       ? 
1 1 1   34   18   51 o    137.2    6.5    0.0000   0.0000          ?        ?   189.0024  17.8786          ?        ?      137.2        6.5       ?       ? 
1 1 1   34   18   52 o    257.5    3.7    0.0000   0.0000          ?        ?   664.0625  19.1556          ?        ?      257.5        3.7       ?       ? 
1 1 1   34   18   53 o    125.7    7.1    0.0000   0.0000          ?        ?   158.9919  17.8786          ?        ?      125.7        7.1       ?       ? 
1 1 1   34   18   54 o    148.5    6.0    0.0000   0.0000          ?        ?   221.5670  17.8786          ?        ?      148.5        6.0       ?       ? 
1 1 1   34   18   55 o    185.9    5.2    0.0000   0.0000          ?        ?   346.7172  19.1556          ?        ?      185.9        5.2       ?       ? 
1 1 1   34   18   56 o     34.5   14.8    0.0000   0.0000          ?        ?    -0.6385  18.5171          ?        ?       34.5       14.8       ?       ? 
1 1 1   34   18   57 o    350.6    3.2    0.0000   0.0000          ?        ?  1231.0697  22.3483          ?        ?      350.6        3.2       ?       ? 
1 1 1   34   18   58 o     70.7   13.1    0.0000   0.0000          ?        ?    52.9973  17.8786          ?        ?       70.7       13.1       ?       ? 
1 1 1   34   18   59 o     64.9   14.2    0.0000   0.0000          ?        ?    45.3350  17.8786          ?        ?       64.9       14.2       ?       ? 
1 1 1   34   18   60 o    161.2    5.7    0.0000   0.0000          ?        ?   261.7939  18.5171          ?        ?      161.2        5.7       ?       ? 
1 1 1   34   19    0 o    237.6    4.0  565.0916  19.1556   565.0916  19.1556   565.0916  19.1556      237.6      4.0      237.6        4.0     0.0     0.0 
1 1 1   34   19    1 o    166.4    3.5    0.0000   0.0000          ?        ?   277.1184  11.4934          ?        ?      166.4        3.5       ?       ? 
1 1 1   34   19    2 o    428.9    2.6    0.0000   0.0000          ?        ?  1839.5808  22.3483          ?        ?      428.9        2.6       ?       ? 
1 1 1   34   19    3 o    727.3    3.2    0.0000   0.0000          ?        ?  5290.7900  47.2506          ?        ?      727.3        3.2       ?       ? 
1 1 1   34   19    4 o    247.2    3.0    0.0000   0.0000          ?        ?   611.0652  14.6860          ?        ?      247.2        3.0       ?       ? 
1 1 1   34   19    5 o    324.8    2.7    0.0000   0.0000          ?        ?  1054.8376  17.2401          ?        ?      324.8        2.7       ?       ? 
1 1 1   34   19    6 o    547.8    2.7    0.0000   0.0000          ?        ?  3001.6902  30.0105          ?        ?      547.8        2.7       ?       ? 
1 1 1   34   19    7 o    660.6    3.0    0.0000   0.0000          ?        ?  4365.5723  40.2269          ?        ?      660.6        3.0       ?       ? 
1 1 1   34   19    8 o    469.9    2.7    0.0000   0.0000          ?        ?  2208.0078  25.5409          ?        ?      469.9        2.7       ?       ? 
1 1 1   34   19    9 o    579.1    2.8    0.0000   0.0000          ?        ?  3354.1541  32.5646          ?        ?      579.1        2.8       ?       ? 
1 1 1   34   19   10 o    443.1    2.6    0.0000   0.0000          ?        ?  1964.0925  22.9868          ?        ?      443.1        2.6       ?       ? 
1 1 1   34   19   11 o    566.0    2.8    0.0000   0.0000          ?        ?  3204.7400  31.9261          ?        ?      566.0        2.8       ?       ? 
1 1 1   34   19   12 o    351.0    2.4    0.0000   0.0000          ?        ?  1232.3467  16.6016          ?        ?      351.0        2.4       ?       ? 
1 1 1   34   19   13 o    302.8    2.2    0.0000   0.0000          ?        ?   916.9171  13.4090          ?        ?      302.8        2.2       ?       ? 
1 1 1   34   19   14 o    420.0    2.3    0.0000   0.0000          ?        ?  1764.2352  19.1556          ?        ?      420.0        2.3       ?       ? 
1 1 1   34   19   15 o    342.4    2.1    0.0000   0.0000          ?        ?  1172.3258  14.6860          ?        ?      342.4        2.1       ?       ? 
1 1 1   34   19   16 o    180.1    3.0    0.0000   0.0000          ?        ?   324.3690  10.8549          ?        ?      180.1        3.0       ?       ? 
1 1 1   34   19   17 o    400.1    2.5    0.0000   0.0000          ?        ?  1600.7737  19.7942          ?        ?      400.1        2.5       ?       ? 
1 1 1   34   19   18 o    347.0    2.5    0.0000   0.0000          ?        ?  1204.2518  17.2401          ?        ?      347.0        2.5       ?       ? 
1 1 1   34   19   19 o    248.1    2.6    0.0000   0.0000          ?        ?   615.5349  12.7704          ?        ?      248.1        2.6       ?       ? 
1 1 1   34   19   20 o    281.1    2.6    0.0000   0.0000          ?        ?   790.4898  14.6860          ?        ?      281.1        2.6       ?       ? 
1 1 1   34   19   21 o    465.5    2.5    0.0000   0.0000          ?        ?  2167.1423  23.6253          ?        ?      465.5        2.5       ?       ? 
1 1 1   34   19   22 o    596.4    2.7    0.0000   0.0000          ?        ?  3557.8425  31.9261          ?        ?      596.4        2.7       ?       ? 
1 1 1   34   19   23 o    556.3    2.6    0.0000   0.0000          ?        ?  3094.9143  28.7335          ?        ?      556.3        2.6       ?       ? 
1 1 1   34   19   24 o    435.1    2.5    0.0000   0.0000          ?        ?  1893.2167  21.7097          ?        ?      435.1        2.5       ?       ? 
1 1 1   34   19   25 o    443.1    2.5    0.0000   0.0000          ?        ?  1963.4540  22.3483          ?        ?      443.1        2.5       ?       ? 
1 1 1   34   19   26 o    373.1    2.4    0.0000   0.0000          ?        ?  1391.9772  17.8786          ?        ?      373.1        2.4       ?       ? 
1 1 1   34   19   27 o     23.6   11.0    0.0000   0.0000          ?        ?   -12.1319  12.7704          ?        ?       23.6       11.0       ?       ? 
1 1 1   34   19   28 o    716.0    2.9    0.0000   0.0000          ?        ?  5127.9668  40.8654          ?        ?      716.0        2.9       ?       ? 
1 1 1   34   19   29 o    300.1    2.8    0.0000   0.0000          ?        ?   900.9540  16.6016          ?        ?      300.1        2.8       ?       ? 
1 1 1   34   19   30 o    520.5    2.6    0.0000   0.0000          ?        ?  2709.8857  26.8179          ?        ?      520.5        2.6       ?       ? 
1 1 1   34   19   31 o    349.0    2.6    0.0000   0.0000          ?        ?  1218.2993  17.8786          ?        ?      349.0        2.6       ?       ? 
1 1 1   34   19   32 o    467.4    2.7    0.0000   0.0000          ?        ?  2185.0210  24.9023          ?        ?      467.4        2.7       ?       ? 
1 1 1   34   19   33 o    222.2    3.4    0.0000   0.0000          ?        ?   494.2158  15.3245          ?        ?      222.2        3.4       ?       ? 
1 1 1   34   19   34 o    586.1    2.7    0.0000   0.0000          ?        ?  3436.5234  31.2876          ?        ?      586.1        2.7       ?       ? 
1 1 1   34   19   35 o     51.8   13.9    0.0000   0.0000          ?        ?    28.0950  14.6860          ?        ?       51.8       13.9       ?       ? 
1 1 1   34   19   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   19   37 o    277.3    3.0    0.0000   0.0000          ?        ?   769.4186  16.6016          ?        ?      277.3        3.0       ?       ? 
1 1 1   34   19   38 o    184.4    4.5    0.0000   0.0000          ?        ?   340.3320  16.6016          ?        ?      184.4        4.5       ?       ? 
1 1 1   34   19   39 o    434.4    2.7    0.0000   0.0000          ?        ?  1887.4700  23.6253          ?        ?      434.4        2.7       ?       ? 
1 1 1   34   19   40 o    151.1    5.5    0.0000   0.0000          ?        ?   228.5907  16.6016          ?        ?      151.1        5.5       ?       ? 
1 1 1   34   19   41 o    114.2    7.0    0.0000   0.0000          ?        ?   130.8969  15.9630          ?        ?      114.2        7.0       ?       ? 
1 1 1   34   19   42 o    135.9    6.1    0.0000   0.0000          ?        ?   185.1713  16.6016          ?        ?      135.9        6.1       ?       ? 
1 1 1   34   19   43 o     19.8    9.9    0.0000   0.0000          ?        ?   -42.7809  15.9630          ?        ?       19.8        9.9       ?       ? 
1 1 1   34   19   44 o     46.0   15.4    0.0000   0.0000          ?        ?    20.4327  16.6016          ?        ?       46.0       15.4       ?       ? 
1 1 1   34   19   45 o     26.7   12.4    0.0000   0.0000          ?        ?   -14.0475  15.9630          ?        ?       26.7       12.4       ?       ? 
1 1 1   34   19   46 o    158.6    5.4    0.0000   0.0000          ?        ?   252.2160  17.2401          ?        ?      158.6        5.4       ?       ? 
1 1 1   34   19   47 o    450.5    2.8    0.0000   0.0000          ?        ?  2031.1373  24.9023          ?        ?      450.5        2.8       ?       ? 
1 1 1   34   19   48 o    114.1    7.8    0.0000   0.0000          ?        ?   130.8969  17.8786          ?        ?      114.1        7.8       ?       ? 
1 1 1   34   19   49 o    329.5    3.2    0.0000   0.0000          ?        ?  1086.7638  21.0712          ?        ?      329.5        3.2       ?       ? 
1 1 1   34   19   50 o    176.8    5.2    0.0000   0.0000          ?        ?   313.5141  18.5171          ?        ?      176.8        5.2       ?       ? 
1 1 1   34   19   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   19   52 o    222.2    4.2    0.0000   0.0000          ?        ?   494.8542  18.5171          ?        ?      222.2        4.2       ?       ? 
1 1 1   34   19   53 o    155.9    5.7    0.0000   0.0000          ?        ?   243.9153  17.8786          ?        ?      155.9        5.7       ?       ? 
1 1 1   34   19   54 o     36.1   15.0    0.0000   0.0000          ?        ?     3.8311  17.8786          ?        ?       36.1       15.0       ?       ? 
1 1 1   34   19   55 o     95.3    9.4    0.0000   0.0000          ?        ?    91.9471  17.8786          ?        ?       95.3        9.4       ?       ? 
1 1 1   34   19   56 o     82.6   11.2    0.0000   0.0000          ?        ?    69.5989  18.5171          ?        ?       82.6       11.2       ?       ? 
1 1 1   34   19   57 o     92.4   10.0    0.0000   0.0000          ?        ?    86.8389  18.5171          ?        ?       92.4       10.0       ?       ? 
1 1 1   34   19   58 o     55.1   16.3    0.0000   0.0000          ?        ?    32.5646  19.1556          ?        ?       55.1       16.3       ?       ? 
1 1 1   34   19   59 o     26.9   12.8    0.0000   0.0000          ?        ?   -23.6253  19.1556          ?        ?       26.9       12.8       ?       ? 
1 1 1   34   20    0 o     17.7   12.3   -9.5778  14.0475    -9.5778  14.0475    -9.5778  14.0475       17.7     12.3       17.7       12.3     0.0     0.0 
1 1 1   34   20    1 o    255.3    2.8    0.0000   0.0000          ?        ?   651.9305  14.0475          ?        ?      255.3        2.8       ?       ? 
1 1 1   34   20    2 o    184.6    3.5    0.0000   0.0000          ?        ?   340.9706  12.7704          ?        ?      184.6        3.5       ?       ? 
1 1 1   34   20    3 o    859.1    3.6    0.0000   0.0000          ?        ?  7383.8643  61.2981          ?        ?      859.1        3.6       ?       ? 
1 1 1   34   20    4 f    403.2    2.9    0.0000   0.0000          ?        ?  1625.6761  23.6253          ?        ?      403.2        2.9       ?       ? 
1 1 1   34   20    5 o    524.3    2.7    0.0000   0.0000          ?        ?  2749.4741  28.7335          ?        ?      524.3        2.7       ?       ? 
1 1 1   34   20    6 o    307.0    2.8    0.0000   0.0000          ?        ?   942.4579  17.2401          ?        ?      307.0        2.8       ?       ? 
1 1 1   34   20    7 f    455.4    2.7    0.0000   0.0000          ?        ?  2073.9182  24.9023          ?        ?      455.4        2.7       ?       ? 
1 1 1   34   20    8 o    424.1    2.8    0.0000   0.0000          ?        ?  1798.7155  23.6253          ?        ?      424.1        2.8       ?       ? 
1 1 1   34   20    9 o    517.5    2.5    0.0000   0.0000          ?        ?  2678.5981  26.1794          ?        ?      517.5        2.5       ?       ? 
1 1 1   34   20   10 o    419.5    2.4    0.0000   0.0000          ?        ?  1759.7656  19.7942          ?        ?      419.5        2.4       ?       ? 
1 1 1   34   20   11 o    623.6    2.7    0.0000   0.0000          ?        ?  3889.8738  33.8416          ?        ?      623.6        2.7       ?       ? 
1 1 1   34   20   12 o    187.0    3.1    0.0000   0.0000          ?        ?   349.9099  11.4934          ?        ?      187.0        3.1       ?       ? 
1 1 1   34   20   13 o    495.8    2.6    0.0000   0.0000          ?        ?  2458.9468  25.5409          ?        ?      495.8        2.6       ?       ? 
1 1 1   34   20   14 o    300.9    2.2    0.0000   0.0000          ?        ?   905.4237  13.4090          ?        ?      300.9        2.2       ?       ? 
1 1 1   34   20   15 o     88.6    5.4    0.0000   0.0000          ?        ?    78.5382   9.5778          ?        ?       88.6        5.4       ?       ? 
1 1 1   34   20   16 o    541.6    2.5    0.0000   0.0000          ?        ?  2934.0068  27.4564          ?        ?      541.6        2.5       ?       ? 
1 1 1   34   20   17 o    101.7    5.3    0.0000   0.0000          ?        ?   103.4405  10.8549          ?        ?      101.7        5.3       ?       ? 
1 1 1   34   20   18 o    873.4    3.4    0.0000   0.0000          ?        ?  7631.6104  60.0210          ?        ?      873.4        3.4       ?       ? 
1 1 1   34   20   19 o    137.0    4.4    0.0000   0.0000          ?        ?   187.7254  12.1319          ?        ?      137.0        4.4       ?       ? 
1 1 1   34   20   20 o    622.4    2.8    0.0000   0.0000          ?        ?  3874.5491  35.1187          ?        ?      622.4        2.8       ?       ? 
1 1 1   34   20   21 o    175.9    3.8    0.0000   0.0000          ?        ?   309.6830  13.4090          ?        ?      175.9        3.8       ?       ? 
1 1 1   34   20   22 o    321.7    2.4    0.0000   0.0000          ?        ?  1035.0436  15.3245          ?        ?      321.7        2.4       ?       ? 
1 1 1   34   20   23 o    442.9    2.4    0.0000   0.0000          ?        ?  1962.1769  21.0712          ?        ?      442.9        2.4       ?       ? 
1 1 1   34   20   24 o    375.4    2.5    0.0000   0.0000          ?        ?  1409.2172  18.5171          ?        ?      375.4        2.5       ?       ? 
1 1 1   34   20   25 o    316.6    2.7    0.0000   0.0000          ?        ?  1002.4789  17.2401          ?        ?      316.6        2.7       ?       ? 
1 1 1   34   20   26 o     34.7   13.2    0.0000   0.0000          ?        ?     8.3008  12.7704          ?        ?       34.7       13.2       ?       ? 
1 1 1   34   20   27 o    312.2    2.8    0.0000   0.0000          ?        ?   975.0225  17.2401          ?        ?      312.2        2.8       ?       ? 
1 1 1   34   20   28 o    485.1    2.6    0.0000   0.0000          ?        ?  2353.5908  24.9023          ?        ?      485.1        2.6       ?       ? 
1 1 1   34   20   29 o     84.4    8.3    0.0000   0.0000          ?        ?    71.5144  14.0475          ?        ?       84.4        8.3       ?       ? 
1 1 1   34   20   30 o    148.8    4.9    0.0000   0.0000          ?        ?   221.5670  14.6860          ?        ?      148.8        4.9       ?       ? 
1 1 1   34   20   31 o    332.7    2.6    0.0000   0.0000          ?        ?  1107.1964  17.2401          ?        ?      332.7        2.6       ?       ? 
1 1 1   34   20   32 o    408.2    2.7    0.0000   0.0000          ?        ?  1666.5415  21.7097          ?        ?      408.2        2.7       ?       ? 
1 1 1   34   20   33 o     17.1    8.6    0.0000   0.0000          ?        ?   -46.6121  14.0475          ?        ?       17.1        8.6       ?       ? 
1 1 1   34   20   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   20   35 o    248.8    3.3    0.0000   0.0000          ?        ?   619.3660  16.6016          ?        ?      248.8        3.3       ?       ? 
1 1 1   34   20   36 o    213.7    3.7    0.0000   0.0000          ?        ?   457.1815  15.9630          ?        ?      213.7        3.7       ?       ? 
1 1 1   34   20   37 o    235.9    3.4    0.0000   0.0000          ?        ?   556.7908  15.9630          ?        ?      235.9        3.4       ?       ? 
1 1 1   34   20   38 o    116.7    7.1    0.0000   0.0000          ?        ?   136.6436  16.6016          ?        ?      116.7        7.1       ?       ? 
1 1 1   34   20   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   20   40 o    296.1    3.1    0.0000   0.0000          ?        ?   877.3287  18.5171          ?        ?      296.1        3.1       ?       ? 
1 1 1   34   20   41 f    309.9    3.0    0.0000   0.0000          ?        ?   960.9750  18.5171          ?        ?      309.9        3.0       ?       ? 
1 1 1   34   20   42 o    128.2    6.5    0.0000   0.0000          ?        ?   164.7386  16.6016          ?        ?      128.2        6.5       ?       ? 
1 1 1   34   20   43 o    418.6    2.7    0.0000   0.0000          ?        ?  1753.3804  22.9868          ?        ?      418.6        2.7       ?       ? 
1 1 1   34   20   44 o     25.2   12.0    0.0000   0.0000          ?        ?   -21.0712  16.6016          ?        ?       25.2       12.0       ?       ? 
1 1 1   34   20   45 f     18.7    9.5    0.0000   0.0000          ?        ?   -58.7440  17.2401          ?        ?       18.7        9.5       ?       ? 
1 1 1   34   20   46 o    131.3    6.3    0.0000   0.0000          ?        ?   173.0394  16.6016          ?        ?      131.3        6.3       ?       ? 
1 1 1   34   20   47 o    326.5    3.1    0.0000   0.0000          ?        ?  1066.9697  20.4327          ?        ?      326.5        3.1       ?       ? 
1 1 1   34   20   48 o     98.1    9.4    0.0000   0.0000          ?        ?    97.0553  18.5171          ?        ?       98.1        9.4       ?       ? 
1 1 1   34   20   49 o     43.0   15.6    0.0000   0.0000          ?        ?    15.9630  17.2401          ?        ?       43.0       15.6       ?       ? 
1 1 1   34   20   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   20   51 o    144.6    6.2    0.0000   0.0000          ?        ?   210.0736  17.8786          ?        ?      144.6        6.2       ?       ? 
1 1 1   34   20   52 f    161.5    5.5    0.0000   0.0000          ?        ?   261.7939  17.8786          ?        ?      161.5        5.5       ?       ? 
1 1 1   34   20   53 o     64.7   14.7    0.0000   0.0000          ?        ?    44.6965  18.5171          ?        ?       64.7       14.7       ?       ? 
1 1 1   34   20   54 o    153.3    6.0    0.0000   0.0000          ?        ?   236.2530  18.5171          ?        ?      153.3        6.0       ?       ? 
1 1 1   34   20   55 o    121.9    7.9    0.0000   0.0000          ?        ?   150.0526  19.1556          ?        ?      121.9        7.9       ?       ? 
1 1 1   34   20   56 o    212.0    4.2    0.0000   0.0000          ?        ?   450.7963  17.8786          ?        ?      212.0        4.2       ?       ? 
1 1 1   34   20   57 o     49.8   16.2    0.0000   0.0000          ?        ?    25.5409  18.5171          ?        ?       49.8       16.2       ?       ? 
1 1 1   34   20   58 o    109.0    8.5    0.0000   0.0000          ?        ?   120.6806  18.5171          ?        ?      109.0        8.5       ?       ? 
1 1 1   34   21    0 o    331.0    5.0 1096.9802  33.2031  1096.9802  33.2031  1096.9802  33.2031      331.0      5.0      331.0        5.0     0.0     0.0 
1 1 1   34   21    1 o    568.5    2.8    0.0000   0.0000          ?        ?  3232.8350  31.2876          ?        ?      568.5        2.8       ?       ? 
1 1 1   34   21    2 o    221.1    4.2    0.0000   0.0000          ?        ?   489.1075  18.5171          ?        ?      221.1        4.2       ?       ? 
1 1 1   34   21    3 o    441.0    2.7    0.0000   0.0000          ?        ?  1944.9369  23.6253          ?        ?      441.0        2.7       ?       ? 
1 1 1   34   21    4 o    777.7    3.5    0.0000   0.0000          ?        ?  6050.6309  54.9129          ?        ?      777.7        3.5       ?       ? 
1 1 1   34   21    5 o    334.0    2.8    0.0000   0.0000          ?        ?  1115.4973  18.5171          ?        ?      334.0        2.8       ?       ? 
1 1 1   34   21    6 o     50.1   11.7    0.0000   0.0000          ?        ?    26.1794  11.4934          ?        ?       50.1       11.7       ?       ? 
1 1 1   34   21    7 o    315.6    2.6    0.0000   0.0000          ?        ?   996.0938  16.6016          ?        ?      315.6        2.6       ?       ? 
1 1 1   34   21    8 o    448.8    2.6    0.0000   0.0000          ?        ?  2014.5358  23.6253          ?        ?      448.8        2.6       ?       ? 
1 1 1   34   21    9 o    373.6    2.6    0.0000   0.0000          ?        ?  1395.8083  19.1556          ?        ?      373.6        2.6       ?       ? 
1 1 1   34   21   10 o     47.6   10.3    0.0000   0.0000          ?        ?    23.6253   9.5778          ?        ?       47.6       10.3       ?       ? 
1 1 1   34   21   11 o     14.2    7.2    0.0000   0.0000          ?        ?   -31.2876   9.5778          ?        ?       14.2        7.2       ?       ? 
1 1 1   34   21   12 o    510.5    2.6    0.0000   0.0000          ?        ?  2607.0837  26.8179          ?        ?      510.5        2.6       ?       ? 
1 1 1   34   21   13 o    308.9    2.4    0.0000   0.0000          ?        ?   954.5898  14.6860          ?        ?      308.9        2.4       ?       ? 
1 1 1   34   21   14 o    252.0    2.8    0.0000   0.0000          ?        ?   635.3290  14.0475          ?        ?      252.0        2.8       ?       ? 
1 1 1   34   21   15 o    637.8    2.9    0.0000   0.0000          ?        ?  4069.2983  36.3957          ?        ?      637.8        2.9       ?       ? 
1 1 1   34   21   16 o    345.2    2.3    0.0000   0.0000          ?        ?  1192.1199  15.9630          ?        ?      345.2        2.3       ?       ? 
1 1 1   34   21   17 o    203.9    3.0    0.0000   0.0000          ?        ?   415.6776  12.1319          ?        ?      203.9        3.0       ?       ? 
1 1 1   34   21   18 o    707.6    3.2    0.0000   0.0000          ?        ?  5009.2021  45.3350          ?        ?      707.6        3.2       ?       ? 
1 1 1   34   21   19 o    437.0    2.6    0.0000   0.0000          ?        ?  1910.4568  22.3483          ?        ?      437.0        2.6       ?       ? 
1 1 1   34   21   20 o    249.9    2.7    0.0000   0.0000          ?        ?   624.4742  13.4090          ?        ?      249.9        2.7       ?       ? 
1 1 1   34   21   21 o    194.4    3.0    0.0000   0.0000          ?        ?   378.0048  11.4934          ?        ?      194.4        3.0       ?       ? 
1 1 1   34   21   22 o    199.7    3.0    0.0000   0.0000          ?        ?   399.0760  12.1319          ?        ?      199.7        3.0       ?       ? 
1 1 1   34   21   23 o    314.8    2.3    0.0000   0.0000          ?        ?   990.9855  14.6860          ?        ?      314.8        2.3       ?       ? 
1 1 1   34   21   24 o    258.5    2.7    0.0000   0.0000          ?        ?   668.5321  14.0475          ?        ?      258.5        2.7       ?       ? 
1 1 1   34   21   25 o    165.5    3.7    0.0000   0.0000          ?        ?   273.9258  12.1319          ?        ?      165.5        3.7       ?       ? 
1 1 1   34   21   26 o    131.2    4.9    0.0000   0.0000          ?        ?   172.4008  12.7704          ?        ?      131.2        4.9       ?       ? 
1 1 1   34   21   27 o    369.9    2.5    0.0000   0.0000          ?        ?  1368.3518  18.5171          ?        ?      369.9        2.5       ?       ? 
1 1 1   34   21   28 o    450.8    2.5    0.0000   0.0000          ?        ?  2032.4143  22.3483          ?        ?      450.8        2.5       ?       ? 
1 1 1   34   21   29 o    370.4    2.6    0.0000   0.0000          ?        ?  1372.1830  19.1556          ?        ?      370.4        2.6       ?       ? 
1 1 1   34   21   30 o    118.4    6.5    0.0000   0.0000          ?        ?   140.4748  15.3245          ?        ?      118.4        6.5       ?       ? 
1 1 1   34   21   31 o    588.5    2.7    0.0000   0.0000          ?        ?  3465.2568  31.9261          ?        ?      588.5        2.7       ?       ? 
1 1 1   34   21   32 o    268.2    3.2    0.0000   0.0000          ?        ?   719.6138  17.2401          ?        ?      268.2        3.2       ?       ? 
1 1 1   34   21   33 o    317.1    3.0    0.0000   0.0000          ?        ?  1006.3101  19.1556          ?        ?      317.1        3.0       ?       ? 
1 1 1   34   21   34 f    215.1    3.7    0.0000   0.0000          ?        ?   462.9282  15.9630          ?        ?      215.1        3.7       ?       ? 
1 1 1   34   21   35 o    239.5    3.5    0.0000   0.0000          ?        ?   574.0309  16.6016          ?        ?      239.5        3.5       ?       ? 
1 1 1   34   21   36 o    116.8    6.3    0.0000   0.0000          ?        ?   136.6436  14.6860          ?        ?      116.8        6.3       ?       ? 
1 1 1   34   21   37 o     86.2    9.6    0.0000   0.0000          ?        ?    74.7070  16.6016          ?        ?       86.2        9.6       ?       ? 
1 1 1   34   21   38 o    116.4    6.9    0.0000   0.0000          ?        ?   136.0051  15.9630          ?        ?      116.4        6.9       ?       ? 
1 1 1   34   21   39 o    195.1    4.1    0.0000   0.0000          ?        ?   381.1974  15.9630          ?        ?      195.1        4.1       ?       ? 
1 1 1   34   21   40 o     87.3    8.8    0.0000   0.0000          ?        ?    76.6226  15.3245          ?        ?       87.3        8.8       ?       ? 
1 1 1   34   21   41 o    347.5    2.8    0.0000   0.0000          ?        ?  1208.0829  19.7942          ?        ?      347.5        2.8       ?       ? 
1 1 1   34   21   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   21   43 o    200.1    4.1    0.0000   0.0000          ?        ?   400.9916  16.6016          ?        ?      200.1        4.1       ?       ? 
1 1 1   34   21   44 o    246.0    3.8    0.0000   0.0000          ?        ?   605.9570  18.5171          ?        ?      246.0        3.8       ?       ? 
1 1 1   34   21   45 o    345.9    3.0    0.0000   0.0000          ?        ?  1197.2280  21.0712          ?        ?      345.9        3.0       ?       ? 
1 1 1   34   21   46 o    153.3    5.8    0.0000   0.0000          ?        ?   235.6145  17.8786          ?        ?      153.3        5.8       ?       ? 
1 1 1   34   21   47 o     79.0   10.9    0.0000   0.0000          ?        ?    63.2136  17.2401          ?        ?       79.0       10.9       ?       ? 
1 1 1   34   21   48 o     19.1    9.7    0.0000   0.0000          ?        ?   -60.0210  17.8786          ?        ?       19.1        9.7       ?       ? 
1 1 1   34   21   49 o    133.3    6.9    0.0000   0.0000          ?        ?   178.7861  18.5171          ?        ?      133.3        6.9       ?       ? 
1 1 1   34   21   50 o     22.4   11.0    0.0000   0.0000          ?        ?   -38.9498  17.8786          ?        ?       22.4       11.0       ?       ? 
1 1 1   34   21   51 o     91.6    9.8    0.0000   0.0000          ?        ?    84.9234  17.8786          ?        ?       91.6        9.8       ?       ? 
1 1 1   34   21   52 o    298.4    3.3    0.0000   0.0000          ?        ?   892.0147  19.7942          ?        ?      298.4        3.3       ?       ? 
1 1 1   34   21   53 o     23.7   11.5    0.0000   0.0000          ?        ?   -29.3720  17.2401          ?        ?       23.7       11.5       ?       ? 
1 1 1   34   21   54 o    136.8    6.5    0.0000   0.0000          ?        ?   188.3639  17.8786          ?        ?      136.8        6.5       ?       ? 
1 1 1   34   21   55 o    236.8    4.0    0.0000   0.0000          ?        ?   562.5375  19.1556          ?        ?      236.8        4.0       ?       ? 
1 1 1   34   21   56 o    110.6    8.4    0.0000   0.0000          ?        ?   123.8732  18.5171          ?        ?      110.6        8.4       ?       ? 
1 1 1   34   21   57 o    241.4    4.0    0.0000   0.0000          ?        ?   584.8858  19.1556          ?        ?      241.4        4.0       ?       ? 
1 1 1   34   22    0 o    158.2    4.4  250.9390  14.0475   250.9390  14.0475   250.9390  14.0475      158.2      4.4      158.2        4.4     0.0     0.0 
1 1 1   34   22    1 o    205.7    2.8    0.0000   0.0000          ?        ?   423.3398  11.4934          ?        ?      205.7        2.8       ?       ? 
1 1 1   34   22    2 o    412.7    2.5    0.0000   0.0000          ?        ?  1703.5756  20.4327          ?        ?      412.7        2.5       ?       ? 
1 1 1   34   22    3 o    335.2    2.7    0.0000   0.0000          ?        ?  1123.7981  17.8786          ?        ?      335.2        2.7       ?       ? 
1 1 1   34   22    4 o     97.5    5.6    0.0000   0.0000          ?        ?    95.1397  10.8549          ?        ?       97.5        5.6       ?       ? 
1 1 1   34   22    5 o    404.3    2.8    0.0000   0.0000          ?        ?  1634.6154  22.9868          ?        ?      404.3        2.8       ?       ? 
1 1 1   34   22    6 f    314.3    2.5    0.0000   0.0000          ?        ?   987.7929  15.9630          ?        ?      314.3        2.5       ?       ? 
1 1 1   34   22    7 o     85.6    6.0    0.0000   0.0000          ?        ?    73.4300  10.2163          ?        ?       85.6        6.0       ?       ? 
1 1 1   34   22    8 o    394.0    2.8    0.0000   0.0000          ?        ?  1552.8845  21.7097          ?        ?      394.0        2.8       ?       ? 
1 1 1   34   22    9 o    685.7    3.3    0.0000   0.0000          ?        ?  4703.9888  45.3350          ?        ?      685.7        3.3       ?       ? 
1 1 1   34   22   10 f    277.7    2.4    0.0000   0.0000          ?        ?   771.3342  13.4090          ?        ?      277.7        2.4       ?       ? 
1 1 1   34   22   11 o    467.0    2.5    0.0000   0.0000          ?        ?  2181.1899  23.6253          ?        ?      467.0        2.5       ?       ? 
1 1 1   34   22   12 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   22   13 o     80.3    6.4    0.0000   0.0000          ?        ?    64.4907  10.2163          ?        ?       80.3        6.4       ?       ? 
1 1 1   34   22   14 o    189.7    3.0    0.0000   0.0000          ?        ?   360.1262  11.4934          ?        ?      189.7        3.0       ?       ? 
1 1 1   34   22   15 o    202.3    2.4    0.0000   0.0000          ?        ?   409.2924   9.5778          ?        ?      202.3        2.4       ?       ? 
1 1 1   34   22   16 o    534.7    2.6    0.0000   0.0000          ?        ?  2859.9382  28.0950          ?        ?      534.7        2.6       ?       ? 
1 1 1   34   22   17 o    502.4    2.5    0.0000   0.0000          ?        ?  2524.7144  24.9023          ?        ?      502.4        2.5       ?       ? 
1 1 1   34   22   18 o    444.6    2.5    0.0000   0.0000          ?        ?  1976.8630  22.3483          ?        ?      444.6        2.5       ?       ? 
1 1 1   34   22   19 o    461.2    2.6    0.0000   0.0000          ?        ?  2127.5542  24.2638          ?        ?      461.2        2.6       ?       ? 
1 1 1   34   22   20 o     33.0   12.3    0.0000   0.0000          ?        ?     8.3008  10.8549          ?        ?       33.0       12.3       ?       ? 
1 1 1   34   22   21 o    100.4    6.0    0.0000   0.0000          ?        ?   100.8864  12.1319          ?        ?      100.4        6.0       ?       ? 
1 1 1   34   22   22 o    136.7    4.2    0.0000   0.0000          ?        ?   187.0868  11.4934          ?        ?      136.7        4.2       ?       ? 
1 1 1   34   22   23 o    257.2    2.7    0.0000   0.0000          ?        ?   661.5084  14.0475          ?        ?      257.2        2.7       ?       ? 
1 1 1   34   22   24 o    229.9    3.1    0.0000   0.0000          ?        ?   528.6959  14.0475          ?        ?      229.9        3.1       ?       ? 
1 1 1   34   22   25 o    129.0    4.7    0.0000   0.0000          ?        ?   166.6541  12.1319          ?        ?      129.0        4.7       ?       ? 
1 1 1   34   22   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   22   27 o    134.1    4.8    0.0000   0.0000          ?        ?   180.0631  12.7704          ?        ?      134.1        4.8       ?       ? 
1 1 1   34   22   28 o    137.9    4.9    0.0000   0.0000          ?        ?   190.2794  13.4090          ?        ?      137.9        4.9       ?       ? 
1 1 1   34   22   29 o    177.2    4.0    0.0000   0.0000          ?        ?   314.1526  14.0475          ?        ?      177.2        4.0       ?       ? 
1 1 1   34   22   30 o    212.1    3.6    0.0000   0.0000          ?        ?   450.1577  15.3245          ?        ?      212.1        3.6       ?       ? 
1 1 1   34   22   31 o     22.9   10.9    0.0000   0.0000          ?        ?   -19.1556  14.0475          ?        ?       22.9       10.9       ?       ? 
1 1 1   34   22   32 o    195.3    3.8    0.0000   0.0000          ?        ?   381.8359  14.6860          ?        ?      195.3        3.8       ?       ? 
1 1 1   34   22   33 f     68.1   10.3    0.0000   0.0000          ?        ?    46.6121  14.0475          ?        ?       68.1       10.3       ?       ? 
1 1 1   34   22   34 o     80.1    9.2    0.0000   0.0000          ?        ?    64.4907  14.6860          ?        ?       80.1        9.2       ?       ? 
1 1 1   34   22   35 o    328.3    2.8    0.0000   0.0000          ?        ?  1078.4630  18.5171          ?        ?      328.3        2.8       ?       ? 
1 1 1   34   22   36 o    219.0    3.8    0.0000   0.0000          ?        ?   480.1682  16.6016          ?        ?      219.0        3.8       ?       ? 
1 1 1   34   22   37 f    296.2    3.1    0.0000   0.0000          ?        ?   877.9672  18.5171          ?        ?      296.2        3.1       ?       ? 
1 1 1   34   22   38 o     20.3   10.1    0.0000   0.0000          ?        ?   -35.7572  15.3245          ?        ?       20.3       10.1       ?       ? 
1 1 1   34   22   39 o    144.3    5.5    0.0000   0.0000          ?        ?   208.7966  15.9630          ?        ?      144.3        5.5       ?       ? 
1 1 1   34   22   40 o    120.4    6.9    0.0000   0.0000          ?        ?   145.5829  16.6016          ?        ?      120.4        6.9       ?       ? 
1 1 1   34   22   41 o    207.2    4.2    0.0000   0.0000          ?        ?   429.7251  17.2401          ?        ?      207.2        4.2       ?       ? 
1 1 1   34   22   42 o    309.5    3.1    0.0000   0.0000          ?        ?   958.4210  19.1556          ?        ?      309.5        3.1       ?       ? 
1 1 1   34   22   43 o     25.2   12.0    0.0000   0.0000          ?        ?   -21.0712  16.6016          ?        ?       25.2       12.0       ?       ? 
1 1 1   34   22   44 o     22.4   11.0    0.0000   0.0000          ?        ?   -32.5646  16.6016          ?        ?       22.4       11.0       ?       ? 
1 1 1   34   22   45 f    205.3    4.2    0.0000   0.0000          ?        ?   422.0628  17.2401          ?        ?      205.3        4.2       ?       ? 
1 1 1   34   22   46 o     65.5   13.6    0.0000   0.0000          ?        ?    45.3350  17.2401          ?        ?       65.5       13.6       ?       ? 
1 1 1   34   22   47 o    131.7    6.8    0.0000   0.0000          ?        ?   174.3164  17.8786          ?        ?      131.7        6.8       ?       ? 
1 1 1   34   22   48 o    220.8    4.2    0.0000   0.0000          ?        ?   488.4691  18.5171          ?        ?      220.8        4.2       ?       ? 
1 1 1   34   22   49 o    226.1    4.1    0.0000   0.0000          ?        ?   512.0943  18.5171          ?        ?      226.1        4.1       ?       ? 
1 1 1   34   22   50 o     46.2   16.2    0.0000   0.0000          ?        ?    19.7942  18.5171          ?        ?       46.2       16.2       ?       ? 
1 1 1   34   22   51 o     58.8   14.7    0.0000   0.0000          ?        ?    37.0343  17.2401          ?        ?       58.8       14.7       ?       ? 
1 1 1   34   22   52 o    105.4    8.5    0.0000   0.0000          ?        ?   112.3798  17.8786          ?        ?      105.4        8.5       ?       ? 
1 1 1   34   22   53 o     25.7   12.4    0.0000   0.0000          ?        ?   -26.1794  18.5171          ?        ?       25.7       12.4       ?       ? 
1 1 1   34   22   54 o    194.0    4.9    0.0000   0.0000          ?        ?   378.0048  19.1556          ?        ?      194.0        4.9       ?       ? 
1 1 1   34   22   55 o     35.5   15.0    0.0000   0.0000          ?        ?     1.9156  18.5171          ?        ?       35.5       15.0       ?       ? 
1 1 1   34   22   56 o     66.9   13.4    0.0000   0.0000          ?        ?    47.8891  17.2401          ?        ?       66.9       13.4       ?       ? 
1 1 1   34   23    0 o    391.2    4.2 1531.1749  32.5646  1531.1749  32.5646  1531.1749  32.5646      391.2      4.2      391.2        4.2     0.0     0.0 
1 1 1   34   23    1 o    316.5    3.0    0.0000   0.0000          ?        ?  1001.8404  19.1556          ?        ?      316.5        3.0       ?       ? 
1 1 1   34   23    2 o    408.4    2.7    0.0000   0.0000          ?        ?  1668.4569  21.7097          ?        ?      408.4        2.7       ?       ? 
1 1 1   34   23    3 o    312.7    2.7    0.0000   0.0000          ?        ?   978.2151  16.6016          ?        ?      312.7        2.7       ?       ? 
1 1 1   34   23    4 o    103.2    5.3    0.0000   0.0000          ?        ?   106.6331  10.8549          ?        ?      103.2        5.3       ?       ? 
1 1 1   34   23    5 o    706.2    3.3    0.0000   0.0000          ?        ?  4988.7695  47.2506          ?        ?      706.2        3.3       ?       ? 
1 1 1   34   23    6 o    319.7    2.7    0.0000   0.0000          ?        ?  1022.2732  17.2401          ?        ?      319.7        2.7       ?       ? 
1 1 1   34   23    7 o    465.4    2.8    0.0000   0.0000          ?        ?  2166.5039  26.1794          ?        ?      465.4        2.8       ?       ? 
1 1 1   34   23    8 o    303.7    2.6    0.0000   0.0000          ?        ?   922.6638  15.9630          ?        ?      303.7        2.6       ?       ? 
1 1 1   34   23    9 f    106.0    5.1    0.0000   0.0000          ?        ?   112.3798  10.8549          ?        ?      106.0        5.1       ?       ? 
1 1 1   34   23   10 o    494.0    2.6    0.0000   0.0000          ?        ?  2441.0681  25.5409          ?        ?      494.0        2.6       ?       ? 
1 1 1   34   23   11 o    565.9    2.7    0.0000   0.0000          ?        ?  3202.8245  30.6490          ?        ?      565.9        2.7       ?       ? 
1 1 1   34   23   12 o    449.4    2.5    0.0000   0.0000          ?        ?  2019.6438  22.3483          ?        ?      449.4        2.5       ?       ? 
1 1 1   34   23   13 o    418.4    2.4    0.0000   0.0000          ?        ?  1750.8264  20.4327          ?        ?      418.4        2.4       ?       ? 
1 1 1   34   23   14 o    302.8    2.5    0.0000   0.0000          ?        ?   916.9171  15.3245          ?        ?      302.8        2.5       ?       ? 
1 1 1   34   23   15 o    631.7    2.9    0.0000   0.0000          ?        ?  3991.3984  37.0343          ?        ?      631.7        2.9       ?       ? 
1 1 1   34   23   16 o    384.3    2.6    0.0000   0.0000          ?        ?  1476.9005  19.7942          ?        ?      384.3        2.6       ?       ? 
1 1 1   34   23   17 o    270.8    2.4    0.0000   0.0000          ?        ?   733.6614  12.7704          ?        ?      270.8        2.4       ?       ? 
1 1 1   34   23   18 o    408.4    2.7    0.0000   0.0000          ?        ?  1668.4569  21.7097          ?        ?      408.4        2.7       ?       ? 
1 1 1   34   23   19 o    606.2    2.8    0.0000   0.0000          ?        ?  3675.9690  34.4802          ?        ?      606.2        2.8       ?       ? 
1 1 1   34   23   20 o    106.6    5.1    0.0000   0.0000          ?        ?   113.6568  10.8549          ?        ?      106.6        5.1       ?       ? 
1 1 1   34   23   21 o    340.7    2.3    0.0000   0.0000          ?        ?  1160.8323  15.9630          ?        ?      340.7        2.3       ?       ? 
1 1 1   34   23   22 o    170.2    3.4    0.0000   0.0000          ?        ?   289.8888  11.4934          ?        ?      170.2        3.4       ?       ? 
1 1 1   34   23   23 o    406.2    2.4    0.0000   0.0000          ?        ?  1650.5784  19.7942          ?        ?      406.2        2.4       ?       ? 
1 1 1   34   23   24 f    291.6    2.5    0.0000   0.0000          ?        ?   850.5108  14.6860          ?        ?      291.6        2.5       ?       ? 
1 1 1   34   23   25 o    379.1    2.4    0.0000   0.0000          ?        ?  1437.9507  18.5171          ?        ?      379.1        2.4       ?       ? 
1 1 1   34   23   26 f    247.1    2.8    0.0000   0.0000          ?        ?   611.0652  14.0475          ?        ?      247.1        2.8       ?       ? 
1 1 1   34   23   27 o    405.6    2.4    0.0000   0.0000          ?        ?  1645.4703  19.7942          ?        ?      405.6        2.4       ?       ? 
1 1 1   34   23   28 o    468.9    2.5    0.0000   0.0000          ?        ?  2199.0684  22.9868          ?        ?      468.9        2.5       ?       ? 
1 1 1   34   23   29 o    292.1    2.8    0.0000   0.0000          ?        ?   853.7034  16.6016          ?        ?      292.1        2.8       ?       ? 
1 1 1   34   23   30 o    345.8    2.7    0.0000   0.0000          ?        ?  1195.9510  18.5171          ?        ?      345.8        2.7       ?       ? 
1 1 1   34   23   31 o    299.6    2.8    0.0000   0.0000          ?        ?   897.7615  16.6016          ?        ?      299.6        2.8       ?       ? 
1 1 1   34   23   32 o    180.7    4.1    0.0000   0.0000          ?        ?   326.9231  14.6860          ?        ?      180.7        4.1       ?       ? 
1 1 1   34   23   33 o    252.6    3.3    0.0000   0.0000          ?        ?   638.5216  16.6016          ?        ?      252.6        3.3       ?       ? 
1 1 1   34   23   34 o    273.7    3.3    0.0000   0.0000          ?        ?   749.6244  17.8786          ?        ?      273.7        3.3       ?       ? 
1 1 1   34   23   35 o    189.5    4.2    0.0000   0.0000          ?        ?   359.4877  15.9630          ?        ?      189.5        4.2       ?       ? 
1 1 1   34   23   36 o    404.9    2.7    0.0000   0.0000          ?        ?  1640.3621  21.7097          ?        ?      404.9        2.7       ?       ? 
1 1 1   34   23   37 o    162.6    4.9    0.0000   0.0000          ?        ?   264.9865  15.9630          ?        ?      162.6        4.9       ?       ? 
1 1 1   34   23   38 o    326.2    2.8    0.0000   0.0000          ?        ?  1064.4155  18.5171          ?        ?      326.2        2.8       ?       ? 
1 1 1   34   23   39 o    214.9    3.9    0.0000   0.0000          ?        ?   462.2897  16.6016          ?        ?      214.9        3.9       ?       ? 
1 1 1   34   23   40 o    259.8    3.4    0.0000   0.0000          ?        ?   675.5559  17.8786          ?        ?      259.8        3.4       ?       ? 
1 1 1   34   23   41 o     21.0   10.5    0.0000   0.0000          ?        ?   -47.2506  17.8786          ?        ?       21.0       10.5       ?       ? 
1 1 1   34   23   42 o    158.8    5.4    0.0000   0.0000          ?        ?   252.8546  17.2401          ?        ?      158.8        5.4       ?       ? 
1 1 1   34   23   43 o    272.4    3.4    0.0000   0.0000          ?        ?   742.6006  18.5171          ?        ?      272.4        3.4       ?       ? 
1 1 1   34   23   44 o    182.3    5.1    0.0000   0.0000          ?        ?   333.3083  18.5171          ?        ?      182.3        5.1       ?       ? 
1 1 1   34   23   45 o    142.7    6.3    0.0000   0.0000          ?        ?   204.3269  17.8786          ?        ?      142.7        6.3       ?       ? 
1 1 1   34   23   46 o     58.0   15.2    0.0000   0.0000          ?        ?    35.7572  17.8786          ?        ?       58.0       15.2       ?       ? 
1 1 1   34   23   47 o    228.7    4.0    0.0000   0.0000          ?        ?   524.2263  18.5171          ?        ?      228.7        4.0       ?       ? 
1 1 1   34   23   48 f     83.6   10.7    0.0000   0.0000          ?        ?    70.8759  17.8786          ?        ?       83.6       10.7       ?       ? 
1 1 1   34   23   49 o    158.9    5.6    0.0000   0.0000          ?        ?   253.4931  17.8786          ?        ?      158.9        5.6       ?       ? 
1 1 1   34   23   50 o     28.1   13.1    0.0000   0.0000          ?        ?   -17.8786  18.5171          ?        ?       28.1       13.1       ?       ? 
1 1 1   34   23   51 o    238.9    3.9    0.0000   0.0000          ?        ?   572.1154  18.5171          ?        ?      238.9        3.9       ?       ? 
1 1 1   34   23   52 o     74.9   11.9    0.0000   0.0000          ?        ?    57.4669  17.8786          ?        ?       74.9       11.9       ?       ? 
1 1 1   34   23   53 o     55.1   15.6    0.0000   0.0000          ?        ?    32.5646  17.8786          ?        ?       55.1       15.6       ?       ? 
1 1 1   34   23   54 o     84.7   10.9    0.0000   0.0000          ?        ?    73.4300  18.5171          ?        ?       84.7       10.9       ?       ? 
1 1 1   34   23   55 o    227.3    4.2    0.0000   0.0000          ?        ?   518.4796  19.1556          ?        ?      227.3        4.2       ?       ? 
1 1 1   34   24    0 o     65.0   22.0   54.9129  25.5409    54.9129  25.5409    54.9129  25.5409       65.0     22.0       65.0       22.0     0.0     0.0 
1 1 1   34   24    1 o    251.2    3.6    0.0000   0.0000          ?        ?   631.4979  17.8786          ?        ?      251.2        3.6       ?       ? 
1 1 1   34   24    2 f    317.2    2.9    0.0000   0.0000          ?        ?  1006.3101  18.5171          ?        ?      317.2        2.9       ?       ? 
1 1 1   34   24    3 o    594.0    3.1    0.0000   0.0000          ?        ?  3529.7476  37.0343          ?        ?      594.0        3.1       ?       ? 
1 1 1   34   24    4 o    643.4    3.2    0.0000   0.0000          ?        ?  4140.8130  41.5039          ?        ?      643.4        3.2       ?       ? 
1 1 1   34   24    5 o    518.0    3.0    0.0000   0.0000          ?        ?  2684.3450  30.6490          ?        ?      518.0        3.0       ?       ? 
1 1 1   34   24    6 f    509.4    3.1    0.0000   0.0000          ?        ?  2596.2290  31.2876          ?        ?      509.4        3.1       ?       ? 
1 1 1   34   24    7 o    254.3    2.5    0.0000   0.0000          ?        ?   646.8224  12.7704          ?        ?      254.3        2.5       ?       ? 
1 1 1   34   24    8 o    394.2    2.7    0.0000   0.0000          ?        ?  1554.1616  21.0712          ?        ?      394.2        2.7       ?       ? 
1 1 1   34   24    9 o     36.5   12.1    0.0000   0.0000          ?        ?    12.7704  10.2163          ?        ?       36.5       12.1       ?       ? 
1 1 1   34   24   10 o    492.5    2.7    0.0000   0.0000          ?        ?  2426.3821  26.1794          ?        ?      492.5        2.7       ?       ? 
1 1 1   34   24   11 o    103.2    4.6    0.0000   0.0000          ?        ?   106.6331   9.5778          ?        ?      103.2        4.6       ?       ? 
1 1 1   34   24   12 o    566.5    2.7    0.0000   0.0000          ?        ?  3209.8484  30.6490          ?        ?      566.5        2.7       ?       ? 
1 1 1   34   24   13 o    126.0    4.3    0.0000   0.0000          ?        ?   158.9919  10.8549          ?        ?      126.0        4.3       ?       ? 
1 1 1   34   24   14 o    477.9    2.5    0.0000   0.0000          ?        ?  2283.9919  24.2638          ?        ?      477.9        2.5       ?       ? 
1 1 1   34   24   15 o    135.1    4.5    0.0000   0.0000          ?        ?   182.6172  12.1319          ?        ?      135.1        4.5       ?       ? 
1 1 1   34   24   16 o     19.9    9.7    0.0000   0.0000          ?        ?   -21.0712  12.1319          ?        ?       19.9        9.7       ?       ? 
1 1 1   34   24   17 o    304.6    2.4    0.0000   0.0000          ?        ?   927.7720  14.6860          ?        ?      304.6        2.4       ?       ? 
1 1 1   34   24   18 o    219.4    2.8    0.0000   0.0000          ?        ?   481.4453  12.1319          ?        ?      219.4        2.8       ?       ? 
1 1 1   34   24   19 o    242.7    2.9    0.0000   0.0000          ?        ?   589.3555  14.0475          ?        ?      242.7        2.9       ?       ? 
1 1 1   34   24   20 o    598.6    2.6    0.0000   0.0000          ?        ?  3584.0217  31.2876          ?        ?      598.6        2.6       ?       ? 
1 1 1   34   24   21 o    378.3    2.4    0.0000   0.0000          ?        ?  1431.5654  17.8786          ?        ?      378.3        2.4       ?       ? 
1 1 1   34   24   22 o    476.8    2.5    0.0000   0.0000          ?        ?  2274.4141  24.2638          ?        ?      476.8        2.5       ?       ? 
1 1 1   34   24   23 o    361.6    2.6    0.0000   0.0000          ?        ?  1307.6923  18.5171          ?        ?      361.6        2.6       ?       ? 
1 1 1   34   24   24 o     79.8    7.6    0.0000   0.0000          ?        ?    63.8522  12.1319          ?        ?       79.8        7.6       ?       ? 
1 1 1   34   24   25 o    277.0    2.7    0.0000   0.0000          ?        ?   767.5030  14.6860          ?        ?      277.0        2.7       ?       ? 
1 1 1   34   24   26 o    265.4    2.9    0.0000   0.0000          ?        ?   704.9279  15.3245          ?        ?      265.4        2.9       ?       ? 
1 1 1   34   24   27 o    194.2    3.5    0.0000   0.0000          ?        ?   377.3663  13.4090          ?        ?      194.2        3.5       ?       ? 
1 1 1   34   24   28 o    104.0    6.8    0.0000   0.0000          ?        ?   108.5487  14.0475          ?        ?      104.0        6.8       ?       ? 
1 1 1   34   24   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   24   30 o    124.7    5.9    0.0000   0.0000          ?        ?   155.7993  14.6860          ?        ?      124.7        5.9       ?       ? 
1 1 1   34   24   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   24   32 o    216.0    3.5    0.0000   0.0000          ?        ?   466.7593  15.3245          ?        ?      216.0        3.5       ?       ? 
1 1 1   34   24   33 o    234.1    3.5    0.0000   0.0000          ?        ?   548.4901  16.6016          ?        ?      234.1        3.5       ?       ? 
1 1 1   34   24   34 o    298.5    3.1    0.0000   0.0000          ?        ?   891.3762  18.5171          ?        ?      298.5        3.1       ?       ? 
1 1 1   34   24   35 o    295.7    3.1    0.0000   0.0000          ?        ?   874.7747  18.5171          ?        ?      295.7        3.1       ?       ? 
1 1 1   34   24   36 o    249.5    3.3    0.0000   0.0000          ?        ?   623.1971  16.6016          ?        ?      249.5        3.3       ?       ? 
1 1 1   34   24   37 o    352.4    2.9    0.0000   0.0000          ?        ?  1242.5631  20.4327          ?        ?      352.4        2.9       ?       ? 
1 1 1   34   24   38 o    274.5    3.1    0.0000   0.0000          ?        ?   754.0941  17.2401          ?        ?      274.5        3.1       ?       ? 
1 1 1   34   24   39 o    153.5    5.6    0.0000   0.0000          ?        ?   236.2530  17.2401          ?        ?      153.5        5.6       ?       ? 
1 1 1   34   24   40 o     20.0    9.9    0.0000   0.0000          ?        ?   -41.5039  15.9630          ?        ?       20.0        9.9       ?       ? 
1 1 1   34   24   41 o    338.6    2.8    0.0000   0.0000          ?        ?  1147.4233  19.1556          ?        ?      338.6        2.8       ?       ? 
1 1 1   34   24   42 o     22.1   10.9    0.0000   0.0000          ?        ?   -33.8416  16.6016          ?        ?       22.1       10.9       ?       ? 
1 1 1   34   24   43 o    166.8    5.2    0.0000   0.0000          ?        ?   279.0340  17.2401          ?        ?      166.8        5.2       ?       ? 
1 1 1   34   24   44 o    213.0    4.2    0.0000   0.0000          ?        ?   454.6274  17.8786          ?        ?      213.0        4.2       ?       ? 
1 1 1   34   24   45 o    204.4    4.4    0.0000   0.0000          ?        ?   418.8702  17.8786          ?        ?      204.4        4.4       ?       ? 
1 1 1   34   24   46 o     20.9   10.4    0.0000   0.0000          ?        ?   -43.4195  17.2401          ?        ?       20.9       10.4       ?       ? 
1 1 1   34   24   47 o     51.6   16.2    0.0000   0.0000          ?        ?    27.4564  18.5171          ?        ?       51.6       16.2       ?       ? 
1 1 1   34   24   48 o     99.9    9.3    0.0000   0.0000          ?        ?   100.8864  18.5171          ?        ?       99.9        9.3       ?       ? 
1 1 1   34   24   49 o    220.4    4.5    0.0000   0.0000          ?        ?   487.1920  19.7942          ?        ?      220.4        4.5       ?       ? 
1 1 1   34   24   50 f     54.8   15.9    0.0000   0.0000          ?        ?    31.9261  18.5171          ?        ?       54.8       15.9       ?       ? 
1 1 1   34   24   51 o    226.8    4.2    0.0000   0.0000          ?        ?   515.9255  19.1556          ?        ?      226.8        4.2       ?       ? 
1 1 1   34   24   52 o     97.7    9.5    0.0000   0.0000          ?        ?    97.0553  18.5171          ?        ?       97.7        9.5       ?       ? 
1 1 1   34   24   53 o    268.1    3.8    0.0000   0.0000          ?        ?   720.8909  20.4327          ?        ?      268.1        3.8       ?       ? 
1 1 1   34   25    0 o     56.4   23.7   45.3350  26.8179    45.3350  26.8179    45.3350  26.8179       56.4     23.7       56.4       23.7     0.0     0.0 
1 1 1   34   25    1 o    168.9    5.3    0.0000   0.0000          ?        ?   285.4192  17.8786          ?        ?      168.9        5.3       ?       ? 
1 1 1   34   25    2 o    275.7    3.7    0.0000   0.0000          ?        ?   760.4792  20.4327          ?        ?      275.7        3.7       ?       ? 
1 1 1   34   25    3 o    193.7    4.0    0.0000   0.0000          ?        ?   375.4507  15.3245          ?        ?      193.7        4.0       ?       ? 
1 1 1   34   25    4 o    487.3    3.9    0.0000   0.0000          ?        ?  2375.9390  37.6728          ?        ?      487.3        3.9       ?       ? 
1 1 1   34   25    5 o    207.4    4.0    0.0000   0.0000          ?        ?   430.3636  16.6016          ?        ?      207.4        4.0       ?       ? 
1 1 1   34   25    6 o    505.6    3.7    0.0000   0.0000          ?        ?  2557.9177  37.6728          ?        ?      505.6        3.7       ?       ? 
1 1 1   34   25    7 o    190.2    4.2    0.0000   0.0000          ?        ?   362.0418  15.9630          ?        ?      190.2        4.2       ?       ? 
1 1 1   34   25    8 o    320.1    3.3    0.0000   0.0000          ?        ?  1024.8273  21.0712          ?        ?      320.1        3.3       ?       ? 
1 1 1   34   25    9 f    236.9    2.6    0.0000   0.0000          ?        ?   561.2605  12.1319          ?        ?      236.9        2.6       ?       ? 
1 1 1   34   25   10 o    268.1    2.7    0.0000   0.0000          ?        ?   718.9753  14.6860          ?        ?      268.1        2.7       ?       ? 
1 1 1   34   25   11 o    268.1    2.9    0.0000   0.0000          ?        ?   718.9753  15.3245          ?        ?      268.1        2.9       ?       ? 
1 1 1   34   25   12 o    197.6    2.7    0.0000   0.0000          ?        ?   390.7752  10.8549          ?        ?      197.6        2.7       ?       ? 
1 1 1   34   25   13 o    476.4    2.5    0.0000   0.0000          ?        ?  2270.5830  24.2638          ?        ?      476.4        2.5       ?       ? 
1 1 1   34   25   14 o    103.2    4.9    0.0000   0.0000          ?        ?   106.6331  10.2163          ?        ?      103.2        4.9       ?       ? 
1 1 1   34   25   15 o    277.3    2.5    0.0000   0.0000          ?        ?   769.4186  14.0475          ?        ?      277.3        2.5       ?       ? 
1 1 1   34   25   16 o     17.9    8.8    0.0000   0.0000          ?        ?   -25.5409  11.4934          ?        ?       17.9        8.8       ?       ? 
1 1 1   34   25   17 o    195.7    2.8    0.0000   0.0000          ?        ?   383.1130  10.8549          ?        ?      195.7        2.8       ?       ? 
1 1 1   34   25   18 o    238.9    2.7    0.0000   0.0000          ?        ?   570.8383  12.7704          ?        ?      238.9        2.7       ?       ? 
1 1 1   34   25   19 o    554.0    2.8    0.0000   0.0000          ?        ?  3070.0120  31.2876          ?        ?      554.0        2.8       ?       ? 
1 1 1   34   25   20 o    476.5    2.5    0.0000   0.0000          ?        ?  2271.2214  24.2638          ?        ?      476.5        2.5       ?       ? 
1 1 1   34   25   21 o    381.1    2.4    0.0000   0.0000          ?        ?  1452.6367  18.5171          ?        ?      381.1        2.4       ?       ? 
1 1 1   34   25   22 o    286.2    2.6    0.0000   0.0000          ?        ?   819.2233  14.6860          ?        ?      286.2        2.6       ?       ? 
1 1 1   34   25   23 o    383.2    2.5    0.0000   0.0000          ?        ?  1469.2383  19.1556          ?        ?      383.2        2.5       ?       ? 
1 1 1   34   25   24 o     23.5   10.9    0.0000   0.0000          ?        ?   -10.2163  12.1319          ?        ?       23.5       10.9       ?       ? 
1 1 1   34   25   25 o     15.3    7.8    0.0000   0.0000          ?        ?   -44.0580  12.1319          ?        ?       15.3        7.8       ?       ? 
1 1 1   34   25   26 o    156.1    4.3    0.0000   0.0000          ?        ?   243.9153  13.4090          ?        ?      156.1        4.3       ?       ? 
1 1 1   34   25   27 o    251.7    2.9    0.0000   0.0000          ?        ?   634.0520  14.6860          ?        ?      251.7        2.9       ?       ? 
1 1 1   34   25   28 o    374.5    2.6    0.0000   0.0000          ?        ?  1402.8320  19.7942          ?        ?      374.5        2.6       ?       ? 
1 1 1   34   25   29 o     31.4   13.0    0.0000   0.0000          ?        ?     2.5541  13.4090          ?        ?       31.4       13.0       ?       ? 
1 1 1   34   25   30 o    335.0    2.7    0.0000   0.0000          ?        ?  1122.5210  17.8786          ?        ?      335.0        2.7       ?       ? 
1 1 1   34   25   31 o    377.8    2.9    0.0000   0.0000          ?        ?  1427.7344  21.7097          ?        ?      377.8        2.9       ?       ? 
1 1 1   34   25   32 o    436.9    2.6    0.0000   0.0000          ?        ?  1909.8182  22.3483          ?        ?      436.9        2.6       ?       ? 
1 1 1   34   25   33 o    122.3    6.3    0.0000   0.0000          ?        ?   150.0526  15.3245          ?        ?      122.3        6.3       ?       ? 
1 1 1   34   25   34 o    135.2    5.4    0.0000   0.0000          ?        ?   183.2557  14.6860          ?        ?      135.2        5.4       ?       ? 
1 1 1   34   25   35 o    125.9    6.1    0.0000   0.0000          ?        ?   158.9919  15.3245          ?        ?      125.9        6.1       ?       ? 
1 1 1   34   25   36 o    682.0    3.0    0.0000   0.0000          ?        ?  4654.1841  40.8654          ?        ?      682.0        3.0       ?       ? 
1 1 1   34   25   37 o    353.4    3.0    0.0000   0.0000          ?        ?  1249.5868  21.0712          ?        ?      353.4        3.0       ?       ? 
1 1 1   34   25   38 o    167.5    4.6    0.0000   0.0000          ?        ?   280.9495  15.3245          ?        ?      167.5        4.6       ?       ? 
1 1 1   34   25   39 o    204.4    4.1    0.0000   0.0000          ?        ?   418.2317  16.6016          ?        ?      204.4        4.1       ?       ? 
1 1 1   34   25   40 o    282.0    3.2    0.0000   0.0000          ?        ?   796.2365  17.8786          ?        ?      282.0        3.2       ?       ? 
1 1 1   34   25   41 f    228.2    3.8    0.0000   0.0000          ?        ?   521.6721  17.2401          ?        ?      228.2        3.8       ?       ? 
1 1 1   34   25   42 o    170.6    5.1    0.0000   0.0000          ?        ?   291.8044  17.2401          ?        ?      170.6        5.1       ?       ? 
1 1 1   34   25   43 o    405.6    2.8    0.0000   0.0000          ?        ?  1646.7472  22.3483          ?        ?      405.6        2.8       ?       ? 
1 1 1   34   25   44 o    247.3    3.7    0.0000   0.0000          ?        ?   612.3422  18.5171          ?        ?      247.3        3.7       ?       ? 
1 1 1   34   25   45 o    241.4    3.8    0.0000   0.0000          ?        ?   583.6088  18.5171          ?        ?      241.4        3.8       ?       ? 
1 1 1   34   25   46 o    445.5    2.8    0.0000   0.0000          ?        ?  1986.4408  24.9023          ?        ?      445.5        2.8       ?       ? 
1 1 1   34   25   47 o    155.0    5.8    0.0000   0.0000          ?        ?   241.3612  17.8786          ?        ?      155.0        5.8       ?       ? 
1 1 1   34   25   48 o     29.0   13.4    0.0000   0.0000          ?        ?   -12.7704  17.8786          ?        ?       29.0       13.4       ?       ? 
1 1 1   34   25   49 o    162.6    5.7    0.0000   0.0000          ?        ?   265.6250  18.5171          ?        ?      162.6        5.7       ?       ? 
1 1 1   34   25   50 o    159.6    5.6    0.0000   0.0000          ?        ?   256.0471  17.8786          ?        ?      159.6        5.6       ?       ? 
1 1 1   34   25   51 o    216.2    4.4    0.0000   0.0000          ?        ?   469.3134  19.1556          ?        ?      216.2        4.4       ?       ? 
1 1 1   34   25   52 o    210.1    4.4    0.0000   0.0000          ?        ?   443.1340  18.5171          ?        ?      210.1        4.4       ?       ? 
1 1 1   34   26    0 o    126.3   11.8  164.1001  29.3720   164.1001  29.3720   164.1001  29.3720      126.3     11.8      126.3       11.8     0.0     0.0 
1 1 1   34   26    1 o    250.3    4.0    0.0000   0.0000          ?        ?   627.0282  19.7942          ?        ?      250.3        4.0       ?       ? 
1 1 1   34   26    2 o    293.7    3.9    0.0000   0.0000          ?        ?   863.2812  22.9868          ?        ?      293.7        3.9       ?       ? 
1 1 1   34   26    3 o    597.3    3.8    0.0000   0.0000          ?        ?  3569.9744  45.3350          ?        ?      597.3        3.8       ?       ? 
1 1 1   34   26    4 o    369.8    4.2    0.0000   0.0000          ?        ?  1368.3518  31.2876          ?        ?      369.8        4.2       ?       ? 
1 1 1   34   26    5 f    388.9    3.2    0.0000   0.0000          ?        ?  1513.2963  24.9023          ?        ?      388.9        3.2       ?       ? 
1 1 1   34   26    6 o    158.1    5.0    0.0000   0.0000          ?        ?   250.3005  15.9630          ?        ?      158.1        5.0       ?       ? 
1 1 1   34   26    7 o    425.2    2.9    0.0000   0.0000          ?        ?  1808.2933  24.2638          ?        ?      425.2        2.9       ?       ? 
1 1 1   34   26    8 o    300.5    3.2    0.0000   0.0000          ?        ?   903.5081  19.1556          ?        ?      300.5        3.2       ?       ? 
1 1 1   34   26    9 o    298.1    3.4    0.0000   0.0000          ?        ?   888.8221  20.4327          ?        ?      298.1        3.4       ?       ? 
1 1 1   34   26   10 o    237.9    3.6    0.0000   0.0000          ?        ?   566.3687  17.2401          ?        ?      237.9        3.6       ?       ? 
1 1 1   34   26   11 o    459.4    2.8    0.0000   0.0000          ?        ?  2111.5911  25.5409          ?        ?      459.4        2.8       ?       ? 
1 1 1   34   26   12 o    221.1    2.6    0.0000   0.0000          ?        ?   489.1075  11.4934          ?        ?      221.1        2.6       ?       ? 
1 1 1   34   26   13 f    310.9    2.5    0.0000   0.0000          ?        ?   966.7217  15.3245          ?        ?      310.9        2.5       ?       ? 
1 1 1   34   26   14 o    446.1    2.6    0.0000   0.0000          ?        ?  1990.9104  22.9868          ?        ?      446.1        2.6       ?       ? 
1 1 1   34   26   15 o    126.0    4.6    0.0000   0.0000          ?        ?   158.9919  11.4934          ?        ?      126.0        4.6       ?       ? 
1 1 1   34   26   16 o    161.3    3.8    0.0000   0.0000          ?        ?   260.5168  12.1319          ?        ?      161.3        3.8       ?       ? 
1 1 1   34   26   17 o    173.7    3.9    0.0000   0.0000          ?        ?   302.0207  13.4090          ?        ?      173.7        3.9       ?       ? 
1 1 1   34   26   18 o    268.9    2.6    0.0000   0.0000          ?        ?   723.4450  14.0475          ?        ?      268.9        2.6       ?       ? 
1 1 1   34   26   19 o    332.4    2.4    0.0000   0.0000          ?        ?  1105.2810  15.9630          ?        ?      332.4        2.4       ?       ? 
1 1 1   34   26   20 o    431.2    2.5    0.0000   0.0000          ?        ?  1860.0134  21.7097          ?        ?      431.2        2.5       ?       ? 
1 1 1   34   26   21 o    150.5    3.8    0.0000   0.0000          ?        ?   226.6752  11.4934          ?        ?      150.5        3.8       ?       ? 
1 1 1   34   26   22 o    209.7    3.2    0.0000   0.0000          ?        ?   439.9414  13.4090          ?        ?      209.7        3.2       ?       ? 
1 1 1   34   26   23 f    197.1    3.2    0.0000   0.0000          ?        ?   388.8597  12.7704          ?        ?      197.1        3.2       ?       ? 
1 1 1   34   26   24 o    303.5    2.6    0.0000   0.0000          ?        ?   921.3867  15.9630          ?        ?      303.5        2.6       ?       ? 
1 1 1   34   26   25 o     77.7    7.8    0.0000   0.0000          ?        ?    60.6596  12.1319          ?        ?       77.7        7.8       ?       ? 
1 1 1   34   26   26 o    143.1    4.5    0.0000   0.0000          ?        ?   204.9654  12.7704          ?        ?      143.1        4.5       ?       ? 
1 1 1   34   26   27 o     18.3    9.1    0.0000   0.0000          ?        ?   -35.1187  13.4090          ?        ?       18.3        9.1       ?       ? 
1 1 1   34   26   28 o    295.5    2.8    0.0000   0.0000          ?        ?   873.4976  16.6016          ?        ?      295.5        2.8       ?       ? 
1 1 1   34   26   29 o     16.5    8.3    0.0000   0.0000          ?        ?   -40.8654  12.7704          ?        ?       16.5        8.3       ?       ? 
1 1 1   34   26   30 o    279.4    3.0    0.0000   0.0000          ?        ?   780.9120  16.6016          ?        ?      279.4        3.0       ?       ? 
1 1 1   34   26   31 o    435.4    2.7    0.0000   0.0000          ?        ?  1896.4092  23.6253          ?        ?      435.4        2.7       ?       ? 
1 1 1   34   26   32 o    481.5    2.6    0.0000   0.0000          ?        ?  2319.7490  24.9023          ?        ?      481.5        2.6       ?       ? 
1 1 1   34   26   33 o    161.1    4.8    0.0000   0.0000          ?        ?   259.8783  15.3245          ?        ?      161.1        4.8       ?       ? 
1 1 1   34   26   34 o     73.4   10.0    0.0000   0.0000          ?        ?    54.2743  14.6860          ?        ?       73.4       10.0       ?       ? 
1 1 1   34   26   35 o    369.6    2.8    0.0000   0.0000          ?        ?  1367.0748  20.4327          ?        ?      369.6        2.8       ?       ? 
1 1 1   34   26   36 f    183.7    4.2    0.0000   0.0000          ?        ?   337.7780  15.3245          ?        ?      183.7        4.2       ?       ? 
1 1 1   34   26   37 o     29.8   13.1    0.0000   0.0000          ?        ?    -4.4697  15.3245          ?        ?       29.8       13.1       ?       ? 
1 1 1   34   26   38 o    101.1    7.6    0.0000   0.0000          ?        ?   102.8020  15.3245          ?        ?      101.1        7.6       ?       ? 
1 1 1   34   26   39 o    160.0    5.0    0.0000   0.0000          ?        ?   256.6857  15.9630          ?        ?      160.0        5.0       ?       ? 
1 1 1   34   26   40 o    173.6    4.6    0.0000   0.0000          ?        ?   302.0207  15.9630          ?        ?      173.6        4.6       ?       ? 
1 1 1   34   26   41 o     40.9   15.0    0.0000   0.0000          ?        ?    14.0475  15.9630          ?        ?       40.9       15.0       ?       ? 
1 1 1   34   26   42 o    288.8    3.3    0.0000   0.0000          ?        ?   835.1863  19.1556          ?        ?      288.8        3.3       ?       ? 
1 1 1   34   26   43 o     42.2   15.3    0.0000   0.0000          ?        ?    15.3245  16.6016          ?        ?       42.2       15.3       ?       ? 
1 1 1   34   26   44 o    219.9    4.1    0.0000   0.0000          ?        ?   484.6379  17.8786          ?        ?      219.9        4.1       ?       ? 
1 1 1   34   26   45 o    198.5    4.5    0.0000   0.0000          ?        ?   395.2449  17.8786          ?        ?      198.5        4.5       ?       ? 
1 1 1   34   26   46 o     30.0   13.5    0.0000   0.0000          ?        ?    -8.3008  17.2401          ?        ?       30.0       13.5       ?       ? 
1 1 1   34   26   47 o     58.2   15.2    0.0000   0.0000          ?        ?    36.3957  17.8786          ?        ?       58.2       15.2       ?       ? 
1 1 1   34   26   48 o    118.8    7.5    0.0000   0.0000          ?        ?   142.3903  17.8786          ?        ?      118.8        7.5       ?       ? 
1 1 1   34   26   49 o    263.9    3.6    0.0000   0.0000          ?        ?   697.9042  19.1556          ?        ?      263.9        3.6       ?       ? 
1 1 1   34   26   50 o    119.8    7.5    0.0000   0.0000          ?        ?   144.9444  17.8786          ?        ?      119.8        7.5       ?       ? 
1 1 1   34   26   51 o    170.2    4.9    0.0000   0.0000          ?        ?   291.1659  16.6016          ?        ?      170.2        4.9       ?       ? 
1 1 1   34   27    0 o    331.2    4.8 1098.2572  31.9261  1098.2572  31.9261  1098.2572  31.9261      331.2      4.8      331.2        4.8     0.0     0.0 
1 1 1   34   27    1 o    284.1    3.7    0.0000   0.0000          ?        ?   807.7299  21.0712          ?        ?      284.1        3.7       ?       ? 
1 1 1   34   27    2 o    177.9    5.2    0.0000   0.0000          ?        ?   316.7067  18.5171          ?        ?      177.9        5.2       ?       ? 
1 1 1   34   27    3 o    175.7    5.3    0.0000   0.0000          ?        ?   309.0445  18.5171          ?        ?      175.7        5.3       ?       ? 
1 1 1   34   27    4 o    171.6    6.1    0.0000   0.0000          ?        ?   294.9970  21.0712          ?        ?      171.6        6.1       ?       ? 
1 1 1   34   27    5 f    271.7    3.9    0.0000   0.0000          ?        ?   738.7695  21.0712          ?        ?      271.7        3.9       ?       ? 
1 1 1   34   27    6 o    169.4    6.2    0.0000   0.0000          ?        ?   287.3347  21.0712          ?        ?      169.4        6.2       ?       ? 
1 1 1   34   27    7 o    233.2    3.0    0.0000   0.0000          ?        ?   544.0204  14.0475          ?        ?      233.2        3.0       ?       ? 
1 1 1   34   27    8 o    183.2    3.7    0.0000   0.0000          ?        ?   335.8624  13.4090          ?        ?      183.2        3.7       ?       ? 
1 1 1   34   27    9 o    156.7    4.7    0.0000   0.0000          ?        ?   245.8308  14.6860          ?        ?      156.7        4.7       ?       ? 
1 1 1   34   27   10 o    113.5    6.5    0.0000   0.0000          ?        ?   128.9814  14.6860          ?        ?      113.5        6.5       ?       ? 
1 1 1   34   27   11 o     23.6   11.3    0.0000   0.0000          ?        ?   -19.1556  14.6860          ?        ?       23.6       11.3       ?       ? 
1 1 1   34   27   12 o     52.0   10.2    0.0000   0.0000          ?        ?    28.0950  10.2163          ?        ?       52.0       10.2       ?       ? 
1 1 1   34   27   13 o    463.2    2.8    0.0000   0.0000          ?        ?  2146.0713  25.5409          ?        ?      463.2        2.8       ?       ? 
1 1 1   34   27   14 o     38.3   12.0    0.0000   0.0000          ?        ?    14.6860  10.2163          ?        ?       38.3       12.0       ?       ? 
1 1 1   34   27   15 o    215.6    2.8    0.0000   0.0000          ?        ?   464.8438  12.1319          ?        ?      215.6        2.8       ?       ? 
1 1 1   34   27   16 f    322.1    2.6    0.0000   0.0000          ?        ?  1037.5977  16.6016          ?        ?      322.1        2.6       ?       ? 
1 1 1   34   27   17 o    665.8    3.3    0.0000   0.0000          ?        ?  4435.8101  44.0580          ?        ?      665.8        3.3       ?       ? 
1 1 1   34   27   18 o    401.9    2.5    0.0000   0.0000          ?        ?  1615.4597  19.7942          ?        ?      401.9        2.5       ?       ? 
1 1 1   34   27   19 o    519.8    2.7    0.0000   0.0000          ?        ?  2703.5005  28.0950          ?        ?      519.8        2.7       ?       ? 
1 1 1   34   27   20 o    251.4    2.7    0.0000   0.0000          ?        ?   632.1364  13.4090          ?        ?      251.4        2.7       ?       ? 
1 1 1   34   27   21 f    364.1    2.4    0.0000   0.0000          ?        ?  1326.2094  17.2401          ?        ?      364.1        2.4       ?       ? 
1 1 1   34   27   22 o    117.9    4.9    0.0000   0.0000          ?        ?   139.1977  11.4934          ?        ?      117.9        4.9       ?       ? 
1 1 1   34   27   23 o    251.1    2.9    0.0000   0.0000          ?        ?   630.8594  14.6860          ?        ?      251.1        2.9       ?       ? 
1 1 1   34   27   24 o    216.4    3.1    0.0000   0.0000          ?        ?   468.6749  13.4090          ?        ?      216.4        3.1       ?       ? 
1 1 1   34   27   25 o    402.8    2.5    0.0000   0.0000          ?        ?  1623.1219  19.7942          ?        ?      402.8        2.5       ?       ? 
1 1 1   34   27   26 o    287.5    2.7    0.0000   0.0000          ?        ?   826.8855  15.3245          ?        ?      287.5        2.7       ?       ? 
1 1 1   34   27   27 o    157.5    4.3    0.0000   0.0000          ?        ?   248.3849  13.4090          ?        ?      157.5        4.3       ?       ? 
1 1 1   34   27   28 f    172.8    3.9    0.0000   0.0000          ?        ?   298.8281  13.4090          ?        ?      172.8        3.9       ?       ? 
1 1 1   34   27   29 o    147.7    4.8    0.0000   0.0000          ?        ?   218.3744  14.0475          ?        ?      147.7        4.8       ?       ? 
1 1 1   34   27   30 o    187.0    3.9    0.0000   0.0000          ?        ?   349.9099  14.6860          ?        ?      187.0        3.9       ?       ? 
1 1 1   34   27   31 o    399.0    2.7    0.0000   0.0000          ?        ?  1593.1115  21.7097          ?        ?      399.0        2.7       ?       ? 
1 1 1   34   27   32 o    395.1    2.6    0.0000   0.0000          ?        ?  1561.8240  20.4327          ?        ?      395.1        2.6       ?       ? 
1 1 1   34   27   33 o    155.2    4.7    0.0000   0.0000          ?        ?   241.3612  14.6860          ?        ?      155.2        4.7       ?       ? 
1 1 1   34   27   34 o    319.8    2.9    0.0000   0.0000          ?        ?  1023.5502  18.5171          ?        ?      319.8        2.9       ?       ? 
1 1 1   34   27   35 o     35.9   14.3    0.0000   0.0000          ?        ?     7.0237  15.3245          ?        ?       35.9       14.3       ?       ? 
1 1 1   34   27   36 o     72.9   10.5    0.0000   0.0000          ?        ?    53.6358  15.3245          ?        ?       72.9       10.5       ?       ? 
1 1 1   34   27   37 o    142.9    5.8    0.0000   0.0000          ?        ?   204.9654  16.6016          ?        ?      142.9        5.8       ?       ? 
1 1 1   34   27   38 o     64.3   12.9    0.0000   0.0000          ?        ?    43.4195  15.9630          ?        ?       64.3       12.9       ?       ? 
1 1 1   34   27   39 o    210.6    3.9    0.0000   0.0000          ?        ?   444.4110  16.6016          ?        ?      210.6        3.9       ?       ? 
1 1 1   34   27   40 o    106.6    7.5    0.0000   0.0000          ?        ?   114.2954  15.9630          ?        ?      106.6        7.5       ?       ? 
1 1 1   34   27   41 o    282.7    3.2    0.0000   0.0000          ?        ?   800.0676  17.8786          ?        ?      282.7        3.2       ?       ? 
1 1 1   34   27   42 o    128.0    6.5    0.0000   0.0000          ?        ?   164.7386  16.6016          ?        ?      128.0        6.5       ?       ? 
1 1 1   34   27   43 o     33.4   14.1    0.0000   0.0000          ?        ?     1.9156  15.9630          ?        ?       33.4       14.1       ?       ? 
1 1 1   34   27   44 o    134.3    6.2    0.0000   0.0000          ?        ?   181.3401  16.6016          ?        ?      134.3        6.2       ?       ? 
1 1 1   34   27   45 o    235.0    3.9    0.0000   0.0000          ?        ?   553.5982  18.5171          ?        ?      235.0        3.9       ?       ? 
1 1 1   34   27   46 o    160.7    5.2    0.0000   0.0000          ?        ?   259.2398  16.6016          ?        ?      160.7        5.2       ?       ? 
1 1 1   34   27   47 o     81.6   10.2    0.0000   0.0000          ?        ?    67.6833  16.6016          ?        ?       81.6       10.2       ?       ? 
1 1 1   34   27   48 o    221.1    4.2    0.0000   0.0000          ?        ?   490.3846  18.5171          ?        ?      221.1        4.2       ?       ? 
1 1 1   34   27   49 o     24.3   11.7    0.0000   0.0000          ?        ?   -26.1794  17.2401          ?        ?       24.3       11.7       ?       ? 
1 1 1   34   27   50 o    139.6    6.4    0.0000   0.0000          ?        ?   196.6647  17.8786          ?        ?      139.6        6.4       ?       ? 
1 1 1   34   28    0 o    273.4    5.0  748.9859  27.4564   748.9859  27.4564   748.9859  27.4564      273.4      5.0      273.4        5.0     0.0     0.0 
1 1 1   34   28    1 o    144.8    6.6    0.0000   0.0000          ?        ?   210.0736  19.1556          ?        ?      144.8        6.6       ?       ? 
1 1 1   34   28    2 o     61.3   15.2    0.0000   0.0000          ?        ?    39.5883  18.5171          ?        ?       61.3       15.2       ?       ? 
1 1 1   34   28    3 o    168.8    5.5    0.0000   0.0000          ?        ?   285.4192  18.5171          ?        ?      168.8        5.5       ?       ? 
1 1 1   34   28    4 o    220.7    5.2    0.0000   0.0000          ?        ?   487.8305  22.9868          ?        ?      220.7        5.2       ?       ? 
1 1 1   34   28    5 o    349.0    3.9    0.0000   0.0000          ?        ?  1218.9377  27.4564          ?        ?      349.0        3.9       ?       ? 
1 1 1   34   28    6 o    310.8    4.0    0.0000   0.0000          ?        ?   966.7217  24.9023          ?        ?      310.8        4.0       ?       ? 
1 1 1   34   28    7 o    444.2    3.4    0.0000   0.0000          ?        ?  1974.3090  30.0105          ?        ?      444.2        3.4       ?       ? 
1 1 1   34   28    8 o    197.5    5.0    0.0000   0.0000          ?        ?   390.7752  19.7942          ?        ?      197.5        5.0       ?       ? 
1 1 1   34   28    9 o    506.2    3.0    0.0000   0.0000          ?        ?  2563.6643  30.6490          ?        ?      506.2        3.0       ?       ? 
1 1 1   34   28   10 o    358.0    3.6    0.0000   0.0000          ?        ?  1282.7899  25.5409          ?        ?      358.0        3.6       ?       ? 
1 1 1   34   28   11 o    546.6    4.0    0.0000   0.0000          ?        ?  2990.8352  44.0580          ?        ?      546.6        4.0       ?       ? 
1 1 1   34   28   12 o    319.3    3.1    0.0000   0.0000          ?        ?  1020.3576  19.7942          ?        ?      319.3        3.1       ?       ? 
1 1 1   34   28   13 o    280.7    3.0    0.0000   0.0000          ?        ?   788.5742  16.6016          ?        ?      280.7        3.0       ?       ? 
1 1 1   34   28   14 o    218.8    2.5    0.0000   0.0000          ?        ?   478.8912  10.8549          ?        ?      218.8        2.5       ?       ? 
1 1 1   34   28   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   28   16 o    221.2    2.9    0.0000   0.0000          ?        ?   489.7461  12.7704          ?        ?      221.2        2.9       ?       ? 
1 1 1   34   28   17 o    297.3    2.7    0.0000   0.0000          ?        ?   884.3525  15.9630          ?        ?      297.3        2.7       ?       ? 
1 1 1   34   28   18 o    115.5    3.6    0.0000   0.0000          ?        ?   133.4510   8.3008          ?        ?      115.5        3.6       ?       ? 
1 1 1   34   28   19 o    149.4    3.4    0.0000   0.0000          ?        ?   223.4826  10.2163          ?        ?      149.4        3.4       ?       ? 
1 1 1   34   28   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   28   21 o     47.5   12.1    0.0000   0.0000          ?        ?    23.6253  11.4934          ?        ?       47.5       12.1       ?       ? 
1 1 1   34   28   22 o    218.2    2.9    0.0000   0.0000          ?        ?   476.3371  12.7704          ?        ?      218.2        2.9       ?       ? 
1 1 1   34   28   23 o    268.8    2.6    0.0000   0.0000          ?        ?   722.8065  14.0475          ?        ?      268.8        2.6       ?       ? 
1 1 1   34   28   24 o    355.0    2.5    0.0000   0.0000          ?        ?  1261.0802  17.8786          ?        ?      355.0        2.5       ?       ? 
1 1 1   34   28   25 f     98.4    6.5    0.0000   0.0000          ?        ?    97.0553  12.7704          ?        ?       98.4        6.5       ?       ? 
1 1 1   34   28   26 o    412.7    2.4    0.0000   0.0000          ?        ?  1703.5756  19.7942          ?        ?      412.7        2.4       ?       ? 
1 1 1   34   28   27 o     77.3    8.3    0.0000   0.0000          ?        ?    60.0210  12.7704          ?        ?       77.3        8.3       ?       ? 
1 1 1   34   28   28 o    116.8    5.5    0.0000   0.0000          ?        ?   136.6436  12.7704          ?        ?      116.8        5.5       ?       ? 
1 1 1   34   28   29 o    259.1    2.8    0.0000   0.0000          ?        ?   671.7247  14.6860          ?        ?      259.1        2.8       ?       ? 
1 1 1   34   28   30 o    393.3    2.7    0.0000   0.0000          ?        ?  1547.7764  21.0712          ?        ?      393.3        2.7       ?       ? 
1 1 1   34   28   31 o    196.9    3.7    0.0000   0.0000          ?        ?   388.2211  14.6860          ?        ?      196.9        3.7       ?       ? 
1 1 1   34   28   32 o     30.9   13.1    0.0000   0.0000          ?        ?     0.6385  14.0475          ?        ?       30.9       13.1       ?       ? 
1 1 1   34   28   33 o    204.1    3.9    0.0000   0.0000          ?        ?   416.9547  15.9630          ?        ?      204.1        3.9       ?       ? 
1 1 1   34   28   34 o    434.5    2.6    0.0000   0.0000          ?        ?  1888.7469  22.3483          ?        ?      434.5        2.6       ?       ? 
1 1 1   34   28   35 o    150.0    4.9    0.0000   0.0000          ?        ?   225.3981  14.6860          ?        ?      150.0        4.9       ?       ? 
1 1 1   34   28   36 o    217.5    3.8    0.0000   0.0000          ?        ?   473.7830  16.6016          ?        ?      217.5        3.8       ?       ? 
1 1 1   34   28   37 o    260.7    3.3    0.0000   0.0000          ?        ?   680.6641  17.2401          ?        ?      260.7        3.3       ?       ? 
1 1 1   34   28   38 o     20.7   10.2    0.0000   0.0000          ?        ?   -33.8416  15.3245          ?        ?       20.7       10.2       ?       ? 
1 1 1   34   28   39 o    213.0    4.0    0.0000   0.0000          ?        ?   454.6274  17.2401          ?        ?      213.0        4.0       ?       ? 
1 1 1   34   28   40 o    184.8    4.3    0.0000   0.0000          ?        ?   342.2476  15.9630          ?        ?      184.8        4.3       ?       ? 
1 1 1   34   28   41 o     31.8   13.7    0.0000   0.0000          ?        ?    -1.2770  15.9630          ?        ?       31.8       13.7       ?       ? 
1 1 1   34   28   42 o    271.2    3.4    0.0000   0.0000          ?        ?   736.8539  18.5171          ?        ?      271.2        3.4       ?       ? 
1 1 1   34   28   43 o    236.0    3.8    0.0000   0.0000          ?        ?   558.0679  17.8786          ?        ?      236.0        3.8       ?       ? 
1 1 1   34   28   44 o     78.4   10.6    0.0000   0.0000          ?        ?    62.5751  16.6016          ?        ?       78.4       10.6       ?       ? 
1 1 1   34   28   45 o    162.6    5.5    0.0000   0.0000          ?        ?   265.6250  17.8786          ?        ?      162.6        5.5       ?       ? 
1 1 1   34   28   46 o     18.2    9.2    0.0000   0.0000          ?        ?   -56.8284  16.6016          ?        ?       18.2        9.2       ?       ? 
1 1 1   34   28   47 o    162.9    5.3    0.0000   0.0000          ?        ?   266.9020  17.2401          ?        ?      162.9        5.3       ?       ? 
1 1 1   34   28   48 o     58.5   14.7    0.0000   0.0000          ?        ?    37.0343  17.2401          ?        ?       58.5       14.7       ?       ? 
1 1 1   34   29    0 f    211.6    8.6  450.7963  36.3957   450.7963  36.3957   450.7963  36.3957      211.6      8.6      211.6        8.6     0.0     0.0 
1 1 1   34   29    1 o    255.3    5.1    0.0000   0.0000          ?        ?   652.5691  26.1794          ?        ?      255.3        5.1       ?       ? 
1 1 1   34   29    2 o     83.1   15.2    0.0000   0.0000          ?        ?    72.1529  24.2638          ?        ?       83.1       15.2       ?       ? 
1 1 1   34   29    3 o    242.4    5.7    0.0000   0.0000          ?        ?   588.7169  27.4564          ?        ?      242.4        5.7       ?       ? 
1 1 1   34   29    4 o    188.7    6.3    0.0000   0.0000          ?        ?   356.9336  23.6253          ?        ?      188.7        6.3       ?       ? 
1 1 1   34   29    5 o    550.6    4.5    0.0000   0.0000          ?        ?  3035.5317  49.1662          ?        ?      550.6        4.5       ?       ? 
1 1 1   34   29    6 o    454.7    4.5    0.0000   0.0000          ?        ?  2070.0872  40.8654          ?        ?      454.7        4.5       ?       ? 
1 1 1   34   29    7 o    304.2    5.0    0.0000   0.0000          ?        ?   926.4949  30.6490          ?        ?      304.2        5.0       ?       ? 
1 1 1   34   29    8 o    178.9    8.0    0.0000   0.0000          ?        ?   321.1764  28.7335          ?        ?      178.9        8.0       ?       ? 
1 1 1   34   29    9 o    371.4    3.6    0.0000   0.0000          ?        ?  1380.4838  26.8179          ?        ?      371.4        3.6       ?       ? 
1 1 1   34   29   10 o    369.4    3.4    0.0000   0.0000          ?        ?  1365.1593  24.9023          ?        ?      369.4        3.4       ?       ? 
1 1 1   34   29   11 o    597.6    3.5    0.0000   0.0000          ?        ?  3573.8057  42.1424          ?        ?      597.6        3.5       ?       ? 
1 1 1   34   29   12 o    246.4    2.9    0.0000   0.0000          ?        ?   607.2341  14.0475          ?        ?      246.4        2.9       ?       ? 
1 1 1   34   29   13 o    210.7    3.3    0.0000   0.0000          ?        ?   444.4110  14.0475          ?        ?      210.7        3.3       ?       ? 
1 1 1   34   29   14 o    294.5    2.9    0.0000   0.0000          ?        ?   867.7509  17.2401          ?        ?      294.5        2.9       ?       ? 
1 1 1   34   29   15 o    299.8    3.0    0.0000   0.0000          ?        ?   899.0385  17.8786          ?        ?      299.8        3.0       ?       ? 
1 1 1   34   29   16 o    214.4    3.0    0.0000   0.0000          ?        ?   459.7356  12.7704          ?        ?      214.4        3.0       ?       ? 
1 1 1   34   29   17 f    116.0    5.0    0.0000   0.0000          ?        ?   134.7281  11.4934          ?        ?      116.0        5.0       ?       ? 
1 1 1   34   29   18 o    214.4    3.1    0.0000   0.0000          ?        ?   459.7356  13.4090          ?        ?      214.4        3.1       ?       ? 
1 1 1   34   29   19 o    125.5    3.8    0.0000   0.0000          ?        ?   157.7148   9.5778          ?        ?      125.5        3.8       ?       ? 
1 1 1   34   29   20 o    250.2    2.7    0.0000   0.0000          ?        ?   626.3897  13.4090          ?        ?      250.2        2.7       ?       ? 
1 1 1   34   29   21 o    252.0    2.5    0.0000   0.0000          ?        ?   635.3290  12.7704          ?        ?      252.0        2.5       ?       ? 
1 1 1   34   29   22 o    262.7    2.7    0.0000   0.0000          ?        ?   690.2419  14.0475          ?        ?      262.7        2.7       ?       ? 
1 1 1   34   29   23 o    372.4    2.6    0.0000   0.0000          ?        ?  1387.5076  19.1556          ?        ?      372.4        2.6       ?       ? 
1 1 1   34   29   24 o    193.4    3.5    0.0000   0.0000          ?        ?   374.1737  13.4090          ?        ?      193.4        3.5       ?       ? 
1 1 1   34   29   25 o    429.5    2.5    0.0000   0.0000          ?        ?  1845.3275  21.0712          ?        ?      429.5        2.5       ?       ? 
1 1 1   34   29   26 o     75.2    8.5    0.0000   0.0000          ?        ?    56.8284  12.7704          ?        ?       75.2        8.5       ?       ? 
1 1 1   34   29   27 o    267.0    2.9    0.0000   0.0000          ?        ?   713.2286  15.3245          ?        ?      267.0        2.9       ?       ? 
1 1 1   34   29   28 o    343.6    2.6    0.0000   0.0000          ?        ?  1181.2650  17.8786          ?        ?      343.6        2.6       ?       ? 
1 1 1   34   29   29 o     81.3    8.3    0.0000   0.0000          ?        ?    66.4062  13.4090          ?        ?       81.3        8.3       ?       ? 
1 1 1   34   29   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   29   31 o    467.6    2.6    0.0000   0.0000          ?        ?  2187.5752  24.2638          ?        ?      467.6        2.6       ?       ? 
1 1 1   34   29   32 o     38.8   14.0    0.0000   0.0000          ?        ?    12.7704  14.0475          ?        ?       38.8       14.0       ?       ? 
1 1 1   34   29   33 o    288.8    2.9    0.0000   0.0000          ?        ?   834.5477  16.6016          ?        ?      288.8        2.9       ?       ? 
1 1 1   34   29   34 o     16.6    8.4    0.0000   0.0000          ?        ?   -45.3350  13.4090          ?        ?       16.6        8.4       ?       ? 
1 1 1   34   29   35 o    124.1    6.2    0.0000   0.0000          ?        ?   154.5222  15.3245          ?        ?      124.1        6.2       ?       ? 
1 1 1   34   29   36 o    141.4    5.6    0.0000   0.0000          ?        ?   200.4958  15.9630          ?        ?      141.4        5.6       ?       ? 
1 1 1   34   29   37 o     77.5    9.9    0.0000   0.0000          ?        ?    60.6596  15.3245          ?        ?       77.5        9.9       ?       ? 
1 1 1   34   29   38 o    176.7    4.5    0.0000   0.0000          ?        ?   312.8756  15.9630          ?        ?      176.7        4.5       ?       ? 
1 1 1   34   29   39 o     48.5   15.0    0.0000   0.0000          ?        ?    24.2638  15.9630          ?        ?       48.5       15.0       ?       ? 
1 1 1   34   29   40 o     84.1    9.5    0.0000   0.0000          ?        ?    71.5144  15.9630          ?        ?       84.1        9.5       ?       ? 
1 1 1   34   29   41 o     19.7    9.8    0.0000   0.0000          ?        ?   -42.7809  15.9630          ?        ?       19.7        9.8       ?       ? 
1 1 1   34   29   42 o    129.9    6.4    0.0000   0.0000          ?        ?   169.8468  16.6016          ?        ?      129.9        6.4       ?       ? 
1 1 1   34   29   43 o    241.8    3.7    0.0000   0.0000          ?        ?   586.1629  17.8786          ?        ?      241.8        3.7       ?       ? 
1 1 1   34   29   44 o     28.3   13.0    0.0000   0.0000          ?        ?   -10.8549  16.6016          ?        ?       28.3       13.0       ?       ? 
1 1 1   34   29   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   29   46 o    218.4    3.9    0.0000   0.0000          ?        ?   478.2527  17.2401          ?        ?      218.4        3.9       ?       ? 
1 1 1   34   29   47 o     21.6   10.6    0.0000   0.0000          ?        ?   -31.9261  15.9630          ?        ?       21.6       10.6       ?       ? 
1 1 1   34   30    0 o     45.4   23.8   30.6490  28.0950    30.6490  28.0950    30.6490  28.0950       45.4     23.8       45.4       23.8     0.0     0.0 
1 1 1   34   30    1 o    286.3    4.2    0.0000   0.0000          ?        ?   820.5003  24.2638          ?        ?      286.3        4.2       ?       ? 
1 1 1   34   30    2 o    292.1    3.8    0.0000   0.0000          ?        ?   853.7034  22.3483          ?        ?      292.1        3.8       ?       ? 
1 1 1   34   30    3 o    416.1    4.0    0.0000   0.0000          ?        ?  1732.9476  33.2031          ?        ?      416.1        4.0       ?       ? 
1 1 1   34   30    4 o    151.3    8.4    0.0000   0.0000          ?        ?   229.8678  25.5409          ?        ?      151.3        8.4       ?       ? 
1 1 1   34   30    5 o    450.9    5.4    0.0000   0.0000          ?        ?  2036.8840  48.5276          ?        ?      450.9        5.4       ?       ? 
1 1 1   34   30    6 o    492.4    4.5    0.0000   0.0000          ?        ?  2427.0208  44.0580          ?        ?      492.4        4.5       ?       ? 
1 1 1   34   30    7 o    280.3    4.7    0.0000   0.0000          ?        ?   786.6586  26.1794          ?        ?      280.3        4.7       ?       ? 
1 1 1   34   30    8 o    267.8    5.2    0.0000   0.0000          ?        ?   718.3369  28.0950          ?        ?      267.8        5.2       ?       ? 
1 1 1   34   30    9 o    362.8    6.6    0.0000   0.0000          ?        ?  1319.8242  47.8891          ?        ?      362.8        6.6       ?       ? 
1 1 1   34   30   10 o    258.2    4.3    0.0000   0.0000          ?        ?   667.2551  22.3483          ?        ?      258.2        4.3       ?       ? 
1 1 1   34   30   11 o    131.4    5.8    0.0000   0.0000          ?        ?   173.0394  15.3245          ?        ?      131.4        5.8       ?       ? 
1 1 1   34   30   12 o     90.6    8.1    0.0000   0.0000          ?        ?    82.3693  14.6860          ?        ?       90.6        8.1       ?       ? 
1 1 1   34   30   13 o    127.8    4.5    0.0000   0.0000          ?        ?   163.4615  11.4934          ?        ?      127.8        4.5       ?       ? 
1 1 1   34   30   14 o    276.8    3.1    0.0000   0.0000          ?        ?   766.8644  17.2401          ?        ?      276.8        3.1       ?       ? 
1 1 1   34   30   15 f    620.5    3.4    0.0000   0.0000          ?        ?  3852.8396  42.1424          ?        ?      620.5        3.4       ?       ? 
1 1 1   34   30   16 o     35.7   13.8    0.0000   0.0000          ?        ?     8.3008  14.0475          ?        ?       35.7       13.8       ?       ? 
1 1 1   34   30   17 o    181.5    3.3    0.0000   0.0000          ?        ?   329.4771  12.1319          ?        ?      181.5        3.3       ?       ? 
1 1 1   34   30   18 o    190.0    3.7    0.0000   0.0000          ?        ?   361.4032  14.0475          ?        ?      190.0        3.7       ?       ? 
1 1 1   34   30   19 o    604.3    3.1    0.0000   0.0000          ?        ?  3654.2593  37.6728          ?        ?      604.3        3.1       ?       ? 
1 1 1   34   30   20 o     72.3    6.6    0.0000   0.0000          ?        ?    52.3588   9.5778          ?        ?       72.3        6.6       ?       ? 
1 1 1   34   30   21 o     14.9    7.5    0.0000   0.0000          ?        ?   -31.9261  10.2163          ?        ?       14.9        7.5       ?       ? 
1 1 1   34   30   22 o    139.9    4.6    0.0000   0.0000          ?        ?   196.0261  12.7704          ?        ?      139.9        4.6       ?       ? 
1 1 1   34   30   23 o    377.8    2.6    0.0000   0.0000          ?        ?  1427.7344  19.7942          ?        ?      377.8        2.6       ?       ? 
1 1 1   34   30   24 o    236.2    3.0    0.0000   0.0000          ?        ?   558.0679  14.0475          ?        ?      236.2        3.0       ?       ? 
1 1 1   34   30   25 o     36.0   13.1    0.0000   0.0000          ?        ?    10.8549  12.1319          ?        ?       36.0       13.1       ?       ? 
1 1 1   34   30   26 o    157.5    4.1    0.0000   0.0000          ?        ?   248.3849  12.7704          ?        ?      157.5        4.1       ?       ? 
1 1 1   34   30   27 o    112.0    5.7    0.0000   0.0000          ?        ?   125.7888  12.7704          ?        ?      112.0        5.7       ?       ? 
1 1 1   34   30   28 o     20.8   10.1    0.0000   0.0000          ?        ?   -23.6253  13.4090          ?        ?       20.8       10.1       ?       ? 
1 1 1   34   30   29 o    186.9    3.9    0.0000   0.0000          ?        ?   349.9099  14.6860          ?        ?      186.9        3.9       ?       ? 
1 1 1   34   30   30 o    256.0    3.0    0.0000   0.0000          ?        ?   655.7617  15.3245          ?        ?      256.0        3.0       ?       ? 
1 1 1   34   30   31 o     56.6   12.7    0.0000   0.0000          ?        ?    33.8416  14.0475          ?        ?       56.6       12.7       ?       ? 
1 1 1   34   30   32 o    206.4    3.7    0.0000   0.0000          ?        ?   426.5325  15.3245          ?        ?      206.4        3.7       ?       ? 
1 1 1   34   30   33 o    212.6    3.6    0.0000   0.0000          ?        ?   452.7119  15.3245          ?        ?      212.6        3.6       ?       ? 
1 1 1   34   30   34 o    141.4    5.2    0.0000   0.0000          ?        ?   200.4958  14.6860          ?        ?      141.4        5.2       ?       ? 
1 1 1   34   30   35 o     28.4   12.7    0.0000   0.0000          ?        ?    -5.7467  14.6860          ?        ?       28.4       12.7       ?       ? 
1 1 1   34   30   36 o     95.5    8.0    0.0000   0.0000          ?        ?    91.9471  15.3245          ?        ?       95.5        8.0       ?       ? 
1 1 1   34   30   37 o    131.5    5.8    0.0000   0.0000          ?        ?   173.6779  15.3245          ?        ?      131.5        5.8       ?       ? 
1 1 1   34   30   38 o     90.7    8.1    0.0000   0.0000          ?        ?    83.0078  14.6860          ?        ?       90.7        8.1       ?       ? 
1 1 1   34   30   39 o    222.9    4.0    0.0000   0.0000          ?        ?   498.0469  17.8786          ?        ?      222.9        4.0       ?       ? 
1 1 1   34   30   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   30   41 o    203.3    4.2    0.0000   0.0000          ?        ?   414.4005  17.2401          ?        ?      203.3        4.2       ?       ? 
1 1 1   34   30   42 o     24.0   11.6    0.0000   0.0000          ?        ?   -24.9023  16.6016          ?        ?       24.0       11.6       ?       ? 
1 1 1   34   30   43 o    124.9    6.4    0.0000   0.0000          ?        ?   157.0763  15.9630          ?        ?      124.9        6.4       ?       ? 
1 1 1   34   30   44 o    102.3    8.1    0.0000   0.0000          ?        ?   105.9946  16.6016          ?        ?      102.3        8.1       ?       ? 
1 1 1   34   30   45 o    341.9    2.9    0.0000   0.0000          ?        ?  1171.0486  19.7942          ?        ?      341.9        2.9       ?       ? 
1 1 1   34   31    0 o    160.7   10.4  262.4324  33.2031   262.4324  33.2031   262.4324  33.2031      160.7     10.4      160.7       10.4     0.0     0.0 
1 1 1   34   31    1 o    392.1    4.4    0.0000   0.0000          ?        ?  1539.4757  34.4802          ?        ?      392.1        4.4       ?       ? 
1 1 1   34   31    2 o    611.5    6.6    0.0000   0.0000          ?        ?  3749.3992  80.4537          ?        ?      611.5        6.6       ?       ? 
1 1 1   34   31    3 o    126.9   16.1    0.0000   0.0000          ?        ?   163.4615  40.8654          ?        ?      126.9       16.1       ?       ? 
1 1 1   34   31    4 o    207.0    6.8    0.0000   0.0000          ?        ?   429.7251  28.0950          ?        ?      207.0        6.8       ?       ? 
1 1 1   34   31    5 o    174.6    7.3    0.0000   0.0000          ?        ?   305.8519  25.5409          ?        ?      174.6        7.3       ?       ? 
1 1 1   34   31    6 o    437.1    4.8    0.0000   0.0000          ?        ?  1913.0109  42.1424          ?        ?      437.1        4.8       ?       ? 
1 1 1   34   31    7 o    294.3    6.6    0.0000   0.0000          ?        ?   868.3894  38.9498          ?        ?      294.3        6.6       ?       ? 
1 1 1   34   31    8 o    242.2    5.9    0.0000   0.0000          ?        ?   588.0784  28.7335          ?        ?      242.2        5.9       ?       ? 
1 1 1   34   31    9 o    310.3    4.7    0.0000   0.0000          ?        ?   964.1677  29.3720          ?        ?      310.3        4.7       ?       ? 
1 1 1   34   31   10 o     52.8   20.4    0.0000   0.0000          ?        ?    19.1556  30.6490          ?        ?       52.8       20.4       ?       ? 
1 1 1   34   31   11 o    172.6    4.6    0.0000   0.0000          ?        ?   298.1896  15.9630          ?        ?      172.6        4.6       ?       ? 
1 1 1   34   31   12 o    281.9    3.6    0.0000   0.0000          ?        ?   795.5980  20.4327          ?        ?      281.9        3.6       ?       ? 
1 1 1   34   31   13 o    207.7    2.9    0.0000   0.0000          ?        ?   431.6406  12.1319          ?        ?      207.7        2.9       ?       ? 
1 1 1   34   31   14 o    123.4    4.9    0.0000   0.0000          ?        ?   152.6067  12.1319          ?        ?      123.4        4.9       ?       ? 
1 1 1   34   31   15 o    126.0    5.3    0.0000   0.0000          ?        ?   158.9919  13.4090          ?        ?      126.0        5.3       ?       ? 
1 1 1   34   31   16 o    276.1    3.4    0.0000   0.0000          ?        ?   763.0333  18.5171          ?        ?      276.1        3.4       ?       ? 
1 1 1   34   31   17 o    176.8    4.5    0.0000   0.0000          ?        ?   312.8756  15.9630          ?        ?      176.8        4.5       ?       ? 
1 1 1   34   31   18 o    690.7    3.5    0.0000   0.0000          ?        ?  4775.5034  48.5276          ?        ?      690.7        3.5       ?       ? 
1 1 1   34   31   19 o    102.2    6.2    0.0000   0.0000          ?        ?   104.7175  12.7704          ?        ?      102.2        6.2       ?       ? 
1 1 1   34   31   20 o    297.0    2.5    0.0000   0.0000          ?        ?   882.4369  14.6860          ?        ?      297.0        2.5       ?       ? 
1 1 1   34   31   21 o    302.1    2.6    0.0000   0.0000          ?        ?   913.0859  15.9630          ?        ?      302.1        2.6       ?       ? 
1 1 1   34   31   22 o    435.6    2.6    0.0000   0.0000          ?        ?  1898.3247  22.9868          ?        ?      435.6        2.6       ?       ? 
1 1 1   34   31   23 o    114.3    5.0    0.0000   0.0000          ?        ?   130.8969  11.4934          ?        ?      114.3        5.0       ?       ? 
1 1 1   34   31   24 o    284.2    2.8    0.0000   0.0000          ?        ?   808.3683  15.9630          ?        ?      284.2        2.8       ?       ? 
1 1 1   34   31   25 o    317.6    2.7    0.0000   0.0000          ?        ?  1009.5027  17.2401          ?        ?      317.6        2.7       ?       ? 
1 1 1   34   31   26 o    283.3    2.7    0.0000   0.0000          ?        ?   803.2603  15.3245          ?        ?      283.3        2.7       ?       ? 
1 1 1   34   31   27 o    137.6    4.6    0.0000   0.0000          ?        ?   189.6409  12.7704          ?        ?      137.6        4.6       ?       ? 
1 1 1   34   31   28 o    276.5    2.9    0.0000   0.0000          ?        ?   764.9489  15.9630          ?        ?      276.5        2.9       ?       ? 
1 1 1   34   31   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   31   30 o     45.5   14.0    0.0000   0.0000          ?        ?    21.0712  14.0475          ?        ?       45.5       14.0       ?       ? 
1 1 1   34   31   31 o     64.1   10.5    0.0000   0.0000          ?        ?    41.5039  13.4090          ?        ?       64.1       10.5       ?       ? 
1 1 1   34   31   32 o    234.6    3.4    0.0000   0.0000          ?        ?   551.0442  15.9630          ?        ?      234.6        3.4       ?       ? 
1 1 1   34   31   33 o    288.1    3.1    0.0000   0.0000          ?        ?   830.7167  17.8786          ?        ?      288.1        3.1       ?       ? 
1 1 1   34   31   34 o     65.4   11.7    0.0000   0.0000          ?        ?    44.6965  14.6860          ?        ?       65.4       11.7       ?       ? 
1 1 1   34   31   35 o    111.6    6.6    0.0000   0.0000          ?        ?   125.1502  14.6860          ?        ?      111.6        6.6       ?       ? 
1 1 1   34   31   36 o    194.4    4.3    0.0000   0.0000          ?        ?   378.6433  16.6016          ?        ?      194.4        4.3       ?       ? 
1 1 1   34   31   37 o    126.5    6.3    0.0000   0.0000          ?        ?   160.9075  15.9630          ?        ?      126.5        6.3       ?       ? 
1 1 1   34   31   38 o    200.1    4.3    0.0000   0.0000          ?        ?   401.6301  17.2401          ?        ?      200.1        4.3       ?       ? 
1 1 1   34   31   39 o    122.1    6.8    0.0000   0.0000          ?        ?   150.0526  16.6016          ?        ?      122.1        6.8       ?       ? 
1 1 1   34   31   40 o    263.7    3.4    0.0000   0.0000          ?        ?   696.6271  17.8786          ?        ?      263.7        3.4       ?       ? 
1 1 1   34   31   41 o    170.8    4.9    0.0000   0.0000          ?        ?   293.0815  16.6016          ?        ?      170.8        4.9       ?       ? 
1 1 1   34   31   42 o    233.6    3.7    0.0000   0.0000          ?        ?   547.2130  17.2401          ?        ?      233.6        3.7       ?       ? 
1 1 1   34   31   43 o     27.4   12.7    0.0000   0.0000          ?        ?   -13.4090  16.6016          ?        ?       27.4       12.7       ?       ? 
1 1 1   34   31   44 o    173.5    5.0    0.0000   0.0000          ?        ?   302.6593  17.2401          ?        ?      173.5        5.0       ?       ? 
1 1 1   34   32    0 o    277.9    8.9  776.4423  49.1662   776.4423  49.1662   776.4423  49.1662      277.9      8.9      277.9        8.9     0.0     0.0 
1 1 1   34   32    1 o    273.4    5.7    0.0000   0.0000          ?        ?   748.9859  31.2876          ?        ?      273.4        5.7       ?       ? 
1 1 1   34   32    2 o    215.6    6.2    0.0000   0.0000          ?        ?   466.1208  26.8179          ?        ?      215.6        6.2       ?       ? 
1 1 1   34   32    3 o    428.2    3.9    0.0000   0.0000          ?        ?  1835.1111  33.2031          ?        ?      428.2        3.9       ?       ? 
1 1 1   34   32    4 o    371.4    5.4    0.0000   0.0000          ?        ?  1381.7607  40.2269          ?        ?      371.4        5.4       ?       ? 
1 1 1   34   32    5 o    340.0    4.6    0.0000   0.0000          ?        ?  1157.6398  31.2876          ?        ?      340.0        4.6       ?       ? 
1 1 1   34   32    6 o    327.0    4.9    0.0000   0.0000          ?        ?  1070.8008  31.9261          ?        ?      327.0        4.9       ?       ? 
1 1 1   34   32    7 o    207.8    5.8    0.0000   0.0000          ?        ?   432.9177  24.2638          ?        ?      207.8        5.8       ?       ? 
1 1 1   34   32    8 o    219.4    7.0    0.0000   0.0000          ?        ?   482.7224  30.6490          ?        ?      219.4        7.0       ?       ? 
1 1 1   34   32    9 o    368.8    4.7    0.0000   0.0000          ?        ?  1361.9667  34.4802          ?        ?      368.8        4.7       ?       ? 
1 1 1   34   32   10 f    110.3   11.0    0.0000   0.0000          ?        ?   122.5962  24.2638          ?        ?      110.3       11.0       ?       ? 
1 1 1   34   32   11 o    187.0    7.5    0.0000   0.0000          ?        ?   351.1869  28.0950          ?        ?      187.0        7.5       ?       ? 
1 1 1   34   32   12 o    165.3    5.6    0.0000   0.0000          ?        ?   273.9258  18.5171          ?        ?      165.3        5.6       ?       ? 
1 1 1   34   32   13 o     47.5   12.6    0.0000   0.0000          ?        ?    23.6253  12.1319          ?        ?       47.5       12.6       ?       ? 
1 1 1   34   32   14 o    361.2    3.1    0.0000   0.0000          ?        ?  1305.7767  22.3483          ?        ?      361.2        3.1       ?       ? 
1 1 1   34   32   15 o    282.5    3.3    0.0000   0.0000          ?        ?   798.7905  18.5171          ?        ?      282.5        3.3       ?       ? 
1 1 1   34   32   16 o    373.6    3.2    0.0000   0.0000          ?        ?  1397.0853  24.2638          ?        ?      373.6        3.2       ?       ? 
1 1 1   34   32   17 o     26.2   12.2    0.0000   0.0000          ?        ?   -13.4090  15.3245          ?        ?       26.2       12.2       ?       ? 
1 1 1   34   32   18 o    276.9    3.7    0.0000   0.0000          ?        ?   767.5030  20.4327          ?        ?      276.9        3.7       ?       ? 
1 1 1   34   32   19 o    364.8    2.9    0.0000   0.0000          ?        ?  1331.3176  21.0712          ?        ?      364.8        2.9       ?       ? 
1 1 1   34   32   20 o    274.7    2.6    0.0000   0.0000          ?        ?   754.7325  14.0475          ?        ?      274.7        2.6       ?       ? 
1 1 1   34   32   21 o    106.2    4.8    0.0000   0.0000          ?        ?   113.0183  10.2163          ?        ?      106.2        4.8       ?       ? 
1 1 1   34   32   22 o     44.8   11.9    0.0000   0.0000          ?        ?    21.0712  10.8549          ?        ?       44.8       11.9       ?       ? 
1 1 1   34   32   23 o    296.5    2.6    0.0000   0.0000          ?        ?   879.8828  15.3245          ?        ?      296.5        2.6       ?       ? 
1 1 1   34   32   24 o    290.1    2.9    0.0000   0.0000          ?        ?   842.2100  16.6016          ?        ?      290.1        2.9       ?       ? 
1 1 1   34   32   25 o    318.0    2.6    0.0000   0.0000          ?        ?  1012.0568  16.6016          ?        ?      318.0        2.6       ?       ? 
1 1 1   34   32   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   32   27 o     83.2    8.1    0.0000   0.0000          ?        ?    69.5989  13.4090          ?        ?       83.2        8.1       ?       ? 
1 1 1   34   32   28 f    284.7    2.8    0.0000   0.0000          ?        ?   810.9225  15.9630          ?        ?      284.7        2.8       ?       ? 
1 1 1   34   32   29 o    115.6    5.8    0.0000   0.0000          ?        ?   134.0895  13.4090          ?        ?      115.6        5.8       ?       ? 
1 1 1   34   32   30 o    167.6    4.4    0.0000   0.0000          ?        ?   281.5880  14.6860          ?        ?      167.6        4.4       ?       ? 
1 1 1   34   32   31 o    107.8    6.8    0.0000   0.0000          ?        ?   116.8494  14.6860          ?        ?      107.8        6.8       ?       ? 
1 1 1   34   32   32 f     19.8    9.8    0.0000   0.0000          ?        ?   -34.4802  14.6860          ?        ?       19.8        9.8       ?       ? 
1 1 1   34   32   33 o    227.4    3.5    0.0000   0.0000          ?        ?   517.8410  15.9630          ?        ?      227.4        3.5       ?       ? 
1 1 1   34   32   34 o    213.8    3.7    0.0000   0.0000          ?        ?   457.8200  15.9630          ?        ?      213.8        3.7       ?       ? 
1 1 1   34   32   35 o    241.7    3.3    0.0000   0.0000          ?        ?   584.8858  15.9630          ?        ?      241.7        3.3       ?       ? 
1 1 1   34   32   36 o    257.3    3.2    0.0000   0.0000          ?        ?   662.7855  16.6016          ?        ?      257.3        3.2       ?       ? 
1 1 1   34   32   37 o    196.0    4.2    0.0000   0.0000          ?        ?   385.0285  16.6016          ?        ?      196.0        4.2       ?       ? 
1 1 1   34   32   38 o     22.8   11.1    0.0000   0.0000          ?        ?   -26.8179  15.9630          ?        ?       22.8       11.1       ?       ? 
1 1 1   34   32   39 o    289.4    3.1    0.0000   0.0000          ?        ?   839.0174  17.8786          ?        ?      289.4        3.1       ?       ? 
1 1 1   34   32   40 o    353.9    3.0    0.0000   0.0000          ?        ?  1254.6949  21.0712          ?        ?      353.9        3.0       ?       ? 
1 1 1   34   32   41 o     22.7   11.0    0.0000   0.0000          ?        ?   -27.4564  15.9630          ?        ?       22.7       11.0       ?       ? 
1 1 1   34   32   42 o     93.2    8.2    0.0000   0.0000          ?        ?    88.1160  15.3245          ?        ?       93.2        8.2       ?       ? 
1 1 1   34   33    0 o     26.7   19.1  -49.8047  41.5039   -49.8047  41.5039   -49.8047  41.5039       26.7     19.1       26.7       19.1     0.0     0.0 
1 1 1   34   33    1 o     38.8   16.8    0.0000   0.0000          ?        ?    -3.1926  24.2638          ?        ?       38.8       16.8       ?       ? 
1 1 1   34   33    2 o    340.7    4.6    0.0000   0.0000          ?        ?  1162.7479  31.2876          ?        ?      340.7        4.6       ?       ? 
1 1 1   34   33    3 o    239.2    5.9    0.0000   0.0000          ?        ?   573.3925  28.0950          ?        ?      239.2        5.9       ?       ? 
1 1 1   34   33    4 o    220.5    6.5    0.0000   0.0000          ?        ?   487.8305  28.7335          ?        ?      220.5        6.5       ?       ? 
1 1 1   34   33    5 o    200.6    6.2    0.0000   0.0000          ?        ?   403.5457  24.9023          ?        ?      200.6        6.2       ?       ? 
1 1 1   34   33    6 o    278.7    6.0    0.0000   0.0000          ?        ?   778.9964  33.2031          ?        ?      278.7        6.0       ?       ? 
1 1 1   34   33    7 o    209.6    8.5    0.0000   0.0000          ?        ?   441.8569  35.7572          ?        ?      209.6        8.5       ?       ? 
1 1 1   34   33    8 o    333.1    5.8    0.0000   0.0000          ?        ?  1112.3047  38.9498          ?        ?      333.1        5.8       ?       ? 
1 1 1   34   33    9 o    291.4    6.8    0.0000   0.0000          ?        ?   851.7878  39.5883          ?        ?      291.4        6.8       ?       ? 
1 1 1   34   33   10 o    269.2    8.4    0.0000   0.0000          ?        ?   728.5532  45.3350          ?        ?      269.2        8.4       ?       ? 
1 1 1   34   33   11 o    183.6    7.5    0.0000   0.0000          ?        ?   338.4165  27.4564          ?        ?      183.6        7.5       ?       ? 
1 1 1   34   33   12 o    247.9    5.9    0.0000   0.0000          ?        ?   616.1733  29.3720          ?        ?      247.9        5.9       ?       ? 
1 1 1   34   33   13 o    251.2    3.2    0.0000   0.0000          ?        ?   631.4979  15.9630          ?        ?      251.2        3.2       ?       ? 
1 1 1   34   33   14 o    194.1    3.8    0.0000   0.0000          ?        ?   377.3663  14.6860          ?        ?      194.1        3.8       ?       ? 
1 1 1   34   33   15 o    284.9    3.5    0.0000   0.0000          ?        ?   812.1995  19.7942          ?        ?      284.9        3.5       ?       ? 
1 1 1   34   33   16 o     88.4    7.9    0.0000   0.0000          ?        ?    78.5382  14.0475          ?        ?       88.4        7.9       ?       ? 
1 1 1   34   33   17 o    257.2    3.5    0.0000   0.0000          ?        ?   662.1469  17.8786          ?        ?      257.2        3.5       ?       ? 
1 1 1   34   33   18 o    242.6    4.1    0.0000   0.0000          ?        ?   589.3555  19.7942          ?        ?      242.6        4.1       ?       ? 
1 1 1   34   33   19 o    164.7    5.6    0.0000   0.0000          ?        ?   272.0102  18.5171          ?        ?      164.7        5.6       ?       ? 
1 1 1   34   33   20 o    293.7    2.3    0.0000   0.0000          ?        ?   863.2812  13.4090          ?        ?      293.7        2.3       ?       ? 
1 1 1   34   33   21 o    236.4    2.7    0.0000   0.0000          ?        ?   559.3449  12.7704          ?        ?      236.4        2.7       ?       ? 
1 1 1   34   33   22 o    192.7    3.1    0.0000   0.0000          ?        ?   371.6196  12.1319          ?        ?      192.7        3.1       ?       ? 
1 1 1   34   33   23 o     83.2    6.9    0.0000   0.0000          ?        ?    69.5989  11.4934          ?        ?       83.2        6.9       ?       ? 
1 1 1   34   33   24 o    410.4    2.4    0.0000   0.0000          ?        ?  1685.0586  19.7942          ?        ?      410.4        2.4       ?       ? 
1 1 1   34   33   25 o    231.2    2.9    0.0000   0.0000          ?        ?   535.0811  13.4090          ?        ?      231.2        2.9       ?       ? 
1 1 1   34   33   26 o    323.3    2.6    0.0000   0.0000          ?        ?  1045.8984  16.6016          ?        ?      323.3        2.6       ?       ? 
1 1 1   34   33   27 o    315.4    2.5    0.0000   0.0000          ?        ?   995.4552  15.9630          ?        ?      315.4        2.5       ?       ? 
1 1 1   34   33   28 o    143.4    4.7    0.0000   0.0000          ?        ?   206.2425  13.4090          ?        ?      143.4        4.7       ?       ? 
1 1 1   34   33   29 o    153.3    4.4    0.0000   0.0000          ?        ?   235.6145  13.4090          ?        ?      153.3        4.4       ?       ? 
1 1 1   34   33   30 o    336.5    2.8    0.0000   0.0000          ?        ?  1133.3759  18.5171          ?        ?      336.5        2.8       ?       ? 
1 1 1   34   33   31 o    221.1    3.5    0.0000   0.0000          ?        ?   489.7461  15.3245          ?        ?      221.1        3.5       ?       ? 
1 1 1   34   33   32 o    189.4    4.0    0.0000   0.0000          ?        ?   359.4877  15.3245          ?        ?      189.4        4.0       ?       ? 
1 1 1   34   33   33 o    163.7    4.7    0.0000   0.0000          ?        ?   268.8176  15.3245          ?        ?      163.7        4.7       ?       ? 
1 1 1   34   33   34 o     65.6   12.1    0.0000   0.0000          ?        ?    45.3350  15.3245          ?        ?       65.6       12.1       ?       ? 
1 1 1   34   33   35 o     91.3    8.4    0.0000   0.0000          ?        ?    84.2849  15.3245          ?        ?       91.3        8.4       ?       ? 
1 1 1   34   33   36 o    205.2    3.9    0.0000   0.0000          ?        ?   422.0628  15.9630          ?        ?      205.2        3.9       ?       ? 
1 1 1   34   33   37 o    107.6    7.1    0.0000   0.0000          ?        ?   116.8494  15.3245          ?        ?      107.6        7.1       ?       ? 
1 1 1   34   33   38 o    117.2    6.8    0.0000   0.0000          ?        ?   138.5592  15.9630          ?        ?      117.2        6.8       ?       ? 
1 1 1   34   33   39 o     17.0    8.7    0.0000   0.0000          ?        ?   -56.1899  15.3245          ?        ?       17.0        8.7       ?       ? 
1 1 1   34   33   40 o     28.9   13.1    0.0000   0.0000          ?        ?    -8.9393  16.6016          ?        ?       28.9       13.1       ?       ? 
1 1 1   34   34    0 o    581.4   10.4 3390.5498 120.6806  3390.5498 120.6806  3390.5498 120.6806      581.4     10.4      581.4       10.4     0.0     0.0 
1 1 1   34   34    1 o    250.7    7.7  631.4979  38.3113   631.4979  38.3113   631.4979  38.3113      250.7      7.7      250.7        7.7     0.0     0.0 
1 1 1   34   34    2 o    224.7   14.0  514.6484  62.5751   514.6484  62.5751   514.6484  62.5751      224.7     14.0      224.7       14.0     0.0     0.0 
1 1 1   34   34    3 o     20.3   15.1 -143.0288  45.9736  -143.0288  45.9736  -143.0288  45.9736       20.3     15.1       20.3       15.1     0.0     0.0 
1 1 1   34   34    4 o     22.0   16.2  -95.1397  42.1424   -95.1397  42.1424   -95.1397  42.1424       22.0     16.2       22.0       16.2     0.0     0.0 
1 1 1   34   34    5 o    105.4   27.8  134.0895  50.4432   134.0895  50.4432   134.0895  50.4432      105.4     27.8      105.4       27.8     0.0     0.0 
1 1 1   34   34    6 o     22.9   16.6  -61.9366  37.0343   -61.9366  37.0343   -61.9366  37.0343       22.9     16.6       22.9       16.6     0.0     0.0 
1 1 1   34   34    7 o    115.0   15.8  137.2822  35.7572   137.2822  35.7572   137.2822  35.7572      115.0     15.8      115.0       15.8     0.0     0.0 
1 1 1   34   34    8 o     21.3   15.5  -58.7440  33.2031   -58.7440  33.2031   -58.7440  33.2031       21.3     15.5       21.3       15.5     0.0     0.0 
1 1 1   34   34    9 o     28.3   20.3  -67.0448  49.8047   -67.0448  49.8047   -67.0448  49.8047       28.3     20.3       28.3       20.3     0.0     0.0 
1 1 1   34   34   10 o     23.4   16.9  -54.9129  36.3957   -54.9129  36.3957   -54.9129  36.3957       23.4     16.9       23.4       16.9     0.0     0.0 
1 1 1   34   34   11 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   34   12 o    339.0    7.6 1153.8086  51.7203  1153.8086  51.7203  1153.8086  51.7203      339.0      7.6      339.0        7.6     0.0     0.0 
1 1 1   34   34   13 o    273.6   11.8  757.2866  64.4907   757.2866  64.4907   757.2866  64.4907      273.6     11.8      273.6       11.8     0.0     0.0 
1 1 1   34   34   14 o    210.7    4.7  445.0496  19.7942   445.0496  19.7942   445.0496  19.7942      210.7      4.7      210.7        4.7     0.0     0.0 
1 1 1   34   34   15 o    148.1    6.5  220.9285  19.1556   220.9285  19.1556   220.9285  19.1556      148.1      6.5      148.1        6.5     0.0     0.0 
1 1 1   34   34   16 o    216.9    5.3  471.8675  22.9868   471.8675  22.9868   471.8675  22.9868      216.9      5.3      216.9        5.3     0.0     0.0 
1 1 1   34   34   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   34   18 o    117.5   10.2  141.7518  23.6253   141.7518  23.6253   141.7518  23.6253      117.5     10.2      117.5       10.2     0.0     0.0 
1 1 1   34   34   19 f    364.9    4.5 1333.2332  32.5646  1333.2332  32.5646  1333.2332  32.5646      364.9      4.5      364.9        4.5     0.0     0.0 
1 1 1   34   34   20 o     79.7   16.3   71.5144  22.9868    71.5144  22.9868    71.5144  22.9868       79.7     16.3       79.7       16.3     0.0     0.0 
1 1 1   34   34   21 o    191.9    4.0  369.0655  15.3245   369.0655  15.3245   369.0655  15.3245      191.9      4.0      191.9        4.0     0.0     0.0 
1 1 1   34   34   22 o    314.1    3.4  987.7929  21.0712   987.7929  21.0712   987.7929  21.0712      314.1      3.4      314.1        3.4     0.0     0.0 
1 1 1   34   34   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   34   34   24 o     61.2   14.4   43.4195  15.3245    43.4195  15.3245    43.4195  15.3245       61.2     14.4       61.2       14.4     0.0     0.0 
1 1 1   34   34   25 o    192.6    4.8  372.2581  18.5171   372.2581  18.5171   372.2581  18.5171      192.6      4.8      192.6        4.8     0.0     0.0 
1 1 1   34   34   26 o    136.9    6.3  189.0024  17.2401   189.0024  17.2401   189.0024  17.2401      136.9      6.3      136.9        6.3     0.0     0.0 
1 1 1   34   34   27 f    223.3    4.6  499.9625  20.4327   499.9625  20.4327   499.9625  20.4327      223.3      4.6      223.3        4.6     0.0     0.0 
1 1 1   34   34   28 o    240.3    4.1  578.5006  19.7942   578.5006  19.7942   578.5006  19.7942      240.3      4.1      240.3        4.1     0.0     0.0 
1 1 1   34   34   29 o     64.8   17.1   50.4432  19.1556    50.4432  19.1556    50.4432  19.1556       64.8     17.1       64.8       17.1     0.0     0.0 
1 1 1   34   34   30 o     15.0   11.1  -52.3588  21.0712   -52.3588  21.0712   -52.3588  21.0712       15.0     11.1       15.0       11.1     0.0     0.0 
1 1 1   34   34   31 o    131.1    7.6  174.3164  19.7942   174.3164  19.7942   174.3164  19.7942      131.1      7.6      131.1        7.6     0.0     0.0 
1 1 1   34   34   32 o    391.8    3.6 1536.9215  28.0950  1536.9215  28.0950  1536.9215  28.0950      391.8      3.6      391.8        3.6     0.0     0.0 
1 1 1   34   34   33 o     64.9   18.2   51.7203  20.4327    51.7203  20.4327    51.7203  20.4327       64.9     18.2       64.9       18.2     0.0     0.0 
1 1 1   34   34   34 o    260.4    4.7  680.0255  24.2638   680.0255  24.2638   680.0255  24.2638      260.4      4.7      260.4        4.7     0.0     0.0 
1 1 1   34   34   35 o     19.3   13.7  -21.7097  20.4327   -21.7097  20.4327   -21.7097  20.4327       19.3     13.7       19.3       13.7     0.0     0.0 
1 1 1   34   34   36 o    103.6    9.7  111.1028  19.7942   111.1028  19.7942   111.1028  19.7942      103.6      9.7      103.6        9.7     0.0     0.0 
1 1 1   34   34   37 o     15.4   11.4  -48.5276  21.0712   -48.5276  21.0712   -48.5276  21.0712       15.4     11.4       15.4       11.4     0.0     0.0 
1 1 1   34   34   38 f     28.4   18.3    3.1926  22.9868     3.1926  22.9868     3.1926  22.9868       28.4     18.3       28.4       18.3     0.0     0.0 
1 1 1   35    0    0 o    517.2    6.4 2676.0442  66.4062  2676.0442  66.4062  2676.0442  66.4062      517.2      6.4      517.2        6.4     0.0     0.0 
1 1 1   35    0    1 o   2029.9    9.5 41215.2930 385.0285 41215.2930 385.0285 41215.2930 385.0285     2029.9      9.5     2029.9        9.5     0.0     0.0 
1 1 1   35    0    2 o    794.6    4.5 6314.3403  71.5144  6314.3403  71.5144  6314.3403  71.5144      794.6      4.5      794.6        4.5     0.0     0.0 
1 1 1   35    0    3 o    299.0    3.0  894.5688  17.8786   894.5688  17.8786   894.5688  17.8786      299.0      3.0      299.0        3.0     0.0     0.0 
1 1 1   35    0    4 o    593.7    3.6 3525.2778  42.7809  3525.2778  42.7809  3525.2778  42.7809      593.7      3.6      593.7        3.6     0.0     0.0 
1 1 1   35    0    5 o    199.3    4.8  397.7990  19.1556   397.7990  19.1556   397.7990  19.1556      199.3      4.8      199.3        4.8     0.0     0.0 
1 1 1   35    0    6 o    119.9    6.2  144.9444  14.6860   144.9444  14.6860   144.9444  14.6860      119.9      6.2      119.9        6.2     0.0     0.0 
1 1 1   35    0    7 f    108.3    6.8  118.7650  14.6860   118.7650  14.6860   118.7650  14.6860      108.3      6.8      108.3        6.8     0.0     0.0 
1 1 1   35    0    8 o   1116.7    5.7 12472.8818 126.4273 12472.8818 126.4273 12472.8818 126.4273     1116.7      5.7     1116.7        5.7     0.0     0.0 
1 1 1   35    0    9 o   1049.3    5.3 11012.5820 111.1028 11012.5820 111.1028 11012.5820 111.1028     1049.3      5.3     1049.3        5.3     0.0     0.0 
1 1 1   35    0   10 o   1189.4    5.9 14149.6396 140.4748 14149.6396 140.4748 14149.6396 140.4748     1189.4      5.9     1189.4        5.9     0.0     0.0 
1 1 1   35    0   11 o   1440.2    7.0 20746.8438 201.1343 20746.8438 201.1343 20746.8438 201.1343     1440.2      7.0     1440.2        7.0     0.0     0.0 
1 1 1   35    0   12 o    269.5    4.0  726.6376  21.7097   726.6376  21.7097   726.6376  21.7097      269.5      4.0      269.5        4.0     0.0     0.0 
1 1 1   35    0   13 o   1767.7    8.3 31254.9941 293.7199 31254.9941 293.7199 31254.9941 293.7199     1767.7      8.3     1767.7        8.3     0.0     0.0 
1 1 1   35    0   14 o    554.8    3.9 3078.9514  43.4195  3078.9514  43.4195  3078.9514  43.4195      554.8      3.9      554.8        3.9     0.0     0.0 
1 1 1   35    0   15 o    493.4    3.6 2435.3215  35.1187  2435.3215  35.1187  2435.3215  35.1187      493.4      3.6      493.4        3.6     0.0     0.0 
1 1 1   35    0   16 o   1039.1    5.4 10798.6777 113.0183 10798.6777 113.0183 10798.6777 113.0183     1039.1      5.4     1039.1        5.4     0.0     0.0 
1 1 1   35    0   17 o    552.1    3.8 3048.3022  42.1424  3048.3022  42.1424  3048.3022  42.1424      552.1      3.8      552.1        3.8     0.0     0.0 
1 1 1   35    0   18 o   1386.1    7.0 19218.2246 192.8335 19218.2246 192.8335 19218.2246 192.8335     1386.1      7.0     1386.1        7.0     0.0     0.0 
1 1 1   35    0   19 o    332.4    3.4 1105.2810  22.3483  1105.2810  22.3483  1105.2810  22.3483      332.4      3.4      332.4        3.4     0.0     0.0 
1 1 1   35    0   20 o    585.5    3.6 3428.8611  42.1424  3428.8611  42.1424  3428.8611  42.1424      585.5      3.6      585.5        3.6     0.0     0.0 
1 1 1   35    0   21 o    788.6    4.4 6219.2007  68.9603  6219.2007  68.9603  6219.2007  68.9603      788.6      4.4      788.6        4.4     0.0     0.0 
1 1 1   35    0   22 o    972.3    5.5 9456.5049 107.2716  9456.5049 107.2716  9456.5049 107.2716      972.3      5.5      972.3        5.5     0.0     0.0 
1 1 1   35    0   23 o    802.0    4.6 6433.7437  74.0685  6433.7437  74.0685  6433.7437  74.0685      802.0      4.6      802.0        4.6     0.0     0.0 
1 1 1   35    0   24 o    166.5    6.5  278.3954  21.7097   278.3954  21.7097   278.3954  21.7097      166.5      6.5      166.5        6.5     0.0     0.0 
1 1 1   35    0   25 o     66.0   19.5   53.6358  22.3483    53.6358  22.3483    53.6358  22.3483       66.0     19.5       66.0       19.5     0.0     0.0 
1 1 1   35    0   26 o   1994.0    9.6 39780.5352 384.3900 39780.5352 384.3900 39780.5352 384.3900     1994.0      9.6     1994.0        9.6     0.0     0.0 
1 1 1   35    0   27 o     21.6   15.0  -16.6016  21.7097   -16.6016  21.7097   -16.6016  21.7097       21.6     15.0       21.6       15.0     0.0     0.0 
1 1 1   35    0   28 o    441.3    3.8 1948.1295  33.8416  1948.1295  33.8416  1948.1295  33.8416      441.3      3.8      441.3        3.8     0.0     0.0 
1 1 1   35    0   29 o    220.5    4.9  487.1920  21.7097   487.1920  21.7097   487.1920  21.7097      220.5      4.9      220.5        4.9     0.0     0.0 
1 1 1   35    0   30 o     15.1   11.2  -55.5514  21.7097   -55.5514  21.7097   -55.5514  21.7097       15.1     11.2       15.1       11.2     0.0     0.0 
1 1 1   35    0   31 o   1256.0    6.8 15781.0615 169.8468 15781.0615 169.8468 15781.0615 169.8468     1256.0      6.8     1256.0        6.8     0.0     0.0 
1 1 1   35    0   32 o   1422.0    7.9 20232.8340 223.4826 20232.8340 223.4826 20232.8340 223.4826     1422.0      7.9     1422.0        7.9     0.0     0.0 
1 1 1   35    0   33 o    154.6    8.7  241.3612  26.8179   241.3612  26.8179   241.3612  26.8179      154.6      8.7      154.6        8.7     0.0     0.0 
1 1 1   35    0   34 o    799.4    5.0 6392.2397  79.1767  6392.2397  79.1767  6392.2397  79.1767      799.4      5.0      799.4        5.0     0.0     0.0 
1 1 1   35    0   35 o    624.1    4.5 3896.8975  56.1899  3896.8975  56.1899  3896.8975  56.1899      624.1      4.5      624.1        4.5     0.0     0.0 
1 1 1   35    0   36 o    331.9    4.9 1102.7268  32.5646  1102.7268  32.5646  1102.7268  32.5646      331.9      4.9      331.9        4.9     0.0     0.0 
1 1 1   35    0   37 o    669.6    4.2 4485.6143  56.1899  4485.6143  56.1899  4485.6143  56.1899      669.6      4.2      669.6        4.2     0.0     0.0 
1 1 1   35    0   38 o    690.5    4.2 4769.7563  58.1055  4769.7563  58.1055  4769.7563  58.1055      690.5      4.2      690.5        4.2     0.0     0.0 
1 1 1   35    0   39 o    495.1    4.0 2452.5615  39.5883  2452.5615  39.5883  2452.5615  39.5883      495.1      4.0      495.1        4.0     0.0     0.0 
1 1 1   35    0   40 o    571.0    4.1 3262.2070  47.2506  3262.2070  47.2506  3262.2070  47.2506      571.0      4.1      571.0        4.1     0.0     0.0 
1 1 1   35    0   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    0   42 o    349.3    4.4 1220.8533  30.6490  1220.8533  30.6490  1220.8533  30.6490      349.3      4.4      349.3        4.4     0.0     0.0 
1 1 1   35    0   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    0   44 o     17.7   12.9  -47.2506  24.2638   -47.2506  24.2638   -47.2506  24.2638       17.7     12.9       17.7       12.9     0.0     0.0 
1 1 1   35    0   45 o    461.1    4.2 2127.5542  38.3113  2127.5542  38.3113  2127.5542  38.3113      461.1      4.2      461.1        4.2     0.0     0.0 
1 1 1   35    0   46 o    143.7    8.5  208.7966  24.2638   208.7966  24.2638   208.7966  24.2638      143.7      8.5      143.7        8.5     0.0     0.0 
1 1 1   35    0   47 o    349.1    4.4 1219.5763  30.6490  1219.5763  30.6490  1219.5763  30.6490      349.1      4.4      349.1        4.4     0.0     0.0 
1 1 1   35    0   48 o    219.0    5.8  480.8068  25.5409   480.8068  25.5409   480.8068  25.5409      219.0      5.8      219.0        5.8     0.0     0.0 
1 1 1   35    0   49 o    376.9    3.9 1421.3491  29.3720  1421.3491  29.3720  1421.3491  29.3720      376.9      3.9      376.9        3.9     0.0     0.0 
1 1 1   35    0   50 o     72.2   17.3   60.6596  21.7097    60.6596  21.7097    60.6596  21.7097       72.2     17.3       72.2       17.3     0.0     0.0 
1 1 1   35    0   51 f     16.3   12.1  -65.7677  25.5409   -65.7677  25.5409   -65.7677  25.5409       16.3     12.1       16.3       12.1     0.0     0.0 
1 1 1   35    0   52 o     58.4   22.2   46.6121  24.2638    46.6121  24.2638    46.6121  24.2638       58.4     22.2       58.4       22.2     0.0     0.0 
1 1 1   35    0   53 o    111.4   11.4  128.3428  24.9023   128.3428  24.9023   128.3428  24.9023      111.4     11.4      111.4       11.4     0.0     0.0 
1 1 1   35    0   54 o     28.1   18.3   -0.6385  24.2638    -0.6385  24.2638    -0.6385  24.2638       28.1     18.3       28.1       18.3     0.0     0.0 
1 1 1   35    0   55 o    362.7    4.2 1316.6316  30.6490  1316.6316  30.6490  1316.6316  30.6490      362.7      4.2      362.7        4.2     0.0     0.0 
1 1 1   35    0   56 o     88.2   17.0   86.2004  26.8179    86.2004  26.8179    86.2004  26.8179       88.2     17.0       88.2       17.0     0.0     0.0 
1 1 1   35    0   57 o     29.3   19.2   -1.2770  26.8179    -1.2770  26.8179    -1.2770  26.8179       29.3     19.2       29.3       19.2     0.0     0.0 
1 1 1   35    0   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    0   59 o    788.0    4.4 6214.7310  68.9603  6214.7310  68.9603  6214.7310  68.9603      788.0      4.4      788.0        4.4     0.0     0.0 
1 1 1   35    0   60 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    0   61 o    437.0    4.5 1912.3723  38.9498  1912.3723  38.9498  1912.3723  38.9498      437.0      4.5      437.0        4.5     0.0     0.0 
1 1 1   35    0   62 o    149.2    9.3  226.0367  27.4564   226.0367  27.4564   226.0367  27.4564      149.2      9.3      149.2        9.3     0.0     0.0 
1 1 1   35    0   63 o    266.5    6.1  712.5901  32.5646   712.5901  32.5646   712.5901  32.5646      266.5      6.1      266.5        6.1     0.0     0.0 
1 1 1   35    0   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    0   65 o    429.4    4.2 1846.6046  35.7572  1846.6046  35.7572  1846.6046  35.7572      429.4      4.2      429.4        4.2     0.0     0.0 
1 1 1   35    0   66 f     45.4   24.4   31.2876  30.0105    31.2876  30.0105    31.2876  30.0105       45.4     24.4       45.4       24.4     0.0     0.0 
1 1 1   35    0   67 f     76.8   22.1   73.4300  29.3720    73.4300  29.3720    73.4300  29.3720       76.8     22.1       76.8       22.1     0.0     0.0 
1 1 1   35    0   68 f     99.5   14.2  104.0790  27.4564   104.0790  27.4564   104.0790  27.4564       99.5     14.2       99.5       14.2     0.0     0.0 
1 1 1   35    0   69 o    172.9    8.0  302.6593  27.4564   302.6593  27.4564   302.6593  27.4564      172.9      8.0      172.9        8.0     0.0     0.0 
1 1 1   35    0   70 o    204.4    7.0  421.4243  28.7335   421.4243  28.7335   421.4243  28.7335      204.4      7.0      204.4        7.0     0.0     0.0 
1 1 1   35    1    0 o    731.9    4.1 5357.1963  59.3825  5357.1963  59.3825  5357.1963  59.3825      731.9      4.1      731.9        4.1     0.0     0.0 
1 1 1   35    1    1 o    950.8    3.5    0.0000   0.0000          ?        ?  9040.1895  66.4062          ?        ?      950.8        3.5       ?       ? 
1 1 1   35    1    2 o    664.4    2.8    0.0000   0.0000          ?        ?  4414.7388  37.0343          ?        ?      664.4        2.8       ?       ? 
1 1 1   35    1    3 o    442.8    2.3    0.0000   0.0000          ?        ?  1960.8999  20.4327          ?        ?      442.8        2.3       ?       ? 
1 1 1   35    1    4 o    143.8    3.6    0.0000   0.0000          ?        ?   206.8810  10.2163          ?        ?      143.8        3.6       ?       ? 
1 1 1   35    1    5 o   1420.1    5.0    0.0000   0.0000          ?        ? 20168.9824 142.3903          ?        ?     1420.1        5.0       ?       ? 
1 1 1   35    1    6 o   1048.9    3.8    0.0000   0.0000          ?        ? 11002.3662  79.8152          ?        ?     1048.9        3.8       ?       ? 
1 1 1   35    1    7 o    241.8    2.8    0.0000   0.0000          ?        ?   584.8858  13.4090          ?        ?      241.8        2.8       ?       ? 
1 1 1   35    1    8 o    957.8    3.6    0.0000   0.0000          ?        ?  9173.6396  68.3218          ?        ?      957.8        3.6       ?       ? 
1 1 1   35    1    9 o    943.5    3.5    0.0000   0.0000          ?        ?  8902.2686  65.7677          ?        ?      943.5        3.5       ?       ? 
1 1 1   35    1   10 o    986.3    3.6    0.0000   0.0000          ?        ?  9727.8770  70.8759          ?        ?      986.3        3.6       ?       ? 
1 1 1   35    1   11 o    242.5    3.2    0.0000   0.0000          ?        ?   588.0784  15.3245          ?        ?      242.5        3.2       ?       ? 
1 1 1   35    1   12 o   1801.2    6.0    0.0000   0.0000          ?        ? 32450.9473 215.8203          ?        ?     1801.2        6.0       ?       ? 
1 1 1   35    1   13 o   1255.8    4.4    0.0000   0.0000          ?        ? 15772.1230 109.8257          ?        ?     1255.8        4.4       ?       ? 
1 1 1   35    1   14 o    293.6    2.9    0.0000   0.0000          ?        ?   862.0042  17.2401          ?        ?      293.6        2.9       ?       ? 
1 1 1   35    1   15 o   1182.5    4.2    0.0000   0.0000          ?        ? 13985.5391  98.3323          ?        ?     1182.5        4.2       ?       ? 
1 1 1   35    1   16 o    517.7    2.5    0.0000   0.0000          ?        ?  2680.5137  25.5409          ?        ?      517.7        2.5       ?       ? 
1 1 1   35    1   17 f   1436.8    5.0    0.0000   0.0000          ?        ? 20648.5117 143.0288          ?        ?     1436.8        5.0       ?       ? 
1 1 1   35    1   18 o    683.4    2.8    0.0000   0.0000          ?        ?  4670.7856  38.3113          ?        ?      683.4        2.8       ?       ? 
1 1 1   35    1   19 o    553.0    2.6    0.0000   0.0000          ?        ?  3058.5186  28.7335          ?        ?      553.0        2.6       ?       ? 
1 1 1   35    1   20 o    449.0    2.5    0.0000   0.0000          ?        ?  2016.4512  22.3483          ?        ?      449.0        2.5       ?       ? 
1 1 1   35    1   21 o    271.8    2.8    0.0000   0.0000          ?        ?   738.7695  15.3245          ?        ?      271.8        2.8       ?       ? 
1 1 1   35    1   22 o    903.7    3.6    0.0000   0.0000          ?        ?  8167.3301  64.4907          ?        ?      903.7        3.6       ?       ? 
1 1 1   35    1   23 o    850.7    3.5    0.0000   0.0000          ?        ?  7238.2808  59.3825          ?        ?      850.7        3.5       ?       ? 
1 1 1   35    1   24 o    666.5    3.1    0.0000   0.0000          ?        ?  4442.8335  40.8654          ?        ?      666.5        3.1       ?       ? 
1 1 1   35    1   25 o    304.8    2.7    0.0000   0.0000          ?        ?   929.0490  16.6016          ?        ?      304.8        2.7       ?       ? 
1 1 1   35    1   26 o    283.2    2.8    0.0000   0.0000          ?        ?   801.9832  15.9630          ?        ?      283.2        2.8       ?       ? 
1 1 1   35    1   27 o    394.3    2.5    0.0000   0.0000          ?        ?  1554.8002  19.7942          ?        ?      394.3        2.5       ?       ? 
1 1 1   35    1   28 o    773.5    3.8    0.0000   0.0000          ?        ?  5984.2246  58.1055          ?        ?      773.5        3.8       ?       ? 
1 1 1   35    1   29 o    450.4    2.6    0.0000   0.0000          ?        ?  2028.5833  23.6253          ?        ?      450.4        2.6       ?       ? 
1 1 1   35    1   30 o    832.5    3.3    0.0000   0.0000          ?        ?  6931.1523  54.9129          ?        ?      832.5        3.3       ?       ? 
1 1 1   35    1   31 o    448.5    2.7    0.0000   0.0000          ?        ?  2011.3431  24.2638          ?        ?      448.5        2.7       ?       ? 
1 1 1   35    1   32 o    639.1    2.8    0.0000   0.0000          ?        ?  4084.6228  36.3957          ?        ?      639.1        2.8       ?       ? 
1 1 1   35    1   33 o    913.6    3.5    0.0000   0.0000          ?        ?  8348.6699  64.4907          ?        ?      913.6        3.5       ?       ? 
1 1 1   35    1   34 o    679.7    2.9    0.0000   0.0000          ?        ?  4620.9810  39.5883          ?        ?      679.7        2.9       ?       ? 
1 1 1   35    1   35 o    399.1    2.6    0.0000   0.0000          ?        ?  1593.1115  20.4327          ?        ?      399.1        2.6       ?       ? 
1 1 1   35    1   36 o    430.1    2.6    0.0000   0.0000          ?        ?  1850.4355  22.3483          ?        ?      430.1        2.6       ?       ? 
1 1 1   35    1   37 f     26.5   12.3    0.0000   0.0000          ?        ?   -12.7704  15.3245          ?        ?       26.5       12.3       ?       ? 
1 1 1   35    1   38 o    306.0    2.8    0.0000   0.0000          ?        ?   936.7112  17.2401          ?        ?      306.0        2.8       ?       ? 
1 1 1   35    1   39 o    568.5    2.7    0.0000   0.0000          ?        ?  3232.8350  30.6490          ?        ?      568.5        2.7       ?       ? 
1 1 1   35    1   40 o    296.5    3.0    0.0000   0.0000          ?        ?   879.2443  17.8786          ?        ?      296.5        3.0       ?       ? 
1 1 1   35    1   41 o    189.9    4.4    0.0000   0.0000          ?        ?   360.7647  16.6016          ?        ?      189.9        4.4       ?       ? 
1 1 1   35    1   42 o    134.6    5.7    0.0000   0.0000          ?        ?   181.3401  15.3245          ?        ?      134.6        5.7       ?       ? 
1 1 1   35    1   43 f    475.4    2.6    0.0000   0.0000          ?        ?  2261.0051  24.9023          ?        ?      475.4        2.6       ?       ? 
1 1 1   35    1   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    1   45 o    140.8    5.7    0.0000   0.0000          ?        ?   198.5802  15.9630          ?        ?      140.8        5.7       ?       ? 
1 1 1   35    1   46 o    164.3    5.1    0.0000   0.0000          ?        ?   270.0946  16.6016          ?        ?      164.3        5.1       ?       ? 
1 1 1   35    1   47 o    314.2    3.0    0.0000   0.0000          ?        ?   987.7929  19.1556          ?        ?      314.2        3.0       ?       ? 
1 1 1   35    1   48 o    226.6    3.9    0.0000   0.0000          ?        ?   514.0099  17.8786          ?        ?      226.6        3.9       ?       ? 
1 1 1   35    1   49 f    341.7    2.9    0.0000   0.0000          ?        ?  1167.8560  19.7942          ?        ?      341.7        2.9       ?       ? 
1 1 1   35    1   50 o    158.5    6.0    0.0000   0.0000          ?        ?   251.5775  19.1556          ?        ?      158.5        6.0       ?       ? 
1 1 1   35    1   51 o    152.1    5.7    0.0000   0.0000          ?        ?   231.7833  17.2401          ?        ?      152.1        5.7       ?       ? 
1 1 1   35    1   52 o    283.1    3.3    0.0000   0.0000          ?        ?   801.9832  18.5171          ?        ?      283.1        3.3       ?       ? 
1 1 1   35    1   53 o    215.3    4.3    0.0000   0.0000          ?        ?   464.2052  18.5171          ?        ?      215.3        4.3       ?       ? 
1 1 1   35    1   54 o    251.2    3.8    0.0000   0.0000          ?        ?   631.4979  19.1556          ?        ?      251.2        3.8       ?       ? 
1 1 1   35    1   55 o    177.6    5.2    0.0000   0.0000          ?        ?   316.0682  18.5171          ?        ?      177.6        5.2       ?       ? 
1 1 1   35    1   56 o    194.9    4.9    0.0000   0.0000          ?        ?   380.5589  19.1556          ?        ?      194.9        4.9       ?       ? 
1 1 1   35    1   57 o    231.4    4.3    0.0000   0.0000          ?        ?   536.3582  19.7942          ?        ?      231.4        4.3       ?       ? 
1 1 1   35    1   58 o    282.5    3.8    0.0000   0.0000          ?        ?   798.7905  21.7097          ?        ?      282.5        3.8       ?       ? 
1 1 1   35    1   59 o    239.3    4.3    0.0000   0.0000          ?        ?   573.3925  20.4327          ?        ?      239.3        4.3       ?       ? 
1 1 1   35    1   60 o    331.6    3.3    0.0000   0.0000          ?        ?  1100.8113  21.7097          ?        ?      331.6        3.3       ?       ? 
1 1 1   35    1   61 o    259.2    4.1    0.0000   0.0000          ?        ?   673.0018  21.0712          ?        ?      259.2        4.1       ?       ? 
1 1 1   35    1   62 o    206.9    4.8    0.0000   0.0000          ?        ?   429.0865  19.7942          ?        ?      206.9        4.8       ?       ? 
1 1 1   35    1   63 o    241.6    4.2    0.0000   0.0000          ?        ?   584.8858  20.4327          ?        ?      241.6        4.2       ?       ? 
1 1 1   35    1   64 o    219.0    4.7    0.0000   0.0000          ?        ?   480.8068  20.4327          ?        ?      219.0        4.7       ?       ? 
1 1 1   35    1   65 o    333.2    3.4    0.0000   0.0000          ?        ?  1111.6661  22.9868          ?        ?      333.2        3.4       ?       ? 
1 1 1   35    1   66 o    211.5    4.8    0.0000   0.0000          ?        ?   448.8807  20.4327          ?        ?      211.5        4.8       ?       ? 
1 1 1   35    1   67 o    225.1    4.7    0.0000   0.0000          ?        ?   508.2632  21.0712          ?        ?      225.1        4.7       ?       ? 
1 1 1   35    1   68 o    254.6    4.3    0.0000   0.0000          ?        ?   650.0150  21.7097          ?        ?      254.6        4.3       ?       ? 
1 1 1   35    1   69 o    152.2    6.7    0.0000   0.0000          ?        ?   233.6989  20.4327          ?        ?      152.2        6.7       ?       ? 
1 1 1   35    1   70 o    238.1    4.4    0.0000   0.0000          ?        ?   569.5613  21.0712          ?        ?      238.1        4.4       ?       ? 
1 1 1   35    2    0 o    267.5    3.6  715.7827  19.1556   715.7827  19.1556   715.7827  19.1556      267.5      3.6      267.5        3.6     0.0     0.0 
1 1 1   35    2    1 o    561.6    2.6    0.0000   0.0000          ?        ?  3154.2969  28.7335          ?        ?      561.6        2.6       ?       ? 
1 1 1   35    2    2 f    880.1    3.3    0.0000   0.0000          ?        ?  7746.5439  58.7440          ?        ?      880.1        3.3       ?       ? 
1 1 1   35    2    3 o    452.2    2.3    0.0000   0.0000          ?        ?  2044.5464  21.0712          ?        ?      452.2        2.3       ?       ? 
1 1 1   35    2    4 o    746.0    3.0    0.0000   0.0000          ?        ?  5565.9932  44.0580          ?        ?      746.0        3.0       ?       ? 
1 1 1   35    2    5 o    273.4    2.5    0.0000   0.0000          ?        ?   747.7088  13.4090          ?        ?      273.4        2.5       ?       ? 
1 1 1   35    2    6 o   1030.3    3.9    0.0000   0.0000          ?        ? 10616.6992  79.8152          ?        ?     1030.3        3.9       ?       ? 
1 1 1   35    2    7 o   1390.1    4.8    0.0000   0.0000          ?        ? 19326.7734 132.8125          ?        ?     1390.1        4.8       ?       ? 
1 1 1   35    2    8 o    422.1    2.3    0.0000   0.0000          ?        ?  1781.4753  19.7942          ?        ?      422.1        2.3       ?       ? 
1 1 1   35    2    9 f    904.1    3.4    0.0000   0.0000          ?        ?  8174.3535  61.2981          ?        ?      904.1        3.4       ?       ? 
1 1 1   35    2   10 o    670.3    2.8    0.0000   0.0000          ?        ?  4493.2769  37.0343          ?        ?      670.3        2.8       ?       ? 
1 1 1   35    2   11 o    354.2    2.4    0.0000   0.0000          ?        ?  1254.6949  17.2401          ?        ?      354.2        2.4       ?       ? 
1 1 1   35    2   12 o    373.4    2.4    0.0000   0.0000          ?        ?  1394.5312  17.8786          ?        ?      373.4        2.4       ?       ? 
1 1 1   35    2   13 o    876.7    3.4    0.0000   0.0000          ?        ?  7685.8843  59.3825          ?        ?      876.7        3.4       ?       ? 
1 1 1   35    2   14 o   1833.6    6.1    0.0000   0.0000          ?        ? 33627.7422 222.2055          ?        ?     1833.6        6.1       ?       ? 
1 1 1   35    2   15 f    404.0    2.6    0.0000   0.0000          ?        ?  1632.0613  21.0712          ?        ?      404.0        2.6       ?       ? 
1 1 1   35    2   16 o   1059.0    3.7    0.0000   0.0000          ?        ? 11214.9941  79.1767          ?        ?     1059.0        3.7       ?       ? 
1 1 1   35    2   17 f    676.8    2.9    0.0000   0.0000          ?        ?  4581.3926  38.9498          ?        ?      676.8        2.9       ?       ? 
1 1 1   35    2   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    2   19 o    367.9    2.5    0.0000   0.0000          ?        ?  1353.6659  18.5171          ?        ?      367.9        2.5       ?       ? 
1 1 1   35    2   20 o    352.5    2.4    0.0000   0.0000          ?        ?  1242.5631  17.2401          ?        ?      352.5        2.4       ?       ? 
1 1 1   35    2   21 o    799.6    3.2    0.0000   0.0000          ?        ?  6394.7939  50.4432          ?        ?      799.6        3.2       ?       ? 
1 1 1   35    2   22 o    440.6    2.5    0.0000   0.0000          ?        ?  1941.1057  21.7097          ?        ?      440.6        2.5       ?       ? 
1 1 1   35    2   23 o    916.9    3.8    0.0000   0.0000          ?        ?  8408.0527  69.5989          ?        ?      916.9        3.8       ?       ? 
1 1 1   35    2   24 o    344.2    2.5    0.0000   0.0000          ?        ?  1185.0962  17.2401          ?        ?      344.2        2.5       ?       ? 
1 1 1   35    2   25 f    438.0    2.6    0.0000   0.0000          ?        ?  1918.7574  22.9868          ?        ?      438.0        2.6       ?       ? 
1 1 1   35    2   26 o    307.6    2.7    0.0000   0.0000          ?        ?   946.2890  16.6016          ?        ?      307.6        2.7       ?       ? 
1 1 1   35    2   27 o    532.8    2.8    0.0000   0.0000          ?        ?  2839.5059  30.0105          ?        ?      532.8        2.8       ?       ? 
1 1 1   35    2   28 o    177.2    4.1    0.0000   0.0000          ?        ?   314.1526  14.6860          ?        ?      177.2        4.1       ?       ? 
1 1 1   35    2   29 o    799.5    3.2    0.0000   0.0000          ?        ?  6393.5171  50.4432          ?        ?      799.5        3.2       ?       ? 
1 1 1   35    2   30 o    772.5    3.1    0.0000   0.0000          ?        ?  5968.2617  48.5276          ?        ?      772.5        3.1       ?       ? 
1 1 1   35    2   31 o    568.9    2.8    0.0000   0.0000          ?        ?  3237.3047  31.9261          ?        ?      568.9        2.8       ?       ? 
1 1 1   35    2   32 o    418.1    2.8    0.0000   0.0000          ?        ?  1748.2721  23.6253          ?        ?      418.1        2.8       ?       ? 
1 1 1   35    2   33 o    533.9    2.7    0.0000   0.0000          ?        ?  2850.9990  28.7335          ?        ?      533.9        2.7       ?       ? 
1 1 1   35    2   34 o    654.9    2.9    0.0000   0.0000          ?        ?  4290.2271  37.6728          ?        ?      654.9        2.9       ?       ? 
1 1 1   35    2   35 o    353.7    2.8    0.0000   0.0000          ?        ?  1251.5024  19.7942          ?        ?      353.7        2.8       ?       ? 
1 1 1   35    2   36 o    437.0    2.7    0.0000   0.0000          ?        ?  1909.8182  23.6253          ?        ?      437.0        2.7       ?       ? 
1 1 1   35    2   37 o    456.0    2.6    0.0000   0.0000          ?        ?  2079.6650  23.6253          ?        ?      456.0        2.6       ?       ? 
1 1 1   35    2   38 o    325.9    3.0    0.0000   0.0000          ?        ?  1062.5000  19.7942          ?        ?      325.9        3.0       ?       ? 
1 1 1   35    2   39 o    179.3    4.8    0.0000   0.0000          ?        ?   321.8149  17.2401          ?        ?      179.3        4.8       ?       ? 
1 1 1   35    2   40 o    889.6    3.4    0.0000   0.0000          ?        ?  7916.3916  60.6596          ?        ?      889.6        3.4       ?       ? 
1 1 1   35    2   41 o    338.1    2.8    0.0000   0.0000          ?        ?  1143.5923  19.1556          ?        ?      338.1        2.8       ?       ? 
1 1 1   35    2   42 o    331.6    2.8    0.0000   0.0000          ?        ?  1100.1727  18.5171          ?        ?      331.6        2.8       ?       ? 
1 1 1   35    2   43 o    614.0    2.8    0.0000   0.0000          ?        ?  3770.4702  34.4802          ?        ?      614.0        2.8       ?       ? 
1 1 1   35    2   44 o    137.6    6.3    0.0000   0.0000          ?        ?   189.6409  17.2401          ?        ?      137.6        6.3       ?       ? 
1 1 1   35    2   45 o    120.6    6.6    0.0000   0.0000          ?        ?   145.5829  15.9630          ?        ?      120.6        6.6       ?       ? 
1 1 1   35    2   46 o     97.4    8.2    0.0000   0.0000          ?        ?    95.1397  15.9630          ?        ?       97.4        8.2       ?       ? 
1 1 1   35    2   47 o    390.7    2.8    0.0000   0.0000          ?        ?  1527.3438  21.7097          ?        ?      390.7        2.8       ?       ? 
1 1 1   35    2   48 o    383.2    2.7    0.0000   0.0000          ?        ?  1469.2383  20.4327          ?        ?      383.2        2.7       ?       ? 
1 1 1   35    2   49 o    359.9    2.8    0.0000   0.0000          ?        ?  1295.5603  20.4327          ?        ?      359.9        2.8       ?       ? 
1 1 1   35    2   50 o    474.5    2.7    0.0000   0.0000          ?        ?  2252.0659  25.5409          ?        ?      474.5        2.7       ?       ? 
1 1 1   35    2   51 o    334.4    3.2    0.0000   0.0000          ?        ?  1118.6898  21.0712          ?        ?      334.4        3.2       ?       ? 
1 1 1   35    2   52 o    139.1    6.7    0.0000   0.0000          ?        ?   194.1106  18.5171          ?        ?      139.1        6.7       ?       ? 
1 1 1   35    2   53 o     26.3   12.5    0.0000   0.0000          ?        ?   -22.3483  17.8786          ?        ?       26.3       12.5       ?       ? 
1 1 1   35    2   54 o    100.8    9.2    0.0000   0.0000          ?        ?   102.1635  18.5171          ?        ?      100.8        9.2       ?       ? 
1 1 1   35    2   55 o    330.8    3.3    0.0000   0.0000          ?        ?  1095.0646  21.7097          ?        ?      330.8        3.3       ?       ? 
1 1 1   35    2   56 o    410.5    2.9    0.0000   0.0000          ?        ?  1686.3357  23.6253          ?        ?      410.5        2.9       ?       ? 
1 1 1   35    2   57 o    218.2    4.4    0.0000   0.0000          ?        ?   476.9756  19.1556          ?        ?      218.2        4.4       ?       ? 
1 1 1   35    2   58 o    120.1    7.7    0.0000   0.0000          ?        ?   144.9444  18.5171          ?        ?      120.1        7.7       ?       ? 
1 1 1   35    2   59 o    255.4    4.0    0.0000   0.0000          ?        ?   653.2076  20.4327          ?        ?      255.4        4.0       ?       ? 
1 1 1   35    2   60 o     94.1   10.2    0.0000   0.0000          ?        ?    89.3930  19.1556          ?        ?       94.1       10.2       ?       ? 
1 1 1   35    2   61 o     69.5   14.7    0.0000   0.0000          ?        ?    51.0817  19.7942          ?        ?       69.5       14.7       ?       ? 
1 1 1   35    2   62 o    134.0    7.4    0.0000   0.0000          ?        ?   180.7016  19.7942          ?        ?      134.0        7.4       ?       ? 
1 1 1   35    2   63 o    101.5    9.8    0.0000   0.0000          ?        ?   104.0790  19.7942          ?        ?      101.5        9.8       ?       ? 
1 1 1   35    2   64 o    251.0    4.3    0.0000   0.0000          ?        ?   631.4979  21.7097          ?        ?      251.0        4.3       ?       ? 
1 1 1   35    2   65 o    228.2    4.6    0.0000   0.0000          ?        ?   522.3107  21.0712          ?        ?      228.2        4.6       ?       ? 
1 1 1   35    2   66 o     37.3   15.8    0.0000   0.0000          ?        ?     1.9156  20.4327          ?        ?       37.3       15.8       ?       ? 
1 1 1   35    2   67 o    203.1    5.0    0.0000   0.0000          ?        ?   414.4005  20.4327          ?        ?      203.1        5.0       ?       ? 
1 1 1   35    2   68 o     29.5   13.8    0.0000   0.0000          ?        ?   -19.1556  20.4327          ?        ?       29.5       13.8       ?       ? 
1 1 1   35    2   69 f     29.8   13.7    0.0000   0.0000          ?        ?   -14.0475  19.1556          ?        ?       29.8       13.7       ?       ? 
1 1 1   35    3    0 o    509.1    3.4 2592.3977  35.1187  2592.3977  35.1187  2592.3977  35.1187      509.1      3.4      509.1        3.4     0.0     0.0 
1 1 1   35    3    1 o    427.2    2.4    0.0000   0.0000          ?        ?  1824.8948  20.4327          ?        ?      427.2        2.4       ?       ? 
1 1 1   35    3    2 o    237.3    2.6    0.0000   0.0000          ?        ?   563.1760  12.1319          ?        ?      237.3        2.6       ?       ? 
1 1 1   35    3    3 o    755.8    3.0    0.0000   0.0000          ?        ?  5712.8530  45.9736          ?        ?      755.8        3.0       ?       ? 
1 1 1   35    3    4 f    212.3    3.2    0.0000   0.0000          ?        ?   450.7963  13.4090          ?        ?      212.3        3.2       ?       ? 
1 1 1   35    3    5 o    827.8    3.2    0.0000   0.0000          ?        ?  6853.2529  52.9973          ?        ?      827.8        3.2       ?       ? 
1 1 1   35    3    6 o    410.8    2.7    0.0000   0.0000          ?        ?  1687.6125  22.3483          ?        ?      410.8        2.7       ?       ? 
1 1 1   35    3    7 o    462.5    2.6    0.0000   0.0000          ?        ?  2139.0474  23.6253          ?        ?      462.5        2.6       ?       ? 
1 1 1   35    3    8 f    229.0    3.3    0.0000   0.0000          ?        ?   524.2263  15.3245          ?        ?      229.0        3.3       ?       ? 
1 1 1   35    3    9 o    639.8    2.7    0.0000   0.0000          ?        ?  4094.2007  34.4802          ?        ?      639.8        2.7       ?       ? 
1 1 1   35    3   10 o    586.8    2.6    0.0000   0.0000          ?        ?  3442.9087  30.0105          ?        ?      586.8        2.6       ?       ? 
1 1 1   35    3   11 o    281.2    2.5    0.0000   0.0000          ?        ?   790.4898  14.0475          ?        ?      281.2        2.5       ?       ? 
1 1 1   35    3   12 o    320.0    2.5    0.0000   0.0000          ?        ?  1024.1886  15.9630          ?        ?      320.0        2.5       ?       ? 
1 1 1   35    3   13 o    405.8    2.4    0.0000   0.0000          ?        ?  1646.7472  19.1556          ?        ?      405.8        2.4       ?       ? 
1 1 1   35    3   14 o   1159.1    4.2    0.0000   0.0000          ?        ? 13436.4111  97.6938          ?        ?     1159.1        4.2       ?       ? 
1 1 1   35    3   15 o    929.3    3.6    0.0000   0.0000          ?        ?  8636.6436  67.0448          ?        ?      929.3        3.6       ?       ? 
1 1 1   35    3   16 o    357.0    2.7    0.0000   0.0000          ?        ?  1274.4893  19.1556          ?        ?      357.0        2.7       ?       ? 
1 1 1   35    3   17 o    572.0    2.6    0.0000   0.0000          ?        ?  3272.4233  29.3720          ?        ?      572.0        2.6       ?       ? 
1 1 1   35    3   18 o    333.1    2.4    0.0000   0.0000          ?        ?  1109.7506  15.9630          ?        ?      333.1        2.4       ?       ? 
1 1 1   35    3   19 o    424.7    2.6    0.0000   0.0000          ?        ?  1803.8236  21.7097          ?        ?      424.7        2.6       ?       ? 
1 1 1   35    3   20 o    232.4    3.2    0.0000   0.0000          ?        ?   540.1893  14.6860          ?        ?      232.4        3.2       ?       ? 
1 1 1   35    3   21 o    198.0    3.9    0.0000   0.0000          ?        ?   392.0523  15.3245          ?        ?      198.0        3.9       ?       ? 
1 1 1   35    3   22 o    293.7    2.8    0.0000   0.0000          ?        ?   862.6428  16.6016          ?        ?      293.7        2.8       ?       ? 
1 1 1   35    3   23 o    314.5    2.7    0.0000   0.0000          ?        ?   989.0699  17.2401          ?        ?      314.5        2.7       ?       ? 
1 1 1   35    3   24 o    998.2    3.8    0.0000   0.0000          ?        ?  9964.7686  76.6226          ?        ?      998.2        3.8       ?       ? 
1 1 1   35    3   25 o    627.4    2.7    0.0000   0.0000          ?        ?  3937.1243  34.4802          ?        ?      627.4        2.7       ?       ? 
1 1 1   35    3   26 o    487.4    2.7    0.0000   0.0000          ?        ?  2375.9390  26.1794          ?        ?      487.4        2.7       ?       ? 
1 1 1   35    3   27 o    858.2    3.4    0.0000   0.0000          ?        ?  7365.9854  58.1055          ?        ?      858.2        3.4       ?       ? 
1 1 1   35    3   28 o    260.6    2.9    0.0000   0.0000          ?        ?   679.3870  15.3245          ?        ?      260.6        2.9       ?       ? 
1 1 1   35    3   29 o    982.4    3.7    0.0000   0.0000          ?        ?  9652.5312  73.4300          ?        ?      982.4        3.7       ?       ? 
1 1 1   35    3   30 o    187.9    4.1    0.0000   0.0000          ?        ?   353.1024  15.3245          ?        ?      187.9        4.1       ?       ? 
1 1 1   35    3   31 o    399.0    2.6    0.0000   0.0000          ?        ?  1591.8345  21.0712          ?        ?      399.0        2.6       ?       ? 
1 1 1   35    3   32 o    643.7    2.8    0.0000   0.0000          ?        ?  4144.6436  36.3957          ?        ?      643.7        2.8       ?       ? 
1 1 1   35    3   33 o    415.8    2.5    0.0000   0.0000          ?        ?  1729.1165  21.0712          ?        ?      415.8        2.5       ?       ? 
1 1 1   35    3   34 o    352.9    2.7    0.0000   0.0000          ?        ?  1245.7557  19.1556          ?        ?      352.9        2.7       ?       ? 
1 1 1   35    3   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    3   36 o    630.8    2.7    0.0000   0.0000          ?        ?  3979.2668  34.4802          ?        ?      630.8        2.7       ?       ? 
1 1 1   35    3   37 o    651.1    2.8    0.0000   0.0000          ?        ?  4240.4219  37.0343          ?        ?      651.1        2.8       ?       ? 
1 1 1   35    3   38 o    532.3    2.6    0.0000   0.0000          ?        ?  2833.7588  28.0950          ?        ?      532.3        2.6       ?       ? 
1 1 1   35    3   39 o    426.6    2.7    0.0000   0.0000          ?        ?  1820.4252  22.9868          ?        ?      426.6        2.7       ?       ? 
1 1 1   35    3   40 o    204.3    4.1    0.0000   0.0000          ?        ?   417.5931  16.6016          ?        ?      204.3        4.1       ?       ? 
1 1 1   35    3   41 o    432.0    2.6    0.0000   0.0000          ?        ?  1866.3987  22.3483          ?        ?      432.0        2.6       ?       ? 
1 1 1   35    3   42 o    170.0    4.9    0.0000   0.0000          ?        ?   289.2503  16.6016          ?        ?      170.0        4.9       ?       ? 
1 1 1   35    3   43 o    184.2    4.5    0.0000   0.0000          ?        ?   339.6935  16.6016          ?        ?      184.2        4.5       ?       ? 
1 1 1   35    3   44 o    154.5    5.4    0.0000   0.0000          ?        ?   238.8071  16.6016          ?        ?      154.5        5.4       ?       ? 
1 1 1   35    3   45 o     41.2   15.0    0.0000   0.0000          ?        ?    14.0475  15.9630          ?        ?       41.2       15.0       ?       ? 
1 1 1   35    3   46 o    308.5    3.1    0.0000   0.0000          ?        ?   952.0358  19.1556          ?        ?      308.5        3.1       ?       ? 
1 1 1   35    3   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    3   48 o    115.7    7.2    0.0000   0.0000          ?        ?   134.0895  16.6016          ?        ?      115.7        7.2       ?       ? 
1 1 1   35    3   49 o    491.9    2.7    0.0000   0.0000          ?        ?  2420.6355  26.1794          ?        ?      491.9        2.7       ?       ? 
1 1 1   35    3   50 o    192.3    4.6    0.0000   0.0000          ?        ?   370.3425  17.8786          ?        ?      192.3        4.6       ?       ? 
1 1 1   35    3   51 o    412.6    2.9    0.0000   0.0000          ?        ?  1702.9373  23.6253          ?        ?      412.6        2.9       ?       ? 
1 1 1   35    3   52 o    301.0    3.4    0.0000   0.0000          ?        ?   906.7007  20.4327          ?        ?      301.0        3.4       ?       ? 
1 1 1   35    3   53 o    319.4    3.4    0.0000   0.0000          ?        ?  1020.9960  21.7097          ?        ?      319.4        3.4       ?       ? 
1 1 1   35    3   54 o    245.1    4.0    0.0000   0.0000          ?        ?   601.4874  19.7942          ?        ?      245.1        4.0       ?       ? 
1 1 1   35    3   55 o     26.8   12.8    0.0000   0.0000          ?        ?   -25.5409  19.1556          ?        ?       26.8       12.8       ?       ? 
1 1 1   35    3   56 o    269.8    3.8    0.0000   0.0000          ?        ?   728.5532  20.4327          ?        ?      269.8        3.8       ?       ? 
1 1 1   35    3   57 o    195.9    5.1    0.0000   0.0000          ?        ?   384.3900  19.7942          ?        ?      195.9        5.1       ?       ? 
1 1 1   35    3   58 o     52.9   16.1    0.0000   0.0000          ?        ?    28.7335  18.5171          ?        ?       52.9       16.1       ?       ? 
1 1 1   35    3   59 o    392.1    2.9    0.0000   0.0000          ?        ?  1538.1986  22.9868          ?        ?      392.1        2.9       ?       ? 
1 1 1   35    3   60 o    106.2    9.0    0.0000   0.0000          ?        ?   113.6568  19.1556          ?        ?      106.2        9.0       ?       ? 
1 1 1   35    3   61 o    139.2    6.9    0.0000   0.0000          ?        ?   194.7491  19.1556          ?        ?      139.2        6.9       ?       ? 
1 1 1   35    3   62 o     25.5   12.4    0.0000   0.0000          ?        ?   -33.2031  19.7942          ?        ?       25.5       12.4       ?       ? 
1 1 1   35    3   63 o     25.9   12.5    0.0000   0.0000          ?        ?   -31.2876  19.7942          ?        ?       25.9       12.5       ?       ? 
1 1 1   35    3   64 o     29.2   13.7    0.0000   0.0000          ?        ?   -18.5171  19.7942          ?        ?       29.2       13.7       ?       ? 
1 1 1   35    3   65 o    122.5    8.1    0.0000   0.0000          ?        ?   151.3296  19.7942          ?        ?      122.5        8.1       ?       ? 
1 1 1   35    3   66 o    151.3    7.0    0.0000   0.0000          ?        ?   230.5063  21.0712          ?        ?      151.3        7.0       ?       ? 
1 1 1   35    3   67 o     31.3   14.3    0.0000   0.0000          ?        ?   -11.4934  19.7942          ?        ?       31.3       14.3       ?       ? 
1 1 1   35    3   68 o    113.0    9.0    0.0000   0.0000          ?        ?   129.6199  20.4327          ?        ?      113.0        9.0       ?       ? 
1 1 1   35    3   69 o     20.7   10.4    0.0000   0.0000          ?        ?   -60.6596  19.7942          ?        ?       20.7       10.4       ?       ? 
1 1 1   35    4    0 o    856.8    4.7 7341.7222  79.8152  7341.7222  79.8152  7341.7222  79.8152      856.8      4.7      856.8        4.7     0.0     0.0 
1 1 1   35    4    1 o    150.3    3.8    0.0000   0.0000          ?        ?   226.0367  11.4934          ?        ?      150.3        3.8       ?       ? 
1 1 1   35    4    2 o   1519.6    5.3    0.0000   0.0000          ?        ? 23094.6875 159.6304          ?        ?     1519.6        5.3       ?       ? 
1 1 1   35    4    3 f    484.2    3.0    0.0000   0.0000          ?        ?  2344.6516  28.7335          ?        ?      484.2        3.0       ?       ? 
1 1 1   35    4    4 o   1785.3    6.2    0.0000   0.0000          ?        ? 31878.8320 219.6514          ?        ?     1785.3        6.2       ?       ? 
1 1 1   35    4    5 o    624.7    3.2    0.0000   0.0000          ?        ?  3902.6443  40.2269          ?        ?      624.7        3.2       ?       ? 
1 1 1   35    4    6 o   1706.7    5.7    0.0000   0.0000          ?        ? 29133.1875 196.0261          ?        ?     1706.7        5.7       ?       ? 
1 1 1   35    4    7 o    737.8    3.1    0.0000   0.0000          ?        ?  5443.3970  45.3350          ?        ?      737.8        3.1       ?       ? 
1 1 1   35    4    8 o    749.3    2.9    0.0000   0.0000          ?        ?  5614.5205  44.0580          ?        ?      749.3        2.9       ?       ? 
1 1 1   35    4    9 o    256.4    2.6    0.0000   0.0000          ?        ?   657.6772  13.4090          ?        ?      256.4        2.6       ?       ? 
1 1 1   35    4   10 f    991.4    3.7    0.0000   0.0000          ?        ?  9830.0400  74.0685          ?        ?      991.4        3.7       ?       ? 
1 1 1   35    4   11 o    376.4    2.3    0.0000   0.0000          ?        ?  1416.8794  17.2401          ?        ?      376.4        2.3       ?       ? 
1 1 1   35    4   12 o    461.0    2.4    0.0000   0.0000          ?        ?  2125.0000  22.3483          ?        ?      461.0        2.4       ?       ? 
1 1 1   35    4   13 f    269.3    2.8    0.0000   0.0000          ?        ?   725.3605  15.3245          ?        ?      269.3        2.8       ?       ? 
1 1 1   35    4   14 o    205.1    3.3    0.0000   0.0000          ?        ?   420.7858  13.4090          ?        ?      205.1        3.3       ?       ? 
1 1 1   35    4   15 o    848.0    3.3    0.0000   0.0000          ?        ?  7191.6694  55.5514          ?        ?      848.0        3.3       ?       ? 
1 1 1   35    4   16 o   1015.0    3.8    0.0000   0.0000          ?        ? 10303.1846  76.6226          ?        ?     1015.0        3.8       ?       ? 
1 1 1   35    4   17 o    556.0    2.5    0.0000   0.0000          ?        ?  3091.7217  28.0950          ?        ?      556.0        2.5       ?       ? 
1 1 1   35    4   18 o    529.9    2.5    0.0000   0.0000          ?        ?  2807.5796  26.8179          ?        ?      529.9        2.5       ?       ? 
1 1 1   35    4   19 o    735.9    3.1    0.0000   0.0000          ?        ?  5416.5791  45.3350          ?        ?      735.9        3.1       ?       ? 
1 1 1   35    4   20 o    594.7    2.8    0.0000   0.0000          ?        ?  3537.4099  33.8416          ?        ?      594.7        2.8       ?       ? 
1 1 1   35    4   21 o   1444.0    5.1    0.0000   0.0000          ?        ? 20855.3926 148.1370          ?        ?     1444.0        5.1       ?       ? 
1 1 1   35    4   22 o    831.5    3.4    0.0000   0.0000          ?        ?  6914.5508  56.8284          ?        ?      831.5        3.4       ?       ? 
1 1 1   35    4   23 o    404.8    2.5    0.0000   0.0000          ?        ?  1638.4465  20.4327          ?        ?      404.8        2.5       ?       ? 
1 1 1   35    4   24 o    479.8    2.7    0.0000   0.0000          ?        ?  2301.8704  25.5409          ?        ?      479.8        2.7       ?       ? 
1 1 1   35    4   25 o    208.8    3.4    0.0000   0.0000          ?        ?   436.1103  14.0475          ?        ?      208.8        3.4       ?       ? 
1 1 1   35    4   26 o    797.3    3.2    0.0000   0.0000          ?        ?  6357.7598  51.0817          ?        ?      797.3        3.2       ?       ? 
1 1 1   35    4   27 o    742.7    3.1    0.0000   0.0000          ?        ?  5516.8267  45.9736          ?        ?      742.7        3.1       ?       ? 
1 1 1   35    4   28 o     91.1    7.4    0.0000   0.0000          ?        ?    83.0078  13.4090          ?        ?       91.1        7.4       ?       ? 
1 1 1   35    4   29 o    260.6    2.9    0.0000   0.0000          ?        ?   679.3870  15.3245          ?        ?      260.6        2.9       ?       ? 
1 1 1   35    4   30 o    941.3    3.6    0.0000   0.0000          ?        ?  8862.6797  68.3218          ?        ?      941.3        3.6       ?       ? 
1 1 1   35    4   31 o    538.1    2.9    0.0000   0.0000          ?        ?  2895.6956  31.2876          ?        ?      538.1        2.9       ?       ? 
1 1 1   35    4   32 o    520.2    2.6    0.0000   0.0000          ?        ?  2706.6931  26.8179          ?        ?      520.2        2.6       ?       ? 
1 1 1   35    4   33 o    657.5    3.1    0.0000   0.0000          ?        ?  4324.0684  40.8654          ?        ?      657.5        3.1       ?       ? 
1 1 1   35    4   34 o    291.1    3.0    0.0000   0.0000          ?        ?   847.3182  17.2401          ?        ?      291.1        3.0       ?       ? 
1 1 1   35    4   35 o    712.5    3.2    0.0000   0.0000          ?        ?  5077.5239  45.3350          ?        ?      712.5        3.2       ?       ? 
1 1 1   35    4   36 f    749.5    3.1    0.0000   0.0000          ?        ?  5618.9902  45.9736          ?        ?      749.5        3.1       ?       ? 
1 1 1   35    4   37 o     98.7    8.4    0.0000   0.0000          ?        ?    97.6938  16.6016          ?        ?       98.7        8.4       ?       ? 
1 1 1   35    4   38 o    437.5    2.6    0.0000   0.0000          ?        ?  1914.2877  22.3483          ?        ?      437.5        2.6       ?       ? 
1 1 1   35    4   39 o    338.0    2.7    0.0000   0.0000          ?        ?  1142.9537  18.5171          ?        ?      338.0        2.7       ?       ? 
1 1 1   35    4   40 o    168.3    5.1    0.0000   0.0000          ?        ?   283.5036  17.2401          ?        ?      168.3        5.1       ?       ? 
1 1 1   35    4   41 o    446.1    2.6    0.0000   0.0000          ?        ?  1990.2720  23.6253          ?        ?      446.1        2.6       ?       ? 
1 1 1   35    4   42 o    299.4    3.1    0.0000   0.0000          ?        ?   896.4843  18.5171          ?        ?      299.4        3.1       ?       ? 
1 1 1   35    4   43 f    281.6    3.2    0.0000   0.0000          ?        ?   793.0438  17.8786          ?        ?      281.6        3.2       ?       ? 
1 1 1   35    4   44 o    241.4    3.6    0.0000   0.0000          ?        ?   582.9703  17.2401          ?        ?      241.4        3.6       ?       ? 
1 1 1   35    4   45 o    184.6    4.3    0.0000   0.0000          ?        ?   340.9706  15.9630          ?        ?      184.6        4.3       ?       ? 
1 1 1   35    4   46 o    132.2    6.3    0.0000   0.0000          ?        ?   174.9549  16.6016          ?        ?      132.2        6.3       ?       ? 
1 1 1   35    4   47 o    149.8    5.8    0.0000   0.0000          ?        ?   224.7596  17.2401          ?        ?      149.8        5.8       ?       ? 
1 1 1   35    4   48 o    146.8    6.1    0.0000   0.0000          ?        ?   215.8203  17.8786          ?        ?      146.8        6.1       ?       ? 
1 1 1   35    4   49 o    486.1    2.6    0.0000   0.0000          ?        ?  2363.8071  25.5409          ?        ?      486.1        2.6       ?       ? 
1 1 1   35    4   50 o    346.0    3.0    0.0000   0.0000          ?        ?  1197.8666  20.4327          ?        ?      346.0        3.0       ?       ? 
1 1 1   35    4   51 o    235.5    3.8    0.0000   0.0000          ?        ?   554.8753  17.8786          ?        ?      235.5        3.8       ?       ? 
1 1 1   35    4   52 o    257.2    3.7    0.0000   0.0000          ?        ?   662.1469  19.1556          ?        ?      257.2        3.7       ?       ? 
1 1 1   35    4   53 o    155.2    6.0    0.0000   0.0000          ?        ?   241.3612  18.5171          ?        ?      155.2        6.0       ?       ? 
1 1 1   35    4   54 o    145.0    6.4    0.0000   0.0000          ?        ?   210.7121  18.5171          ?        ?      145.0        6.4       ?       ? 
1 1 1   35    4   55 o    400.0    2.9    0.0000   0.0000          ?        ?  1600.7737  22.9868          ?        ?      400.0        2.9       ?       ? 
1 1 1   35    4   56 o    119.6    7.5    0.0000   0.0000          ?        ?   143.6674  17.8786          ?        ?      119.6        7.5       ?       ? 
1 1 1   35    4   57 o     32.4   14.5    0.0000   0.0000          ?        ?    -7.6623  19.1556          ?        ?       32.4       14.5       ?       ? 
1 1 1   35    4   58 o    243.0    4.2    0.0000   0.0000          ?        ?   591.2710  20.4327          ?        ?      243.0        4.2       ?       ? 
1 1 1   35    4   59 o    259.1    4.3    0.0000   0.0000          ?        ?   672.3633  22.3483          ?        ?      259.1        4.3       ?       ? 
1 1 1   35    4   60 o    241.6    4.2    0.0000   0.0000          ?        ?   584.8858  20.4327          ?        ?      241.6        4.2       ?       ? 
1 1 1   35    4   61 o    259.6    4.1    0.0000   0.0000          ?        ?   674.9174  21.0712          ?        ?      259.6        4.1       ?       ? 
1 1 1   35    4   62 o    117.8    8.4    0.0000   0.0000          ?        ?   139.8362  19.7942          ?        ?      117.8        8.4       ?       ? 
1 1 1   35    4   63 o     89.8   10.7    0.0000   0.0000          ?        ?    81.7308  19.1556          ?        ?       89.8       10.7       ?       ? 
1 1 1   35    4   64 o     30.4   14.0    0.0000   0.0000          ?        ?   -14.6860  19.7942          ?        ?       30.4       14.0       ?       ? 
1 1 1   35    4   65 o    217.0    4.6    0.0000   0.0000          ?        ?   472.5060  19.7942          ?        ?      217.0        4.6       ?       ? 
1 1 1   35    4   66 o    122.1    7.8    0.0000   0.0000          ?        ?   150.6911  19.1556          ?        ?      122.1        7.8       ?       ? 
1 1 1   35    4   67 o     76.4   12.5    0.0000   0.0000          ?        ?    60.0210  19.1556          ?        ?       76.4       12.5       ?       ? 
1 1 1   35    4   68 o    185.7    5.3    0.0000   0.0000          ?        ?   346.7172  19.7942          ?        ?      185.7        5.3       ?       ? 
1 1 1   35    5    0 o    768.8    4.3 5910.7949  65.7677  5910.7949  65.7677  5910.7949  65.7677      768.8      4.3      768.8        4.3     0.0     0.0 
1 1 1   35    5    1 o    369.4    2.5    0.0000   0.0000          ?        ?  1364.5208  18.5171          ?        ?      369.4        2.5       ?       ? 
1 1 1   35    5    2 o    498.3    2.4    0.0000   0.0000          ?        ?  2483.2104  24.2638          ?        ?      498.3        2.4       ?       ? 
1 1 1   35    5    3 o    402.6    2.4    0.0000   0.0000          ?        ?  1620.5679  19.1556          ?        ?      402.6        2.4       ?       ? 
1 1 1   35    5    4 o    645.3    2.8    0.0000   0.0000          ?        ?  4164.4380  35.7572          ?        ?      645.3        2.8       ?       ? 
1 1 1   35    5    5 o    459.4    2.7    0.0000   0.0000          ?        ?  2110.3140  24.9023          ?        ?      459.4        2.7       ?       ? 
1 1 1   35    5    6 o    343.6    2.7    0.0000   0.0000          ?        ?  1180.6265  18.5171          ?        ?      343.6        2.7       ?       ? 
1 1 1   35    5    7 o   1418.5    5.1    0.0000   0.0000          ?        ? 20123.6484 144.3059          ?        ?     1418.5        5.1       ?       ? 
1 1 1   35    5    8 o   1640.8    5.8    0.0000   0.0000          ?        ? 26929.0098 189.0024          ?        ?     1640.8        5.8       ?       ? 
1 1 1   35    5    9 o    568.6    2.8    0.0000   0.0000          ?        ?  3232.8350  31.9261          ?        ?      568.6        2.8       ?       ? 
1 1 1   35    5   10 o   1123.4    4.3    0.0000   0.0000          ?        ? 12622.9346  95.7782          ?        ?     1123.4        4.3       ?       ? 
1 1 1   35    5   11 o   1969.5    6.6    0.0000   0.0000          ?        ? 38799.7656 261.7939          ?        ?     1969.5        6.6       ?       ? 
1 1 1   35    5   12 o    545.6    2.8    0.0000   0.0000          ?        ?  2976.7878  30.0105          ?        ?      545.6        2.8       ?       ? 
1 1 1   35    5   13 o    463.2    2.4    0.0000   0.0000          ?        ?  2146.0713  22.3483          ?        ?      463.2        2.4       ?       ? 
1 1 1   35    5   14 o    561.4    2.6    0.0000   0.0000          ?        ?  3152.3813  28.7335          ?        ?      561.4        2.6       ?       ? 
1 1 1   35    5   15 o    468.9    2.5    0.0000   0.0000          ?        ?  2199.0684  23.6253          ?        ?      468.9        2.5       ?       ? 
1 1 1   35    5   16 o    890.7    3.4    0.0000   0.0000          ?        ?  7934.9077  61.2981          ?        ?      890.7        3.4       ?       ? 
1 1 1   35    5   17 o    767.2    3.0    0.0000   0.0000          ?        ?  5887.1694  46.6121          ?        ?      767.2        3.0       ?       ? 
1 1 1   35    5   18 o    381.4    2.5    0.0000   0.0000          ?        ?  1454.5522  19.1556          ?        ?      381.4        2.5       ?       ? 
1 1 1   35    5   19 o    292.2    2.7    0.0000   0.0000          ?        ?   853.7034  15.9630          ?        ?      292.2        2.7       ?       ? 
1 1 1   35    5   20 o    694.2    2.9    0.0000   0.0000          ?        ?  4818.9229  39.5883          ?        ?      694.2        2.9       ?       ? 
1 1 1   35    5   21 o    741.2    3.2    0.0000   0.0000          ?        ?  5495.1172  47.8891          ?        ?      741.2        3.2       ?       ? 
1 1 1   35    5   22 o    777.5    3.2    0.0000   0.0000          ?        ?  6046.1616  49.1662          ?        ?      777.5        3.2       ?       ? 
1 1 1   35    5   23 o    394.9    2.5    0.0000   0.0000          ?        ?  1559.2698  19.7942          ?        ?      394.9        2.5       ?       ? 
1 1 1   35    5   24 o    347.3    2.6    0.0000   0.0000          ?        ?  1206.1674  17.8786          ?        ?      347.3        2.6       ?       ? 
1 1 1   35    5   25 o    434.7    2.6    0.0000   0.0000          ?        ?  1889.3855  22.3483          ?        ?      434.7        2.6       ?       ? 
1 1 1   35    5   26 o    405.6    2.6    0.0000   0.0000          ?        ?  1645.4703  21.0712          ?        ?      405.6        2.6       ?       ? 
1 1 1   35    5   27 o    913.0    3.6    0.0000   0.0000          ?        ?  8337.1768  65.1292          ?        ?      913.0        3.6       ?       ? 
1 1 1   35    5   28 o    130.8    5.4    0.0000   0.0000          ?        ?   171.1238  14.0475          ?        ?      130.8        5.4       ?       ? 
1 1 1   35    5   29 o    549.8    2.8    0.0000   0.0000          ?        ?  3023.3999  30.6490          ?        ?      549.8        2.8       ?       ? 
1 1 1   35    5   30 o    410.6    2.7    0.0000   0.0000          ?        ?  1686.3357  22.3483          ?        ?      410.6        2.7       ?       ? 
1 1 1   35    5   31 o    397.4    2.7    0.0000   0.0000          ?        ?  1579.7025  21.0712          ?        ?      397.4        2.7       ?       ? 
1 1 1   35    5   32 o     60.6   13.0    0.0000   0.0000          ?        ?    38.3113  15.3245          ?        ?       60.6       13.0       ?       ? 
1 1 1   35    5   33 o    260.9    3.1    0.0000   0.0000          ?        ?   680.6641  15.9630          ?        ?      260.9        3.1       ?       ? 
1 1 1   35    5   34 o    280.1    3.1    0.0000   0.0000          ?        ?   784.7431  17.2401          ?        ?      280.1        3.1       ?       ? 
1 1 1   35    5   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    5   36 o    569.9    2.7    0.0000   0.0000          ?        ?  3248.7979  30.6490          ?        ?      569.9        2.7       ?       ? 
1 1 1   35    5   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    5   38 o    189.0    4.2    0.0000   0.0000          ?        ?   357.5721  15.9630          ?        ?      189.0        4.2       ?       ? 
1 1 1   35    5   39 o    116.0    7.4    0.0000   0.0000          ?        ?   134.7281  17.2401          ?        ?      116.0        7.4       ?       ? 
1 1 1   35    5   40 o    587.2    2.7    0.0000   0.0000          ?        ?  3449.2939  31.2876          ?        ?      587.2        2.7       ?       ? 
1 1 1   35    5   41 f    452.3    2.8    0.0000   0.0000          ?        ?  2046.4618  24.9023          ?        ?      452.3        2.8       ?       ? 
1 1 1   35    5   42 o    319.7    3.0    0.0000   0.0000          ?        ?  1022.2732  19.1556          ?        ?      319.7        3.0       ?       ? 
1 1 1   35    5   43 f    180.2    4.4    0.0000   0.0000          ?        ?   325.0075  15.9630          ?        ?      180.2        4.4       ?       ? 
1 1 1   35    5   44 o    156.5    5.1    0.0000   0.0000          ?        ?   245.1923  15.9630          ?        ?      156.5        5.1       ?       ? 
1 1 1   35    5   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    5   46 o    429.9    2.6    0.0000   0.0000          ?        ?  1848.5201  22.3483          ?        ?      429.9        2.6       ?       ? 
1 1 1   35    5   47 o    216.7    4.1    0.0000   0.0000          ?        ?   469.9519  17.8786          ?        ?      216.7        4.1       ?       ? 
1 1 1   35    5   48 o    490.3    2.7    0.0000   0.0000          ?        ?  2405.3110  26.8179          ?        ?      490.3        2.7       ?       ? 
1 1 1   35    5   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    5   50 o    409.8    2.7    0.0000   0.0000          ?        ?  1679.9504  22.3483          ?        ?      409.8        2.7       ?       ? 
1 1 1   35    5   51 o    245.3    3.9    0.0000   0.0000          ?        ?   602.1259  19.1556          ?        ?      245.3        3.9       ?       ? 
1 1 1   35    5   52 o    309.0    3.2    0.0000   0.0000          ?        ?   955.2284  19.7942          ?        ?      309.0        3.2       ?       ? 
1 1 1   35    5   53 o    226.0    4.2    0.0000   0.0000          ?        ?   511.4558  19.1556          ?        ?      226.0        4.2       ?       ? 
1 1 1   35    5   54 o    111.3    8.3    0.0000   0.0000          ?        ?   124.5117  18.5171          ?        ?      111.3        8.3       ?       ? 
1 1 1   35    5   55 o    416.3    2.8    0.0000   0.0000          ?        ?  1734.2247  23.6253          ?        ?      416.3        2.8       ?       ? 
1 1 1   35    5   56 f     49.9   16.5    0.0000   0.0000          ?        ?    24.2638  19.1556          ?        ?       49.9       16.5       ?       ? 
1 1 1   35    5   57 o     88.2   10.9    0.0000   0.0000          ?        ?    78.5382  19.1556          ?        ?       88.2       10.9       ?       ? 
1 1 1   35    5   58 o    190.2    5.0    0.0000   0.0000          ?        ?   362.6803  19.1556          ?        ?      190.2        5.0       ?       ? 
1 1 1   35    5   59 o    334.0    3.3    0.0000   0.0000          ?        ?  1116.7743  22.3483          ?        ?      334.0        3.3       ?       ? 
1 1 1   35    5   60 o     22.3   11.1    0.0000   0.0000          ?        ?   -50.4432  19.7942          ?        ?       22.3       11.1       ?       ? 
1 1 1   35    5   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    5   62 o    319.5    3.4    0.0000   0.0000          ?        ?  1022.2732  21.7097          ?        ?      319.5        3.4       ?       ? 
1 1 1   35    5   63 o    124.0    8.2    0.0000   0.0000          ?        ?   155.1608  20.4327          ?        ?      124.0        8.2       ?       ? 
1 1 1   35    5   64 o     93.9   10.2    0.0000   0.0000          ?        ?    89.3930  19.1556          ?        ?       93.9       10.2       ?       ? 
1 1 1   35    5   65 o    251.1    4.2    0.0000   0.0000          ?        ?   632.1364  21.0712          ?        ?      251.1        4.2       ?       ? 
1 1 1   35    5   66 o    111.1    8.9    0.0000   0.0000          ?        ?   125.1502  19.7942          ?        ?      111.1        8.9       ?       ? 
1 1 1   35    5   67 o     52.9   16.7    0.0000   0.0000          ?        ?    29.3720  19.7942          ?        ?       52.9       16.7       ?       ? 
1 1 1   35    5   68 o     27.7   13.2    0.0000   0.0000          ?        ?   -22.9868  19.7942          ?        ?       27.7       13.2       ?       ? 
1 1 1   35    6    0 o    952.2    5.0 9068.9229  95.1397  9068.9229  95.1397  9068.9229  95.1397      952.2      5.0      952.2        5.0     0.0     0.0 
1 1 1   35    6    1 o    744.2    3.0    0.0000   0.0000          ?        ?  5538.5366  45.3350          ?        ?      744.2        3.0       ?       ? 
1 1 1   35    6    2 o    406.5    2.4    0.0000   0.0000          ?        ?  1652.4939  19.1556          ?        ?      406.5        2.4       ?       ? 
1 1 1   35    6    3 o    167.2    3.2    0.0000   0.0000          ?        ?   279.6725  10.8549          ?        ?      167.2        3.2       ?       ? 
1 1 1   35    6    4 o    595.0    2.6    0.0000   0.0000          ?        ?  3540.6025  31.2876          ?        ?      595.0        2.6       ?       ? 
1 1 1   35    6    5 o   1211.1    4.6    0.0000   0.0000          ?        ? 14669.3955 110.4642          ?        ?     1211.1        4.6       ?       ? 
1 1 1   35    6    6 o    688.9    2.8    0.0000   0.0000          ?        ?  4746.7700  38.9498          ?        ?      688.9        2.8       ?       ? 
1 1 1   35    6    7 o    593.7    2.7    0.0000   0.0000          ?        ?  3524.6394  31.9261          ?        ?      593.7        2.7       ?       ? 
1 1 1   35    6    8 o    444.9    2.7    0.0000   0.0000          ?        ?  1979.4170  24.2638          ?        ?      444.9        2.7       ?       ? 
1 1 1   35    6    9 o    421.2    2.5    0.0000   0.0000          ?        ?  1774.4515  21.0712          ?        ?      421.2        2.5       ?       ? 
1 1 1   35    6   10 o    791.5    3.3    0.0000   0.0000          ?        ?  6264.5356  52.3588          ?        ?      791.5        3.3       ?       ? 
1 1 1   35    6   11 o    586.7    2.6    0.0000   0.0000          ?        ?  3442.2700  30.6490          ?        ?      586.7        2.6       ?       ? 
1 1 1   35    6   12 o   1264.5    4.5    0.0000   0.0000          ?        ? 15991.7744 113.6568          ?        ?     1264.5        4.5       ?       ? 
1 1 1   35    6   13 o    282.4    2.6    0.0000   0.0000          ?        ?   797.5135  14.6860          ?        ?      282.4        2.6       ?       ? 
1 1 1   35    6   14 o    528.6    2.6    0.0000   0.0000          ?        ?  2794.1707  27.4564          ?        ?      528.6        2.6       ?       ? 
1 1 1   35    6   15 o    229.1    2.9    0.0000   0.0000          ?        ?   524.8647  13.4090          ?        ?      229.1        2.9       ?       ? 
1 1 1   35    6   16 o    548.1    2.7    0.0000   0.0000          ?        ?  3004.2441  29.3720          ?        ?      548.1        2.7       ?       ? 
1 1 1   35    6   17 o   1527.9    5.5    0.0000   0.0000          ?        ? 23350.7363 168.5697          ?        ?     1527.9        5.5       ?       ? 
1 1 1   35    6   18 o    357.3    2.6    0.0000   0.0000          ?        ?  1276.4047  18.5171          ?        ?      357.3        2.6       ?       ? 
1 1 1   35    6   19 o    399.4    2.6    0.0000   0.0000          ?        ?  1595.0271  20.4327          ?        ?      399.4        2.6       ?       ? 
1 1 1   35    6   20 o    587.2    2.7    0.0000   0.0000          ?        ?  3448.6550  31.2876          ?        ?      587.2        2.7       ?       ? 
1 1 1   35    6   21 o    297.2    2.8    0.0000   0.0000          ?        ?   883.0754  16.6016          ?        ?      297.2        2.8       ?       ? 
1 1 1   35    6   22 o    229.8    3.2    0.0000   0.0000          ?        ?   528.0574  14.6860          ?        ?      229.8        3.2       ?       ? 
1 1 1   35    6   23 o    345.8    2.6    0.0000   0.0000          ?        ?  1195.9510  17.8786          ?        ?      345.8        2.6       ?       ? 
1 1 1   35    6   24 o    597.2    2.7    0.0000   0.0000          ?        ?  3566.7817  31.9261          ?        ?      597.2        2.7       ?       ? 
1 1 1   35    6   25 o    261.1    2.9    0.0000   0.0000          ?        ?   681.9411  15.3245          ?        ?      261.1        2.9       ?       ? 
1 1 1   35    6   26 o   1004.5    3.9    0.0000   0.0000          ?        ? 10093.1113  78.5382          ?        ?     1004.5        3.9       ?       ? 
1 1 1   35    6   27 o     24.0   11.2    0.0000   0.0000          ?        ?   -13.4090  13.4090          ?        ?       24.0       11.2       ?       ? 
1 1 1   35    6   28 o    522.1    2.6    0.0000   0.0000          ?        ?  2725.8489  27.4564          ?        ?      522.1        2.6       ?       ? 
1 1 1   35    6   29 f    428.8    2.8    0.0000   0.0000          ?        ?  1838.9423  23.6253          ?        ?      428.8        2.8       ?       ? 
1 1 1   35    6   30 o    528.5    2.6    0.0000   0.0000          ?        ?  2793.5322  27.4564          ?        ?      528.5        2.6       ?       ? 
1 1 1   35    6   31 o    651.6    2.7    0.0000   0.0000          ?        ?  4246.8071  35.7572          ?        ?      651.6        2.7       ?       ? 
1 1 1   35    6   32 o    280.0    2.9    0.0000   0.0000          ?        ?   784.1046  15.9630          ?        ?      280.0        2.9       ?       ? 
1 1 1   35    6   33 o    490.9    2.5    0.0000   0.0000          ?        ?  2410.4192  24.9023          ?        ?      490.9        2.5       ?       ? 
1 1 1   35    6   34 o    359.6    2.7    0.0000   0.0000          ?        ?  1293.6449  19.1556          ?        ?      359.6        2.7       ?       ? 
1 1 1   35    6   35 o    343.3    2.7    0.0000   0.0000          ?        ?  1178.7109  18.5171          ?        ?      343.3        2.7       ?       ? 
1 1 1   35    6   36 o    349.7    2.9    0.0000   0.0000          ?        ?  1223.4075  20.4327          ?        ?      349.7        2.9       ?       ? 
1 1 1   35    6   37 o    451.6    2.5    0.0000   0.0000          ?        ?  2040.0765  22.9868          ?        ?      451.6        2.5       ?       ? 
1 1 1   35    6   38 o    394.5    2.7    0.0000   0.0000          ?        ?  1556.7157  21.0712          ?        ?      394.5        2.7       ?       ? 
1 1 1   35    6   39 o    408.3    2.5    0.0000   0.0000          ?        ?  1667.1801  20.4327          ?        ?      408.3        2.5       ?       ? 
1 1 1   35    6   40 o    304.5    3.0    0.0000   0.0000          ?        ?   927.7720  18.5171          ?        ?      304.5        3.0       ?       ? 
1 1 1   35    6   41 o    243.4    3.5    0.0000   0.0000          ?        ?   592.5481  17.2401          ?        ?      243.4        3.5       ?       ? 
1 1 1   35    6   42 o    257.8    3.3    0.0000   0.0000          ?        ?   664.7010  17.2401          ?        ?      257.8        3.3       ?       ? 
1 1 1   35    6   43 f    271.5    3.3    0.0000   0.0000          ?        ?   737.4925  17.8786          ?        ?      271.5        3.3       ?       ? 
1 1 1   35    6   44 o    155.9    5.3    0.0000   0.0000          ?        ?   243.2767  16.6016          ?        ?      155.9        5.3       ?       ? 
1 1 1   35    6   45 o    220.6    3.9    0.0000   0.0000          ?        ?   487.1920  17.2401          ?        ?      220.6        3.9       ?       ? 
1 1 1   35    6   46 o    108.8    7.9    0.0000   0.0000          ?        ?   118.7650  17.2401          ?        ?      108.8        7.9       ?       ? 
1 1 1   35    6   47 o    509.1    2.7    0.0000   0.0000          ?        ?  2593.0364  27.4564          ?        ?      509.1        2.7       ?       ? 
1 1 1   35    6   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    6   49 o     73.8   11.7    0.0000   0.0000          ?        ?    54.9129  17.2401          ?        ?       73.8       11.7       ?       ? 
1 1 1   35    6   50 o    410.0    2.8    0.0000   0.0000          ?        ?  1681.8660  22.9868          ?        ?      410.0        2.8       ?       ? 
1 1 1   35    6   51 o    230.5    4.0    0.0000   0.0000          ?        ?   531.8885  18.5171          ?        ?      230.5        4.0       ?       ? 
1 1 1   35    6   52 o     18.7    9.5    0.0000   0.0000          ?        ?   -58.7440  17.2401          ?        ?       18.7        9.5       ?       ? 
1 1 1   35    6   53 o    205.9    4.7    0.0000   0.0000          ?        ?   424.6169  19.1556          ?        ?      205.9        4.7       ?       ? 
1 1 1   35    6   54 o    169.1    5.5    0.0000   0.0000          ?        ?   286.6962  18.5171          ?        ?      169.1        5.5       ?       ? 
1 1 1   35    6   55 o    148.9    6.2    0.0000   0.0000          ?        ?   222.2055  18.5171          ?        ?      148.9        6.2       ?       ? 
1 1 1   35    6   56 o     23.0   11.3    0.0000   0.0000          ?        ?   -39.5883  18.5171          ?        ?       23.0       11.3       ?       ? 
1 1 1   35    6   57 f     60.6   15.7    0.0000   0.0000          ?        ?    38.9498  19.1556          ?        ?       60.6       15.7       ?       ? 
1 1 1   35    6   58 o    114.3    8.7    0.0000   0.0000          ?        ?   131.5355  19.7942          ?        ?      114.3        8.7       ?       ? 
1 1 1   35    6   59 o    270.3    3.8    0.0000   0.0000          ?        ?   731.7458  20.4327          ?        ?      270.3        3.8       ?       ? 
1 1 1   35    6   60 o    211.8    4.8    0.0000   0.0000          ?        ?   449.5192  20.4327          ?        ?      211.8        4.8       ?       ? 
1 1 1   35    6   61 o     20.5   10.4    0.0000   0.0000          ?        ?   -72.7915  21.0712          ?        ?       20.5       10.4       ?       ? 
1 1 1   35    6   62 o    172.3    5.9    0.0000   0.0000          ?        ?   298.1896  20.4327          ?        ?      172.3        5.9       ?       ? 
1 1 1   35    6   63 o    249.7    4.1    0.0000   0.0000          ?        ?   625.1127  20.4327          ?        ?      249.7        4.1       ?       ? 
1 1 1   35    6   64 o    103.8    9.5    0.0000   0.0000          ?        ?   109.1872  19.7942          ?        ?      103.8        9.5       ?       ? 
1 1 1   35    6   65 o     84.7   12.1    0.0000   0.0000          ?        ?    73.4300  20.4327          ?        ?       84.7       12.1       ?       ? 
1 1 1   35    6   66 o    148.0    6.7    0.0000   0.0000          ?        ?   220.9285  19.7942          ?        ?      148.0        6.7       ?       ? 
1 1 1   35    6   67 o    133.2    7.4    0.0000   0.0000          ?        ?   179.4246  19.7942          ?        ?      133.2        7.4       ?       ? 
1 1 1   35    7    0 o    132.2    5.3  175.5934  14.0475   175.5934  14.0475   175.5934  14.0475      132.2      5.3      132.2        5.3     0.0     0.0 
1 1 1   35    7    1 o    538.5    2.7    0.0000   0.0000          ?        ?  2899.5269  28.7335          ?        ?      538.5        2.7       ?       ? 
1 1 1   35    7    2 o    727.5    3.2    0.0000   0.0000          ?        ?  5292.7061  45.9736          ?        ?      727.5        3.2       ?       ? 
1 1 1   35    7    3 o   1215.1    4.4    0.0000   0.0000          ?        ? 14766.4521 107.2716          ?        ?     1215.1        4.4       ?       ? 
1 1 1   35    7    4 o    381.7    2.5    0.0000   0.0000          ?        ?  1457.1063  19.1556          ?        ?      381.7        2.5       ?       ? 
1 1 1   35    7    5 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    7    6 o    322.6    2.6    0.0000   0.0000          ?        ?  1040.7903  16.6016          ?        ?      322.6        2.6       ?       ? 
1 1 1   35    7    7 o    444.9    2.6    0.0000   0.0000          ?        ?  1979.4170  22.9868          ?        ?      444.9        2.6       ?       ? 
1 1 1   35    7    8 o   1059.4    4.0    0.0000   0.0000          ?        ? 11224.5723  84.2849          ?        ?     1059.4        4.0       ?       ? 
1 1 1   35    7    9 o    921.3    3.5    0.0000   0.0000          ?        ?  8487.8682  63.8522          ?        ?      921.3        3.5       ?       ? 
1 1 1   35    7   10 o    529.6    2.7    0.0000   0.0000          ?        ?  2805.0254  28.0950          ?        ?      529.6        2.7       ?       ? 
1 1 1   35    7   11 o    600.7    2.8    0.0000   0.0000          ?        ?  3608.9243  33.8416          ?        ?      600.7        2.8       ?       ? 
1 1 1   35    7   12 o    321.2    2.5    0.0000   0.0000          ?        ?  1031.8510  15.9630          ?        ?      321.2        2.5       ?       ? 
1 1 1   35    7   13 f    761.4    3.0    0.0000   0.0000          ?        ?  5797.1382  45.9736          ?        ?      761.4        3.0       ?       ? 
1 1 1   35    7   14 o    371.3    2.5    0.0000   0.0000          ?        ?  1378.5681  18.5171          ?        ?      371.3        2.5       ?       ? 
1 1 1   35    7   15 o    511.8    2.7    0.0000   0.0000          ?        ?  2619.2158  27.4564          ?        ?      511.8        2.7       ?       ? 
1 1 1   35    7   16 o    818.9    3.3    0.0000   0.0000          ?        ?  6706.3931  54.2743          ?        ?      818.9        3.3       ?       ? 
1 1 1   35    7   17 o    391.5    2.5    0.0000   0.0000          ?        ?  1532.4519  19.7942          ?        ?      391.5        2.5       ?       ? 
1 1 1   35    7   18 o    394.9    2.4    0.0000   0.0000          ?        ?  1559.2698  19.1556          ?        ?      394.9        2.4       ?       ? 
1 1 1   35    7   19 o    712.4    3.0    0.0000   0.0000          ?        ?  5074.9697  42.7809          ?        ?      712.4        3.0       ?       ? 
1 1 1   35    7   20 o    480.0    2.7    0.0000   0.0000          ?        ?  2303.7859  25.5409          ?        ?      480.0        2.7       ?       ? 
1 1 1   35    7   21 o    444.7    2.4    0.0000   0.0000          ?        ?  1978.1399  21.7097          ?        ?      444.7        2.4       ?       ? 
1 1 1   35    7   22 o    521.7    2.6    0.0000   0.0000          ?        ?  2722.0176  27.4564          ?        ?      521.7        2.6       ?       ? 
1 1 1   35    7   23 o    383.5    2.5    0.0000   0.0000          ?        ?  1471.1538  19.1556          ?        ?      383.5        2.5       ?       ? 
1 1 1   35    7   24 o    192.6    3.6    0.0000   0.0000          ?        ?   370.9810  14.0475          ?        ?      192.6        3.6       ?       ? 
1 1 1   35    7   25 o    312.0    2.7    0.0000   0.0000          ?        ?   973.7455  16.6016          ?        ?      312.0        2.7       ?       ? 
1 1 1   35    7   26 o   1024.6    4.0    0.0000   0.0000          ?        ? 10501.7646  81.0922          ?        ?     1024.6        4.0       ?       ? 
1 1 1   35    7   27 o    557.9    2.7    0.0000   0.0000          ?        ?  3113.4314  30.6490          ?        ?      557.9        2.7       ?       ? 
1 1 1   35    7   28 o     72.7   10.5    0.0000   0.0000          ?        ?    52.9973  15.3245          ?        ?       72.7       10.5       ?       ? 
1 1 1   35    7   29 o    345.7    2.8    0.0000   0.0000          ?        ?  1195.3125  19.1556          ?        ?      345.7        2.8       ?       ? 
1 1 1   35    7   30 o    703.3    3.1    0.0000   0.0000          ?        ?  4947.9043  43.4195          ?        ?      703.3        3.1       ?       ? 
1 1 1   35    7   31 o    652.2    2.8    0.0000   0.0000          ?        ?  4254.4697  36.3957          ?        ?      652.2        2.8       ?       ? 
1 1 1   35    7   32 o    558.6    2.8    0.0000   0.0000          ?        ?  3121.0938  31.2876          ?        ?      558.6        2.8       ?       ? 
1 1 1   35    7   33 o    220.8    3.6    0.0000   0.0000          ?        ?   487.8305  15.9630          ?        ?      220.8        3.6       ?       ? 
1 1 1   35    7   34 o    388.6    2.7    0.0000   0.0000          ?        ?  1510.7422  21.0712          ?        ?      388.6        2.7       ?       ? 
1 1 1   35    7   35 o    124.8    5.6    0.0000   0.0000          ?        ?   155.7993  14.0475          ?        ?      124.8        5.6       ?       ? 
1 1 1   35    7   36 o    126.5    5.8    0.0000   0.0000          ?        ?   160.2689  14.6860          ?        ?      126.5        5.8       ?       ? 
1 1 1   35    7   37 o    300.0    2.9    0.0000   0.0000          ?        ?   900.3155  17.2401          ?        ?      300.0        2.9       ?       ? 
1 1 1   35    7   38 o    545.8    2.6    0.0000   0.0000          ?        ?  2979.3420  28.7335          ?        ?      545.8        2.6       ?       ? 
1 1 1   35    7   39 o    366.0    2.7    0.0000   0.0000          ?        ?  1339.6184  19.7942          ?        ?      366.0        2.7       ?       ? 
1 1 1   35    7   40 o    362.0    2.7    0.0000   0.0000          ?        ?  1310.8849  19.7942          ?        ?      362.0        2.7       ?       ? 
1 1 1   35    7   41 o     42.1   15.0    0.0000   0.0000          ?        ?    15.3245  15.9630          ?        ?       42.1       15.0       ?       ? 
1 1 1   35    7   42 f    390.3    2.7    0.0000   0.0000          ?        ?  1523.5127  21.0712          ?        ?      390.3        2.7       ?       ? 
1 1 1   35    7   43 o     22.4   10.9    0.0000   0.0000          ?        ?   -29.3720  15.9630          ?        ?       22.4       10.9       ?       ? 
1 1 1   35    7   44 o    440.3    2.8    0.0000   0.0000          ?        ?  1939.1903  24.2638          ?        ?      440.3        2.8       ?       ? 
1 1 1   35    7   45 o    206.9    4.2    0.0000   0.0000          ?        ?   428.4480  17.2401          ?        ?      206.9        4.2       ?       ? 
1 1 1   35    7   46 o    443.2    2.7    0.0000   0.0000          ?        ?  1964.7311  24.2638          ?        ?      443.2        2.7       ?       ? 
1 1 1   35    7   47 o    154.2    5.8    0.0000   0.0000          ?        ?   238.1686  17.8786          ?        ?      154.2        5.8       ?       ? 
1 1 1   35    7   48 o    215.9    4.3    0.0000   0.0000          ?        ?   466.7593  18.5171          ?        ?      215.9        4.3       ?       ? 
1 1 1   35    7   49 o    156.0    5.7    0.0000   0.0000          ?        ?   243.9153  17.8786          ?        ?      156.0        5.7       ?       ? 
1 1 1   35    7   50 o    219.2    4.1    0.0000   0.0000          ?        ?   480.8068  17.8786          ?        ?      219.2        4.1       ?       ? 
1 1 1   35    7   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    7   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    7   53 o    405.9    3.1    0.0000   0.0000          ?        ?  1648.6630  24.9023          ?        ?      405.9        3.1       ?       ? 
1 1 1   35    7   54 o    205.1    4.7    0.0000   0.0000          ?        ?   421.4243  19.1556          ?        ?      205.1        4.7       ?       ? 
1 1 1   35    7   55 o    379.9    3.2    0.0000   0.0000          ?        ?  1444.3359  24.2638          ?        ?      379.9        3.2       ?       ? 
1 1 1   35    7   56 o    182.4    5.3    0.0000   0.0000          ?        ?   333.3083  19.1556          ?        ?      182.4        5.3       ?       ? 
1 1 1   35    7   57 o    262.4    3.6    0.0000   0.0000          ?        ?   689.6033  19.1556          ?        ?      262.4        3.6       ?       ? 
1 1 1   35    7   58 o     24.6   12.0    0.0000   0.0000          ?        ?   -37.6728  19.7942          ?        ?       24.6       12.0       ?       ? 
1 1 1   35    7   59 o     26.9   12.8    0.0000   0.0000          ?        ?   -24.9023  19.1556          ?        ?       26.9       12.8       ?       ? 
1 1 1   35    7   60 o    150.4    6.6    0.0000   0.0000          ?        ?   227.3137  19.7942          ?        ?      150.4        6.6       ?       ? 
1 1 1   35    7   61 f     24.6   12.0    0.0000   0.0000          ?        ?   -34.4802  19.1556          ?        ?       24.6       12.0       ?       ? 
1 1 1   35    7   62 o    227.1    4.8    0.0000   0.0000          ?        ?   517.2025  21.7097          ?        ?      227.1        4.8       ?       ? 
1 1 1   35    7   63 o    179.3    6.1    0.0000   0.0000          ?        ?   323.0919  21.7097          ?        ?      179.3        6.1       ?       ? 
1 1 1   35    7   64 o     26.7   12.8    0.0000   0.0000          ?        ?   -27.4564  19.7942          ?        ?       26.7       12.8       ?       ? 
1 1 1   35    7   65 o     96.3   10.3    0.0000   0.0000          ?        ?    94.5012  19.7942          ?        ?       96.3       10.3       ?       ? 
1 1 1   35    7   66 o    104.0    8.9    0.0000   0.0000          ?        ?   109.8257  18.5171          ?        ?      104.0        8.9       ?       ? 
1 1 1   35    7   67 f    127.0    7.8    0.0000   0.0000          ?        ?   163.4615  19.7942          ?        ?      127.0        7.8       ?       ? 
1 1 1   35    8    0 o    351.0    3.5 1232.3467  24.2638  1232.3467  24.2638  1232.3467  24.2638      351.0      3.5      351.0        3.5     0.0     0.0 
1 1 1   35    8    1 o    230.1    2.9    0.0000   0.0000          ?        ?   529.3344  13.4090          ?        ?      230.1        2.9       ?       ? 
1 1 1   35    8    2 o   1519.1    5.4    0.0000   0.0000          ?        ? 23081.2793 165.3771          ?        ?     1519.1        5.4       ?       ? 
1 1 1   35    8    3 o    525.9    3.0    0.0000   0.0000          ?        ?  2766.0757  31.2876          ?        ?      525.9        3.0       ?       ? 
1 1 1   35    8    4 o   1097.9    4.2    0.0000   0.0000          ?        ? 12055.2881  91.3086          ?        ?     1097.9        4.2       ?       ? 
1 1 1   35    8    5 o    253.6    2.9    0.0000   0.0000          ?        ?   642.9913  14.6860          ?        ?      253.6        2.9       ?       ? 
1 1 1   35    8    6 o    461.7    2.6    0.0000   0.0000          ?        ?  2131.3850  23.6253          ?        ?      461.7        2.6       ?       ? 
1 1 1   35    8    7 o    184.8    2.9    0.0000   0.0000          ?        ?   341.6091  10.8549          ?        ?      184.8        2.9       ?       ? 
1 1 1   35    8    8 o    540.8    2.7    0.0000   0.0000          ?        ?  2925.0676  28.7335          ?        ?      540.8        2.7       ?       ? 
1 1 1   35    8    9 o    178.3    3.6    0.0000   0.0000          ?        ?   317.9838  12.7704          ?        ?      178.3        3.6       ?       ? 
1 1 1   35    8   10 o    266.0    2.9    0.0000   0.0000          ?        ?   707.4820  15.3245          ?        ?      266.0        2.9       ?       ? 
1 1 1   35    8   11 o    265.7    2.4    0.0000   0.0000          ?        ?   706.2049  12.7704          ?        ?      265.7        2.4       ?       ? 
1 1 1   35    8   12 o    351.1    2.5    0.0000   0.0000          ?        ?  1232.9854  17.2401          ?        ?      351.1        2.5       ?       ? 
1 1 1   35    8   13 f    983.6    3.8    0.0000   0.0000          ?        ?  9675.5186  74.0685          ?        ?      983.6        3.8       ?       ? 
1 1 1   35    8   14 o    896.4    3.6    0.0000   0.0000          ?        ?  8036.4331  64.4907          ?        ?      896.4        3.6       ?       ? 
1 1 1   35    8   15 o    216.8    3.1    0.0000   0.0000          ?        ?   469.9519  13.4090          ?        ?      216.8        3.1       ?       ? 
1 1 1   35    8   16 o    593.7    2.8    0.0000   0.0000          ?        ?  3525.2778  33.2031          ?        ?      593.7        2.8       ?       ? 
1 1 1   35    8   17 o    248.3    3.0    0.0000   0.0000          ?        ?   616.8119  14.6860          ?        ?      248.3        3.0       ?       ? 
1 1 1   35    8   18 o    622.5    2.8    0.0000   0.0000          ?        ?  3875.8262  35.1187          ?        ?      622.5        2.8       ?       ? 
1 1 1   35    8   19 o    300.5    2.6    0.0000   0.0000          ?        ?   902.8696  15.3245          ?        ?      300.5        2.6       ?       ? 
1 1 1   35    8   20 o    694.5    3.0    0.0000   0.0000          ?        ?  4824.0308  42.1424          ?        ?      694.5        3.0       ?       ? 
1 1 1   35    8   21 o    478.9    2.5    0.0000   0.0000          ?        ?  2293.5698  23.6253          ?        ?      478.9        2.5       ?       ? 
1 1 1   35    8   22 o    903.8    3.8    0.0000   0.0000          ?        ?  8170.5225  68.3218          ?        ?      903.8        3.8       ?       ? 
1 1 1   35    8   23 o    243.4    3.0    0.0000   0.0000          ?        ?   592.5481  14.6860          ?        ?      243.4        3.0       ?       ? 
1 1 1   35    8   24 o    737.4    2.9    0.0000   0.0000          ?        ?  5437.6499  43.4195          ?        ?      737.4        2.9       ?       ? 
1 1 1   35    8   25 o    519.5    2.6    0.0000   0.0000          ?        ?  2699.0310  27.4564          ?        ?      519.5        2.6       ?       ? 
1 1 1   35    8   26 o    410.7    2.6    0.0000   0.0000          ?        ?  1686.9742  21.0712          ?        ?      410.7        2.6       ?       ? 
1 1 1   35    8   27 o    810.4    3.2    0.0000   0.0000          ?        ?  6569.1108  51.7203          ?        ?      810.4        3.2       ?       ? 
1 1 1   35    8   28 o    334.3    2.7    0.0000   0.0000          ?        ?  1117.4128  17.8786          ?        ?      334.3        2.7       ?       ? 
1 1 1   35    8   29 o    564.9    2.6    0.0000   0.0000          ?        ?  3191.3311  29.3720          ?        ?      564.9        2.6       ?       ? 
1 1 1   35    8   30 o    341.1    2.7    0.0000   0.0000          ?        ?  1164.0249  18.5171          ?        ?      341.1        2.7       ?       ? 
1 1 1   35    8   31 o    367.8    2.6    0.0000   0.0000          ?        ?  1353.0273  19.1556          ?        ?      367.8        2.6       ?       ? 
1 1 1   35    8   32 o    385.1    2.5    0.0000   0.0000          ?        ?  1483.2858  19.1556          ?        ?      385.1        2.5       ?       ? 
1 1 1   35    8   33 o    403.3    2.5    0.0000   0.0000          ?        ?  1626.9531  19.7942          ?        ?      403.3        2.5       ?       ? 
1 1 1   35    8   34 o    435.5    2.5    0.0000   0.0000          ?        ?  1897.0479  21.7097          ?        ?      435.5        2.5       ?       ? 
1 1 1   35    8   35 o    758.4    3.0    0.0000   0.0000          ?        ?  5753.7183  45.9736          ?        ?      758.4        3.0       ?       ? 
1 1 1   35    8   36 o    479.3    2.5    0.0000   0.0000          ?        ?  2297.4006  24.2638          ?        ?      479.3        2.5       ?       ? 
1 1 1   35    8   37 o    662.5    2.8    0.0000   0.0000          ?        ?  4389.8364  37.0343          ?        ?      662.5        2.8       ?       ? 
1 1 1   35    8   38 o    156.9    5.1    0.0000   0.0000          ?        ?   246.4693  15.9630          ?        ?      156.9        5.1       ?       ? 
1 1 1   35    8   39 o    677.0    2.9    0.0000   0.0000          ?        ?  4585.2236  38.9498          ?        ?      677.0        2.9       ?       ? 
1 1 1   35    8   40 o    374.4    2.7    0.0000   0.0000          ?        ?  1402.1935  20.4327          ?        ?      374.4        2.7       ?       ? 
1 1 1   35    8   41 o    148.1    5.4    0.0000   0.0000          ?        ?   219.6514  15.9630          ?        ?      148.1        5.4       ?       ? 
1 1 1   35    8   42 f     23.3   11.2    0.0000   0.0000          ?        ?   -22.9868  15.3245          ?        ?       23.3       11.2       ?       ? 
1 1 1   35    8   43 o    107.1    7.2    0.0000   0.0000          ?        ?   114.9339  15.3245          ?        ?      107.1        7.2       ?       ? 
1 1 1   35    8   44 o    326.2    3.0    0.0000   0.0000          ?        ?  1064.4155  19.7942          ?        ?      326.2        3.0       ?       ? 
1 1 1   35    8   45 o     23.2   11.3    0.0000   0.0000          ?        ?   -31.9261  17.2401          ?        ?       23.2       11.3       ?       ? 
1 1 1   35    8   46 o    150.2    5.7    0.0000   0.0000          ?        ?   226.0367  17.2401          ?        ?      150.2        5.7       ?       ? 
1 1 1   35    8   47 o    231.1    3.9    0.0000   0.0000          ?        ?   534.4426  17.8786          ?        ?      231.1        3.9       ?       ? 
1 1 1   35    8   48 o    209.0    4.1    0.0000   0.0000          ?        ?   437.3873  17.2401          ?        ?      209.0        4.1       ?       ? 
1 1 1   35    8   49 o    315.2    3.1    0.0000   0.0000          ?        ?   994.1782  19.7942          ?        ?      315.2        3.1       ?       ? 
1 1 1   35    8   50 o    227.4    4.1    0.0000   0.0000          ?        ?   517.8410  18.5171          ?        ?      227.4        4.1       ?       ? 
1 1 1   35    8   51 f    152.9    5.8    0.0000   0.0000          ?        ?   234.3374  17.8786          ?        ?      152.9        5.8       ?       ? 
1 1 1   35    8   52 o    301.6    3.3    0.0000   0.0000          ?        ?   910.5319  19.7942          ?        ?      301.6        3.3       ?       ? 
1 1 1   35    8   53 o    231.0    4.3    0.0000   0.0000          ?        ?   534.4426  19.7942          ?        ?      231.0        4.3       ?       ? 
1 1 1   35    8   54 o    242.5    4.2    0.0000   0.0000          ?        ?   588.7169  20.4327          ?        ?      242.5        4.2       ?       ? 
1 1 1   35    8   55 o    142.5    6.7    0.0000   0.0000          ?        ?   203.6884  19.1556          ?        ?      142.5        6.7       ?       ? 
1 1 1   35    8   56 o    158.4    6.0    0.0000   0.0000          ?        ?   251.5775  19.1556          ?        ?      158.4        6.0       ?       ? 
1 1 1   35    8   57 o    186.8    5.3    0.0000   0.0000          ?        ?   349.9099  19.7942          ?        ?      186.8        5.3       ?       ? 
1 1 1   35    8   58 o    193.9    4.9    0.0000   0.0000          ?        ?   376.7278  19.1556          ?        ?      193.9        4.9       ?       ? 
1 1 1   35    8   59 o     20.8   10.5    0.0000   0.0000          ?        ?   -56.1899  19.1556          ?        ?       20.8       10.5       ?       ? 
1 1 1   35    8   60 o    244.1    4.3    0.0000   0.0000          ?        ?   597.0177  21.0712          ?        ?      244.1        4.3       ?       ? 
1 1 1   35    8   61 o     79.9   12.4    0.0000   0.0000          ?        ?    65.1292  19.7942          ?        ?       79.9       12.4       ?       ? 
1 1 1   35    8   62 o    147.0    7.4    0.0000   0.0000          ?        ?   217.7359  21.7097          ?        ?      147.0        7.4       ?       ? 
1 1 1   35    8   63 o     38.6   15.9    0.0000   0.0000          ?        ?     5.7467  19.7942          ?        ?       38.6       15.9       ?       ? 
1 1 1   35    8   64 o    172.2    5.9    0.0000   0.0000          ?        ?   298.1896  20.4327          ?        ?      172.2        5.9       ?       ? 
1 1 1   35    8   65 o    181.7    5.6    0.0000   0.0000          ?        ?   332.0312  20.4327          ?        ?      181.7        5.6       ?       ? 
1 1 1   35    8   66 o     84.2   11.4    0.0000   0.0000          ?        ?    72.7915  19.1556          ?        ?       84.2       11.4       ?       ? 
1 1 1   35    9    0 o    193.6    4.3  375.4507  16.6016   375.4507  16.6016   375.4507  16.6016      193.6      4.3      193.6        4.3     0.0     0.0 
1 1 1   35    9    1 o     16.9    8.5    0.0000   0.0000          ?        ?   -34.4802  12.1319          ?        ?       16.9        8.5       ?       ? 
1 1 1   35    9    2 o   1479.4    5.2    0.0000   0.0000          ?        ? 21892.9902 153.8837          ?        ?     1479.4        5.2       ?       ? 
1 1 1   35    9    3 o    445.5    3.1    0.0000   0.0000          ?        ?  1984.5251  27.4564          ?        ?      445.5        3.1       ?       ? 
1 1 1   35    9    4 o   1579.5    5.7    0.0000   0.0000          ?        ? 24957.2578 180.7016          ?        ?     1579.5        5.7       ?       ? 
1 1 1   35    9    5 o    747.6    3.2    0.0000   0.0000          ?        ?  5590.2568  48.5276          ?        ?      747.6        3.2       ?       ? 
1 1 1   35    9    6 o    303.1    2.4    0.0000   0.0000          ?        ?   918.8326  14.6860          ?        ?      303.1        2.4       ?       ? 
1 1 1   35    9    7 o    503.0    2.5    0.0000   0.0000          ?        ?  2530.4612  24.9023          ?        ?      503.0        2.5       ?       ? 
1 1 1   35    9    8 f    236.8    2.6    0.0000   0.0000          ?        ?   560.6220  12.1319          ?        ?      236.8        2.6       ?       ? 
1 1 1   35    9    9 o    525.4    2.6    0.0000   0.0000          ?        ?  2760.3289  27.4564          ?        ?      525.4        2.6       ?       ? 
1 1 1   35    9   10 o    629.8    3.0    0.0000   0.0000          ?        ?  3966.4963  37.6728          ?        ?      629.8        3.0       ?       ? 
1 1 1   35    9   11 o    533.0    2.6    0.0000   0.0000          ?        ?  2841.4211  28.0950          ?        ?      533.0        2.6       ?       ? 
1 1 1   35    9   12 o    758.2    3.2    0.0000   0.0000          ?        ?  5748.6104  47.8891          ?        ?      758.2        3.2       ?       ? 
1 1 1   35    9   13 o    555.7    2.5    0.0000   0.0000          ?        ?  3088.5293  28.0950          ?        ?      555.7        2.5       ?       ? 
1 1 1   35    9   14 o    293.7    2.6    0.0000   0.0000          ?        ?   862.6428  15.3245          ?        ?      293.7        2.6       ?       ? 
1 1 1   35    9   15 o    290.2    2.8    0.0000   0.0000          ?        ?   842.2100  15.9630          ?        ?      290.2        2.8       ?       ? 
1 1 1   35    9   16 o    248.3    3.0    0.0000   0.0000          ?        ?   616.8119  14.6860          ?        ?      248.3        3.0       ?       ? 
1 1 1   35    9   17 o     70.1    9.1    0.0000   0.0000          ?        ?    49.1662  12.7704          ?        ?       70.1        9.1       ?       ? 
1 1 1   35    9   18 o    415.2    2.5    0.0000   0.0000          ?        ?  1724.0084  20.4327          ?        ?      415.2        2.5       ?       ? 
1 1 1   35    9   19 o    724.6    3.0    0.0000   0.0000          ?        ?  5251.2021  42.7809          ?        ?      724.6        3.0       ?       ? 
1 1 1   35    9   20 o    637.4    2.9    0.0000   0.0000          ?        ?  4063.5518  37.0343          ?        ?      637.4        2.9       ?       ? 
1 1 1   35    9   21 f    176.7    3.8    0.0000   0.0000          ?        ?   312.2371  13.4090          ?        ?      176.7        3.8       ?       ? 
1 1 1   35    9   22 o    364.2    2.5    0.0000   0.0000          ?        ?  1326.8479  17.8786          ?        ?      364.2        2.5       ?       ? 
1 1 1   35    9   23 o    410.6    2.4    0.0000   0.0000          ?        ?  1686.3357  19.7942          ?        ?      410.6        2.4       ?       ? 
1 1 1   35    9   24 o    362.0    2.6    0.0000   0.0000          ?        ?  1310.8849  18.5171          ?        ?      362.0        2.6       ?       ? 
1 1 1   35    9   25 o    342.6    2.6    0.0000   0.0000          ?        ?  1173.6028  17.8786          ?        ?      342.6        2.6       ?       ? 
1 1 1   35    9   26 f    567.5    2.5    0.0000   0.0000          ?        ?  3221.3416  28.7335          ?        ?      567.5        2.5       ?       ? 
1 1 1   35    9   27 o    582.5    2.6    0.0000   0.0000          ?        ?  3393.7424  30.6490          ?        ?      582.5        2.6       ?       ? 
1 1 1   35    9   28 o    521.8    2.6    0.0000   0.0000          ?        ?  2722.6562  26.8179          ?        ?      521.8        2.6       ?       ? 
1 1 1   35    9   29 o    238.9    3.2    0.0000   0.0000          ?        ?   570.8383  15.3245          ?        ?      238.9        3.2       ?       ? 
1 1 1   35    9   30 o    211.5    3.8    0.0000   0.0000          ?        ?   447.6036  15.9630          ?        ?      211.5        3.8       ?       ? 
1 1 1   35    9   31 o    379.6    2.4    0.0000   0.0000          ?        ?  1441.1433  18.5171          ?        ?      379.6        2.4       ?       ? 
1 1 1   35    9   32 o    215.9    3.7    0.0000   0.0000          ?        ?   466.1208  15.9630          ?        ?      215.9        3.7       ?       ? 
1 1 1   35    9   33 o     34.3   13.9    0.0000   0.0000          ?        ?     5.1082  14.6860          ?        ?       34.3       13.9       ?       ? 
1 1 1   35    9   34 o    513.6    2.5    0.0000   0.0000          ?        ?  2638.3713  25.5409          ?        ?      513.6        2.5       ?       ? 
1 1 1   35    9   35 o    241.7    3.4    0.0000   0.0000          ?        ?   584.2473  16.6016          ?        ?      241.7        3.4       ?       ? 
1 1 1   35    9   36 o     57.5   12.6    0.0000   0.0000          ?        ?    34.4802  14.0475          ?        ?       57.5       12.6       ?       ? 
1 1 1   35    9   37 o     40.8   14.7    0.0000   0.0000          ?        ?    14.0475  15.3245          ?        ?       40.8       14.7       ?       ? 
1 1 1   35    9   38 o    650.1    2.9    0.0000   0.0000          ?        ?  4227.0132  37.6728          ?        ?      650.1        2.9       ?       ? 
1 1 1   35    9   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    9   40 o    258.5    3.3    0.0000   0.0000          ?        ?   668.5321  17.2401          ?        ?      258.5        3.3       ?       ? 
1 1 1   35    9   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35    9   42 o     66.4   13.0    0.0000   0.0000          ?        ?    45.9736  16.6016          ?        ?       66.4       13.0       ?       ? 
1 1 1   35    9   43 o    535.5    2.6    0.0000   0.0000          ?        ?  2868.8777  28.0950          ?        ?      535.5        2.6       ?       ? 
1 1 1   35    9   44 o     66.5   12.5    0.0000   0.0000          ?        ?    45.9736  15.9630          ?        ?       66.5       12.5       ?       ? 
1 1 1   35    9   45 o    242.9    3.7    0.0000   0.0000          ?        ?   590.6325  17.8786          ?        ?      242.9        3.7       ?       ? 
1 1 1   35    9   46 o    199.0    4.0    0.0000   0.0000          ?        ?   396.5219  15.9630          ?        ?      199.0        4.0       ?       ? 
1 1 1   35    9   47 o    197.6    4.2    0.0000   0.0000          ?        ?   390.7752  16.6016          ?        ?      197.6        4.2       ?       ? 
1 1 1   35    9   48 o    165.4    5.0    0.0000   0.0000          ?        ?   273.9258  16.6016          ?        ?      165.4        5.0       ?       ? 
1 1 1   35    9   49 o     60.8   14.4    0.0000   0.0000          ?        ?    38.9498  17.2401          ?        ?       60.8       14.4       ?       ? 
1 1 1   35    9   50 o    592.2    2.9    0.0000   0.0000          ?        ?  3508.6763  33.8416          ?        ?      592.2        2.9       ?       ? 
1 1 1   35    9   51 o    280.0    3.5    0.0000   0.0000          ?        ?   784.7431  19.7942          ?        ?      280.0        3.5       ?       ? 
1 1 1   35    9   52 o    338.4    3.2    0.0000   0.0000          ?        ?  1146.1464  21.7097          ?        ?      338.4        3.2       ?       ? 
1 1 1   35    9   53 o    482.8    2.8    0.0000   0.0000          ?        ?  2332.5195  26.8179          ?        ?      482.8        2.8       ?       ? 
1 1 1   35    9   54 o    189.0    5.4    0.0000   0.0000          ?        ?   358.2106  20.4327          ?        ?      189.0        5.4       ?       ? 
1 1 1   35    9   55 o    224.6    4.4    0.0000   0.0000          ?        ?   505.0706  19.7942          ?        ?      224.6        4.4       ?       ? 
1 1 1   35    9   56 o    243.8    4.2    0.0000   0.0000          ?        ?   595.1021  20.4327          ?        ?      243.8        4.2       ?       ? 
1 1 1   35    9   57 o    143.5    6.9    0.0000   0.0000          ?        ?   206.8810  19.7942          ?        ?      143.5        6.9       ?       ? 
1 1 1   35    9   58 o    133.3    7.2    0.0000   0.0000          ?        ?   178.7861  19.1556          ?        ?      133.3        7.2       ?       ? 
1 1 1   35    9   59 f    145.6    7.0    0.0000   0.0000          ?        ?   213.2662  20.4327          ?        ?      145.6        7.0       ?       ? 
1 1 1   35    9   60 o     82.3   12.4    0.0000   0.0000          ?        ?    68.9603  20.4327          ?        ?       82.3       12.4       ?       ? 
1 1 1   35    9   61 o    374.1    3.1    0.0000   0.0000          ?        ?  1401.5549  22.9868          ?        ?      374.1        3.1       ?       ? 
1 1 1   35    9   62 o     45.9   16.7    0.0000   0.0000          ?        ?    18.5171  19.7942          ?        ?       45.9       16.7       ?       ? 
1 1 1   35    9   63 o    238.9    4.5    0.0000   0.0000          ?        ?   572.7539  21.7097          ?        ?      238.9        4.5       ?       ? 
1 1 1   35    9   64 o    204.8    5.0    0.0000   0.0000          ?        ?   421.4243  20.4327          ?        ?      204.8        5.0       ?       ? 
1 1 1   35    9   65 o     60.8   15.7    0.0000   0.0000          ?        ?    40.2269  19.1556          ?        ?       60.8       15.7       ?       ? 
1 1 1   35   10    0 o   1007.0    5.5 10142.2773 109.8257 10142.2773 109.8257 10142.2773 109.8257     1007.0      5.5     1007.0        5.5     0.0     0.0 
1 1 1   35   10    1 o    507.6    2.6    0.0000   0.0000          ?        ?  2576.4348  26.1794          ?        ?      507.6        2.6       ?       ? 
1 1 1   35   10    2 o    519.9    2.5    0.0000   0.0000          ?        ?  2702.8621  26.1794          ?        ?      519.9        2.5       ?       ? 
1 1 1   35   10    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   10    4 o    565.9    2.7    0.0000   0.0000          ?        ?  3202.8245  30.0105          ?        ?      565.9        2.7       ?       ? 
1 1 1   35   10    5 o   1072.4    4.1    0.0000   0.0000          ?        ? 11502.3291  88.7545          ?        ?     1072.4        4.1       ?       ? 
1 1 1   35   10    6 o    627.8    2.9    0.0000   0.0000          ?        ?  3942.2327  36.3957          ?        ?      627.8        2.9       ?       ? 
1 1 1   35   10    7 o    356.9    2.3    0.0000   0.0000          ?        ?  1273.8506  16.6016          ?        ?      356.9        2.3       ?       ? 
1 1 1   35   10    8 o    457.8    2.4    0.0000   0.0000          ?        ?  2095.6282  22.3483          ?        ?      457.8        2.4       ?       ? 
1 1 1   35   10    9 o    656.0    3.1    0.0000   0.0000          ?        ?  4304.2739  40.2269          ?        ?      656.0        3.1       ?       ? 
1 1 1   35   10   10 o    970.7    3.7    0.0000   0.0000          ?        ?  9423.3027  72.7915          ?        ?      970.7        3.7       ?       ? 
1 1 1   35   10   11 o    637.7    2.8    0.0000   0.0000          ?        ?  4066.7444  35.7572          ?        ?      637.7        2.8       ?       ? 
1 1 1   35   10   12 o    567.9    2.8    0.0000   0.0000          ?        ?  3225.1729  31.2876          ?        ?      567.9        2.8       ?       ? 
1 1 1   35   10   13 o    568.8    2.8    0.0000   0.0000          ?        ?  3235.3892  31.2876          ?        ?      568.8        2.8       ?       ? 
1 1 1   35   10   14 o    791.0    3.2    0.0000   0.0000          ?        ?  6258.1504  50.4432          ?        ?      791.0        3.2       ?       ? 
1 1 1   35   10   15 o    695.5    2.8    0.0000   0.0000          ?        ?  4837.4395  39.5883          ?        ?      695.5        2.8       ?       ? 
1 1 1   35   10   16 o    512.8    2.7    0.0000   0.0000          ?        ?  2629.4319  27.4564          ?        ?      512.8        2.7       ?       ? 
1 1 1   35   10   17 o    565.4    2.7    0.0000   0.0000          ?        ?  3197.0779  30.6490          ?        ?      565.4        2.7       ?       ? 
1 1 1   35   10   18 f    846.5    3.4    0.0000   0.0000          ?        ?  7166.7671  58.1055          ?        ?      846.5        3.4       ?       ? 
1 1 1   35   10   19 o    658.7    2.8    0.0000   0.0000          ?        ?  4339.3926  37.0343          ?        ?      658.7        2.8       ?       ? 
1 1 1   35   10   20 o    544.6    2.6    0.0000   0.0000          ?        ?  2966.5715  28.0950          ?        ?      544.6        2.6       ?       ? 
1 1 1   35   10   21 o    643.6    2.8    0.0000   0.0000          ?        ?  4143.3672  35.7572          ?        ?      643.6        2.8       ?       ? 
1 1 1   35   10   22 o    522.7    2.5    0.0000   0.0000          ?        ?  2732.8726  26.1794          ?        ?      522.7        2.5       ?       ? 
1 1 1   35   10   23 o    191.4    3.8    0.0000   0.0000          ?        ?   366.5114  14.6860          ?        ?      191.4        3.8       ?       ? 
1 1 1   35   10   24 o    422.5    2.4    0.0000   0.0000          ?        ?  1785.3065  20.4327          ?        ?      422.5        2.4       ?       ? 
1 1 1   35   10   25 o    224.9    3.1    0.0000   0.0000          ?        ?   505.7091  14.0475          ?        ?      224.9        3.1       ?       ? 
1 1 1   35   10   26 o    305.5    2.8    0.0000   0.0000          ?        ?   933.5186  17.2401          ?        ?      305.5        2.8       ?       ? 
1 1 1   35   10   27 f     18.1    9.0    0.0000   0.0000          ?        ?   -36.3957  13.4090          ?        ?       18.1        9.0       ?       ? 
1 1 1   35   10   28 o    549.0    2.7    0.0000   0.0000          ?        ?  3014.4607  29.3720          ?        ?      549.0        2.7       ?       ? 
1 1 1   35   10   29 o    305.1    2.6    0.0000   0.0000          ?        ?   930.9645  15.9630          ?        ?      305.1        2.6       ?       ? 
1 1 1   35   10   30 o    432.6    2.4    0.0000   0.0000          ?        ?  1871.5070  21.0712          ?        ?      432.6        2.4       ?       ? 
1 1 1   35   10   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   10   32 o    154.7    4.5    0.0000   0.0000          ?        ?   239.4456  14.0475          ?        ?      154.7        4.5       ?       ? 
1 1 1   35   10   33 o    191.9    4.0    0.0000   0.0000          ?        ?   368.4270  15.3245          ?        ?      191.9        4.0       ?       ? 
1 1 1   35   10   34 o    418.7    2.5    0.0000   0.0000          ?        ?  1753.3804  21.0712          ?        ?      418.7        2.5       ?       ? 
1 1 1   35   10   35 o    645.1    2.7    0.0000   0.0000          ?        ?  4162.5225  35.1187          ?        ?      645.1        2.7       ?       ? 
1 1 1   35   10   36 o    160.8    4.6    0.0000   0.0000          ?        ?   258.6013  14.6860          ?        ?      160.8        4.6       ?       ? 
1 1 1   35   10   37 o    220.8    3.6    0.0000   0.0000          ?        ?   487.8305  15.9630          ?        ?      220.8        3.6       ?       ? 
1 1 1   35   10   38 o    145.3    5.5    0.0000   0.0000          ?        ?   211.3506  15.9630          ?        ?      145.3        5.5       ?       ? 
1 1 1   35   10   39 o    740.0    3.0    0.0000   0.0000          ?        ?  5478.5156  44.0580          ?        ?      740.0        3.0       ?       ? 
1 1 1   35   10   40 f    453.4    2.5    0.0000   0.0000          ?        ?  2056.6782  22.9868          ?        ?      453.4        2.5       ?       ? 
1 1 1   35   10   41 o     88.5    8.7    0.0000   0.0000          ?        ?    78.5382  15.3245          ?        ?       88.5        8.7       ?       ? 
1 1 1   35   10   42 o    164.1    4.9    0.0000   0.0000          ?        ?   269.4561  15.9630          ?        ?      164.1        4.9       ?       ? 
1 1 1   35   10   43 o    298.4    3.1    0.0000   0.0000          ?        ?   890.7377  18.5171          ?        ?      298.4        3.1       ?       ? 
1 1 1   35   10   44 o    191.3    4.3    0.0000   0.0000          ?        ?   366.5114  16.6016          ?        ?      191.3        4.3       ?       ? 
1 1 1   35   10   45 o    361.1    2.8    0.0000   0.0000          ?        ?  1304.4998  20.4327          ?        ?      361.1        2.8       ?       ? 
1 1 1   35   10   46 o    214.0    4.0    0.0000   0.0000          ?        ?   458.4586  17.2401          ?        ?      214.0        4.0       ?       ? 
1 1 1   35   10   47 f    202.5    4.3    0.0000   0.0000          ?        ?   410.5694  17.2401          ?        ?      202.5        4.3       ?       ? 
1 1 1   35   10   48 o     67.1   13.8    0.0000   0.0000          ?        ?    47.2506  17.8786          ?        ?       67.1       13.8       ?       ? 
1 1 1   35   10   49 o    218.4    4.2    0.0000   0.0000          ?        ?   477.6142  18.5171          ?        ?      218.4        4.2       ?       ? 
1 1 1   35   10   50 o    213.5    4.3    0.0000   0.0000          ?        ?   456.5430  18.5171          ?        ?      213.5        4.3       ?       ? 
1 1 1   35   10   51 f    302.1    3.3    0.0000   0.0000          ?        ?   913.0859  19.7942          ?        ?      302.1        3.3       ?       ? 
1 1 1   35   10   52 o    147.3    6.3    0.0000   0.0000          ?        ?   217.7359  18.5171          ?        ?      147.3        6.3       ?       ? 
1 1 1   35   10   53 o     84.1   11.4    0.0000   0.0000          ?        ?    71.5144  19.1556          ?        ?       84.1       11.4       ?       ? 
1 1 1   35   10   54 o    169.3    5.7    0.0000   0.0000          ?        ?   287.3347  19.1556          ?        ?      169.3        5.7       ?       ? 
1 1 1   35   10   55 o    367.3    3.1    0.0000   0.0000          ?        ?  1350.4733  22.9868          ?        ?      367.3        3.1       ?       ? 
1 1 1   35   10   56 o    289.3    3.5    0.0000   0.0000          ?        ?   837.7404  20.4327          ?        ?      289.3        3.5       ?       ? 
1 1 1   35   10   57 o     97.1    9.5    0.0000   0.0000          ?        ?    95.1397  18.5171          ?        ?       97.1        9.5       ?       ? 
1 1 1   35   10   58 o     38.5   15.5    0.0000   0.0000          ?        ?     7.0237  18.5171          ?        ?       38.5       15.5       ?       ? 
1 1 1   35   10   59 o    223.6    4.7    0.0000   0.0000          ?        ?   501.2395  21.0712          ?        ?      223.6        4.7       ?       ? 
1 1 1   35   10   60 o     28.3   13.3    0.0000   0.0000          ?        ?   -21.7097  19.7942          ?        ?       28.3       13.3       ?       ? 
1 1 1   35   10   61 o    107.4    9.5    0.0000   0.0000          ?        ?   116.8494  20.4327          ?        ?      107.4        9.5       ?       ? 
1 1 1   35   10   62 o     66.8   15.2    0.0000   0.0000          ?        ?    47.8891  19.7942          ?        ?       66.8       15.2       ?       ? 
1 1 1   35   10   63 o     24.2   11.9    0.0000   0.0000          ?        ?   -42.1424  20.4327          ?        ?       24.2       11.9       ?       ? 
1 1 1   35   10   64 o    117.4    8.7    0.0000   0.0000          ?        ?   139.8362  20.4327          ?        ?      117.4        8.7       ?       ? 
1 1 1   35   10   65 o     38.2   15.7    0.0000   0.0000          ?        ?     6.3852  19.1556          ?        ?       38.2       15.7       ?       ? 
1 1 1   35   11    0 o    184.0    3.8  339.0550  14.0475   339.0550  14.0475   339.0550  14.0475      184.0      3.8      184.0        3.8     0.0     0.0 
1 1 1   35   11    1 o    513.9    2.7    0.0000   0.0000          ?        ?  2640.9255  27.4564          ?        ?      513.9        2.7       ?       ? 
1 1 1   35   11    2 f    912.0    3.5    0.0000   0.0000          ?        ?  8318.6602  63.8522          ?        ?      912.0        3.5       ?       ? 
1 1 1   35   11    3 o    674.0    2.9    0.0000   0.0000          ?        ?  4543.7197  39.5883          ?        ?      674.0        2.9       ?       ? 
1 1 1   35   11    4 o    277.8    2.5    0.0000   0.0000          ?        ?   771.9727  14.0475          ?        ?      277.8        2.5       ?       ? 
1 1 1   35   11    5 o   1082.1    4.1    0.0000   0.0000          ?        ? 11711.1250  88.1160          ?        ?     1082.1        4.1       ?       ? 
1 1 1   35   11    6 o    784.8    3.3    0.0000   0.0000          ?        ?  6160.4565  51.0817          ?        ?      784.8        3.3       ?       ? 
1 1 1   35   11    7 o    924.7    3.7    0.0000   0.0000          ?        ?  8552.9971  68.9603          ?        ?      924.7        3.7       ?       ? 
1 1 1   35   11    8 o    582.8    2.7    0.0000   0.0000          ?        ?  3396.9351  31.9261          ?        ?      582.8        2.7       ?       ? 
1 1 1   35   11    9 o    788.4    3.1    0.0000   0.0000          ?        ?  6216.6465  49.1662          ?        ?      788.4        3.1       ?       ? 
1 1 1   35   11   10 o    280.1    2.5    0.0000   0.0000          ?        ?   784.7431  14.0475          ?        ?      280.1        2.5       ?       ? 
1 1 1   35   11   11 o    643.4    2.9    0.0000   0.0000          ?        ?  4139.5356  37.0343          ?        ?      643.4        2.9       ?       ? 
1 1 1   35   11   12 o    626.3    2.8    0.0000   0.0000          ?        ?  3923.0771  35.1187          ?        ?      626.3        2.8       ?       ? 
1 1 1   35   11   13 o    615.4    2.7    0.0000   0.0000          ?        ?  3787.7104  33.8416          ?        ?      615.4        2.7       ?       ? 
1 1 1   35   11   14 o    464.6    2.5    0.0000   0.0000          ?        ?  2158.8416  22.9868          ?        ?      464.6        2.5       ?       ? 
1 1 1   35   11   15 o    631.4    2.9    0.0000   0.0000          ?        ?  3986.9292  36.3957          ?        ?      631.4        2.9       ?       ? 
1 1 1   35   11   16 o    158.2    3.8    0.0000   0.0000          ?        ?   250.3005  12.1319          ?        ?      158.2        3.8       ?       ? 
1 1 1   35   11   17 o    257.3    2.6    0.0000   0.0000          ?        ?   662.1469  13.4090          ?        ?      257.3        2.6       ?       ? 
1 1 1   35   11   18 o    140.9    4.1    0.0000   0.0000          ?        ?   198.5802  11.4934          ?        ?      140.9        4.1       ?       ? 
1 1 1   35   11   19 o    509.8    2.5    0.0000   0.0000          ?        ?  2598.7830  25.5409          ?        ?      509.8        2.5       ?       ? 
1 1 1   35   11   20 o    507.4    2.4    0.0000   0.0000          ?        ?  2575.1577  24.2638          ?        ?      507.4        2.4       ?       ? 
1 1 1   35   11   21 o    378.1    2.4    0.0000   0.0000          ?        ?  1429.6499  18.5171          ?        ?      378.1        2.4       ?       ? 
1 1 1   35   11   22 f    610.8    2.7    0.0000   0.0000          ?        ?  3731.5205  32.5646          ?        ?      610.8        2.7       ?       ? 
1 1 1   35   11   23 o     39.2   13.5    0.0000   0.0000          ?        ?    14.0475  12.7704          ?        ?       39.2       13.5       ?       ? 
1 1 1   35   11   24 o    517.3    2.5    0.0000   0.0000          ?        ?  2676.6826  25.5409          ?        ?      517.3        2.5       ?       ? 
1 1 1   35   11   25 o    393.3    2.4    0.0000   0.0000          ?        ?  1547.1379  19.1556          ?        ?      393.3        2.4       ?       ? 
1 1 1   35   11   26 o    969.4    3.5    0.0000   0.0000          ?        ?  9400.3154  68.3218          ?        ?      969.4        3.5       ?       ? 
1 1 1   35   11   27 o    325.4    2.6    0.0000   0.0000          ?        ?  1059.3074  16.6016          ?        ?      325.4        2.6       ?       ? 
1 1 1   35   11   28 f    408.6    2.6    0.0000   0.0000          ?        ?  1669.7340  21.0712          ?        ?      408.6        2.6       ?       ? 
1 1 1   35   11   29 o    334.4    2.6    0.0000   0.0000          ?        ?  1118.6898  17.2401          ?        ?      334.4        2.6       ?       ? 
1 1 1   35   11   30 o    287.1    2.7    0.0000   0.0000          ?        ?   824.3315  15.3245          ?        ?      287.1        2.7       ?       ? 
1 1 1   35   11   31 f    541.3    2.6    0.0000   0.0000          ?        ?  2930.8142  28.0950          ?        ?      541.3        2.6       ?       ? 
1 1 1   35   11   32 o    250.2    3.1    0.0000   0.0000          ?        ?   626.3897  15.3245          ?        ?      250.2        3.1       ?       ? 
1 1 1   35   11   33 o    230.6    3.3    0.0000   0.0000          ?        ?   531.8885  15.3245          ?        ?      230.6        3.3       ?       ? 
1 1 1   35   11   34 f    555.7    2.6    0.0000   0.0000          ?        ?  3089.1675  28.7335          ?        ?      555.7        2.6       ?       ? 
1 1 1   35   11   35 o    316.9    2.8    0.0000   0.0000          ?        ?  1004.3945  17.8786          ?        ?      316.9        2.8       ?       ? 
1 1 1   35   11   36 o    225.1    3.4    0.0000   0.0000          ?        ?   506.9862  15.3245          ?        ?      225.1        3.4       ?       ? 
1 1 1   35   11   37 f    458.1    2.6    0.0000   0.0000          ?        ?  2098.8206  23.6253          ?        ?      458.1        2.6       ?       ? 
1 1 1   35   11   38 o    498.2    2.5    0.0000   0.0000          ?        ?  2482.5720  24.9023          ?        ?      498.2        2.5       ?       ? 
1 1 1   35   11   39 o    180.9    4.2    0.0000   0.0000          ?        ?   327.5616  15.3245          ?        ?      180.9        4.2       ?       ? 
1 1 1   35   11   40 o    299.5    3.0    0.0000   0.0000          ?        ?   897.1229  17.8786          ?        ?      299.5        3.0       ?       ? 
1 1 1   35   11   41 f    400.4    2.7    0.0000   0.0000          ?        ?  1603.9663  21.7097          ?        ?      400.4        2.7       ?       ? 
1 1 1   35   11   42 f    156.3    5.3    0.0000   0.0000          ?        ?   244.5538  16.6016          ?        ?      156.3        5.3       ?       ? 
1 1 1   35   11   43 o    142.6    5.8    0.0000   0.0000          ?        ?   203.6884  16.6016          ?        ?      142.6        5.8       ?       ? 
1 1 1   35   11   44 o     20.2   10.1    0.0000   0.0000          ?        ?   -44.0580  16.6016          ?        ?       20.2       10.1       ?       ? 
1 1 1   35   11   45 o    181.4    4.8    0.0000   0.0000          ?        ?   329.4771  17.2401          ?        ?      181.4        4.8       ?       ? 
1 1 1   35   11   46 o    742.2    3.0    0.0000   0.0000          ?        ?  5511.0801  44.0580          ?        ?      742.2        3.0       ?       ? 
1 1 1   35   11   47 o    349.0    2.9    0.0000   0.0000          ?        ?  1218.2993  20.4327          ?        ?      349.0        2.9       ?       ? 
1 1 1   35   11   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   11   49 o    193.6    4.6    0.0000   0.0000          ?        ?   375.4507  17.8786          ?        ?      193.6        4.6       ?       ? 
1 1 1   35   11   50 o    418.2    2.8    0.0000   0.0000          ?        ?  1750.1879  23.6253          ?        ?      418.2        2.8       ?       ? 
1 1 1   35   11   51 o     27.1   12.8    0.0000   0.0000          ?        ?   -21.7097  18.5171          ?        ?       27.1       12.8       ?       ? 
1 1 1   35   11   52 o    406.4    2.8    0.0000   0.0000          ?        ?  1652.4939  22.9868          ?        ?      406.4        2.8       ?       ? 
1 1 1   35   11   53 o     47.2   16.5    0.0000   0.0000          ?        ?    20.4327  19.1556          ?        ?       47.2       16.5       ?       ? 
1 1 1   35   11   54 o    244.1    3.8    0.0000   0.0000          ?        ?   596.3792  18.5171          ?        ?      244.1        3.8       ?       ? 
1 1 1   35   11   55 o     36.9   15.3    0.0000   0.0000          ?        ?     3.8311  18.5171          ?        ?       36.9       15.3       ?       ? 
1 1 1   35   11   56 o     45.0   16.6    0.0000   0.0000          ?        ?    16.6016  19.7942          ?        ?       45.0       16.6       ?       ? 
1 1 1   35   11   57 o    131.6    7.5    0.0000   0.0000          ?        ?   174.3164  19.7942          ?        ?      131.6        7.5       ?       ? 
1 1 1   35   11   58 f    148.5    6.7    0.0000   0.0000          ?        ?   221.5670  19.7942          ?        ?      148.5        6.7       ?       ? 
1 1 1   35   11   59 o     26.4   12.7    0.0000   0.0000          ?        ?   -31.9261  20.4327          ?        ?       26.4       12.7       ?       ? 
1 1 1   35   11   60 o    190.3    5.2    0.0000   0.0000          ?        ?   363.3188  19.7942          ?        ?      190.3        5.2       ?       ? 
1 1 1   35   11   61 o     26.3   12.6    0.0000   0.0000          ?        ?   -24.2638  18.5171          ?        ?       26.3       12.6       ?       ? 
1 1 1   35   11   62 o     42.4   16.6    0.0000   0.0000          ?        ?    12.1319  20.4327          ?        ?       42.4       16.6       ?       ? 
1 1 1   35   11   63 o    162.2    6.3    0.0000   0.0000          ?        ?   264.9865  20.4327          ?        ?      162.2        6.3       ?       ? 
1 1 1   35   11   64 o     27.9   13.3    0.0000   0.0000          ?        ?   -24.9023  20.4327          ?        ?       27.9       13.3       ?       ? 
1 1 1   35   12    0 o    116.5    6.9  137.2822  15.9630   137.2822  15.9630   137.2822  15.9630      116.5      6.9      116.5        6.9     0.0     0.0 
1 1 1   35   12    1 o     97.2    4.9    0.0000   0.0000          ?        ?    94.5012   9.5778          ?        ?       97.2        4.9       ?       ? 
1 1 1   35   12    2 f    531.3    2.5    0.0000   0.0000          ?        ?  2822.9041  26.1794          ?        ?      531.3        2.5       ?       ? 
1 1 1   35   12    3 o    344.1    2.3    0.0000   0.0000          ?        ?  1184.4576  15.9630          ?        ?      344.1        2.3       ?       ? 
1 1 1   35   12    4 o    954.4    3.5    0.0000   0.0000          ?        ?  9110.4268  67.6833          ?        ?      954.4        3.5       ?       ? 
1 1 1   35   12    5 o    543.3    2.6    0.0000   0.0000          ?        ?  2951.8855  28.7335          ?        ?      543.3        2.6       ?       ? 
1 1 1   35   12    6 o    347.9    2.3    0.0000   0.0000          ?        ?  1210.6371  15.9630          ?        ?      347.9        2.3       ?       ? 
1 1 1   35   12    7 o    691.2    3.0    0.0000   0.0000          ?        ?  4778.6958  41.5039          ?        ?      691.2        3.0       ?       ? 
1 1 1   35   12    8 o   1029.0    4.1    0.0000   0.0000          ?        ? 10591.7969  83.6463          ?        ?     1029.0        4.1       ?       ? 
1 1 1   35   12    9 o    868.7    3.6    0.0000   0.0000          ?        ?  7547.3257  61.9366          ?        ?      868.7        3.6       ?       ? 
1 1 1   35   12   10 o    386.6    2.4    0.0000   0.0000          ?        ?  1494.7792  18.5171          ?        ?      386.6        2.4       ?       ? 
1 1 1   35   12   11 o    987.0    3.8    0.0000   0.0000          ?        ?  9743.2012  75.3456          ?        ?      987.0        3.8       ?       ? 
1 1 1   35   12   12 o    833.2    3.5    0.0000   0.0000          ?        ?  6943.9229  58.1055          ?        ?      833.2        3.5       ?       ? 
1 1 1   35   12   13 o    344.0    2.5    0.0000   0.0000          ?        ?  1183.1805  17.2401          ?        ?      344.0        2.5       ?       ? 
1 1 1   35   12   14 o    154.1    3.7    0.0000   0.0000          ?        ?   237.5300  11.4934          ?        ?      154.1        3.7       ?       ? 
1 1 1   35   12   15 o    104.2    5.5    0.0000   0.0000          ?        ?   108.5487  11.4934          ?        ?      104.2        5.5       ?       ? 
1 1 1   35   12   16 o    662.8    2.8    0.0000   0.0000          ?        ?  4393.6670  37.0343          ?        ?      662.8        2.8       ?       ? 
1 1 1   35   12   17 o    416.3    2.4    0.0000   0.0000          ?        ?  1732.9476  19.7942          ?        ?      416.3        2.4       ?       ? 
1 1 1   35   12   18 o    421.4    2.3    0.0000   0.0000          ?        ?  1775.7286  19.7942          ?        ?      421.4        2.3       ?       ? 
1 1 1   35   12   19 o     20.2    9.7    0.0000   0.0000          ?        ?   -17.2401  11.4934          ?        ?       20.2        9.7       ?       ? 
1 1 1   35   12   20 o    728.5    2.9    0.0000   0.0000          ?        ?  5308.6689  42.7809          ?        ?      728.5        2.9       ?       ? 
1 1 1   35   12   21 o    305.2    2.7    0.0000   0.0000          ?        ?   931.6030  16.6016          ?        ?      305.2        2.7       ?       ? 
1 1 1   35   12   22 o    762.4    2.9    0.0000   0.0000          ?        ?  5813.1011  44.6965          ?        ?      762.4        2.9       ?       ? 
1 1 1   35   12   23 o    750.8    3.0    0.0000   0.0000          ?        ?  5638.7842  44.6965          ?        ?      750.8        3.0       ?       ? 
1 1 1   35   12   24 o    105.1    6.1    0.0000   0.0000          ?        ?   110.4642  12.7704          ?        ?      105.1        6.1       ?       ? 
1 1 1   35   12   25 o    174.3    3.8    0.0000   0.0000          ?        ?   303.9363  13.4090          ?        ?      174.3        3.8       ?       ? 
1 1 1   35   12   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   12   27 o    763.3    3.1    0.0000   0.0000          ?        ?  5827.1484  46.6121          ?        ?      763.3        3.1       ?       ? 
1 1 1   35   12   28 o    312.0    2.7    0.0000   0.0000          ?        ?   973.7455  16.6016          ?        ?      312.0        2.7       ?       ? 
1 1 1   35   12   29 o    298.4    2.8    0.0000   0.0000          ?        ?   890.7377  16.6016          ?        ?      298.4        2.8       ?       ? 
1 1 1   35   12   30 o    447.6    2.5    0.0000   0.0000          ?        ?  2003.6808  22.3483          ?        ?      447.6        2.5       ?       ? 
1 1 1   35   12   31 o    501.6    2.5    0.0000   0.0000          ?        ?  2516.4138  25.5409          ?        ?      501.6        2.5       ?       ? 
1 1 1   35   12   32 o    264.4    3.0    0.0000   0.0000          ?        ?   699.1812  15.9630          ?        ?      264.4        3.0       ?       ? 
1 1 1   35   12   33 o    466.2    2.5    0.0000   0.0000          ?        ?  2173.5276  22.9868          ?        ?      466.2        2.5       ?       ? 
1 1 1   35   12   34 o    456.5    2.6    0.0000   0.0000          ?        ?  2084.7732  23.6253          ?        ?      456.5        2.6       ?       ? 
1 1 1   35   12   35 o    101.0    7.0    0.0000   0.0000          ?        ?   102.1635  14.0475          ?        ?      101.0        7.0       ?       ? 
1 1 1   35   12   36 f    368.7    2.7    0.0000   0.0000          ?        ?  1359.4125  19.7942          ?        ?      368.7        2.7       ?       ? 
1 1 1   35   12   37 o    484.7    2.6    0.0000   0.0000          ?        ?  2350.3982  24.9023          ?        ?      484.7        2.6       ?       ? 
1 1 1   35   12   38 o    415.0    2.5    0.0000   0.0000          ?        ?  1722.7313  20.4327          ?        ?      415.0        2.5       ?       ? 
1 1 1   35   12   39 o    405.5    2.6    0.0000   0.0000          ?        ?  1644.8318  21.0712          ?        ?      405.5        2.6       ?       ? 
1 1 1   35   12   40 o    394.8    2.7    0.0000   0.0000          ?        ?  1559.2698  21.7097          ?        ?      394.8        2.7       ?       ? 
1 1 1   35   12   41 o    141.9    5.6    0.0000   0.0000          ?        ?   201.7728  15.9630          ?        ?      141.9        5.6       ?       ? 
1 1 1   35   12   42 o    282.8    3.2    0.0000   0.0000          ?        ?   800.0676  17.8786          ?        ?      282.8        3.2       ?       ? 
1 1 1   35   12   43 o     47.6   14.7    0.0000   0.0000          ?        ?    22.9868  15.3245          ?        ?       47.6       14.7       ?       ? 
1 1 1   35   12   44 o    409.9    2.6    0.0000   0.0000          ?        ?  1680.5890  21.7097          ?        ?      409.9        2.6       ?       ? 
1 1 1   35   12   45 o    349.6    2.8    0.0000   0.0000          ?        ?  1222.7689  19.7942          ?        ?      349.6        2.8       ?       ? 
1 1 1   35   12   46 o    383.6    2.9    0.0000   0.0000          ?        ?  1472.4309  22.3483          ?        ?      383.6        2.9       ?       ? 
1 1 1   35   12   47 o     53.8   15.7    0.0000   0.0000          ?        ?    30.0105  17.8786          ?        ?       53.8       15.7       ?       ? 
1 1 1   35   12   48 o    329.0    2.9    0.0000   0.0000          ?        ?  1082.9327  19.1556          ?        ?      329.0        2.9       ?       ? 
1 1 1   35   12   49 o    120.7    7.1    0.0000   0.0000          ?        ?   146.2215  17.2401          ?        ?      120.7        7.1       ?       ? 
1 1 1   35   12   50 o     21.7   10.7    0.0000   0.0000          ?        ?   -39.5883  17.2401          ?        ?       21.7       10.7       ?       ? 
1 1 1   35   12   51 o    133.5    6.9    0.0000   0.0000          ?        ?   178.7861  18.5171          ?        ?      133.5        6.9       ?       ? 
1 1 1   35   12   52 o     31.8   14.0    0.0000   0.0000          ?        ?    -4.4697  17.2401          ?        ?       31.8       14.0       ?       ? 
1 1 1   35   12   53 o    152.0    5.9    0.0000   0.0000          ?        ?   231.7833  17.8786          ?        ?      152.0        5.9       ?       ? 
1 1 1   35   12   54 o     99.4    9.3    0.0000   0.0000          ?        ?    99.6094  18.5171          ?        ?       99.4        9.3       ?       ? 
1 1 1   35   12   55 o    247.1    3.9    0.0000   0.0000          ?        ?   611.7037  19.1556          ?        ?      247.1        3.9       ?       ? 
1 1 1   35   12   56 o     21.0   10.6    0.0000   0.0000          ?        ?   -59.3825  19.7942          ?        ?       21.0       10.6       ?       ? 
1 1 1   35   12   57 o    218.4    4.4    0.0000   0.0000          ?        ?   478.2527  19.1556          ?        ?      218.4        4.4       ?       ? 
1 1 1   35   12   58 o    186.2    5.3    0.0000   0.0000          ?        ?   347.9943  19.7942          ?        ?      186.2        5.3       ?       ? 
1 1 1   35   12   59 o    343.8    3.2    0.0000   0.0000          ?        ?  1183.8191  22.3483          ?        ?      343.8        3.2       ?       ? 
1 1 1   35   12   60 o     48.1   16.5    0.0000   0.0000          ?        ?    22.3483  19.1556          ?        ?       48.1       16.5       ?       ? 
1 1 1   35   12   61 o     98.3   10.4    0.0000   0.0000          ?        ?    98.3323  20.4327          ?        ?       98.3       10.4       ?       ? 
1 1 1   35   12   62 o    182.1    5.4    0.0000   0.0000          ?        ?   333.3083  19.7942          ?        ?      182.1        5.4       ?       ? 
1 1 1   35   12   63 o     95.2   10.4    0.0000   0.0000          ?        ?    92.5856  19.7942          ?        ?       95.2       10.4       ?       ? 
1 1 1   35   13    0 o   1076.6    6.8 11596.8291 145.5829 11596.8291 145.5829 11596.8291 145.5829     1076.6      6.8     1076.6        6.8     0.0     0.0 
1 1 1   35   13    1 o    655.8    3.1    0.0000   0.0000          ?        ?  4301.0815  40.8654          ?        ?      655.8        3.1       ?       ? 
1 1 1   35   13    2 o     60.3   11.5    0.0000   0.0000          ?        ?    37.6728  13.4090          ?        ?       60.3       11.5       ?       ? 
1 1 1   35   13    3 o    591.9    2.9    0.0000   0.0000          ?        ?  3504.2065  33.8416          ?        ?      591.9        2.9       ?       ? 
1 1 1   35   13    4 o    406.9    2.8    0.0000   0.0000          ?        ?  1655.6865  22.9868          ?        ?      406.9        2.8       ?       ? 
1 1 1   35   13    5 o    947.3    3.8    0.0000   0.0000          ?        ?  8976.3369  72.7915          ?        ?      947.3        3.8       ?       ? 
1 1 1   35   13    6 o    807.2    3.2    0.0000   0.0000          ?        ?  6516.1133  51.7203          ?        ?      807.2        3.2       ?       ? 
1 1 1   35   13    7 o    313.8    2.3    0.0000   0.0000          ?        ?   984.6003  14.6860          ?        ?      313.8        2.3       ?       ? 
1 1 1   35   13    8 f    131.5    3.9    0.0000   0.0000          ?        ?   173.0394  10.2163          ?        ?      131.5        3.9       ?       ? 
1 1 1   35   13    9 o    266.1    2.5    0.0000   0.0000          ?        ?   708.1205  13.4090          ?        ?      266.1        2.5       ?       ? 
1 1 1   35   13   10 o     57.6    9.4    0.0000   0.0000          ?        ?    33.2031  10.8549          ?        ?       57.6        9.4       ?       ? 
1 1 1   35   13   11 o    473.6    2.7    0.0000   0.0000          ?        ?  2243.1265  25.5409          ?        ?      473.6        2.7       ?       ? 
1 1 1   35   13   12 o    381.4    2.7    0.0000   0.0000          ?        ?  1455.1908  20.4327          ?        ?      381.4        2.7       ?       ? 
1 1 1   35   13   13 o   1060.3    3.9    0.0000   0.0000          ?        ? 11244.3662  81.7308          ?        ?     1060.3        3.9       ?       ? 
1 1 1   35   13   14 o    222.6    2.7    0.0000   0.0000          ?        ?   495.4928  12.1319          ?        ?      222.6        2.7       ?       ? 
1 1 1   35   13   15 o    414.7    2.3    0.0000   0.0000          ?        ?  1720.1772  19.1556          ?        ?      414.7        2.3       ?       ? 
1 1 1   35   13   16 o    457.8    2.4    0.0000   0.0000          ?        ?  2096.2664  21.7097          ?        ?      457.8        2.4       ?       ? 
1 1 1   35   13   17 o    509.1    2.4    0.0000   0.0000          ?        ?  2591.7593  24.9023          ?        ?      509.1        2.4       ?       ? 
1 1 1   35   13   18 o    748.6    3.0    0.0000   0.0000          ?        ?  5604.9429  44.6965          ?        ?      748.6        3.0       ?       ? 
1 1 1   35   13   19 o    718.9    2.9    0.0000   0.0000          ?        ?  5168.8325  42.1424          ?        ?      718.9        2.9       ?       ? 
1 1 1   35   13   20 o    516.3    2.5    0.0000   0.0000          ?        ?  2666.4663  25.5409          ?        ?      516.3        2.5       ?       ? 
1 1 1   35   13   21 o    380.4    2.3    0.0000   0.0000          ?        ?  1447.5286  17.8786          ?        ?      380.4        2.3       ?       ? 
1 1 1   35   13   22 o    306.1    2.6    0.0000   0.0000          ?        ?   937.3498  15.9630          ?        ?      306.1        2.6       ?       ? 
1 1 1   35   13   23 o    261.4    2.8    0.0000   0.0000          ?        ?   683.2181  14.6860          ?        ?      261.4        2.8       ?       ? 
1 1 1   35   13   24 o    307.4    2.6    0.0000   0.0000          ?        ?   945.0120  15.9630          ?        ?      307.4        2.6       ?       ? 
1 1 1   35   13   25 o    336.9    2.5    0.0000   0.0000          ?        ?  1135.2915  16.6016          ?        ?      336.9        2.5       ?       ? 
1 1 1   35   13   26 o    193.4    3.5    0.0000   0.0000          ?        ?   374.1737  13.4090          ?        ?      193.4        3.5       ?       ? 
1 1 1   35   13   27 o    650.8    2.7    0.0000   0.0000          ?        ?  4235.9526  35.7572          ?        ?      650.8        2.7       ?       ? 
1 1 1   35   13   28 o    291.6    2.6    0.0000   0.0000          ?        ?   850.5108  15.3245          ?        ?      291.6        2.6       ?       ? 
1 1 1   35   13   29 o    108.9    6.4    0.0000   0.0000          ?        ?   118.7650  14.0475          ?        ?      108.9        6.4       ?       ? 
1 1 1   35   13   30 o    134.8    5.0    0.0000   0.0000          ?        ?   181.9787  13.4090          ?        ?      134.8        5.0       ?       ? 
1 1 1   35   13   31 o    365.3    2.5    0.0000   0.0000          ?        ?  1334.5103  18.5171          ?        ?      365.3        2.5       ?       ? 
1 1 1   35   13   32 o    174.3    4.4    0.0000   0.0000          ?        ?   303.9363  15.3245          ?        ?      174.3        4.4       ?       ? 
1 1 1   35   13   33 o    140.9    5.0    0.0000   0.0000          ?        ?   198.5802  14.0475          ?        ?      140.9        5.0       ?       ? 
1 1 1   35   13   34 o     74.8    9.4    0.0000   0.0000          ?        ?    56.1899  14.0475          ?        ?       74.8        9.4       ?       ? 
1 1 1   35   13   35 o    198.8    3.9    0.0000   0.0000          ?        ?   395.2449  15.3245          ?        ?      198.8        3.9       ?       ? 
1 1 1   35   13   36 o    289.9    3.0    0.0000   0.0000          ?        ?   840.9330  17.2401          ?        ?      289.9        3.0       ?       ? 
1 1 1   35   13   37 o    367.4    2.4    0.0000   0.0000          ?        ?  1349.8347  17.8786          ?        ?      367.4        2.4       ?       ? 
1 1 1   35   13   38 o    314.7    2.7    0.0000   0.0000          ?        ?   990.9855  17.2401          ?        ?      314.7        2.7       ?       ? 
1 1 1   35   13   39 o    192.7    4.0    0.0000   0.0000          ?        ?   371.6196  15.3245          ?        ?      192.7        4.0       ?       ? 
1 1 1   35   13   40 o    332.1    2.8    0.0000   0.0000          ?        ?  1103.3654  18.5171          ?        ?      332.1        2.8       ?       ? 
1 1 1   35   13   41 o     96.4    7.9    0.0000   0.0000          ?        ?    93.2242  15.3245          ?        ?       96.4        7.9       ?       ? 
1 1 1   35   13   42 o    172.6    4.6    0.0000   0.0000          ?        ?   298.1896  15.9630          ?        ?      172.6        4.6       ?       ? 
1 1 1   35   13   43 o     55.7   13.8    0.0000   0.0000          ?        ?    32.5646  15.3245          ?        ?       55.7       13.8       ?       ? 
1 1 1   35   13   44 o     45.8   15.1    0.0000   0.0000          ?        ?    20.4327  15.9630          ?        ?       45.8       15.1       ?       ? 
1 1 1   35   13   45 o    320.0    3.0    0.0000   0.0000          ?        ?  1024.8273  19.1556          ?        ?      320.0        3.0       ?       ? 
1 1 1   35   13   46 o     32.7   14.2    0.0000   0.0000          ?        ?    -2.5541  17.2401          ?        ?       32.7       14.2       ?       ? 
1 1 1   35   13   47 o    513.4    2.7    0.0000   0.0000          ?        ?  2637.0942  27.4564          ?        ?      513.4        2.7       ?       ? 
1 1 1   35   13   48 o    242.1    3.7    0.0000   0.0000          ?        ?   586.8014  17.8786          ?        ?      242.1        3.7       ?       ? 
1 1 1   35   13   49 o     23.4   11.4    0.0000   0.0000          ?        ?   -31.2876  17.2401          ?        ?       23.4       11.4       ?       ? 
1 1 1   35   13   50 o    304.8    3.1    0.0000   0.0000          ?        ?   929.6875  19.1556          ?        ?      304.8        3.1       ?       ? 
1 1 1   35   13   51 o    116.9    7.6    0.0000   0.0000          ?        ?   137.2822  17.8786          ?        ?      116.9        7.6       ?       ? 
1 1 1   35   13   52 o     29.7   13.5    0.0000   0.0000          ?        ?   -11.4934  17.8786          ?        ?       29.7       13.5       ?       ? 
1 1 1   35   13   53 o    168.0    5.3    0.0000   0.0000          ?        ?   282.8651  17.8786          ?        ?      168.0        5.3       ?       ? 
1 1 1   35   13   54 o    183.9    5.2    0.0000   0.0000          ?        ?   339.0550  19.1556          ?        ?      183.9        5.2       ?       ? 
1 1 1   35   13   55 o    207.4    4.6    0.0000   0.0000          ?        ?   431.0021  19.1556          ?        ?      207.4        4.6       ?       ? 
1 1 1   35   13   56 o    117.9    7.6    0.0000   0.0000          ?        ?   139.8362  17.8786          ?        ?      117.9        7.6       ?       ? 
1 1 1   35   13   57 f     86.1   11.9    0.0000   0.0000          ?        ?    75.3456  20.4327          ?        ?       86.1       11.9       ?       ? 
1 1 1   35   13   58 o    127.6    7.5    0.0000   0.0000          ?        ?   164.1001  19.1556          ?        ?      127.6        7.5       ?       ? 
1 1 1   35   13   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   13   60 o     72.2   14.2    0.0000   0.0000          ?        ?    55.5514  19.7942          ?        ?       72.2       14.2       ?       ? 
1 1 1   35   13   61 o     34.4   14.8    0.0000   0.0000          ?        ?    -0.6385  18.5171          ?        ?       34.4       14.8       ?       ? 
1 1 1   35   13   62 o    103.0    9.3    0.0000   0.0000          ?        ?   107.9102  19.1556          ?        ?      103.0        9.3       ?       ? 
1 1 1   35   13   63 o     71.1   14.0    0.0000   0.0000          ?        ?    54.2743  19.1556          ?        ?       71.1       14.0       ?       ? 
1 1 1   35   14    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   14    1 o    154.3    4.3    0.0000   0.0000          ?        ?   238.1686  13.4090          ?        ?      154.3        4.3       ?       ? 
1 1 1   35   14    2 o    283.8    2.9    0.0000   0.0000          ?        ?   805.8143  16.6016          ?        ?      283.8        2.9       ?       ? 
1 1 1   35   14    3 o    245.0    2.7    0.0000   0.0000          ?        ?   600.2103  13.4090          ?        ?      245.0        2.7       ?       ? 
1 1 1   35   14    4 o    174.9    3.7    0.0000   0.0000          ?        ?   305.8519  12.7704          ?        ?      174.9        3.7       ?       ? 
1 1 1   35   14    5 o    479.6    2.6    0.0000   0.0000          ?        ?  2299.9551  24.9023          ?        ?      479.6        2.6       ?       ? 
1 1 1   35   14    6 o    483.1    2.5    0.0000   0.0000          ?        ?  2334.4351  24.2638          ?        ?      483.1        2.5       ?       ? 
1 1 1   35   14    7 o    202.9    2.7    0.0000   0.0000          ?        ?   411.8464  10.8549          ?        ?      202.9        2.7       ?       ? 
1 1 1   35   14    8 o    256.3    2.5    0.0000   0.0000          ?        ?   657.0388  12.7704          ?        ?      256.3        2.5       ?       ? 
1 1 1   35   14    9 o    418.9    2.3    0.0000   0.0000          ?        ?  1754.6573  19.1556          ?        ?      418.9        2.3       ?       ? 
1 1 1   35   14   10 o    103.2    4.3    0.0000   0.0000          ?        ?   106.6331   8.9393          ?        ?      103.2        4.3       ?       ? 
1 1 1   35   14   11 o    225.7    2.5    0.0000   0.0000          ?        ?   509.5403  11.4934          ?        ?      225.7        2.5       ?       ? 
1 1 1   35   14   12 o    150.7    4.0    0.0000   0.0000          ?        ?   227.3137  12.1319          ?        ?      150.7        4.0       ?       ? 
1 1 1   35   14   13 o    278.7    2.4    0.0000   0.0000          ?        ?   777.0808  13.4090          ?        ?      278.7        2.4       ?       ? 
1 1 1   35   14   14 o    395.9    2.3    0.0000   0.0000          ?        ?  1567.5706  18.5171          ?        ?      395.9        2.3       ?       ? 
1 1 1   35   14   15 o    390.0    2.3    0.0000   0.0000          ?        ?  1520.9585  17.8786          ?        ?      390.0        2.3       ?       ? 
1 1 1   35   14   16 o    188.7    3.2    0.0000   0.0000          ?        ?   356.2951  12.1319          ?        ?      188.7        3.2       ?       ? 
1 1 1   35   14   17 o    217.4    2.9    0.0000   0.0000          ?        ?   472.5060  12.7704          ?        ?      217.4        2.9       ?       ? 
1 1 1   35   14   18 o    286.8    2.7    0.0000   0.0000          ?        ?   822.4159  15.3245          ?        ?      286.8        2.7       ?       ? 
1 1 1   35   14   19 o    317.6    2.5    0.0000   0.0000          ?        ?  1008.8642  15.9630          ?        ?      317.6        2.5       ?       ? 
1 1 1   35   14   20 o    464.1    2.4    0.0000   0.0000          ?        ?  2153.7334  22.3483          ?        ?      464.1        2.4       ?       ? 
1 1 1   35   14   21 o    384.7    2.3    0.0000   0.0000          ?        ?  1480.0931  17.8786          ?        ?      384.7        2.3       ?       ? 
1 1 1   35   14   22 o    665.2    2.7    0.0000   0.0000          ?        ?  4425.5933  36.3957          ?        ?      665.2        2.7       ?       ? 
1 1 1   35   14   23 o    342.2    2.4    0.0000   0.0000          ?        ?  1171.0486  16.6016          ?        ?      342.2        2.4       ?       ? 
1 1 1   35   14   24 o    403.2    2.5    0.0000   0.0000          ?        ?  1626.3146  19.7942          ?        ?      403.2        2.5       ?       ? 
1 1 1   35   14   25 o    195.7    3.3    0.0000   0.0000          ?        ?   383.1130  12.7704          ?        ?      195.7        3.3       ?       ? 
1 1 1   35   14   26 o     32.0   12.9    0.0000   0.0000          ?        ?     4.4697  12.7704          ?        ?       32.0       12.9       ?       ? 
1 1 1   35   14   27 f    320.3    2.5    0.0000   0.0000          ?        ?  1026.1042  15.9630          ?        ?      320.3        2.5       ?       ? 
1 1 1   35   14   28 o     20.1    9.9    0.0000   0.0000          ?        ?   -30.0105  14.0475          ?        ?       20.1        9.9       ?       ? 
1 1 1   35   14   29 o    606.8    2.7    0.0000   0.0000          ?        ?  3682.9927  32.5646          ?        ?      606.8        2.7       ?       ? 
1 1 1   35   14   30 o    274.7    2.9    0.0000   0.0000          ?        ?   754.7325  15.9630          ?        ?      274.7        2.9       ?       ? 
1 1 1   35   14   31 o    439.4    2.5    0.0000   0.0000          ?        ?  1930.8894  22.3483          ?        ?      439.4        2.5       ?       ? 
1 1 1   35   14   32 o    375.1    2.6    0.0000   0.0000          ?        ?  1407.3016  19.7942          ?        ?      375.1        2.6       ?       ? 
1 1 1   35   14   33 o    231.1    3.3    0.0000   0.0000          ?        ?   534.4426  15.3245          ?        ?      231.1        3.3       ?       ? 
1 1 1   35   14   34 f    196.3    3.7    0.0000   0.0000          ?        ?   385.6671  14.6860          ?        ?      196.3        3.7       ?       ? 
1 1 1   35   14   35 o    364.7    2.6    0.0000   0.0000          ?        ?  1330.6791  19.1556          ?        ?      364.7        2.6       ?       ? 
1 1 1   35   14   36 o    483.7    2.7    0.0000   0.0000          ?        ?  2340.1816  26.1794          ?        ?      483.7        2.7       ?       ? 
1 1 1   35   14   37 o    306.6    2.9    0.0000   0.0000          ?        ?   940.5424  17.8786          ?        ?      306.6        2.9       ?       ? 
1 1 1   35   14   38 o    140.8    5.2    0.0000   0.0000          ?        ?   198.5802  14.6860          ?        ?      140.8        5.2       ?       ? 
1 1 1   35   14   39 o    168.7    4.5    0.0000   0.0000          ?        ?   284.7806  15.3245          ?        ?      168.7        4.5       ?       ? 
1 1 1   35   14   40 o     82.5    9.3    0.0000   0.0000          ?        ?    68.3218  15.3245          ?        ?       82.5        9.3       ?       ? 
1 1 1   35   14   41 o    280.1    3.1    0.0000   0.0000          ?        ?   784.7431  17.2401          ?        ?      280.1        3.1       ?       ? 
1 1 1   35   14   42 o    205.3    4.0    0.0000   0.0000          ?        ?   422.0628  16.6016          ?        ?      205.3        4.0       ?       ? 
1 1 1   35   14   43 o     18.1    9.2    0.0000   0.0000          ?        ?   -53.6358  15.9630          ?        ?       18.1        9.2       ?       ? 
1 1 1   35   14   44 o    153.6    5.4    0.0000   0.0000          ?        ?   236.2530  16.6016          ?        ?      153.6        5.4       ?       ? 
1 1 1   35   14   45 o    418.7    2.7    0.0000   0.0000          ?        ?  1754.0190  22.9868          ?        ?      418.7        2.7       ?       ? 
1 1 1   35   14   46 o    284.0    3.1    0.0000   0.0000          ?        ?   807.0914  17.8786          ?        ?      284.0        3.1       ?       ? 
1 1 1   35   14   47 o    119.6    7.2    0.0000   0.0000          ?        ?   143.6674  17.2401          ?        ?      119.6        7.2       ?       ? 
1 1 1   35   14   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   14   49 o    141.2    6.3    0.0000   0.0000          ?        ?   199.8573  17.8786          ?        ?      141.2        6.3       ?       ? 
1 1 1   35   14   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   14   51 o     28.5   13.1    0.0000   0.0000          ?        ?   -12.7704  17.2401          ?        ?       28.5       13.1       ?       ? 
1 1 1   35   14   52 o    197.1    5.0    0.0000   0.0000          ?        ?   389.4982  19.7942          ?        ?      197.1        5.0       ?       ? 
1 1 1   35   14   53 o    325.8    3.2    0.0000   0.0000          ?        ?  1062.5000  21.0712          ?        ?      325.8        3.2       ?       ? 
1 1 1   35   14   54 o     94.4   10.1    0.0000   0.0000          ?        ?    90.0316  19.1556          ?        ?       94.4       10.1       ?       ? 
1 1 1   35   14   55 o    191.7    5.0    0.0000   0.0000          ?        ?   368.4270  19.1556          ?        ?      191.7        5.0       ?       ? 
1 1 1   35   14   56 o    109.6    8.7    0.0000   0.0000          ?        ?   121.3191  19.1556          ?        ?      109.6        8.7       ?       ? 
1 1 1   35   14   57 o    206.9    4.6    0.0000   0.0000          ?        ?   429.0865  19.1556          ?        ?      206.9        4.6       ?       ? 
1 1 1   35   14   58 o    103.6    9.2    0.0000   0.0000          ?        ?   108.5487  19.1556          ?        ?      103.6        9.2       ?       ? 
1 1 1   35   14   59 o    180.3    5.8    0.0000   0.0000          ?        ?   326.9231  21.0712          ?        ?      180.3        5.8       ?       ? 
1 1 1   35   14   60 o    196.9    5.2    0.0000   0.0000          ?        ?   389.4982  20.4327          ?        ?      196.9        5.2       ?       ? 
1 1 1   35   14   61 o     50.7   16.8    0.0000   0.0000          ?        ?    26.1794  19.7942          ?        ?       50.7       16.8       ?       ? 
1 1 1   35   14   62 o    252.7    3.9    0.0000   0.0000          ?        ?   640.4372  19.7942          ?        ?      252.7        3.9       ?       ? 
1 1 1   35   15    0 o    610.8    4.5 3731.5205  55.5514  3731.5205  55.5514  3731.5205  55.5514      610.8      4.5      610.8        4.5     0.0     0.0 
1 1 1   35   15    1 o    314.1    2.8    0.0000   0.0000          ?        ?   986.5159  17.8786          ?        ?      314.1        2.8       ?       ? 
1 1 1   35   15    2 o    615.2    3.1    0.0000   0.0000          ?        ?  3785.7949  38.3113          ?        ?      615.2        3.1       ?       ? 
1 1 1   35   15    3 o    461.1    2.8    0.0000   0.0000          ?        ?  2126.2771  25.5409          ?        ?      461.1        2.8       ?       ? 
1 1 1   35   15    4 o    589.2    2.9    0.0000   0.0000          ?        ?  3472.2805  34.4802          ?        ?      589.2        2.9       ?       ? 
1 1 1   35   15    5 o    329.4    2.5    0.0000   0.0000          ?        ?  1084.8481  16.6016          ?        ?      329.4        2.5       ?       ? 
1 1 1   35   15    6 o    429.7    2.5    0.0000   0.0000          ?        ?  1846.6046  21.0712          ?        ?      429.7        2.5       ?       ? 
1 1 1   35   15    7 o    147.5    3.7    0.0000   0.0000          ?        ?   217.7359  10.8549          ?        ?      147.5        3.7       ?       ? 
1 1 1   35   15    8 o    455.8    2.5    0.0000   0.0000          ?        ?  2077.7493  22.9868          ?        ?      455.8        2.5       ?       ? 
1 1 1   35   15    9 o    177.0    2.9    0.0000   0.0000          ?        ?   313.5141  10.2163          ?        ?      177.0        2.9       ?       ? 
1 1 1   35   15   10 o    655.7    3.0    0.0000   0.0000          ?        ?  4300.4434  38.9498          ?        ?      655.7        3.0       ?       ? 
1 1 1   35   15   11 o    342.9    2.4    0.0000   0.0000          ?        ?  1176.1569  16.6016          ?        ?      342.9        2.4       ?       ? 
1 1 1   35   15   12 o    809.9    3.1    0.0000   0.0000          ?        ?  6561.4482  49.8047          ?        ?      809.9        3.1       ?       ? 
1 1 1   35   15   13 f    122.7    4.4    0.0000   0.0000          ?        ?   150.6911  10.8549          ?        ?      122.7        4.4       ?       ? 
1 1 1   35   15   14 o    297.9    2.4    0.0000   0.0000          ?        ?   887.5450  14.0475          ?        ?      297.9        2.4       ?       ? 
1 1 1   35   15   15 o    280.7    2.5    0.0000   0.0000          ?        ?   787.9357  14.0475          ?        ?      280.7        2.5       ?       ? 
1 1 1   35   15   16 o    442.7    2.5    0.0000   0.0000          ?        ?  1960.2614  21.7097          ?        ?      442.7        2.5       ?       ? 
1 1 1   35   15   17 o    560.9    2.6    0.0000   0.0000          ?        ?  3146.6345  28.7335          ?        ?      560.9        2.6       ?       ? 
1 1 1   35   15   18 o    369.3    2.3    0.0000   0.0000          ?        ?  1363.8822  17.2401          ?        ?      369.3        2.3       ?       ? 
1 1 1   35   15   19 o    410.2    2.3    0.0000   0.0000          ?        ?  1682.5045  19.1556          ?        ?      410.2        2.3       ?       ? 
1 1 1   35   15   20 o    254.4    2.8    0.0000   0.0000          ?        ?   647.4609  14.0475          ?        ?      254.4        2.8       ?       ? 
1 1 1   35   15   21 o    435.3    2.3    0.0000   0.0000          ?        ?  1895.1321  20.4327          ?        ?      435.3        2.3       ?       ? 
1 1 1   35   15   22 o    267.0    2.6    0.0000   0.0000          ?        ?   713.2286  14.0475          ?        ?      267.0        2.6       ?       ? 
1 1 1   35   15   23 o    106.3    5.4    0.0000   0.0000          ?        ?   113.0183  11.4934          ?        ?      106.3        5.4       ?       ? 
1 1 1   35   15   24 o     83.0    7.7    0.0000   0.0000          ?        ?    68.9603  12.7704          ?        ?       83.0        7.7       ?       ? 
1 1 1   35   15   25 o    277.8    2.8    0.0000   0.0000          ?        ?   771.9727  15.3245          ?        ?      277.8        2.8       ?       ? 
1 1 1   35   15   26 o    557.4    2.6    0.0000   0.0000          ?        ?  3107.0464  28.7335          ?        ?      557.4        2.6       ?       ? 
1 1 1   35   15   27 o    187.7    3.6    0.0000   0.0000          ?        ?   352.4639  13.4090          ?        ?      187.7        3.6       ?       ? 
1 1 1   35   15   28 o    437.2    2.6    0.0000   0.0000          ?        ?  1911.7338  22.3483          ?        ?      437.2        2.6       ?       ? 
1 1 1   35   15   29 o    135.5    5.2    0.0000   0.0000          ?        ?   183.8942  14.0475          ?        ?      135.5        5.2       ?       ? 
1 1 1   35   15   30 o    244.6    3.1    0.0000   0.0000          ?        ?   598.2947  15.3245          ?        ?      244.6        3.1       ?       ? 
1 1 1   35   15   31 o    469.2    2.5    0.0000   0.0000          ?        ?  2201.6226  23.6253          ?        ?      469.2        2.5       ?       ? 
1 1 1   35   15   32 o     93.8    7.8    0.0000   0.0000          ?        ?    88.1160  14.6860          ?        ?       93.8        7.8       ?       ? 
1 1 1   35   15   33 o     93.1    7.5    0.0000   0.0000          ?        ?    86.8389  14.0475          ?        ?       93.1        7.5       ?       ? 
1 1 1   35   15   34 o    301.6    2.8    0.0000   0.0000          ?        ?   909.8933  16.6016          ?        ?      301.6        2.8       ?       ? 
1 1 1   35   15   35 o    295.8    2.8    0.0000   0.0000          ?        ?   875.4132  16.6016          ?        ?      295.8        2.8       ?       ? 
1 1 1   35   15   36 f    181.1    4.2    0.0000   0.0000          ?        ?   328.2001  15.3245          ?        ?      181.1        4.2       ?       ? 
1 1 1   35   15   37 o     59.4   13.7    0.0000   0.0000          ?        ?    37.0343  15.9630          ?        ?       59.4       13.7       ?       ? 
1 1 1   35   15   38 o    434.8    2.6    0.0000   0.0000          ?        ?  1891.3011  22.3483          ?        ?      434.8        2.6       ?       ? 
1 1 1   35   15   39 o    224.7    3.4    0.0000   0.0000          ?        ?   505.0706  15.3245          ?        ?      224.7        3.4       ?       ? 
1 1 1   35   15   40 o    151.1    5.1    0.0000   0.0000          ?        ?   228.5907  15.3245          ?        ?      151.1        5.1       ?       ? 
1 1 1   35   15   41 f    184.5    4.5    0.0000   0.0000          ?        ?   340.9706  16.6016          ?        ?      184.5        4.5       ?       ? 
1 1 1   35   15   42 o    235.6    3.5    0.0000   0.0000          ?        ?   555.5138  16.6016          ?        ?      235.6        3.5       ?       ? 
1 1 1   35   15   43 o    185.1    4.5    0.0000   0.0000          ?        ?   342.8861  16.6016          ?        ?      185.1        4.5       ?       ? 
1 1 1   35   15   44 o     89.1    9.3    0.0000   0.0000          ?        ?    79.8152  16.6016          ?        ?       89.1        9.3       ?       ? 
1 1 1   35   15   45 o    331.3    3.2    0.0000   0.0000          ?        ?  1098.2572  21.0712          ?        ?      331.3        3.2       ?       ? 
1 1 1   35   15   46 o     67.7   13.2    0.0000   0.0000          ?        ?    47.8891  17.2401          ?        ?       67.7       13.2       ?       ? 
1 1 1   35   15   47 o    382.4    2.8    0.0000   0.0000          ?        ?  1463.4916  21.0712          ?        ?      382.4        2.8       ?       ? 
1 1 1   35   15   48 o     64.8   13.3    0.0000   0.0000          ?        ?    44.0580  16.6016          ?        ?       64.8       13.3       ?       ? 
1 1 1   35   15   49 o    218.2    4.1    0.0000   0.0000          ?        ?   476.9756  17.8786          ?        ?      218.2        4.1       ?       ? 
1 1 1   35   15   50 o    301.2    3.3    0.0000   0.0000          ?        ?   907.9777  19.7942          ?        ?      301.2        3.3       ?       ? 
1 1 1   35   15   51 o     20.2   10.1    0.0000   0.0000          ?        ?   -47.8891  17.2401          ?        ?       20.2       10.1       ?       ? 
1 1 1   35   15   52 o     79.0   10.9    0.0000   0.0000          ?        ?    63.2136  17.2401          ?        ?       79.0       10.9       ?       ? 
1 1 1   35   15   53 o    167.2    5.5    0.0000   0.0000          ?        ?   280.3110  18.5171          ?        ?      167.2        5.5       ?       ? 
1 1 1   35   15   54 o     40.7   16.0    0.0000   0.0000          ?        ?    10.2163  19.1556          ?        ?       40.7       16.0       ?       ? 
1 1 1   35   15   55 o     71.4   13.5    0.0000   0.0000          ?        ?    53.6358  18.5171          ?        ?       71.4       13.5       ?       ? 
1 1 1   35   15   56 o     59.9   15.4    0.0000   0.0000          ?        ?    38.3113  18.5171          ?        ?       59.9       15.4       ?       ? 
1 1 1   35   15   57 o     23.0   11.3    0.0000   0.0000          ?        ?   -38.9498  18.5171          ?        ?       23.0       11.3       ?       ? 
1 1 1   35   15   58 o     57.8   16.0    0.0000   0.0000          ?        ?    35.7572  19.1556          ?        ?       57.8       16.0       ?       ? 
1 1 1   35   15   59 o    295.9    3.7    0.0000   0.0000          ?        ?   877.3287  21.7097          ?        ?      295.9        3.7       ?       ? 
1 1 1   35   15   60 o     60.9   15.6    0.0000   0.0000          ?        ?    40.2269  19.1556          ?        ?       60.9       15.6       ?       ? 
1 1 1   35   15   61 o    447.5    2.9    0.0000   0.0000          ?        ?  2005.5964  25.5409          ?        ?      447.5        2.9       ?       ? 
1 1 1   35   16    0 o    256.1    4.4  656.4003  22.3483   656.4003  22.3483   656.4003  22.3483      256.1      4.4      256.1        4.4     0.0     0.0 
1 1 1   35   16    1 o    331.3    2.7    0.0000   0.0000          ?        ?  1097.6187  17.8786          ?        ?      331.3        2.7       ?       ? 
1 1 1   35   16    2 o    279.9    3.0    0.0000   0.0000          ?        ?   783.4660  16.6016          ?        ?      279.9        3.0       ?       ? 
1 1 1   35   16    3 o    591.5    3.1    0.0000   0.0000          ?        ?  3499.0986  37.0343          ?        ?      591.5        3.1       ?       ? 
1 1 1   35   16    4 o    269.4    3.1    0.0000   0.0000          ?        ?   725.9991  16.6016          ?        ?      269.4        3.1       ?       ? 
1 1 1   35   16    5 o    671.1    3.2    0.0000   0.0000          ?        ?  4504.1318  42.7809          ?        ?      671.1        3.2       ?       ? 
1 1 1   35   16    6 o    273.2    2.7    0.0000   0.0000          ?        ?   746.4318  14.6860          ?        ?      273.2        2.7       ?       ? 
1 1 1   35   16    7 o    297.7    2.4    0.0000   0.0000          ?        ?   886.2681  14.0475          ?        ?      297.7        2.4       ?       ? 
1 1 1   35   16    8 f    512.2    2.6    0.0000   0.0000          ?        ?  2623.6853  26.1794          ?        ?      512.2        2.6       ?       ? 
1 1 1   35   16    9 o    404.1    2.4    0.0000   0.0000          ?        ?  1633.3384  19.7942          ?        ?      404.1        2.4       ?       ? 
1 1 1   35   16   10 o    508.6    2.7    0.0000   0.0000          ?        ?  2586.6511  27.4564          ?        ?      508.6        2.7       ?       ? 
1 1 1   35   16   11 o    404.3    2.1    0.0000   0.0000          ?        ?  1634.6154  17.2401          ?        ?      404.3        2.1       ?       ? 
1 1 1   35   16   12 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   16   13 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   16   14 o    342.3    2.3    0.0000   0.0000          ?        ?  1171.6871  15.9630          ?        ?      342.3        2.3       ?       ? 
1 1 1   35   16   15 o    400.5    2.3    0.0000   0.0000          ?        ?  1604.6049  18.5171          ?        ?      400.5        2.3       ?       ? 
1 1 1   35   16   16 o    769.9    3.1    0.0000   0.0000          ?        ?  5928.6733  47.2506          ?        ?      769.9        3.1       ?       ? 
1 1 1   35   16   17 o     16.3    8.2    0.0000   0.0000          ?        ?   -33.2031  11.4934          ?        ?       16.3        8.2       ?       ? 
1 1 1   35   16   18 o    304.4    2.4    0.0000   0.0000          ?        ?   926.4949  14.6860          ?        ?      304.4        2.4       ?       ? 
1 1 1   35   16   19 o    198.9    3.2    0.0000   0.0000          ?        ?   395.8834  12.7704          ?        ?      198.9        3.2       ?       ? 
1 1 1   35   16   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   16   21 o    166.4    3.6    0.0000   0.0000          ?        ?   277.1184  12.1319          ?        ?      166.4        3.6       ?       ? 
1 1 1   35   16   22 o    104.7    5.8    0.0000   0.0000          ?        ?   109.8257  12.1319          ?        ?      104.7        5.8       ?       ? 
1 1 1   35   16   23 o    282.8    2.6    0.0000   0.0000          ?        ?   800.0676  14.6860          ?        ?      282.8        2.6       ?       ? 
1 1 1   35   16   24 o    141.8    4.3    0.0000   0.0000          ?        ?   201.1343  12.1319          ?        ?      141.8        4.3       ?       ? 
1 1 1   35   16   25 o    650.0    2.8    0.0000   0.0000          ?        ?  4226.3750  35.7572          ?        ?      650.0        2.8       ?       ? 
1 1 1   35   16   26 o     21.1   10.1    0.0000   0.0000          ?        ?   -17.2401  12.1319          ?        ?       21.1       10.1       ?       ? 
1 1 1   35   16   27 o    302.2    2.5    0.0000   0.0000          ?        ?   913.7245  15.3245          ?        ?      302.2        2.5       ?       ? 
1 1 1   35   16   28 o    242.5    3.3    0.0000   0.0000          ?        ?   588.0784  15.9630          ?        ?      242.5        3.3       ?       ? 
1 1 1   35   16   29 o    518.2    2.6    0.0000   0.0000          ?        ?  2686.2605  26.8179          ?        ?      518.2        2.6       ?       ? 
1 1 1   35   16   30 o    196.5    3.6    0.0000   0.0000          ?        ?   386.3056  14.0475          ?        ?      196.5        3.6       ?       ? 
1 1 1   35   16   31 o    385.7    2.6    0.0000   0.0000          ?        ?  1487.7554  20.4327          ?        ?      385.7        2.6       ?       ? 
1 1 1   35   16   32 o    432.1    2.4    0.0000   0.0000          ?        ?  1867.6758  21.0712          ?        ?      432.1        2.4       ?       ? 
1 1 1   35   16   33 o    211.1    3.6    0.0000   0.0000          ?        ?   445.6881  15.3245          ?        ?      211.1        3.6       ?       ? 
1 1 1   35   16   34 o    305.4    2.8    0.0000   0.0000          ?        ?   932.8801  17.2401          ?        ?      305.4        2.8       ?       ? 
1 1 1   35   16   35 o     91.3    8.0    0.0000   0.0000          ?        ?    83.6463  14.6860          ?        ?       91.3        8.0       ?       ? 
1 1 1   35   16   36 o    336.3    2.7    0.0000   0.0000          ?        ?  1131.4603  17.8786          ?        ?      336.3        2.7       ?       ? 
1 1 1   35   16   37 o    217.4    3.8    0.0000   0.0000          ?        ?   473.1445  16.6016          ?        ?      217.4        3.8       ?       ? 
1 1 1   35   16   38 o    254.5    3.3    0.0000   0.0000          ?        ?   648.0994  16.6016          ?        ?      254.5        3.3       ?       ? 
1 1 1   35   16   39 o    196.8    3.9    0.0000   0.0000          ?        ?   387.5826  15.3245          ?        ?      196.8        3.9       ?       ? 
1 1 1   35   16   40 o    102.5    7.5    0.0000   0.0000          ?        ?   105.3561  15.3245          ?        ?      102.5        7.5       ?       ? 
1 1 1   35   16   41 o    107.0    7.5    0.0000   0.0000          ?        ?   114.9339  15.9630          ?        ?      107.0        7.5       ?       ? 
1 1 1   35   16   42 o    320.4    2.9    0.0000   0.0000          ?        ?  1027.3812  18.5171          ?        ?      320.4        2.9       ?       ? 
1 1 1   35   16   43 o    162.5    5.1    0.0000   0.0000          ?        ?   264.3480  16.6016          ?        ?      162.5        5.1       ?       ? 
1 1 1   35   16   44 o    347.8    2.8    0.0000   0.0000          ?        ?  1209.9985  19.7942          ?        ?      347.8        2.8       ?       ? 
1 1 1   35   16   45 o    412.5    2.8    0.0000   0.0000          ?        ?  1702.2987  22.9868          ?        ?      412.5        2.8       ?       ? 
1 1 1   35   16   46 o    151.4    5.7    0.0000   0.0000          ?        ?   229.8678  17.2401          ?        ?      151.4        5.7       ?       ? 
1 1 1   35   16   47 o     32.7   14.2    0.0000   0.0000          ?        ?    -2.5541  17.2401          ?        ?       32.7       14.2       ?       ? 
1 1 1   35   16   48 o    271.6    3.4    0.0000   0.0000          ?        ?   738.1310  18.5171          ?        ?      271.6        3.4       ?       ? 
1 1 1   35   16   49 o     21.9   10.9    0.0000   0.0000          ?        ?   -45.3350  18.5171          ?        ?       21.9       10.9       ?       ? 
1 1 1   35   16   50 o     69.3   13.4    0.0000   0.0000          ?        ?    50.4432  17.8786          ?        ?       69.3       13.4       ?       ? 
1 1 1   35   16   51 o    170.4    5.6    0.0000   0.0000          ?        ?   291.1659  19.1556          ?        ?      170.4        5.6       ?       ? 
1 1 1   35   16   52 o     28.3   13.1    0.0000   0.0000          ?        ?   -15.3245  17.8786          ?        ?       28.3       13.1       ?       ? 
1 1 1   35   16   53 o     21.4   10.7    0.0000   0.0000          ?        ?   -48.5276  18.5171          ?        ?       21.4       10.7       ?       ? 
1 1 1   35   16   54 o     39.5   15.7    0.0000   0.0000          ?        ?     8.9393  18.5171          ?        ?       39.5       15.7       ?       ? 
1 1 1   35   16   55 o    153.3    6.2    0.0000   0.0000          ?        ?   236.2530  19.1556          ?        ?      153.3        6.2       ?       ? 
1 1 1   35   16   56 o    183.8    5.0    0.0000   0.0000          ?        ?   339.0550  18.5171          ?        ?      183.8        5.0       ?       ? 
1 1 1   35   16   57 o     29.5   13.6    0.0000   0.0000          ?        ?   -13.4090  18.5171          ?        ?       29.5       13.6       ?       ? 
1 1 1   35   16   58 o    303.3    3.3    0.0000   0.0000          ?        ?   921.3867  19.7942          ?        ?      303.3        3.3       ?       ? 
1 1 1   35   16   59 o     22.7   11.3    0.0000   0.0000          ?        ?   -43.4195  19.1556          ?        ?       22.7       11.3       ?       ? 
1 1 1   35   16   60 o     92.2   10.4    0.0000   0.0000          ?        ?    86.8389  19.1556          ?        ?       92.2       10.4       ?       ? 
1 1 1   35   17    0 o    140.5    5.9  198.5802  16.6016   198.5802  16.6016   198.5802  16.6016      140.5      5.9      140.5        5.9     0.0     0.0 
1 1 1   35   17    1 o    200.5    3.3    0.0000   0.0000          ?        ?   402.2686  13.4090          ?        ?      200.5        3.3       ?       ? 
1 1 1   35   17    2 o    669.9    3.4    0.0000   0.0000          ?        ?  4488.1685  45.3350          ?        ?      669.9        3.4       ?       ? 
1 1 1   35   17    3 o    253.9    3.1    0.0000   0.0000          ?        ?   644.9069  15.9630          ?        ?      253.9        3.1       ?       ? 
1 1 1   35   17    4 o    446.2    2.9    0.0000   0.0000          ?        ?  1991.5490  25.5409          ?        ?      446.2        2.9       ?       ? 
1 1 1   35   17    5 o    186.5    3.4    0.0000   0.0000          ?        ?   347.9943  12.7704          ?        ?      186.5        3.4       ?       ? 
1 1 1   35   17    6 o    418.5    2.7    0.0000   0.0000          ?        ?  1751.4647  22.3483          ?        ?      418.5        2.7       ?       ? 
1 1 1   35   17    7 o    196.2    3.1    0.0000   0.0000          ?        ?   385.0285  12.1319          ?        ?      196.2        3.1       ?       ? 
1 1 1   35   17    8 o    542.3    2.8    0.0000   0.0000          ?        ?  2941.6692  30.6490          ?        ?      542.3        2.8       ?       ? 
1 1 1   35   17    9 o    161.8    3.6    0.0000   0.0000          ?        ?   261.7939  11.4934          ?        ?      161.8        3.6       ?       ? 
1 1 1   35   17   10 o    274.6    2.8    0.0000   0.0000          ?        ?   754.0941  15.3245          ?        ?      274.6        2.8       ?       ? 
1 1 1   35   17   11 o    864.9    3.5    0.0000   0.0000          ?        ?  7482.1968  60.0210          ?        ?      864.9        3.5       ?       ? 
1 1 1   35   17   12 o    810.3    3.3    0.0000   0.0000          ?        ?  6567.8335  52.9973          ?        ?      810.3        3.3       ?       ? 
1 1 1   35   17   13 o    726.3    3.1    0.0000   0.0000          ?        ?  5276.7427  44.6965          ?        ?      726.3        3.1       ?       ? 
1 1 1   35   17   14 o    154.5    3.3    0.0000   0.0000          ?        ?   238.8071  10.2163          ?        ?      154.5        3.3       ?       ? 
1 1 1   35   17   15 o     67.3    8.1    0.0000   0.0000          ?        ?    45.3350  10.8549          ?        ?       67.3        8.1       ?       ? 
1 1 1   35   17   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   17   17 o    578.3    2.8    0.0000   0.0000          ?        ?  3345.2148  32.5646          ?        ?      578.3        2.8       ?       ? 
1 1 1   35   17   18 o    191.9    3.2    0.0000   0.0000          ?        ?   368.4270  12.1319          ?        ?      191.9        3.2       ?       ? 
1 1 1   35   17   19 o    542.9    2.5    0.0000   0.0000          ?        ?  2947.4158  26.8179          ?        ?      542.9        2.5       ?       ? 
1 1 1   35   17   20 o    318.9    2.4    0.0000   0.0000          ?        ?  1017.1650  15.3245          ?        ?      318.9        2.4       ?       ? 
1 1 1   35   17   21 o    179.9    3.5    0.0000   0.0000          ?        ?   323.7305  12.7704          ?        ?      179.9        3.5       ?       ? 
1 1 1   35   17   22 o    714.5    2.9    0.0000   0.0000          ?        ?  5106.8960  41.5039          ?        ?      714.5        2.9       ?       ? 
1 1 1   35   17   23 o    131.0    4.9    0.0000   0.0000          ?        ?   171.7623  12.7704          ?        ?      131.0        4.9       ?       ? 
1 1 1   35   17   24 o    690.8    2.8    0.0000   0.0000          ?        ?  4773.5874  38.3113          ?        ?      690.8        2.8       ?       ? 
1 1 1   35   17   25 o    327.4    2.5    0.0000   0.0000          ?        ?  1072.0778  16.6016          ?        ?      327.4        2.5       ?       ? 
1 1 1   35   17   26 o    286.1    2.8    0.0000   0.0000          ?        ?   818.5847  15.9630          ?        ?      286.1        2.8       ?       ? 
1 1 1   35   17   27 o    447.5    2.5    0.0000   0.0000          ?        ?  2003.0425  22.3483          ?        ?      447.5        2.5       ?       ? 
1 1 1   35   17   28 o    281.8    3.1    0.0000   0.0000          ?        ?   794.3209  17.2401          ?        ?      281.8        3.1       ?       ? 
1 1 1   35   17   29 o    139.9    5.0    0.0000   0.0000          ?        ?   196.0261  14.0475          ?        ?      139.9        5.0       ?       ? 
1 1 1   35   17   30 o    401.6    2.5    0.0000   0.0000          ?        ?  1613.5442  20.4327          ?        ?      401.6        2.5       ?       ? 
1 1 1   35   17   31 o    543.4    2.6    0.0000   0.0000          ?        ?  2953.1626  28.7335          ?        ?      543.4        2.6       ?       ? 
1 1 1   35   17   32 o    283.8    2.8    0.0000   0.0000          ?        ?   805.8143  15.9630          ?        ?      283.8        2.8       ?       ? 
1 1 1   35   17   33 o     85.2    8.2    0.0000   0.0000          ?        ?    72.7915  14.0475          ?        ?       85.2        8.2       ?       ? 
1 1 1   35   17   34 o    235.8    3.2    0.0000   0.0000          ?        ?   556.1523  15.3245          ?        ?      235.8        3.2       ?       ? 
1 1 1   35   17   35 o    347.1    2.7    0.0000   0.0000          ?        ?  1205.5288  18.5171          ?        ?      347.1        2.7       ?       ? 
1 1 1   35   17   36 o    280.5    3.1    0.0000   0.0000          ?        ?   787.2972  17.2401          ?        ?      280.5        3.1       ?       ? 
1 1 1   35   17   37 o    177.3    4.3    0.0000   0.0000          ?        ?   314.7912  15.3245          ?        ?      177.3        4.3       ?       ? 
1 1 1   35   17   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   17   39 o    111.1    6.9    0.0000   0.0000          ?        ?   123.8732  15.3245          ?        ?      111.1        6.9       ?       ? 
1 1 1   35   17   40 o    196.6    4.1    0.0000   0.0000          ?        ?   386.9441  15.9630          ?        ?      196.6        4.1       ?       ? 
1 1 1   35   17   41 o    142.3    5.8    0.0000   0.0000          ?        ?   203.0499  16.6016          ?        ?      142.3        5.8       ?       ? 
1 1 1   35   17   42 o    299.9    3.1    0.0000   0.0000          ?        ?   899.6769  18.5171          ?        ?      299.9        3.1       ?       ? 
1 1 1   35   17   43 o    238.4    3.6    0.0000   0.0000          ?        ?   568.9227  17.2401          ?        ?      238.4        3.6       ?       ? 
1 1 1   35   17   44 o    197.9    4.4    0.0000   0.0000          ?        ?   392.0523  17.2401          ?        ?      197.9        4.4       ?       ? 
1 1 1   35   17   45 o    347.5    2.9    0.0000   0.0000          ?        ?  1208.0829  20.4327          ?        ?      347.5        2.9       ?       ? 
1 1 1   35   17   46 o    224.3    3.8    0.0000   0.0000          ?        ?   503.7936  17.2401          ?        ?      224.3        3.8       ?       ? 
1 1 1   35   17   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   17   48 o    289.9    3.2    0.0000   0.0000          ?        ?   840.9330  18.5171          ?        ?      289.9        3.2       ?       ? 
1 1 1   35   17   49 o    120.4    7.4    0.0000   0.0000          ?        ?   145.5829  17.8786          ?        ?      120.4        7.4       ?       ? 
1 1 1   35   17   50 o    276.4    3.5    0.0000   0.0000          ?        ?   764.9489  19.1556          ?        ?      276.4        3.5       ?       ? 
1 1 1   35   17   51 o    302.4    3.4    0.0000   0.0000          ?        ?   915.6400  20.4327          ?        ?      302.4        3.4       ?       ? 
1 1 1   35   17   52 o     34.6   14.9    0.0000   0.0000          ?        ?    -0.6385  18.5171          ?        ?       34.6       14.9       ?       ? 
1 1 1   35   17   53 o    356.4    3.2    0.0000   0.0000          ?        ?  1271.9351  22.9868          ?        ?      356.4        3.2       ?       ? 
1 1 1   35   17   54 o    135.0    6.9    0.0000   0.0000          ?        ?   183.2557  18.5171          ?        ?      135.0        6.9       ?       ? 
1 1 1   35   17   55 o     92.6    9.7    0.0000   0.0000          ?        ?    86.8389  17.8786          ?        ?       92.6        9.7       ?       ? 
1 1 1   35   17   56 o    177.4    5.4    0.0000   0.0000          ?        ?   316.0682  19.1556          ?        ?      177.4        5.4       ?       ? 
1 1 1   35   17   57 o    110.4    8.4    0.0000   0.0000          ?        ?   123.2347  18.5171          ?        ?      110.4        8.4       ?       ? 
1 1 1   35   17   58 o    176.6    5.4    0.0000   0.0000          ?        ?   313.5141  19.1556          ?        ?      176.6        5.4       ?       ? 
1 1 1   35   17   59 o    147.2    6.1    0.0000   0.0000          ?        ?   218.3744  17.8786          ?        ?      147.2        6.1       ?       ? 
1 1 1   35   18    0 o    474.9    4.0 2255.8967  37.6728  2255.8967  37.6728  2255.8967  37.6728      474.9      4.0      474.9        4.0     0.0     0.0 
1 1 1   35   18    1 o    285.4    2.8    0.0000   0.0000          ?        ?   814.7536  15.9630          ?        ?      285.4        2.8       ?       ? 
1 1 1   35   18    2 o    567.1    3.0    0.0000   0.0000          ?        ?  3216.2334  34.4802          ?        ?      567.1        3.0       ?       ? 
1 1 1   35   18    3 o    737.5    3.5    0.0000   0.0000          ?        ?  5440.2041  51.7203          ?        ?      737.5        3.5       ?       ? 
1 1 1   35   18    4 o    638.6    3.2    0.0000   0.0000          ?        ?  4078.8760  41.5039          ?        ?      638.6        3.2       ?       ? 
1 1 1   35   18    5 o    300.3    2.9    0.0000   0.0000          ?        ?   902.2311  17.2401          ?        ?      300.3        2.9       ?       ? 
1 1 1   35   18    6 o    256.5    3.0    0.0000   0.0000          ?        ?   658.3158  15.3245          ?        ?      256.5        3.0       ?       ? 
1 1 1   35   18    7 o    412.2    2.7    0.0000   0.0000          ?        ?  1699.1061  22.3483          ?        ?      412.2        2.7       ?       ? 
1 1 1   35   18    8 o    126.8    4.3    0.0000   0.0000          ?        ?   160.9075  10.8549          ?        ?      126.8        4.3       ?       ? 
1 1 1   35   18    9 o    320.5    2.4    0.0000   0.0000          ?        ?  1027.3812  15.3245          ?        ?      320.5        2.4       ?       ? 
1 1 1   35   18   10 o    165.1    3.5    0.0000   0.0000          ?        ?   272.6487  11.4934          ?        ?      165.1        3.5       ?       ? 
1 1 1   35   18   11 f    306.2    2.8    0.0000   0.0000          ?        ?   937.9882  17.2401          ?        ?      306.2        2.8       ?       ? 
1 1 1   35   18   12 o    374.4    2.6    0.0000   0.0000          ?        ?  1402.1935  19.1556          ?        ?      374.4        2.6       ?       ? 
1 1 1   35   18   13 o    269.8    2.7    0.0000   0.0000          ?        ?   727.9147  14.6860          ?        ?      269.8        2.7       ?       ? 
1 1 1   35   18   14 o    131.5    3.4    0.0000   0.0000          ?        ?   173.0394   8.9393          ?        ?      131.5        3.4       ?       ? 
1 1 1   35   18   15 o    485.2    2.4    0.0000   0.0000          ?        ?  2354.8677  23.6253          ?        ?      485.2        2.4       ?       ? 
1 1 1   35   18   16 o    211.8    2.7    0.0000   0.0000          ?        ?   448.8807  11.4934          ?        ?      211.8        2.7       ?       ? 
1 1 1   35   18   17 o    425.5    2.5    0.0000   0.0000          ?        ?  1810.8474  21.0712          ?        ?      425.5        2.5       ?       ? 
1 1 1   35   18   18 f     68.2    8.9    0.0000   0.0000          ?        ?    46.6121  12.1319          ?        ?       68.2        8.9       ?       ? 
1 1 1   35   18   19 o    183.4    3.5    0.0000   0.0000          ?        ?   336.5009  12.7704          ?        ?      183.4        3.5       ?       ? 
1 1 1   35   18   20 o     85.6    7.1    0.0000   0.0000          ?        ?    73.4300  12.1319          ?        ?       85.6        7.1       ?       ? 
1 1 1   35   18   21 o    437.5    2.4    0.0000   0.0000          ?        ?  1914.2877  21.0712          ?        ?      437.5        2.4       ?       ? 
1 1 1   35   18   22 o    241.0    2.9    0.0000   0.0000          ?        ?   581.0547  14.0475          ?        ?      241.0        2.9       ?       ? 
1 1 1   35   18   23 o    387.7    2.3    0.0000   0.0000          ?        ?  1503.0798  17.8786          ?        ?      387.7        2.3       ?       ? 
1 1 1   35   18   24 o    104.1    6.1    0.0000   0.0000          ?        ?   108.5487  12.7704          ?        ?      104.1        6.1       ?       ? 
1 1 1   35   18   25 o     33.8   13.1    0.0000   0.0000          ?        ?     7.0237  12.7704          ?        ?       33.8       13.1       ?       ? 
1 1 1   35   18   26 o    136.5    4.9    0.0000   0.0000          ?        ?   186.4483  13.4090          ?        ?      136.5        4.9       ?       ? 
1 1 1   35   18   27 o    373.5    2.4    0.0000   0.0000          ?        ?  1395.1698  17.8786          ?        ?      373.5        2.4       ?       ? 
1 1 1   35   18   28 o    126.5    5.6    0.0000   0.0000          ?        ?   160.2689  14.0475          ?        ?      126.5        5.6       ?       ? 
1 1 1   35   18   29 o    259.4    2.8    0.0000   0.0000          ?        ?   673.0018  14.6860          ?        ?      259.4        2.8       ?       ? 
1 1 1   35   18   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   18   31 o    269.4    2.8    0.0000   0.0000          ?        ?   725.9991  15.3245          ?        ?      269.4        2.8       ?       ? 
1 1 1   35   18   32 o    105.0    6.7    0.0000   0.0000          ?        ?   110.4642  14.0475          ?        ?      105.0        6.7       ?       ? 
1 1 1   35   18   33 o    430.9    2.5    0.0000   0.0000          ?        ?  1857.4594  21.7097          ?        ?      430.9        2.5       ?       ? 
1 1 1   35   18   34 o    216.7    3.5    0.0000   0.0000          ?        ?   469.9519  15.3245          ?        ?      216.7        3.5       ?       ? 
1 1 1   35   18   35 o    276.3    3.0    0.0000   0.0000          ?        ?   763.6719  16.6016          ?        ?      276.3        3.0       ?       ? 
1 1 1   35   18   36 o    317.2    2.7    0.0000   0.0000          ?        ?  1006.3101  17.2401          ?        ?      317.2        2.7       ?       ? 
1 1 1   35   18   37 o     87.4    8.4    0.0000   0.0000          ?        ?    76.6226  14.6860          ?        ?       87.4        8.4       ?       ? 
1 1 1   35   18   38 o    108.2    7.1    0.0000   0.0000          ?        ?   117.4880  15.3245          ?        ?      108.2        7.1       ?       ? 
1 1 1   35   18   39 f    129.9    6.1    0.0000   0.0000          ?        ?   169.2082  15.9630          ?        ?      129.9        6.1       ?       ? 
1 1 1   35   18   40 o    216.1    3.7    0.0000   0.0000          ?        ?   467.3978  15.9630          ?        ?      216.1        3.7       ?       ? 
1 1 1   35   18   41 o    136.2    5.9    0.0000   0.0000          ?        ?   185.8098  15.9630          ?        ?      136.2        5.9       ?       ? 
1 1 1   35   18   42 o    214.6    3.9    0.0000   0.0000          ?        ?   461.0126  16.6016          ?        ?      214.6        3.9       ?       ? 
1 1 1   35   18   43 o    112.5    7.1    0.0000   0.0000          ?        ?   127.0658  15.9630          ?        ?      112.5        7.1       ?       ? 
1 1 1   35   18   44 o    145.4    5.7    0.0000   0.0000          ?        ?   211.9892  16.6016          ?        ?      145.4        5.7       ?       ? 
1 1 1   35   18   45 o    204.2    4.2    0.0000   0.0000          ?        ?   417.5931  17.2401          ?        ?      204.2        4.2       ?       ? 
1 1 1   35   18   46 o    135.1    6.4    0.0000   0.0000          ?        ?   183.2557  17.2401          ?        ?      135.1        6.4       ?       ? 
1 1 1   35   18   47 f    244.2    3.8    0.0000   0.0000          ?        ?   597.0177  18.5171          ?        ?      244.2        3.8       ?       ? 
1 1 1   35   18   48 o    218.5    4.1    0.0000   0.0000          ?        ?   478.2527  17.8786          ?        ?      218.5        4.1       ?       ? 
1 1 1   35   18   49 o    166.8    5.6    0.0000   0.0000          ?        ?   279.0340  18.5171          ?        ?      166.8        5.6       ?       ? 
1 1 1   35   18   50 o    121.1    7.4    0.0000   0.0000          ?        ?   147.4985  17.8786          ?        ?      121.1        7.4       ?       ? 
1 1 1   35   18   51 o    306.6    3.3    0.0000   0.0000          ?        ?   941.1808  20.4327          ?        ?      306.6        3.3       ?       ? 
1 1 1   35   18   52 o    154.2    6.2    0.0000   0.0000          ?        ?   238.8071  19.1556          ?        ?      154.2        6.2       ?       ? 
1 1 1   35   18   53 o     43.3   16.1    0.0000   0.0000          ?        ?    15.3245  18.5171          ?        ?       43.3       16.1       ?       ? 
1 1 1   35   18   54 o     18.9    9.6    0.0000   0.0000          ?        ?   -61.2981  17.8786          ?        ?       18.9        9.6       ?       ? 
1 1 1   35   18   55 o     63.1   14.9    0.0000   0.0000          ?        ?    42.7809  18.5171          ?        ?       63.1       14.9       ?       ? 
1 1 1   35   18   56 o     84.9   10.5    0.0000   0.0000          ?        ?    73.4300  17.8786          ?        ?       84.9       10.5       ?       ? 
1 1 1   35   18   57 o     93.7    9.9    0.0000   0.0000          ?        ?    89.3930  18.5171          ?        ?       93.7        9.9       ?       ? 
1 1 1   35   18   58 f     86.6   10.7    0.0000   0.0000          ?        ?    76.6226  18.5171          ?        ?       86.6       10.7       ?       ? 
1 1 1   35   18   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   19    0 o    173.3    5.2  301.3822  17.8786   301.3822  17.8786   301.3822  17.8786      173.3      5.2      173.3        5.2     0.0     0.0 
1 1 1   35   19    1 o    189.4    3.2    0.0000   0.0000          ?        ?   358.8492  12.1319          ?        ?      189.4        3.2       ?       ? 
1 1 1   35   19    2 o    237.2    3.0    0.0000   0.0000          ?        ?   562.5375  14.0475          ?        ?      237.2        3.0       ?       ? 
1 1 1   35   19    3 o    406.9    2.7    0.0000   0.0000          ?        ?  1655.6865  22.3483          ?        ?      406.9        2.7       ?       ? 
1 1 1   35   19    4 o    394.0    2.7    0.0000   0.0000          ?        ?  1552.8845  21.0712          ?        ?      394.0        2.7       ?       ? 
1 1 1   35   19    5 o    179.9    3.7    0.0000   0.0000          ?        ?   323.7305  13.4090          ?        ?      179.9        3.7       ?       ? 
1 1 1   35   19    6 o    258.4    3.0    0.0000   0.0000          ?        ?   667.8936  15.3245          ?        ?      258.4        3.0       ?       ? 
1 1 1   35   19    7 o    264.4    3.1    0.0000   0.0000          ?        ?   699.1812  16.6016          ?        ?      264.4        3.1       ?       ? 
1 1 1   35   19    8 o    638.1    2.9    0.0000   0.0000          ?        ?  4073.1296  36.3957          ?        ?      638.1        2.9       ?       ? 
1 1 1   35   19    9 o    279.5    2.4    0.0000   0.0000          ?        ?   781.5505  13.4090          ?        ?      279.5        2.4       ?       ? 
1 1 1   35   19   10 f    128.3    4.0    0.0000   0.0000          ?        ?   164.7386  10.2163          ?        ?      128.3        4.0       ?       ? 
1 1 1   35   19   11 o    349.1    2.5    0.0000   0.0000          ?        ?  1218.9377  17.2401          ?        ?      349.1        2.5       ?       ? 
1 1 1   35   19   12 o    342.1    2.6    0.0000   0.0000          ?        ?  1170.4102  17.8786          ?        ?      342.1        2.6       ?       ? 
1 1 1   35   19   13 o    605.5    2.7    0.0000   0.0000          ?        ?  3667.6685  33.2031          ?        ?      605.5        2.7       ?       ? 
1 1 1   35   19   14 o    318.3    2.2    0.0000   0.0000          ?        ?  1013.3338  14.0475          ?        ?      318.3        2.2       ?       ? 
1 1 1   35   19   15 o    182.2    3.0    0.0000   0.0000          ?        ?   332.0312  10.8549          ?        ?      182.2        3.0       ?       ? 
1 1 1   35   19   16 o    291.5    2.3    0.0000   0.0000          ?        ?   849.8723  13.4090          ?        ?      291.5        2.3       ?       ? 
1 1 1   35   19   17 o    365.0    2.4    0.0000   0.0000          ?        ?  1332.5946  17.8786          ?        ?      365.0        2.4       ?       ? 
1 1 1   35   19   18 o    654.1    3.0    0.0000   0.0000          ?        ?  4280.0103  38.9498          ?        ?      654.1        3.0       ?       ? 
1 1 1   35   19   19 o    193.6    3.1    0.0000   0.0000          ?        ?   374.8122  12.1319          ?        ?      193.6        3.1       ?       ? 
1 1 1   35   19   20 o    496.2    2.4    0.0000   0.0000          ?        ?  2462.7781  23.6253          ?        ?      496.2        2.4       ?       ? 
1 1 1   35   19   21 o    399.7    2.4    0.0000   0.0000          ?        ?  1597.5811  19.1556          ?        ?      399.7        2.4       ?       ? 
1 1 1   35   19   22 o    524.5    2.6    0.0000   0.0000          ?        ?  2751.3896  26.8179          ?        ?      524.5        2.6       ?       ? 
1 1 1   35   19   23 o    169.6    4.0    0.0000   0.0000          ?        ?   287.9732  13.4090          ?        ?      169.6        4.0       ?       ? 
1 1 1   35   19   24 o     18.4    9.1    0.0000   0.0000          ?        ?   -30.6490  12.7704          ?        ?       18.4        9.1       ?       ? 
1 1 1   35   19   25 o    377.0    2.5    0.0000   0.0000          ?        ?  1421.3491  18.5171          ?        ?      377.0        2.5       ?       ? 
1 1 1   35   19   26 o    182.2    3.9    0.0000   0.0000          ?        ?   332.0312  14.0475          ?        ?      182.2        3.9       ?       ? 
1 1 1   35   19   27 o    225.8    3.1    0.0000   0.0000          ?        ?   510.1788  14.0475          ?        ?      225.8        3.1       ?       ? 
1 1 1   35   19   28 o    299.8    2.7    0.0000   0.0000          ?        ?   899.0385  15.9630          ?        ?      299.8        2.7       ?       ? 
1 1 1   35   19   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   19   30 f     60.2   11.5    0.0000   0.0000          ?        ?    37.6728  13.4090          ?        ?       60.2       11.5       ?       ? 
1 1 1   35   19   31 o    213.9    3.4    0.0000   0.0000          ?        ?   457.8200  14.6860          ?        ?      213.9        3.4       ?       ? 
1 1 1   35   19   32 o     24.1   11.3    0.0000   0.0000          ?        ?   -15.3245  14.0475          ?        ?       24.1       11.3       ?       ? 
1 1 1   35   19   33 o    442.2    2.6    0.0000   0.0000          ?        ?  1956.4302  22.9868          ?        ?      442.2        2.6       ?       ? 
1 1 1   35   19   34 o    285.0    3.0    0.0000   0.0000          ?        ?   812.8381  17.2401          ?        ?      285.0        3.0       ?       ? 
1 1 1   35   19   35 o     22.0   10.7    0.0000   0.0000          ?        ?   -24.9023  14.6860          ?        ?       22.0       10.7       ?       ? 
1 1 1   35   19   36 o    269.2    3.2    0.0000   0.0000          ?        ?   725.3605  17.2401          ?        ?      269.2        3.2       ?       ? 
1 1 1   35   19   37 f    345.4    2.7    0.0000   0.0000          ?        ?  1193.3969  18.5171          ?        ?      345.4        2.7       ?       ? 
1 1 1   35   19   38 o    264.2    3.3    0.0000   0.0000          ?        ?   698.5427  17.2401          ?        ?      264.2        3.3       ?       ? 
1 1 1   35   19   39 o    267.3    3.2    0.0000   0.0000          ?        ?   715.1442  17.2401          ?        ?      267.3        3.2       ?       ? 
1 1 1   35   19   40 o    131.9    6.1    0.0000   0.0000          ?        ?   174.3164  15.9630          ?        ?      131.9        6.1       ?       ? 
1 1 1   35   19   41 o    185.0    4.5    0.0000   0.0000          ?        ?   342.8861  16.6016          ?        ?      185.0        4.5       ?       ? 
1 1 1   35   19   42 o    180.3    4.6    0.0000   0.0000          ?        ?   325.6460  16.6016          ?        ?      180.3        4.6       ?       ? 
1 1 1   35   19   43 o     92.9    8.6    0.0000   0.0000          ?        ?    86.8389  15.9630          ?        ?       92.9        8.6       ?       ? 
1 1 1   35   19   44 o    166.5    5.2    0.0000   0.0000          ?        ?   277.7569  17.2401          ?        ?      166.5        5.2       ?       ? 
1 1 1   35   19   45 o    212.2    4.2    0.0000   0.0000          ?        ?   450.7963  17.8786          ?        ?      212.2        4.2       ?       ? 
1 1 1   35   19   46 o    140.9    6.1    0.0000   0.0000          ?        ?   199.2188  17.2401          ?        ?      140.9        6.1       ?       ? 
1 1 1   35   19   47 o    156.8    5.7    0.0000   0.0000          ?        ?   246.4693  17.8786          ?        ?      156.8        5.7       ?       ? 
1 1 1   35   19   48 o    127.8    6.7    0.0000   0.0000          ?        ?   164.1001  17.2401          ?        ?      127.8        6.7       ?       ? 
1 1 1   35   19   49 o    249.4    3.8    0.0000   0.0000          ?        ?   623.1971  19.1556          ?        ?      249.4        3.8       ?       ? 
1 1 1   35   19   50 o    184.6    5.0    0.0000   0.0000          ?        ?   341.6091  18.5171          ?        ?      184.6        5.0       ?       ? 
1 1 1   35   19   51 o    217.8    4.5    0.0000   0.0000          ?        ?   475.6986  19.7942          ?        ?      217.8        4.5       ?       ? 
1 1 1   35   19   52 o    184.2    5.0    0.0000   0.0000          ?        ?   340.3320  18.5171          ?        ?      184.2        5.0       ?       ? 
1 1 1   35   19   53 o    109.4    8.2    0.0000   0.0000          ?        ?   120.6806  17.8786          ?        ?      109.4        8.2       ?       ? 
1 1 1   35   19   54 o     66.9   14.7    0.0000   0.0000          ?        ?    47.8891  19.1556          ?        ?       66.9       14.7       ?       ? 
1 1 1   35   19   55 o    119.3    7.8    0.0000   0.0000          ?        ?   143.6674  18.5171          ?        ?      119.3        7.8       ?       ? 
1 1 1   35   19   56 o     61.5   15.1    0.0000   0.0000          ?        ?    40.8654  18.5171          ?        ?       61.5       15.1       ?       ? 
1 1 1   35   19   57 o     20.3   10.2    0.0000   0.0000          ?        ?   -54.9129  18.5171          ?        ?       20.3       10.2       ?       ? 
1 1 1   35   19   58 o     54.4   16.0    0.0000   0.0000          ?        ?    31.9261  18.5171          ?        ?       54.4       16.0       ?       ? 
1 1 1   35   20    0 o    269.8    3.9  728.5532  21.0712   728.5532  21.0712   728.5532  21.0712      269.8      3.9      269.8        3.9     0.0     0.0 
1 1 1   35   20    1 o    307.6    2.6    0.0000   0.0000          ?        ?   946.2890  15.9630          ?        ?      307.6        2.6       ?       ? 
1 1 1   35   20    2 o     99.8    5.4    0.0000   0.0000          ?        ?    99.6094  10.8549          ?        ?       99.8        5.4       ?       ? 
1 1 1   35   20    3 o    340.1    2.8    0.0000   0.0000          ?        ?  1157.0012  19.1556          ?        ?      340.1        2.8       ?       ? 
1 1 1   35   20    4 o    551.2    3.0    0.0000   0.0000          ?        ?  3039.3630  33.2031          ?        ?      551.2        3.0       ?       ? 
1 1 1   35   20    5 o    364.9    3.0    0.0000   0.0000          ?        ?  1331.9562  21.7097          ?        ?      364.9        3.0       ?       ? 
1 1 1   35   20    6 f    416.5    2.8    0.0000   0.0000          ?        ?  1735.5017  23.6253          ?        ?      416.5        2.8       ?       ? 
1 1 1   35   20    7 o    611.5    3.2    0.0000   0.0000          ?        ?  3740.4597  38.9498          ?        ?      611.5        3.2       ?       ? 
1 1 1   35   20    8 o    534.7    2.9    0.0000   0.0000          ?        ?  2859.9382  30.6490          ?        ?      534.7        2.9       ?       ? 
1 1 1   35   20    9 o    545.0    2.7    0.0000   0.0000          ?        ?  2970.4026  29.3720          ?        ?      545.0        2.7       ?       ? 
1 1 1   35   20   10 o    201.5    2.7    0.0000   0.0000          ?        ?   406.0997  10.8549          ?        ?      201.5        2.7       ?       ? 
1 1 1   35   20   11 o    252.9    2.7    0.0000   0.0000          ?        ?   639.7986  13.4090          ?        ?      252.9        2.7       ?       ? 
1 1 1   35   20   12 o    193.6    3.1    0.0000   0.0000          ?        ?   374.8122  12.1319          ?        ?      193.6        3.1       ?       ? 
1 1 1   35   20   13 o    469.4    2.7    0.0000   0.0000          ?        ?  2204.1768  24.9023          ?        ?      469.4        2.7       ?       ? 
1 1 1   35   20   14 o    422.9    2.3    0.0000   0.0000          ?        ?  1788.4991  19.1556          ?        ?      422.9        2.3       ?       ? 
1 1 1   35   20   15 o    579.0    2.5    0.0000   0.0000          ?        ?  3352.8770  29.3720          ?        ?      579.0        2.5       ?       ? 
1 1 1   35   20   16 f    253.4    2.5    0.0000   0.0000          ?        ?   642.3527  12.7704          ?        ?      253.4        2.5       ?       ? 
1 1 1   35   20   17 o    404.9    2.4    0.0000   0.0000          ?        ?  1639.7235  19.1556          ?        ?      404.9        2.4       ?       ? 
1 1 1   35   20   18 o    234.3    2.6    0.0000   0.0000          ?        ?   549.1286  12.1319          ?        ?      234.3        2.6       ?       ? 
1 1 1   35   20   19 o    649.8    2.9    0.0000   0.0000          ?        ?  4223.8208  38.3113          ?        ?      649.8        2.9       ?       ? 
1 1 1   35   20   20 o    425.3    2.4    0.0000   0.0000          ?        ?  1809.5702  20.4327          ?        ?      425.3        2.4       ?       ? 
1 1 1   35   20   21 o    203.8    3.0    0.0000   0.0000          ?        ?   415.6776  12.1319          ?        ?      203.8        3.0       ?       ? 
1 1 1   35   20   22 o    315.3    2.4    0.0000   0.0000          ?        ?   994.1782  15.3245          ?        ?      315.3        2.4       ?       ? 
1 1 1   35   20   23 o    461.9    2.4    0.0000   0.0000          ?        ?  2133.9395  22.3483          ?        ?      461.9        2.4       ?       ? 
1 1 1   35   20   24 o    221.6    2.9    0.0000   0.0000          ?        ?   491.0231  12.7704          ?        ?      221.6        2.9       ?       ? 
1 1 1   35   20   25 f    229.3    3.1    0.0000   0.0000          ?        ?   526.1418  14.0475          ?        ?      229.3        3.1       ?       ? 
1 1 1   35   20   26 o    390.0    2.5    0.0000   0.0000          ?        ?  1521.5970  19.1556          ?        ?      390.0        2.5       ?       ? 
1 1 1   35   20   27 o    465.4    2.5    0.0000   0.0000          ?        ?  2166.5039  23.6253          ?        ?      465.4        2.5       ?       ? 
1 1 1   35   20   28 o     66.7   10.5    0.0000   0.0000          ?        ?    44.6965  14.0475          ?        ?       66.7       10.5       ?       ? 
1 1 1   35   20   29 o    189.5    4.0    0.0000   0.0000          ?        ?   359.4877  15.3245          ?        ?      189.5        4.0       ?       ? 
1 1 1   35   20   30 o    332.3    2.6    0.0000   0.0000          ?        ?  1104.6425  17.2401          ?        ?      332.3        2.6       ?       ? 
1 1 1   35   20   31 o     31.4   13.2    0.0000   0.0000          ?        ?     1.2770  14.0475          ?        ?       31.4       13.2       ?       ? 
1 1 1   35   20   32 o    152.8    4.6    0.0000   0.0000          ?        ?   233.6989  14.0475          ?        ?      152.8        4.6       ?       ? 
1 1 1   35   20   33 o    267.7    3.1    0.0000   0.0000          ?        ?   717.0598  16.6016          ?        ?      267.7        3.1       ?       ? 
1 1 1   35   20   34 o    223.4    3.4    0.0000   0.0000          ?        ?   499.3239  15.3245          ?        ?      223.4        3.4       ?       ? 
1 1 1   35   20   35 o    155.2    4.9    0.0000   0.0000          ?        ?   241.3612  15.3245          ?        ?      155.2        4.9       ?       ? 
1 1 1   35   20   36 o    310.9    2.9    0.0000   0.0000          ?        ?   967.3603  17.8786          ?        ?      310.9        2.9       ?       ? 
1 1 1   35   20   37 o     53.5   13.7    0.0000   0.0000          ?        ?    30.0105  14.6860          ?        ?       53.5       13.7       ?       ? 
1 1 1   35   20   38 o    190.0    4.4    0.0000   0.0000          ?        ?   361.4032  16.6016          ?        ?      190.0        4.4       ?       ? 
1 1 1   35   20   39 o    269.5    3.1    0.0000   0.0000          ?        ?   726.6376  16.6016          ?        ?      269.5        3.1       ?       ? 
1 1 1   35   20   40 o    193.3    4.3    0.0000   0.0000          ?        ?   374.1737  16.6016          ?        ?      193.3        4.3       ?       ? 
1 1 1   35   20   41 o     53.6   14.9    0.0000   0.0000          ?        ?    30.0105  16.6016          ?        ?       53.6       14.9       ?       ? 
1 1 1   35   20   42 o    148.7    5.6    0.0000   0.0000          ?        ?   221.5670  16.6016          ?        ?      148.7        5.6       ?       ? 
1 1 1   35   20   43 o    188.6    4.7    0.0000   0.0000          ?        ?   356.2951  17.8786          ?        ?      188.6        4.7       ?       ? 
1 1 1   35   20   44 o    183.6    4.7    0.0000   0.0000          ?        ?   337.7780  17.2401          ?        ?      183.6        4.7       ?       ? 
1 1 1   35   20   45 o    344.8    3.0    0.0000   0.0000          ?        ?  1189.5658  20.4327          ?        ?      344.8        3.0       ?       ? 
1 1 1   35   20   46 o     83.0   10.8    0.0000   0.0000          ?        ?    69.5989  17.8786          ?        ?       83.0       10.8       ?       ? 
1 1 1   35   20   47 o     23.4   11.5    0.0000   0.0000          ?        ?   -37.0343  18.5171          ?        ?       23.4       11.5       ?       ? 
1 1 1   35   20   48 o    170.0    5.4    0.0000   0.0000          ?        ?   289.8888  18.5171          ?        ?      170.0        5.4       ?       ? 
1 1 1   35   20   49 o     95.8    9.0    0.0000   0.0000          ?        ?    92.5856  17.2401          ?        ?       95.8        9.0       ?       ? 
1 1 1   35   20   50 o    191.0    4.7    0.0000   0.0000          ?        ?   365.8729  17.8786          ?        ?      191.0        4.7       ?       ? 
1 1 1   35   20   51 o    236.5    4.2    0.0000   0.0000          ?        ?   560.6220  19.7942          ?        ?      236.5        4.2       ?       ? 
1 1 1   35   20   52 o    155.2    6.0    0.0000   0.0000          ?        ?   241.9997  18.5171          ?        ?      155.2        6.0       ?       ? 
1 1 1   35   20   53 o     53.4   16.1    0.0000   0.0000          ?        ?    30.0105  18.5171          ?        ?       53.4       16.1       ?       ? 
1 1 1   35   20   54 o     79.8   11.6    0.0000   0.0000          ?        ?    65.1292  18.5171          ?        ?       79.8       11.6       ?       ? 
1 1 1   35   20   55 o     90.3    9.9    0.0000   0.0000          ?        ?    83.0078  17.8786          ?        ?       90.3        9.9       ?       ? 
1 1 1   35   20   56 o     48.2   15.9    0.0000   0.0000          ?        ?    23.6253  17.8786          ?        ?       48.2       15.9       ?       ? 
1 1 1   35   20   57 o    113.1    7.9    0.0000   0.0000          ?        ?   129.6199  17.8786          ?        ?      113.1        7.9       ?       ? 
1 1 1   35   21    0 o    645.2    4.7 4164.4380  60.6596  4164.4380  60.6596  4164.4380  60.6596      645.2      4.7      645.2        4.7     0.0     0.0 
1 1 1   35   21    1 o    254.5    2.9    0.0000   0.0000          ?        ?   648.0994  14.6860          ?        ?      254.5        2.9       ?       ? 
1 1 1   35   21    2 o     92.5    5.9    0.0000   0.0000          ?        ?    85.5619  10.8549          ?        ?       92.5        5.9       ?       ? 
1 1 1   35   21    3 o    455.9    2.7    0.0000   0.0000          ?        ?  2079.0264  24.2638          ?        ?      455.9        2.7       ?       ? 
1 1 1   35   21    4 o     70.0    8.7    0.0000   0.0000          ?        ?    49.1662  12.1319          ?        ?       70.0        8.7       ?       ? 
1 1 1   35   21    5 o    165.5    4.1    0.0000   0.0000          ?        ?   273.9258  13.4090          ?        ?      165.5        4.1       ?       ? 
1 1 1   35   21    6 o    141.3    4.7    0.0000   0.0000          ?        ?   199.8573  13.4090          ?        ?      141.3        4.7       ?       ? 
1 1 1   35   21    7 o    124.3    5.4    0.0000   0.0000          ?        ?   154.5222  13.4090          ?        ?      124.3        5.4       ?       ? 
1 1 1   35   21    8 o    202.1    3.6    0.0000   0.0000          ?        ?   408.6538  14.6860          ?        ?      202.1        3.6       ?       ? 
1 1 1   35   21    9 o    377.8    2.9    0.0000   0.0000          ?        ?  1427.7344  21.7097          ?        ?      377.8        2.9       ?       ? 
1 1 1   35   21   10 o    289.4    2.4    0.0000   0.0000          ?        ?   837.7404  14.0475          ?        ?      289.4        2.4       ?       ? 
1 1 1   35   21   11 o    108.1    4.4    0.0000   0.0000          ?        ?   116.8494   9.5778          ?        ?      108.1        4.4       ?       ? 
1 1 1   35   21   12 o    425.4    2.3    0.0000   0.0000          ?        ?  1810.2089  19.7942          ?        ?      425.4        2.3       ?       ? 
1 1 1   35   21   13 o    271.7    2.6    0.0000   0.0000          ?        ?   738.1310  14.0475          ?        ?      271.7        2.6       ?       ? 
1 1 1   35   21   14 o    580.7    2.8    0.0000   0.0000          ?        ?  3373.3096  32.5646          ?        ?      580.7        2.8       ?       ? 
1 1 1   35   21   15 o    370.7    2.2    0.0000   0.0000          ?        ?  1374.7371  16.6016          ?        ?      370.7        2.2       ?       ? 
1 1 1   35   21   16 o    521.4    2.5    0.0000   0.0000          ?        ?  2719.4636  26.1794          ?        ?      521.4        2.5       ?       ? 
1 1 1   35   21   17 o    213.2    2.8    0.0000   0.0000          ?        ?   454.6274  12.1319          ?        ?      213.2        2.8       ?       ? 
1 1 1   35   21   18 o    206.8    2.9    0.0000   0.0000          ?        ?   427.8095  12.1319          ?        ?      206.8        2.9       ?       ? 
1 1 1   35   21   19 o    482.9    2.4    0.0000   0.0000          ?        ?  2332.5195  23.6253          ?        ?      482.9        2.4       ?       ? 
1 1 1   35   21   20 o    361.8    2.3    0.0000   0.0000          ?        ?  1309.6079  16.6016          ?        ?      361.8        2.3       ?       ? 
1 1 1   35   21   21 o     35.1   12.7    0.0000   0.0000          ?        ?    10.2163  11.4934          ?        ?       35.1       12.7       ?       ? 
1 1 1   35   21   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   21   23 o    239.0    2.8    0.0000   0.0000          ?        ?   571.4769  13.4090          ?        ?      239.0        2.8       ?       ? 
1 1 1   35   21   24 o     67.7    9.0    0.0000   0.0000          ?        ?    45.9736  12.1319          ?        ?       67.7        9.0       ?       ? 
1 1 1   35   21   25 o    240.3    2.9    0.0000   0.0000          ?        ?   577.8621  14.0475          ?        ?      240.3        2.9       ?       ? 
1 1 1   35   21   26 o     80.6    8.3    0.0000   0.0000          ?        ?    65.1292  13.4090          ?        ?       80.6        8.3       ?       ? 
1 1 1   35   21   27 o    317.9    2.7    0.0000   0.0000          ?        ?  1010.7797  17.2401          ?        ?      317.9        2.7       ?       ? 
1 1 1   35   21   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   21   29 o    379.0    2.6    0.0000   0.0000          ?        ?  1437.3123  19.7942          ?        ?      379.0        2.6       ?       ? 
1 1 1   35   21   30 o     94.7    7.4    0.0000   0.0000          ?        ?    90.0316  14.0475          ?        ?       94.7        7.4       ?       ? 
1 1 1   35   21   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   21   32 o    244.5    3.5    0.0000   0.0000          ?        ?   598.2947  17.2401          ?        ?      244.5        3.5       ?       ? 
1 1 1   35   21   33 o    388.8    2.7    0.0000   0.0000          ?        ?  1512.0193  21.0712          ?        ?      388.8        2.7       ?       ? 
1 1 1   35   21   34 o    116.2    6.6    0.0000   0.0000          ?        ?   135.3666  15.3245          ?        ?      116.2        6.6       ?       ? 
1 1 1   35   21   35 o     23.3   11.2    0.0000   0.0000          ?        ?   -22.9868  15.3245          ?        ?       23.3       11.2       ?       ? 
1 1 1   35   21   36 o     44.8   15.1    0.0000   0.0000          ?        ?    19.1556  15.9630          ?        ?       44.8       15.1       ?       ? 
1 1 1   35   21   37 f    124.1    6.4    0.0000   0.0000          ?        ?   154.5222  15.9630          ?        ?      124.1        6.4       ?       ? 
1 1 1   35   21   38 o    202.5    3.9    0.0000   0.0000          ?        ?   410.5694  15.9630          ?        ?      202.5        3.9       ?       ? 
1 1 1   35   21   39 o    303.8    2.9    0.0000   0.0000          ?        ?   923.3023  17.8786          ?        ?      303.8        2.9       ?       ? 
1 1 1   35   21   40 o    207.3    4.0    0.0000   0.0000          ?        ?   430.3636  16.6016          ?        ?      207.3        4.0       ?       ? 
1 1 1   35   21   41 o    182.6    4.5    0.0000   0.0000          ?        ?   333.9468  16.6016          ?        ?      182.6        4.5       ?       ? 
1 1 1   35   21   42 o    205.9    4.2    0.0000   0.0000          ?        ?   424.6169  17.2401          ?        ?      205.9        4.2       ?       ? 
1 1 1   35   21   43 o     40.6   15.4    0.0000   0.0000          ?        ?    12.1319  17.2401          ?        ?       40.6       15.4       ?       ? 
1 1 1   35   21   44 o    496.2    2.7    0.0000   0.0000          ?        ?  2463.4163  26.8179          ?        ?      496.2        2.7       ?       ? 
1 1 1   35   21   45 f    222.3    4.0    0.0000   0.0000          ?        ?   494.8542  17.8786          ?        ?      222.3        4.0       ?       ? 
1 1 1   35   21   46 o    138.6    6.2    0.0000   0.0000          ?        ?   192.8335  17.2401          ?        ?      138.6        6.2       ?       ? 
1 1 1   35   21   47 o    129.7    6.9    0.0000   0.0000          ?        ?   169.2082  17.8786          ?        ?      129.7        6.9       ?       ? 
1 1 1   35   21   48 o     35.6   14.9    0.0000   0.0000          ?        ?     2.5541  17.8786          ?        ?       35.6       14.9       ?       ? 
1 1 1   35   21   49 o     30.7   13.6    0.0000   0.0000          ?        ?    -5.1082  16.6016          ?        ?       30.7       13.6       ?       ? 
1 1 1   35   21   50 o    381.9    2.9    0.0000   0.0000          ?        ?  1460.2990  22.3483          ?        ?      381.9        2.9       ?       ? 
1 1 1   35   21   51 o    153.9    6.0    0.0000   0.0000          ?        ?   238.1686  18.5171          ?        ?      153.9        6.0       ?       ? 
1 1 1   35   21   52 o    253.9    3.8    0.0000   0.0000          ?        ?   646.1838  19.1556          ?        ?      253.9        3.8       ?       ? 
1 1 1   35   21   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   21   54 o     69.1   12.5    0.0000   0.0000          ?        ?    50.4432  16.6016          ?        ?       69.1       12.5       ?       ? 
1 1 1   35   21   55 o     99.7    9.0    0.0000   0.0000          ?        ?   100.8864  17.8786          ?        ?       99.7        9.0       ?       ? 
1 1 1   35   21   56 o     22.2   10.9    0.0000   0.0000          ?        ?   -35.7572  17.2401          ?        ?       22.2       10.9       ?       ? 
1 1 1   35   22    0 o    123.5    6.2  153.8837  15.3245   153.8837  15.3245   153.8837  15.3245      123.5      6.2      123.5        6.2     0.0     0.0 
1 1 1   35   22    1 o     99.4    5.1    0.0000   0.0000          ?        ?    98.9709  10.2163          ?        ?       99.4        5.1       ?       ? 
1 1 1   35   22    2 o    125.3    4.1    0.0000   0.0000          ?        ?   157.0763  10.2163          ?        ?      125.3        4.1       ?       ? 
1 1 1   35   22    3 o    304.9    2.9    0.0000   0.0000          ?        ?   929.6875  17.8786          ?        ?      304.9        2.9       ?       ? 
1 1 1   35   22    4 o    250.9    3.2    0.0000   0.0000          ?        ?   629.5823  15.9630          ?        ?      250.9        3.2       ?       ? 
1 1 1   35   22    5 o    258.4    3.1    0.0000   0.0000          ?        ?   667.8936  15.9630          ?        ?      258.4        3.1       ?       ? 
1 1 1   35   22    6 o    178.3    3.6    0.0000   0.0000          ?        ?   317.9838  12.7704          ?        ?      178.3        3.6       ?       ? 
1 1 1   35   22    7 o     58.1    9.3    0.0000   0.0000          ?        ?    33.8416  10.8549          ?        ?       58.1        9.3       ?       ? 
1 1 1   35   22    8 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   22    9 o    234.8    3.0    0.0000   0.0000          ?        ?   551.6827  14.0475          ?        ?      234.8        3.0       ?       ? 
1 1 1   35   22   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   22   11 o    103.2    4.9    0.0000   0.0000          ?        ?   106.6331  10.2163          ?        ?      103.2        4.9       ?       ? 
1 1 1   35   22   12 o    255.7    2.6    0.0000   0.0000          ?        ?   653.8461  13.4090          ?        ?      255.7        2.6       ?       ? 
1 1 1   35   22   13 o    380.2    2.4    0.0000   0.0000          ?        ?  1445.6129  17.8786          ?        ?      380.2        2.4       ?       ? 
1 1 1   35   22   14 o    303.1    2.6    0.0000   0.0000          ?        ?   918.8326  15.9630          ?        ?      303.1        2.6       ?       ? 
1 1 1   35   22   15 o    114.6    5.3    0.0000   0.0000          ?        ?   131.5355  12.1319          ?        ?      114.6        5.3       ?       ? 
1 1 1   35   22   16 o    348.0    2.4    0.0000   0.0000          ?        ?  1211.2755  16.6016          ?        ?      348.0        2.4       ?       ? 
1 1 1   35   22   17 o    152.0    3.4    0.0000   0.0000          ?        ?   231.1448  10.2163          ?        ?      152.0        3.4       ?       ? 
1 1 1   35   22   18 o    225.3    2.8    0.0000   0.0000          ?        ?   507.6247  12.7704          ?        ?      225.3        2.8       ?       ? 
1 1 1   35   22   19 o     66.3    8.2    0.0000   0.0000          ?        ?    44.0580  10.8549          ?        ?       66.3        8.2       ?       ? 
1 1 1   35   22   20 o    203.7    3.0    0.0000   0.0000          ?        ?   415.0391  12.1319          ?        ?      203.7        3.0       ?       ? 
1 1 1   35   22   21 o    235.4    2.8    0.0000   0.0000          ?        ?   554.2368  13.4090          ?        ?      235.4        2.8       ?       ? 
1 1 1   35   22   22 o     25.7   11.3    0.0000   0.0000          ?        ?    -3.8311  11.4934          ?        ?       25.7       11.3       ?       ? 
1 1 1   35   22   23 o    252.4    2.7    0.0000   0.0000          ?        ?   637.2446  13.4090          ?        ?      252.4        2.7       ?       ? 
1 1 1   35   22   24 o     20.8    9.9    0.0000   0.0000          ?        ?   -15.3245  11.4934          ?        ?       20.8        9.9       ?       ? 
1 1 1   35   22   25 o     96.8    6.3    0.0000   0.0000          ?        ?    93.8627  12.1319          ?        ?       96.8        6.3       ?       ? 
1 1 1   35   22   26 o    447.0    2.4    0.0000   0.0000          ?        ?  1998.5726  21.0712          ?        ?      447.0        2.4       ?       ? 
1 1 1   35   22   27 o    351.9    2.5    0.0000   0.0000          ?        ?  1238.7319  17.8786          ?        ?      351.9        2.5       ?       ? 
1 1 1   35   22   28 o    110.9    6.0    0.0000   0.0000          ?        ?   123.2347  13.4090          ?        ?      110.9        6.0       ?       ? 
1 1 1   35   22   29 o    414.9    2.5    0.0000   0.0000          ?        ?  1722.0929  20.4327          ?        ?      414.9        2.5       ?       ? 
1 1 1   35   22   30 o    433.3    2.7    0.0000   0.0000          ?        ?  1877.8921  22.9868          ?        ?      433.3        2.7       ?       ? 
1 1 1   35   22   31 o     30.3   12.8    0.0000   0.0000          ?        ?     0.6385  13.4090          ?        ?       30.3       12.8       ?       ? 
1 1 1   35   22   32 o    238.3    3.3    0.0000   0.0000          ?        ?   568.2842  15.9630          ?        ?      238.3        3.3       ?       ? 
1 1 1   35   22   33 o    178.0    4.3    0.0000   0.0000          ?        ?   317.3452  15.3245          ?        ?      178.0        4.3       ?       ? 
1 1 1   35   22   34 o    163.2    4.9    0.0000   0.0000          ?        ?   266.9020  15.9630          ?        ?      163.2        4.9       ?       ? 
1 1 1   35   22   35 o    167.3    4.6    0.0000   0.0000          ?        ?   280.3110  15.3245          ?        ?      167.3        4.6       ?       ? 
1 1 1   35   22   36 o    193.1    4.5    0.0000   0.0000          ?        ?   373.5352  17.2401          ?        ?      193.1        4.5       ?       ? 
1 1 1   35   22   37 o    145.2    5.5    0.0000   0.0000          ?        ?   211.3506  15.9630          ?        ?      145.2        5.5       ?       ? 
1 1 1   35   22   38 o    206.4    4.3    0.0000   0.0000          ?        ?   426.5325  17.8786          ?        ?      206.4        4.3       ?       ? 
1 1 1   35   22   39 o    312.1    3.1    0.0000   0.0000          ?        ?   975.0225  19.1556          ?        ?      312.1        3.1       ?       ? 
1 1 1   35   22   40 o    194.8    4.6    0.0000   0.0000          ?        ?   379.9204  17.8786          ?        ?      194.8        4.6       ?       ? 
1 1 1   35   22   41 o    297.4    3.0    0.0000   0.0000          ?        ?   884.9910  17.8786          ?        ?      297.4        3.0       ?       ? 
1 1 1   35   22   42 o    169.7    5.1    0.0000   0.0000          ?        ?   288.6118  17.2401          ?        ?      169.7        5.1       ?       ? 
1 1 1   35   22   43 o    183.9    4.7    0.0000   0.0000          ?        ?   339.0550  17.2401          ?        ?      183.9        4.7       ?       ? 
1 1 1   35   22   44 o    264.0    3.6    0.0000   0.0000          ?        ?   697.9042  19.1556          ?        ?      264.0        3.6       ?       ? 
1 1 1   35   22   45 o    355.3    3.0    0.0000   0.0000          ?        ?  1263.6343  21.0712          ?        ?      355.3        3.0       ?       ? 
1 1 1   35   22   46 o     22.2   10.9    0.0000   0.0000          ?        ?   -36.3957  17.2401          ?        ?       22.2       10.9       ?       ? 
1 1 1   35   22   47 o     95.1    9.4    0.0000   0.0000          ?        ?    91.3086  17.8786          ?        ?       95.1        9.4       ?       ? 
1 1 1   35   22   48 o    127.7    7.0    0.0000   0.0000          ?        ?   164.1001  17.8786          ?        ?      127.7        7.0       ?       ? 
1 1 1   35   22   49 o     30.1   13.6    0.0000   0.0000          ?        ?    -8.3008  17.2401          ?        ?       30.1       13.6       ?       ? 
1 1 1   35   22   50 o    233.9    4.1    0.0000   0.0000          ?        ?   548.4901  19.1556          ?        ?      233.9        4.1       ?       ? 
1 1 1   35   22   51 o     26.3   12.5    0.0000   0.0000          ?        ?   -21.7097  17.8786          ?        ?       26.3       12.5       ?       ? 
1 1 1   35   22   52 o    143.8    6.2    0.0000   0.0000          ?        ?   208.1580  17.8786          ?        ?      143.8        6.2       ?       ? 
1 1 1   35   22   53 o    151.3    5.9    0.0000   0.0000          ?        ?   230.5063  17.8786          ?        ?      151.3        5.9       ?       ? 
1 1 1   35   22   54 o    149.2    6.0    0.0000   0.0000          ?        ?   224.1211  17.8786          ?        ?      149.2        6.0       ?       ? 
1 1 1   35   23    0 o    160.8    6.4  259.8783  20.4327   259.8783  20.4327   259.8783  20.4327      160.8      6.4      160.8        6.4     0.0     0.0 
1 1 1   35   23    1 o     79.8    6.4    0.0000   0.0000          ?        ?    63.8522  10.2163          ?        ?       79.8        6.4       ?       ? 
1 1 1   35   23    2 o    166.6    3.6    0.0000   0.0000          ?        ?   277.7569  12.1319          ?        ?      166.6        3.6       ?       ? 
1 1 1   35   23    3 o    162.4    3.7    0.0000   0.0000          ?        ?   263.7094  12.1319          ?        ?      162.4        3.7       ?       ? 
1 1 1   35   23    4 f    703.4    3.5    0.0000   0.0000          ?        ?  4950.4580  49.8047          ?        ?      703.4        3.5       ?       ? 
1 1 1   35   23    5 o    467.2    2.9    0.0000   0.0000          ?        ?  2183.1055  26.8179          ?        ?      467.2        2.9       ?       ? 
1 1 1   35   23    6 o    373.0    2.7    0.0000   0.0000          ?        ?  1391.3386  20.4327          ?        ?      373.0        2.7       ?       ? 
1 1 1   35   23    7 o    328.4    2.8    0.0000   0.0000          ?        ?  1078.4630  18.5171          ?        ?      328.4        2.8       ?       ? 
1 1 1   35   23    8 o    508.7    2.8    0.0000   0.0000          ?        ?  2588.5667  28.0950          ?        ?      508.7        2.8       ?       ? 
1 1 1   35   23    9 o    406.8    2.7    0.0000   0.0000          ?        ?  1655.0481  21.7097          ?        ?      406.8        2.7       ?       ? 
1 1 1   35   23   10 o    331.6    2.7    0.0000   0.0000          ?        ?  1100.1727  17.8786          ?        ?      331.6        2.7       ?       ? 
1 1 1   35   23   11 o    196.7    2.9    0.0000   0.0000          ?        ?   386.9441  11.4934          ?        ?      196.7        2.9       ?       ? 
1 1 1   35   23   12 o    591.5    3.0    0.0000   0.0000          ?        ?  3499.7368  35.7572          ?        ?      591.5        3.0       ?       ? 
1 1 1   35   23   13 o    184.4    3.3    0.0000   0.0000          ?        ?   340.3320  12.1319          ?        ?      184.4        3.3       ?       ? 
1 1 1   35   23   14 o    248.7    2.7    0.0000   0.0000          ?        ?   618.7275  13.4090          ?        ?      248.7        2.7       ?       ? 
1 1 1   35   23   15 o    276.4    2.5    0.0000   0.0000          ?        ?   764.3104  14.0475          ?        ?      276.4        2.5       ?       ? 
1 1 1   35   23   16 o    332.9    2.2    0.0000   0.0000          ?        ?  1108.4736  14.6860          ?        ?      332.9        2.2       ?       ? 
1 1 1   35   23   17 f    374.2    2.4    0.0000   0.0000          ?        ?  1400.2780  17.8786          ?        ?      374.2        2.4       ?       ? 
1 1 1   35   23   18 f    342.2    2.5    0.0000   0.0000          ?        ?  1171.0486  17.2401          ?        ?      342.2        2.5       ?       ? 
1 1 1   35   23   19 o    129.8    4.4    0.0000   0.0000          ?        ?   168.5697  11.4934          ?        ?      129.8        4.4       ?       ? 
1 1 1   35   23   20 o     18.7    9.1    0.0000   0.0000          ?        ?   -19.1556  10.8549          ?        ?       18.7        9.1       ?       ? 
1 1 1   35   23   21 o    220.1    2.9    0.0000   0.0000          ?        ?   484.6379  12.7704          ?        ?      220.1        2.9       ?       ? 
1 1 1   35   23   22 f    392.8    2.4    0.0000   0.0000          ?        ?  1543.3068  19.1556          ?        ?      392.8        2.4       ?       ? 
1 1 1   35   23   23 o     22.6   10.4    0.0000   0.0000          ?        ?    -8.3008  10.8549          ?        ?       22.6       10.4       ?       ? 
1 1 1   35   23   24 o    271.5    2.7    0.0000   0.0000          ?        ?   737.4925  14.6860          ?        ?      271.5        2.7       ?       ? 
1 1 1   35   23   25 o    151.1    4.2    0.0000   0.0000          ?        ?   228.5907  12.7704          ?        ?      151.1        4.2       ?       ? 
1 1 1   35   23   26 o    114.3    5.9    0.0000   0.0000          ?        ?   130.8969  13.4090          ?        ?      114.3        5.9       ?       ? 
1 1 1   35   23   27 o    411.3    2.6    0.0000   0.0000          ?        ?  1692.0823  21.0712          ?        ?      411.3        2.6       ?       ? 
1 1 1   35   23   28 o     94.8    6.7    0.0000   0.0000          ?        ?    90.0316  12.7704          ?        ?       94.8        6.7       ?       ? 
1 1 1   35   23   29 o    152.6    4.6    0.0000   0.0000          ?        ?   233.0604  14.0475          ?        ?      152.6        4.6       ?       ? 
1 1 1   35   23   30 o     19.4    9.6    0.0000   0.0000          ?        ?   -37.0343  14.6860          ?        ?       19.4        9.6       ?       ? 
1 1 1   35   23   31 o    135.7    5.4    0.0000   0.0000          ?        ?   184.5327  14.6860          ?        ?      135.7        5.4       ?       ? 
1 1 1   35   23   32 o    291.8    2.8    0.0000   0.0000          ?        ?   851.7878  16.6016          ?        ?      291.8        2.8       ?       ? 
1 1 1   35   23   33 o    364.6    2.6    0.0000   0.0000          ?        ?  1330.0405  19.1556          ?        ?      364.6        2.6       ?       ? 
1 1 1   35   23   34 o    375.6    2.8    0.0000   0.0000          ?        ?  1411.7714  21.0712          ?        ?      375.6        2.8       ?       ? 
1 1 1   35   23   35 o    264.0    3.4    0.0000   0.0000          ?        ?   697.2656  17.8786          ?        ?      264.0        3.4       ?       ? 
1 1 1   35   23   36 o    106.1    7.2    0.0000   0.0000          ?        ?   113.0183  15.3245          ?        ?      106.1        7.2       ?       ? 
1 1 1   35   23   37 o    611.6    2.8    0.0000   0.0000          ?        ?  3743.0139  33.8416          ?        ?      611.6        2.8       ?       ? 
1 1 1   35   23   38 o    413.2    2.8    0.0000   0.0000          ?        ?  1708.6840  22.9868          ?        ?      413.2        2.8       ?       ? 
1 1 1   35   23   39 o     20.4   10.2    0.0000   0.0000          ?        ?   -51.0817  17.8786          ?        ?       20.4       10.2       ?       ? 
1 1 1   35   23   40 o    140.0    5.9    0.0000   0.0000          ?        ?   196.6647  16.6016          ?        ?      140.0        5.9       ?       ? 
1 1 1   35   23   41 o     27.8   12.8    0.0000   0.0000          ?        ?   -12.7704  16.6016          ?        ?       27.8       12.8       ?       ? 
1 1 1   35   23   42 o    218.9    4.2    0.0000   0.0000          ?        ?   480.1682  18.5171          ?        ?      218.9        4.2       ?       ? 
1 1 1   35   23   43 o    121.4    7.1    0.0000   0.0000          ?        ?   148.1370  17.2401          ?        ?      121.4        7.1       ?       ? 
1 1 1   35   23   44 o    116.0    7.7    0.0000   0.0000          ?        ?   135.3666  17.8786          ?        ?      116.0        7.7       ?       ? 
1 1 1   35   23   45 o     20.0   10.0    0.0000   0.0000          ?        ?   -53.6358  17.8786          ?        ?       20.0       10.0       ?       ? 
1 1 1   35   23   46 o    402.5    2.9    0.0000   0.0000          ?        ?  1621.8450  22.9868          ?        ?      402.5        2.9       ?       ? 
1 1 1   35   23   47 o     58.9   15.1    0.0000   0.0000          ?        ?    37.0343  17.8786          ?        ?       58.9       15.1       ?       ? 
1 1 1   35   23   48 o     25.1   12.0    0.0000   0.0000          ?        ?   -23.6253  17.2401          ?        ?       25.1       12.0       ?       ? 
1 1 1   35   23   49 o     81.3   10.2    0.0000   0.0000          ?        ?    67.0448  16.6016          ?        ?       81.3       10.2       ?       ? 
1 1 1   35   23   50 o    156.8    5.5    0.0000   0.0000          ?        ?   247.1079  17.2401          ?        ?      156.8        5.5       ?       ? 
1 1 1   35   23   51 o    173.9    5.3    0.0000   0.0000          ?        ?   303.9363  18.5171          ?        ?      173.9        5.3       ?       ? 
1 1 1   35   23   52 o    266.8    3.8    0.0000   0.0000          ?        ?   713.8672  20.4327          ?        ?      266.8        3.8       ?       ? 
1 1 1   35   23   53 o    141.4    6.5    0.0000   0.0000          ?        ?   201.7728  18.5171          ?        ?      141.4        6.5       ?       ? 
1 1 1   35   24    0 o    426.7    4.3 1821.7021  36.3957  1821.7021  36.3957  1821.7021  36.3957      426.7      4.3      426.7        4.3     0.0     0.0 
1 1 1   35   24    1 o    203.4    3.1    0.0000   0.0000          ?        ?   413.7620  12.7704          ?        ?      203.4        3.1       ?       ? 
1 1 1   35   24    2 o    316.7    2.6    0.0000   0.0000          ?        ?  1003.1175  16.6016          ?        ?      316.7        2.6       ?       ? 
1 1 1   35   24    3 o    265.7    3.6    0.0000   0.0000          ?        ?   706.2049  19.1556          ?        ?      265.7        3.6       ?       ? 
1 1 1   35   24    4 o    347.0    3.3    0.0000   0.0000          ?        ?  1204.8903  22.9868          ?        ?      347.0        3.3       ?       ? 
1 1 1   35   24    5 o    298.7    2.6    0.0000   0.0000          ?        ?   892.6533  15.3245          ?        ?      298.7        2.6       ?       ? 
1 1 1   35   24    6 o    525.2    2.8    0.0000   0.0000          ?        ?  2759.0520  29.3720          ?        ?      525.2        2.8       ?       ? 
1 1 1   35   24    7 o    189.7    3.0    0.0000   0.0000          ?        ?   360.1262  11.4934          ?        ?      189.7        3.0       ?       ? 
1 1 1   35   24    8 o    288.4    2.7    0.0000   0.0000          ?        ?   831.9937  15.3245          ?        ?      288.4        2.7       ?       ? 
1 1 1   35   24    9 o    451.1    2.7    0.0000   0.0000          ?        ?  2035.6068  24.2638          ?        ?      451.1        2.7       ?       ? 
1 1 1   35   24   10 o    448.6    2.8    0.0000   0.0000          ?        ?  2012.6202  24.9023          ?        ?      448.6        2.8       ?       ? 
1 1 1   35   24   11 o    421.7    2.6    0.0000   0.0000          ?        ?  1778.9213  21.7097          ?        ?      421.7        2.6       ?       ? 
1 1 1   35   24   12 o    569.0    2.9    0.0000   0.0000          ?        ?  3238.5818  33.2031          ?        ?      569.0        2.9       ?       ? 
1 1 1   35   24   13 o    103.5    5.2    0.0000   0.0000          ?        ?   107.2716  10.8549          ?        ?      103.5        5.2       ?       ? 
1 1 1   35   24   14 o    274.9    2.6    0.0000   0.0000          ?        ?   756.0096  14.0475          ?        ?      274.9        2.6       ?       ? 
1 1 1   35   24   15 o    429.9    2.7    0.0000   0.0000          ?        ?  1848.5201  22.9868          ?        ?      429.9        2.7       ?       ? 
1 1 1   35   24   16 o    470.2    2.6    0.0000   0.0000          ?        ?  2211.2002  24.9023          ?        ?      470.2        2.6       ?       ? 
1 1 1   35   24   17 o    223.3    2.6    0.0000   0.0000          ?        ?   498.6854  11.4934          ?        ?      223.3        2.6       ?       ? 
1 1 1   35   24   18 o    330.1    2.4    0.0000   0.0000          ?        ?  1089.9564  15.9630          ?        ?      330.1        2.4       ?       ? 
1 1 1   35   24   19 o    537.6    2.6    0.0000   0.0000          ?        ?  2891.2258  28.0950          ?        ?      537.6        2.6       ?       ? 
1 1 1   35   24   20 o    385.8    2.5    0.0000   0.0000          ?        ?  1489.0325  19.1556          ?        ?      385.8        2.5       ?       ? 
1 1 1   35   24   21 o    281.7    2.5    0.0000   0.0000          ?        ?   793.6824  14.0475          ?        ?      281.7        2.5       ?       ? 
1 1 1   35   24   22 o     31.8   12.7    0.0000   0.0000          ?        ?     5.1082  12.1319          ?        ?       31.8       12.7       ?       ? 
1 1 1   35   24   23 o    631.3    2.7    0.0000   0.0000          ?        ?  3987.5676  33.8416          ?        ?      631.3        2.7       ?       ? 
1 1 1   35   24   24 o    361.5    2.6    0.0000   0.0000          ?        ?  1307.0537  18.5171          ?        ?      361.5        2.6       ?       ? 
1 1 1   35   24   25 f     16.0    8.0    0.0000   0.0000          ?        ?   -35.1187  11.4934          ?        ?       16.0        8.0       ?       ? 
1 1 1   35   24   26 o    344.1    2.5    0.0000   0.0000          ?        ?  1184.4576  17.2401          ?        ?      344.1        2.5       ?       ? 
1 1 1   35   24   27 o     26.3   11.8    0.0000   0.0000          ?        ?    -5.7467  12.7704          ?        ?       26.3       11.8       ?       ? 
1 1 1   35   24   28 o    413.5    2.5    0.0000   0.0000          ?        ?  1710.5994  21.0712          ?        ?      413.5        2.5       ?       ? 
1 1 1   35   24   29 o    198.7    3.7    0.0000   0.0000          ?        ?   395.2449  14.6860          ?        ?      198.7        3.7       ?       ? 
1 1 1   35   24   30 o    581.4    2.7    0.0000   0.0000          ?        ?  3382.2490  31.9261          ?        ?      581.4        2.7       ?       ? 
1 1 1   35   24   31 o    271.7    3.1    0.0000   0.0000          ?        ?   738.7695  16.6016          ?        ?      271.7        3.1       ?       ? 
1 1 1   35   24   32 o    258.8    3.1    0.0000   0.0000          ?        ?   670.4477  15.9630          ?        ?      258.8        3.1       ?       ? 
1 1 1   35   24   33 o    206.1    3.7    0.0000   0.0000          ?        ?   425.2554  15.3245          ?        ?      206.1        3.7       ?       ? 
1 1 1   35   24   34 o    237.8    3.4    0.0000   0.0000          ?        ?   565.7302  15.9630          ?        ?      237.8        3.4       ?       ? 
1 1 1   35   24   35 o    177.5    4.5    0.0000   0.0000          ?        ?   315.4297  15.9630          ?        ?      177.5        4.5       ?       ? 
1 1 1   35   24   36 o     25.5   12.0    0.0000   0.0000          ?        ?   -15.3245  15.3245          ?        ?       25.5       12.0       ?       ? 
1 1 1   35   24   37 o    159.8    5.4    0.0000   0.0000          ?        ?   256.0471  17.2401          ?        ?      159.8        5.4       ?       ? 
1 1 1   35   24   38 o    140.7    5.9    0.0000   0.0000          ?        ?   198.5802  16.6016          ?        ?      140.7        5.9       ?       ? 
1 1 1   35   24   39 o     54.0   14.9    0.0000   0.0000          ?        ?    30.6490  16.6016          ?        ?       54.0       14.9       ?       ? 
1 1 1   35   24   40 o    151.4    5.3    0.0000   0.0000          ?        ?   229.8678  15.9630          ?        ?      151.4        5.3       ?       ? 
1 1 1   35   24   41 o     74.0   11.6    0.0000   0.0000          ?        ?    55.5514  17.2401          ?        ?       74.0       11.6       ?       ? 
1 1 1   35   24   42 o    344.7    3.0    0.0000   0.0000          ?        ?  1188.9272  20.4327          ?        ?      344.7        3.0       ?       ? 
1 1 1   35   24   43 f     26.1   12.3    0.0000   0.0000          ?        ?   -17.8786  16.6016          ?        ?       26.1       12.3       ?       ? 
1 1 1   35   24   44 o     19.1    9.6    0.0000   0.0000          ?        ?   -51.0817  16.6016          ?        ?       19.1        9.6       ?       ? 
1 1 1   35   24   45 o    172.2    5.2    0.0000   0.0000          ?        ?   297.5511  17.8786          ?        ?      172.2        5.2       ?       ? 
1 1 1   35   24   46 o     60.9   14.4    0.0000   0.0000          ?        ?    39.5883  17.2401          ?        ?       60.9       14.4       ?       ? 
1 1 1   35   24   47 o    132.9    6.2    0.0000   0.0000          ?        ?   177.5090  16.6016          ?        ?      132.9        6.2       ?       ? 
1 1 1   35   24   48 o    183.6    4.9    0.0000   0.0000          ?        ?   338.4165  17.8786          ?        ?      183.6        4.9       ?       ? 
1 1 1   35   24   49 o    128.8    6.9    0.0000   0.0000          ?        ?   167.2927  17.8786          ?        ?      128.8        6.9       ?       ? 
1 1 1   35   24   50 o     20.7   10.3    0.0000   0.0000          ?        ?   -48.5276  17.8786          ?        ?       20.7       10.3       ?       ? 
1 1 1   35   24   51 o    237.8    4.0    0.0000   0.0000          ?        ?   567.0072  19.1556          ?        ?      237.8        4.0       ?       ? 
1 1 1   35   24   52 f    253.8    3.8    0.0000   0.0000          ?        ?   646.1838  19.1556          ?        ?      253.8        3.8       ?       ? 
1 1 1   35   25    0 o    262.8    7.1  692.7960  37.0343   692.7960  37.0343   692.7960  37.0343      262.8      7.1      262.8        7.1     0.0     0.0 
1 1 1   35   25    1 f    640.6    4.3    0.0000   0.0000          ?        ?  4106.9712  55.5514          ?        ?      640.6        4.3       ?       ? 
1 1 1   35   25    2 f    188.4    5.9    0.0000   0.0000          ?        ?   355.6566  22.3483          ?        ?      188.4        5.9       ?       ? 
1 1 1   35   25    3 o    340.3    3.6    0.0000   0.0000          ?        ?  1158.9167  24.2638          ?        ?      340.3        3.6       ?       ? 
1 1 1   35   25    4 o    219.2    4.2    0.0000   0.0000          ?        ?   480.8068  18.5171          ?        ?      219.2        4.2       ?       ? 
1 1 1   35   25    5 o    505.1    3.2    0.0000   0.0000          ?        ?  2552.1709  31.9261          ?        ?      505.1        3.2       ?       ? 
1 1 1   35   25    6 o     23.9   11.1    0.0000   0.0000          ?        ?   -11.4934  12.7704          ?        ?       23.9       11.1       ?       ? 
1 1 1   35   25    7 o    172.4    4.6    0.0000   0.0000          ?        ?   297.5511  15.9630          ?        ?      172.4        4.6       ?       ? 
1 1 1   35   25    8 o     93.0    8.6    0.0000   0.0000          ?        ?    86.8389  15.9630          ?        ?       93.0        8.6       ?       ? 
1 1 1   35   25    9 o    421.1    2.9    0.0000   0.0000          ?        ?  1773.8130  24.2638          ?        ?      421.1        2.9       ?       ? 
1 1 1   35   25   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   25   11 o     15.9    8.0    0.0000   0.0000          ?        ?   -35.7572  11.4934          ?        ?       15.9        8.0       ?       ? 
1 1 1   35   25   12 f    167.0    3.1    0.0000   0.0000          ?        ?   279.0340  10.2163          ?        ?      167.0        3.1       ?       ? 
1 1 1   35   25   13 o     29.8   11.7    0.0000   0.0000          ?        ?     5.1082  10.2163          ?        ?       29.8       11.7       ?       ? 
1 1 1   35   25   14 o    262.8    2.7    0.0000   0.0000          ?        ?   690.8804  14.0475          ?        ?      262.8        2.7       ?       ? 
1 1 1   35   25   15 f     98.4    5.5    0.0000   0.0000          ?        ?    97.0553  10.8549          ?        ?       98.4        5.5       ?       ? 
1 1 1   35   25   16 o     26.7   11.6    0.0000   0.0000          ?        ?    -1.9156  11.4934          ?        ?       26.7       11.6       ?       ? 
1 1 1   35   25   17 o    351.8    2.7    0.0000   0.0000          ?        ?  1238.0934  19.1556          ?        ?      351.8        2.7       ?       ? 
1 1 1   35   25   18 o    380.0    2.4    0.0000   0.0000          ?        ?  1444.3359  18.5171          ?        ?      380.0        2.4       ?       ? 
1 1 1   35   25   19 o    358.7    2.4    0.0000   0.0000          ?        ?  1287.2596  17.2401          ?        ?      358.7        2.4       ?       ? 
1 1 1   35   25   20 o    165.3    3.7    0.0000   0.0000          ?        ?   273.2873  12.1319          ?        ?      165.3        3.7       ?       ? 
1 1 1   35   25   21 o    160.9    3.6    0.0000   0.0000          ?        ?   259.2398  11.4934          ?        ?      160.9        3.6       ?       ? 
1 1 1   35   25   22 o    214.4    3.0    0.0000   0.0000          ?        ?   459.7356  12.7704          ?        ?      214.4        3.0       ?       ? 
1 1 1   35   25   23 o    130.2    5.1    0.0000   0.0000          ?        ?   169.8468  13.4090          ?        ?      130.2        5.1       ?       ? 
1 1 1   35   25   24 o    432.2    2.4    0.0000   0.0000          ?        ?  1868.9529  21.0712          ?        ?      432.2        2.4       ?       ? 
1 1 1   35   25   25 f    354.1    2.5    0.0000   0.0000          ?        ?  1254.0564  17.8786          ?        ?      354.1        2.5       ?       ? 
1 1 1   35   25   26 o     25.5   11.4    0.0000   0.0000          ?        ?    -5.7467  12.1319          ?        ?       25.5       11.4       ?       ? 
1 1 1   35   25   27 o    271.6    2.8    0.0000   0.0000          ?        ?   738.1310  15.3245          ?        ?      271.6        2.8       ?       ? 
1 1 1   35   25   28 o    426.6    2.6    0.0000   0.0000          ?        ?  1821.0637  22.3483          ?        ?      426.6        2.6       ?       ? 
1 1 1   35   25   29 o     37.0   13.9    0.0000   0.0000          ?        ?    10.2163  14.0475          ?        ?       37.0       13.9       ?       ? 
1 1 1   35   25   30 o    364.9    2.6    0.0000   0.0000          ?        ?  1331.9562  19.1556          ?        ?      364.9        2.6       ?       ? 
1 1 1   35   25   31 o     17.9    9.0    0.0000   0.0000          ?        ?   -41.5039  14.0475          ?        ?       17.9        9.0       ?       ? 
1 1 1   35   25   32 o    387.2    2.6    0.0000   0.0000          ?        ?  1499.8872  20.4327          ?        ?      387.2        2.6       ?       ? 
1 1 1   35   25   33 o    141.7    5.2    0.0000   0.0000          ?        ?   201.1343  14.6860          ?        ?      141.7        5.2       ?       ? 
1 1 1   35   25   34 o    182.8    4.2    0.0000   0.0000          ?        ?   334.5853  15.3245          ?        ?      182.8        4.2       ?       ? 
1 1 1   35   25   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   25   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   25   37 o    193.9    4.4    0.0000   0.0000          ?        ?   376.7278  17.2401          ?        ?      193.9        4.4       ?       ? 
1 1 1   35   25   38 o    273.4    3.2    0.0000   0.0000          ?        ?   748.3474  17.2401          ?        ?      273.4        3.2       ?       ? 
1 1 1   35   25   39 o    152.2    5.7    0.0000   0.0000          ?        ?   232.4219  17.2401          ?        ?      152.2        5.7       ?       ? 
1 1 1   35   25   40 o    258.7    3.5    0.0000   0.0000          ?        ?   669.8092  17.8786          ?        ?      258.7        3.5       ?       ? 
1 1 1   35   25   41 o     96.8    8.6    0.0000   0.0000          ?        ?    94.5012  16.6016          ?        ?       96.8        8.6       ?       ? 
1 1 1   35   25   42 o    158.6    5.2    0.0000   0.0000          ?        ?   252.2160  16.6016          ?        ?      158.6        5.2       ?       ? 
1 1 1   35   25   43 o    232.6    3.8    0.0000   0.0000          ?        ?   542.1049  17.8786          ?        ?      232.6        3.8       ?       ? 
1 1 1   35   25   44 o    280.6    3.2    0.0000   0.0000          ?        ?   788.5742  17.8786          ?        ?      280.6        3.2       ?       ? 
1 1 1   35   25   45 o    573.4    2.7    0.0000   0.0000          ?        ?  3291.5791  31.2876          ?        ?      573.4        2.7       ?       ? 
1 1 1   35   25   46 o     78.4   11.0    0.0000   0.0000          ?        ?    62.5751  17.2401          ?        ?       78.4       11.0       ?       ? 
1 1 1   35   25   47 o    145.2    6.2    0.0000   0.0000          ?        ?   211.9892  17.8786          ?        ?      145.2        6.2       ?       ? 
1 1 1   35   25   48 o    274.9    3.5    0.0000   0.0000          ?        ?   757.2866  19.1556          ?        ?      274.9        3.5       ?       ? 
1 1 1   35   25   49 o     35.8   14.8    0.0000   0.0000          ?        ?     4.4697  17.2401          ?        ?       35.8       14.8       ?       ? 
1 1 1   35   25   50 o    106.8    8.1    0.0000   0.0000          ?        ?   115.5724  17.2401          ?        ?      106.8        8.1       ?       ? 
1 1 1   35   25   51 o    219.6    4.2    0.0000   0.0000          ?        ?   483.9994  18.5171          ?        ?      219.6        4.2       ?       ? 
1 1 1   35   26    0 o    137.5   15.7  197.3032  42.1424   197.3032  42.1424   197.3032  42.1424      137.5     15.7      137.5       15.7     0.0     0.0 
1 1 1   35   26    1 f    325.3    4.4    0.0000   0.0000          ?        ?  1059.3074  28.7335          ?        ?      325.3        4.4       ?       ? 
1 1 1   35   26    2 o    326.8    3.9    0.0000   0.0000          ?        ?  1068.8851  25.5409          ?        ?      326.8        3.9       ?       ? 
1 1 1   35   26    3 o    143.4    7.8    0.0000   0.0000          ?        ?   206.2425  22.3483          ?        ?      143.4        7.8       ?       ? 
1 1 1   35   26    4 f    257.6    4.5    0.0000   0.0000          ?        ?   664.0625  22.9868          ?        ?      257.6        4.5       ?       ? 
1 1 1   35   26    5 o    139.2    5.5    0.0000   0.0000          ?        ?   194.1106  15.3245          ?        ?      139.2        5.5       ?       ? 
1 1 1   35   26    6 o    210.4    4.1    0.0000   0.0000          ?        ?   443.1340  17.2401          ?        ?      210.4        4.1       ?       ? 
1 1 1   35   26    7 o    217.3    3.7    0.0000   0.0000          ?        ?   472.5060  15.9630          ?        ?      217.3        3.7       ?       ? 
1 1 1   35   26    8 o    202.7    3.9    0.0000   0.0000          ?        ?   411.2079  15.9630          ?        ?      202.7        3.9       ?       ? 
1 1 1   35   26    9 o     93.4    7.9    0.0000   0.0000          ?        ?    87.4775  14.6860          ?        ?       93.4        7.9       ?       ? 
1 1 1   35   26   10 o    335.8    3.6    0.0000   0.0000          ?        ?  1128.2677  24.2638          ?        ?      335.8        3.6       ?       ? 
1 1 1   35   26   11 o    270.6    2.6    0.0000   0.0000          ?        ?   732.3843  14.0475          ?        ?      270.6        2.6       ?       ? 
1 1 1   35   26   12 o    283.8    2.5    0.0000   0.0000          ?        ?   805.8143  14.0475          ?        ?      283.8        2.5       ?       ? 
1 1 1   35   26   13 o    444.2    2.7    0.0000   0.0000          ?        ?  1973.6704  23.6253          ?        ?      444.2        2.7       ?       ? 
1 1 1   35   26   14 o    282.6    2.5    0.0000   0.0000          ?        ?   798.7905  14.0475          ?        ?      282.6        2.5       ?       ? 
1 1 1   35   26   15 o     92.1    5.9    0.0000   0.0000          ?        ?    84.9234  10.8549          ?        ?       92.1        5.9       ?       ? 
1 1 1   35   26   16 o    168.1    3.6    0.0000   0.0000          ?        ?   282.8651  12.1319          ?        ?      168.1        3.6       ?       ? 
1 1 1   35   26   17 o    278.0    3.0    0.0000   0.0000          ?        ?   773.2497  16.6016          ?        ?      278.0        3.0       ?       ? 
1 1 1   35   26   18 o    193.2    2.8    0.0000   0.0000          ?        ?   373.5352  10.8549          ?        ?      193.2        2.8       ?       ? 
1 1 1   35   26   19 f    316.6    2.5    0.0000   0.0000          ?        ?  1002.4789  15.9630          ?        ?      316.6        2.5       ?       ? 
1 1 1   35   26   20 o    155.1    3.5    0.0000   0.0000          ?        ?   240.7227  10.8549          ?        ?      155.1        3.5       ?       ? 
1 1 1   35   26   21 o    214.8    3.1    0.0000   0.0000          ?        ?   461.6512  13.4090          ?        ?      214.8        3.1       ?       ? 
1 1 1   35   26   22 o    466.7    2.6    0.0000   0.0000          ?        ?  2178.6360  24.2638          ?        ?      466.7        2.6       ?       ? 
1 1 1   35   26   23 o    222.2    3.0    0.0000   0.0000          ?        ?   494.2158  13.4090          ?        ?      222.2        3.0       ?       ? 
1 1 1   35   26   24 o     82.9    7.3    0.0000   0.0000          ?        ?    68.9603  12.1319          ?        ?       82.9        7.3       ?       ? 
1 1 1   35   26   25 o    275.0    2.9    0.0000   0.0000          ?        ?   756.6481  15.9630          ?        ?      275.0        2.9       ?       ? 
1 1 1   35   26   26 o    122.6    5.5    0.0000   0.0000          ?        ?   150.6911  13.4090          ?        ?      122.6        5.5       ?       ? 
1 1 1   35   26   27 o    367.3    2.6    0.0000   0.0000          ?        ?  1349.8347  19.1556          ?        ?      367.3        2.6       ?       ? 
1 1 1   35   26   28 o    199.0    3.5    0.0000   0.0000          ?        ?   396.5219  14.0475          ?        ?      199.0        3.5       ?       ? 
1 1 1   35   26   29 o    175.0    4.2    0.0000   0.0000          ?        ?   306.4904  14.6860          ?        ?      175.0        4.2       ?       ? 
1 1 1   35   26   30 o    247.1    3.1    0.0000   0.0000          ?        ?   611.0652  15.3245          ?        ?      247.1        3.1       ?       ? 
1 1 1   35   26   31 o    298.9    3.2    0.0000   0.0000          ?        ?   893.9303  19.1556          ?        ?      298.9        3.2       ?       ? 
1 1 1   35   26   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   26   33 o    333.4    2.9    0.0000   0.0000          ?        ?  1112.3047  19.1556          ?        ?      333.4        2.9       ?       ? 
1 1 1   35   26   34 o     55.6   13.4    0.0000   0.0000          ?        ?    32.5646  14.6860          ?        ?       55.6       13.4       ?       ? 
1 1 1   35   26   35 f    283.3    3.3    0.0000   0.0000          ?        ?   803.2603  18.5171          ?        ?      283.3        3.3       ?       ? 
1 1 1   35   26   36 o     26.6   12.3    0.0000   0.0000          ?        ?   -12.1319  15.3245          ?        ?       26.6       12.3       ?       ? 
1 1 1   35   26   37 o    182.4    4.9    0.0000   0.0000          ?        ?   333.3083  17.8786          ?        ?      182.4        4.9       ?       ? 
1 1 1   35   26   38 o    172.5    4.6    0.0000   0.0000          ?        ?   298.1896  15.9630          ?        ?      172.5        4.6       ?       ? 
1 1 1   35   26   39 o     95.2    8.7    0.0000   0.0000          ?        ?    91.3086  16.6016          ?        ?       95.2        8.7       ?       ? 
1 1 1   35   26   40 o     86.0    9.7    0.0000   0.0000          ?        ?    74.7070  16.6016          ?        ?       86.0        9.7       ?       ? 
1 1 1   35   26   41 o     30.5   13.5    0.0000   0.0000          ?        ?    -5.7467  16.6016          ?        ?       30.5       13.5       ?       ? 
1 1 1   35   26   42 o    117.7    6.8    0.0000   0.0000          ?        ?   139.1977  15.9630          ?        ?      117.7        6.8       ?       ? 
1 1 1   35   26   43 o    165.2    5.0    0.0000   0.0000          ?        ?   273.9258  16.6016          ?        ?      165.2        5.0       ?       ? 
1 1 1   35   26   44 o     28.9   13.1    0.0000   0.0000          ?        ?    -9.5778  16.6016          ?        ?       28.9       13.1       ?       ? 
1 1 1   35   26   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   26   46 o     92.9    8.9    0.0000   0.0000          ?        ?    87.4775  16.6016          ?        ?       92.9        8.9       ?       ? 
1 1 1   35   26   47 o    113.5    7.9    0.0000   0.0000          ?        ?   130.2584  17.8786          ?        ?      113.5        7.9       ?       ? 
1 1 1   35   26   48 o     97.8    9.1    0.0000   0.0000          ?        ?    97.0553  17.8786          ?        ?       97.8        9.1       ?       ? 
1 1 1   35   26   49 o     89.2   10.0    0.0000   0.0000          ?        ?    81.0922  17.8786          ?        ?       89.2       10.0       ?       ? 
1 1 1   35   26   50 o     62.8   14.5    0.0000   0.0000          ?        ?    42.7809  17.8786          ?        ?       62.8       14.5       ?       ? 
1 1 1   35   27    0 o     38.3   22.9   16.6016  30.6490    16.6016  30.6490    16.6016  30.6490       38.3     22.9       38.3       22.9     0.0     0.0 
1 1 1   35   27    1 o    212.3    5.4    0.0000   0.0000          ?        ?   451.4348  22.9868          ?        ?      212.3        5.4       ?       ? 
1 1 1   35   27    2 o    255.7    5.0    0.0000   0.0000          ?        ?   654.4847  25.5409          ?        ?      255.7        5.0       ?       ? 
1 1 1   35   27    3 o    324.7    4.7    0.0000   0.0000          ?        ?  1055.4763  30.6490          ?        ?      324.7        4.7       ?       ? 
1 1 1   35   27    4 o    658.8    4.4    0.0000   0.0000          ?        ?  4344.5015  57.4669          ?        ?      658.8        4.4       ?       ? 
1 1 1   35   27    5 o    263.9    5.3    0.0000   0.0000          ?        ?   697.2656  28.0950          ?        ?      263.9        5.3       ?       ? 
1 1 1   35   27    6 o     89.9   13.8    0.0000   0.0000          ?        ?    81.7308  24.9023          ?        ?       89.9       13.8       ?       ? 
1 1 1   35   27    7 o    230.8    3.2    0.0000   0.0000          ?        ?   533.1656  14.6860          ?        ?      230.8        3.2       ?       ? 
1 1 1   35   27    8 o    355.7    3.2    0.0000   0.0000          ?        ?  1266.1884  22.9868          ?        ?      355.7        3.2       ?       ? 
1 1 1   35   27    9 o    207.5    3.5    0.0000   0.0000          ?        ?   431.0021  14.6860          ?        ?      207.5        3.5       ?       ? 
1 1 1   35   27   10 o    288.6    3.2    0.0000   0.0000          ?        ?   833.2708  18.5171          ?        ?      288.6        3.2       ?       ? 
1 1 1   35   27   11 o    131.4    5.6    0.0000   0.0000          ?        ?   173.0394  14.6860          ?        ?      131.4        5.6       ?       ? 
1 1 1   35   27   12 o    212.7    3.5    0.0000   0.0000          ?        ?   452.7119  14.6860          ?        ?      212.7        3.5       ?       ? 
1 1 1   35   27   13 o     47.7    9.0    0.0000   0.0000          ?        ?    23.6253   8.3008          ?        ?       47.7        9.0       ?       ? 
1 1 1   35   27   14 o    179.3    3.2    0.0000   0.0000          ?        ?   321.8149  11.4934          ?        ?      179.3        3.2       ?       ? 
1 1 1   35   27   15 o    379.5    2.8    0.0000   0.0000          ?        ?  1440.5049  21.0712          ?        ?      379.5        2.8       ?       ? 
1 1 1   35   27   16 f    203.4    3.1    0.0000   0.0000          ?        ?   413.7620  12.7704          ?        ?      203.4        3.1       ?       ? 
1 1 1   35   27   17 o    409.3    2.9    0.0000   0.0000          ?        ?  1676.1193  23.6253          ?        ?      409.3        2.9       ?       ? 
1 1 1   35   27   18 o     75.6    8.4    0.0000   0.0000          ?        ?    57.4669  12.7704          ?        ?       75.6        8.4       ?       ? 
1 1 1   35   27   19 o    213.3    2.7    0.0000   0.0000          ?        ?   455.2659  11.4934          ?        ?      213.3        2.7       ?       ? 
1 1 1   35   27   20 o    508.3    2.4    0.0000   0.0000          ?        ?  2584.7354  24.9023          ?        ?      508.3        2.4       ?       ? 
1 1 1   35   27   21 o    406.1    2.4    0.0000   0.0000          ?        ?  1649.9398  19.7942          ?        ?      406.1        2.4       ?       ? 
1 1 1   35   27   22 o    216.4    3.0    0.0000   0.0000          ?        ?   468.6749  12.7704          ?        ?      216.4        3.0       ?       ? 
1 1 1   35   27   23 o    376.3    2.4    0.0000   0.0000          ?        ?  1416.2410  17.8786          ?        ?      376.3        2.4       ?       ? 
1 1 1   35   27   24 o    311.3    2.6    0.0000   0.0000          ?        ?   969.2759  15.9630          ?        ?      311.3        2.6       ?       ? 
1 1 1   35   27   25 o    270.1    2.8    0.0000   0.0000          ?        ?   729.8303  15.3245          ?        ?      270.1        2.8       ?       ? 
1 1 1   35   27   26 o    334.1    2.6    0.0000   0.0000          ?        ?  1116.7743  17.2401          ?        ?      334.1        2.6       ?       ? 
1 1 1   35   27   27 o    422.7    2.4    0.0000   0.0000          ?        ?  1787.8606  20.4327          ?        ?      422.7        2.4       ?       ? 
1 1 1   35   27   28 o     95.0    7.1    0.0000   0.0000          ?        ?    90.6701  13.4090          ?        ?       95.0        7.1       ?       ? 
1 1 1   35   27   29 o    241.5    3.2    0.0000   0.0000          ?        ?   583.6088  15.3245          ?        ?      241.5        3.2       ?       ? 
1 1 1   35   27   30 o    226.3    3.4    0.0000   0.0000          ?        ?   512.7329  15.3245          ?        ?      226.3        3.4       ?       ? 
1 1 1   35   27   31 o    136.6    5.6    0.0000   0.0000          ?        ?   187.0868  15.3245          ?        ?      136.6        5.6       ?       ? 
1 1 1   35   27   32 o    107.6    6.8    0.0000   0.0000          ?        ?   116.2109  14.6860          ?        ?      107.6        6.8       ?       ? 
1 1 1   35   27   33 o    153.5    5.0    0.0000   0.0000          ?        ?   236.2530  15.3245          ?        ?      153.5        5.0       ?       ? 
1 1 1   35   27   34 o    151.6    5.1    0.0000   0.0000          ?        ?   230.5063  15.3245          ?        ?      151.6        5.1       ?       ? 
1 1 1   35   27   35 o     96.5    8.6    0.0000   0.0000          ?        ?    93.8627  16.6016          ?        ?       96.5        8.6       ?       ? 
1 1 1   35   27   36 o    204.0    3.9    0.0000   0.0000          ?        ?   416.9547  15.9630          ?        ?      204.0        3.9       ?       ? 
1 1 1   35   27   37 o    114.4    6.7    0.0000   0.0000          ?        ?   131.5355  15.3245          ?        ?      114.4        6.7       ?       ? 
1 1 1   35   27   38 o     28.8   13.0    0.0000   0.0000          ?        ?    -8.3008  15.9630          ?        ?       28.8       13.0       ?       ? 
1 1 1   35   27   39 o    246.3    3.4    0.0000   0.0000          ?        ?   607.2341  16.6016          ?        ?      246.3        3.4       ?       ? 
1 1 1   35   27   40 o    222.4    3.7    0.0000   0.0000          ?        ?   495.4928  16.6016          ?        ?      222.4        3.7       ?       ? 
1 1 1   35   27   41 o    104.4    7.6    0.0000   0.0000          ?        ?   109.8257  15.9630          ?        ?      104.4        7.6       ?       ? 
1 1 1   35   27   42 o    223.8    3.7    0.0000   0.0000          ?        ?   501.8780  16.6016          ?        ?      223.8        3.7       ?       ? 
1 1 1   35   27   43 o    246.7    3.6    0.0000   0.0000          ?        ?   609.7881  17.8786          ?        ?      246.7        3.6       ?       ? 
1 1 1   35   27   44 o    145.4    5.9    0.0000   0.0000          ?        ?   212.6277  17.2401          ?        ?      145.4        5.9       ?       ? 
1 1 1   35   27   45 o    196.1    4.4    0.0000   0.0000          ?        ?   385.6671  17.2401          ?        ?      196.1        4.4       ?       ? 
1 1 1   35   27   46 o    131.5    6.6    0.0000   0.0000          ?        ?   174.3164  17.2401          ?        ?      131.5        6.6       ?       ? 
1 1 1   35   27   47 o     30.4   13.6    0.0000   0.0000          ?        ?    -7.0237  17.2401          ?        ?       30.4       13.6       ?       ? 
1 1 1   35   27   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   28    0 o    379.2    5.6 1440.5049  42.7809  1440.5049  42.7809  1440.5049  42.7809      379.2      5.6      379.2        5.6     0.0     0.0 
1 1 1   35   28    1 o    228.3    4.8    0.0000   0.0000          ?        ?   521.6721  21.7097          ?        ?      228.3        4.8       ?       ? 
1 1 1   35   28    2 o    285.7    4.2    0.0000   0.0000          ?        ?   817.3077  24.2638          ?        ?      285.7        4.2       ?       ? 
1 1 1   35   28    3 o    390.6    3.8    0.0000   0.0000          ?        ?  1527.3438  30.0105          ?        ?      390.6        3.8       ?       ? 
1 1 1   35   28    4 o    100.8   10.5    0.0000   0.0000          ?        ?   102.1635  21.0712          ?        ?      100.8       10.5       ?       ? 
1 1 1   35   28    5 o    241.3    5.2    0.0000   0.0000          ?        ?   582.9703  24.9023          ?        ?      241.3        5.2       ?       ? 
1 1 1   35   28    6 o    136.9    9.1    0.0000   0.0000          ?        ?   188.3639  24.9023          ?        ?      136.9        9.1       ?       ? 
1 1 1   35   28    7 o    304.1    4.2    0.0000   0.0000          ?        ?   925.8564  25.5409          ?        ?      304.1        4.2       ?       ? 
1 1 1   35   28    8 o    285.2    3.9    0.0000   0.0000          ?        ?   814.1151  22.3483          ?        ?      285.2        3.9       ?       ? 
1 1 1   35   28    9 o    277.3    3.1    0.0000   0.0000          ?        ?   769.4186  17.2401          ?        ?      277.3        3.1       ?       ? 
1 1 1   35   28   10 o    247.4    3.6    0.0000   0.0000          ?        ?   612.3422  17.8786          ?        ?      247.4        3.6       ?       ? 
1 1 1   35   28   11 o    147.4    5.2    0.0000   0.0000          ?        ?   217.7359  15.3245          ?        ?      147.4        5.2       ?       ? 
1 1 1   35   28   12 o    205.8    4.2    0.0000   0.0000          ?        ?   423.9784  17.2401          ?        ?      205.8        4.2       ?       ? 
1 1 1   35   28   13 o     70.9    7.7    0.0000   0.0000          ?        ?    50.4432  10.8549          ?        ?       70.9        7.7       ?       ? 
1 1 1   35   28   14 o    139.3    3.2    0.0000   0.0000          ?        ?   194.1106   8.9393          ?        ?      139.3        3.2       ?       ? 
1 1 1   35   28   15 o    267.5    2.7    0.0000   0.0000          ?        ?   715.7827  14.6860          ?        ?      267.5        2.7       ?       ? 
1 1 1   35   28   16 o    281.4    2.6    0.0000   0.0000          ?        ?   792.4053  14.6860          ?        ?      281.4        2.6       ?       ? 
1 1 1   35   28   17 o    190.7    3.5    0.0000   0.0000          ?        ?   363.9573  13.4090          ?        ?      190.7        3.5       ?       ? 
1 1 1   35   28   18 o     96.4    6.6    0.0000   0.0000          ?        ?    93.2242  12.7704          ?        ?       96.4        6.6       ?       ? 
1 1 1   35   28   19 o    411.5    2.5    0.0000   0.0000          ?        ?  1693.9978  20.4327          ?        ?      411.5        2.5       ?       ? 
1 1 1   35   28   20 o    336.4    2.4    0.0000   0.0000          ?        ?  1132.0989  15.9630          ?        ?      336.4        2.4       ?       ? 
1 1 1   35   28   21 o    199.4    3.2    0.0000   0.0000          ?        ?   397.7990  12.7704          ?        ?      199.4        3.2       ?       ? 
1 1 1   35   28   22 o    631.2    2.8    0.0000   0.0000          ?        ?  3986.2905  35.1187          ?        ?      631.2        2.8       ?       ? 
1 1 1   35   28   23 o     72.2    8.0    0.0000   0.0000          ?        ?    52.3588  11.4934          ?        ?       72.2        8.0       ?       ? 
1 1 1   35   28   24 o    159.7    3.8    0.0000   0.0000          ?        ?   255.4086  12.1319          ?        ?      159.7        3.8       ?       ? 
1 1 1   35   28   25 o    291.5    2.5    0.0000   0.0000          ?        ?   849.8723  14.6860          ?        ?      291.5        2.5       ?       ? 
1 1 1   35   28   26 o    300.9    2.7    0.0000   0.0000          ?        ?   906.0621  15.9630          ?        ?      300.9        2.7       ?       ? 
1 1 1   35   28   27 o    173.1    3.9    0.0000   0.0000          ?        ?   300.1052  13.4090          ?        ?      173.1        3.9       ?       ? 
1 1 1   35   28   28 o    321.0    2.5    0.0000   0.0000          ?        ?  1031.2124  15.9630          ?        ?      321.0        2.5       ?       ? 
1 1 1   35   28   29 o    238.7    3.2    0.0000   0.0000          ?        ?   570.1998  15.3245          ?        ?      238.7        3.2       ?       ? 
1 1 1   35   28   30 o    141.9    4.9    0.0000   0.0000          ?        ?   201.7728  14.0475          ?        ?      141.9        4.9       ?       ? 
1 1 1   35   28   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   28   32 o    168.8    4.4    0.0000   0.0000          ?        ?   285.4192  14.6860          ?        ?      168.8        4.4       ?       ? 
1 1 1   35   28   33 o    172.3    4.6    0.0000   0.0000          ?        ?   297.5511  15.9630          ?        ?      172.3        4.6       ?       ? 
1 1 1   35   28   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   28   35 o     90.8    8.1    0.0000   0.0000          ?        ?    83.0078  14.6860          ?        ?       90.8        8.1       ?       ? 
1 1 1   35   28   36 f    369.1    2.8    0.0000   0.0000          ?        ?  1363.2437  20.4327          ?        ?      369.1        2.8       ?       ? 
1 1 1   35   28   37 f     81.8    9.8    0.0000   0.0000          ?        ?    67.6833  15.9630          ?        ?       81.8        9.8       ?       ? 
1 1 1   35   28   38 o    174.1    4.8    0.0000   0.0000          ?        ?   303.9363  16.6016          ?        ?      174.1        4.8       ?       ? 
1 1 1   35   28   39 o    132.2    6.0    0.0000   0.0000          ?        ?   175.5934  15.9630          ?        ?      132.2        6.0       ?       ? 
1 1 1   35   28   40 o     33.4   14.2    0.0000   0.0000          ?        ?     0.6385  16.6016          ?        ?       33.4       14.2       ?       ? 
1 1 1   35   28   41 o     23.2   11.2    0.0000   0.0000          ?        ?   -25.5409  15.9630          ?        ?       23.2       11.2       ?       ? 
1 1 1   35   28   42 o     37.8   14.7    0.0000   0.0000          ?        ?     9.5778  15.9630          ?        ?       37.8       14.7       ?       ? 
1 1 1   35   28   43 o    102.7    8.1    0.0000   0.0000          ?        ?   106.6331  16.6016          ?        ?      102.7        8.1       ?       ? 
1 1 1   35   28   44 o    202.1    4.4    0.0000   0.0000          ?        ?   409.9309  17.8786          ?        ?      202.1        4.4       ?       ? 
1 1 1   35   28   45 o    185.1    4.7    0.0000   0.0000          ?        ?   344.1632  17.2401          ?        ?      185.1        4.7       ?       ? 
1 1 1   35   28   46 o    300.8    3.2    0.0000   0.0000          ?        ?   906.7007  19.1556          ?        ?      300.8        3.2       ?       ? 
1 1 1   35   28   47 o     50.2   15.2    0.0000   0.0000          ?        ?    26.8179  16.6016          ?        ?       50.2       15.2       ?       ? 
1 1 1   35   29    0 o    137.2    9.9  191.5565  26.8179   191.5565  26.8179   191.5565  26.8179      137.2      9.9      137.2        9.9     0.0     0.0 
1 1 1   35   29    1 o    195.8    6.2    0.0000   0.0000          ?        ?   384.3900  24.2638          ?        ?      195.8        6.2       ?       ? 
1 1 1   35   29    2 o    313.4    4.8    0.0000   0.0000          ?        ?   983.3233  30.0105          ?        ?      313.4        4.8       ?       ? 
1 1 1   35   29    3 o    213.0    6.1    0.0000   0.0000          ?        ?   454.6274  26.1794          ?        ?      213.0        6.1       ?       ? 
1 1 1   35   29    4 o    431.8    4.4    0.0000   0.0000          ?        ?  1867.0372  38.3113          ?        ?      431.8        4.4       ?       ? 
1 1 1   35   29    5 o    372.7    4.8    0.0000   0.0000          ?        ?  1390.7001  35.7572          ?        ?      372.7        4.8       ?       ? 
1 1 1   35   29    6 o    213.1    6.1    0.0000   0.0000          ?        ?   455.2659  26.1794          ?        ?      213.1        6.1       ?       ? 
1 1 1   35   29    7 f    223.6    6.1    0.0000   0.0000          ?        ?   501.2395  27.4564          ?        ?      223.6        6.1       ?       ? 
1 1 1   35   29    8 o    414.8    5.3    0.0000   0.0000          ?        ?  1723.3699  44.0580          ?        ?      414.8        5.3       ?       ? 
1 1 1   35   29    9 o    445.8    6.2    0.0000   0.0000          ?        ?  1992.1875  54.9129          ?        ?      445.8        6.2       ?       ? 
1 1 1   35   29   10 o    305.9    3.4    0.0000   0.0000          ?        ?   936.7112  21.0712          ?        ?      305.9        3.4       ?       ? 
1 1 1   35   29   11 o    337.3    3.9    0.0000   0.0000          ?        ?  1138.4841  26.1794          ?        ?      337.3        3.9       ?       ? 
1 1 1   35   29   12 o    241.1    3.6    0.0000   0.0000          ?        ?   581.6932  17.2401          ?        ?      241.1        3.6       ?       ? 
1 1 1   35   29   13 o    323.2    3.0    0.0000   0.0000          ?        ?  1045.2599  19.1556          ?        ?      323.2        3.0       ?       ? 
1 1 1   35   29   14 o    565.5    3.5    0.0000   0.0000          ?        ?  3200.2705  39.5883          ?        ?      565.5        3.5       ?       ? 
1 1 1   35   29   15 o    167.3    4.6    0.0000   0.0000          ?        ?   280.3110  15.3245          ?        ?      167.3        4.6       ?       ? 
1 1 1   35   29   16 o    233.5    2.7    0.0000   0.0000          ?        ?   545.2975  12.7704          ?        ?      233.5        2.7       ?       ? 
1 1 1   35   29   17 o    306.4    2.6    0.0000   0.0000          ?        ?   939.2654  15.9630          ?        ?      306.4        2.6       ?       ? 
1 1 1   35   29   18 o    379.6    2.8    0.0000   0.0000          ?        ?  1441.7819  21.0712          ?        ?      379.6        2.8       ?       ? 
1 1 1   35   29   19 f     64.2   10.4    0.0000   0.0000          ?        ?    41.5039  13.4090          ?        ?       64.2       10.4       ?       ? 
1 1 1   35   29   20 o    314.4    2.6    0.0000   0.0000          ?        ?   989.0699  16.6016          ?        ?      314.4        2.6       ?       ? 
1 1 1   35   29   21 o    728.7    3.0    0.0000   0.0000          ?        ?  5313.1382  44.0580          ?        ?      728.7        3.0       ?       ? 
1 1 1   35   29   22 o    328.9    2.7    0.0000   0.0000          ?        ?  1082.2942  17.8786          ?        ?      328.9        2.7       ?       ? 
1 1 1   35   29   23 o    370.8    2.5    0.0000   0.0000          ?        ?  1375.3755  18.5171          ?        ?      370.8        2.5       ?       ? 
1 1 1   35   29   24 o     20.6    9.9    0.0000   0.0000          ?        ?   -18.5171  12.1319          ?        ?       20.6        9.9       ?       ? 
1 1 1   35   29   25 o    108.0    5.6    0.0000   0.0000          ?        ?   116.8494  12.1319          ?        ?      108.0        5.6       ?       ? 
1 1 1   35   29   26 o    107.6    6.2    0.0000   0.0000          ?        ?   116.2109  13.4090          ?        ?      107.6        6.2       ?       ? 
1 1 1   35   29   27 o    170.7    3.9    0.0000   0.0000          ?        ?   291.8044  13.4090          ?        ?      170.7        3.9       ?       ? 
1 1 1   35   29   28 o     88.4    7.6    0.0000   0.0000          ?        ?    78.5382  13.4090          ?        ?       88.4        7.6       ?       ? 
1 1 1   35   29   29 o    152.9    4.8    0.0000   0.0000          ?        ?   234.3374  14.6860          ?        ?      152.9        4.8       ?       ? 
1 1 1   35   29   30 o    487.6    2.6    0.0000   0.0000          ?        ?  2379.1316  24.9023          ?        ?      487.6        2.6       ?       ? 
1 1 1   35   29   31 o    112.5    6.5    0.0000   0.0000          ?        ?   127.0658  14.6860          ?        ?      112.5        6.5       ?       ? 
1 1 1   35   29   32 o     28.0   12.4    0.0000   0.0000          ?        ?    -5.1082  14.0475          ?        ?       28.0       12.4       ?       ? 
1 1 1   35   29   33 o    241.8    3.4    0.0000   0.0000          ?        ?   585.5243  16.6016          ?        ?      241.8        3.4       ?       ? 
1 1 1   35   29   34 o    254.9    3.3    0.0000   0.0000          ?        ?   650.6536  16.6016          ?        ?      254.9        3.3       ?       ? 
1 1 1   35   29   35 o    207.9    3.8    0.0000   0.0000          ?        ?   432.9177  15.9630          ?        ?      207.9        3.8       ?       ? 
1 1 1   35   29   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   29   37 o    137.2    5.6    0.0000   0.0000          ?        ?   189.0024  15.3245          ?        ?      137.2        5.6       ?       ? 
1 1 1   35   29   38 o     41.7   15.0    0.0000   0.0000          ?        ?    15.3245  15.9630          ?        ?       41.7       15.0       ?       ? 
1 1 1   35   29   39 o    171.7    4.6    0.0000   0.0000          ?        ?   295.6355  15.9630          ?        ?      171.7        4.6       ?       ? 
1 1 1   35   29   40 o    213.4    4.0    0.0000   0.0000          ?        ?   456.5430  17.2401          ?        ?      213.4        4.0       ?       ? 
1 1 1   35   29   41 o    157.7    5.1    0.0000   0.0000          ?        ?   249.6619  15.9630          ?        ?      157.7        5.1       ?       ? 
1 1 1   35   29   42 o     42.4   15.0    0.0000   0.0000          ?        ?    16.6016  15.9630          ?        ?       42.4       15.0       ?       ? 
1 1 1   35   29   43 o     29.6   13.2    0.0000   0.0000          ?        ?    -5.7467  15.9630          ?        ?       29.6       13.2       ?       ? 
1 1 1   35   29   44 o    180.3    4.6    0.0000   0.0000          ?        ?   326.2845  16.6016          ?        ?      180.3        4.6       ?       ? 
1 1 1   35   29   45 o    103.2    7.7    0.0000   0.0000          ?        ?   107.9102  15.9630          ?        ?      103.2        7.7       ?       ? 
1 1 1   35   30    0 o    173.4   13.6  307.7674  46.6121   307.7674  46.6121   307.7674  46.6121      173.4     13.6      173.4       13.6     0.0     0.0 
1 1 1   35   30    1 o    309.8    5.4    0.0000   0.0000          ?        ?   961.6136  33.2031          ?        ?      309.8        5.4       ?       ? 
1 1 1   35   30    2 o    317.4    4.9    0.0000   0.0000          ?        ?  1008.8642  31.2876          ?        ?      317.4        4.9       ?       ? 
1 1 1   35   30    3 o    181.2    7.0    0.0000   0.0000          ?        ?   329.4771  25.5409          ?        ?      181.2        7.0       ?       ? 
1 1 1   35   30    4 o    309.1    4.4    0.0000   0.0000          ?        ?   956.5054  27.4564          ?        ?      309.1        4.4       ?       ? 
1 1 1   35   30    5 o    185.4    6.5    0.0000   0.0000          ?        ?   344.8017  24.2638          ?        ?      185.4        6.5       ?       ? 
1 1 1   35   30    6 o    504.1    4.4    0.0000   0.0000          ?        ?  2543.8701  44.6965          ?        ?      504.1        4.4       ?       ? 
1 1 1   35   30    7 o    272.4    4.6    0.0000   0.0000          ?        ?   743.2392  24.9023          ?        ?      272.4        4.6       ?       ? 
1 1 1   35   30    8 o    214.4    5.5    0.0000   0.0000          ?        ?   460.3741  23.6253          ?        ?      214.4        5.5       ?       ? 
1 1 1   35   30    9 o    239.6    5.7    0.0000   0.0000          ?        ?   575.3080  27.4564          ?        ?      239.6        5.7       ?       ? 
1 1 1   35   30   10 o    411.3    4.4    0.0000   0.0000          ?        ?  1693.3594  36.3957          ?        ?      411.3        4.4       ?       ? 
1 1 1   35   30   11 o    182.6    4.4    0.0000   0.0000          ?        ?   333.9468  15.9630          ?        ?      182.6        4.4       ?       ? 
1 1 1   35   30   12 o    166.7    4.6    0.0000   0.0000          ?        ?   278.3954  15.3245          ?        ?      166.7        4.6       ?       ? 
1 1 1   35   30   13 o    202.1    3.5    0.0000   0.0000          ?        ?   408.6538  14.0475          ?        ?      202.1        3.5       ?       ? 
1 1 1   35   30   14 o    247.6    2.8    0.0000   0.0000          ?        ?   613.6193  14.0475          ?        ?      247.6        2.8       ?       ? 
1 1 1   35   30   15 o    206.1    3.4    0.0000   0.0000          ?        ?   425.2554  14.0475          ?        ?      206.1        3.4       ?       ? 
1 1 1   35   30   16 o    345.2    3.4    0.0000   0.0000          ?        ?  1192.7584  23.6253          ?        ?      345.2        3.4       ?       ? 
1 1 1   35   30   17 f    271.3    2.7    0.0000   0.0000          ?        ?   736.2155  14.6860          ?        ?      271.3        2.7       ?       ? 
1 1 1   35   30   18 o     74.4    8.2    0.0000   0.0000          ?        ?    55.5514  12.1319          ?        ?       74.4        8.2       ?       ? 
1 1 1   35   30   19 f    153.6    4.4    0.0000   0.0000          ?        ?   236.2530  13.4090          ?        ?      153.6        4.4       ?       ? 
1 1 1   35   30   20 o    329.0    2.3    0.0000   0.0000          ?        ?  1082.9327  15.3245          ?        ?      329.0        2.3       ?       ? 
1 1 1   35   30   21 o     95.8    5.3    0.0000   0.0000          ?        ?    91.9471  10.2163          ?        ?       95.8        5.3       ?       ? 
1 1 1   35   30   22 o    438.1    2.6    0.0000   0.0000          ?        ?  1920.0347  22.3483          ?        ?      438.1        2.6       ?       ? 
1 1 1   35   30   23 o    224.2    3.0    0.0000   0.0000          ?        ?   503.1551  13.4090          ?        ?      224.2        3.0       ?       ? 
1 1 1   35   30   24 o    357.8    2.5    0.0000   0.0000          ?        ?  1280.8744  17.8786          ?        ?      357.8        2.5       ?       ? 
1 1 1   35   30   25 o    109.7    5.5    0.0000   0.0000          ?        ?   120.6806  12.1319          ?        ?      109.7        5.5       ?       ? 
1 1 1   35   30   26 o    263.2    2.8    0.0000   0.0000          ?        ?   693.4344  14.6860          ?        ?      263.2        2.8       ?       ? 
1 1 1   35   30   27 o    134.3    4.8    0.0000   0.0000          ?        ?   180.7016  12.7704          ?        ?      134.3        4.8       ?       ? 
1 1 1   35   30   28 o    305.3    2.8    0.0000   0.0000          ?        ?   932.8801  17.2401          ?        ?      305.3        2.8       ?       ? 
1 1 1   35   30   29 o    371.3    2.7    0.0000   0.0000          ?        ?  1379.8452  19.7942          ?        ?      371.3        2.7       ?       ? 
1 1 1   35   30   30 o     77.5    9.5    0.0000   0.0000          ?        ?    60.6596  14.6860          ?        ?       77.5        9.5       ?       ? 
1 1 1   35   30   31 o    165.1    4.8    0.0000   0.0000          ?        ?   273.2873  15.9630          ?        ?      165.1        4.8       ?       ? 
1 1 1   35   30   32 o    104.8    7.0    0.0000   0.0000          ?        ?   110.4642  14.6860          ?        ?      104.8        7.0       ?       ? 
1 1 1   35   30   33 o    240.4    3.5    0.0000   0.0000          ?        ?   578.5006  16.6016          ?        ?      240.4        3.5       ?       ? 
1 1 1   35   30   34 o    189.6    4.0    0.0000   0.0000          ?        ?   360.1262  15.3245          ?        ?      189.6        4.0       ?       ? 
1 1 1   35   30   35 o     32.5   13.7    0.0000   0.0000          ?        ?     1.2770  15.3245          ?        ?       32.5       13.7       ?       ? 
1 1 1   35   30   36 o    160.0    5.0    0.0000   0.0000          ?        ?   256.6857  15.9630          ?        ?      160.0        5.0       ?       ? 
1 1 1   35   30   37 o    232.2    3.6    0.0000   0.0000          ?        ?   540.1893  16.6016          ?        ?      232.2        3.6       ?       ? 
1 1 1   35   30   38 o    185.7    4.6    0.0000   0.0000          ?        ?   346.0787  17.2401          ?        ?      185.7        4.6       ?       ? 
1 1 1   35   30   39 o    146.1    5.9    0.0000   0.0000          ?        ?   214.5433  17.2401          ?        ?      146.1        5.9       ?       ? 
1 1 1   35   30   40 o     61.3   13.9    0.0000   0.0000          ?        ?    40.2269  16.6016          ?        ?       61.3       13.9       ?       ? 
1 1 1   35   30   41 o    213.4    4.0    0.0000   0.0000          ?        ?   456.5430  17.2401          ?        ?      213.4        4.0       ?       ? 
1 1 1   35   30   42 o    125.3    6.6    0.0000   0.0000          ?        ?   158.3534  16.6016          ?        ?      125.3        6.6       ?       ? 
1 1 1   35   30   43 o    190.1    4.4    0.0000   0.0000          ?        ?   362.6803  16.6016          ?        ?      190.1        4.4       ?       ? 
1 1 1   35   30   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   31    0 o    131.2   13.1  178.1475  33.8416   178.1475  33.8416   178.1475  33.8416      131.2     13.1      131.2       13.1     0.0     0.0 
1 1 1   35   31    1 o    268.5    4.9    0.0000   0.0000          ?        ?   722.1680  26.1794          ?        ?      268.5        4.9       ?       ? 
1 1 1   35   31    2 o    160.1    7.4    0.0000   0.0000          ?        ?   257.3242  23.6253          ?        ?      160.1        7.4       ?       ? 
1 1 1   35   31    3 o    296.5    4.6    0.0000   0.0000          ?        ?   880.5213  27.4564          ?        ?      296.5        4.6       ?       ? 
1 1 1   35   31    4 o    241.8    5.2    0.0000   0.0000          ?        ?   585.5243  24.9023          ?        ?      241.8        5.2       ?       ? 
1 1 1   35   31    5 o    147.7   10.2    0.0000   0.0000          ?        ?   219.6514  30.0105          ?        ?      147.7       10.2       ?       ? 
1 1 1   35   31    6 o     56.9   19.5    0.0000   0.0000          ?        ?    30.6490  26.8179          ?        ?       56.9       19.5       ?       ? 
1 1 1   35   31    7 o    328.4    4.9    0.0000   0.0000          ?        ?  1080.3785  31.9261          ?        ?      328.4        4.9       ?       ? 
1 1 1   35   31    8 o    175.0    8.4    0.0000   0.0000          ?        ?   307.7674  29.3720          ?        ?      175.0        8.4       ?       ? 
1 1 1   35   31    9 o    165.1    8.7    0.0000   0.0000          ?        ?   273.9258  28.7335          ?        ?      165.1        8.7       ?       ? 
1 1 1   35   31   10 o    217.9    5.7    0.0000   0.0000          ?        ?   475.6986  24.9023          ?        ?      217.9        5.7       ?       ? 
1 1 1   35   31   11 o    355.8    4.8    0.0000   0.0000          ?        ?  1268.1040  33.8416          ?        ?      355.8        4.8       ?       ? 
1 1 1   35   31   12 o     56.7   13.7    0.0000   0.0000          ?        ?    33.8416  15.3245          ?        ?       56.7       13.7       ?       ? 
1 1 1   35   31   13 o    205.0    4.4    0.0000   0.0000          ?        ?   420.7858  17.8786          ?        ?      205.0        4.4       ?       ? 
1 1 1   35   31   14 o     94.7    6.4    0.0000   0.0000          ?        ?    90.0316  12.1319          ?        ?       94.7        6.4       ?       ? 
1 1 1   35   31   15 o     96.7    7.3    0.0000   0.0000          ?        ?    93.8627  14.0475          ?        ?       96.7        7.3       ?       ? 
1 1 1   35   31   16 o    185.7    4.1    0.0000   0.0000          ?        ?   345.4402  15.3245          ?        ?      185.7        4.1       ?       ? 
1 1 1   35   31   17 o    331.2    3.3    0.0000   0.0000          ?        ?  1097.6187  21.7097          ?        ?      331.2        3.3       ?       ? 
1 1 1   35   31   18 o    160.7    3.6    0.0000   0.0000          ?        ?   258.6013  11.4934          ?        ?      160.7        3.6       ?       ? 
1 1 1   35   31   19 o     80.1    7.6    0.0000   0.0000          ?        ?    64.4907  12.1319          ?        ?       80.1        7.6       ?       ? 
1 1 1   35   31   20 o     15.0    7.4    0.0000   0.0000          ?        ?   -19.1556   8.3008          ?        ?       15.0        7.4       ?       ? 
1 1 1   35   31   21 o    218.3    2.9    0.0000   0.0000          ?        ?   476.9756  12.7704          ?        ?      218.3        2.9       ?       ? 
1 1 1   35   31   22 o     94.7    6.1    0.0000   0.0000          ?        ?    90.0316  11.4934          ?        ?       94.7        6.1       ?       ? 
1 1 1   35   31   23 o    248.9    2.8    0.0000   0.0000          ?        ?   620.0045  14.0475          ?        ?      248.9        2.8       ?       ? 
1 1 1   35   31   24 o    271.7    2.7    0.0000   0.0000          ?        ?   738.7695  14.6860          ?        ?      271.7        2.7       ?       ? 
1 1 1   35   31   25 o    132.1    4.6    0.0000   0.0000          ?        ?   174.9549  12.1319          ?        ?      132.1        4.6       ?       ? 
1 1 1   35   31   26 o    162.3    3.9    0.0000   0.0000          ?        ?   263.7094  12.7704          ?        ?      162.3        3.9       ?       ? 
1 1 1   35   31   27 o    148.5    4.5    0.0000   0.0000          ?        ?   220.9285  13.4090          ?        ?      148.5        4.5       ?       ? 
1 1 1   35   31   28 o     91.2    7.4    0.0000   0.0000          ?        ?    83.6463  13.4090          ?        ?       91.2        7.4       ?       ? 
1 1 1   35   31   29 o     19.0    9.4    0.0000   0.0000          ?        ?   -31.2876  13.4090          ?        ?       19.0        9.4       ?       ? 
1 1 1   35   31   30 o    444.2    2.7    0.0000   0.0000          ?        ?  1974.3090  23.6253          ?        ?      444.2        2.7       ?       ? 
1 1 1   35   31   31 o    385.1    2.7    0.0000   0.0000          ?        ?  1484.5627  20.4327          ?        ?      385.1        2.7       ?       ? 
1 1 1   35   31   32 o    289.3    3.0    0.0000   0.0000          ?        ?   837.7404  17.2401          ?        ?      289.3        3.0       ?       ? 
1 1 1   35   31   33 o    197.8    4.0    0.0000   0.0000          ?        ?   392.0523  15.9630          ?        ?      197.8        4.0       ?       ? 
1 1 1   35   31   34 o     86.0    8.5    0.0000   0.0000          ?        ?    74.7070  14.6860          ?        ?       86.0        8.5       ?       ? 
1 1 1   35   31   35 o    107.2    6.9    0.0000   0.0000          ?        ?   115.5724  14.6860          ?        ?      107.2        6.9       ?       ? 
1 1 1   35   31   36 o    314.3    2.7    0.0000   0.0000          ?        ?   989.0699  17.2401          ?        ?      314.3        2.7       ?       ? 
1 1 1   35   31   37 o    128.2    6.2    0.0000   0.0000          ?        ?   165.3771  15.9630          ?        ?      128.2        6.2       ?       ? 
1 1 1   35   31   38 o     27.4   12.7    0.0000   0.0000          ?        ?   -13.4090  16.6016          ?        ?       27.4       12.7       ?       ? 
1 1 1   35   31   39 o     25.6   12.1    0.0000   0.0000          ?        ?   -19.1556  16.6016          ?        ?       25.6       12.1       ?       ? 
1 1 1   35   31   40 o    240.5    3.6    0.0000   0.0000          ?        ?   579.7776  17.2401          ?        ?      240.5        3.6       ?       ? 
1 1 1   35   31   41 o    210.6    3.9    0.0000   0.0000          ?        ?   445.0496  16.6016          ?        ?      210.6        3.9       ?       ? 
1 1 1   35   31   42 o     49.6   14.9    0.0000   0.0000          ?        ?    26.1794  15.9630          ?        ?       49.6       14.9       ?       ? 
1 1 1   35   32    0 o    224.2    9.0  506.3477  40.2269   506.3477  40.2269   506.3477  40.2269      224.2      9.0      224.2        9.0     0.0     0.0 
1 1 1   35   32    1 o    207.2    7.6    0.0000   0.0000          ?        ?   431.0021  31.2876          ?        ?      207.2        7.6       ?       ? 
1 1 1   35   32    2 o    217.8    7.9    0.0000   0.0000          ?        ?   476.3371  34.4802          ?        ?      217.8        7.9       ?       ? 
1 1 1   35   32    3 o    253.7    6.4    0.0000   0.0000          ?        ?   645.5453  32.5646          ?        ?      253.7        6.4       ?       ? 
1 1 1   35   32    4 o    317.7    5.5    0.0000   0.0000          ?        ?  1011.4182  35.1187          ?        ?      317.7        5.5       ?       ? 
1 1 1   35   32    5 o    157.9    9.3    0.0000   0.0000          ?        ?   250.9390  29.3720          ?        ?      157.9        9.3       ?       ? 
1 1 1   35   32    6 o    346.3    5.0    0.0000   0.0000          ?        ?  1201.0592  34.4802          ?        ?      346.3        5.0       ?       ? 
1 1 1   35   32    7 o    189.4    7.6    0.0000   0.0000          ?        ?   360.1262  28.7335          ?        ?      189.4        7.6       ?       ? 
1 1 1   35   32    8 o    197.5    6.8    0.0000   0.0000          ?        ?   391.4138  26.8179          ?        ?      197.5        6.8       ?       ? 
1 1 1   35   32    9 o     98.9   15.8    0.0000   0.0000          ?        ?    99.6094  31.2876          ?        ?       98.9       15.8       ?       ? 
1 1 1   35   32   10 o    219.6    6.5    0.0000   0.0000          ?        ?   483.9994  28.7335          ?        ?      219.6        6.5       ?       ? 
1 1 1   35   32   11 o    317.0    5.8    0.0000   0.0000          ?        ?  1007.5872  37.0343          ?        ?      317.0        5.8       ?       ? 
1 1 1   35   32   12 o    374.2    4.6    0.0000   0.0000          ?        ?  1402.1935  34.4802          ?        ?      374.2        4.6       ?       ? 
1 1 1   35   32   13 o    288.6    4.3    0.0000   0.0000          ?        ?   833.9093  24.9023          ?        ?      288.6        4.3       ?       ? 
1 1 1   35   32   14 o    151.7    4.0    0.0000   0.0000          ?        ?   230.5063  12.1319          ?        ?      151.7        4.0       ?       ? 
1 1 1   35   32   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   35   32   16 o    214.1    3.9    0.0000   0.0000          ?        ?   459.0970  16.6016          ?        ?      214.1        3.9       ?       ? 
1 1 1   35   32   17 o    379.9    3.0    0.0000   0.0000          ?        ?  1444.3359  22.9868          ?        ?      379.9        3.0       ?       ? 
1 1 1   35   32   18 o     88.3    9.0    0.0000   0.0000          ?        ?    78.5382  15.9630          ?        ?       88.3        9.0       ?       ? 
1 1 1   35   32   19 o    300.8    2.9    0.0000   0.0000          ?        ?   905.4237  17.2401          ?        ?      300.8        2.9       ?       ? 
1 1 1   35   32   20 o     89.9    6.4    0.0000   0.0000          ?        ?    81.0922  11.4934          ?        ?       89.9        6.4       ?       ? 
1 1 1   35   32   21 o    251.7    2.4    0.0000   0.0000          ?        ?   634.0520  12.1319          ?        ?      251.7        2.4       ?       ? 
1 1 1   35   32   22 o    160.9    3.4    0.0000   0.0000          ?        ?   259.2398  10.8549          ?        ?      160.9        3.4       ?       ? 
1 1 1   35   32   23 o     38.3   12.8    0.0000   0.0000          ?        ?    14.0475  11.4934          ?        ?       38.3       12.8       ?       ? 
1 1 1   35   32   24 o    368.2    2.4    0.0000   0.0000          ?        ?  1356.8584  17.8786          ?        ?      368.2        2.4       ?       ? 
1 1 1   35   32   25 o    188.6    3.6    0.0000   0.0000          ?        ?   356.2951  13.4090          ?        ?      188.6        3.6       ?       ? 
1 1 1   35   32   26 o    379.3    2.5    0.0000   0.0000          ?        ?  1439.8662  19.1556          ?        ?      379.3        2.5       ?       ? 
1 1 1   35   32   27 o    162.0    4.1    0.0000   0.0000          ?        ?   263.0709  13.4090          ?        ?      162.0        4.1       ?       ? 
1 1 1   35   32   28 o    213.1    3.3    0.0000   0.0000          ?        ?   454.6274  14.0475          ?        ?      213.1        3.3       ?       ? 
1 1 1   35   32   29 o    367.3    2.6    0.0000   0.0000          ?        ?  1349.8347  19.1556          ?        ?      367.3        2.6       ?       ? 
1 1 1   35   32   30 o     18.2    9.1    0.0000   0.0000          ?        ?   -39.5883  14.0475          ?        ?       18.2        9.1       ?       ? 
1 1 1   35   32   31 o     69.2   10.6    0.0000   0.0000          ?        ?    48.5276  14.6860          ?        ?       69.2       10.6       ?       ? 
1 1 1   35   32   32 o    235.8    3.4    0.0000   0.0000          ?        ?   556.7908  15.9630          ?        ?      235.8        3.4       ?       ? 
1 1 1   35   32   33 o    163.1    4.7    0.0000   0.0000          ?        ?   266.9020  15.3245          ?        ?      163.1        4.7       ?       ? 
1 1 1   35   32   34 f     86.4    8.1    0.0000   0.0000          ?        ?    75.3456  14.0475          ?        ?       86.4        8.1       ?       ? 
1 1 1   35   32   35 o    118.5    5.9    0.0000   0.0000          ?        ?   141.1133  14.0475          ?        ?      118.5        5.9       ?       ? 
1 1 1   35   32   36 f    115.1    6.4    0.0000   0.0000          ?        ?   133.4510  14.6860          ?        ?      115.1        6.4       ?       ? 
1 1 1   35   32   37 o    126.4    6.3    0.0000   0.0000          ?        ?   160.9075  15.9630          ?        ?      126.4        6.3       ?       ? 
1 1 1   35   32   38 o     49.2   14.9    0.0000   0.0000          ?        ?    25.5409  15.9630          ?        ?       49.2       14.9       ?       ? 
1 1 1   35   32   39 o     40.5   14.9    0.0000   0.0000          ?        ?    14.0475  15.9630          ?        ?       40.5       14.9       ?       ? 
1 1 1   35   32   40 o    124.8    6.1    0.0000   0.0000          ?        ?   157.0763  15.3245          ?        ?      124.8        6.1       ?       ? 
1 1 1   35   33    0 o    464.0    7.4 2158.8416  68.9603  2158.8416  68.9603  2158.8416  68.9603      464.0      7.4      464.0        7.4     0.0     0.0 
1 1 1   35   33    1 f    301.3   10.5    0.0000   0.0000          ?        ?   915.6400  63.2136          ?        ?      301.3       10.5       ?       ? 
1 1 1   35   33    2 o    232.8    7.7    0.0000   0.0000          ?        ?   544.6590  35.7572          ?        ?      232.8        7.7       ?       ? 
1 1 1   35   33    3 f    319.5    5.0    0.0000   0.0000          ?        ?  1022.9116  31.9261          ?        ?      319.5        5.0       ?       ? 
1 1 1   35   33    4 o    146.7    8.7    0.0000   0.0000          ?        ?   216.4588  25.5409          ?        ?      146.7        8.7       ?       ? 
1 1 1   35   33    5 o    278.3    6.5    0.0000   0.0000          ?        ?   777.0808  36.3957          ?        ?      278.3        6.5       ?       ? 
1 1 1   35   33    6 o    121.8   14.2    0.0000   0.0000          ?        ?   150.6911  34.4802          ?        ?      121.8       14.2       ?       ? 
1 1 1   35   33    7 o    404.3    5.8    0.0000   0.0000          ?        ?  1639.0851  47.2506          ?        ?      404.3        5.8       ?       ? 
1 1 1   35   33    8 o    220.0    8.4    0.0000   0.0000          ?        ?   486.5535  37.0343          ?        ?      220.0        8.4       ?       ? 
1 1 1   35   33    9 o     82.8   27.6    0.0000   0.0000          ?        ?    70.2374  53.6358          ?        ?       82.8       27.6       ?       ? 
1 1 1   35   33   10 o     51.0   21.1    0.0000   0.0000          ?        ?     8.9393  35.1187          ?        ?       51.0       21.1       ?       ? 
1 1 1   35   33   11 f     79.6   18.4    0.0000   0.0000          ?        ?    67.6833  28.7335          ?        ?       79.6       18.4       ?       ? 
1 1 1   35   33   12 o     54.1   20.5    0.0000   0.0000          ?        ?    22.3483  30.6490          ?        ?       54.1       20.5       ?       ? 
1 1 1   35   33   13 o    214.9    4.9    0.0000   0.0000          ?        ?   462.9282  21.0712          ?        ?      214.9        4.9       ?       ? 
1 1 1   35   33   14 f    176.0    3.8    0.0000   0.0000          ?        ?   310.3215  13.4090          ?        ?      176.0        3.8       ?       ? 
1 1 1   35   33   15 o    270.0    3.3    0.0000   0.0000          ?        ?   729.8303  17.8786          ?        ?      270.0        3.3       ?       ? 
1 1 1   35   33   16 o    269.5    3.6    0.0000   0.0000          ?        ?   727.2761  19.1556          ?        ?      269.5        3.6       ?       ? 
1 1 1   35   33   17 o    306.5    3.3    0.0000   0.0000          ?        ?   940.5424  20.4327          ?        ?      306.5        3.3       ?       ? 
1 1 1   35   33   18 o    134.5    5.5    0.0000   0.0000          ?        ?   181.3401  14.6860          ?        ?      134.5        5.5       ?       ? 
1 1 1   35   33   19 o    263.8    3.6    0.0000   0.0000          ?        ?   696.6271  19.1556          ?        ?      263.8        3.6       ?       ? 
1 1 1   35   33   20 f    195.6    3.3    0.0000   0.0000          ?        ?   383.1130  12.7704          ?        ?      195.6        3.3       ?       ? 
1 1 1   35   33   21 o    117.3    4.1    0.0000   0.0000          ?        ?   137.9207   9.5778          ?        ?      117.3        4.1       ?       ? 
1 1 1   35   33   22 o     83.2    6.5    0.0000   0.0000          ?        ?    69.5989  10.8549          ?        ?       83.2        6.5       ?       ? 
1 1 1   35   33   23 o    245.9    2.9    0.0000   0.0000          ?        ?   605.3185  14.0475          ?        ?      245.9        2.9       ?       ? 
1 1 1   35   33   24 o    355.1    2.4    0.0000   0.0000          ?        ?  1261.7188  17.2401          ?        ?      355.1        2.4       ?       ? 
1 1 1   35   33   25 o    142.3    4.3    0.0000   0.0000          ?        ?   203.0499  12.1319          ?        ?      142.3        4.3       ?       ? 
1 1 1   35   33   26 o     97.6    6.5    0.0000   0.0000          ?        ?    95.7782  12.7704          ?        ?       97.6        6.5       ?       ? 
1 1 1   35   33   27 o    146.3    4.4    0.0000   0.0000          ?        ?   214.5433  12.7704          ?        ?      146.3        4.4       ?       ? 
1 1 1   35   33   28 o    211.6    3.3    0.0000   0.0000          ?        ?   448.2422  14.0475          ?        ?      211.6        3.3       ?       ? 
1 1 1   35   33   29 o    370.3    2.6    0.0000   0.0000          ?        ?  1372.1830  19.1556          ?        ?      370.3        2.6       ?       ? 
1 1 1   35   33   30 o    296.0    2.9    0.0000   0.0000          ?        ?   877.3287  17.2401          ?        ?      296.0        2.9       ?       ? 
1 1 1   35   33   31 f    117.7    6.0    0.0000   0.0000          ?        ?   139.1977  14.0475          ?        ?      117.7        6.0       ?       ? 
1 1 1   35   33   32 o     97.8    7.5    0.0000   0.0000          ?        ?    96.4168  14.6860          ?        ?       97.8        7.5       ?       ? 
1 1 1   35   33   33 o     61.3   11.9    0.0000   0.0000          ?        ?    39.5883  14.0475          ?        ?       61.3       11.9       ?       ? 
1 1 1   35   33   34 o    136.9    5.1    0.0000   0.0000          ?        ?   188.3639  14.0475          ?        ?      136.9        5.1       ?       ? 
1 1 1   35   33   35 o    234.2    3.4    0.0000   0.0000          ?        ?   549.7671  15.9630          ?        ?      234.2        3.4       ?       ? 
1 1 1   35   33   36 o     64.6   11.8    0.0000   0.0000          ?        ?    44.0580  14.6860          ?        ?       64.6       11.8       ?       ? 
1 1 1   35   33   37 o    122.6    6.0    0.0000   0.0000          ?        ?   151.3296  14.6860          ?        ?      122.6        6.0       ?       ? 
1 1 1   35   33   38 o    100.4    7.9    0.0000   0.0000          ?        ?   102.1635  15.9630          ?        ?      100.4        7.9       ?       ? 
1 1 1   35   34    0 o    334.6    9.4 1126.3521  62.5751  1126.3521  62.5751  1126.3521  62.5751      334.6      9.4      334.6        9.4     0.0     0.0 
1 1 1   35   34    1 o     77.7   18.3    0.0000   0.0000          ?        ?    64.4907  28.0950          ?        ?       77.7       18.3       ?       ? 
1 1 1   35   34    2 o    136.7   10.0    0.0000   0.0000          ?        ?   188.3639  27.4564          ?        ?      136.7       10.0       ?       ? 
1 1 1   35   34    3 o    260.7    6.9    0.0000   0.0000          ?        ?   682.5797  35.7572          ?        ?      260.7        6.9       ?       ? 
1 1 1   35   34    4 o    287.3   10.4    0.0000   0.0000          ?        ?   833.2708  60.0210          ?        ?      287.3       10.4       ?       ? 
1 1 1   35   34    5 o    188.7    9.5    0.0000   0.0000          ?        ?   358.8492  35.7572          ?        ?      188.7        9.5       ?       ? 
1 1 1   35   34    6 o     97.6   20.6    0.0000   0.0000          ?        ?   102.1635  38.9498          ?        ?       97.6       20.6       ?       ? 
1 1 1   35   34    7 o    134.5   16.4    0.0000   0.0000          ?        ?   185.1713  44.0580          ?        ?      134.5       16.4       ?       ? 
1 1 1   35   34    8 o     35.5   16.4    0.0000   0.0000          ?        ?   -21.7097  27.4564          ?        ?       35.5       16.4       ?       ? 
1 1 1   35   34    9 o    125.1   11.5    0.0000   0.0000          ?        ?   158.3534  28.7335          ?        ?      125.1       11.5       ?       ? 
1 1 1   35   34   10 o    300.7    7.7    0.0000   0.0000          ?        ?   909.2548  46.6121          ?        ?      300.7        7.7       ?       ? 
1 1 1   35   34   11 o    162.3   14.9    0.0000   0.0000          ?        ?   268.8176  48.5276          ?        ?      162.3       14.9       ?       ? 
1 1 1   35   34   12 o    117.8   19.5    0.0000   0.0000          ?        ?   143.6674  45.9736          ?        ?      117.8       19.5       ?       ? 
1 1 1   35   34   13 o    247.8    6.2    0.0000   0.0000          ?        ?   616.1733  30.6490          ?        ?      247.8        6.2       ?       ? 
1 1 1   35   34   14 o    269.3    3.2    0.0000   0.0000          ?        ?   725.9991  17.2401          ?        ?      269.3        3.2       ?       ? 
1 1 1   35   34   15 o     50.4   12.2    0.0000   0.0000          ?        ?    26.8179  12.1319          ?        ?       50.4       12.2       ?       ? 
1 1 1   35   34   16 o    123.4    5.4    0.0000   0.0000          ?        ?   152.6067  13.4090          ?        ?      123.4        5.4       ?       ? 
1 1 1   35   34   17 o    160.2    4.6    0.0000   0.0000          ?        ?   257.3242  14.6860          ?        ?      160.2        4.6       ?       ? 
1 1 1   35   34   18 o    285.9    3.8    0.0000   0.0000          ?        ?   818.5847  21.7097          ?        ?      285.9        3.8       ?       ? 
1 1 1   35   34   19 o     23.0   11.3    0.0000   0.0000          ?        ?   -35.7572  17.8786          ?        ?       23.0       11.3       ?       ? 
1 1 1   35   34   20 o     29.1   13.0    0.0000   0.0000          ?        ?    -5.7467  15.3245          ?        ?       29.1       13.0       ?       ? 
1 1 1   35   34   21 f    192.3    3.3    0.0000   0.0000          ?        ?   370.3425  12.7704          ?        ?      192.3        3.3       ?       ? 
1 1 1   35   34   22 o    205.3    2.8    0.0000   0.0000          ?        ?   422.0628  11.4934          ?        ?      205.3        2.8       ?       ? 
1 1 1   35   34   23 o     95.4    5.7    0.0000   0.0000          ?        ?    91.3086  10.8549          ?        ?       95.4        5.7       ?       ? 
1 1 1   35   34   24 o    117.5    4.9    0.0000   0.0000          ?        ?   138.5592  11.4934          ?        ?      117.5        4.9       ?       ? 
1 1 1   35   34   25 o    177.7    3.4    0.0000   0.0000          ?        ?   316.0682  12.1319          ?        ?      177.7        3.4       ?       ? 
1 1 1   35   34   26 o     95.6    6.3    0.0000   0.0000          ?        ?    91.9471  12.1319          ?        ?       95.6        6.3       ?       ? 
1 1 1   35   34   27 o    205.8    3.1    0.0000   0.0000          ?        ?   423.9784  12.7704          ?        ?      205.8        3.1       ?       ? 
1 1 1   35   34   28 f    161.8    4.1    0.0000   0.0000          ?        ?   262.4324  13.4090          ?        ?      161.8        4.1       ?       ? 
1 1 1   35   34   29 o    225.0    3.3    0.0000   0.0000          ?        ?   506.9862  14.6860          ?        ?      225.0        3.3       ?       ? 
1 1 1   35   34   30 o    137.9    5.1    0.0000   0.0000          ?        ?   190.9180  14.0475          ?        ?      137.9        5.1       ?       ? 
1 1 1   35   34   31 o     76.6    8.8    0.0000   0.0000          ?        ?    59.3825  13.4090          ?        ?       76.6        8.8       ?       ? 
1 1 1   35   34   32 o    134.9    5.0    0.0000   0.0000          ?        ?   182.6172  13.4090          ?        ?      134.9        5.0       ?       ? 
1 1 1   35   34   33 o     93.4    7.5    0.0000   0.0000          ?        ?    88.1160  14.0475          ?        ?       93.4        7.5       ?       ? 
1 1 1   35   34   34 o    210.3    3.5    0.0000   0.0000          ?        ?   443.1340  14.6860          ?        ?      210.3        3.5       ?       ? 
1 1 1   35   34   35 o    150.6    4.9    0.0000   0.0000          ?        ?   227.9522  14.6860          ?        ?      150.6        4.9       ?       ? 
1 1 1   35   34   36 o     94.7    7.4    0.0000   0.0000          ?        ?    90.6701  14.0475          ?        ?       94.7        7.4       ?       ? 
1 1 1   35   35    0 o   1088.2   21.8 11988.2432 475.0601 11988.2432 475.0601 11988.2432 475.0601     1088.2     21.8     1088.2       21.8     0.0     0.0 
1 1 1   35   35    1 o    429.8    8.6 1855.5439  73.4300  1855.5439  73.4300  1855.5439  73.4300      429.8      8.6      429.8        8.6     0.0     0.0 
1 1 1   35   35    2 o    183.9   16.2  349.9099  58.7440   349.9099  58.7440   349.9099  58.7440      183.9     16.2      183.9       16.2     0.0     0.0 
1 1 1   35   35    3 o     47.3   29.7   17.8786  56.8284    17.8786  56.8284    17.8786  56.8284       47.3     29.7       47.3       29.7     0.0     0.0 
1 1 1   35   35    4 o     36.8   24.2   -2.5541  43.4195    -2.5541  43.4195    -2.5541  43.4195       36.8     24.2       36.8       24.2     0.0     0.0 
1 1 1   35   35    5 o     63.0   28.5   59.3825  38.3113    59.3825  38.3113    59.3825  38.3113       63.0     28.5       63.0       28.5     0.0     0.0 
1 1 1   35   35    6 o    230.5   11.4  538.2737  52.3588   538.2737  52.3588   538.2737  52.3588      230.5     11.4      230.5       11.4     0.0     0.0 
1 1 1   35   35    7 o     46.1   30.5   -6.3852  70.8759    -6.3852  70.8759    -6.3852  70.8759       46.1     30.5       46.1       30.5     0.0     0.0 
1 1 1   35   35    8 o     34.0   24.5 -111.7413  76.6226  -111.7413  76.6226  -111.7413  76.6226       34.0     24.5       34.0       24.5     0.0     0.0 
1 1 1   35   35    9 o     26.5   19.8 -240.0841  78.5382  -240.0841  78.5382  -240.0841  78.5382       26.5     19.8       26.5       19.8     0.0     0.0 
1 1 1   35   35   10 o     23.3   16.9  -58.1055  37.0343   -58.1055  37.0343   -58.1055  37.0343       23.3     16.9       23.3       16.9     0.0     0.0 
1 1 1   35   35   11 o    240.7    9.9  584.8858  47.2506   584.8858  47.2506   584.8858  47.2506      240.7      9.9      240.7        9.9     0.0     0.0 
1 1 1   35   35   12 o     32.4   22.8  -45.3350  52.9973   -45.3350  52.9973   -45.3350  52.9973       32.4     22.8       32.4       22.8     0.0     0.0 
1 1 1   35   35   13 o     27.5   20.0 -102.8020  56.8284  -102.8020  56.8284  -102.8020  56.8284       27.5     20.0       27.5       20.0     0.0     0.0 
1 1 1   35   35   14 o     30.9   22.1  -71.5144  57.4669   -71.5144  57.4669   -71.5144  57.4669       30.9     22.1       30.9       22.1     0.0     0.0 
1 1 1   35   35   15 o     15.9   11.5  -22.3483  15.9630   -22.3483  15.9630   -22.3483  15.9630       15.9     11.5       15.9       11.5     0.0     0.0 
1 1 1   35   35   16 o    113.2    8.6  130.8969  19.1556   130.8969  19.1556   130.8969  19.1556      113.2      8.6      113.2        8.6     0.0     0.0 
1 1 1   35   35   17 o    138.3    7.4  193.4720  20.4327   193.4720  20.4327   193.4720  20.4327      138.3      7.4      138.3        7.4     0.0     0.0 
1 1 1   35   35   18 o    178.4    6.6  320.5379  23.6253   320.5379  23.6253   320.5379  23.6253      178.4      6.6      178.4        6.6     0.0     0.0 
1 1 1   35   35   19 f     36.3   20.5   18.5171  22.3483    18.5171  22.3483    18.5171  22.3483       36.3     20.5       36.3       20.5     0.0     0.0 
1 1 1   35   35   20 o    101.1   12.6  107.9102  24.9023   107.9102  24.9023   107.9102  24.9023      101.1     12.6      101.1       12.6     0.0     0.0 
1 1 1   35   35   21 o    235.3    6.0  556.1523  28.0950   556.1523  28.0950   556.1523  28.0950      235.3      6.0      235.3        6.0     0.0     0.0 
1 1 1   35   35   22 o     15.2   10.7  -12.1319  12.1319   -12.1319  12.1319   -12.1319  12.1319       15.2     10.7       15.2       10.7     0.0     0.0 
1 1 1   35   35   23 o     62.8   13.3   44.6965  14.6860    44.6965  14.6860    44.6965  14.6860       62.8     13.3       62.8       13.3     0.0     0.0 
1 1 1   35   35   24 o    155.6    5.1  243.2767  15.9630   243.2767  15.9630   243.2767  15.9630      155.6      5.1      155.6        5.1     0.0     0.0 
1 1 1   35   35   25 o     32.9   17.7   15.9630  15.9630    15.9630  15.9630    15.9630  15.9630       32.9     17.7       32.9       17.7     0.0     0.0 
1 1 1   35   35   26 o     17.7   12.4  -14.6860  15.9630   -14.6860  15.9630   -14.6860  15.9630       17.7     12.4       17.7       12.4     0.0     0.0 
1 1 1   35   35   27 o     46.0   18.6   30.0105  16.6016    30.0105  16.6016    30.0105  16.6016       46.0     18.6       46.0       18.6     0.0     0.0 
1 1 1   35   35   28 o    368.7    3.6 1361.3281  26.1794  1361.3281  26.1794  1361.3281  26.1794      368.7      3.6      368.7        3.6     0.0     0.0 
1 1 1   35   35   29 o    202.4    4.9  411.2079  19.7942   411.2079  19.7942   411.2079  19.7942      202.4      4.9      202.4        4.9     0.0     0.0 
1 1 1   35   35   30 o     67.3   15.3   52.3588  17.8786    52.3588  17.8786    52.3588  17.8786       67.3     15.3       67.3       15.3     0.0     0.0 
1 1 1   35   35   31 o    186.6    5.5  349.9099  20.4327   349.9099  20.4327   349.9099  20.4327      186.6      5.5      186.6        5.5     0.0     0.0 
1 1 1   35   35   32 o    106.9    8.8  117.4880  18.5171   117.4880  18.5171   117.4880  18.5171      106.9      8.8      106.9        8.8     0.0     0.0 
1 1 1   35   35   33 o    284.8    4.5  813.4766  25.5409   813.4766  25.5409   813.4766  25.5409      284.8      4.5      284.8        4.5     0.0     0.0 
1 1 1   35   35   34 o    187.5    5.5  353.7410  20.4327   353.7410  20.4327   353.7410  20.4327      187.5      5.5      187.5        5.5     0.0     0.0 
1 1 1   36    0    0 o   2910.7   19.0 84771.4062 1103.3654 84771.4062 1103.3654 84771.4062 1103.3654     2910.7     19.0     2910.7       19.0     0.0     0.0 
1 1 1   36    0    1 o    398.2    3.8 1586.0876  30.0105  1586.0876  30.0105  1586.0876  30.0105      398.2      3.8      398.2        3.8     0.0     0.0 
1 1 1   36    0    2 o    204.5    4.1  418.8702  16.6016   418.8702  16.6016   418.8702  16.6016      204.5      4.1      204.5        4.1     0.0     0.0 
1 1 1   36    0    3 o    354.6    3.3 1257.8876  23.6253  1257.8876  23.6253  1257.8876  23.6253      354.6      3.3      354.6        3.3     0.0     0.0 
1 1 1   36    0    4 o     44.8   17.3   27.4564  14.6860    27.4564  14.6860    27.4564  14.6860       44.8     17.3       44.8       17.3     0.0     0.0 
1 1 1   36    0    5 o    864.3    4.8 7471.3413  82.3693  7471.3413  82.3693  7471.3413  82.3693      864.3      4.8      864.3        4.8     0.0     0.0 
1 1 1   36    0    6 o    488.6    3.5 2387.4324  34.4802  2387.4324  34.4802  2387.4324  34.4802      488.6      3.5      488.6        3.5     0.0     0.0 
1 1 1   36    0    7 o    256.1    3.9  656.4003  19.7942   656.4003  19.7942   656.4003  19.7942      256.1      3.9      256.1        3.9     0.0     0.0 
1 1 1   36    0    8 o    835.2    4.6 6976.4873  77.2611  6976.4873  77.2611  6976.4873  77.2611      835.2      4.6      835.2        4.6     0.0     0.0 
1 1 1   36    0    9 o    190.6    4.7  363.9573  17.8786   363.9573  17.8786   363.9573  17.8786      190.6      4.7      190.6        4.7     0.0     0.0 
1 1 1   36    0   10 o    173.7    5.5  302.6593  19.1556   302.6593  19.1556   302.6593  19.1556      173.7      5.5      173.7        5.5     0.0     0.0 
1 1 1   36    0   11 o    806.3    4.5 6502.7046  72.7915  6502.7046  72.7915  6502.7046  72.7915      806.3      4.5      806.3        4.5     0.0     0.0 
1 1 1   36    0   12 f    278.3    3.8  775.1653  21.0712   775.1653  21.0712   775.1653  21.0712      278.3      3.8      278.3        3.8     0.0     0.0 
1 1 1   36    0   13 o    187.9    6.1  354.3795  22.9868   354.3795  22.9868   354.3795  22.9868      187.9      6.1      187.9        6.1     0.0     0.0 
1 1 1   36    0   14 o   2930.1   16.3 85929.0469 955.2284 85929.0469 955.2284 85929.0469 955.2284     2930.1     16.3     2930.1       16.3     0.0     0.0 
1 1 1   36    0   15 o   1350.8    6.6 18250.8633 178.1475 18250.8633 178.1475 18250.8633 178.1475     1350.8      6.6     1350.8        6.6     0.0     0.0 
1 1 1   36    0   16 o    697.6    4.3 4867.4502  60.0210  4867.4502  60.0210  4867.4502  60.0210      697.6      4.3      697.6        4.3     0.0     0.0 
1 1 1   36    0   17 o    433.1    3.8 1876.6150  33.2031  1876.6150  33.2031  1876.6150  33.2031      433.1      3.8      433.1        3.8     0.0     0.0 
1 1 1   36    0   18 o   1030.7    5.5 10626.2764 114.2954 10626.2764 114.2954 10626.2764 114.2954     1030.7      5.5     1030.7        5.5     0.0     0.0 
1 1 1   36    0   19 o     60.7   16.5   44.0580  17.2401    44.0580  17.2401    44.0580  17.2401       60.7     16.5       60.7       16.5     0.0     0.0 
1 1 1   36    0   20 o    142.3    6.3  203.6884  17.8786   203.6884  17.8786   203.6884  17.8786      142.3      6.3      142.3        6.3     0.0     0.0 
1 1 1   36    0   21 o   1211.4    6.6 14678.3359 158.9919 14678.3359 158.9919 14678.3359 158.9919     1211.4      6.6     1211.4        6.6     0.0     0.0 
1 1 1   36    0   22 o    849.8    4.7 7223.5957  79.1767  7223.5957  79.1767  7223.5957  79.1767      849.8      4.7      849.8        4.7     0.0     0.0 
1 1 1   36    0   23 o     45.4   19.4   29.3720  17.8786    29.3720  17.8786    29.3720  17.8786       45.4     19.4       45.4       19.4     0.0     0.0 
1 1 1   36    0   24 o    390.4    3.6 1524.7897  28.0950  1524.7897  28.0950  1524.7897  28.0950      390.4      3.6      390.4        3.6     0.0     0.0 
1 1 1   36    0   25 o    373.4    3.8 1394.5312  28.0950  1394.5312  28.0950  1394.5312  28.0950      373.4      3.8      373.4        3.8     0.0     0.0 
1 1 1   36    0   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    0   27 f   1723.7   10.5 29734.6738 363.3188 29734.6738 363.3188 29734.6738 363.3188     1723.7     10.5     1723.7       10.5     0.0     0.0 
1 1 1   36    0   28 o    480.9    3.6 2313.3638  34.4802  2313.3638  34.4802  2313.3638  34.4802      480.9      3.6      480.9        3.6     0.0     0.0 
1 1 1   36    0   29 o    395.7    3.4 1566.2936  26.8179  1566.2936  26.8179  1566.2936  26.8179      395.7      3.4      395.7        3.4     0.0     0.0 
1 1 1   36    0   30 o    384.2    3.7 1476.9005  28.0950  1476.9005  28.0950  1476.9005  28.0950      384.2      3.7      384.2        3.7     0.0     0.0 
1 1 1   36    0   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    0   32 o    395.3    3.7 1563.1010  29.3720  1563.1010  29.3720  1563.1010  29.3720      395.3      3.7      395.3        3.7     0.0     0.0 
1 1 1   36    0   33 o    516.5    4.0 2668.3818  40.8654  2668.3818  40.8654  2668.3818  40.8654      516.5      4.0      516.5        4.0     0.0     0.0 
1 1 1   36    0   34 o    331.8    3.8 1101.4498  24.9023  1101.4498  24.9023  1101.4498  24.9023      331.8      3.8      331.8        3.8     0.0     0.0 
1 1 1   36    0   35 o     15.3   11.4  -61.2981  22.9868   -61.2981  22.9868   -61.2981  22.9868       15.3     11.4       15.3       11.4     0.0     0.0 
1 1 1   36    0   36 o    407.0    3.5 1656.9636  28.7335  1656.9636  28.7335  1656.9636  28.7335      407.0      3.5      407.0        3.5     0.0     0.0 
1 1 1   36    0   37 o     91.4   11.5   87.4775  20.4327    87.4775  20.4327    87.4775  20.4327       91.4     11.5       91.4       11.5     0.0     0.0 
1 1 1   36    0   38 o    371.5    3.7 1380.4838  27.4564  1380.4838  27.4564  1380.4838  27.4564      371.5      3.7      371.5        3.7     0.0     0.0 
1 1 1   36    0   39 f    119.5    9.2  145.5829  21.7097   145.5829  21.7097   145.5829  21.7097      119.5      9.2      119.5        9.2     0.0     0.0 
1 1 1   36    0   40 o    259.7    4.8  675.5559  24.9023   675.5559  24.9023   675.5559  24.9023      259.7      4.8      259.7        4.8     0.0     0.0 
1 1 1   36    0   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    0   42 o    515.1    3.8 2654.3345  38.9498  2654.3345  38.9498  2654.3345  38.9498      515.1      3.8      515.1        3.8     0.0     0.0 
1 1 1   36    0   43 o    757.2    4.2 5736.4785  63.8522  5736.4785  63.8522  5736.4785  63.8522      757.2      4.2      757.2        4.2     0.0     0.0 
1 1 1   36    0   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    0   45 o    685.4    4.1 4699.5190  55.5514  4699.5190  55.5514  4699.5190  55.5514      685.4      4.1      685.4        4.1     0.0     0.0 
1 1 1   36    0   46 o    517.6    3.8 2679.8752  38.9498  2679.8752  38.9498  2679.8752  38.9498      517.6      3.8      517.6        3.8     0.0     0.0 
1 1 1   36    0   47 o    168.6    6.8  286.0577  22.9868   286.0577  22.9868   286.0577  22.9868      168.6      6.8      168.6        6.8     0.0     0.0 
1 1 1   36    0   48 o    133.3    9.4  180.7016  24.9023   180.7016  24.9023   180.7016  24.9023      133.3      9.4      133.3        9.4     0.0     0.0 
1 1 1   36    0   49 o     14.4   10.8  -84.9234  24.9023   -84.9234  24.9023   -84.9234  24.9023       14.4     10.8       14.4       10.8     0.0     0.0 
1 1 1   36    0   50 o    437.9    3.7 1918.7574  32.5646  1918.7574  32.5646  1918.7574  32.5646      437.9      3.7      437.9        3.7     0.0     0.0 
1 1 1   36    0   51 o    371.1    4.0 1377.9297  29.3720  1377.9297  29.3720  1377.9297  29.3720      371.1      4.0      371.1        4.0     0.0     0.0 
1 1 1   36    0   52 o    468.4    3.8 2195.2373  35.7572  2195.2373  35.7572  2195.2373  35.7572      468.4      3.8      468.4        3.8     0.0     0.0 
1 1 1   36    0   53 o    395.9    4.1 1568.8477  32.5646  1568.8477  32.5646  1568.8477  32.5646      395.9      4.1      395.9        4.1     0.0     0.0 
1 1 1   36    0   54 o    109.0   12.3  123.8732  26.1794   123.8732  26.1794   123.8732  26.1794      109.0     12.3      109.0       12.3     0.0     0.0 
1 1 1   36    0   55 o    284.0    5.0  807.7299  28.0950   807.7299  28.0950   807.7299  28.0950      284.0      5.0      284.0        5.0     0.0     0.0 
1 1 1   36    0   56 o    132.9   10.0  180.0631  26.1794   180.0631  26.1794   180.0631  26.1794      132.9     10.0      132.9       10.0     0.0     0.0 
1 1 1   36    0   57 o     32.9   20.5    8.3008  26.8179     8.3008  26.8179     8.3008  26.8179       32.9     20.5       32.9       20.5     0.0     0.0 
1 1 1   36    0   58 o     64.2   22.1   54.2743  25.5409    54.2743  25.5409    54.2743  25.5409       64.2     22.1       64.2       22.1     0.0     0.0 
1 1 1   36    0   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    0   60 o     83.9   18.2   80.4537  26.8179    80.4537  26.8179    80.4537  26.8179       83.9     18.2       83.9       18.2     0.0     0.0 
1 1 1   36    0   61 o    121.4   11.2  151.9681  26.8179   151.9681  26.8179   151.9681  26.8179      121.4     11.2      121.4       11.2     0.0     0.0 
1 1 1   36    0   62 o    175.7    7.8  311.5985  27.4564   311.5985  27.4564   311.5985  27.4564      175.7      7.8      175.7        7.8     0.0     0.0 
1 1 1   36    0   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    0   64 o    169.8    8.7  291.8044  29.3720   291.8044  29.3720   291.8044  29.3720      169.8      8.7      169.8        8.7     0.0     0.0 
1 1 1   36    0   65 o     18.6   13.7  -67.6833  30.0105   -67.6833  30.0105   -67.6833  30.0105       18.6     13.7       18.6       13.7     0.0     0.0 
1 1 1   36    0   66 o     26.4   18.1  -14.0475  28.7335   -14.0475  28.7335   -14.0475  28.7335       26.4     18.1       26.4       18.1     0.0     0.0 
1 1 1   36    0   67 o    145.1   10.0  215.1818  28.7335   215.1818  28.7335   215.1818  28.7335      145.1     10.0      145.1       10.0     0.0     0.0 
1 1 1   36    0   68 o     35.8   21.8   14.0475  28.7335    14.0475  28.7335    14.0475  28.7335       35.8     21.8       35.8       21.8     0.0     0.0 
1 1 1   36    0   69 o    181.1    8.0  332.0312  28.7335   332.0312  28.7335   332.0312  28.7335      181.1      8.0      181.1        8.0     0.0     0.0 
1 1 1   36    1    0 o     11.7    8.7  -48.5276  15.3245   -48.5276  15.3245   -48.5276  15.3245       11.7      8.7       11.7        8.7     0.0     0.0 
1 1 1   36    1    1 o    957.6    3.5    0.0000   0.0000          ?        ?  9171.0869  67.6833          ?        ?      957.6        3.5       ?       ? 
1 1 1   36    1    2 o    391.2    2.4    0.0000   0.0000          ?        ?  1530.5364  18.5171          ?        ?      391.2        2.4       ?       ? 
1 1 1   36    1    3 o   1011.9    3.7    0.0000   0.0000          ?        ? 10239.9707  74.7070          ?        ?     1011.9        3.7       ?       ? 
1 1 1   36    1    4 o    689.1    2.9    0.0000   0.0000          ?        ?  4749.3237  40.2269          ?        ?      689.1        2.9       ?       ? 
1 1 1   36    1    5 o    644.6    2.9    0.0000   0.0000          ?        ?  4154.8604  37.6728          ?        ?      644.6        2.9       ?       ? 
1 1 1   36    1    6 f   1024.9    3.9    0.0000   0.0000          ?        ? 10504.9570  80.4537          ?        ?     1024.9        3.9       ?       ? 
1 1 1   36    1    7 o   1794.1    6.0    0.0000   0.0000          ?        ? 32194.9004 215.1818          ?        ?     1794.1        6.0       ?       ? 
1 1 1   36    1    8 o   1140.5    4.3    0.0000   0.0000          ?        ? 13009.2402  97.0553          ?        ?     1140.5        4.3       ?       ? 
1 1 1   36    1    9 o   1011.3    3.7    0.0000   0.0000          ?        ? 10227.8398  75.3456          ?        ?     1011.3        3.7       ?       ? 
1 1 1   36    1   10 o    679.0    2.9    0.0000   0.0000          ?        ?  4610.7646  38.9498          ?        ?      679.0        2.9       ?       ? 
1 1 1   36    1   11 o   1345.2    4.7    0.0000   0.0000          ?        ? 18097.6191 127.0658          ?        ?     1345.2        4.7       ?       ? 
1 1 1   36    1   12 o    478.0    2.5    0.0000   0.0000          ?        ?  2284.6304  23.6253          ?        ?      478.0        2.5       ?       ? 
1 1 1   36    1   13 o     95.2    5.7    0.0000   0.0000          ?        ?    90.6701  10.8549          ?        ?       95.2        5.7       ?       ? 
1 1 1   36    1   14 o   1299.7    4.6    0.0000   0.0000          ?        ? 16893.3672 119.4035          ?        ?     1299.7        4.6       ?       ? 
1 1 1   36    1   15 o    911.8    3.5    0.0000   0.0000          ?        ?  8313.5518  63.2136          ?        ?      911.8        3.5       ?       ? 
1 1 1   36    1   16 o    309.0    2.8    0.0000   0.0000          ?        ?   954.5898  17.2401          ?        ?      309.0        2.8       ?       ? 
1 1 1   36    1   17 f    658.1    2.8    0.0000   0.0000          ?        ?  4331.7310  37.0343          ?        ?      658.1        2.8       ?       ? 
1 1 1   36    1   18 o    915.0    3.5    0.0000   0.0000          ?        ?  8373.5732  63.2136          ?        ?      915.0        3.5       ?       ? 
1 1 1   36    1   19 o    151.6    4.0    0.0000   0.0000          ?        ?   229.8678  12.1319          ?        ?      151.6        4.0       ?       ? 
1 1 1   36    1   20 o    625.1    2.7    0.0000   0.0000          ?        ?  3907.7524  33.8416          ?        ?      625.1        2.7       ?       ? 
1 1 1   36    1   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    1   22 o    355.2    2.5    0.0000   0.0000          ?        ?  1261.7188  17.8786          ?        ?      355.2        2.5       ?       ? 
1 1 1   36    1   23 o   1289.9    4.4    0.0000   0.0000          ?        ? 16641.1504 114.2954          ?        ?     1289.9        4.4       ?       ? 
1 1 1   36    1   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    1   25 o    255.4    3.2    0.0000   0.0000          ?        ?   652.5691  16.6016          ?        ?      255.4        3.2       ?       ? 
1 1 1   36    1   26 o    636.4    2.9    0.0000   0.0000          ?        ?  4050.7812  37.0343          ?        ?      636.4        2.9       ?       ? 
1 1 1   36    1   27 o    484.1    2.5    0.0000   0.0000          ?        ?  2343.3743  24.2638          ?        ?      484.1        2.5       ?       ? 
1 1 1   36    1   28 o    258.7    3.1    0.0000   0.0000          ?        ?   669.1707  15.9630          ?        ?      258.7        3.1       ?       ? 
1 1 1   36    1   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    1   30 o    273.1    2.9    0.0000   0.0000          ?        ?   745.7933  15.9630          ?        ?      273.1        2.9       ?       ? 
1 1 1   36    1   31 o    494.9    2.5    0.0000   0.0000          ?        ?  2449.3689  24.9023          ?        ?      494.9        2.5       ?       ? 
1 1 1   36    1   32 o     22.2   10.8    0.0000   0.0000          ?        ?   -24.2638  14.6860          ?        ?       22.2       10.8       ?       ? 
1 1 1   36    1   33 o    217.2    3.5    0.0000   0.0000          ?        ?   471.8675  15.3245          ?        ?      217.2        3.5       ?       ? 
1 1 1   36    1   34 o    689.8    2.8    0.0000   0.0000          ?        ?  4759.5405  38.9498          ?        ?      689.8        2.8       ?       ? 
1 1 1   36    1   35 o     86.0    9.3    0.0000   0.0000          ?        ?    74.0685  15.9630          ?        ?       86.0        9.3       ?       ? 
1 1 1   36    1   36 o    148.8    4.9    0.0000   0.0000          ?        ?   221.5670  14.6860          ?        ?      148.8        4.9       ?       ? 
1 1 1   36    1   37 o    362.8    2.6    0.0000   0.0000          ?        ?  1316.6316  19.1556          ?        ?      362.8        2.6       ?       ? 
1 1 1   36    1   38 o    167.0    4.6    0.0000   0.0000          ?        ?   279.0340  15.3245          ?        ?      167.0        4.6       ?       ? 
1 1 1   36    1   39 o    307.8    2.9    0.0000   0.0000          ?        ?   947.5660  17.8786          ?        ?      307.8        2.9       ?       ? 
1 1 1   36    1   40 o    390.6    2.6    0.0000   0.0000          ?        ?  1526.0667  20.4327          ?        ?      390.6        2.6       ?       ? 
1 1 1   36    1   41 o    574.0    2.6    0.0000   0.0000          ?        ?  3295.4099  30.0105          ?        ?      574.0        2.6       ?       ? 
1 1 1   36    1   42 f    122.9    6.2    0.0000   0.0000          ?        ?   151.3296  15.3245          ?        ?      122.9        6.2       ?       ? 
1 1 1   36    1   43 o    356.9    3.0    0.0000   0.0000          ?        ?  1274.4893  21.0712          ?        ?      356.9        3.0       ?       ? 
1 1 1   36    1   44 o    354.2    2.7    0.0000   0.0000          ?        ?  1254.6949  19.1556          ?        ?      354.2        2.7       ?       ? 
1 1 1   36    1   45 o    264.2    3.1    0.0000   0.0000          ?        ?   698.5427  16.6016          ?        ?      264.2        3.1       ?       ? 
1 1 1   36    1   46 f    164.6    5.0    0.0000   0.0000          ?        ?   271.3717  16.6016          ?        ?      164.6        5.0       ?       ? 
1 1 1   36    1   47 o    105.3    7.6    0.0000   0.0000          ?        ?   111.1028  15.9630          ?        ?      105.3        7.6       ?       ? 
1 1 1   36    1   48 o    123.1    7.0    0.0000   0.0000          ?        ?   151.9681  17.2401          ?        ?      123.1        7.0       ?       ? 
1 1 1   36    1   49 o    312.2    3.2    0.0000   0.0000          ?        ?   975.0225  19.7942          ?        ?      312.2        3.2       ?       ? 
1 1 1   36    1   50 o    509.9    2.7    0.0000   0.0000          ?        ?  2601.3372  27.4564          ?        ?      509.9        2.7       ?       ? 
1 1 1   36    1   51 o    160.9    5.6    0.0000   0.0000          ?        ?   259.2398  17.8786          ?        ?      160.9        5.6       ?       ? 
1 1 1   36    1   52 o    292.4    3.2    0.0000   0.0000          ?        ?   855.6190  18.5171          ?        ?      292.4        3.2       ?       ? 
1 1 1   36    1   53 o    241.3    3.8    0.0000   0.0000          ?        ?   582.9703  18.5171          ?        ?      241.3        3.8       ?       ? 
1 1 1   36    1   54 o     20.8   10.4    0.0000   0.0000          ?        ?   -48.5276  17.8786          ?        ?       20.8       10.4       ?       ? 
1 1 1   36    1   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    1   56 o    321.8    3.2    0.0000   0.0000          ?        ?  1036.3207  20.4327          ?        ?      321.8        3.2       ?       ? 
1 1 1   36    1   57 o     33.3   14.5    0.0000   0.0000          ?        ?    -2.5541  17.8786          ?        ?       33.3       14.5       ?       ? 
1 1 1   36    1   58 o     34.8   14.9    0.0000   0.0000          ?        ?    -0.6385  18.5171          ?        ?       34.8       14.9       ?       ? 
1 1 1   36    1   59 o     25.4   12.4    0.0000   0.0000          ?        ?   -37.0343  20.4327          ?        ?       25.4       12.4       ?       ? 
1 1 1   36    1   60 o    360.2    3.1    0.0000   0.0000          ?        ?  1298.7529  22.3483          ?        ?      360.2        3.1       ?       ? 
1 1 1   36    1   61 o    195.3    5.1    0.0000   0.0000          ?        ?   382.4745  19.7942          ?        ?      195.3        5.1       ?       ? 
1 1 1   36    1   62 o     53.0   16.7    0.0000   0.0000          ?        ?    28.7335  19.7942          ?        ?       53.0       16.7       ?       ? 
1 1 1   36    1   63 o    283.9    3.7    0.0000   0.0000          ?        ?   807.0914  21.0712          ?        ?      283.9        3.7       ?       ? 
1 1 1   36    1   64 o    245.5    4.3    0.0000   0.0000          ?        ?   604.0414  21.0712          ?        ?      245.5        4.3       ?       ? 
1 1 1   36    1   65 o     20.9   10.5    0.0000   0.0000          ?        ?   -64.4907  20.4327          ?        ?       20.9       10.5       ?       ? 
1 1 1   36    1   66 o    168.7    6.1    0.0000   0.0000          ?        ?   286.0577  20.4327          ?        ?      168.7        6.1       ?       ? 
1 1 1   36    1   67 o    107.3    9.2    0.0000   0.0000          ?        ?   116.8494  19.7942          ?        ?      107.3        9.2       ?       ? 
1 1 1   36    1   68 o    153.5    6.4    0.0000   0.0000          ?        ?   237.5300  19.7942          ?        ?      153.5        6.4       ?       ? 
1 1 1   36    1   69 o     47.9   16.7    0.0000   0.0000          ?        ?    22.3483  19.7942          ?        ?       47.9       16.7       ?       ? 
1 1 1   36    2    0 o   1068.6    5.5 11421.8750 116.8494 11421.8750 116.8494 11421.8750 116.8494     1068.6      5.5     1068.6        5.5     0.0     0.0 
1 1 1   36    2    1 o    402.2    2.5    0.0000   0.0000          ?        ?  1617.3752  20.4327          ?        ?      402.2        2.5       ?       ? 
1 1 1   36    2    2 o   1341.6    4.7    0.0000   0.0000          ?        ? 17999.9238 125.7888          ?        ?     1341.6        4.7       ?       ? 
1 1 1   36    2    3 o    717.2    3.0    0.0000   0.0000          ?        ?  5143.9302  42.7809          ?        ?      717.2        3.0       ?       ? 
1 1 1   36    2    4 f   1113.3    4.0    0.0000   0.0000          ?        ? 12396.2588  88.7545          ?        ?     1113.3        4.0       ?       ? 
1 1 1   36    2    5 o   1130.1    4.2    0.0000   0.0000          ?        ? 12772.9863  93.8627          ?        ?     1130.1        4.2       ?       ? 
1 1 1   36    2    6 o   1410.0    4.9    0.0000   0.0000          ?        ? 19883.5625 137.2822          ?        ?     1410.0        4.9       ?       ? 
1 1 1   36    2    7 o   1859.3    6.2    0.0000   0.0000          ?        ? 34577.2227 231.1448          ?        ?     1859.3        6.2       ?       ? 
1 1 1   36    2    8 o    307.5    2.6    0.0000   0.0000          ?        ?   945.6506  15.9630          ?        ?      307.5        2.6       ?       ? 
1 1 1   36    2    9 o    443.4    2.4    0.0000   0.0000          ?        ?  1966.0081  21.0712          ?        ?      443.4        2.4       ?       ? 
1 1 1   36    2   10 o    229.2    2.6    0.0000   0.0000          ?        ?   525.5033  12.1319          ?        ?      229.2        2.6       ?       ? 
1 1 1   36    2   11 o    595.9    2.6    0.0000   0.0000          ?        ?  3550.8186  30.6490          ?        ?      595.9        2.6       ?       ? 
1 1 1   36    2   12 o    410.4    2.3    0.0000   0.0000          ?        ?  1684.4199  19.1556          ?        ?      410.4        2.3       ?       ? 
1 1 1   36    2   13 o    425.5    2.4    0.0000   0.0000          ?        ?  1810.2089  20.4327          ?        ?      425.5        2.4       ?       ? 
1 1 1   36    2   14 o     34.0   13.8    0.0000   0.0000          ?        ?     4.4697  14.6860          ?        ?       34.0       13.8       ?       ? 
1 1 1   36    2   15 o   1342.2    4.6    0.0000   0.0000          ?        ? 18017.8027 124.5117          ?        ?     1342.2        4.6       ?       ? 
1 1 1   36    2   16 o    828.7    3.2    0.0000   0.0000          ?        ?  6868.5767  52.9973          ?        ?      828.7        3.2       ?       ? 
1 1 1   36    2   17 o    927.1    3.5    0.0000   0.0000          ?        ?  8595.7773  64.4907          ?        ?      927.1        3.5       ?       ? 
1 1 1   36    2   18 o   1060.7    3.8    0.0000   0.0000          ?        ? 11252.6670  79.8152          ?        ?     1060.7        3.8       ?       ? 
1 1 1   36    2   19 o    670.6    2.8    0.0000   0.0000          ?        ?  4497.7466  37.0343          ?        ?      670.6        2.8       ?       ? 
1 1 1   36    2   20 o    764.6    3.0    0.0000   0.0000          ?        ?  5846.9424  46.6121          ?        ?      764.6        3.0       ?       ? 
1 1 1   36    2   21 o    127.8    5.0    0.0000   0.0000          ?        ?   163.4615  12.7704          ?        ?      127.8        5.0       ?       ? 
1 1 1   36    2   22 o   1440.8    5.4    0.0000   0.0000          ?        ? 20766.0000 154.5222          ?        ?     1440.8        5.4       ?       ? 
1 1 1   36    2   23 o    888.3    3.5    0.0000   0.0000          ?        ?  7892.1274  61.2981          ?        ?      888.3        3.5       ?       ? 
1 1 1   36    2   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    2   25 o    339.5    2.6    0.0000   0.0000          ?        ?  1152.5315  17.8786          ?        ?      339.5        2.6       ?       ? 
1 1 1   36    2   26 o   1163.6    4.3    0.0000   0.0000          ?        ? 13541.7666  99.6094          ?        ?     1163.6        4.3       ?       ? 
1 1 1   36    2   27 o    303.9    2.6    0.0000   0.0000          ?        ?   923.9408  15.9630          ?        ?      303.9        2.6       ?       ? 
1 1 1   36    2   28 o    770.0    3.1    0.0000   0.0000          ?        ?  5929.3115  47.2506          ?        ?      770.0        3.1       ?       ? 
1 1 1   36    2   29 o    440.0    2.5    0.0000   0.0000          ?        ?  1936.6360  22.3483          ?        ?      440.0        2.5       ?       ? 
1 1 1   36    2   30 o   1000.2    3.6    0.0000   0.0000          ?        ? 10006.9102  72.1529          ?        ?     1000.2        3.6       ?       ? 
1 1 1   36    2   31 o    625.6    2.7    0.0000   0.0000          ?        ?  3914.7759  33.8416          ?        ?      625.6        2.7       ?       ? 
1 1 1   36    2   32 o    673.1    2.8    0.0000   0.0000          ?        ?  4530.9492  38.3113          ?        ?      673.1        2.8       ?       ? 
1 1 1   36    2   33 o    182.7    4.4    0.0000   0.0000          ?        ?   333.9468  15.9630          ?        ?      182.7        4.4       ?       ? 
1 1 1   36    2   34 o     25.9   12.1    0.0000   0.0000          ?        ?   -14.6860  15.3245          ?        ?       25.9       12.1       ?       ? 
1 1 1   36    2   35 o    787.8    3.1    0.0000   0.0000          ?        ?  6208.3457  48.5276          ?        ?      787.8        3.1       ?       ? 
1 1 1   36    2   36 o    564.2    2.5    0.0000   0.0000          ?        ?  3183.6689  28.7335          ?        ?      564.2        2.5       ?       ? 
1 1 1   36    2   37 o    146.6    4.8    0.0000   0.0000          ?        ?   215.1818  14.0475          ?        ?      146.6        4.8       ?       ? 
1 1 1   36    2   38 o    328.4    2.8    0.0000   0.0000          ?        ?  1078.4630  18.5171          ?        ?      328.4        2.8       ?       ? 
1 1 1   36    2   39 o    438.6    2.5    0.0000   0.0000          ?        ?  1923.8656  22.3483          ?        ?      438.6        2.5       ?       ? 
1 1 1   36    2   40 o    423.9    2.6    0.0000   0.0000          ?        ?  1797.4384  21.7097          ?        ?      423.9        2.6       ?       ? 
1 1 1   36    2   41 o     65.1   12.7    0.0000   0.0000          ?        ?    44.0580  15.9630          ?        ?       65.1       12.7       ?       ? 
1 1 1   36    2   42 o     28.9   13.1    0.0000   0.0000          ?        ?   -10.2163  16.6016          ?        ?       28.9       13.1       ?       ? 
1 1 1   36    2   43 o    388.5    2.7    0.0000   0.0000          ?        ?  1509.4651  21.0712          ?        ?      388.5        2.7       ?       ? 
1 1 1   36    2   44 o    528.3    2.7    0.0000   0.0000          ?        ?  2792.2549  28.0950          ?        ?      528.3        2.7       ?       ? 
1 1 1   36    2   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    2   46 o    154.6    5.4    0.0000   0.0000          ?        ?   239.4456  16.6016          ?        ?      154.6        5.4       ?       ? 
1 1 1   36    2   47 o    372.7    2.7    0.0000   0.0000          ?        ?  1389.4231  20.4327          ?        ?      372.7        2.7       ?       ? 
1 1 1   36    2   48 o    175.7    4.9    0.0000   0.0000          ?        ?   309.0445  17.2401          ?        ?      175.7        4.9       ?       ? 
1 1 1   36    2   49 o     48.1   15.3    0.0000   0.0000          ?        ?    22.9868  16.6016          ?        ?       48.1       15.3       ?       ? 
1 1 1   36    2   50 o    298.6    3.2    0.0000   0.0000          ?        ?   892.0147  19.1556          ?        ?      298.6        3.2       ?       ? 
1 1 1   36    2   51 o    112.8    7.4    0.0000   0.0000          ?        ?   127.7043  16.6016          ?        ?      112.8        7.4       ?       ? 
1 1 1   36    2   52 o    192.5    4.8    0.0000   0.0000          ?        ?   370.9810  18.5171          ?        ?      192.5        4.8       ?       ? 
1 1 1   36    2   53 o    146.7    6.1    0.0000   0.0000          ?        ?   215.8203  17.8786          ?        ?      146.7        6.1       ?       ? 
1 1 1   36    2   54 f    189.8    4.7    0.0000   0.0000          ?        ?   360.7647  17.8786          ?        ?      189.8        4.7       ?       ? 
1 1 1   36    2   55 o    171.6    5.6    0.0000   0.0000          ?        ?   294.9970  19.1556          ?        ?      171.6        5.6       ?       ? 
1 1 1   36    2   56 o    171.2    5.4    0.0000   0.0000          ?        ?   293.7199  18.5171          ?        ?      171.2        5.4       ?       ? 
1 1 1   36    2   57 o    344.3    3.2    0.0000   0.0000          ?        ?  1186.3732  21.7097          ?        ?      344.3        3.2       ?       ? 
1 1 1   36    2   58 o    139.5    7.1    0.0000   0.0000          ?        ?   195.3876  19.7942          ?        ?      139.5        7.1       ?       ? 
1 1 1   36    2   59 o    176.8    5.8    0.0000   0.0000          ?        ?   313.5141  20.4327          ?        ?      176.8        5.8       ?       ? 
1 1 1   36    2   60 o     76.5   13.9    0.0000   0.0000          ?        ?    61.2981  20.4327          ?        ?       76.5       13.9       ?       ? 
1 1 1   36    2   61 o     82.8   12.0    0.0000   0.0000          ?        ?    69.5989  19.7942          ?        ?       82.8       12.0       ?       ? 
1 1 1   36    2   62 o    254.2    4.0    0.0000   0.0000          ?        ?   647.4609  20.4327          ?        ?      254.2        4.0       ?       ? 
1 1 1   36    2   63 o     21.1   10.6    0.0000   0.0000          ?        ?   -63.2136  20.4327          ?        ?       21.1       10.6       ?       ? 
1 1 1   36    2   64 o    182.9    5.6    0.0000   0.0000          ?        ?   335.8624  20.4327          ?        ?      182.9        5.6       ?       ? 
1 1 1   36    2   65 o     19.5    9.9    0.0000   0.0000          ?        ?   -66.4062  19.1556          ?        ?       19.5        9.9       ?       ? 
1 1 1   36    2   66 o     62.4   16.2    0.0000   0.0000          ?        ?    42.1424  20.4327          ?        ?       62.4       16.2       ?       ? 
1 1 1   36    2   67 f     46.5   16.7    0.0000   0.0000          ?        ?    19.7942  19.7942          ?        ?       46.5       16.7       ?       ? 
1 1 1   36    2   68 o    121.4    8.1    0.0000   0.0000          ?        ?   149.4141  19.7942          ?        ?      121.4        8.1       ?       ? 
1 1 1   36    3    0 o     17.1   12.1  -15.3245  15.3245   -15.3245  15.3245   -15.3245  15.3245       17.1     12.1       17.1       12.1     0.0     0.0 
1 1 1   36    3    1 o    508.2    2.5    0.0000   0.0000          ?        ?  2582.8201  24.9023          ?        ?      508.2        2.5       ?       ? 
1 1 1   36    3    2 o    126.1    4.6    0.0000   0.0000          ?        ?   158.9919  11.4934          ?        ?      126.1        4.6       ?       ? 
1 1 1   36    3    3 o    995.1    3.8    0.0000   0.0000          ?        ?  9903.4707  75.9841          ?        ?      995.1        3.8       ?       ? 
1 1 1   36    3    4 o   1430.1    5.0    0.0000   0.0000          ?        ? 20455.0410 141.7518          ?        ?     1430.1        5.0       ?       ? 
1 1 1   36    3    5 o    482.4    2.5    0.0000   0.0000          ?        ?  2327.4114  24.2638          ?        ?      482.4        2.5       ?       ? 
1 1 1   36    3    6 o    649.6    2.9    0.0000   0.0000          ?        ?  4220.6279  37.0343          ?        ?      649.6        2.9       ?       ? 
1 1 1   36    3    7 o    956.7    3.7    0.0000   0.0000          ?        ?  9153.2070  70.2374          ?        ?      956.7        3.7       ?       ? 
1 1 1   36    3    8 o   1191.1    4.2    0.0000   0.0000          ?        ? 14189.2275  99.6094          ?        ?     1191.1        4.2       ?       ? 
1 1 1   36    3    9 o   1185.0    4.2    0.0000   0.0000          ?        ? 14043.6436  98.9709          ?        ?     1185.0        4.2       ?       ? 
1 1 1   36    3   10 o    402.2    2.5    0.0000   0.0000          ?        ?  1617.3752  20.4327          ?        ?      402.2        2.5       ?       ? 
1 1 1   36    3   11 o    867.7    3.3    0.0000   0.0000          ?        ?  7529.4468  58.1055          ?        ?      867.7        3.3       ?       ? 
1 1 1   36    3   12 o    635.7    2.7    0.0000   0.0000          ?        ?  4041.2036  34.4802          ?        ?      635.7        2.7       ?       ? 
1 1 1   36    3   13 o    498.1    2.4    0.0000   0.0000          ?        ?  2481.2952  24.2638          ?        ?      498.1        2.4       ?       ? 
1 1 1   36    3   14 o    915.9    3.6    0.0000   0.0000          ?        ?  8388.8975  65.1292          ?        ?      915.9        3.6       ?       ? 
1 1 1   36    3   15 o   1025.9    3.8    0.0000   0.0000          ?        ? 10526.6670  77.2611          ?        ?     1025.9        3.8       ?       ? 
1 1 1   36    3   16 o    371.7    2.5    0.0000   0.0000          ?        ?  1381.7607  18.5171          ?        ?      371.7        2.5       ?       ? 
1 1 1   36    3   17 o    426.7    2.4    0.0000   0.0000          ?        ?  1820.4252  20.4327          ?        ?      426.7        2.4       ?       ? 
1 1 1   36    3   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    3   19 o    292.3    2.7    0.0000   0.0000          ?        ?   854.3420  15.9630          ?        ?      292.3        2.7       ?       ? 
1 1 1   36    3   20 o   1151.6    4.2    0.0000   0.0000          ?        ? 13263.3711  97.6938          ?        ?     1151.6        4.2       ?       ? 
1 1 1   36    3   21 o    770.8    3.2    0.0000   0.0000          ?        ?  5941.4438  49.1662          ?        ?      770.8        3.2       ?       ? 
1 1 1   36    3   22 o    384.3    2.5    0.0000   0.0000          ?        ?  1476.9005  19.1556          ?        ?      384.3        2.5       ?       ? 
1 1 1   36    3   23 o    651.3    2.9    0.0000   0.0000          ?        ?  4242.9761  38.3113          ?        ?      651.3        2.9       ?       ? 
1 1 1   36    3   24 o    666.8    2.8    0.0000   0.0000          ?        ?  4446.0259  37.6728          ?        ?      666.8        2.8       ?       ? 
1 1 1   36    3   25 o    386.9    2.5    0.0000   0.0000          ?        ?  1496.6947  19.1556          ?        ?      386.9        2.5       ?       ? 
1 1 1   36    3   26 o    439.6    2.5    0.0000   0.0000          ?        ?  1932.8051  21.7097          ?        ?      439.6        2.5       ?       ? 
1 1 1   36    3   27 o    457.3    2.5    0.0000   0.0000          ?        ?  2091.1584  22.9868          ?        ?      457.3        2.5       ?       ? 
1 1 1   36    3   28 o    338.8    2.6    0.0000   0.0000          ?        ?  1148.0619  17.8786          ?        ?      338.8        2.6       ?       ? 
1 1 1   36    3   29 o    112.1    6.8    0.0000   0.0000          ?        ?   125.7888  15.3245          ?        ?      112.1        6.8       ?       ? 
1 1 1   36    3   30 f    254.7    3.1    0.0000   0.0000          ?        ?   648.7380  15.9630          ?        ?      254.7        3.1       ?       ? 
1 1 1   36    3   31 o    165.1    4.6    0.0000   0.0000          ?        ?   272.6487  15.3245          ?        ?      165.1        4.6       ?       ? 
1 1 1   36    3   32 o    946.2    3.6    0.0000   0.0000          ?        ?  8955.2656  67.6833          ?        ?      946.2        3.6       ?       ? 
1 1 1   36    3   33 o    258.5    3.0    0.0000   0.0000          ?        ?   668.5321  15.3245          ?        ?      258.5        3.0       ?       ? 
1 1 1   36    3   34 o    244.6    3.1    0.0000   0.0000          ?        ?   598.2947  15.3245          ?        ?      244.6        3.1       ?       ? 
1 1 1   36    3   35 o    249.7    3.2    0.0000   0.0000          ?        ?   623.8356  15.9630          ?        ?      249.7        3.2       ?       ? 
1 1 1   36    3   36 o    179.9    4.4    0.0000   0.0000          ?        ?   323.7305  15.9630          ?        ?      179.9        4.4       ?       ? 
1 1 1   36    3   37 o     22.4   10.8    0.0000   0.0000          ?        ?   -23.6253  14.6860          ?        ?       22.4       10.8       ?       ? 
1 1 1   36    3   38 o    154.7    5.0    0.0000   0.0000          ?        ?   239.4456  15.3245          ?        ?      154.7        5.0       ?       ? 
1 1 1   36    3   39 f     24.8   11.9    0.0000   0.0000          ?        ?   -22.9868  16.6016          ?        ?       24.8       11.9       ?       ? 
1 1 1   36    3   40 o    247.3    3.5    0.0000   0.0000          ?        ?   611.7037  17.2401          ?        ?      247.3        3.5       ?       ? 
1 1 1   36    3   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    3   42 o     94.8    8.4    0.0000   0.0000          ?        ?    90.0316  15.9630          ?        ?       94.8        8.4       ?       ? 
1 1 1   36    3   43 o    450.6    2.6    0.0000   0.0000          ?        ?  2030.4988  22.9868          ?        ?      450.6        2.6       ?       ? 
1 1 1   36    3   44 o    547.2    2.6    0.0000   0.0000          ?        ?  2995.3049  28.7335          ?        ?      547.2        2.6       ?       ? 
1 1 1   36    3   45 o    252.5    3.4    0.0000   0.0000          ?        ?   637.8831  17.2401          ?        ?      252.5        3.4       ?       ? 
1 1 1   36    3   46 o    160.1    5.2    0.0000   0.0000          ?        ?   256.6857  16.6016          ?        ?      160.1        5.2       ?       ? 
1 1 1   36    3   47 o    113.4    7.6    0.0000   0.0000          ?        ?   128.9814  17.2401          ?        ?      113.4        7.6       ?       ? 
1 1 1   36    3   48 o    436.7    2.8    0.0000   0.0000          ?        ?  1907.9026  24.2638          ?        ?      436.7        2.8       ?       ? 
1 1 1   36    3   49 f    219.6    4.1    0.0000   0.0000          ?        ?   482.7224  17.8786          ?        ?      219.6        4.1       ?       ? 
1 1 1   36    3   50 o    310.3    3.1    0.0000   0.0000          ?        ?   963.5291  19.1556          ?        ?      310.3        3.1       ?       ? 
1 1 1   36    3   51 o    141.2    6.3    0.0000   0.0000          ?        ?   199.8573  17.8786          ?        ?      141.2        6.3       ?       ? 
1 1 1   36    3   52 o    136.8    6.8    0.0000   0.0000          ?        ?   187.7254  18.5171          ?        ?      136.8        6.8       ?       ? 
1 1 1   36    3   53 o    109.9    7.8    0.0000   0.0000          ?        ?   121.3191  17.2401          ?        ?      109.9        7.8       ?       ? 
1 1 1   36    3   54 o     82.0   10.5    0.0000   0.0000          ?        ?    67.6833  17.2401          ?        ?       82.0       10.5       ?       ? 
1 1 1   36    3   55 o     60.3   15.7    0.0000   0.0000          ?        ?    38.3113  19.1556          ?        ?       60.3       15.7       ?       ? 
1 1 1   36    3   56 o    212.3    4.5    0.0000   0.0000          ?        ?   451.4348  19.1556          ?        ?      212.3        4.5       ?       ? 
1 1 1   36    3   57 o    210.5    4.7    0.0000   0.0000          ?        ?   443.7725  19.7942          ?        ?      210.5        4.7       ?       ? 
1 1 1   36    3   58 o    233.6    4.2    0.0000   0.0000          ?        ?   546.5745  19.7942          ?        ?      233.6        4.2       ?       ? 
1 1 1   36    3   59 o    260.8    4.0    0.0000   0.0000          ?        ?   681.3026  21.0712          ?        ?      260.8        4.0       ?       ? 
1 1 1   36    3   60 o    346.6    3.2    0.0000   0.0000          ?        ?  1202.3362  22.3483          ?        ?      346.6        3.2       ?       ? 
1 1 1   36    3   61 o    377.9    3.1    0.0000   0.0000          ?        ?  1429.6499  23.6253          ?        ?      377.9        3.1       ?       ? 
1 1 1   36    3   62 o    219.5    4.5    0.0000   0.0000          ?        ?   482.7224  19.7942          ?        ?      219.5        4.5       ?       ? 
1 1 1   36    3   63 o     38.6   15.7    0.0000   0.0000          ?        ?     6.3852  19.1556          ?        ?       38.6       15.7       ?       ? 
1 1 1   36    3   64 o    103.2    9.6    0.0000   0.0000          ?        ?   107.9102  19.7942          ?        ?      103.2        9.6       ?       ? 
1 1 1   36    3   65 o     24.9   12.1    0.0000   0.0000          ?        ?   -35.7572  19.7942          ?        ?       24.9       12.1       ?       ? 
1 1 1   36    3   66 o    147.0    6.7    0.0000   0.0000          ?        ?   217.7359  19.7942          ?        ?      147.0        6.7       ?       ? 
1 1 1   36    3   67 o     89.7   11.0    0.0000   0.0000          ?        ?    82.3693  19.7942          ?        ?       89.7       11.0       ?       ? 
1 1 1   36    3   68 o     78.6   12.6    0.0000   0.0000          ?        ?    63.8522  19.7942          ?        ?       78.6       12.6       ?       ? 
1 1 1   36    4    0 o    784.3    4.4 6151.5176  68.3218  6151.5176  68.3218  6151.5176  68.3218      784.3      4.4      784.3        4.4     0.0     0.0 
1 1 1   36    4    1 o    607.8    2.7    0.0000   0.0000          ?        ?  3693.8477  32.5646          ?        ?      607.8        2.7       ?       ? 
1 1 1   36    4    2 o    565.1    2.6    0.0000   0.0000          ?        ?  3193.2466  29.3720          ?        ?      565.1        2.6       ?       ? 
1 1 1   36    4    3 o    650.3    2.7    0.0000   0.0000          ?        ?  4229.5674  35.7572          ?        ?      650.3        2.7       ?       ? 
1 1 1   36    4    4 o     64.7   12.8    0.0000   0.0000          ?        ?    43.4195  15.9630          ?        ?       64.7       12.8       ?       ? 
1 1 1   36    4    5 o   1235.6    4.3    0.0000   0.0000          ?        ? 15268.3291 106.6331          ?        ?     1235.6        4.3       ?       ? 
1 1 1   36    4    6 o    205.1    3.3    0.0000   0.0000          ?        ?   420.7858  13.4090          ?        ?      205.1        3.3       ?       ? 
1 1 1   36    4    7 o    508.4    2.8    0.0000   0.0000          ?        ?  2584.7354  28.0950          ?        ?      508.4        2.8       ?       ? 
1 1 1   36    4    8 o   1008.6    3.8    0.0000   0.0000          ?        ? 10172.9258  77.2611          ?        ?     1008.6        3.8       ?       ? 
1 1 1   36    4    9 o    511.0    2.5    0.0000   0.0000          ?        ?  2610.9148  25.5409          ?        ?      511.0        2.5       ?       ? 
1 1 1   36    4   10 o    314.3    2.5    0.0000   0.0000          ?        ?   987.7929  15.9630          ?        ?      314.3        2.5       ?       ? 
1 1 1   36    4   11 o    997.5    3.7    0.0000   0.0000          ?        ?  9951.3594  73.4300          ?        ?      997.5        3.7       ?       ? 
1 1 1   36    4   12 f    511.6    2.6    0.0000   0.0000          ?        ?  2617.3000  26.1794          ?        ?      511.6        2.6       ?       ? 
1 1 1   36    4   13 o    813.6    3.3    0.0000   0.0000          ?        ?  6619.5532  53.6358          ?        ?      813.6        3.3       ?       ? 
1 1 1   36    4   14 o   1563.4    5.4    0.0000   0.0000          ?        ? 24448.3535 167.9312          ?        ?     1563.4        5.4       ?       ? 
1 1 1   36    4   15 o   1184.6    4.3    0.0000   0.0000          ?        ? 14035.3447 100.8864          ?        ?     1184.6        4.3       ?       ? 
1 1 1   36    4   16 o    944.2    3.7    0.0000   0.0000          ?        ?  8915.6777  70.2374          ?        ?      944.2        3.7       ?       ? 
1 1 1   36    4   17 o    290.5    2.5    0.0000   0.0000          ?        ?   844.1255  14.6860          ?        ?      290.5        2.5       ?       ? 
1 1 1   36    4   18 o    452.1    2.5    0.0000   0.0000          ?        ?  2043.9077  22.3483          ?        ?      452.1        2.5       ?       ? 
1 1 1   36    4   19 o    106.6    6.0    0.0000   0.0000          ?        ?   113.6568  12.7704          ?        ?      106.6        6.0       ?       ? 
1 1 1   36    4   20 o    693.2    3.1    0.0000   0.0000          ?        ?  4805.5137  42.7809          ?        ?      693.2        3.1       ?       ? 
1 1 1   36    4   21 o    111.0    7.2    0.0000   0.0000          ?        ?   123.2347  15.9630          ?        ?      111.0        7.2       ?       ? 
1 1 1   36    4   22 o    160.8    4.8    0.0000   0.0000          ?        ?   258.6013  15.3245          ?        ?      160.8        4.8       ?       ? 
1 1 1   36    4   23 o    252.4    3.0    0.0000   0.0000          ?        ?   637.2446  15.3245          ?        ?      252.4        3.0       ?       ? 
1 1 1   36    4   24 o    221.1    3.3    0.0000   0.0000          ?        ?   489.1075  14.6860          ?        ?      221.1        3.3       ?       ? 
1 1 1   36    4   25 o    357.1    2.5    0.0000   0.0000          ?        ?  1275.1277  17.8786          ?        ?      357.1        2.5       ?       ? 
1 1 1   36    4   26 o    221.6    3.3    0.0000   0.0000          ?        ?   491.0231  14.6860          ?        ?      221.6        3.3       ?       ? 
1 1 1   36    4   27 o    987.8    3.8    0.0000   0.0000          ?        ?  9760.4414  74.7070          ?        ?      987.8        3.8       ?       ? 
1 1 1   36    4   28 o    268.5    2.9    0.0000   0.0000          ?        ?   720.8909  15.3245          ?        ?      268.5        2.9       ?       ? 
1 1 1   36    4   29 o    621.6    2.7    0.0000   0.0000          ?        ?  3864.9714  33.2031          ?        ?      621.6        2.7       ?       ? 
1 1 1   36    4   30 o    361.3    2.6    0.0000   0.0000          ?        ?  1305.7767  18.5171          ?        ?      361.3        2.6       ?       ? 
1 1 1   36    4   31 o    587.9    2.7    0.0000   0.0000          ?        ?  3456.9563  31.2876          ?        ?      587.9        2.7       ?       ? 
1 1 1   36    4   32 o    207.9    3.7    0.0000   0.0000          ?        ?   432.2791  15.3245          ?        ?      207.9        3.7       ?       ? 
1 1 1   36    4   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    4   34 o    389.6    2.5    0.0000   0.0000          ?        ?  1517.7659  19.1556          ?        ?      389.6        2.5       ?       ? 
1 1 1   36    4   35 o    320.4    2.7    0.0000   0.0000          ?        ?  1026.7428  17.2401          ?        ?      320.4        2.7       ?       ? 
1 1 1   36    4   36 o    382.8    2.8    0.0000   0.0000          ?        ?  1466.0457  21.0712          ?        ?      382.8        2.8       ?       ? 
1 1 1   36    4   37 o    680.3    2.8    0.0000   0.0000          ?        ?  4628.6436  37.6728          ?        ?      680.3        2.8       ?       ? 
1 1 1   36    4   38 o    452.5    2.7    0.0000   0.0000          ?        ?  2047.7389  24.2638          ?        ?      452.5        2.7       ?       ? 
1 1 1   36    4   39 o    271.3    3.2    0.0000   0.0000          ?        ?   736.2155  17.2401          ?        ?      271.3        3.2       ?       ? 
1 1 1   36    4   40 o    784.0    3.1    0.0000   0.0000          ?        ?  6148.9634  49.1662          ?        ?      784.0        3.1       ?       ? 
1 1 1   36    4   41 o    618.3    2.7    0.0000   0.0000          ?        ?  3824.1062  33.8416          ?        ?      618.3        2.7       ?       ? 
1 1 1   36    4   42 o    162.7    4.9    0.0000   0.0000          ?        ?   264.9865  15.9630          ?        ?      162.7        4.9       ?       ? 
1 1 1   36    4   43 o    473.6    2.6    0.0000   0.0000          ?        ?  2243.7649  24.2638          ?        ?      473.6        2.6       ?       ? 
1 1 1   36    4   44 o    248.4    3.5    0.0000   0.0000          ?        ?   617.4504  17.2401          ?        ?      248.4        3.5       ?       ? 
1 1 1   36    4   45 o    202.7    4.1    0.0000   0.0000          ?        ?   411.2079  16.6016          ?        ?      202.7        4.1       ?       ? 
1 1 1   36    4   46 o    353.4    2.7    0.0000   0.0000          ?        ?  1249.5868  19.1556          ?        ?      353.4        2.7       ?       ? 
1 1 1   36    4   47 o    263.0    3.4    0.0000   0.0000          ?        ?   692.1575  17.8786          ?        ?      263.0        3.4       ?       ? 
1 1 1   36    4   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    4   49 o    519.6    2.6    0.0000   0.0000          ?        ?  2700.9465  27.4564          ?        ?      519.6        2.6       ?       ? 
1 1 1   36    4   50 f     46.6   16.2    0.0000   0.0000          ?        ?    19.7942  18.5171          ?        ?       46.6       16.2       ?       ? 
1 1 1   36    4   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    4   52 o    283.7    3.4    0.0000   0.0000          ?        ?   805.1758  19.1556          ?        ?      283.7        3.4       ?       ? 
1 1 1   36    4   53 o     77.6   10.7    0.0000   0.0000          ?        ?    60.6596  16.6016          ?        ?       77.6       10.7       ?       ? 
1 1 1   36    4   54 o     20.4   10.2    0.0000   0.0000          ?        ?   -51.0817  17.8786          ?        ?       20.4       10.2       ?       ? 
1 1 1   36    4   55 o     31.4   14.0    0.0000   0.0000          ?        ?    -7.0237  17.8786          ?        ?       31.4       14.0       ?       ? 
1 1 1   36    4   56 o    186.3    5.3    0.0000   0.0000          ?        ?   347.9943  19.7942          ?        ?      186.3        5.3       ?       ? 
1 1 1   36    4   57 o     93.5    9.9    0.0000   0.0000          ?        ?    88.1160  18.5171          ?        ?       93.5        9.9       ?       ? 
1 1 1   36    4   58 f    146.0    6.3    0.0000   0.0000          ?        ?   213.9047  18.5171          ?        ?      146.0        6.3       ?       ? 
1 1 1   36    4   59 o    196.6    5.0    0.0000   0.0000          ?        ?   387.5826  19.7942          ?        ?      196.6        5.0       ?       ? 
1 1 1   36    4   60 o    227.3    4.6    0.0000   0.0000          ?        ?   517.8410  21.0712          ?        ?      227.3        4.6       ?       ? 
1 1 1   36    4   61 o     23.1   11.5    0.0000   0.0000          ?        ?   -45.3350  19.7942          ?        ?       23.1       11.5       ?       ? 
1 1 1   36    4   62 o    308.0    3.4    0.0000   0.0000          ?        ?   950.1202  21.0712          ?        ?      308.0        3.4       ?       ? 
1 1 1   36    4   63 o     30.2   13.9    0.0000   0.0000          ?        ?   -13.4090  19.1556          ?        ?       30.2       13.9       ?       ? 
1 1 1   36    4   64 o     66.4   15.2    0.0000   0.0000          ?        ?    47.2506  19.7942          ?        ?       66.4       15.2       ?       ? 
1 1 1   36    4   65 o    172.8    5.7    0.0000   0.0000          ?        ?   300.1052  19.7942          ?        ?      172.8        5.7       ?       ? 
1 1 1   36    4   66 o    222.2    4.5    0.0000   0.0000          ?        ?   495.4928  19.7942          ?        ?      222.2        4.5       ?       ? 
1 1 1   36    4   67 o    100.2    9.6    0.0000   0.0000          ?        ?   102.1635  19.1556          ?        ?      100.2        9.6       ?       ? 
1 1 1   36    5    0 f    428.0    3.5 1831.9185  30.0105  1831.9185  30.0105  1831.9185  30.0105      428.0      3.5      428.0        3.5     0.0     0.0 
1 1 1   36    5    1 o    437.0    2.8    0.0000   0.0000          ?        ?  1909.8182  24.2638          ?        ?      437.0        2.8       ?       ? 
1 1 1   36    5    2 o   1091.8    4.1    0.0000   0.0000          ?        ? 11921.1992  90.0316          ?        ?     1091.8        4.1       ?       ? 
1 1 1   36    5    3 o    589.2    2.8    0.0000   0.0000          ?        ?  3472.2805  33.2031          ?        ?      589.2        2.8       ?       ? 
1 1 1   36    5    4 o   1000.5    3.8    0.0000   0.0000          ?        ? 10011.3809  76.6226          ?        ?     1000.5        3.8       ?       ? 
1 1 1   36    5    5 o   1056.7    4.0    0.0000   0.0000          ?        ? 11166.4668  84.9234          ?        ?     1056.7        4.0       ?       ? 
1 1 1   36    5    6 o    839.0    3.4    0.0000   0.0000          ?        ?  7040.3394  57.4669          ?        ?      839.0        3.4       ?       ? 
1 1 1   36    5    7 o   1277.5    4.7    0.0000   0.0000          ?        ? 16323.1660 120.0421          ?        ?     1277.5        4.7       ?       ? 
1 1 1   36    5    8 o   1281.2    4.6    0.0000   0.0000          ?        ? 16416.3906 116.8494          ?        ?     1281.2        4.6       ?       ? 
1 1 1   36    5    9 f    663.0    2.8    0.0000   0.0000          ?        ?  4396.2212  37.6728          ?        ?      663.0        2.8       ?       ? 
1 1 1   36    5   10 o    922.5    3.5    0.0000   0.0000          ?        ?  8510.2168  63.8522          ?        ?      922.5        3.5       ?       ? 
1 1 1   36    5   11 o    427.7    2.5    0.0000   0.0000          ?        ?  1829.3645  21.7097          ?        ?      427.7        2.5       ?       ? 
1 1 1   36    5   12 o    388.4    2.5    0.0000   0.0000          ?        ?  1508.8267  19.1556          ?        ?      388.4        2.5       ?       ? 
1 1 1   36    5   13 o    654.9    2.8    0.0000   0.0000          ?        ?  4289.5884  36.3957          ?        ?      654.9        2.8       ?       ? 
1 1 1   36    5   14 o    795.4    3.3    0.0000   0.0000          ?        ?  6327.1108  52.3588          ?        ?      795.4        3.3       ?       ? 
1 1 1   36    5   15 o    403.7    2.5    0.0000   0.0000          ?        ?  1629.5072  19.7942          ?        ?      403.7        2.5       ?       ? 
1 1 1   36    5   16 o   1068.8    4.0    0.0000   0.0000          ?        ? 11425.7061  85.5619          ?        ?     1068.8        4.0       ?       ? 
1 1 1   36    5   17 o    520.2    2.6    0.0000   0.0000          ?        ?  2706.6931  26.8179          ?        ?      520.2        2.6       ?       ? 
1 1 1   36    5   18 o    391.0    2.4    0.0000   0.0000          ?        ?  1528.6207  18.5171          ?        ?      391.0        2.4       ?       ? 
1 1 1   36    5   19 o    640.4    2.7    0.0000   0.0000          ?        ?  4101.2241  34.4802          ?        ?      640.4        2.7       ?       ? 
1 1 1   36    5   20 o    383.0    2.7    0.0000   0.0000          ?        ?  1467.3228  20.4327          ?        ?      383.0        2.7       ?       ? 
1 1 1   36    5   21 o    195.4    3.3    0.0000   0.0000          ?        ?   381.8359  12.7704          ?        ?      195.4        3.3       ?       ? 
1 1 1   36    5   22 o    271.3    2.7    0.0000   0.0000          ?        ?   736.2155  14.6860          ?        ?      271.3        2.7       ?       ? 
1 1 1   36    5   23 o    234.2    2.9    0.0000   0.0000          ?        ?   548.4901  13.4090          ?        ?      234.2        2.9       ?       ? 
1 1 1   36    5   24 o    155.5    4.3    0.0000   0.0000          ?        ?   241.9997  13.4090          ?        ?      155.5        4.3       ?       ? 
1 1 1   36    5   25 f    748.4    3.0    0.0000   0.0000          ?        ?  5601.7500  44.6965          ?        ?      748.4        3.0       ?       ? 
1 1 1   36    5   26 o    219.5    3.3    0.0000   0.0000          ?        ?   482.0838  14.6860          ?        ?      219.5        3.3       ?       ? 
1 1 1   36    5   27 o    807.8    3.1    0.0000   0.0000          ?        ?  6526.9683  50.4432          ?        ?      807.8        3.1       ?       ? 
1 1 1   36    5   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    5   29 o    757.5    3.2    0.0000   0.0000          ?        ?  5739.0322  49.1662          ?        ?      757.5        3.2       ?       ? 
1 1 1   36    5   30 o    269.9    2.8    0.0000   0.0000          ?        ?   728.5532  15.3245          ?        ?      269.9        2.8       ?       ? 
1 1 1   36    5   31 o    371.3    2.6    0.0000   0.0000          ?        ?  1379.2067  19.1556          ?        ?      371.3        2.6       ?       ? 
1 1 1   36    5   32 o    495.9    2.5    0.0000   0.0000          ?        ?  2459.5854  24.9023          ?        ?      495.9        2.5       ?       ? 
1 1 1   36    5   33 f    308.6    2.7    0.0000   0.0000          ?        ?   952.6743  16.6016          ?        ?      308.6        2.7       ?       ? 
1 1 1   36    5   34 f    254.3    3.3    0.0000   0.0000          ?        ?   646.8224  16.6016          ?        ?      254.3        3.3       ?       ? 
1 1 1   36    5   35 o    347.4    2.6    0.0000   0.0000          ?        ?  1206.8059  17.8786          ?        ?      347.4        2.6       ?       ? 
1 1 1   36    5   36 o    197.8    4.0    0.0000   0.0000          ?        ?   391.4138  15.9630          ?        ?      197.8        4.0       ?       ? 
1 1 1   36    5   37 o    896.5    3.4    0.0000   0.0000          ?        ?  8040.2642  60.6596          ?        ?      896.5        3.4       ?       ? 
1 1 1   36    5   38 o    509.6    2.6    0.0000   0.0000          ?        ?  2597.5059  26.8179          ?        ?      509.6        2.6       ?       ? 
1 1 1   36    5   39 o    796.8    3.1    0.0000   0.0000          ?        ?  6350.7358  49.1662          ?        ?      796.8        3.1       ?       ? 
1 1 1   36    5   40 o     86.3    9.6    0.0000   0.0000          ?        ?    74.7070  16.6016          ?        ?       86.3        9.6       ?       ? 
1 1 1   36    5   41 o     19.7    9.8    0.0000   0.0000          ?        ?   -39.5883  15.3245          ?        ?       19.7        9.8       ?       ? 
1 1 1   36    5   42 o    618.8    2.7    0.0000   0.0000          ?        ?  3829.8525  33.8416          ?        ?      618.8        2.7       ?       ? 
1 1 1   36    5   43 o    312.3    2.9    0.0000   0.0000          ?        ?   975.6611  17.8786          ?        ?      312.3        2.9       ?       ? 
1 1 1   36    5   44 o    115.7    6.9    0.0000   0.0000          ?        ?   134.0895  15.9630          ?        ?      115.7        6.9       ?       ? 
1 1 1   36    5   45 o    344.9    2.8    0.0000   0.0000          ?        ?  1190.2042  19.1556          ?        ?      344.9        2.8       ?       ? 
1 1 1   36    5   46 o    224.4    3.8    0.0000   0.0000          ?        ?   503.7936  17.2401          ?        ?      224.4        3.8       ?       ? 
1 1 1   36    5   47 o     42.5   15.0    0.0000   0.0000          ?        ?    15.9630  15.9630          ?        ?       42.5       15.0       ?       ? 
1 1 1   36    5   48 o     77.2   10.7    0.0000   0.0000          ?        ?    60.0210  16.6016          ?        ?       77.2       10.7       ?       ? 
1 1 1   36    5   49 f    247.6    3.7    0.0000   0.0000          ?        ?   613.6193  18.5171          ?        ?      247.6        3.7       ?       ? 
1 1 1   36    5   50 o    114.8    7.5    0.0000   0.0000          ?        ?   132.1740  17.2401          ?        ?      114.8        7.5       ?       ? 
1 1 1   36    5   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    5   52 o    278.5    3.4    0.0000   0.0000          ?        ?   776.4423  19.1556          ?        ?      278.5        3.4       ?       ? 
1 1 1   36    5   53 o    245.1    3.8    0.0000   0.0000          ?        ?   601.4874  18.5171          ?        ?      245.1        3.8       ?       ? 
1 1 1   36    5   54 o    208.8    4.6    0.0000   0.0000          ?        ?   436.7488  19.1556          ?        ?      208.8        4.6       ?       ? 
1 1 1   36    5   55 o    144.5    6.6    0.0000   0.0000          ?        ?   209.4351  19.1556          ?        ?      144.5        6.6       ?       ? 
1 1 1   36    5   56 o    166.6    5.7    0.0000   0.0000          ?        ?   278.3954  19.1556          ?        ?      166.6        5.7       ?       ? 
1 1 1   36    5   57 o    121.6    8.1    0.0000   0.0000          ?        ?   148.7755  19.7942          ?        ?      121.6        8.1       ?       ? 
1 1 1   36    5   58 o    227.5    4.5    0.0000   0.0000          ?        ?   518.4796  20.4327          ?        ?      227.5        4.5       ?       ? 
1 1 1   36    5   59 o    249.4    4.1    0.0000   0.0000          ?        ?   623.1971  20.4327          ?        ?      249.4        4.1       ?       ? 
1 1 1   36    5   60 o    109.7    9.0    0.0000   0.0000          ?        ?   121.3191  19.7942          ?        ?      109.7        9.0       ?       ? 
1 1 1   36    5   61 o     41.0   16.1    0.0000   0.0000          ?        ?    10.8549  19.1556          ?        ?       41.0       16.1       ?       ? 
1 1 1   36    5   62 o     42.4   16.8    0.0000   0.0000          ?        ?    10.8549  21.0712          ?        ?       42.4       16.8       ?       ? 
1 1 1   36    5   63 o    142.5    6.7    0.0000   0.0000          ?        ?   204.3269  19.1556          ?        ?      142.5        6.7       ?       ? 
1 1 1   36    5   64 o     89.6   11.0    0.0000   0.0000          ?        ?    81.7308  19.7942          ?        ?       89.6       11.0       ?       ? 
1 1 1   36    5   65 o     48.2   16.7    0.0000   0.0000          ?        ?    22.3483  19.7942          ?        ?       48.2       16.7       ?       ? 
1 1 1   36    5   66 o    210.2    4.9    0.0000   0.0000          ?        ?   443.7725  20.4327          ?        ?      210.2        4.9       ?       ? 
1 1 1   36    5   67 o    129.8    7.4    0.0000   0.0000          ?        ?   170.4853  19.1556          ?        ?      129.8        7.4       ?       ? 
1 1 1   36    6    0 o    388.7    3.3 1511.3806  25.5409  1511.3806  25.5409  1511.3806  25.5409      388.7      3.3      388.7        3.3     0.0     0.0 
1 1 1   36    6    1 o    401.0    2.4    0.0000   0.0000          ?        ?  1607.7975  19.1556          ?        ?      401.0        2.4       ?       ? 
1 1 1   36    6    2 o    418.0    2.6    0.0000   0.0000          ?        ?  1747.6338  21.7097          ?        ?      418.0        2.6       ?       ? 
1 1 1   36    6    3 o    342.3    2.5    0.0000   0.0000          ?        ?  1171.6871  17.2401          ?        ?      342.3        2.5       ?       ? 
1 1 1   36    6    4 o    104.5    4.9    0.0000   0.0000          ?        ?   109.1872  10.2163          ?        ?      104.5        4.9       ?       ? 
1 1 1   36    6    5 o    536.4    2.6    0.0000   0.0000          ?        ?  2877.8171  27.4564          ?        ?      536.4        2.6       ?       ? 
1 1 1   36    6    6 o    847.0    3.4    0.0000   0.0000          ?        ?  7174.4287  58.1055          ?        ?      847.0        3.4       ?       ? 
1 1 1   36    6    7 o   1224.5    4.5    0.0000   0.0000          ?        ? 14995.6807 110.4642          ?        ?     1224.5        4.5       ?       ? 
1 1 1   36    6    8 o    277.7    2.8    0.0000   0.0000          ?        ?   771.3342  15.3245          ?        ?      277.7        2.8       ?       ? 
1 1 1   36    6    9 o    718.6    3.1    0.0000   0.0000          ?        ?  5164.3628  44.0580          ?        ?      718.6        3.1       ?       ? 
1 1 1   36    6   10 o    400.7    2.4    0.0000   0.0000          ?        ?  1605.8818  19.1556          ?        ?      400.7        2.4       ?       ? 
1 1 1   36    6   11 o    680.4    2.9    0.0000   0.0000          ?        ?  4629.2817  38.9498          ?        ?      680.4        2.9       ?       ? 
1 1 1   36    6   12 o    543.3    2.5    0.0000   0.0000          ?        ?  2951.8855  27.4564          ?        ?      543.3        2.5       ?       ? 
1 1 1   36    6   13 o    337.9    2.5    0.0000   0.0000          ?        ?  1141.6766  16.6016          ?        ?      337.9        2.5       ?       ? 
1 1 1   36    6   14 o    281.5    2.6    0.0000   0.0000          ?        ?   792.4053  14.6860          ?        ?      281.5        2.6       ?       ? 
1 1 1   36    6   15 o    457.2    2.4    0.0000   0.0000          ?        ?  2090.5198  22.3483          ?        ?      457.2        2.4       ?       ? 
1 1 1   36    6   16 o    628.8    2.6    0.0000   0.0000          ?        ?  3954.3643  33.2031          ?        ?      628.8        2.6       ?       ? 
1 1 1   36    6   17 f    295.1    2.7    0.0000   0.0000          ?        ?   870.9435  15.9630          ?        ?      295.1        2.7       ?       ? 
1 1 1   36    6   18 o    502.2    2.5    0.0000   0.0000          ?        ?  2522.1604  24.9023          ?        ?      502.2        2.5       ?       ? 
1 1 1   36    6   19 o    630.7    2.7    0.0000   0.0000          ?        ?  3978.6282  33.8416          ?        ?      630.7        2.7       ?       ? 
1 1 1   36    6   20 o    671.8    2.9    0.0000   0.0000          ?        ?  4513.7095  39.5883          ?        ?      671.8        2.9       ?       ? 
1 1 1   36    6   21 o    646.0    2.8    0.0000   0.0000          ?        ?  4174.0161  36.3957          ?        ?      646.0        2.8       ?       ? 
1 1 1   36    6   22 o    477.8    2.4    0.0000   0.0000          ?        ?  2282.7148  22.9868          ?        ?      477.8        2.4       ?       ? 
1 1 1   36    6   23 o    720.2    2.9    0.0000   0.0000          ?        ?  5187.3496  41.5039          ?        ?      720.2        2.9       ?       ? 
1 1 1   36    6   24 o    520.5    2.7    0.0000   0.0000          ?        ?  2709.8857  28.0950          ?        ?      520.5        2.7       ?       ? 
1 1 1   36    6   25 o    380.0    2.4    0.0000   0.0000          ?        ?  1444.3359  18.5171          ?        ?      380.0        2.4       ?       ? 
1 1 1   36    6   26 o    194.6    3.9    0.0000   0.0000          ?        ?   378.6433  15.3245          ?        ?      194.6        3.9       ?       ? 
1 1 1   36    6   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    6   28 o    271.0    2.9    0.0000   0.0000          ?        ?   734.2999  15.9630          ?        ?      271.0        2.9       ?       ? 
1 1 1   36    6   29 o    404.9    2.6    0.0000   0.0000          ?        ?  1639.7235  21.0712          ?        ?      404.9        2.6       ?       ? 
1 1 1   36    6   30 o    244.0    3.3    0.0000   0.0000          ?        ?   595.7407  15.9630          ?        ?      244.0        3.3       ?       ? 
1 1 1   36    6   31 o    296.8    2.7    0.0000   0.0000          ?        ?   881.1599  15.9630          ?        ?      296.8        2.7       ?       ? 
1 1 1   36    6   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    6   33 o    196.5    3.7    0.0000   0.0000          ?        ?   386.3056  14.6860          ?        ?      196.5        3.7       ?       ? 
1 1 1   36    6   34 o    359.3    2.7    0.0000   0.0000          ?        ?  1291.0907  19.1556          ?        ?      359.3        2.7       ?       ? 
1 1 1   36    6   35 o    253.0    3.2    0.0000   0.0000          ?        ?   640.4372  15.9630          ?        ?      253.0        3.2       ?       ? 
1 1 1   36    6   36 o    670.7    2.8    0.0000   0.0000          ?        ?  4499.6621  37.0343          ?        ?      670.7        2.8       ?       ? 
1 1 1   36    6   37 o    457.1    2.7    0.0000   0.0000          ?        ?  2089.8811  24.9023          ?        ?      457.1        2.7       ?       ? 
1 1 1   36    6   38 o    291.8    3.0    0.0000   0.0000          ?        ?   851.7878  17.2401          ?        ?      291.8        3.0       ?       ? 
1 1 1   36    6   39 o    311.5    2.9    0.0000   0.0000          ?        ?   970.5529  17.8786          ?        ?      311.5        2.9       ?       ? 
1 1 1   36    6   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    6   41 o    195.3    4.1    0.0000   0.0000          ?        ?   381.8359  15.9630          ?        ?      195.3        4.1       ?       ? 
1 1 1   36    6   42 f    221.8    3.7    0.0000   0.0000          ?        ?   492.3002  16.6016          ?        ?      221.8        3.7       ?       ? 
1 1 1   36    6   43 o    168.5    5.1    0.0000   0.0000          ?        ?   284.1421  17.2401          ?        ?      168.5        5.1       ?       ? 
1 1 1   36    6   44 o     25.8   12.3    0.0000   0.0000          ?        ?   -21.7097  17.2401          ?        ?       25.8       12.3       ?       ? 
1 1 1   36    6   45 o    209.5    4.0    0.0000   0.0000          ?        ?   439.3029  16.6016          ?        ?      209.5        4.0       ?       ? 
1 1 1   36    6   46 o     31.1   13.6    0.0000   0.0000          ?        ?    -3.1926  15.9630          ?        ?       31.1       13.6       ?       ? 
1 1 1   36    6   47 o     99.0    8.4    0.0000   0.0000          ?        ?    98.3323  16.6016          ?        ?       99.0        8.4       ?       ? 
1 1 1   36    6   48 o    288.1    3.3    0.0000   0.0000          ?        ?   830.7167  19.1556          ?        ?      288.1        3.3       ?       ? 
1 1 1   36    6   49 o    152.3    5.7    0.0000   0.0000          ?        ?   232.4219  17.2401          ?        ?      152.3        5.7       ?       ? 
1 1 1   36    6   50 o    159.9    5.4    0.0000   0.0000          ?        ?   256.0471  17.2401          ?        ?      159.9        5.4       ?       ? 
1 1 1   36    6   51 o    331.0    3.1    0.0000   0.0000          ?        ?  1096.3416  20.4327          ?        ?      331.0        3.1       ?       ? 
1 1 1   36    6   52 o    101.1    8.8    0.0000   0.0000          ?        ?   102.8020  17.8786          ?        ?      101.1        8.8       ?       ? 
1 1 1   36    6   53 o     78.8   10.9    0.0000   0.0000          ?        ?    62.5751  17.2401          ?        ?       78.8       10.9       ?       ? 
1 1 1   36    6   54 o    236.6    4.2    0.0000   0.0000          ?        ?   560.6220  19.7942          ?        ?      236.6        4.2       ?       ? 
1 1 1   36    6   55 o    290.6    3.6    0.0000   0.0000          ?        ?   845.4026  21.0712          ?        ?      290.6        3.6       ?       ? 
1 1 1   36    6   56 o    250.7    4.1    0.0000   0.0000          ?        ?   629.5823  20.4327          ?        ?      250.7        4.1       ?       ? 
1 1 1   36    6   57 f     35.9   15.3    0.0000   0.0000          ?        ?     0.6385  19.1556          ?        ?       35.9       15.3       ?       ? 
1 1 1   36    6   58 o    147.9    6.5    0.0000   0.0000          ?        ?   219.6514  19.1556          ?        ?      147.9        6.5       ?       ? 
1 1 1   36    6   59 o    112.3    8.8    0.0000   0.0000          ?        ?   127.0658  19.7942          ?        ?      112.3        8.8       ?       ? 
1 1 1   36    6   60 o    188.7    5.1    0.0000   0.0000          ?        ?   356.9336  19.1556          ?        ?      188.7        5.1       ?       ? 
1 1 1   36    6   61 o    163.0    5.9    0.0000   0.0000          ?        ?   266.9020  19.1556          ?        ?      163.0        5.9       ?       ? 
1 1 1   36    6   62 o    249.3    4.2    0.0000   0.0000          ?        ?   623.1971  21.0712          ?        ?      249.3        4.2       ?       ? 
1 1 1   36    6   63 o    149.0    6.6    0.0000   0.0000          ?        ?   223.4826  19.7942          ?        ?      149.0        6.6       ?       ? 
1 1 1   36    6   64 o     56.3   16.2    0.0000   0.0000          ?        ?    33.8416  19.1556          ?        ?       56.3       16.2       ?       ? 
1 1 1   36    6   65 o     90.8   10.9    0.0000   0.0000          ?        ?    84.2849  19.7942          ?        ?       90.8       10.9       ?       ? 
1 1 1   36    6   66 o    175.9    5.8    0.0000   0.0000          ?        ?   311.5985  20.4327          ?        ?      175.9        5.8       ?       ? 
1 1 1   36    7    0 o    574.9    3.8 3305.6265  44.0580  3305.6265  44.0580  3305.6265  44.0580      574.9      3.8      574.9        3.8     0.0     0.0 
1 1 1   36    7    1 o    350.0    2.6    0.0000   0.0000          ?        ?  1225.3230  17.8786          ?        ?      350.0        2.6       ?       ? 
1 1 1   36    7    2 o   1049.9    4.0    0.0000   0.0000          ?        ? 11024.7139  84.9234          ?        ?     1049.9        4.0       ?       ? 
1 1 1   36    7    3 o    909.0    3.7    0.0000   0.0000          ?        ?  8263.1084  67.0448          ?        ?      909.0        3.7       ?       ? 
1 1 1   36    7    4 o    438.3    2.6    0.0000   0.0000          ?        ?  1921.3115  22.9868          ?        ?      438.3        2.6       ?       ? 
1 1 1   36    7    5 o    479.2    2.5    0.0000   0.0000          ?        ?  2296.7625  24.2638          ?        ?      479.2        2.5       ?       ? 
1 1 1   36    7    6 o    168.9    3.6    0.0000   0.0000          ?        ?   285.4192  12.1319          ?        ?      168.9        3.6       ?       ? 
1 1 1   36    7    7 o    541.1    2.5    0.0000   0.0000          ?        ?  2927.6216  27.4564          ?        ?      541.1        2.5       ?       ? 
1 1 1   36    7    8 o    705.6    3.0    0.0000   0.0000          ?        ?  4979.1914  42.7809          ?        ?      705.6        3.0       ?       ? 
1 1 1   36    7    9 f    435.5    2.6    0.0000   0.0000          ?        ?  1897.0479  22.3483          ?        ?      435.5        2.6       ?       ? 
1 1 1   36    7   10 o    552.5    2.7    0.0000   0.0000          ?        ?  3052.7720  29.3720          ?        ?      552.5        2.7       ?       ? 
1 1 1   36    7   11 o   1024.1    3.9    0.0000   0.0000          ?        ? 10489.6338  80.4537          ?        ?     1024.1        3.9       ?       ? 
1 1 1   36    7   12 o    341.3    2.5    0.0000   0.0000          ?        ?  1164.6635  17.2401          ?        ?      341.3        2.5       ?       ? 
1 1 1   36    7   13 o    791.2    3.3    0.0000   0.0000          ?        ?  6260.7046  51.7203          ?        ?      791.2        3.3       ?       ? 
1 1 1   36    7   14 o    370.1    2.5    0.0000   0.0000          ?        ?  1369.6289  18.5171          ?        ?      370.1        2.5       ?       ? 
1 1 1   36    7   15 o    472.1    2.6    0.0000   0.0000          ?        ?  2229.0791  24.9023          ?        ?      472.1        2.6       ?       ? 
1 1 1   36    7   16 o     67.8    9.0    0.0000   0.0000          ?        ?    45.9736  12.1319          ?        ?       67.8        9.0       ?       ? 
1 1 1   36    7   17 o    219.3    2.9    0.0000   0.0000          ?        ?   480.8068  12.7704          ?        ?      219.3        2.9       ?       ? 
1 1 1   36    7   18 o    798.8    3.2    0.0000   0.0000          ?        ?  6381.3853  50.4432          ?        ?      798.8        3.2       ?       ? 
1 1 1   36    7   19 o    405.7    2.5    0.0000   0.0000          ?        ?  1646.1086  20.4327          ?        ?      405.7        2.5       ?       ? 
1 1 1   36    7   20 o    460.2    2.5    0.0000   0.0000          ?        ?  2117.9763  22.9868          ?        ?      460.2        2.5       ?       ? 
1 1 1   36    7   21 o    381.4    2.5    0.0000   0.0000          ?        ?  1454.5522  19.1556          ?        ?      381.4        2.5       ?       ? 
1 1 1   36    7   22 o    407.3    2.4    0.0000   0.0000          ?        ?  1658.8792  19.7942          ?        ?      407.3        2.4       ?       ? 
1 1 1   36    7   23 o     21.7   10.5    0.0000   0.0000          ?        ?   -20.4327  13.4090          ?        ?       21.7       10.5       ?       ? 
1 1 1   36    7   24 o    684.3    2.8    0.0000   0.0000          ?        ?  4682.9180  38.9498          ?        ?      684.3        2.8       ?       ? 
1 1 1   36    7   25 o     19.3    9.5    0.0000   0.0000          ?        ?   -26.8179  12.7704          ?        ?       19.3        9.5       ?       ? 
1 1 1   36    7   26 o    434.4    2.4    0.0000   0.0000          ?        ?  1886.8314  21.0712          ?        ?      434.4        2.4       ?       ? 
1 1 1   36    7   27 o    264.8    3.3    0.0000   0.0000          ?        ?   701.0967  17.2401          ?        ?      264.8        3.3       ?       ? 
1 1 1   36    7   28 o   1387.4    4.8    0.0000   0.0000          ?        ? 19259.7285 134.0895          ?        ?     1387.4        4.8       ?       ? 
1 1 1   36    7   29 o    127.8    5.7    0.0000   0.0000          ?        ?   163.4615  14.6860          ?        ?      127.8        5.7       ?       ? 
1 1 1   36    7   30 o    603.8    2.8    0.0000   0.0000          ?        ?  3645.9585  33.8416          ?        ?      603.8        2.8       ?       ? 
1 1 1   36    7   31 o    363.3    2.7    0.0000   0.0000          ?        ?  1320.4628  19.7942          ?        ?      363.3        2.7       ?       ? 
1 1 1   36    7   32 o    519.8    2.6    0.0000   0.0000          ?        ?  2702.8621  26.8179          ?        ?      519.8        2.6       ?       ? 
1 1 1   36    7   33 o    539.6    2.5    0.0000   0.0000          ?        ?  2912.2971  27.4564          ?        ?      539.6        2.5       ?       ? 
1 1 1   36    7   34 o     20.6   10.2    0.0000   0.0000          ?        ?   -34.4802  15.3245          ?        ?       20.6       10.2       ?       ? 
1 1 1   36    7   35 o    591.1    2.7    0.0000   0.0000          ?        ?  3494.6287  31.9261          ?        ?      591.1        2.7       ?       ? 
1 1 1   36    7   36 o    199.7    3.8    0.0000   0.0000          ?        ?   399.0760  15.3245          ?        ?      199.7        3.8       ?       ? 
1 1 1   36    7   37 o     17.5    8.8    0.0000   0.0000          ?        ?   -48.5276  14.6860          ?        ?       17.5        8.8       ?       ? 
1 1 1   36    7   38 o    328.6    2.8    0.0000   0.0000          ?        ?  1080.3785  18.5171          ?        ?      328.6        2.8       ?       ? 
1 1 1   36    7   39 o    537.0    2.7    0.0000   0.0000          ?        ?  2884.8406  28.7335          ?        ?      537.0        2.7       ?       ? 
1 1 1   36    7   40 f    345.3    2.8    0.0000   0.0000          ?        ?  1192.7584  19.1556          ?        ?      345.3        2.8       ?       ? 
1 1 1   36    7   41 o    218.0    4.0    0.0000   0.0000          ?        ?   475.6986  17.2401          ?        ?      218.0        4.0       ?       ? 
1 1 1   36    7   42 o    261.2    3.2    0.0000   0.0000          ?        ?   682.5797  16.6016          ?        ?      261.2        3.2       ?       ? 
1 1 1   36    7   43 o    309.0    2.9    0.0000   0.0000          ?        ?   955.2284  17.8786          ?        ?      309.0        2.9       ?       ? 
1 1 1   36    7   44 o     27.5   12.7    0.0000   0.0000          ?        ?   -14.0475  16.6016          ?        ?       27.5       12.7       ?       ? 
1 1 1   36    7   45 o    319.1    3.1    0.0000   0.0000          ?        ?  1018.4420  19.7942          ?        ?      319.1        3.1       ?       ? 
1 1 1   36    7   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    7   47 o    287.0    3.3    0.0000   0.0000          ?        ?   824.3315  19.1556          ?        ?      287.0        3.3       ?       ? 
1 1 1   36    7   48 o    193.3    4.5    0.0000   0.0000          ?        ?   374.1737  17.2401          ?        ?      193.3        4.5       ?       ? 
1 1 1   36    7   49 o     96.3    8.9    0.0000   0.0000          ?        ?    93.2242  17.2401          ?        ?       96.3        8.9       ?       ? 
1 1 1   36    7   50 o    422.8    2.8    0.0000   0.0000          ?        ?  1788.4991  23.6253          ?        ?      422.8        2.8       ?       ? 
1 1 1   36    7   51 o    528.8    2.7    0.0000   0.0000          ?        ?  2798.0020  28.7335          ?        ?      528.8        2.7       ?       ? 
1 1 1   36    7   52 o     39.0   15.6    0.0000   0.0000          ?        ?     7.6623  18.5171          ?        ?       39.0       15.6       ?       ? 
1 1 1   36    7   53 o    282.3    3.6    0.0000   0.0000          ?        ?   797.5135  20.4327          ?        ?      282.3        3.6       ?       ? 
1 1 1   36    7   54 o    255.8    3.6    0.0000   0.0000          ?        ?   655.1232  18.5171          ?        ?      255.8        3.6       ?       ? 
1 1 1   36    7   55 f    194.9    4.9    0.0000   0.0000          ?        ?   380.5589  19.1556          ?        ?      194.9        4.9       ?       ? 
1 1 1   36    7   56 o     98.4    9.7    0.0000   0.0000          ?        ?    97.6938  19.1556          ?        ?       98.4        9.7       ?       ? 
1 1 1   36    7   57 o     20.9   10.5    0.0000   0.0000          ?        ?   -51.7203  18.5171          ?        ?       20.9       10.5       ?       ? 
1 1 1   36    7   58 o    227.2    4.2    0.0000   0.0000          ?        ?   517.2025  19.1556          ?        ?      227.2        4.2       ?       ? 
1 1 1   36    7   59 o     20.4   10.3    0.0000   0.0000          ?        ?   -59.3825  19.1556          ?        ?       20.4       10.3       ?       ? 
1 1 1   36    7   60 o    175.4    5.8    0.0000   0.0000          ?        ?   309.0445  20.4327          ?        ?      175.4        5.8       ?       ? 
1 1 1   36    7   61 o    118.8    8.1    0.0000   0.0000          ?        ?   142.3903  19.1556          ?        ?      118.8        8.1       ?       ? 
1 1 1   36    7   62 o     35.4   15.3    0.0000   0.0000          ?        ?    -1.2770  19.7942          ?        ?       35.4       15.3       ?       ? 
1 1 1   36    7   63 o    228.5    4.3    0.0000   0.0000          ?        ?   523.5877  19.7942          ?        ?      228.5        4.3       ?       ? 
1 1 1   36    7   64 o     62.4   16.2    0.0000   0.0000          ?        ?    42.1424  20.4327          ?        ?       62.4       16.2       ?       ? 
1 1 1   36    7   65 o    124.1    7.7    0.0000   0.0000          ?        ?   155.7993  19.1556          ?        ?      124.1        7.7       ?       ? 
1 1 1   36    7   66 o    133.2    7.2    0.0000   0.0000          ?        ?   179.4246  19.1556          ?        ?      133.2        7.2       ?       ? 
1 1 1   36    8    0 o    252.6    3.9  638.5216  19.7942   638.5216  19.7942   638.5216  19.7942      252.6      3.9      252.6        3.9     0.0     0.0 
1 1 1   36    8    1 o    990.9    3.8    0.0000   0.0000          ?        ?  9819.8242  75.3456          ?        ?      990.9        3.8       ?       ? 
1 1 1   36    8    2 o    816.5    3.4    0.0000   0.0000          ?        ?  6667.4424  54.9129          ?        ?      816.5        3.4       ?       ? 
1 1 1   36    8    3 o    737.9    3.2    0.0000   0.0000          ?        ?  5445.9512  47.2506          ?        ?      737.9        3.2       ?       ? 
1 1 1   36    8    4 o    196.7    3.2    0.0000   0.0000          ?        ?   386.9441  12.7704          ?        ?      196.7        3.2       ?       ? 
1 1 1   36    8    5 o    511.7    2.5    0.0000   0.0000          ?        ?  2618.5771  25.5409          ?        ?      511.7        2.5       ?       ? 
1 1 1   36    8    6 o    613.2    2.8    0.0000   0.0000          ?        ?  3760.8923  34.4802          ?        ?      613.2        2.8       ?       ? 
1 1 1   36    8    7 o     39.1   12.0    0.0000   0.0000          ?        ?    15.3245  10.2163          ?        ?       39.1       12.0       ?       ? 
1 1 1   36    8    8 o    533.9    2.6    0.0000   0.0000          ?        ?  2850.3606  28.0950          ?        ?      533.9        2.6       ?       ? 
1 1 1   36    8    9 o    648.8    2.9    0.0000   0.0000          ?        ?  4209.7729  37.6728          ?        ?      648.8        2.9       ?       ? 
1 1 1   36    8   10 o    544.5    2.7    0.0000   0.0000          ?        ?  2965.2944  29.3720          ?        ?      544.5        2.7       ?       ? 
1 1 1   36    8   11 o    466.8    2.5    0.0000   0.0000          ?        ?  2179.2742  23.6253          ?        ?      466.8        2.5       ?       ? 
1 1 1   36    8   12 o    157.0    3.7    0.0000   0.0000          ?        ?   246.4693  11.4934          ?        ?      157.0        3.7       ?       ? 
1 1 1   36    8   13 o    426.3    2.6    0.0000   0.0000          ?        ?  1817.2325  22.3483          ?        ?      426.3        2.6       ?       ? 
1 1 1   36    8   14 o   1337.7    4.7    0.0000   0.0000          ?        ? 17899.6777 125.1502          ?        ?     1337.7        4.7       ?       ? 
1 1 1   36    8   15 o    579.7    2.8    0.0000   0.0000          ?        ?  3361.1780  32.5646          ?        ?      579.7        2.8       ?       ? 
1 1 1   36    8   16 o    911.6    3.5    0.0000   0.0000          ?        ?  8312.2744  63.2136          ?        ?      911.6        3.5       ?       ? 
1 1 1   36    8   17 o    276.9    2.7    0.0000   0.0000          ?        ?   766.8644  14.6860          ?        ?      276.9        2.7       ?       ? 
1 1 1   36    8   18 o    634.6    2.7    0.0000   0.0000          ?        ?  4027.1560  34.4802          ?        ?      634.6        2.7       ?       ? 
1 1 1   36    8   19 o    253.1    2.9    0.0000   0.0000          ?        ?   640.4372  14.6860          ?        ?      253.1        2.9       ?       ? 
1 1 1   36    8   20 o   1386.0    4.7    0.0000   0.0000          ?        ? 19216.3086 130.2584          ?        ?     1386.0        4.7       ?       ? 
1 1 1   36    8   21 o    475.3    2.5    0.0000   0.0000          ?        ?  2259.0894  23.6253          ?        ?      475.3        2.5       ?       ? 
1 1 1   36    8   22 o    315.9    2.5    0.0000   0.0000          ?        ?   998.0093  15.9630          ?        ?      315.9        2.5       ?       ? 
1 1 1   36    8   23 o    209.4    3.2    0.0000   0.0000          ?        ?   438.6643  13.4090          ?        ?      209.4        3.2       ?       ? 
1 1 1   36    8   24 o    448.4    2.4    0.0000   0.0000          ?        ?  2010.7046  21.7097          ?        ?      448.4        2.4       ?       ? 
1 1 1   36    8   25 o    199.4    3.4    0.0000   0.0000          ?        ?   397.7990  13.4090          ?        ?      199.4        3.4       ?       ? 
1 1 1   36    8   26 o    115.8    6.1    0.0000   0.0000          ?        ?   134.0895  14.0475          ?        ?      115.8        6.1       ?       ? 
1 1 1   36    8   27 o    406.1    2.4    0.0000   0.0000          ?        ?  1649.3013  19.7942          ?        ?      406.1        2.4       ?       ? 
1 1 1   36    8   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    8   29 o    303.8    2.7    0.0000   0.0000          ?        ?   923.3023  16.6016          ?        ?      303.8        2.7       ?       ? 
1 1 1   36    8   30 o    174.3    4.0    0.0000   0.0000          ?        ?   303.9363  14.0475          ?        ?      174.3        4.0       ?       ? 
1 1 1   36    8   31 o    527.0    2.5    0.0000   0.0000          ?        ?  2777.5691  26.1794          ?        ?      527.0        2.5       ?       ? 
1 1 1   36    8   32 o    339.8    2.7    0.0000   0.0000          ?        ?  1155.0856  18.5171          ?        ?      339.8        2.7       ?       ? 
1 1 1   36    8   33 f    329.8    2.6    0.0000   0.0000          ?        ?  1088.0408  17.2401          ?        ?      329.8        2.6       ?       ? 
1 1 1   36    8   34 o    184.3    4.2    0.0000   0.0000          ?        ?   339.6935  15.3245          ?        ?      184.3        4.2       ?       ? 
1 1 1   36    8   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    8   36 o    335.2    2.8    0.0000   0.0000          ?        ?  1123.7981  18.5171          ?        ?      335.2        2.8       ?       ? 
1 1 1   36    8   37 o    172.6    4.4    0.0000   0.0000          ?        ?   298.1896  15.3245          ?        ?      172.6        4.4       ?       ? 
1 1 1   36    8   38 o     18.7    9.4    0.0000   0.0000          ?        ?   -45.3350  15.3245          ?        ?       18.7        9.4       ?       ? 
1 1 1   36    8   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    8   40 o     79.8    9.6    0.0000   0.0000          ?        ?    63.8522  15.3245          ?        ?       79.8        9.6       ?       ? 
1 1 1   36    8   41 o    168.1    4.7    0.0000   0.0000          ?        ?   282.8651  15.9630          ?        ?      168.1        4.7       ?       ? 
1 1 1   36    8   42 o    789.9    3.1    0.0000   0.0000          ?        ?  6241.5488  49.1662          ?        ?      789.9        3.1       ?       ? 
1 1 1   36    8   43 o    177.0    4.5    0.0000   0.0000          ?        ?   313.5141  15.9630          ?        ?      177.0        4.5       ?       ? 
1 1 1   36    8   44 o    153.4    5.2    0.0000   0.0000          ?        ?   235.6145  15.9630          ?        ?      153.4        5.2       ?       ? 
1 1 1   36    8   45 o    510.7    2.6    0.0000   0.0000          ?        ?  2608.9995  26.8179          ?        ?      510.7        2.6       ?       ? 
1 1 1   36    8   46 o    388.1    2.8    0.0000   0.0000          ?        ?  1506.9110  21.7097          ?        ?      388.1        2.8       ?       ? 
1 1 1   36    8   47 o    114.2    7.3    0.0000   0.0000          ?        ?   130.8969  16.6016          ?        ?      114.2        7.3       ?       ? 
1 1 1   36    8   48 o    234.1    3.8    0.0000   0.0000          ?        ?   548.4901  17.8786          ?        ?      234.1        3.8       ?       ? 
1 1 1   36    8   49 o    106.4    8.1    0.0000   0.0000          ?        ?   113.6568  17.2401          ?        ?      106.4        8.1       ?       ? 
1 1 1   36    8   50 o     54.0   16.0    0.0000   0.0000          ?        ?    30.0105  18.5171          ?        ?       54.0       16.0       ?       ? 
1 1 1   36    8   51 o     81.1   11.8    0.0000   0.0000          ?        ?    66.4062  19.1556          ?        ?       81.1       11.8       ?       ? 
1 1 1   36    8   52 o    244.4    3.7    0.0000   0.0000          ?        ?   597.6562  17.8786          ?        ?      244.4        3.7       ?       ? 
1 1 1   36    8   53 o    160.0    5.8    0.0000   0.0000          ?        ?   256.6857  18.5171          ?        ?      160.0        5.8       ?       ? 
1 1 1   36    8   54 o    152.2    6.1    0.0000   0.0000          ?        ?   232.4219  18.5171          ?        ?      152.2        6.1       ?       ? 
1 1 1   36    8   55 o    355.3    3.0    0.0000   0.0000          ?        ?  1263.6343  21.0712          ?        ?      355.3        3.0       ?       ? 
1 1 1   36    8   56 o    297.7    3.6    0.0000   0.0000          ?        ?   887.5450  21.7097          ?        ?      297.7        3.6       ?       ? 
1 1 1   36    8   57 o    204.9    4.7    0.0000   0.0000          ?        ?   420.7858  19.1556          ?        ?      204.9        4.7       ?       ? 
1 1 1   36    8   58 o    117.9    7.9    0.0000   0.0000          ?        ?   139.8362  18.5171          ?        ?      117.9        7.9       ?       ? 
1 1 1   36    8   59 o     26.7   12.8    0.0000   0.0000          ?        ?   -25.5409  19.1556          ?        ?       26.7       12.8       ?       ? 
1 1 1   36    8   60 o     38.2   15.7    0.0000   0.0000          ?        ?     5.7467  19.1556          ?        ?       38.2       15.7       ?       ? 
1 1 1   36    8   61 o    145.8    7.0    0.0000   0.0000          ?        ?   213.9047  20.4327          ?        ?      145.8        7.0       ?       ? 
1 1 1   36    8   62 o    131.7    7.8    0.0000   0.0000          ?        ?   174.9549  20.4327          ?        ?      131.7        7.8       ?       ? 
1 1 1   36    8   63 o     68.5   14.9    0.0000   0.0000          ?        ?    50.4432  19.7942          ?        ?       68.5       14.9       ?       ? 
1 1 1   36    8   64 o    198.0    5.2    0.0000   0.0000          ?        ?   393.9678  20.4327          ?        ?      198.0        5.2       ?       ? 
1 1 1   36    8   65 o    162.8    6.1    0.0000   0.0000          ?        ?   266.9020  19.7942          ?        ?      162.8        6.1       ?       ? 
1 1 1   36    9    0 o    269.7    3.6  727.9147  19.1556   727.9147  19.1556   727.9147  19.1556      269.7      3.6      269.7        3.6     0.0     0.0 
1 1 1   36    9    1 o    165.5    3.5    0.0000   0.0000          ?        ?   273.9258  11.4934          ?        ?      165.5        3.5       ?       ? 
1 1 1   36    9    2 o     98.2    6.8    0.0000   0.0000          ?        ?    96.4168  13.4090          ?        ?       98.2        6.8       ?       ? 
1 1 1   36    9    3 o    292.2    2.5    0.0000   0.0000          ?        ?   853.7034  14.6860          ?        ?      292.2        2.5       ?       ? 
1 1 1   36    9    4 o    282.1    2.6    0.0000   0.0000          ?        ?   795.5980  14.6860          ?        ?      282.1        2.6       ?       ? 
1 1 1   36    9    5 o    292.3    2.4    0.0000   0.0000          ?        ?   854.3420  14.0475          ?        ?      292.3        2.4       ?       ? 
1 1 1   36    9    6 o    894.2    3.6    0.0000   0.0000          ?        ?  7996.8452  64.4907          ?        ?      894.2        3.6       ?       ? 
1 1 1   36    9    7 o    778.9    3.1    0.0000   0.0000          ?        ?  6067.2324  48.5276          ?        ?      778.9        3.1       ?       ? 
1 1 1   36    9    8 o    795.7    3.2    0.0000   0.0000          ?        ?  6332.2192  51.0817          ?        ?      795.7        3.2       ?       ? 
1 1 1   36    9    9 o    439.0    2.5    0.0000   0.0000          ?        ?  1927.0582  21.7097          ?        ?      439.0        2.5       ?       ? 
1 1 1   36    9   10 o    659.6    3.0    0.0000   0.0000          ?        ?  4351.5249  40.2269          ?        ?      659.6        3.0       ?       ? 
1 1 1   36    9   11 f    398.3    2.4    0.0000   0.0000          ?        ?  1586.7262  19.1556          ?        ?      398.3        2.4       ?       ? 
1 1 1   36    9   12 o    852.7    3.4    0.0000   0.0000          ?        ?  7272.7612  58.1055          ?        ?      852.7        3.4       ?       ? 
1 1 1   36    9   13 o    395.6    2.4    0.0000   0.0000          ?        ?  1565.0166  19.1556          ?        ?      395.6        2.4       ?       ? 
1 1 1   36    9   14 o     51.9   11.4    0.0000   0.0000          ?        ?    28.0950  11.4934          ?        ?       51.9       11.4       ?       ? 
1 1 1   36    9   15 o    322.1    2.7    0.0000   0.0000          ?        ?  1037.5977  17.2401          ?        ?      322.1        2.7       ?       ? 
1 1 1   36    9   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    9   17 o    579.3    2.6    0.0000   0.0000          ?        ?  3356.0696  30.6490          ?        ?      579.3        2.6       ?       ? 
1 1 1   36    9   18 o    464.0    2.4    0.0000   0.0000          ?        ?  2153.0950  22.3483          ?        ?      464.0        2.4       ?       ? 
1 1 1   36    9   19 o    474.4    2.4    0.0000   0.0000          ?        ?  2250.7888  22.9868          ?        ?      474.4        2.4       ?       ? 
1 1 1   36    9   20 o    375.7    2.5    0.0000   0.0000          ?        ?  1411.7714  18.5171          ?        ?      375.7        2.5       ?       ? 
1 1 1   36    9   21 o    448.3    2.4    0.0000   0.0000          ?        ?  2010.0660  21.7097          ?        ?      448.3        2.4       ?       ? 
1 1 1   36    9   22 o    750.2    3.0    0.0000   0.0000          ?        ?  5629.2065  45.3350          ?        ?      750.2        3.0       ?       ? 
1 1 1   36    9   23 o    908.5    3.3    0.0000   0.0000          ?        ?  8255.4463  60.6596          ?        ?      908.5        3.3       ?       ? 
1 1 1   36    9   24 f    142.2    4.7    0.0000   0.0000          ?        ?   202.4114  13.4090          ?        ?      142.2        4.7       ?       ? 
1 1 1   36    9   25 o    144.2    5.1    0.0000   0.0000          ?        ?   208.1580  14.6860          ?        ?      144.2        5.1       ?       ? 
1 1 1   36    9   26 o    122.2    5.5    0.0000   0.0000          ?        ?   149.4141  13.4090          ?        ?      122.2        5.5       ?       ? 
1 1 1   36    9   27 o    446.0    2.5    0.0000   0.0000          ?        ?  1989.6334  22.3483          ?        ?      446.0        2.5       ?       ? 
1 1 1   36    9   28 o    233.5    3.1    0.0000   0.0000          ?        ?   545.2975  14.6860          ?        ?      233.5        3.1       ?       ? 
1 1 1   36    9   29 o    238.6    2.9    0.0000   0.0000          ?        ?   569.5613  14.0475          ?        ?      238.6        2.9       ?       ? 
1 1 1   36    9   30 o    194.5    3.9    0.0000   0.0000          ?        ?   378.6433  15.3245          ?        ?      194.5        3.9       ?       ? 
1 1 1   36    9   31 o    179.9    3.9    0.0000   0.0000          ?        ?   323.7305  14.0475          ?        ?      179.9        3.9       ?       ? 
1 1 1   36    9   32 o    266.2    2.8    0.0000   0.0000          ?        ?   708.7590  14.6860          ?        ?      266.2        2.8       ?       ? 
1 1 1   36    9   33 o    504.9    2.5    0.0000   0.0000          ?        ?  2549.6167  25.5409          ?        ?      504.9        2.5       ?       ? 
1 1 1   36    9   34 o    170.6    4.3    0.0000   0.0000          ?        ?   291.1659  14.6860          ?        ?      170.6        4.3       ?       ? 
1 1 1   36    9   35 f    189.9    4.2    0.0000   0.0000          ?        ?   360.7647  15.9630          ?        ?      189.9        4.2       ?       ? 
1 1 1   36    9   36 o    313.4    2.9    0.0000   0.0000          ?        ?   982.6848  17.8786          ?        ?      313.4        2.9       ?       ? 
1 1 1   36    9   37 f    205.2    3.7    0.0000   0.0000          ?        ?   421.4243  15.3245          ?        ?      205.2        3.7       ?       ? 
1 1 1   36    9   38 o     84.1    8.7    0.0000   0.0000          ?        ?    70.8759  14.6860          ?        ?       84.1        8.7       ?       ? 
1 1 1   36    9   39 o    290.2    3.1    0.0000   0.0000          ?        ?   842.2100  17.8786          ?        ?      290.2        3.1       ?       ? 
1 1 1   36    9   40 o    410.2    2.6    0.0000   0.0000          ?        ?  1683.1431  21.0712          ?        ?      410.2        2.6       ?       ? 
1 1 1   36    9   41 o    581.8    2.6    0.0000   0.0000          ?        ?  3385.4417  30.6490          ?        ?      581.8        2.6       ?       ? 
1 1 1   36    9   42 f    298.2    3.0    0.0000   0.0000          ?        ?   889.4606  17.8786          ?        ?      298.2        3.0       ?       ? 
1 1 1   36    9   43 o    317.8    2.7    0.0000   0.0000          ?        ?  1010.1412  17.2401          ?        ?      317.8        2.7       ?       ? 
1 1 1   36    9   44 o     30.2   13.2    0.0000   0.0000          ?        ?    -3.8311  15.3245          ?        ?       30.2       13.2       ?       ? 
1 1 1   36    9   45 o    440.4    2.6    0.0000   0.0000          ?        ?  1940.4672  22.9868          ?        ?      440.4        2.6       ?       ? 
1 1 1   36    9   46 o    178.7    5.0    0.0000   0.0000          ?        ?   319.8993  17.8786          ?        ?      178.7        5.0       ?       ? 
1 1 1   36    9   47 o    417.9    2.8    0.0000   0.0000          ?        ?  1747.6338  23.6253          ?        ?      417.9        2.8       ?       ? 
1 1 1   36    9   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    9   49 o     28.8   13.2    0.0000   0.0000          ?        ?   -12.1319  17.2401          ?        ?       28.8       13.2       ?       ? 
1 1 1   36    9   50 o    266.0    3.5    0.0000   0.0000          ?        ?   708.1205  18.5171          ?        ?      266.0        3.5       ?       ? 
1 1 1   36    9   51 o    189.6    4.9    0.0000   0.0000          ?        ?   360.1262  18.5171          ?        ?      189.6        4.9       ?       ? 
1 1 1   36    9   52 o    312.2    3.3    0.0000   0.0000          ?        ?   975.6611  20.4327          ?        ?      312.2        3.3       ?       ? 
1 1 1   36    9   53 o    153.7    6.0    0.0000   0.0000          ?        ?   236.8915  18.5171          ?        ?      153.7        6.0       ?       ? 
1 1 1   36    9   54 o    125.5    7.6    0.0000   0.0000          ?        ?   158.3534  19.1556          ?        ?      125.5        7.6       ?       ? 
1 1 1   36    9   55 o    166.0    5.8    0.0000   0.0000          ?        ?   276.4799  19.1556          ?        ?      166.0        5.8       ?       ? 
1 1 1   36    9   56 o    100.6    9.5    0.0000   0.0000          ?        ?   102.1635  19.1556          ?        ?      100.6        9.5       ?       ? 
1 1 1   36    9   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    9   58 o    189.8    5.4    0.0000   0.0000          ?        ?   361.4032  20.4327          ?        ?      189.8        5.4       ?       ? 
1 1 1   36    9   59 o    141.9    6.5    0.0000   0.0000          ?        ?   202.4114  18.5171          ?        ?      141.9        6.5       ?       ? 
1 1 1   36    9   60 o    201.5    4.9    0.0000   0.0000          ?        ?   407.3768  19.7942          ?        ?      201.5        4.9       ?       ? 
1 1 1   36    9   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36    9   62 o     47.6   16.5    0.0000   0.0000          ?        ?    21.7097  19.1556          ?        ?       47.6       16.5       ?       ? 
1 1 1   36    9   63 o     28.0   13.2    0.0000   0.0000          ?        ?   -22.3483  19.7942          ?        ?       28.0       13.2       ?       ? 
1 1 1   36    9   64 o     33.0   14.6    0.0000   0.0000          ?        ?    -5.1082  19.1556          ?        ?       33.0       14.6       ?       ? 
1 1 1   36   10    0 o     94.3   11.1   92.5856  20.4327    92.5856  20.4327    92.5856  20.4327       94.3     11.1       94.3       11.1     0.0     0.0 
1 1 1   36   10    1 f    711.0    3.0    0.0000   0.0000          ?        ?  5055.8140  42.1424          ?        ?      711.0        3.0       ?       ? 
1 1 1   36   10    2 o   1378.1    5.0    0.0000   0.0000          ?        ? 18996.0176 136.6436          ?        ?     1378.1        5.0       ?       ? 
1 1 1   36   10    3 o    698.3    2.8    0.0000   0.0000          ?        ?  4877.0283  39.5883          ?        ?      698.3        2.8       ?       ? 
1 1 1   36   10    4 o     36.2   11.7    0.0000   0.0000          ?        ?    12.7704   9.5778          ?        ?       36.2       11.7       ?       ? 
1 1 1   36   10    5 o    361.0    2.4    0.0000   0.0000          ?        ?  1303.2227  17.2401          ?        ?      361.0        2.4       ?       ? 
1 1 1   36   10    6 o    793.4    3.3    0.0000   0.0000          ?        ?  6295.8232  52.3588          ?        ?      793.4        3.3       ?       ? 
1 1 1   36   10    7 o    287.8    2.4    0.0000   0.0000          ?        ?   828.1625  14.0475          ?        ?      287.8        2.4       ?       ? 
1 1 1   36   10    8 o    151.8    3.8    0.0000   0.0000          ?        ?   230.5063  11.4934          ?        ?      151.8        3.8       ?       ? 
1 1 1   36   10    9 o    198.6    3.1    0.0000   0.0000          ?        ?   394.6064  12.1319          ?        ?      198.6        3.1       ?       ? 
1 1 1   36   10   10 o    435.8    2.6    0.0000   0.0000          ?        ?  1898.9633  22.3483          ?        ?      435.8        2.6       ?       ? 
1 1 1   36   10   11 o    637.9    2.9    0.0000   0.0000          ?        ?  4069.2983  36.3957          ?        ?      637.9        2.9       ?       ? 
1 1 1   36   10   12 o    909.3    3.6    0.0000   0.0000          ?        ?  8268.8555  65.1292          ?        ?      909.3        3.6       ?       ? 
1 1 1   36   10   13 o   1037.7    3.8    0.0000   0.0000          ?        ? 10770.5830  79.1767          ?        ?     1037.7        3.8       ?       ? 
1 1 1   36   10   14 o    579.3    2.8    0.0000   0.0000          ?        ?  3356.0696  31.9261          ?        ?      579.3        2.8       ?       ? 
1 1 1   36   10   15 o    973.1    3.6    0.0000   0.0000          ?        ?  9471.1914  69.5989          ?        ?      973.1        3.6       ?       ? 
1 1 1   36   10   16 o    940.3    3.7    0.0000   0.0000          ?        ?  8843.5244  69.5989          ?        ?      940.3        3.7       ?       ? 
1 1 1   36   10   17 o    829.3    3.3    0.0000   0.0000          ?        ?  6878.7939  54.2743          ?        ?      829.3        3.3       ?       ? 
1 1 1   36   10   18 o    597.1    2.6    0.0000   0.0000          ?        ?  3565.5049  30.6490          ?        ?      597.1        2.6       ?       ? 
1 1 1   36   10   19 o    311.8    2.5    0.0000   0.0000          ?        ?   972.4684  15.3245          ?        ?      311.8        2.5       ?       ? 
1 1 1   36   10   20 o    157.0    4.1    0.0000   0.0000          ?        ?   246.4693  12.7704          ?        ?      157.0        4.1       ?       ? 
1 1 1   36   10   21 o    358.9    2.4    0.0000   0.0000          ?        ?  1287.8981  17.2401          ?        ?      358.9        2.4       ?       ? 
1 1 1   36   10   22 o    663.1    2.7    0.0000   0.0000          ?        ?  4397.4985  36.3957          ?        ?      663.1        2.7       ?       ? 
1 1 1   36   10   23 o    202.9    3.3    0.0000   0.0000          ?        ?   411.8464  13.4090          ?        ?      202.9        3.3       ?       ? 
1 1 1   36   10   24 o    163.7    4.1    0.0000   0.0000          ?        ?   268.1791  13.4090          ?        ?      163.7        4.1       ?       ? 
1 1 1   36   10   25 o    611.0    2.6    0.0000   0.0000          ?        ?  3733.4360  31.9261          ?        ?      611.0        2.6       ?       ? 
1 1 1   36   10   26 o    344.1    2.6    0.0000   0.0000          ?        ?  1184.4576  17.8786          ?        ?      344.1        2.6       ?       ? 
1 1 1   36   10   27 o     26.0   11.9    0.0000   0.0000          ?        ?   -10.2163  14.0475          ?        ?       26.0       11.9       ?       ? 
1 1 1   36   10   28 o    130.5    5.4    0.0000   0.0000          ?        ?   170.4853  14.0475          ?        ?      130.5        5.4       ?       ? 
1 1 1   36   10   29 o    108.9    5.9    0.0000   0.0000          ?        ?   118.7650  12.7704          ?        ?      108.9        5.9       ?       ? 
1 1 1   36   10   30 o    203.7    3.8    0.0000   0.0000          ?        ?   415.0391  15.3245          ?        ?      203.7        3.8       ?       ? 
1 1 1   36   10   31 o    454.9    2.4    0.0000   0.0000          ?        ?  2069.4487  21.7097          ?        ?      454.9        2.4       ?       ? 
1 1 1   36   10   32 o    128.0    5.2    0.0000   0.0000          ?        ?   164.1001  13.4090          ?        ?      128.0        5.2       ?       ? 
1 1 1   36   10   33 o    204.3    3.8    0.0000   0.0000          ?        ?   417.5931  15.3245          ?        ?      204.3        3.8       ?       ? 
1 1 1   36   10   34 o    184.8    4.1    0.0000   0.0000          ?        ?   341.6091  15.3245          ?        ?      184.8        4.1       ?       ? 
1 1 1   36   10   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   10   36 o    278.9    2.9    0.0000   0.0000          ?        ?   778.3578  15.9630          ?        ?      278.9        2.9       ?       ? 
1 1 1   36   10   37 o    398.4    2.6    0.0000   0.0000          ?        ?  1587.3647  20.4327          ?        ?      398.4        2.6       ?       ? 
1 1 1   36   10   38 o    154.9    4.7    0.0000   0.0000          ?        ?   240.0841  14.6860          ?        ?      154.9        4.7       ?       ? 
1 1 1   36   10   39 o    329.4    2.8    0.0000   0.0000          ?        ?  1085.4868  18.5171          ?        ?      329.4        2.8       ?       ? 
1 1 1   36   10   40 o    333.3    2.8    0.0000   0.0000          ?        ?  1111.0276  18.5171          ?        ?      333.3        2.8       ?       ? 
1 1 1   36   10   41 o    362.3    2.7    0.0000   0.0000          ?        ?  1313.4390  19.7942          ?        ?      362.3        2.7       ?       ? 
1 1 1   36   10   42 o    238.2    3.5    0.0000   0.0000          ?        ?   567.6458  16.6016          ?        ?      238.2        3.5       ?       ? 
1 1 1   36   10   43 o    146.1    5.2    0.0000   0.0000          ?        ?   213.9047  15.3245          ?        ?      146.1        5.2       ?       ? 
1 1 1   36   10   44 o    123.4    6.5    0.0000   0.0000          ?        ?   152.6067  15.9630          ?        ?      123.4        6.5       ?       ? 
1 1 1   36   10   45 o    485.9    2.6    0.0000   0.0000          ?        ?  2361.8914  24.9023          ?        ?      485.9        2.6       ?       ? 
1 1 1   36   10   46 o     20.8   10.4    0.0000   0.0000          ?        ?   -44.6965  17.2401          ?        ?       20.8       10.4       ?       ? 
1 1 1   36   10   47 o    119.7    7.2    0.0000   0.0000          ?        ?   143.6674  17.2401          ?        ?      119.7        7.2       ?       ? 
1 1 1   36   10   48 o     94.6    9.1    0.0000   0.0000          ?        ?    90.0316  17.2401          ?        ?       94.6        9.1       ?       ? 
1 1 1   36   10   49 o    406.8    2.9    0.0000   0.0000          ?        ?  1655.6865  23.6253          ?        ?      406.8        2.9       ?       ? 
1 1 1   36   10   50 o    262.8    3.8    0.0000   0.0000          ?        ?   691.5189  19.7942          ?        ?      262.8        3.8       ?       ? 
1 1 1   36   10   51 o     20.1   10.0    0.0000   0.0000          ?        ?   -49.1662  17.2401          ?        ?       20.1       10.0       ?       ? 
1 1 1   36   10   52 o     23.0   11.3    0.0000   0.0000          ?        ?   -39.5883  18.5171          ?        ?       23.0       11.3       ?       ? 
1 1 1   36   10   53 o     19.6    9.9    0.0000   0.0000          ?        ?   -56.8284  17.8786          ?        ?       19.6        9.9       ?       ? 
1 1 1   36   10   54 o    118.2    7.8    0.0000   0.0000          ?        ?   140.4748  18.5171          ?        ?      118.2        7.8       ?       ? 
1 1 1   36   10   55 o    149.8    6.4    0.0000   0.0000          ?        ?   225.3981  19.1556          ?        ?      149.8        6.4       ?       ? 
1 1 1   36   10   56 o    177.1    5.6    0.0000   0.0000          ?        ?   314.7912  19.7942          ?        ?      177.1        5.6       ?       ? 
1 1 1   36   10   57 o    166.5    5.8    0.0000   0.0000          ?        ?   278.3954  19.1556          ?        ?      166.5        5.8       ?       ? 
1 1 1   36   10   58 o    127.2    7.5    0.0000   0.0000          ?        ?   162.8230  19.1556          ?        ?      127.2        7.5       ?       ? 
1 1 1   36   10   59 o    180.5    5.3    0.0000   0.0000          ?        ?   326.9231  19.1556          ?        ?      180.5        5.3       ?       ? 
1 1 1   36   10   60 o     92.8   10.7    0.0000   0.0000          ?        ?    87.4775  19.7942          ?        ?       92.8       10.7       ?       ? 
1 1 1   36   10   61 o    240.3    4.3    0.0000   0.0000          ?        ?   579.1391  20.4327          ?        ?      240.3        4.3       ?       ? 
1 1 1   36   10   62 o    140.3    7.1    0.0000   0.0000          ?        ?   198.5802  19.7942          ?        ?      140.3        7.1       ?       ? 
1 1 1   36   10   63 o    204.4    4.7    0.0000   0.0000          ?        ?   419.5087  19.1556          ?        ?      204.4        4.7       ?       ? 
1 1 1   36   10   64 o     19.2    9.7    0.0000   0.0000          ?        ?   -68.3218  19.1556          ?        ?       19.2        9.7       ?       ? 
1 1 1   36   11    0 f    825.1    4.7 6809.1948  77.2611  6809.1948  77.2611  6809.1948  77.2611      825.1      4.7      825.1        4.7     0.0     0.0 
1 1 1   36   11    1 o    678.8    3.0    0.0000   0.0000          ?        ?  4607.5718  40.8654          ?        ?      678.8        3.0       ?       ? 
1 1 1   36   11    2 o    226.7    2.7    0.0000   0.0000          ?        ?   514.0099  12.1319          ?        ?      226.7        2.7       ?       ? 
1 1 1   36   11    3 f    498.9    2.5    0.0000   0.0000          ?        ?  2488.9573  24.9023          ?        ?      498.9        2.5       ?       ? 
1 1 1   36   11    4 o    695.2    2.9    0.0000   0.0000          ?        ?  4833.6089  40.8654          ?        ?      695.2        2.9       ?       ? 
1 1 1   36   11    5 o     27.6   12.1    0.0000   0.0000          ?        ?    -3.1926  12.7704          ?        ?       27.6       12.1       ?       ? 
1 1 1   36   11    6 o    245.2    2.6    0.0000   0.0000          ?        ?   601.4874  12.7704          ?        ?      245.2        2.6       ?       ? 
1 1 1   36   11    7 o    178.7    3.4    0.0000   0.0000          ?        ?   319.2608  12.1319          ?        ?      178.7        3.4       ?       ? 
1 1 1   36   11    8 o    420.9    2.4    0.0000   0.0000          ?        ?  1771.8975  19.7942          ?        ?      420.9        2.4       ?       ? 
1 1 1   36   11    9 o    799.9    3.2    0.0000   0.0000          ?        ?  6399.9023  51.7203          ?        ?      799.9        3.2       ?       ? 
1 1 1   36   11   10 o    382.5    2.5    0.0000   0.0000          ?        ?  1462.8530  19.1556          ?        ?      382.5        2.5       ?       ? 
1 1 1   36   11   11 o    559.0    2.5    0.0000   0.0000          ?        ?  3124.9248  27.4564          ?        ?      559.0        2.5       ?       ? 
1 1 1   36   11   12 o    203.7    3.0    0.0000   0.0000          ?        ?   415.0391  12.1319          ?        ?      203.7        3.0       ?       ? 
1 1 1   36   11   13 o    828.2    3.3    0.0000   0.0000          ?        ?  6860.2764  54.2743          ?        ?      828.2        3.3       ?       ? 
1 1 1   36   11   14 o    749.0    3.1    0.0000   0.0000          ?        ?  5611.3281  46.6121          ?        ?      749.0        3.1       ?       ? 
1 1 1   36   11   15 o    772.3    3.3    0.0000   0.0000          ?        ?  5965.0693  50.4432          ?        ?      772.3        3.3       ?       ? 
1 1 1   36   11   16 o    300.4    2.6    0.0000   0.0000          ?        ?   902.2311  15.3245          ?        ?      300.4        2.6       ?       ? 
1 1 1   36   11   17 o    366.4    2.5    0.0000   0.0000          ?        ?  1342.8110  18.5171          ?        ?      366.4        2.5       ?       ? 
1 1 1   36   11   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   11   19 o    525.1    2.4    0.0000   0.0000          ?        ?  2757.1362  25.5409          ?        ?      525.1        2.4       ?       ? 
1 1 1   36   11   20 o     79.5    7.6    0.0000   0.0000          ?        ?    63.2136  12.1319          ?        ?       79.5        7.6       ?       ? 
1 1 1   36   11   21 o     77.4    7.8    0.0000   0.0000          ?        ?    60.0210  12.1319          ?        ?       77.4        7.8       ?       ? 
1 1 1   36   11   22 o    372.1    2.4    0.0000   0.0000          ?        ?  1384.9534  17.8786          ?        ?      372.1        2.4       ?       ? 
1 1 1   36   11   23 o    153.3    4.4    0.0000   0.0000          ?        ?   234.9760  13.4090          ?        ?      153.3        4.4       ?       ? 
1 1 1   36   11   24 o    465.3    2.4    0.0000   0.0000          ?        ?  2165.2268  22.3483          ?        ?      465.3        2.4       ?       ? 
1 1 1   36   11   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   11   26 o    477.2    2.5    0.0000   0.0000          ?        ?  2277.6067  24.2638          ?        ?      477.2        2.5       ?       ? 
1 1 1   36   11   27 o    511.8    2.4    0.0000   0.0000          ?        ?  2619.8542  24.9023          ?        ?      511.8        2.4       ?       ? 
1 1 1   36   11   28 o    517.1    2.6    0.0000   0.0000          ?        ?  2674.1284  26.8179          ?        ?      517.1        2.6       ?       ? 
1 1 1   36   11   29 o    356.7    2.4    0.0000   0.0000          ?        ?  1272.5736  17.2401          ?        ?      356.7        2.4       ?       ? 
1 1 1   36   11   30 o    181.5    4.0    0.0000   0.0000          ?        ?   329.4771  14.6860          ?        ?      181.5        4.0       ?       ? 
1 1 1   36   11   31 o    638.9    2.8    0.0000   0.0000          ?        ?  4082.7075  35.7572          ?        ?      638.9        2.8       ?       ? 
1 1 1   36   11   32 o    175.6    4.0    0.0000   0.0000          ?        ?   308.4059  14.0475          ?        ?      175.6        4.0       ?       ? 
1 1 1   36   11   33 o    510.8    2.5    0.0000   0.0000          ?        ?  2609.6379  25.5409          ?        ?      510.8        2.5       ?       ? 
1 1 1   36   11   34 o    639.9    2.7    0.0000   0.0000          ?        ?  4096.1162  35.1187          ?        ?      639.9        2.7       ?       ? 
1 1 1   36   11   35 o    377.2    2.5    0.0000   0.0000          ?        ?  1423.2646  19.1556          ?        ?      377.2        2.5       ?       ? 
1 1 1   36   11   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   11   37 o    324.7    2.9    0.0000   0.0000          ?        ?  1054.8376  19.1556          ?        ?      324.7        2.9       ?       ? 
1 1 1   36   11   38 o    165.2    4.6    0.0000   0.0000          ?        ?   273.2873  15.3245          ?        ?      165.2        4.6       ?       ? 
1 1 1   36   11   39 o    368.0    2.6    0.0000   0.0000          ?        ?  1354.3044  19.1556          ?        ?      368.0        2.6       ?       ? 
1 1 1   36   11   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   11   41 o    152.1    5.2    0.0000   0.0000          ?        ?   231.7833  15.9630          ?        ?      152.1        5.2       ?       ? 
1 1 1   36   11   42 o     22.6   10.9    0.0000   0.0000          ?        ?   -25.5409  15.3245          ?        ?       22.6       10.9       ?       ? 
1 1 1   36   11   43 o    378.4    2.7    0.0000   0.0000          ?        ?  1432.2040  20.4327          ?        ?      378.4        2.7       ?       ? 
1 1 1   36   11   44 o     23.8   11.5    0.0000   0.0000          ?        ?   -23.6253  15.9630          ?        ?       23.8       11.5       ?       ? 
1 1 1   36   11   45 o    138.7    6.0    0.0000   0.0000          ?        ?   192.8335  16.6016          ?        ?      138.7        6.0       ?       ? 
1 1 1   36   11   46 o     69.1   12.9    0.0000   0.0000          ?        ?    49.8047  17.2401          ?        ?       69.1       12.9       ?       ? 
1 1 1   36   11   47 o    240.8    3.7    0.0000   0.0000          ?        ?   580.4161  17.8786          ?        ?      240.8        3.7       ?       ? 
1 1 1   36   11   48 o     45.5   15.6    0.0000   0.0000          ?        ?    19.1556  17.2401          ?        ?       45.5       15.6       ?       ? 
1 1 1   36   11   49 o    245.8    3.8    0.0000   0.0000          ?        ?   604.6799  18.5171          ?        ?      245.8        3.8       ?       ? 
1 1 1   36   11   50 o    171.6    5.2    0.0000   0.0000          ?        ?   294.9970  17.8786          ?        ?      171.6        5.2       ?       ? 
1 1 1   36   11   51 o    248.7    3.9    0.0000   0.0000          ?        ?   619.3660  19.1556          ?        ?      248.7        3.9       ?       ? 
1 1 1   36   11   52 f     23.7   11.6    0.0000   0.0000          ?        ?   -32.5646  17.8786          ?        ?       23.7       11.6       ?       ? 
1 1 1   36   11   53 o     19.5    9.9    0.0000   0.0000          ?        ?   -67.0448  19.1556          ?        ?       19.5        9.9       ?       ? 
1 1 1   36   11   54 f     24.2   11.8    0.0000   0.0000          ?        ?   -33.2031  18.5171          ?        ?       24.2       11.8       ?       ? 
1 1 1   36   11   55 o    127.3    7.3    0.0000   0.0000          ?        ?   162.8230  18.5171          ?        ?      127.3        7.3       ?       ? 
1 1 1   36   11   56 o    119.5    7.7    0.0000   0.0000          ?        ?   143.6674  18.5171          ?        ?      119.5        7.7       ?       ? 
1 1 1   36   11   57 o    185.4    5.0    0.0000   0.0000          ?        ?   344.8017  18.5171          ?        ?      185.4        5.0       ?       ? 
1 1 1   36   11   58 f     30.2   13.9    0.0000   0.0000          ?        ?   -13.4090  19.1556          ?        ?       30.2       13.9       ?       ? 
1 1 1   36   11   59 o    168.0    5.5    0.0000   0.0000          ?        ?   283.5036  18.5171          ?        ?      168.0        5.5       ?       ? 
1 1 1   36   11   60 o     80.6   11.9    0.0000   0.0000          ?        ?    66.4062  19.1556          ?        ?       80.6       11.9       ?       ? 
1 1 1   36   11   61 o     75.7   13.6    0.0000   0.0000          ?        ?    60.6596  19.7942          ?        ?       75.7       13.6       ?       ? 
1 1 1   36   11   62 o     44.5   16.4    0.0000   0.0000          ?        ?    17.2401  19.1556          ?        ?       44.5       16.4       ?       ? 
1 1 1   36   11   63 o    203.7    4.7    0.0000   0.0000          ?        ?   416.9547  19.1556          ?        ?      203.7        4.7       ?       ? 
1 1 1   36   12    0 o    284.4    6.2  810.2839  35.1187   810.2839  35.1187   810.2839  35.1187      284.4      6.2      284.4        6.2     0.0     0.0 
1 1 1   36   12    1 o   1026.0    3.7    0.0000   0.0000          ?        ? 10529.2217  76.6226          ?        ?     1026.0        3.7       ?       ? 
1 1 1   36   12    2 f    647.1    2.8    0.0000   0.0000          ?        ?  4188.0635  35.7572          ?        ?      647.1        2.8       ?       ? 
1 1 1   36   12    3 o    438.5    2.3    0.0000   0.0000          ?        ?  1922.5886  20.4327          ?        ?      438.5        2.3       ?       ? 
1 1 1   36   12    4 o    283.2    2.4    0.0000   0.0000          ?        ?   801.9832  13.4090          ?        ?      283.2        2.4       ?       ? 
1 1 1   36   12    5 o    424.4    2.4    0.0000   0.0000          ?        ?  1801.2695  20.4327          ?        ?      424.4        2.4       ?       ? 
1 1 1   36   12    6 o    483.7    2.4    0.0000   0.0000          ?        ?  2339.5432  23.6253          ?        ?      483.7        2.4       ?       ? 
1 1 1   36   12    7 o    821.7    3.1    0.0000   0.0000          ?        ?  6752.3662  51.7203          ?        ?      821.7        3.1       ?       ? 
1 1 1   36   12    8 o    189.4    3.2    0.0000   0.0000          ?        ?   358.8492  12.1319          ?        ?      189.4        3.2       ?       ? 
1 1 1   36   12    9 o    362.7    2.4    0.0000   0.0000          ?        ?  1315.9932  17.2401          ?        ?      362.7        2.4       ?       ? 
1 1 1   36   12   10 o    378.2    2.4    0.0000   0.0000          ?        ?  1430.2885  17.8786          ?        ?      378.2        2.4       ?       ? 
1 1 1   36   12   11 o    359.8    2.2    0.0000   0.0000          ?        ?  1294.9219  15.9630          ?        ?      359.8        2.2       ?       ? 
1 1 1   36   12   12 o    200.4    3.0    0.0000   0.0000          ?        ?   401.6301  12.1319          ?        ?      200.4        3.0       ?       ? 
1 1 1   36   12   13 o    121.4    4.5    0.0000   0.0000          ?        ?   147.4985  10.8549          ?        ?      121.4        4.5       ?       ? 
1 1 1   36   12   14 o    604.8    2.7    0.0000   0.0000          ?        ?  3658.0906  32.5646          ?        ?      604.8        2.7       ?       ? 
1 1 1   36   12   15 o    664.3    2.8    0.0000   0.0000          ?        ?  4414.1001  37.0343          ?        ?      664.3        2.8       ?       ? 
1 1 1   36   12   16 o    670.3    2.8    0.0000   0.0000          ?        ?  4493.9150  37.6728          ?        ?      670.3        2.8       ?       ? 
1 1 1   36   12   17 o    592.7    2.7    0.0000   0.0000          ?        ?  3513.7844  31.9261          ?        ?      592.7        2.7       ?       ? 
1 1 1   36   12   18 o    259.9    2.6    0.0000   0.0000          ?        ?   675.5559  13.4090          ?        ?      259.9        2.6       ?       ? 
1 1 1   36   12   19 o    508.7    2.4    0.0000   0.0000          ?        ?  2587.9280  24.9023          ?        ?      508.7        2.4       ?       ? 
1 1 1   36   12   20 o    264.5    2.8    0.0000   0.0000          ?        ?   699.8197  14.6860          ?        ?      264.5        2.8       ?       ? 
1 1 1   36   12   21 o    562.0    2.6    0.0000   0.0000          ?        ?  3159.4050  29.3720          ?        ?      562.0        2.6       ?       ? 
1 1 1   36   12   22 o    500.9    2.4    0.0000   0.0000          ?        ?  2509.3899  24.2638          ?        ?      500.9        2.4       ?       ? 
1 1 1   36   12   23 o    306.0    2.7    0.0000   0.0000          ?        ?   936.7112  16.6016          ?        ?      306.0        2.7       ?       ? 
1 1 1   36   12   24 o    449.9    2.3    0.0000   0.0000          ?        ?  2024.1135  21.0712          ?        ?      449.9        2.3       ?       ? 
1 1 1   36   12   25 o    277.6    2.6    0.0000   0.0000          ?        ?   770.6956  14.6860          ?        ?      277.6        2.6       ?       ? 
1 1 1   36   12   26 o    379.7    2.4    0.0000   0.0000          ?        ?  1441.7819  18.5171          ?        ?      379.7        2.4       ?       ? 
1 1 1   36   12   27 o    158.0    4.4    0.0000   0.0000          ?        ?   249.6619  14.0475          ?        ?      158.0        4.4       ?       ? 
1 1 1   36   12   28 o     16.2    8.2    0.0000   0.0000          ?        ?   -47.8891  13.4090          ?        ?       16.2        8.2       ?       ? 
1 1 1   36   12   29 o    320.6    2.6    0.0000   0.0000          ?        ?  1028.0198  16.6016          ?        ?      320.6        2.6       ?       ? 
1 1 1   36   12   30 o    318.8    2.5    0.0000   0.0000          ?        ?  1016.5264  15.9630          ?        ?      318.8        2.5       ?       ? 
1 1 1   36   12   31 o    120.6    5.8    0.0000   0.0000          ?        ?   145.5829  14.0475          ?        ?      120.6        5.8       ?       ? 
1 1 1   36   12   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   12   33 o    358.1    2.6    0.0000   0.0000          ?        ?  1282.7899  18.5171          ?        ?      358.1        2.6       ?       ? 
1 1 1   36   12   34 o    159.3    4.8    0.0000   0.0000          ?        ?   254.1316  15.3245          ?        ?      159.3        4.8       ?       ? 
1 1 1   36   12   35 o    128.3    5.7    0.0000   0.0000          ?        ?   164.7386  14.6860          ?        ?      128.3        5.7       ?       ? 
1 1 1   36   12   36 o    274.9    3.0    0.0000   0.0000          ?        ?   756.0096  16.6016          ?        ?      274.9        3.0       ?       ? 
1 1 1   36   12   37 o    391.2    2.5    0.0000   0.0000          ?        ?  1531.1749  19.7942          ?        ?      391.2        2.5       ?       ? 
1 1 1   36   12   38 o    256.6    3.4    0.0000   0.0000          ?        ?   658.9543  17.2401          ?        ?      256.6        3.4       ?       ? 
1 1 1   36   12   39 o    274.8    3.1    0.0000   0.0000          ?        ?   755.3711  17.2401          ?        ?      274.8        3.1       ?       ? 
1 1 1   36   12   40 o    359.6    2.8    0.0000   0.0000          ?        ?  1293.6449  19.7942          ?        ?      359.6        2.8       ?       ? 
1 1 1   36   12   41 o    134.3    5.7    0.0000   0.0000          ?        ?   180.7016  15.3245          ?        ?      134.3        5.7       ?       ? 
1 1 1   36   12   42 o     35.6   14.2    0.0000   0.0000          ?        ?     6.3852  15.3245          ?        ?       35.6       14.2       ?       ? 
1 1 1   36   12   43 o    144.4    5.8    0.0000   0.0000          ?        ?   208.7966  16.6016          ?        ?      144.4        5.8       ?       ? 
1 1 1   36   12   44 o     99.9    8.0    0.0000   0.0000          ?        ?   100.2479  15.9630          ?        ?       99.9        8.0       ?       ? 
1 1 1   36   12   45 o    234.4    4.0    0.0000   0.0000          ?        ?   549.7671  18.5171          ?        ?      234.4        4.0       ?       ? 
1 1 1   36   12   46 o    400.7    2.8    0.0000   0.0000          ?        ?  1606.5205  22.3483          ?        ?      400.7        2.8       ?       ? 
1 1 1   36   12   47 o     75.9   10.9    0.0000   0.0000          ?        ?    58.1055  16.6016          ?        ?       75.9       10.9       ?       ? 
1 1 1   36   12   48 o    228.5    4.1    0.0000   0.0000          ?        ?   522.9492  18.5171          ?        ?      228.5        4.1       ?       ? 
1 1 1   36   12   49 o     25.9   12.4    0.0000   0.0000          ?        ?   -23.6253  17.8786          ?        ?       25.9       12.4       ?       ? 
1 1 1   36   12   50 o    233.2    4.1    0.0000   0.0000          ?        ?   544.6590  19.1556          ?        ?      233.2        4.1       ?       ? 
1 1 1   36   12   51 o    282.0    3.5    0.0000   0.0000          ?        ?   796.2365  19.7942          ?        ?      282.0        3.5       ?       ? 
1 1 1   36   12   52 o    222.3    4.5    0.0000   0.0000          ?        ?   494.8542  19.7942          ?        ?      222.3        4.5       ?       ? 
1 1 1   36   12   53 o    296.8    3.6    0.0000   0.0000          ?        ?   881.7984  21.0712          ?        ?      296.8        3.6       ?       ? 
1 1 1   36   12   54 o     78.1   11.8    0.0000   0.0000          ?        ?    61.9366  18.5171          ?        ?       78.1       11.8       ?       ? 
1 1 1   36   12   55 o    253.1    3.9    0.0000   0.0000          ?        ?   641.7142  19.7942          ?        ?      253.1        3.9       ?       ? 
1 1 1   36   12   56 o    183.0    5.2    0.0000   0.0000          ?        ?   335.8624  19.1556          ?        ?      183.0        5.2       ?       ? 
1 1 1   36   12   57 o     28.5   13.3    0.0000   0.0000          ?        ?   -16.6016  18.5171          ?        ?       28.5       13.3       ?       ? 
1 1 1   36   12   58 o     23.9   11.7    0.0000   0.0000          ?        ?   -34.4802  18.5171          ?        ?       23.9       11.7       ?       ? 
1 1 1   36   12   59 o     30.6   13.9    0.0000   0.0000          ?        ?   -10.2163  18.5171          ?        ?       30.6       13.9       ?       ? 
1 1 1   36   12   60 o     27.6   13.0    0.0000   0.0000          ?        ?   -21.7097  19.1556          ?        ?       27.6       13.0       ?       ? 
1 1 1   36   12   61 o    221.6    4.5    0.0000   0.0000          ?        ?   492.9387  19.7942          ?        ?      221.6        4.5       ?       ? 
1 1 1   36   12   62 o     69.4   14.3    0.0000   0.0000          ?        ?    51.7203  19.1556          ?        ?       69.4       14.3       ?       ? 
1 1 1   36   13    0 o   1282.4    7.4 16453.4258 189.6409 16453.4258 189.6409 16453.4258 189.6409     1282.4      7.4     1282.4        7.4     0.0     0.0 
1 1 1   36   13    1 o    898.5    3.9    0.0000   0.0000          ?        ?  8074.1060  69.5989          ?        ?      898.5        3.9       ?       ? 
1 1 1   36   13    2 o    828.9    3.4    0.0000   0.0000          ?        ?  6872.4087  56.1899          ?        ?      828.9        3.4       ?       ? 
1 1 1   36   13    3 o    402.2    2.5    0.0000   0.0000          ?        ?  1618.0138  19.7942          ?        ?      402.2        2.5       ?       ? 
1 1 1   36   13    4 o    282.1    2.4    0.0000   0.0000          ?        ?   795.5980  13.4090          ?        ?      282.1        2.4       ?       ? 
1 1 1   36   13    5 o    702.5    3.1    0.0000   0.0000          ?        ?  4935.7720  43.4195          ?        ?      702.5        3.1       ?       ? 
1 1 1   36   13    6 o    781.6    3.1    0.0000   0.0000          ?        ?  6109.3750  47.8891          ?        ?      781.6        3.1       ?       ? 
1 1 1   36   13    7 o    808.5    3.1    0.0000   0.0000          ?        ?  6537.1846  49.8047          ?        ?      808.5        3.1       ?       ? 
1 1 1   36   13    8 f    517.7    2.5    0.0000   0.0000          ?        ?  2680.5137  26.1794          ?        ?      517.7        2.5       ?       ? 
1 1 1   36   13    9 o    487.9    2.6    0.0000   0.0000          ?        ?  2381.0471  24.9023          ?        ?      487.9        2.6       ?       ? 
1 1 1   36   13   10 o    938.5    3.5    0.0000   0.0000          ?        ?  8809.6826  65.1292          ?        ?      938.5        3.5       ?       ? 
1 1 1   36   13   11 o    261.1    2.6    0.0000   0.0000          ?        ?   681.9411  13.4090          ?        ?      261.1        2.6       ?       ? 
1 1 1   36   13   12 o    608.6    2.7    0.0000   0.0000          ?        ?  3704.0637  32.5646          ?        ?      608.6        2.7       ?       ? 
1 1 1   36   13   13 o     19.3    9.3    0.0000   0.0000          ?        ?   -17.2401  10.8549          ?        ?       19.3        9.3       ?       ? 
1 1 1   36   13   14 o    364.8    2.3    0.0000   0.0000          ?        ?  1330.6791  16.6016          ?        ?      364.8        2.3       ?       ? 
1 1 1   36   13   15 o     18.4    9.0    0.0000   0.0000          ?        ?   -20.4327  10.8549          ?        ?       18.4        9.0       ?       ? 
1 1 1   36   13   16 o    256.4    2.7    0.0000   0.0000          ?        ?   657.6772  14.0475          ?        ?      256.4        2.7       ?       ? 
1 1 1   36   13   17 o    316.4    2.5    0.0000   0.0000          ?        ?  1001.2019  15.9630          ?        ?      316.4        2.5       ?       ? 
1 1 1   36   13   18 o    171.5    3.9    0.0000   0.0000          ?        ?   294.3585  13.4090          ?        ?      171.5        3.9       ?       ? 
1 1 1   36   13   19 o    718.1    3.0    0.0000   0.0000          ?        ?  5157.9775  43.4195          ?        ?      718.1        3.0       ?       ? 
1 1 1   36   13   20 f    137.7    4.9    0.0000   0.0000          ?        ?   189.6409  13.4090          ?        ?      137.7        4.9       ?       ? 
1 1 1   36   13   21 o    249.1    2.8    0.0000   0.0000          ?        ?   620.6430  14.0475          ?        ?      249.1        2.8       ?       ? 
1 1 1   36   13   22 o    579.0    2.6    0.0000   0.0000          ?        ?  3353.5156  30.0105          ?        ?      579.0        2.6       ?       ? 
1 1 1   36   13   23 o    382.0    2.4    0.0000   0.0000          ?        ?  1459.6605  18.5171          ?        ?      382.0        2.4       ?       ? 
1 1 1   36   13   24 o    171.9    3.9    0.0000   0.0000          ?        ?   295.6355  13.4090          ?        ?      171.9        3.9       ?       ? 
1 1 1   36   13   25 o    414.7    2.5    0.0000   0.0000          ?        ?  1720.1772  20.4327          ?        ?      414.7        2.5       ?       ? 
1 1 1   36   13   26 o    527.6    2.5    0.0000   0.0000          ?        ?  2784.5928  26.1794          ?        ?      527.6        2.5       ?       ? 
1 1 1   36   13   27 o    606.3    2.6    0.0000   0.0000          ?        ?  3677.2461  31.9261          ?        ?      606.3        2.6       ?       ? 
1 1 1   36   13   28 o    418.7    2.4    0.0000   0.0000          ?        ?  1753.3804  20.4327          ?        ?      418.7        2.4       ?       ? 
1 1 1   36   13   29 o    141.8    5.2    0.0000   0.0000          ?        ?   201.1343  14.6860          ?        ?      141.8        5.2       ?       ? 
1 1 1   36   13   30 o    433.9    2.4    0.0000   0.0000          ?        ?  1883.0002  21.0712          ?        ?      433.9        2.4       ?       ? 
1 1 1   36   13   31 o    275.0    3.0    0.0000   0.0000          ?        ?   756.6481  16.6016          ?        ?      275.0        3.0       ?       ? 
1 1 1   36   13   32 o    363.6    2.5    0.0000   0.0000          ?        ?  1322.3783  17.8786          ?        ?      363.6        2.5       ?       ? 
1 1 1   36   13   33 o    157.1    4.5    0.0000   0.0000          ?        ?   247.1079  14.0475          ?        ?      157.1        4.5       ?       ? 
1 1 1   36   13   34 o    166.4    4.4    0.0000   0.0000          ?        ?   277.1184  14.6860          ?        ?      166.4        4.4       ?       ? 
1 1 1   36   13   35 o    276.6    3.0    0.0000   0.0000          ?        ?   765.5875  16.6016          ?        ?      276.6        3.0       ?       ? 
1 1 1   36   13   36 o    497.2    2.5    0.0000   0.0000          ?        ?  2472.9941  24.9023          ?        ?      497.2        2.5       ?       ? 
1 1 1   36   13   37 o    331.1    2.8    0.0000   0.0000          ?        ?  1096.9802  18.5171          ?        ?      331.1        2.8       ?       ? 
1 1 1   36   13   38 o     96.7    7.9    0.0000   0.0000          ?        ?    93.8627  15.3245          ?        ?       96.7        7.9       ?       ? 
1 1 1   36   13   39 o     64.7   11.8    0.0000   0.0000          ?        ?    43.4195  14.6860          ?        ?       64.7       11.8       ?       ? 
1 1 1   36   13   40 o    157.9    4.9    0.0000   0.0000          ?        ?   249.6619  15.3245          ?        ?      157.9        4.9       ?       ? 
1 1 1   36   13   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   13   42 o    273.4    3.0    0.0000   0.0000          ?        ?   747.7088  16.6016          ?        ?      273.4        3.0       ?       ? 
1 1 1   36   13   43 o    198.1    4.2    0.0000   0.0000          ?        ?   392.6908  16.6016          ?        ?      198.1        4.2       ?       ? 
1 1 1   36   13   44 o    360.7    2.7    0.0000   0.0000          ?        ?  1301.9456  19.7942          ?        ?      360.7        2.7       ?       ? 
1 1 1   36   13   45 o     22.8   11.1    0.0000   0.0000          ?        ?   -30.6490  16.6016          ?        ?       22.8       11.1       ?       ? 
1 1 1   36   13   46 o    244.1    3.8    0.0000   0.0000          ?        ?   596.3792  18.5171          ?        ?      244.1        3.8       ?       ? 
1 1 1   36   13   47 o    115.3    7.5    0.0000   0.0000          ?        ?   133.4510  17.2401          ?        ?      115.3        7.5       ?       ? 
1 1 1   36   13   48 o     17.9    9.1    0.0000   0.0000          ?        ?   -60.0210  16.6016          ?        ?       17.9        9.1       ?       ? 
1 1 1   36   13   49 o    163.0    5.5    0.0000   0.0000          ?        ?   266.2635  17.8786          ?        ?      163.0        5.5       ?       ? 
1 1 1   36   13   50 o     39.2   15.5    0.0000   0.0000          ?        ?     8.9393  17.8786          ?        ?       39.2       15.5       ?       ? 
1 1 1   36   13   51 o    102.6    9.0    0.0000   0.0000          ?        ?   105.9946  18.5171          ?        ?      102.6        9.0       ?       ? 
1 1 1   36   13   52 o    241.7    4.0    0.0000   0.0000          ?        ?   584.8858  19.1556          ?        ?      241.7        4.0       ?       ? 
1 1 1   36   13   53 o    132.2    7.0    0.0000   0.0000          ?        ?   175.5934  18.5171          ?        ?      132.2        7.0       ?       ? 
1 1 1   36   13   54 o    190.2    5.0    0.0000   0.0000          ?        ?   362.6803  19.1556          ?        ?      190.2        5.0       ?       ? 
1 1 1   36   13   55 o    121.0    7.6    0.0000   0.0000          ?        ?   147.4985  18.5171          ?        ?      121.0        7.6       ?       ? 
1 1 1   36   13   56 o     56.0   15.8    0.0000   0.0000          ?        ?    33.2031  18.5171          ?        ?       56.0       15.8       ?       ? 
1 1 1   36   13   57 o    266.2    3.7    0.0000   0.0000          ?        ?   710.0360  19.7942          ?        ?      266.2        3.7       ?       ? 
1 1 1   36   13   58 o    272.5    3.7    0.0000   0.0000          ?        ?   743.8777  20.4327          ?        ?      272.5        3.7       ?       ? 
1 1 1   36   13   59 o     47.1   16.5    0.0000   0.0000          ?        ?    21.0712  19.1556          ?        ?       47.1       16.5       ?       ? 
1 1 1   36   13   60 o    367.9    3.0    0.0000   0.0000          ?        ?  1355.5814  21.7097          ?        ?      367.9        3.0       ?       ? 
1 1 1   36   13   61 o     20.2   10.2    0.0000   0.0000          ?        ?   -55.5514  18.5171          ?        ?       20.2       10.2       ?       ? 
1 1 1   36   13   62 o     34.2   14.9    0.0000   0.0000          ?        ?    -1.9156  19.1556          ?        ?       34.2       14.9       ?       ? 
1 1 1   36   14    0 o    353.8    4.0 1252.1410  28.0950  1252.1410  28.0950  1252.1410  28.0950      353.8      4.0      353.8        4.0     0.0     0.0 
1 1 1   36   14    1 o    170.2    3.9    0.0000   0.0000          ?        ?   289.8888  13.4090          ?        ?      170.2        3.9       ?       ? 
1 1 1   36   14    2 o    248.3    3.1    0.0000   0.0000          ?        ?   616.8119  15.3245          ?        ?      248.3        3.1       ?       ? 
1 1 1   36   14    3 o    305.5    2.5    0.0000   0.0000          ?        ?   933.5186  15.3245          ?        ?      305.5        2.5       ?       ? 
1 1 1   36   14    4 o    608.7    2.8    0.0000   0.0000          ?        ?  3705.9797  33.8416          ?        ?      608.7        2.8       ?       ? 
1 1 1   36   14    5 o    880.3    3.5    0.0000   0.0000          ?        ?  7751.0142  61.9366          ?        ?      880.3        3.5       ?       ? 
1 1 1   36   14    6 o    798.2    3.3    0.0000   0.0000          ?        ?  6372.4458  52.3588          ?        ?      798.2        3.3       ?       ? 
1 1 1   36   14    7 o    288.5    2.3    0.0000   0.0000          ?        ?   832.6321  13.4090          ?        ?      288.5        2.3       ?       ? 
1 1 1   36   14    8 o     37.3   11.1    0.0000   0.0000          ?        ?    14.0475   8.9393          ?        ?       37.3       11.1       ?       ? 
1 1 1   36   14    9 o    126.1    3.5    0.0000   0.0000          ?        ?   158.9919   8.9393          ?        ?      126.1        3.5       ?       ? 
1 1 1   36   14   10 o    404.5    2.4    0.0000   0.0000          ?        ?  1636.5309  19.1556          ?        ?      404.5        2.4       ?       ? 
1 1 1   36   14   11 o    764.7    3.0    0.0000   0.0000          ?        ?  5848.2197  45.3350          ?        ?      764.7        3.0       ?       ? 
1 1 1   36   14   12 o    465.3    2.5    0.0000   0.0000          ?        ?  2165.2268  22.9868          ?        ?      465.3        2.5       ?       ? 
1 1 1   36   14   13 o    229.8    2.6    0.0000   0.0000          ?        ?   528.0574  12.1319          ?        ?      229.8        2.6       ?       ? 
1 1 1   36   14   14 o     98.2    5.5    0.0000   0.0000          ?        ?    96.4168  10.8549          ?        ?       98.2        5.5       ?       ? 
1 1 1   36   14   15 o    140.4    3.9    0.0000   0.0000          ?        ?   197.3032  10.8549          ?        ?      140.4        3.9       ?       ? 
1 1 1   36   14   16 o    303.1    2.3    0.0000   0.0000          ?        ?   918.8326  14.0475          ?        ?      303.1        2.3       ?       ? 
1 1 1   36   14   17 o    446.3    2.5    0.0000   0.0000          ?        ?  1992.1875  22.3483          ?        ?      446.3        2.5       ?       ? 
1 1 1   36   14   18 o    968.4    3.7    0.0000   0.0000          ?        ?  9380.5215  71.5144          ?        ?      968.4        3.7       ?       ? 
1 1 1   36   14   19 o     69.1    9.2    0.0000   0.0000          ?        ?    47.8891  12.7704          ?        ?       69.1        9.2       ?       ? 
1 1 1   36   14   20 o     18.1    8.9    0.0000   0.0000          ?        ?   -24.9023  11.4934          ?        ?       18.1        8.9       ?       ? 
1 1 1   36   14   21 o    610.4    2.6    0.0000   0.0000          ?        ?  3727.0508  31.9261          ?        ?      610.4        2.6       ?       ? 
1 1 1   36   14   22 o    387.6    2.5    0.0000   0.0000          ?        ?  1502.4414  19.1556          ?        ?      387.6        2.5       ?       ? 
1 1 1   36   14   23 o    622.0    2.6    0.0000   0.0000          ?        ?  3870.0793  32.5646          ?        ?      622.0        2.6       ?       ? 
1 1 1   36   14   24 o    504.7    2.5    0.0000   0.0000          ?        ?  2547.7012  25.5409          ?        ?      504.7        2.5       ?       ? 
1 1 1   36   14   25 o    122.2    5.2    0.0000   0.0000          ?        ?   149.4141  12.7704          ?        ?      122.2        5.2       ?       ? 
1 1 1   36   14   26 o    175.9    3.8    0.0000   0.0000          ?        ?   309.6830  13.4090          ?        ?      175.9        3.8       ?       ? 
1 1 1   36   14   27 o    316.5    2.6    0.0000   0.0000          ?        ?  1001.8404  16.6016          ?        ?      316.5        2.6       ?       ? 
1 1 1   36   14   28 o     17.9    8.9    0.0000   0.0000          ?        ?   -33.2031  12.7704          ?        ?       17.9        8.9       ?       ? 
1 1 1   36   14   29 o    118.2    6.2    0.0000   0.0000          ?        ?   139.8362  14.6860          ?        ?      118.2        6.2       ?       ? 
1 1 1   36   14   30 o     56.4   12.2    0.0000   0.0000          ?        ?    33.2031  13.4090          ?        ?       56.4       12.2       ?       ? 
1 1 1   36   14   31 o    367.7    2.5    0.0000   0.0000          ?        ?  1352.3888  18.5171          ?        ?      367.7        2.5       ?       ? 
1 1 1   36   14   32 o    267.6    3.0    0.0000   0.0000          ?        ?   716.4213  15.9630          ?        ?      267.6        3.0       ?       ? 
1 1 1   36   14   33 o    128.8    5.5    0.0000   0.0000          ?        ?   166.0156  14.0475          ?        ?      128.8        5.5       ?       ? 
1 1 1   36   14   34 o     98.4    7.8    0.0000   0.0000          ?        ?    97.0553  15.3245          ?        ?       98.4        7.8       ?       ? 
1 1 1   36   14   35 o    389.8    2.6    0.0000   0.0000          ?        ?  1519.6815  20.4327          ?        ?      389.8        2.6       ?       ? 
1 1 1   36   14   36 o     70.9    9.9    0.0000   0.0000          ?        ?    50.4432  14.0475          ?        ?       70.9        9.9       ?       ? 
1 1 1   36   14   37 f    137.1    5.4    0.0000   0.0000          ?        ?   188.3639  14.6860          ?        ?      137.1        5.4       ?       ? 
1 1 1   36   14   38 o     80.9    9.1    0.0000   0.0000          ?        ?    65.7677  14.6860          ?        ?       80.9        9.1       ?       ? 
1 1 1   36   14   39 o    324.5    2.8    0.0000   0.0000          ?        ?  1053.5607  17.8786          ?        ?      324.5        2.8       ?       ? 
1 1 1   36   14   40 o    312.4    2.8    0.0000   0.0000          ?        ?   976.2995  17.2401          ?        ?      312.4        2.8       ?       ? 
1 1 1   36   14   41 o    296.9    3.0    0.0000   0.0000          ?        ?   881.7984  17.8786          ?        ?      296.9        3.0       ?       ? 
1 1 1   36   14   42 o     28.6   13.0    0.0000   0.0000          ?        ?    -8.9393  15.9630          ?        ?       28.6       13.0       ?       ? 
1 1 1   36   14   43 o    237.2    3.6    0.0000   0.0000          ?        ?   563.1760  17.2401          ?        ?      237.2        3.6       ?       ? 
1 1 1   36   14   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   14   45 o    541.5    2.7    0.0000   0.0000          ?        ?  2933.3684  29.3720          ?        ?      541.5        2.7       ?       ? 
1 1 1   36   14   46 o    227.2    3.8    0.0000   0.0000          ?        ?   516.5640  17.2401          ?        ?      227.2        3.8       ?       ? 
1 1 1   36   14   47 o     98.2    8.8    0.0000   0.0000          ?        ?    97.0553  17.2401          ?        ?       98.2        8.8       ?       ? 
1 1 1   36   14   48 o    188.4    4.7    0.0000   0.0000          ?        ?   355.6566  17.8786          ?        ?      188.4        4.7       ?       ? 
1 1 1   36   14   49 o     21.1   10.5    0.0000   0.0000          ?        ?   -42.7809  17.2401          ?        ?       21.1       10.5       ?       ? 
1 1 1   36   14   50 o    364.6    2.9    0.0000   0.0000          ?        ?  1330.0405  21.0712          ?        ?      364.6        2.9       ?       ? 
1 1 1   36   14   51 o     28.8   13.3    0.0000   0.0000          ?        ?   -14.0475  17.8786          ?        ?       28.8       13.3       ?       ? 
1 1 1   36   14   52 o    278.8    3.4    0.0000   0.0000          ?        ?   778.3578  19.1556          ?        ?      278.8        3.4       ?       ? 
1 1 1   36   14   53 o     34.1   14.8    0.0000   0.0000          ?        ?    -1.9156  18.5171          ?        ?       34.1       14.8       ?       ? 
1 1 1   36   14   54 o     89.9   10.3    0.0000   0.0000          ?        ?    81.7308  18.5171          ?        ?       89.9       10.3       ?       ? 
1 1 1   36   14   55 o     57.0   16.1    0.0000   0.0000          ?        ?    34.4802  19.1556          ?        ?       57.0       16.1       ?       ? 
1 1 1   36   14   56 o     80.0   11.6    0.0000   0.0000          ?        ?    65.1292  18.5171          ?        ?       80.0       11.6       ?       ? 
1 1 1   36   14   57 o     28.9   13.4    0.0000   0.0000          ?        ?   -15.3245  18.5171          ?        ?       28.9       13.4       ?       ? 
1 1 1   36   14   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   14   59 o     84.0   11.4    0.0000   0.0000          ?        ?    72.1529  19.1556          ?        ?       84.0       11.4       ?       ? 
1 1 1   36   14   60 o     78.9   11.7    0.0000   0.0000          ?        ?    63.8522  18.5171          ?        ?       78.9       11.7       ?       ? 
1 1 1   36   14   61 o     22.9   11.4    0.0000   0.0000          ?        ?   -45.9736  19.7942          ?        ?       22.9       11.4       ?       ? 
1 1 1   36   15    0 o     72.3   13.8   57.4669  17.8786    57.4669  17.8786    57.4669  17.8786       72.3     13.8       72.3       13.8     0.0     0.0 
1 1 1   36   15    1 o    475.7    2.7    0.0000   0.0000          ?        ?  2262.9207  25.5409          ?        ?      475.7        2.7       ?       ? 
1 1 1   36   15    2 o    217.1    3.2    0.0000   0.0000          ?        ?   471.2290  14.0475          ?        ?      217.1        3.2       ?       ? 
1 1 1   36   15    3 o    533.3    2.8    0.0000   0.0000          ?        ?  2844.6138  30.0105          ?        ?      533.3        2.8       ?       ? 
1 1 1   36   15    4 o    192.3    3.5    0.0000   0.0000          ?        ?   369.7040  13.4090          ?        ?      192.3        3.5       ?       ? 
1 1 1   36   15    5 o    227.1    2.8    0.0000   0.0000          ?        ?   515.9255  12.7704          ?        ?      227.1        2.8       ?       ? 
1 1 1   36   15    6 o    458.1    2.5    0.0000   0.0000          ?        ?  2098.8206  22.9868          ?        ?      458.1        2.5       ?       ? 
1 1 1   36   15    7 o    517.3    2.5    0.0000   0.0000          ?        ?  2676.0442  26.1794          ?        ?      517.3        2.5       ?       ? 
1 1 1   36   15    8 f    638.4    2.8    0.0000   0.0000          ?        ?  4076.3223  35.1187          ?        ?      638.4        2.8       ?       ? 
1 1 1   36   15    9 o    646.9    2.8    0.0000   0.0000          ?        ?  4185.5093  35.7572          ?        ?      646.9        2.8       ?       ? 
1 1 1   36   15   10 o    539.7    2.5    0.0000   0.0000          ?        ?  2912.9358  26.8179          ?        ?      539.7        2.5       ?       ? 
1 1 1   36   15   11 o    491.5    2.5    0.0000   0.0000          ?        ?  2416.1658  24.9023          ?        ?      491.5        2.5       ?       ? 
1 1 1   36   15   12 o    522.4    2.4    0.0000   0.0000          ?        ?  2729.0415  25.5409          ?        ?      522.4        2.4       ?       ? 
1 1 1   36   15   13 o    248.7    2.4    0.0000   0.0000          ?        ?   618.7275  12.1319          ?        ?      248.7        2.4       ?       ? 
1 1 1   36   15   14 o    245.9    2.5    0.0000   0.0000          ?        ?   604.6799  12.1319          ?        ?      245.9        2.5       ?       ? 
1 1 1   36   15   15 f    335.1    2.4    0.0000   0.0000          ?        ?  1123.1595  15.9630          ?        ?      335.1        2.4       ?       ? 
1 1 1   36   15   16 o    212.6    3.0    0.0000   0.0000          ?        ?   452.0733  12.7704          ?        ?      212.6        3.0       ?       ? 
1 1 1   36   15   17 o    163.3    3.7    0.0000   0.0000          ?        ?   266.9020  12.1319          ?        ?      163.3        3.7       ?       ? 
1 1 1   36   15   18 o    145.6    3.9    0.0000   0.0000          ?        ?   211.9892  11.4934          ?        ?      145.6        3.9       ?       ? 
1 1 1   36   15   19 o     43.9   12.5    0.0000   0.0000          ?        ?    19.7942  11.4934          ?        ?       43.9       12.5       ?       ? 
1 1 1   36   15   20 o    142.7    4.3    0.0000   0.0000          ?        ?   203.6884  12.1319          ?        ?      142.7        4.3       ?       ? 
1 1 1   36   15   21 o    451.2    2.4    0.0000   0.0000          ?        ?  2036.2455  21.7097          ?        ?      451.2        2.4       ?       ? 
1 1 1   36   15   22 o    138.4    4.4    0.0000   0.0000          ?        ?   191.5565  12.1319          ?        ?      138.4        4.4       ?       ? 
1 1 1   36   15   23 o    288.4    2.5    0.0000   0.0000          ?        ?   831.9937  14.6860          ?        ?      288.4        2.5       ?       ? 
1 1 1   36   15   24 o    544.0    2.5    0.0000   0.0000          ?        ?  2959.5479  27.4564          ?        ?      544.0        2.5       ?       ? 
1 1 1   36   15   25 o    556.7    2.5    0.0000   0.0000          ?        ?  3100.0225  28.0950          ?        ?      556.7        2.5       ?       ? 
1 1 1   36   15   26 o    123.2    5.2    0.0000   0.0000          ?        ?   151.9681  12.7704          ?        ?      123.2        5.2       ?       ? 
1 1 1   36   15   27 o    512.7    2.6    0.0000   0.0000          ?        ?  2629.4319  26.1794          ?        ?      512.7        2.6       ?       ? 
1 1 1   36   15   28 o    393.6    2.4    0.0000   0.0000          ?        ?  1549.6920  19.1556          ?        ?      393.6        2.4       ?       ? 
1 1 1   36   15   29 o    259.6    3.1    0.0000   0.0000          ?        ?   674.2788  15.9630          ?        ?      259.6        3.1       ?       ? 
1 1 1   36   15   30 o    118.7    5.6    0.0000   0.0000          ?        ?   141.1133  13.4090          ?        ?      118.7        5.6       ?       ? 
1 1 1   36   15   31 o    471.3    2.5    0.0000   0.0000          ?        ?  2222.0552  23.6253          ?        ?      471.3        2.5       ?       ? 
1 1 1   36   15   32 o     52.4   12.9    0.0000   0.0000          ?        ?    28.7335  13.4090          ?        ?       52.4       12.9       ?       ? 
1 1 1   36   15   33 o     65.2   10.8    0.0000   0.0000          ?        ?    42.7809  14.0475          ?        ?       65.2       10.8       ?       ? 
1 1 1   36   15   34 f     61.6   12.4    0.0000   0.0000          ?        ?    39.5883  14.6860          ?        ?       61.6       12.4       ?       ? 
1 1 1   36   15   35 o    466.4    2.6    0.0000   0.0000          ?        ?  2176.0815  24.2638          ?        ?      466.4        2.6       ?       ? 
1 1 1   36   15   36 o    259.8    3.2    0.0000   0.0000          ?        ?   675.5559  16.6016          ?        ?      259.8        3.2       ?       ? 
1 1 1   36   15   37 o     74.3   10.3    0.0000   0.0000          ?        ?    55.5514  15.3245          ?        ?       74.3       10.3       ?       ? 
1 1 1   36   15   38 o     60.0   12.6    0.0000   0.0000          ?        ?    37.6728  14.6860          ?        ?       60.0       12.6       ?       ? 
1 1 1   36   15   39 o    110.8    7.2    0.0000   0.0000          ?        ?   123.2347  15.9630          ?        ?      110.8        7.2       ?       ? 
1 1 1   36   15   40 o     42.3   14.4    0.0000   0.0000          ?        ?    16.6016  14.6860          ?        ?       42.3       14.4       ?       ? 
1 1 1   36   15   41 o     40.7   14.7    0.0000   0.0000          ?        ?    14.0475  15.3245          ?        ?       40.7       14.7       ?       ? 
1 1 1   36   15   42 o    205.9    4.3    0.0000   0.0000          ?        ?   424.6169  17.8786          ?        ?      205.9        4.3       ?       ? 
1 1 1   36   15   43 o    262.3    3.4    0.0000   0.0000          ?        ?   688.3264  17.8786          ?        ?      262.3        3.4       ?       ? 
1 1 1   36   15   44 o    104.3    8.0    0.0000   0.0000          ?        ?   109.1872  16.6016          ?        ?      104.3        8.0       ?       ? 
1 1 1   36   15   45 o    206.4    4.2    0.0000   0.0000          ?        ?   426.5325  17.2401          ?        ?      206.4        4.2       ?       ? 
1 1 1   36   15   46 o     42.3   15.5    0.0000   0.0000          ?        ?    14.6860  17.2401          ?        ?       42.3       15.5       ?       ? 
1 1 1   36   15   47 o     73.3   11.8    0.0000   0.0000          ?        ?    54.2743  17.2401          ?        ?       73.3       11.8       ?       ? 
1 1 1   36   15   48 o     25.4   12.1    0.0000   0.0000          ?        ?   -22.9868  17.2401          ?        ?       25.4       12.1       ?       ? 
1 1 1   36   15   49 o    207.4    4.5    0.0000   0.0000          ?        ?   431.0021  18.5171          ?        ?      207.4        4.5       ?       ? 
1 1 1   36   15   50 o     51.7   15.8    0.0000   0.0000          ?        ?    27.4564  17.8786          ?        ?       51.7       15.8       ?       ? 
1 1 1   36   15   51 o     55.6   15.9    0.0000   0.0000          ?        ?    32.5646  18.5171          ?        ?       55.6       15.9       ?       ? 
1 1 1   36   15   52 o     30.3   13.7    0.0000   0.0000          ?        ?    -9.5778  17.8786          ?        ?       30.3       13.7       ?       ? 
1 1 1   36   15   53 o    189.2    4.9    0.0000   0.0000          ?        ?   358.8492  18.5171          ?        ?      189.2        4.9       ?       ? 
1 1 1   36   15   54 o    172.9    5.5    0.0000   0.0000          ?        ?   300.1052  19.1556          ?        ?      172.9        5.5       ?       ? 
1 1 1   36   15   55 o    317.3    3.2    0.0000   0.0000          ?        ?  1008.2256  20.4327          ?        ?      317.3        3.2       ?       ? 
1 1 1   36   15   56 o    163.8    5.7    0.0000   0.0000          ?        ?   269.4561  18.5171          ?        ?      163.8        5.7       ?       ? 
1 1 1   36   15   57 o     71.1   13.5    0.0000   0.0000          ?        ?    53.6358  18.5171          ?        ?       71.1       13.5       ?       ? 
1 1 1   36   15   58 o    141.9    6.7    0.0000   0.0000          ?        ?   203.0499  19.1556          ?        ?      141.9        6.7       ?       ? 
1 1 1   36   15   59 o     55.1   15.9    0.0000   0.0000          ?        ?    32.5646  18.5171          ?        ?       55.1       15.9       ?       ? 
1 1 1   36   15   60 o     40.1   15.6    0.0000   0.0000          ?        ?    11.4934  17.8786          ?        ?       40.1       15.6       ?       ? 
1 1 1   36   16    0 o    430.8    3.7 1856.8208  31.9261  1856.8208  31.9261  1856.8208  31.9261      430.8      3.7      430.8        3.7     0.0     0.0 
1 1 1   36   16    1 o    273.3    2.8    0.0000   0.0000          ?        ?   747.0703  15.3245          ?        ?      273.3        2.8       ?       ? 
1 1 1   36   16    2 o    573.1    2.9    0.0000   0.0000          ?        ?  3285.1938  33.2031          ?        ?      573.1        2.9       ?       ? 
1 1 1   36   16    3 o    137.4    4.6    0.0000   0.0000          ?        ?   189.0024  12.7704          ?        ?      137.4        4.6       ?       ? 
1 1 1   36   16    4 o     63.9    9.5    0.0000   0.0000          ?        ?    40.8654  12.1319          ?        ?       63.9        9.5       ?       ? 
1 1 1   36   16    5 o    398.1    2.6    0.0000   0.0000          ?        ?  1585.4492  21.0712          ?        ?      398.1        2.6       ?       ? 
1 1 1   36   16    6 o    319.0    2.6    0.0000   0.0000          ?        ?  1017.8034  16.6016          ?        ?      319.0        2.6       ?       ? 
1 1 1   36   16    7 o    736.5    3.1    0.0000   0.0000          ?        ?  5424.8794  45.9736          ?        ?      736.5        3.1       ?       ? 
1 1 1   36   16    8 o    598.7    2.7    0.0000   0.0000          ?        ?  3585.2988  31.9261          ?        ?      598.7        2.7       ?       ? 
1 1 1   36   16    9 o    276.7    2.7    0.0000   0.0000          ?        ?   765.5875  14.6860          ?        ?      276.7        2.7       ?       ? 
1 1 1   36   16   10 o    631.3    2.8    0.0000   0.0000          ?        ?  3986.2905  35.7572          ?        ?      631.3        2.8       ?       ? 
1 1 1   36   16   11 o    226.8    2.5    0.0000   0.0000          ?        ?   514.6484  11.4934          ?        ?      226.8        2.5       ?       ? 
1 1 1   36   16   12 o    373.5    2.3    0.0000   0.0000          ?        ?  1395.1698  17.2401          ?        ?      373.5        2.3       ?       ? 
1 1 1   36   16   13 o    449.5    2.3    0.0000   0.0000          ?        ?  2020.9209  21.0712          ?        ?      449.5        2.3       ?       ? 
1 1 1   36   16   14 o    651.8    2.8    0.0000   0.0000          ?        ?  4250.0000  37.0343          ?        ?      651.8        2.8       ?       ? 
1 1 1   36   16   15 o     75.8    6.7    0.0000   0.0000          ?        ?    57.4669  10.2163          ?        ?       75.8        6.7       ?       ? 
1 1 1   36   16   16 o    171.9    3.3    0.0000   0.0000          ?        ?   295.6355  11.4934          ?        ?      171.9        3.3       ?       ? 
1 1 1   36   16   17 o     15.3    7.7    0.0000   0.0000          ?        ?   -30.0105  10.2163          ?        ?       15.3        7.7       ?       ? 
1 1 1   36   16   18 o    466.1    2.4    0.0000   0.0000          ?        ?  2172.8889  22.3483          ?        ?      466.1        2.4       ?       ? 
1 1 1   36   16   19 f    660.9    2.8    0.0000   0.0000          ?        ?  4369.4033  36.3957          ?        ?      660.9        2.8       ?       ? 
1 1 1   36   16   20 o    278.3    2.5    0.0000   0.0000          ?        ?   774.5267  14.0475          ?        ?      278.3        2.5       ?       ? 
1 1 1   36   16   21 o    336.2    2.4    0.0000   0.0000          ?        ?  1130.8219  15.9630          ?        ?      336.2        2.4       ?       ? 
1 1 1   36   16   22 o    196.2    3.3    0.0000   0.0000          ?        ?   385.0285  12.7704          ?        ?      196.2        3.3       ?       ? 
1 1 1   36   16   23 o    195.5    3.3    0.0000   0.0000          ?        ?   382.4745  12.7704          ?        ?      195.5        3.3       ?       ? 
1 1 1   36   16   24 o     18.3    9.1    0.0000   0.0000          ?        ?   -31.2876  12.7704          ?        ?       18.3        9.1       ?       ? 
1 1 1   36   16   25 f    215.7    3.4    0.0000   0.0000          ?        ?   465.4823  14.6860          ?        ?      215.7        3.4       ?       ? 
1 1 1   36   16   26 o     98.8    6.5    0.0000   0.0000          ?        ?    97.6938  12.7704          ?        ?       98.8        6.5       ?       ? 
1 1 1   36   16   27 o     63.8   10.5    0.0000   0.0000          ?        ?    40.8654  13.4090          ?        ?       63.8       10.5       ?       ? 
1 1 1   36   16   28 o    387.7    2.5    0.0000   0.0000          ?        ?  1503.0798  19.1556          ?        ?      387.7        2.5       ?       ? 
1 1 1   36   16   29 o    430.3    2.6    0.0000   0.0000          ?        ?  1851.7128  22.3483          ?        ?      430.3        2.6       ?       ? 
1 1 1   36   16   30 o    190.7    4.0    0.0000   0.0000          ?        ?   363.9573  15.3245          ?        ?      190.7        4.0       ?       ? 
1 1 1   36   16   31 o    561.3    2.6    0.0000   0.0000          ?        ?  3151.1042  29.3720          ?        ?      561.3        2.6       ?       ? 
1 1 1   36   16   32 o    187.2    4.1    0.0000   0.0000          ?        ?   350.5484  15.3245          ?        ?      187.2        4.1       ?       ? 
1 1 1   36   16   33 o    227.2    3.4    0.0000   0.0000          ?        ?   516.5640  15.3245          ?        ?      227.2        3.4       ?       ? 
1 1 1   36   16   34 o    434.2    2.5    0.0000   0.0000          ?        ?  1886.1929  21.7097          ?        ?      434.2        2.5       ?       ? 
1 1 1   36   16   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   16   36 o    666.0    2.8    0.0000   0.0000          ?        ?  4437.0869  37.6728          ?        ?      666.0        2.8       ?       ? 
1 1 1   36   16   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   16   38 o    133.6    6.2    0.0000   0.0000          ?        ?   178.7861  16.6016          ?        ?      133.6        6.2       ?       ? 
1 1 1   36   16   39 o    212.2    3.9    0.0000   0.0000          ?        ?   450.7963  16.6016          ?        ?      212.2        3.9       ?       ? 
1 1 1   36   16   40 f    180.9    4.6    0.0000   0.0000          ?        ?   327.5616  16.6016          ?        ?      180.9        4.6       ?       ? 
1 1 1   36   16   41 o    329.5    2.9    0.0000   0.0000          ?        ?  1086.1254  19.1556          ?        ?      329.5        2.9       ?       ? 
1 1 1   36   16   42 o    156.1    4.9    0.0000   0.0000          ?        ?   243.9153  15.3245          ?        ?      156.1        4.9       ?       ? 
1 1 1   36   16   43 o    138.9    5.7    0.0000   0.0000          ?        ?   193.4720  15.9630          ?        ?      138.9        5.7       ?       ? 
1 1 1   36   16   44 o    426.9    2.7    0.0000   0.0000          ?        ?  1822.9792  22.9868          ?        ?      426.9        2.7       ?       ? 
1 1 1   36   16   45 o     45.9   15.7    0.0000   0.0000          ?        ?    19.7942  17.2401          ?        ?       45.9       15.7       ?       ? 
1 1 1   36   16   46 o    370.9    2.8    0.0000   0.0000          ?        ?  1376.6527  21.0712          ?        ?      370.9        2.8       ?       ? 
1 1 1   36   16   47 o    171.8    5.0    0.0000   0.0000          ?        ?   295.6355  17.2401          ?        ?      171.8        5.0       ?       ? 
1 1 1   36   16   48 o    199.0    4.5    0.0000   0.0000          ?        ?   396.5219  17.8786          ?        ?      199.0        4.5       ?       ? 
1 1 1   36   16   49 o    399.0    2.8    0.0000   0.0000          ?        ?  1593.1115  22.3483          ?        ?      399.0        2.8       ?       ? 
1 1 1   36   16   50 o    280.6    3.5    0.0000   0.0000          ?        ?   788.5742  19.7942          ?        ?      280.6        3.5       ?       ? 
1 1 1   36   16   51 o    369.4    2.9    0.0000   0.0000          ?        ?  1365.7977  21.7097          ?        ?      369.4        2.9       ?       ? 
1 1 1   36   16   52 o    179.6    5.3    0.0000   0.0000          ?        ?   323.7305  19.1556          ?        ?      179.6        5.3       ?       ? 
1 1 1   36   16   53 o    289.2    3.4    0.0000   0.0000          ?        ?   837.7404  19.7942          ?        ?      289.2        3.4       ?       ? 
1 1 1   36   16   54 o     18.6    9.4    0.0000   0.0000          ?        ?   -64.4907  17.8786          ?        ?       18.6        9.4       ?       ? 
1 1 1   36   16   55 o     27.5   12.9    0.0000   0.0000          ?        ?   -19.7942  18.5171          ?        ?       27.5       12.9       ?       ? 
1 1 1   36   16   56 o     59.2   15.9    0.0000   0.0000          ?        ?    37.6728  19.1556          ?        ?       59.2       15.9       ?       ? 
1 1 1   36   16   57 o     22.9   11.3    0.0000   0.0000          ?        ?   -42.7809  19.1556          ?        ?       22.9       11.3       ?       ? 
1 1 1   36   16   58 o    208.0    4.6    0.0000   0.0000          ?        ?   434.1947  19.1556          ?        ?      208.0        4.6       ?       ? 
1 1 1   36   16   59 o    111.3    8.6    0.0000   0.0000          ?        ?   125.7888  19.1556          ?        ?      111.3        8.6       ?       ? 
1 1 1   36   17    0 o     18.0   12.6  -14.0475  15.9630   -14.0475  15.9630   -14.0475  15.9630       18.0     12.6       18.0       12.6     0.0     0.0 
1 1 1   36   17    1 o    230.7    3.0    0.0000   0.0000          ?        ?   532.5270  14.0475          ?        ?      230.7        3.0       ?       ? 
1 1 1   36   17    2 o     36.2   13.1    0.0000   0.0000          ?        ?    10.8549  12.1319          ?        ?       36.2       13.1       ?       ? 
1 1 1   36   17    3 o    387.6    2.6    0.0000   0.0000          ?        ?  1502.4414  19.7942          ?        ?      387.6        2.6       ?       ? 
1 1 1   36   17    4 f    674.5    3.1    0.0000   0.0000          ?        ?  4550.7437  41.5039          ?        ?      674.5        3.1       ?       ? 
1 1 1   36   17    5 o    325.3    2.6    0.0000   0.0000          ?        ?  1058.6688  17.2401          ?        ?      325.3        2.6       ?       ? 
1 1 1   36   17    6 o    302.0    2.7    0.0000   0.0000          ?        ?   912.4474  16.6016          ?        ?      302.0        2.7       ?       ? 
1 1 1   36   17    7 o    503.1    2.7    0.0000   0.0000          ?        ?  2531.7383  26.8179          ?        ?      503.1        2.7       ?       ? 
1 1 1   36   17    8 o    638.3    2.8    0.0000   0.0000          ?        ?  4075.6833  35.1187          ?        ?      638.3        2.8       ?       ? 
1 1 1   36   17    9 o    232.9    3.0    0.0000   0.0000          ?        ?   542.7434  14.0475          ?        ?      232.9        3.0       ?       ? 
1 1 1   36   17   10 o    514.5    2.7    0.0000   0.0000          ?        ?  2647.3108  28.0950          ?        ?      514.5        2.7       ?       ? 
1 1 1   36   17   11 o    278.3    2.6    0.0000   0.0000          ?        ?   774.5267  14.6860          ?        ?      278.3        2.6       ?       ? 
1 1 1   36   17   12 o    189.9    2.5    0.0000   0.0000          ?        ?   360.7647   9.5778          ?        ?      189.9        2.5       ?       ? 
1 1 1   36   17   13 o    383.4    2.5    0.0000   0.0000          ?        ?  1470.5154  19.1556          ?        ?      383.4        2.5       ?       ? 
1 1 1   36   17   14 o    188.6    3.4    0.0000   0.0000          ?        ?   355.6566  12.7704          ?        ?      188.6        3.4       ?       ? 
1 1 1   36   17   15 f     20.2    9.5    0.0000   0.0000          ?        ?   -12.1319  10.2163          ?        ?       20.2        9.5       ?       ? 
1 1 1   36   17   16 o    242.6    2.8    0.0000   0.0000          ?        ?   588.7169  13.4090          ?        ?      242.6        2.8       ?       ? 
1 1 1   36   17   17 o    255.9    2.6    0.0000   0.0000          ?        ?   655.1232  13.4090          ?        ?      255.9        2.6       ?       ? 
1 1 1   36   17   18 o    194.1    3.1    0.0000   0.0000          ?        ?   376.7278  12.1319          ?        ?      194.1        3.1       ?       ? 
1 1 1   36   17   19 o    858.6    3.3    0.0000   0.0000          ?        ?  7374.2866  56.1899          ?        ?      858.6        3.3       ?       ? 
1 1 1   36   17   20 o    370.0    2.5    0.0000   0.0000          ?        ?  1368.9904  18.5171          ?        ?      370.0        2.5       ?       ? 
1 1 1   36   17   21 o    345.8    2.6    0.0000   0.0000          ?        ?  1195.9510  17.8786          ?        ?      345.8        2.6       ?       ? 
1 1 1   36   17   22 o    354.3    2.4    0.0000   0.0000          ?        ?  1255.3335  17.2401          ?        ?      354.3        2.4       ?       ? 
1 1 1   36   17   23 o    167.8    3.8    0.0000   0.0000          ?        ?   281.5880  12.7704          ?        ?      167.8        3.8       ?       ? 
1 1 1   36   17   24 o    630.5    2.7    0.0000   0.0000          ?        ?  3976.0742  34.4802          ?        ?      630.5        2.7       ?       ? 
1 1 1   36   17   25 o    253.7    2.9    0.0000   0.0000          ?        ?   643.6298  14.6860          ?        ?      253.7        2.9       ?       ? 
1 1 1   36   17   26 o    777.2    3.0    0.0000   0.0000          ?        ?  6042.3301  46.6121          ?        ?      777.2        3.0       ?       ? 
1 1 1   36   17   27 o    506.3    2.5    0.0000   0.0000          ?        ?  2563.6643  25.5409          ?        ?      506.3        2.5       ?       ? 
1 1 1   36   17   28 o    542.4    2.6    0.0000   0.0000          ?        ?  2942.9460  28.0950          ?        ?      542.4        2.6       ?       ? 
1 1 1   36   17   29 o     47.8   13.5    0.0000   0.0000          ?        ?    23.6253  13.4090          ?        ?       47.8       13.5       ?       ? 
1 1 1   36   17   30 o    276.2    2.9    0.0000   0.0000          ?        ?   763.0333  15.9630          ?        ?      276.2        2.9       ?       ? 
1 1 1   36   17   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   17   32 o    295.9    2.8    0.0000   0.0000          ?        ?   876.0516  16.6016          ?        ?      295.9        2.8       ?       ? 
1 1 1   36   17   33 o    171.9    4.3    0.0000   0.0000          ?        ?   295.6355  14.6860          ?        ?      171.9        4.3       ?       ? 
1 1 1   36   17   34 o    182.8    4.2    0.0000   0.0000          ?        ?   334.5853  15.3245          ?        ?      182.8        4.2       ?       ? 
1 1 1   36   17   35 o    431.1    2.5    0.0000   0.0000          ?        ?  1858.7365  21.7097          ?        ?      431.1        2.5       ?       ? 
1 1 1   36   17   36 o    538.8    2.6    0.0000   0.0000          ?        ?  2903.9963  28.0950          ?        ?      538.8        2.6       ?       ? 
1 1 1   36   17   37 o    272.2    3.2    0.0000   0.0000          ?        ?   741.3236  17.2401          ?        ?      272.2        3.2       ?       ? 
1 1 1   36   17   38 o    455.9    2.6    0.0000   0.0000          ?        ?  2079.0264  23.6253          ?        ?      455.9        2.6       ?       ? 
1 1 1   36   17   39 o    321.8    2.8    0.0000   0.0000          ?        ?  1036.3207  17.8786          ?        ?      321.8        2.8       ?       ? 
1 1 1   36   17   40 o     33.0   13.8    0.0000   0.0000          ?        ?     1.9156  15.3245          ?        ?       33.0       13.8       ?       ? 
1 1 1   36   17   41 o    407.3    2.7    0.0000   0.0000          ?        ?  1659.5177  21.7097          ?        ?      407.3        2.7       ?       ? 
1 1 1   36   17   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   17   43 o    262.5    3.4    0.0000   0.0000          ?        ?   689.6033  17.8786          ?        ?      262.5        3.4       ?       ? 
1 1 1   36   17   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   17   45 o    126.1    6.8    0.0000   0.0000          ?        ?   159.6304  17.2401          ?        ?      126.1        6.8       ?       ? 
1 1 1   36   17   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   17   47 o    378.4    2.9    0.0000   0.0000          ?        ?  1432.8425  21.7097          ?        ?      378.4        2.9       ?       ? 
1 1 1   36   17   48 o    138.4    6.5    0.0000   0.0000          ?        ?   192.1950  17.8786          ?        ?      138.4        6.5       ?       ? 
1 1 1   36   17   49 o    276.4    3.5    0.0000   0.0000          ?        ?   764.9489  19.1556          ?        ?      276.4        3.5       ?       ? 
1 1 1   36   17   50 o     33.5   14.5    0.0000   0.0000          ?        ?    -1.9156  17.8786          ?        ?       33.5       14.5       ?       ? 
1 1 1   36   17   51 o    329.4    3.2    0.0000   0.0000          ?        ?  1086.1254  21.0712          ?        ?      329.4        3.2       ?       ? 
1 1 1   36   17   52 o     95.1    9.1    0.0000   0.0000          ?        ?    91.3086  17.2401          ?        ?       95.1        9.1       ?       ? 
1 1 1   36   17   53 o    143.6    6.7    0.0000   0.0000          ?        ?   207.5195  19.1556          ?        ?      143.6        6.7       ?       ? 
1 1 1   36   17   54 o     27.0   12.8    0.0000   0.0000          ?        ?   -21.7097  18.5171          ?        ?       27.0       12.8       ?       ? 
1 1 1   36   17   55 f    146.5    6.3    0.0000   0.0000          ?        ?   215.8203  18.5171          ?        ?      146.5        6.3       ?       ? 
1 1 1   36   17   56 o    169.1    5.5    0.0000   0.0000          ?        ?   287.3347  18.5171          ?        ?      169.1        5.5       ?       ? 
1 1 1   36   17   57 o    145.9    6.3    0.0000   0.0000          ?        ?   214.5433  18.5171          ?        ?      145.9        6.3       ?       ? 
1 1 1   36   17   58 o     42.1   15.8    0.0000   0.0000          ?        ?    14.6860  17.8786          ?        ?       42.1       15.8       ?       ? 
1 1 1   36   18    0 o    171.2    4.7  293.7199  15.9630   293.7199  15.9630   293.7199  15.9630      171.2      4.7      171.2        4.7     0.0     0.0 
1 1 1   36   18    1 o     82.2    6.6    0.0000   0.0000          ?        ?    67.6833  10.8549          ?        ?       82.2        6.6       ?       ? 
1 1 1   36   18    2 o     27.8   11.6    0.0000   0.0000          ?        ?     1.2770  10.8549          ?        ?       27.8       11.6       ?       ? 
1 1 1   36   18    3 o    221.6    3.2    0.0000   0.0000          ?        ?   491.0231  14.0475          ?        ?      221.6        3.2       ?       ? 
1 1 1   36   18    4 o    554.9    2.9    0.0000   0.0000          ?        ?  3080.2283  31.9261          ?        ?      554.9        2.9       ?       ? 
1 1 1   36   18    5 o    528.8    2.8    0.0000   0.0000          ?        ?  2796.7246  29.3720          ?        ?      528.8        2.8       ?       ? 
1 1 1   36   18    6 o    334.8    2.7    0.0000   0.0000          ?        ?  1121.2440  17.8786          ?        ?      334.8        2.7       ?       ? 
1 1 1   36   18    7 o    365.6    2.7    0.0000   0.0000          ?        ?  1337.0642  19.7942          ?        ?      365.6        2.7       ?       ? 
1 1 1   36   18    8 f    477.5    2.5    0.0000   0.0000          ?        ?  2280.1609  23.6253          ?        ?      477.5        2.5       ?       ? 
1 1 1   36   18    9 o    320.1    2.4    0.0000   0.0000          ?        ?  1024.8273  15.3245          ?        ?      320.1        2.4       ?       ? 
1 1 1   36   18   10 o    677.2    3.0    0.0000   0.0000          ?        ?  4586.5010  40.2269          ?        ?      677.2        3.0       ?       ? 
1 1 1   36   18   11 o    308.8    2.7    0.0000   0.0000          ?        ?   953.9513  16.6016          ?        ?      308.8        2.7       ?       ? 
1 1 1   36   18   12 o    238.2    2.9    0.0000   0.0000          ?        ?   567.6458  14.0475          ?        ?      238.2        2.9       ?       ? 
1 1 1   36   18   13 o    651.8    2.7    0.0000   0.0000          ?        ?  4250.0000  35.1187          ?        ?      651.8        2.7       ?       ? 
1 1 1   36   18   14 o    741.0    3.0    0.0000   0.0000          ?        ?  5491.9243  44.6965          ?        ?      741.0        3.0       ?       ? 
1 1 1   36   18   15 o    367.4    2.3    0.0000   0.0000          ?        ?  1349.8347  17.2401          ?        ?      367.4        2.3       ?       ? 
1 1 1   36   18   16 o     49.5   10.6    0.0000   0.0000          ?        ?    25.5409  10.2163          ?        ?       49.5       10.6       ?       ? 
1 1 1   36   18   17 o    105.1    5.2    0.0000   0.0000          ?        ?   110.4642  10.8549          ?        ?      105.1        5.2       ?       ? 
1 1 1   36   18   18 o    640.9    2.9    0.0000   0.0000          ?        ?  4108.8867  37.0343          ?        ?      640.9        2.9       ?       ? 
1 1 1   36   18   19 o    289.7    2.6    0.0000   0.0000          ?        ?   839.6559  15.3245          ?        ?      289.7        2.6       ?       ? 
1 1 1   36   18   20 o     48.2   12.0    0.0000   0.0000          ?        ?    24.2638  11.4934          ?        ?       48.2       12.0       ?       ? 
1 1 1   36   18   21 o    258.5    2.7    0.0000   0.0000          ?        ?   668.5321  14.0475          ?        ?      258.5        2.7       ?       ? 
1 1 1   36   18   22 o    404.3    2.4    0.0000   0.0000          ?        ?  1635.2539  19.7942          ?        ?      404.3        2.4       ?       ? 
1 1 1   36   18   23 o    316.5    2.5    0.0000   0.0000          ?        ?  1001.8404  15.9630          ?        ?      316.5        2.5       ?       ? 
1 1 1   36   18   24 o    547.3    2.6    0.0000   0.0000          ?        ?  2995.9436  28.0950          ?        ?      547.3        2.6       ?       ? 
1 1 1   36   18   25 o    137.9    4.6    0.0000   0.0000          ?        ?   190.2794  12.7704          ?        ?      137.9        4.6       ?       ? 
1 1 1   36   18   26 o    755.0    3.0    0.0000   0.0000          ?        ?  5702.6367  44.6965          ?        ?      755.0        3.0       ?       ? 
1 1 1   36   18   27 o    178.1    3.8    0.0000   0.0000          ?        ?   317.3452  13.4090          ?        ?      178.1        3.8       ?       ? 
1 1 1   36   18   28 f    331.4    2.6    0.0000   0.0000          ?        ?  1098.8958  17.2401          ?        ?      331.4        2.6       ?       ? 
1 1 1   36   18   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   18   30 o    216.1    3.4    0.0000   0.0000          ?        ?   467.3978  14.6860          ?        ?      216.1        3.4       ?       ? 
1 1 1   36   18   31 o     20.1    9.9    0.0000   0.0000          ?        ?   -30.0105  14.0475          ?        ?       20.1        9.9       ?       ? 
1 1 1   36   18   32 o     71.7   10.2    0.0000   0.0000          ?        ?    51.7203  14.6860          ?        ?       71.7       10.2       ?       ? 
1 1 1   36   18   33 o    303.8    2.8    0.0000   0.0000          ?        ?   923.3023  17.2401          ?        ?      303.8        2.8       ?       ? 
1 1 1   36   18   34 o    178.2    4.7    0.0000   0.0000          ?        ?   317.9838  16.6016          ?        ?      178.2        4.7       ?       ? 
1 1 1   36   18   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   18   36 o    255.1    3.5    0.0000   0.0000          ?        ?   651.2921  17.8786          ?        ?      255.1        3.5       ?       ? 
1 1 1   36   18   37 o     33.7   14.0    0.0000   0.0000          ?        ?     3.1926  15.3245          ?        ?       33.7       14.0       ?       ? 
1 1 1   36   18   38 o    206.1    4.0    0.0000   0.0000          ?        ?   425.2554  16.6016          ?        ?      206.1        4.0       ?       ? 
1 1 1   36   18   39 f    171.8    4.5    0.0000   0.0000          ?        ?   295.6355  15.3245          ?        ?      171.8        4.5       ?       ? 
1 1 1   36   18   40 o    263.5    3.3    0.0000   0.0000          ?        ?   694.7115  17.2401          ?        ?      263.5        3.3       ?       ? 
1 1 1   36   18   41 o    334.8    2.9    0.0000   0.0000          ?        ?  1121.8824  19.1556          ?        ?      334.8        2.9       ?       ? 
1 1 1   36   18   42 o    142.1    5.8    0.0000   0.0000          ?        ?   202.4114  16.6016          ?        ?      142.1        5.8       ?       ? 
1 1 1   36   18   43 o    241.1    3.6    0.0000   0.0000          ?        ?   581.6932  17.2401          ?        ?      241.1        3.6       ?       ? 
1 1 1   36   18   44 o    229.7    3.9    0.0000   0.0000          ?        ?   528.0574  17.8786          ?        ?      229.7        3.9       ?       ? 
1 1 1   36   18   45 o     43.1   15.6    0.0000   0.0000          ?        ?    15.9630  17.2401          ?        ?       43.1       15.6       ?       ? 
1 1 1   36   18   46 o    174.7    5.1    0.0000   0.0000          ?        ?   305.8519  17.8786          ?        ?      174.7        5.1       ?       ? 
1 1 1   36   18   47 o     41.8   15.5    0.0000   0.0000          ?        ?    14.0475  17.2401          ?        ?       41.8       15.5       ?       ? 
1 1 1   36   18   48 o     36.1   14.8    0.0000   0.0000          ?        ?     4.4697  17.2401          ?        ?       36.1       14.8       ?       ? 
1 1 1   36   18   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   18   50 o    195.7    4.6    0.0000   0.0000          ?        ?   383.7515  17.8786          ?        ?      195.7        4.6       ?       ? 
1 1 1   36   18   51 o     35.5   15.0    0.0000   0.0000          ?        ?     1.2770  18.5171          ?        ?       35.5       15.0       ?       ? 
1 1 1   36   18   52 o    183.1    5.2    0.0000   0.0000          ?        ?   336.5009  19.1556          ?        ?      183.1        5.2       ?       ? 
1 1 1   36   18   53 o     92.2    9.7    0.0000   0.0000          ?        ?    86.2004  17.8786          ?        ?       92.2        9.7       ?       ? 
1 1 1   36   18   54 o    190.9    4.8    0.0000   0.0000          ?        ?   365.8729  18.5171          ?        ?      190.9        4.8       ?       ? 
1 1 1   36   18   55 o    190.7    4.9    0.0000   0.0000          ?        ?   365.2344  18.5171          ?        ?      190.7        4.9       ?       ? 
1 1 1   36   18   56 f    120.8    7.9    0.0000   0.0000          ?        ?   147.4985  19.1556          ?        ?      120.8        7.9       ?       ? 
1 1 1   36   18   57 o    100.5    9.5    0.0000   0.0000          ?        ?   102.8020  19.1556          ?        ?      100.5        9.5       ?       ? 
1 1 1   36   19    0 o    246.0    4.0  605.9570  19.7942   605.9570  19.7942   605.9570  19.7942      246.0      4.0      246.0        4.0     0.0     0.0 
1 1 1   36   19    1 o    215.7    3.0    0.0000   0.0000          ?        ?   465.4823  12.7704          ?        ?      215.7        3.0       ?       ? 
1 1 1   36   19    2 o    275.9    2.7    0.0000   0.0000          ?        ?   761.1177  14.6860          ?        ?      275.9        2.7       ?       ? 
1 1 1   36   19    3 o    329.7    2.6    0.0000   0.0000          ?        ?  1087.4023  17.2401          ?        ?      329.7        2.6       ?       ? 
1 1 1   36   19    4 o     19.1    9.3    0.0000   0.0000          ?        ?   -21.0712  11.4934          ?        ?       19.1        9.3       ?       ? 
1 1 1   36   19    5 o    239.6    2.9    0.0000   0.0000          ?        ?   574.0309  14.0475          ?        ?      239.6        2.9       ?       ? 
1 1 1   36   19    6 o    693.9    3.3    0.0000   0.0000          ?        ?  4816.3687  45.3350          ?        ?      693.9        3.3       ?       ? 
1 1 1   36   19    7 o    723.1    3.4    0.0000   0.0000          ?        ?  5230.7690  48.5276          ?        ?      723.1        3.4       ?       ? 
1 1 1   36   19    8 o    546.1    2.9    0.0000   0.0000          ?        ?  2982.5347  31.2876          ?        ?      546.1        2.9       ?       ? 
1 1 1   36   19    9 o     17.7    8.7    0.0000   0.0000          ?        ?   -26.8179  11.4934          ?        ?       17.7        8.7       ?       ? 
1 1 1   36   19   10 o     16.1    8.0    0.0000   0.0000          ?        ?   -26.1794  10.2163          ?        ?       16.1        8.0       ?       ? 
1 1 1   36   19   11 o    162.7    3.7    0.0000   0.0000          ?        ?   264.9865  12.1319          ?        ?      162.7        3.7       ?       ? 
1 1 1   36   19   12 o    626.5    2.9    0.0000   0.0000          ?        ?  3926.2695  36.3957          ?        ?      626.5        2.9       ?       ? 
1 1 1   36   19   13 o    226.5    3.0    0.0000   0.0000          ?        ?   513.3714  13.4090          ?        ?      226.5        3.0       ?       ? 
1 1 1   36   19   14 o    502.9    2.3    0.0000   0.0000          ?        ?  2529.1841  23.6253          ?        ?      502.9        2.3       ?       ? 
1 1 1   36   19   15 o    548.2    2.5    0.0000   0.0000          ?        ?  3006.1597  27.4564          ?        ?      548.2        2.5       ?       ? 
1 1 1   36   19   16 o     20.2    9.5    0.0000   0.0000          ?        ?   -12.1319  10.2163          ?        ?       20.2        9.5       ?       ? 
1 1 1   36   19   17 o    263.3    2.7    0.0000   0.0000          ?        ?   693.4344  14.0475          ?        ?      263.3        2.7       ?       ? 
1 1 1   36   19   18 o     31.9   11.9    0.0000   0.0000          ?        ?     7.6623  10.2163          ?        ?       31.9       11.9       ?       ? 
1 1 1   36   19   19 o     64.8    8.4    0.0000   0.0000          ?        ?    42.1424  10.8549          ?        ?       64.8        8.4       ?       ? 
1 1 1   36   19   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   19   21 o    178.3    3.6    0.0000   0.0000          ?        ?   317.9838  12.7704          ?        ?      178.3        3.6       ?       ? 
1 1 1   36   19   22 o    282.3    2.6    0.0000   0.0000          ?        ?   796.8750  14.6860          ?        ?      282.3        2.6       ?       ? 
1 1 1   36   19   23 o     81.8    7.8    0.0000   0.0000          ?        ?    67.0448  12.7704          ?        ?       81.8        7.8       ?       ? 
1 1 1   36   19   24 o    123.7    5.2    0.0000   0.0000          ?        ?   153.2452  12.7704          ?        ?      123.7        5.2       ?       ? 
1 1 1   36   19   25 o    268.7    2.9    0.0000   0.0000          ?        ?   722.1680  15.3245          ?        ?      268.7        2.9       ?       ? 
1 1 1   36   19   26 o     67.7    9.4    0.0000   0.0000          ?        ?    45.9736  12.7704          ?        ?       67.7        9.4       ?       ? 
1 1 1   36   19   27 o    187.9    3.4    0.0000   0.0000          ?        ?   353.1024  12.7704          ?        ?      187.9        3.4       ?       ? 
1 1 1   36   19   28 o    237.9    3.0    0.0000   0.0000          ?        ?   566.3687  14.0475          ?        ?      237.9        3.0       ?       ? 
1 1 1   36   19   29 o    228.8    3.1    0.0000   0.0000          ?        ?   523.5877  14.0475          ?        ?      228.8        3.1       ?       ? 
1 1 1   36   19   30 o    317.6    2.8    0.0000   0.0000          ?        ?  1008.8642  17.8786          ?        ?      317.6        2.8       ?       ? 
1 1 1   36   19   31 o     60.2   11.6    0.0000   0.0000          ?        ?    37.6728  13.4090          ?        ?       60.2       11.6       ?       ? 
1 1 1   36   19   32 o    292.7    2.9    0.0000   0.0000          ?        ?   856.8960  17.2401          ?        ?      292.7        2.9       ?       ? 
1 1 1   36   19   33 o    248.8    3.1    0.0000   0.0000          ?        ?   619.3660  15.3245          ?        ?      248.8        3.1       ?       ? 
1 1 1   36   19   34 o    406.5    2.6    0.0000   0.0000          ?        ?  1653.1324  21.0712          ?        ?      406.5        2.6       ?       ? 
1 1 1   36   19   35 o     74.7    9.8    0.0000   0.0000          ?        ?    56.1899  14.6860          ?        ?       74.7        9.8       ?       ? 
1 1 1   36   19   36 o    332.8    2.9    0.0000   0.0000          ?        ?  1107.8350  19.1556          ?        ?      332.8        2.9       ?       ? 
1 1 1   36   19   37 f    481.8    2.7    0.0000   0.0000          ?        ?  2322.3032  25.5409          ?        ?      481.8        2.7       ?       ? 
1 1 1   36   19   38 o     25.6   12.1    0.0000   0.0000          ?        ?   -19.7942  16.6016          ?        ?       25.6       12.1       ?       ? 
1 1 1   36   19   39 o    136.6    5.8    0.0000   0.0000          ?        ?   187.0868  15.9630          ?        ?      136.6        5.8       ?       ? 
1 1 1   36   19   40 o    118.6    6.7    0.0000   0.0000          ?        ?   141.1133  15.9630          ?        ?      118.6        6.7       ?       ? 
1 1 1   36   19   41 o     28.8   13.0    0.0000   0.0000          ?        ?    -8.3008  15.9630          ?        ?       28.8       13.0       ?       ? 
1 1 1   36   19   42 o    292.7    3.2    0.0000   0.0000          ?        ?   857.5345  18.5171          ?        ?      292.7        3.2       ?       ? 
1 1 1   36   19   43 o    111.3    7.5    0.0000   0.0000          ?        ?   124.5117  16.6016          ?        ?      111.3        7.5       ?       ? 
1 1 1   36   19   44 o    190.9    4.5    0.0000   0.0000          ?        ?   365.2344  17.2401          ?        ?      190.9        4.5       ?       ? 
1 1 1   36   19   45 o    396.3    2.9    0.0000   0.0000          ?        ?  1572.0403  22.9868          ?        ?      396.3        2.9       ?       ? 
1 1 1   36   19   46 o    285.4    3.4    0.0000   0.0000          ?        ?   815.3921  19.1556          ?        ?      285.4        3.4       ?       ? 
1 1 1   36   19   47 o    109.8    7.9    0.0000   0.0000          ?        ?   121.3191  17.2401          ?        ?      109.8        7.9       ?       ? 
1 1 1   36   19   48 o     40.6   15.8    0.0000   0.0000          ?        ?    10.8549  18.5171          ?        ?       40.6       15.8       ?       ? 
1 1 1   36   19   49 o    169.4    5.5    0.0000   0.0000          ?        ?   287.9732  18.5171          ?        ?      169.4        5.5       ?       ? 
1 1 1   36   19   50 o    280.6    3.5    0.0000   0.0000          ?        ?   788.5742  19.7942          ?        ?      280.6        3.5       ?       ? 
1 1 1   36   19   51 o    148.5    6.0    0.0000   0.0000          ?        ?   221.5670  17.8786          ?        ?      148.5        6.0       ?       ? 
1 1 1   36   19   52 o    108.7    8.5    0.0000   0.0000          ?        ?   119.4035  18.5171          ?        ?      108.7        8.5       ?       ? 
1 1 1   36   19   53 o     59.2   15.5    0.0000   0.0000          ?        ?    37.6728  18.5171          ?        ?       59.2       15.5       ?       ? 
1 1 1   36   19   54 o     33.4   14.7    0.0000   0.0000          ?        ?    -4.4697  19.1556          ?        ?       33.4       14.7       ?       ? 
1 1 1   36   19   55 o    128.9    7.4    0.0000   0.0000          ?        ?   167.9312  19.1556          ?        ?      128.9        7.4       ?       ? 
1 1 1   36   19   56 o    129.0    6.9    0.0000   0.0000          ?        ?   167.9312  17.8786          ?        ?      129.0        6.9       ?       ? 
1 1 1   36   20    0 o    350.4    3.9 1228.5156  27.4564  1228.5156  27.4564  1228.5156  27.4564      350.4      3.9      350.4        3.9     0.0     0.0 
1 1 1   36   20    1 o    254.4    2.8    0.0000   0.0000          ?        ?   647.4609  14.0475          ?        ?      254.4        2.8       ?       ? 
1 1 1   36   20    2 o    329.3    2.6    0.0000   0.0000          ?        ?  1084.8481  17.2401          ?        ?      329.3        2.6       ?       ? 
1 1 1   36   20    3 o    131.5    4.4    0.0000   0.0000          ?        ?   173.0394  11.4934          ?        ?      131.5        4.4       ?       ? 
1 1 1   36   20    4 o    534.5    2.8    0.0000   0.0000          ?        ?  2857.3843  30.0105          ?        ?      534.5        2.8       ?       ? 
1 1 1   36   20    5 o    524.9    2.8    0.0000   0.0000          ?        ?  2755.8594  29.3720          ?        ?      524.9        2.8       ?       ? 
1 1 1   36   20    6 o    534.9    2.9    0.0000   0.0000          ?        ?  2861.8540  31.2876          ?        ?      534.9        2.9       ?       ? 
1 1 1   36   20    7 o    240.5    3.5    0.0000   0.0000          ?        ?   578.5006  16.6016          ?        ?      240.5        3.5       ?       ? 
1 1 1   36   20    8 o    207.3    3.7    0.0000   0.0000          ?        ?   429.7251  15.3245          ?        ?      207.3        3.7       ?       ? 
1 1 1   36   20    9 o    163.5    3.5    0.0000   0.0000          ?        ?   267.5406  11.4934          ?        ?      163.5        3.5       ?       ? 
1 1 1   36   20   10 o    389.3    2.4    0.0000   0.0000          ?        ?  1515.8503  18.5171          ?        ?      389.3        2.4       ?       ? 
1 1 1   36   20   11 o    247.8    2.4    0.0000   0.0000          ?        ?   614.2578  12.1319          ?        ?      247.8        2.4       ?       ? 
1 1 1   36   20   12 f    361.6    2.4    0.0000   0.0000          ?        ?  1307.6923  17.2401          ?        ?      361.6        2.4       ?       ? 
1 1 1   36   20   13 o    472.3    2.6    0.0000   0.0000          ?        ?  2231.6331  24.2638          ?        ?      472.3        2.6       ?       ? 
1 1 1   36   20   14 o     17.0    8.5    0.0000   0.0000          ?        ?   -30.0105  11.4934          ?        ?       17.0        8.5       ?       ? 
1 1 1   36   20   15 o     54.1    7.7    0.0000   0.0000          ?        ?    29.3720   8.3008          ?        ?       54.1        7.7       ?       ? 
1 1 1   36   20   16 o    664.2    2.8    0.0000   0.0000          ?        ?  4412.8228  37.6728          ?        ?      664.2        2.8       ?       ? 
1 1 1   36   20   17 o    545.7    2.6    0.0000   0.0000          ?        ?  2978.7034  28.7335          ?        ?      545.7        2.6       ?       ? 
1 1 1   36   20   18 o    309.4    2.5    0.0000   0.0000          ?        ?   957.7824  15.3245          ?        ?      309.4        2.5       ?       ? 
1 1 1   36   20   19 o     60.2    9.0    0.0000   0.0000          ?        ?    36.3957  10.8549          ?        ?       60.2        9.0       ?       ? 
1 1 1   36   20   20 o     74.0    7.3    0.0000   0.0000          ?        ?    54.9129  10.8549          ?        ?       74.0        7.3       ?       ? 
1 1 1   36   20   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   20   22 o    206.8    3.1    0.0000   0.0000          ?        ?   427.8095  12.7704          ?        ?      206.8        3.1       ?       ? 
1 1 1   36   20   23 o    144.0    4.2    0.0000   0.0000          ?        ?   207.5195  12.1319          ?        ?      144.0        4.2       ?       ? 
1 1 1   36   20   24 o    413.0    2.4    0.0000   0.0000          ?        ?  1706.1299  19.7942          ?        ?      413.0        2.4       ?       ? 
1 1 1   36   20   25 f    134.4    4.8    0.0000   0.0000          ?        ?   180.7016  12.7704          ?        ?      134.4        4.8       ?       ? 
1 1 1   36   20   26 o    244.0    3.1    0.0000   0.0000          ?        ?   595.7407  15.3245          ?        ?      244.0        3.1       ?       ? 
1 1 1   36   20   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   20   28 f    237.7    3.2    0.0000   0.0000          ?        ?   565.0916  15.3245          ?        ?      237.7        3.2       ?       ? 
1 1 1   36   20   29 o    180.7    4.2    0.0000   0.0000          ?        ?   326.9231  15.3245          ?        ?      180.7        4.2       ?       ? 
1 1 1   36   20   30 o     22.9   11.0    0.0000   0.0000          ?        ?   -21.7097  14.6860          ?        ?       22.9       11.0       ?       ? 
1 1 1   36   20   31 o    174.1    4.0    0.0000   0.0000          ?        ?   303.2978  14.0475          ?        ?      174.1        4.0       ?       ? 
1 1 1   36   20   32 o    203.0    3.9    0.0000   0.0000          ?        ?   412.4850  15.9630          ?        ?      203.0        3.9       ?       ? 
1 1 1   36   20   33 o    129.5    5.9    0.0000   0.0000          ?        ?   167.9312  15.3245          ?        ?      129.5        5.9       ?       ? 
1 1 1   36   20   34 o    320.9    2.9    0.0000   0.0000          ?        ?  1030.5739  18.5171          ?        ?      320.9        2.9       ?       ? 
1 1 1   36   20   35 o    761.0    3.2    0.0000   0.0000          ?        ?  5794.5840  48.5276          ?        ?      761.0        3.2       ?       ? 
1 1 1   36   20   36 o    473.9    2.8    0.0000   0.0000          ?        ?  2246.9575  26.8179          ?        ?      473.9        2.8       ?       ? 
1 1 1   36   20   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   20   38 o    113.6    7.3    0.0000   0.0000          ?        ?   129.6199  16.6016          ?        ?      113.6        7.3       ?       ? 
1 1 1   36   20   39 f    535.1    2.7    0.0000   0.0000          ?        ?  2865.0466  28.7335          ?        ?      535.1        2.7       ?       ? 
1 1 1   36   20   40 o    301.0    3.1    0.0000   0.0000          ?        ?   906.7007  18.5171          ?        ?      301.0        3.1       ?       ? 
1 1 1   36   20   41 o    116.9    7.1    0.0000   0.0000          ?        ?   137.2822  16.6016          ?        ?      116.9        7.1       ?       ? 
1 1 1   36   20   42 o    211.9    4.2    0.0000   0.0000          ?        ?   449.5192  17.8786          ?        ?      211.9        4.2       ?       ? 
1 1 1   36   20   43 o    407.7    2.8    0.0000   0.0000          ?        ?  1663.3489  22.9868          ?        ?      407.7        2.8       ?       ? 
1 1 1   36   20   44 o    199.9    4.5    0.0000   0.0000          ?        ?   400.3531  17.8786          ?        ?      199.9        4.5       ?       ? 
1 1 1   36   20   45 o     43.9   15.8    0.0000   0.0000          ?        ?    16.6016  17.8786          ?        ?       43.9       15.8       ?       ? 
1 1 1   36   20   46 o    469.8    2.9    0.0000   0.0000          ?        ?  2208.6462  26.8179          ?        ?      469.8        2.9       ?       ? 
1 1 1   36   20   47 o    250.1    3.8    0.0000   0.0000          ?        ?   626.3897  19.1556          ?        ?      250.1        3.8       ?       ? 
1 1 1   36   20   48 o    150.6    6.1    0.0000   0.0000          ?        ?   227.9522  18.5171          ?        ?      150.6        6.1       ?       ? 
1 1 1   36   20   49 o     29.6   13.5    0.0000   0.0000          ?        ?   -11.4934  17.8786          ?        ?       29.6       13.5       ?       ? 
1 1 1   36   20   50 o    112.8    7.9    0.0000   0.0000          ?        ?   128.3428  17.8786          ?        ?      112.8        7.9       ?       ? 
1 1 1   36   20   51 o     26.5   12.5    0.0000   0.0000          ?        ?   -18.5171  17.2401          ?        ?       26.5       12.5       ?       ? 
1 1 1   36   20   52 o    308.0    3.3    0.0000   0.0000          ?        ?   950.1202  20.4327          ?        ?      308.0        3.3       ?       ? 
1 1 1   36   20   53 o     22.2   11.0    0.0000   0.0000          ?        ?   -39.5883  17.8786          ?        ?       22.2       11.0       ?       ? 
1 1 1   36   20   54 o     23.4   11.5    0.0000   0.0000          ?        ?   -33.2031  17.8786          ?        ?       23.4       11.5       ?       ? 
1 1 1   36   20   55 o     27.1   12.7    0.0000   0.0000          ?        ?   -18.5171  17.8786          ?        ?       27.1       12.7       ?       ? 
1 1 1   36   21    0 f     13.2    9.7  -31.9261  14.6860   -31.9261  14.6860   -31.9261  14.6860       13.2      9.7       13.2        9.7     0.0     0.0 
1 1 1   36   21    1 o    237.0    2.8    0.0000   0.0000          ?        ?   561.8990  13.4090          ?        ?      237.0        2.8       ?       ? 
1 1 1   36   21    2 o    362.6    2.6    0.0000   0.0000          ?        ?  1315.3545  19.1556          ?        ?      362.6        2.6       ?       ? 
1 1 1   36   21    3 f    310.6    2.8    0.0000   0.0000          ?        ?   964.8062  17.2401          ?        ?      310.6        2.8       ?       ? 
1 1 1   36   21    4 o    246.0    3.0    0.0000   0.0000          ?        ?   605.3185  14.6860          ?        ?      246.0        3.0       ?       ? 
1 1 1   36   21    5 o    153.7    3.9    0.0000   0.0000          ?        ?   236.2530  12.1319          ?        ?      153.7        3.9       ?       ? 
1 1 1   36   21    6 o    531.5    2.9    0.0000   0.0000          ?        ?  2826.0967  30.6490          ?        ?      531.5        2.9       ?       ? 
1 1 1   36   21    7 o    198.8    3.5    0.0000   0.0000          ?        ?   395.2449  14.0475          ?        ?      198.8        3.5       ?       ? 
1 1 1   36   21    8 o    349.2    2.7    0.0000   0.0000          ?        ?  1219.5763  19.1556          ?        ?      349.2        2.7       ?       ? 
1 1 1   36   21    9 o     95.5    6.0    0.0000   0.0000          ?        ?    91.3086  11.4934          ?        ?       95.5        6.0       ?       ? 
1 1 1   36   21   10 o    332.5    2.4    0.0000   0.0000          ?        ?  1105.9194  15.9630          ?        ?      332.5        2.4       ?       ? 
1 1 1   36   21   11 o    319.7    2.5    0.0000   0.0000          ?        ?  1022.2732  15.9630          ?        ?      319.7        2.5       ?       ? 
1 1 1   36   21   12 o     18.4    8.9    0.0000   0.0000          ?        ?   -17.2401  10.2163          ?        ?       18.4        8.9       ?       ? 
1 1 1   36   21   13 o    197.3    3.1    0.0000   0.0000          ?        ?   389.4982  12.1319          ?        ?      197.3        3.1       ?       ? 
1 1 1   36   21   14 o     87.8    6.5    0.0000   0.0000          ?        ?    77.2611  11.4934          ?        ?       87.8        6.5       ?       ? 
1 1 1   36   21   15 o    124.5    4.6    0.0000   0.0000          ?        ?   155.1608  11.4934          ?        ?      124.5        4.6       ?       ? 
1 1 1   36   21   16 o    393.9    2.4    0.0000   0.0000          ?        ?  1552.2461  18.5171          ?        ?      393.9        2.4       ?       ? 
1 1 1   36   21   17 f    127.1    4.3    0.0000   0.0000          ?        ?   161.5460  10.8549          ?        ?      127.1        4.3       ?       ? 
1 1 1   36   21   18 o    757.9    3.2    0.0000   0.0000          ?        ?  5746.0562  48.5276          ?        ?      757.9        3.2       ?       ? 
1 1 1   36   21   19 o    134.9    4.0    0.0000   0.0000          ?        ?   181.9787  10.8549          ?        ?      134.9        4.0       ?       ? 
1 1 1   36   21   20 o    121.9    4.7    0.0000   0.0000          ?        ?   148.7755  11.4934          ?        ?      121.9        4.7       ?       ? 
1 1 1   36   21   21 o    405.8    2.4    0.0000   0.0000          ?        ?  1647.3857  19.1556          ?        ?      405.8        2.4       ?       ? 
1 1 1   36   21   22 o    401.3    2.4    0.0000   0.0000          ?        ?  1610.9901  19.1556          ?        ?      401.3        2.4       ?       ? 
1 1 1   36   21   23 o    431.3    2.4    0.0000   0.0000          ?        ?  1860.6520  21.0712          ?        ?      431.3        2.4       ?       ? 
1 1 1   36   21   24 o    165.3    3.7    0.0000   0.0000          ?        ?   273.2873  12.1319          ?        ?      165.3        3.7       ?       ? 
1 1 1   36   21   25 o    473.2    2.4    0.0000   0.0000          ?        ?  2239.9338  22.9868          ?        ?      473.2        2.4       ?       ? 
1 1 1   36   21   26 o    201.9    3.3    0.0000   0.0000          ?        ?   408.0153  13.4090          ?        ?      201.9        3.3       ?       ? 
1 1 1   36   21   27 o    127.3    5.0    0.0000   0.0000          ?        ?   162.1845  12.7704          ?        ?      127.3        5.0       ?       ? 
1 1 1   36   21   28 o     16.4    8.3    0.0000   0.0000          ?        ?   -46.6121  13.4090          ?        ?       16.4        8.3       ?       ? 
1 1 1   36   21   29 o    341.0    2.9    0.0000   0.0000          ?        ?  1163.3864  19.7942          ?        ?      341.0        2.9       ?       ? 
1 1 1   36   21   30 o     19.3    9.6    0.0000   0.0000          ?        ?   -37.6728  14.6860          ?        ?       19.3        9.6       ?       ? 
1 1 1   36   21   31 f     33.8   13.8    0.0000   0.0000          ?        ?     4.4697  14.6860          ?        ?       33.8       13.8       ?       ? 
1 1 1   36   21   32 o    131.2    6.1    0.0000   0.0000          ?        ?   172.4008  15.9630          ?        ?      131.2        6.1       ?       ? 
1 1 1   36   21   33 o    385.5    2.8    0.0000   0.0000          ?        ?  1487.1168  21.7097          ?        ?      385.5        2.8       ?       ? 
1 1 1   36   21   34 o    306.7    3.0    0.0000   0.0000          ?        ?   941.1808  18.5171          ?        ?      306.7        3.0       ?       ? 
1 1 1   36   21   35 o    209.6    4.0    0.0000   0.0000          ?        ?   439.9414  16.6016          ?        ?      209.6        4.0       ?       ? 
1 1 1   36   21   36 o    277.8    3.0    0.0000   0.0000          ?        ?   771.9727  16.6016          ?        ?      277.8        3.0       ?       ? 
1 1 1   36   21   37 o    227.4    3.9    0.0000   0.0000          ?        ?   517.8410  17.8786          ?        ?      227.4        3.9       ?       ? 
1 1 1   36   21   38 o    411.9    2.7    0.0000   0.0000          ?        ?  1697.8290  22.3483          ?        ?      411.9        2.7       ?       ? 
1 1 1   36   21   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   21   40 o    115.8    6.9    0.0000   0.0000          ?        ?   134.7281  15.9630          ?        ?      115.8        6.9       ?       ? 
1 1 1   36   21   41 o    169.1    4.9    0.0000   0.0000          ?        ?   286.6962  16.6016          ?        ?      169.1        4.9       ?       ? 
1 1 1   36   21   42 o    147.8    5.8    0.0000   0.0000          ?        ?   219.0129  17.2401          ?        ?      147.8        5.8       ?       ? 
1 1 1   36   21   43 o     29.7   13.4    0.0000   0.0000          ?        ?    -7.6623  16.6016          ?        ?       29.7       13.4       ?       ? 
1 1 1   36   21   44 o    141.1    6.1    0.0000   0.0000          ?        ?   199.8573  17.2401          ?        ?      141.1        6.1       ?       ? 
1 1 1   36   21   45 o    318.5    3.2    0.0000   0.0000          ?        ?  1015.2494  20.4327          ?        ?      318.5        3.2       ?       ? 
1 1 1   36   21   46 o    222.9    4.4    0.0000   0.0000          ?        ?   498.0469  19.7942          ?        ?      222.9        4.4       ?       ? 
1 1 1   36   21   47 o    312.3    3.3    0.0000   0.0000          ?        ?   976.2995  20.4327          ?        ?      312.3        3.3       ?       ? 
1 1 1   36   21   48 f    156.5    5.7    0.0000   0.0000          ?        ?   245.8308  17.8786          ?        ?      156.5        5.7       ?       ? 
1 1 1   36   21   49 o    247.3    3.9    0.0000   0.0000          ?        ?   612.9808  19.1556          ?        ?      247.3        3.9       ?       ? 
1 1 1   36   21   50 o     25.8   12.3    0.0000   0.0000          ?        ?   -23.6253  17.8786          ?        ?       25.8       12.3       ?       ? 
1 1 1   36   21   51 o     29.5   13.4    0.0000   0.0000          ?        ?    -9.5778  17.2401          ?        ?       29.5       13.4       ?       ? 
1 1 1   36   21   52 o    161.4    5.5    0.0000   0.0000          ?        ?   261.7939  17.8786          ?        ?      161.4        5.5       ?       ? 
1 1 1   36   21   53 o     39.7   15.3    0.0000   0.0000          ?        ?    11.4934  17.2401          ?        ?       39.7       15.3       ?       ? 
1 1 1   36   21   54 o     76.1   11.3    0.0000   0.0000          ?        ?    59.3825  17.2401          ?        ?       76.1       11.3       ?       ? 
1 1 1   36   22    0 f    415.9    3.9 1730.3936  32.5646  1730.3936  32.5646  1730.3936  32.5646      415.9      3.9      415.9        3.9     0.0     0.0 
1 1 1   36   22    1 o    576.6    3.0    0.0000   0.0000          ?        ?  3326.0593  35.1187          ?        ?      576.6        3.0       ?       ? 
1 1 1   36   22    2 o    111.8    4.6    0.0000   0.0000          ?        ?   125.1502  10.2163          ?        ?      111.8        4.6       ?       ? 
1 1 1   36   22    3 o    284.4    2.6    0.0000   0.0000          ?        ?   809.0069  14.6860          ?        ?      284.4        2.6       ?       ? 
1 1 1   36   22    4 o    211.7    3.2    0.0000   0.0000          ?        ?   448.2422  13.4090          ?        ?      211.7        3.2       ?       ? 
1 1 1   36   22    5 o    429.0    2.7    0.0000   0.0000          ?        ?  1840.8578  22.9868          ?        ?      429.0        2.7       ?       ? 
1 1 1   36   22    6 o    371.1    2.8    0.0000   0.0000          ?        ?  1377.2911  20.4327          ?        ?      371.1        2.8       ?       ? 
1 1 1   36   22    7 f     91.7    5.9    0.0000   0.0000          ?        ?    84.2849  10.8549          ?        ?       91.7        5.9       ?       ? 
1 1 1   36   22    8 o    397.6    2.8    0.0000   0.0000          ?        ?  1581.6180  22.3483          ?        ?      397.6        2.8       ?       ? 
1 1 1   36   22    9 o    505.9    3.0    0.0000   0.0000          ?        ?  2560.4717  30.6490          ?        ?      505.9        3.0       ?       ? 
1 1 1   36   22   10 o    300.2    2.7    0.0000   0.0000          ?        ?   901.5925  15.9630          ?        ?      300.2        2.7       ?       ? 
1 1 1   36   22   11 o    509.9    3.1    0.0000   0.0000          ?        ?  2601.3372  31.2876          ?        ?      509.9        3.1       ?       ? 
1 1 1   36   22   12 o    377.1    2.6    0.0000   0.0000          ?        ?  1422.6262  19.7942          ?        ?      377.1        2.6       ?       ? 
1 1 1   36   22   13 o    184.6    3.3    0.0000   0.0000          ?        ?   340.9706  12.1319          ?        ?      184.6        3.3       ?       ? 
1 1 1   36   22   14 o    239.2    2.8    0.0000   0.0000          ?        ?   572.1154  13.4090          ?        ?      239.2        2.8       ?       ? 
1 1 1   36   22   15 f    396.3    2.6    0.0000   0.0000          ?        ?  1570.7632  20.4327          ?        ?      396.3        2.6       ?       ? 
1 1 1   36   22   16 o     71.4    5.4    0.0000   0.0000          ?        ?    51.0817   7.6623          ?        ?       71.4        5.4       ?       ? 
1 1 1   36   22   17 o    311.3    2.4    0.0000   0.0000          ?        ?   969.2759  14.6860          ?        ?      311.3        2.4       ?       ? 
1 1 1   36   22   18 o    390.4    2.5    0.0000   0.0000          ?        ?  1524.1511  19.1556          ?        ?      390.4        2.5       ?       ? 
1 1 1   36   22   19 o    113.2    5.1    0.0000   0.0000          ?        ?   128.3428  11.4934          ?        ?      113.2        5.1       ?       ? 
1 1 1   36   22   20 o    185.8    3.1    0.0000   0.0000          ?        ?   345.4402  11.4934          ?        ?      185.8        3.1       ?       ? 
1 1 1   36   22   21 o    338.7    2.4    0.0000   0.0000          ?        ?  1147.4233  15.9630          ?        ?      338.7        2.4       ?       ? 
1 1 1   36   22   22 o    336.8    2.5    0.0000   0.0000          ?        ?  1134.6530  16.6016          ?        ?      336.8        2.5       ?       ? 
1 1 1   36   22   23 o    286.8    2.7    0.0000   0.0000          ?        ?   823.0543  15.3245          ?        ?      286.8        2.7       ?       ? 
1 1 1   36   22   24 o     22.8   10.7    0.0000   0.0000          ?        ?   -12.1319  12.1319          ?        ?       22.8       10.7       ?       ? 
1 1 1   36   22   25 f    371.7    2.4    0.0000   0.0000          ?        ?  1382.3993  17.8786          ?        ?      371.7        2.4       ?       ? 
1 1 1   36   22   26 o     65.2    9.8    0.0000   0.0000          ?        ?    42.7809  12.7704          ?        ?       65.2        9.8       ?       ? 
1 1 1   36   22   27 o    266.2    2.9    0.0000   0.0000          ?        ?   708.7590  15.3245          ?        ?      266.2        2.9       ?       ? 
1 1 1   36   22   28 o     95.4    6.7    0.0000   0.0000          ?        ?    91.3086  12.7704          ?        ?       95.4        6.7       ?       ? 
1 1 1   36   22   29 o    218.6    3.4    0.0000   0.0000          ?        ?   478.2527  14.6860          ?        ?      218.6        3.4       ?       ? 
1 1 1   36   22   30 o    193.7    3.8    0.0000   0.0000          ?        ?   375.4507  14.6860          ?        ?      193.7        3.8       ?       ? 
1 1 1   36   22   31 o    614.5    2.8    0.0000   0.0000          ?        ?  3777.4939  33.8416          ?        ?      614.5        2.8       ?       ? 
1 1 1   36   22   32 o     62.1   12.3    0.0000   0.0000          ?        ?    40.2269  14.6860          ?        ?       62.1       12.3       ?       ? 
1 1 1   36   22   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   22   34 o     39.8   14.6    0.0000   0.0000          ?        ?    12.7704  15.3245          ?        ?       39.8       14.6       ?       ? 
1 1 1   36   22   35 o    131.4    5.8    0.0000   0.0000          ?        ?   173.0394  15.3245          ?        ?      131.4        5.8       ?       ? 
1 1 1   36   22   36 o     27.2   12.5    0.0000   0.0000          ?        ?   -12.7704  15.9630          ?        ?       27.2       12.5       ?       ? 
1 1 1   36   22   37 o    321.4    3.1    0.0000   0.0000          ?        ?  1033.7665  19.7942          ?        ?      321.4        3.1       ?       ? 
1 1 1   36   22   38 o    315.2    3.1    0.0000   0.0000          ?        ?   994.1782  19.7942          ?        ?      315.2        3.1       ?       ? 
1 1 1   36   22   39 o    236.3    4.1    0.0000   0.0000          ?        ?   559.3449  19.1556          ?        ?      236.3        4.1       ?       ? 
1 1 1   36   22   40 o    181.5    4.7    0.0000   0.0000          ?        ?   330.1157  17.2401          ?        ?      181.5        4.7       ?       ? 
1 1 1   36   22   41 o    199.1    4.2    0.0000   0.0000          ?        ?   397.1605  16.6016          ?        ?      199.1        4.2       ?       ? 
1 1 1   36   22   42 o    129.1    6.4    0.0000   0.0000          ?        ?   167.2927  16.6016          ?        ?      129.1        6.4       ?       ? 
1 1 1   36   22   43 o    229.6    3.9    0.0000   0.0000          ?        ?   528.0574  17.8786          ?        ?      229.6        3.9       ?       ? 
1 1 1   36   22   44 o    224.5    4.0    0.0000   0.0000          ?        ?   505.0706  17.8786          ?        ?      224.5        4.0       ?       ? 
1 1 1   36   22   45 o    103.7    8.6    0.0000   0.0000          ?        ?   108.5487  17.8786          ?        ?      103.7        8.6       ?       ? 
1 1 1   36   22   46 o    294.6    3.4    0.0000   0.0000          ?        ?   869.0280  19.7942          ?        ?      294.6        3.4       ?       ? 
1 1 1   36   22   47 o    151.9    5.9    0.0000   0.0000          ?        ?   231.7833  17.8786          ?        ?      151.9        5.9       ?       ? 
1 1 1   36   22   48 o     74.3   11.6    0.0000   0.0000          ?        ?    56.1899  17.2401          ?        ?       74.3       11.6       ?       ? 
1 1 1   36   22   49 o    148.2    6.0    0.0000   0.0000          ?        ?   220.9285  17.8786          ?        ?      148.2        6.0       ?       ? 
1 1 1   36   22   50 o     78.6   11.8    0.0000   0.0000          ?        ?    63.2136  18.5171          ?        ?       78.6       11.8       ?       ? 
1 1 1   36   22   51 o    214.1    4.3    0.0000   0.0000          ?        ?   459.7356  18.5171          ?        ?      214.1        4.3       ?       ? 
1 1 1   36   22   52 o    116.8    7.4    0.0000   0.0000          ?        ?   137.9207  17.2401          ?        ?      116.8        7.4       ?       ? 
1 1 1   36   22   53 o    161.3    5.5    0.0000   0.0000          ?        ?   261.7939  17.8786          ?        ?      161.3        5.5       ?       ? 
1 1 1   36   23    0 o     27.2   15.7    9.5778  13.4090     9.5778  13.4090     9.5778  13.4090       27.2     15.7       27.2       15.7     0.0     0.0 
1 1 1   36   23    1 o    540.5    3.0    0.0000   0.0000          ?        ?  2921.8750  31.9261          ?        ?      540.5        3.0       ?       ? 
1 1 1   36   23    2 o    569.2    3.0    0.0000   0.0000          ?        ?  3241.1357  34.4802          ?        ?      569.2        3.0       ?       ? 
1 1 1   36   23    3 o    401.8    3.3    0.0000   0.0000          ?        ?  1614.8212  26.1794          ?        ?      401.8        3.3       ?       ? 
1 1 1   36   23    4 o    696.0    3.5    0.0000   0.0000          ?        ?  4847.0176  49.1662          ?        ?      696.0        3.5       ?       ? 
1 1 1   36   23    5 o    491.8    2.9    0.0000   0.0000          ?        ?  2419.3584  28.0950          ?        ?      491.8        2.9       ?       ? 
1 1 1   36   23    6 o    326.7    2.6    0.0000   0.0000          ?        ?  1067.6082  17.2401          ?        ?      326.7        2.6       ?       ? 
1 1 1   36   23    7 o    210.9    3.2    0.0000   0.0000          ?        ?   445.0496  13.4090          ?        ?      210.9        3.2       ?       ? 
1 1 1   36   23    8 o    225.0    3.0    0.0000   0.0000          ?        ?   506.3477  13.4090          ?        ?      225.0        3.0       ?       ? 
1 1 1   36   23    9 o    397.2    2.7    0.0000   0.0000          ?        ?  1578.4254  21.0712          ?        ?      397.2        2.7       ?       ? 
1 1 1   36   23   10 o    207.7    3.5    0.0000   0.0000          ?        ?   431.6406  14.6860          ?        ?      207.7        3.5       ?       ? 
1 1 1   36   23   11 o    343.2    2.6    0.0000   0.0000          ?        ?  1178.0724  17.8786          ?        ?      343.2        2.6       ?       ? 
1 1 1   36   23   12 o     84.9    6.0    0.0000   0.0000          ?        ?    72.1529  10.2163          ?        ?       84.9        6.0       ?       ? 
1 1 1   36   23   13 o    299.9    2.8    0.0000   0.0000          ?        ?   899.6769  16.6016          ?        ?      299.9        2.8       ?       ? 
1 1 1   36   23   14 o    472.9    2.7    0.0000   0.0000          ?        ?  2236.7412  25.5409          ?        ?      472.9        2.7       ?       ? 
1 1 1   36   23   15 o    386.3    2.6    0.0000   0.0000          ?        ?  1492.8635  20.4327          ?        ?      386.3        2.6       ?       ? 
1 1 1   36   23   16 o    183.2    3.5    0.0000   0.0000          ?        ?   335.8624  12.7704          ?        ?      183.2        3.5       ?       ? 
1 1 1   36   23   17 o    250.9    2.4    0.0000   0.0000          ?        ?   629.5823  12.1319          ?        ?      250.9        2.4       ?       ? 
1 1 1   36   23   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   23   19 o    377.9    2.5    0.0000   0.0000          ?        ?  1428.3728  18.5171          ?        ?      377.9        2.5       ?       ? 
1 1 1   36   23   20 o    207.9    3.1    0.0000   0.0000          ?        ?   432.2791  12.7704          ?        ?      207.9        3.1       ?       ? 
1 1 1   36   23   21 o    356.3    2.3    0.0000   0.0000          ?        ?  1270.0195  16.6016          ?        ?      356.3        2.3       ?       ? 
1 1 1   36   23   22 o    497.3    2.6    0.0000   0.0000          ?        ?  2473.6328  25.5409          ?        ?      497.3        2.6       ?       ? 
1 1 1   36   23   23 o     30.8   12.7    0.0000   0.0000          ?        ?     2.5541  12.7704          ?        ?       30.8       12.7       ?       ? 
1 1 1   36   23   24 o     98.7    6.1    0.0000   0.0000          ?        ?    97.6938  12.1319          ?        ?       98.7        6.1       ?       ? 
1 1 1   36   23   25 o    362.0    2.5    0.0000   0.0000          ?        ?  1310.8849  17.8786          ?        ?      362.0        2.5       ?       ? 
1 1 1   36   23   26 o    321.2    2.6    0.0000   0.0000          ?        ?  1031.8510  16.6016          ?        ?      321.2        2.6       ?       ? 
1 1 1   36   23   27 o     66.7   10.1    0.0000   0.0000          ?        ?    44.6965  13.4090          ?        ?       66.7       10.1       ?       ? 
1 1 1   36   23   28 o    387.0    2.6    0.0000   0.0000          ?        ?  1497.9718  19.7942          ?        ?      387.0        2.6       ?       ? 
1 1 1   36   23   29 o    409.0    2.6    0.0000   0.0000          ?        ?  1673.5652  21.0712          ?        ?      409.0        2.6       ?       ? 
1 1 1   36   23   30 o    177.3    4.5    0.0000   0.0000          ?        ?   314.7912  15.9630          ?        ?      177.3        4.5       ?       ? 
1 1 1   36   23   31 o    221.8    3.5    0.0000   0.0000          ?        ?   492.3002  15.3245          ?        ?      221.8        3.5       ?       ? 
1 1 1   36   23   32 o     27.9   12.7    0.0000   0.0000          ?        ?    -8.9393  15.3245          ?        ?       27.9       12.7       ?       ? 
1 1 1   36   23   33 o    219.2    3.6    0.0000   0.0000          ?        ?   480.8068  15.9630          ?        ?      219.2        3.6       ?       ? 
1 1 1   36   23   34 o    256.7    3.4    0.0000   0.0000          ?        ?   659.5928  17.2401          ?        ?      256.7        3.4       ?       ? 
1 1 1   36   23   35 o    104.9    7.3    0.0000   0.0000          ?        ?   110.4642  15.3245          ?        ?      104.9        7.3       ?       ? 
1 1 1   36   23   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   23   37 f    359.8    3.0    0.0000   0.0000          ?        ?  1295.5603  21.7097          ?        ?      359.8        3.0       ?       ? 
1 1 1   36   23   38 f     45.8   15.7    0.0000   0.0000          ?        ?    19.7942  17.2401          ?        ?       45.8       15.7       ?       ? 
1 1 1   36   23   39 o     53.5   15.3    0.0000   0.0000          ?        ?    30.0105  17.2401          ?        ?       53.5       15.3       ?       ? 
1 1 1   36   23   40 o     22.0   10.8    0.0000   0.0000          ?        ?   -37.6728  17.2401          ?        ?       22.0       10.8       ?       ? 
1 1 1   36   23   41 o    217.6    4.3    0.0000   0.0000          ?        ?   474.4216  18.5171          ?        ?      217.6        4.3       ?       ? 
1 1 1   36   23   42 o    274.8    3.4    0.0000   0.0000          ?        ?   756.0096  18.5171          ?        ?      274.8        3.4       ?       ? 
1 1 1   36   23   43 o    152.4    5.7    0.0000   0.0000          ?        ?   233.0604  17.2401          ?        ?      152.4        5.7       ?       ? 
1 1 1   36   23   44 o    247.0    3.9    0.0000   0.0000          ?        ?   611.0652  19.1556          ?        ?      247.0        3.9       ?       ? 
1 1 1   36   23   45 o    176.4    5.2    0.0000   0.0000          ?        ?   312.2371  18.5171          ?        ?      176.4        5.2       ?       ? 
1 1 1   36   23   46 o    153.3    6.0    0.0000   0.0000          ?        ?   236.2530  18.5171          ?        ?      153.3        6.0       ?       ? 
1 1 1   36   23   47 o    267.6    3.8    0.0000   0.0000          ?        ?   717.6983  20.4327          ?        ?      267.6        3.8       ?       ? 
1 1 1   36   23   48 o    104.8    8.5    0.0000   0.0000          ?        ?   111.1028  17.8786          ?        ?      104.8        8.5       ?       ? 
1 1 1   36   23   49 o     22.6   11.1    0.0000   0.0000          ?        ?   -37.6728  17.8786          ?        ?       22.6       11.1       ?       ? 
1 1 1   36   23   50 o     83.3   10.7    0.0000   0.0000          ?        ?    70.8759  17.8786          ?        ?       83.3       10.7       ?       ? 
1 1 1   36   23   51 o    220.9    4.3    0.0000   0.0000          ?        ?   489.7461  19.1556          ?        ?      220.9        4.3       ?       ? 
1 1 1   36   23   52 o     56.9   15.4    0.0000   0.0000          ?        ?    35.1187  17.8786          ?        ?       56.9       15.4       ?       ? 
1 1 1   36   24    0 o    345.8    5.0 1197.2280  34.4802  1197.2280  34.4802  1197.2280  34.4802      345.8      5.0      345.8        5.0     0.0     0.0 
1 1 1   36   24    1 o    353.1    3.1    0.0000   0.0000          ?        ?  1247.0327  21.7097          ?        ?      353.1        3.1       ?       ? 
1 1 1   36   24    2 o    309.5    3.0    0.0000   0.0000          ?        ?   958.4210  18.5171          ?        ?      309.5        3.0       ?       ? 
1 1 1   36   24    3 o    506.0    2.8    0.0000   0.0000          ?        ?  2561.1104  28.7335          ?        ?      506.0        2.8       ?       ? 
1 1 1   36   24    4 o    181.8    3.0    0.0000   0.0000          ?        ?   330.7542  10.8549          ?        ?      181.8        3.0       ?       ? 
1 1 1   36   24    5 o     47.0    9.8    0.0000   0.0000          ?        ?    22.9868   8.9393          ?        ?       47.0        9.8       ?       ? 
1 1 1   36   24    6 o    299.7    2.8    0.0000   0.0000          ?        ?   898.3999  16.6016          ?        ?      299.7        2.8       ?       ? 
1 1 1   36   24    7 o    299.9    2.8    0.0000   0.0000          ?        ?   899.6769  16.6016          ?        ?      299.9        2.8       ?       ? 
1 1 1   36   24    8 o     53.0   11.8    0.0000   0.0000          ?        ?    29.3720  12.1319          ?        ?       53.0       11.8       ?       ? 
1 1 1   36   24    9 o    243.9    3.1    0.0000   0.0000          ?        ?   595.1021  15.3245          ?        ?      243.9        3.1       ?       ? 
1 1 1   36   24   10 o    629.3    3.3    0.0000   0.0000          ?        ?  3962.0266  42.1424          ?        ?      629.3        3.3       ?       ? 
1 1 1   36   24   11 o    368.8    2.7    0.0000   0.0000          ?        ?  1360.6896  19.7942          ?        ?      368.8        2.7       ?       ? 
1 1 1   36   24   12 f    370.6    2.4    0.0000   0.0000          ?        ?  1374.0985  17.8786          ?        ?      370.6        2.4       ?       ? 
1 1 1   36   24   13 f    372.2    2.6    0.0000   0.0000          ?        ?  1385.5919  19.1556          ?        ?      372.2        2.6       ?       ? 
1 1 1   36   24   14 o    177.9    3.4    0.0000   0.0000          ?        ?   316.7067  12.1319          ?        ?      177.9        3.4       ?       ? 
1 1 1   36   24   15 o    220.7    2.9    0.0000   0.0000          ?        ?   487.1920  12.7704          ?        ?      220.7        2.9       ?       ? 
1 1 1   36   24   16 o    417.2    2.6    0.0000   0.0000          ?        ?  1741.2485  21.7097          ?        ?      417.2        2.6       ?       ? 
1 1 1   36   24   17 o    116.0    3.9    0.0000   0.0000          ?        ?   134.7281   8.9393          ?        ?      116.0        3.9       ?       ? 
1 1 1   36   24   18 o    366.4    2.5    0.0000   0.0000          ?        ?  1342.8110  18.5171          ?        ?      366.4        2.5       ?       ? 
1 1 1   36   24   19 o    131.7    3.9    0.0000   0.0000          ?        ?   173.6779  10.2163          ?        ?      131.7        3.9       ?       ? 
1 1 1   36   24   20 o    124.2    4.4    0.0000   0.0000          ?        ?   154.5222  10.8549          ?        ?      124.2        4.4       ?       ? 
1 1 1   36   24   21 o    404.5    2.4    0.0000   0.0000          ?        ?  1637.1694  19.7942          ?        ?      404.5        2.4       ?       ? 
1 1 1   36   24   22 o    182.0    3.9    0.0000   0.0000          ?        ?   331.3927  14.0475          ?        ?      182.0        3.9       ?       ? 
1 1 1   36   24   23 o    458.0    2.6    0.0000   0.0000          ?        ?  2098.1821  24.2638          ?        ?      458.0        2.6       ?       ? 
1 1 1   36   24   24 o     47.0   13.1    0.0000   0.0000          ?        ?    22.9868  12.7704          ?        ?       47.0       13.1       ?       ? 
1 1 1   36   24   25 o     17.8    8.9    0.0000   0.0000          ?        ?   -37.6728  13.4090          ?        ?       17.8        8.9       ?       ? 
1 1 1   36   24   26 o    300.1    2.7    0.0000   0.0000          ?        ?   900.9540  15.9630          ?        ?      300.1        2.7       ?       ? 
1 1 1   36   24   27 o    225.2    3.3    0.0000   0.0000          ?        ?   507.6247  14.6860          ?        ?      225.2        3.3       ?       ? 
1 1 1   36   24   28 o    148.5    4.7    0.0000   0.0000          ?        ?   220.9285  14.0475          ?        ?      148.5        4.7       ?       ? 
1 1 1   36   24   29 o     61.6   11.8    0.0000   0.0000          ?        ?    39.5883  14.0475          ?        ?       61.6       11.8       ?       ? 
1 1 1   36   24   30 o    316.6    2.8    0.0000   0.0000          ?        ?  1003.1175  17.8786          ?        ?      316.6        2.8       ?       ? 
1 1 1   36   24   31 o     25.0   11.7    0.0000   0.0000          ?        ?   -14.6860  14.6860          ?        ?       25.0       11.7       ?       ? 
1 1 1   36   24   32 o    243.9    3.3    0.0000   0.0000          ?        ?   595.1021  15.9630          ?        ?      243.9        3.3       ?       ? 
1 1 1   36   24   33 o    180.9    4.2    0.0000   0.0000          ?        ?   327.5616  15.3245          ?        ?      180.9        4.2       ?       ? 
1 1 1   36   24   34 o    303.5    3.1    0.0000   0.0000          ?        ?   922.0252  18.5171          ?        ?      303.5        3.1       ?       ? 
1 1 1   36   24   35 o    115.3    6.6    0.0000   0.0000          ?        ?   133.4510  15.3245          ?        ?      115.3        6.6       ?       ? 
1 1 1   36   24   36 o    387.7    2.7    0.0000   0.0000          ?        ?  1503.7184  21.0712          ?        ?      387.7        2.7       ?       ? 
1 1 1   36   24   37 o    209.4    4.3    0.0000   0.0000          ?        ?   439.3029  17.8786          ?        ?      209.4        4.3       ?       ? 
1 1 1   36   24   38 o    314.9    3.0    0.0000   0.0000          ?        ?   992.2626  19.1556          ?        ?      314.9        3.0       ?       ? 
1 1 1   36   24   39 o    191.3    4.5    0.0000   0.0000          ?        ?   366.5114  17.2401          ?        ?      191.3        4.5       ?       ? 
1 1 1   36   24   40 o     83.0   10.0    0.0000   0.0000          ?        ?    69.5989  16.6016          ?        ?       83.0       10.0       ?       ? 
1 1 1   36   24   41 o    262.9    3.5    0.0000   0.0000          ?        ?   692.1575  18.5171          ?        ?      262.9        3.5       ?       ? 
1 1 1   36   24   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   24   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   24   44 o    155.3    5.6    0.0000   0.0000          ?        ?   241.9997  17.2401          ?        ?      155.3        5.6       ?       ? 
1 1 1   36   24   45 o    366.1    3.0    0.0000   0.0000          ?        ?  1341.5339  21.7097          ?        ?      366.1        3.0       ?       ? 
1 1 1   36   24   46 o    137.3    6.3    0.0000   0.0000          ?        ?   189.6409  17.2401          ?        ?      137.3        6.3       ?       ? 
1 1 1   36   24   47 o    199.2    4.8    0.0000   0.0000          ?        ?   398.4375  19.1556          ?        ?      199.2        4.8       ?       ? 
1 1 1   36   24   48 o     37.5   15.4    0.0000   0.0000          ?        ?     5.7467  18.5171          ?        ?       37.5       15.4       ?       ? 
1 1 1   36   24   49 o    150.3    5.9    0.0000   0.0000          ?        ?   227.3137  17.8786          ?        ?      150.3        5.9       ?       ? 
1 1 1   36   24   50 o     55.0   15.6    0.0000   0.0000          ?        ?    32.5646  17.8786          ?        ?       55.0       15.6       ?       ? 
1 1 1   36   24   51 o    119.4    7.8    0.0000   0.0000          ?        ?   144.3059  18.5171          ?        ?      119.4        7.8       ?       ? 
1 1 1   36   25    0 o    184.9    6.9  343.5246  25.5409   343.5246  25.5409   343.5246  25.5409      184.9      6.9      184.9        6.9     0.0     0.0 
1 1 1   36   25    1 o     36.1   12.7    0.0000   0.0000          ?        ?    11.4934  11.4934          ?        ?       36.1       12.7       ?       ? 
1 1 1   36   25    2 o    428.1    3.2    0.0000   0.0000          ?        ?  1833.8342  27.4564          ?        ?      428.1        3.2       ?       ? 
1 1 1   36   25    3 o    270.1    4.4    0.0000   0.0000          ?        ?   730.4688  23.6253          ?        ?      270.1        4.4       ?       ? 
1 1 1   36   25    4 o    254.1    3.9    0.0000   0.0000          ?        ?   646.1838  19.7942          ?        ?      254.1        3.9       ?       ? 
1 1 1   36   25    5 o    156.9    4.5    0.0000   0.0000          ?        ?   246.4693  14.0475          ?        ?      156.9        4.5       ?       ? 
1 1 1   36   25    6 o    116.5    5.5    0.0000   0.0000          ?        ?   136.0051  12.7704          ?        ?      116.5        5.5       ?       ? 
1 1 1   36   25    7 o    219.8    4.1    0.0000   0.0000          ?        ?   483.3608  17.8786          ?        ?      219.8        4.1       ?       ? 
1 1 1   36   25    8 o     82.6    5.0    0.0000   0.0000          ?        ?    68.3218   8.3008          ?        ?       82.6        5.0       ?       ? 
1 1 1   36   25    9 o    100.1    4.8    0.0000   0.0000          ?        ?   100.2479   9.5778          ?        ?      100.1        4.8       ?       ? 
1 1 1   36   25   10 o    215.2    3.7    0.0000   0.0000          ?        ?   463.5667  15.9630          ?        ?      215.2        3.7       ?       ? 
1 1 1   36   25   11 o    138.6    4.6    0.0000   0.0000          ?        ?   192.1950  12.7704          ?        ?      138.6        4.6       ?       ? 
1 1 1   36   25   12 o    411.1    2.5    0.0000   0.0000          ?        ?  1690.8052  20.4327          ?        ?      411.1        2.5       ?       ? 
1 1 1   36   25   13 o    267.8    2.6    0.0000   0.0000          ?        ?   717.6983  14.0475          ?        ?      267.8        2.6       ?       ? 
1 1 1   36   25   14 o    383.5    2.6    0.0000   0.0000          ?        ?  1471.1538  19.7942          ?        ?      383.5        2.6       ?       ? 
1 1 1   36   25   15 o    111.5    5.7    0.0000   0.0000          ?        ?   124.5117  12.7704          ?        ?      111.5        5.7       ?       ? 
1 1 1   36   25   16 o    299.8    2.9    0.0000   0.0000          ?        ?   899.0385  17.2401          ?        ?      299.8        2.9       ?       ? 
1 1 1   36   25   17 o    394.4    2.8    0.0000   0.0000          ?        ?  1556.0771  22.3483          ?        ?      394.4        2.8       ?       ? 
1 1 1   36   25   18 o     23.7   10.2    0.0000   0.0000          ?        ?    -1.2770   8.9393          ?        ?       23.7       10.2       ?       ? 
1 1 1   36   25   19 o    102.3    5.0    0.0000   0.0000          ?        ?   104.7175  10.2163          ?        ?      102.3        5.0       ?       ? 
1 1 1   36   25   20 o    135.1    4.0    0.0000   0.0000          ?        ?   182.6172  10.8549          ?        ?      135.1        4.0       ?       ? 
1 1 1   36   25   21 o    250.5    2.7    0.0000   0.0000          ?        ?   627.6667  13.4090          ?        ?      250.5        2.7       ?       ? 
1 1 1   36   25   22 o    261.9    2.7    0.0000   0.0000          ?        ?   686.4108  14.0475          ?        ?      261.9        2.7       ?       ? 
1 1 1   36   25   23 o    367.3    2.4    0.0000   0.0000          ?        ?  1349.8347  17.8786          ?        ?      367.3        2.4       ?       ? 
1 1 1   36   25   24 o    316.9    2.6    0.0000   0.0000          ?        ?  1004.3945  16.6016          ?        ?      316.9        2.6       ?       ? 
1 1 1   36   25   25 o    321.0    2.7    0.0000   0.0000          ?        ?  1030.5739  17.2401          ?        ?      321.0        2.7       ?       ? 
1 1 1   36   25   26 o    149.4    4.7    0.0000   0.0000          ?        ?   223.4826  14.0475          ?        ?      149.4        4.7       ?       ? 
1 1 1   36   25   27 o    672.6    2.9    0.0000   0.0000          ?        ?  4526.4800  38.9498          ?        ?      672.6        2.9       ?       ? 
1 1 1   36   25   28 o    295.3    2.8    0.0000   0.0000          ?        ?   872.2206  16.6016          ?        ?      295.3        2.8       ?       ? 
1 1 1   36   25   29 o     74.7    9.4    0.0000   0.0000          ?        ?    56.1899  14.0475          ?        ?       74.7        9.4       ?       ? 
1 1 1   36   25   30 o    191.3    3.8    0.0000   0.0000          ?        ?   366.5114  14.6860          ?        ?      191.3        3.8       ?       ? 
1 1 1   36   25   31 o     54.5   13.5    0.0000   0.0000          ?        ?    31.2876  14.6860          ?        ?       54.5       13.5       ?       ? 
1 1 1   36   25   32 f    241.2    3.4    0.0000   0.0000          ?        ?   582.3317  16.6016          ?        ?      241.2        3.4       ?       ? 
1 1 1   36   25   33 o    325.1    2.8    0.0000   0.0000          ?        ?  1057.3918  18.5171          ?        ?      325.1        2.8       ?       ? 
1 1 1   36   25   34 o    187.4    4.3    0.0000   0.0000          ?        ?   351.8254  15.9630          ?        ?      187.4        4.3       ?       ? 
1 1 1   36   25   35 o    151.7    5.1    0.0000   0.0000          ?        ?   230.5063  15.3245          ?        ?      151.7        5.1       ?       ? 
1 1 1   36   25   36 o    369.7    2.7    0.0000   0.0000          ?        ?  1367.7133  19.7942          ?        ?      369.7        2.7       ?       ? 
1 1 1   36   25   37 o    246.9    3.7    0.0000   0.0000          ?        ?   610.4266  18.5171          ?        ?      246.9        3.7       ?       ? 
1 1 1   36   25   38 o    161.4    5.1    0.0000   0.0000          ?        ?   261.1554  16.6016          ?        ?      161.4        5.1       ?       ? 
1 1 1   36   25   39 o    172.3    4.6    0.0000   0.0000          ?        ?   297.5511  15.9630          ?        ?      172.3        4.6       ?       ? 
1 1 1   36   25   40 o    135.1    5.9    0.0000   0.0000          ?        ?   183.2557  15.9630          ?        ?      135.1        5.9       ?       ? 
1 1 1   36   25   41 o    192.7    4.6    0.0000   0.0000          ?        ?   372.2581  17.8786          ?        ?      192.7        4.6       ?       ? 
1 1 1   36   25   42 o     44.6   15.1    0.0000   0.0000          ?        ?    19.1556  15.9630          ?        ?       44.6       15.1       ?       ? 
1 1 1   36   25   43 o    467.6    2.7    0.0000   0.0000          ?        ?  2188.8521  25.5409          ?        ?      467.6        2.7       ?       ? 
1 1 1   36   25   44 o    230.1    4.0    0.0000   0.0000          ?        ?   530.6115  18.5171          ?        ?      230.1        4.0       ?       ? 
1 1 1   36   25   45 o     85.8   10.0    0.0000   0.0000          ?        ?    74.7070  17.2401          ?        ?       85.8       10.0       ?       ? 
1 1 1   36   25   46 o     83.9   10.3    0.0000   0.0000          ?        ?    71.5144  17.2401          ?        ?       83.9       10.3       ?       ? 
1 1 1   36   25   47 o    103.3    8.3    0.0000   0.0000          ?        ?   107.9102  17.2401          ?        ?      103.3        8.3       ?       ? 
1 1 1   36   25   48 o    129.5    6.7    0.0000   0.0000          ?        ?   169.2082  17.2401          ?        ?      129.5        6.7       ?       ? 
1 1 1   36   25   49 o     73.6   11.3    0.0000   0.0000          ?        ?    55.5514  16.6016          ?        ?       73.6       11.3       ?       ? 
1 1 1   36   26    0 o     24.7   17.2  -20.4327  28.0950   -20.4327  28.0950   -20.4327  28.0950       24.7     17.2       24.7       17.2     0.0     0.0 
1 1 1   36   26    1 o     38.6   16.4    0.0000   0.0000          ?        ?     0.0000  22.3483          ?        ?       38.6       16.4       ?       ? 
1 1 1   36   26    2 o    163.8    8.4    0.0000   0.0000          ?        ?   269.4561  27.4564          ?        ?      163.8        8.4       ?       ? 
1 1 1   36   26    3 o    380.2    4.4    0.0000   0.0000          ?        ?  1446.8900  33.2031          ?        ?      380.2        4.4       ?       ? 
1 1 1   36   26    4 o    185.9    4.3    0.0000   0.0000          ?        ?   346.0787  15.9630          ?        ?      185.9        4.3       ?       ? 
1 1 1   36   26    5 o    359.8    3.5    0.0000   0.0000          ?        ?  1295.5603  25.5409          ?        ?      359.8        3.5       ?       ? 
1 1 1   36   26    6 o    561.6    3.9    0.0000   0.0000          ?        ?  3156.2124  43.4195          ?        ?      561.6        3.9       ?       ? 
1 1 1   36   26    7 o    156.5    4.7    0.0000   0.0000          ?        ?   245.1923  14.6860          ?        ?      156.5        4.7       ?       ? 
1 1 1   36   26    8 o     17.6    8.8    0.0000   0.0000          ?        ?   -38.9498  13.4090          ?        ?       17.6        8.8       ?       ? 
1 1 1   36   26    9 o    207.2    4.0    0.0000   0.0000          ?        ?   429.7251  16.6016          ?        ?      207.2        4.0       ?       ? 
1 1 1   36   26   10 o     47.3   13.9    0.0000   0.0000          ?        ?    22.9868  14.0475          ?        ?       47.3       13.9       ?       ? 
1 1 1   36   26   11 o    355.1    2.8    0.0000   0.0000          ?        ?  1261.7188  19.7942          ?        ?      355.1        2.8       ?       ? 
1 1 1   36   26   12 f    139.3    3.4    0.0000   0.0000          ?        ?   194.1106   9.5778          ?        ?      139.3        3.4       ?       ? 
1 1 1   36   26   13 o     46.2   10.6    0.0000   0.0000          ?        ?    22.3483   9.5778          ?        ?       46.2       10.6       ?       ? 
1 1 1   36   26   14 o     41.7   12.2    0.0000   0.0000          ?        ?    17.8786  10.8549          ?        ?       41.7       12.2       ?       ? 
1 1 1   36   26   15 o     64.3    8.4    0.0000   0.0000          ?        ?    41.5039  10.8549          ?        ?       64.3        8.4       ?       ? 
1 1 1   36   26   16 o    152.0    4.0    0.0000   0.0000          ?        ?   231.1448  12.1319          ?        ?      152.0        4.0       ?       ? 
1 1 1   36   26   17 o    220.1    3.0    0.0000   0.0000          ?        ?   484.6379  13.4090          ?        ?      220.1        3.0       ?       ? 
1 1 1   36   26   18 o    275.0    2.9    0.0000   0.0000          ?        ?   756.6481  15.9630          ?        ?      275.0        2.9       ?       ? 
1 1 1   36   26   19 o    249.8    2.6    0.0000   0.0000          ?        ?   624.4742  12.7704          ?        ?      249.8        2.6       ?       ? 
1 1 1   36   26   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   26   21 o    250.6    2.8    0.0000   0.0000          ?        ?   628.3053  14.0475          ?        ?      250.6        2.8       ?       ? 
1 1 1   36   26   22 o    397.3    2.5    0.0000   0.0000          ?        ?  1579.0640  19.7942          ?        ?      397.3        2.5       ?       ? 
1 1 1   36   26   23 o    333.4    2.7    0.0000   0.0000          ?        ?  1112.3047  17.8786          ?        ?      333.4        2.7       ?       ? 
1 1 1   36   26   24 o     92.4    6.6    0.0000   0.0000          ?        ?    85.5619  12.1319          ?        ?       92.4        6.6       ?       ? 
1 1 1   36   26   25 o    314.6    2.6    0.0000   0.0000          ?        ?   990.3471  16.6016          ?        ?      314.6        2.6       ?       ? 
1 1 1   36   26   26 o    218.5    3.4    0.0000   0.0000          ?        ?   477.6142  14.6860          ?        ?      218.5        3.4       ?       ? 
1 1 1   36   26   27 o     16.8    8.5    0.0000   0.0000          ?        ?   -53.6358  14.6860          ?        ?       16.8        8.5       ?       ? 
1 1 1   36   26   28 o    200.0    3.7    0.0000   0.0000          ?        ?   400.3531  14.6860          ?        ?      200.0        3.7       ?       ? 
1 1 1   36   26   29 o    314.7    2.6    0.0000   0.0000          ?        ?   990.9855  16.6016          ?        ?      314.7        2.6       ?       ? 
1 1 1   36   26   30 o    144.1    4.9    0.0000   0.0000          ?        ?   208.1580  14.0475          ?        ?      144.1        4.9       ?       ? 
1 1 1   36   26   31 o    251.8    3.4    0.0000   0.0000          ?        ?   634.6905  17.2401          ?        ?      251.8        3.4       ?       ? 
1 1 1   36   26   32 o    311.0    2.9    0.0000   0.0000          ?        ?   967.9988  17.8786          ?        ?      311.0        2.9       ?       ? 
1 1 1   36   26   33 o    130.9    5.9    0.0000   0.0000          ?        ?   171.7623  15.3245          ?        ?      130.9        5.9       ?       ? 
1 1 1   36   26   34 o    100.2    7.3    0.0000   0.0000          ?        ?   100.8864  14.6860          ?        ?      100.2        7.3       ?       ? 
1 1 1   36   26   35 o    130.3    6.4    0.0000   0.0000          ?        ?   170.4853  16.6016          ?        ?      130.3        6.4       ?       ? 
1 1 1   36   26   36 o    218.5    3.9    0.0000   0.0000          ?        ?   478.2527  17.2401          ?        ?      218.5        3.9       ?       ? 
1 1 1   36   26   37 o    215.7    4.0    0.0000   0.0000          ?        ?   466.1208  17.2401          ?        ?      215.7        4.0       ?       ? 
1 1 1   36   26   38 o    112.7    7.1    0.0000   0.0000          ?        ?   127.7043  15.9630          ?        ?      112.7        7.1       ?       ? 
1 1 1   36   26   39 o    135.3    5.9    0.0000   0.0000          ?        ?   183.8942  15.9630          ?        ?      135.3        5.9       ?       ? 
1 1 1   36   26   40 o    237.8    3.6    0.0000   0.0000          ?        ?   566.3687  17.2401          ?        ?      237.8        3.6       ?       ? 
1 1 1   36   26   41 o    167.7    5.1    0.0000   0.0000          ?        ?   282.2266  17.2401          ?        ?      167.7        5.1       ?       ? 
1 1 1   36   26   42 o     23.7   11.5    0.0000   0.0000          ?        ?   -29.3720  17.2401          ?        ?       23.7       11.5       ?       ? 
1 1 1   36   26   43 f     93.6    9.6    0.0000   0.0000          ?        ?    88.7545  17.8786          ?        ?       93.6        9.6       ?       ? 
1 1 1   36   26   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   26   45 o     21.1   10.5    0.0000   0.0000          ?        ?   -49.8047  18.5171          ?        ?       21.1       10.5       ?       ? 
1 1 1   36   26   46 o     37.5   15.1    0.0000   0.0000          ?        ?     7.6623  17.2401          ?        ?       37.5       15.1       ?       ? 
1 1 1   36   26   47 o     62.7   13.6    0.0000   0.0000          ?        ?    42.1424  16.6016          ?        ?       62.7       13.6       ?       ? 
1 1 1   36   26   48 o     39.7   15.5    0.0000   0.0000          ?        ?    10.8549  17.8786          ?        ?       39.7       15.5       ?       ? 
1 1 1   36   27    0 f    494.9    8.4 2456.3928  83.0078  2456.3928  83.0078  2456.3928  83.0078      494.9      8.4      494.9        8.4     0.0     0.0 
1 1 1   36   27    1 o    185.8    6.7    0.0000   0.0000          ?        ?   346.0787  24.9023          ?        ?      185.8        6.7       ?       ? 
1 1 1   36   27    2 o    147.3    7.2    0.0000   0.0000          ?        ?   217.7359  21.0712          ?        ?      147.3        7.2       ?       ? 
1 1 1   36   27    3 o    174.0    6.1    0.0000   0.0000          ?        ?   303.2978  21.0712          ?        ?      174.0        6.1       ?       ? 
1 1 1   36   27    4 o    328.1    4.2    0.0000   0.0000          ?        ?  1077.8246  27.4564          ?        ?      328.1        4.2       ?       ? 
1 1 1   36   27    5 o    353.6    4.8    0.0000   0.0000          ?        ?  1252.1410  33.8416          ?        ?      353.6        4.8       ?       ? 
1 1 1   36   27    6 o    402.1    3.4    0.0000   0.0000          ?        ?  1618.0138  27.4564          ?        ?      402.1        3.4       ?       ? 
1 1 1   36   27    7 o    230.8    4.0    0.0000   0.0000          ?        ?   533.1656  18.5171          ?        ?      230.8        4.0       ?       ? 
1 1 1   36   27    8 f    274.4    4.1    0.0000   0.0000          ?        ?   753.4555  22.3483          ?        ?      274.4        4.1       ?       ? 
1 1 1   36   27    9 o    112.3    6.8    0.0000   0.0000          ?        ?   126.4273  15.3245          ?        ?      112.3        6.8       ?       ? 
1 1 1   36   27   10 o    113.1    6.5    0.0000   0.0000          ?        ?   128.3428  14.6860          ?        ?      113.1        6.5       ?       ? 
1 1 1   36   27   11 o    199.5    4.2    0.0000   0.0000          ?        ?   398.4375  16.6016          ?        ?      199.5        4.2       ?       ? 
1 1 1   36   27   12 o    238.1    3.9    0.0000   0.0000          ?        ?   567.6458  18.5171          ?        ?      238.1        3.9       ?       ? 
1 1 1   36   27   13 f    133.9    3.3    0.0000   0.0000          ?        ?   179.4246   8.9393          ?        ?      133.9        3.3       ?       ? 
1 1 1   36   27   14 o    101.9    5.0    0.0000   0.0000          ?        ?   104.0790  10.2163          ?        ?      101.9        5.0       ?       ? 
1 1 1   36   27   15 f    146.4    3.9    0.0000   0.0000          ?        ?   214.5433  11.4934          ?        ?      146.4        3.9       ?       ? 
1 1 1   36   27   16 o    162.5    3.9    0.0000   0.0000          ?        ?   264.3480  12.7704          ?        ?      162.5        3.9       ?       ? 
1 1 1   36   27   17 o    172.6    3.7    0.0000   0.0000          ?        ?   298.1896  12.7704          ?        ?      172.6        3.7       ?       ? 
1 1 1   36   27   18 o     76.5    8.3    0.0000   0.0000          ?        ?    58.7440  12.7704          ?        ?       76.5        8.3       ?       ? 
1 1 1   36   27   19 o    499.3    2.7    0.0000   0.0000          ?        ?  2494.0654  26.8179          ?        ?      499.3        2.7       ?       ? 
1 1 1   36   27   20 f    317.2    2.5    0.0000   0.0000          ?        ?  1006.3101  15.9630          ?        ?      317.2        2.5       ?       ? 
1 1 1   36   27   21 o    167.2    3.4    0.0000   0.0000          ?        ?   279.6725  11.4934          ?        ?      167.2        3.4       ?       ? 
1 1 1   36   27   22 o    404.1    2.5    0.0000   0.0000          ?        ?  1633.3384  20.4327          ?        ?      404.1        2.5       ?       ? 
1 1 1   36   27   23 o    174.2    3.8    0.0000   0.0000          ?        ?   303.9363  13.4090          ?        ?      174.2        3.8       ?       ? 
1 1 1   36   27   24 o    168.5    3.8    0.0000   0.0000          ?        ?   284.1421  12.7704          ?        ?      168.5        3.8       ?       ? 
1 1 1   36   27   25 o    405.4    2.5    0.0000   0.0000          ?        ?  1644.1932  20.4327          ?        ?      405.4        2.5       ?       ? 
1 1 1   36   27   26 o    463.0    2.6    0.0000   0.0000          ?        ?  2144.7942  23.6253          ?        ?      463.0        2.6       ?       ? 
1 1 1   36   27   27 o    243.7    3.0    0.0000   0.0000          ?        ?   594.4636  14.6860          ?        ?      243.7        3.0       ?       ? 
1 1 1   36   27   28 o    209.9    3.5    0.0000   0.0000          ?        ?   441.2184  14.6860          ?        ?      209.9        3.5       ?       ? 
1 1 1   36   27   29 o    274.2    3.0    0.0000   0.0000          ?        ?   752.1785  16.6016          ?        ?      274.2        3.0       ?       ? 
1 1 1   36   27   30 o    118.1    6.2    0.0000   0.0000          ?        ?   139.8362  14.6860          ?        ?      118.1        6.2       ?       ? 
1 1 1   36   27   31 o     25.7   11.9    0.0000   0.0000          ?        ?   -12.7704  14.6860          ?        ?       25.7       11.9       ?       ? 
1 1 1   36   27   32 o    181.0    4.4    0.0000   0.0000          ?        ?   328.2001  15.9630          ?        ?      181.0        4.4       ?       ? 
1 1 1   36   27   33 o    455.0    2.7    0.0000   0.0000          ?        ?  2072.0027  24.9023          ?        ?      455.0        2.7       ?       ? 
1 1 1   36   27   34 o    110.5    6.9    0.0000   0.0000          ?        ?   122.5962  15.3245          ?        ?      110.5        6.9       ?       ? 
1 1 1   36   27   35 o    250.4    3.6    0.0000   0.0000          ?        ?   627.6667  17.8786          ?        ?      250.4        3.6       ?       ? 
1 1 1   36   27   36 o    317.5    2.9    0.0000   0.0000          ?        ?  1008.8642  18.5171          ?        ?      317.5        2.9       ?       ? 
1 1 1   36   27   37 o    193.6    4.3    0.0000   0.0000          ?        ?   375.4507  16.6016          ?        ?      193.6        4.3       ?       ? 
1 1 1   36   27   38 o    156.3    5.3    0.0000   0.0000          ?        ?   245.1923  16.6016          ?        ?      156.3        5.3       ?       ? 
1 1 1   36   27   39 o     72.2   11.5    0.0000   0.0000          ?        ?    52.9973  16.6016          ?        ?       72.2       11.5       ?       ? 
1 1 1   36   27   40 o    122.6    6.8    0.0000   0.0000          ?        ?   151.3296  16.6016          ?        ?      122.6        6.8       ?       ? 
1 1 1   36   27   41 o    199.7    4.3    0.0000   0.0000          ?        ?   399.7145  17.2401          ?        ?      199.7        4.3       ?       ? 
1 1 1   36   27   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   27   43 o    214.7    4.2    0.0000   0.0000          ?        ?   462.2897  17.8786          ?        ?      214.7        4.2       ?       ? 
1 1 1   36   27   44 o    182.4    4.9    0.0000   0.0000          ?        ?   333.9468  17.8786          ?        ?      182.4        4.9       ?       ? 
1 1 1   36   27   45 o     24.8   11.9    0.0000   0.0000          ?        ?   -24.2638  17.2401          ?        ?       24.8       11.9       ?       ? 
1 1 1   36   27   46 o     58.0   14.4    0.0000   0.0000          ?        ?    36.3957  16.6016          ?        ?       58.0       14.4       ?       ? 
1 1 1   36   27   47 o    255.3    3.6    0.0000   0.0000          ?        ?   653.8461  18.5171          ?        ?      255.3        3.6       ?       ? 
1 1 1   36   28    0 o    151.0   11.8  233.0604  35.1187   233.0604  35.1187   233.0604  35.1187      151.0     11.8      151.0       11.8     0.0     0.0 
1 1 1   36   28    1 o    261.3    6.2    0.0000   0.0000          ?        ?   684.4952  32.5646          ?        ?      261.3        6.2       ?       ? 
1 1 1   36   28    2 o    122.4    9.9    0.0000   0.0000          ?        ?   150.6911  24.2638          ?        ?      122.4        9.9       ?       ? 
1 1 1   36   28    3 o    415.1    4.0    0.0000   0.0000          ?        ?  1724.6470  33.2031          ?        ?      415.1        4.0       ?       ? 
1 1 1   36   28    4 o    165.1    6.0    0.0000   0.0000          ?        ?   273.2873  19.7942          ?        ?      165.1        6.0       ?       ? 
1 1 1   36   28    5 o    387.3    4.0    0.0000   0.0000          ?        ?  1501.8029  30.6490          ?        ?      387.3        4.0       ?       ? 
1 1 1   36   28    6 o    295.3    4.5    0.0000   0.0000          ?        ?   872.8591  26.8179          ?        ?      295.3        4.5       ?       ? 
1 1 1   36   28    7 o    225.7    5.5    0.0000   0.0000          ?        ?   510.1788  24.9023          ?        ?      225.7        5.5       ?       ? 
1 1 1   36   28    8 o     45.6   11.8    0.0000   0.0000          ?        ?    21.7097  10.8549          ?        ?       45.6       11.8       ?       ? 
1 1 1   36   28    9 o    492.0    3.4    0.0000   0.0000          ?        ?  2421.9124  33.2031          ?        ?      492.0        3.4       ?       ? 
1 1 1   36   28   10 o    318.3    3.9    0.0000   0.0000          ?        ?  1013.9724  24.9023          ?        ?      318.3        3.9       ?       ? 
1 1 1   36   28   11 f    160.9    5.4    0.0000   0.0000          ?        ?   259.2398  17.2401          ?        ?      160.9        5.4       ?       ? 
1 1 1   36   28   12 o    362.2    3.7    0.0000   0.0000          ?        ?  1312.8005  26.8179          ?        ?      362.2        3.7       ?       ? 
1 1 1   36   28   13 o     45.8   13.2    0.0000   0.0000          ?        ?    21.7097  12.7704          ?        ?       45.8       13.2       ?       ? 
1 1 1   36   28   14 o    168.1    2.8    0.0000   0.0000          ?        ?   282.8651   9.5778          ?        ?      168.1        2.8       ?       ? 
1 1 1   36   28   15 o    399.8    3.0    0.0000   0.0000          ?        ?  1599.4967  23.6253          ?        ?      399.8        3.0       ?       ? 
1 1 1   36   28   16 o    218.8    3.1    0.0000   0.0000          ?        ?   478.8912  13.4090          ?        ?      218.8        3.1       ?       ? 
1 1 1   36   28   17 o    155.3    4.1    0.0000   0.0000          ?        ?   241.3612  12.7704          ?        ?      155.3        4.1       ?       ? 
1 1 1   36   28   18 o    246.0    3.0    0.0000   0.0000          ?        ?   605.3185  14.6860          ?        ?      246.0        3.0       ?       ? 
1 1 1   36   28   19 o    221.2    3.3    0.0000   0.0000          ?        ?   489.7461  14.6860          ?        ?      221.2        3.3       ?       ? 
1 1 1   36   28   20 o    116.0    4.4    0.0000   0.0000          ?        ?   134.7281  10.2163          ?        ?      116.0        4.4       ?       ? 
1 1 1   36   28   21 o    164.1    3.5    0.0000   0.0000          ?        ?   269.4561  11.4934          ?        ?      164.1        3.5       ?       ? 
1 1 1   36   28   22 o    142.8    4.2    0.0000   0.0000          ?        ?   204.3269  12.1319          ?        ?      142.8        4.2       ?       ? 
1 1 1   36   28   23 f    301.9    2.7    0.0000   0.0000          ?        ?   911.8089  16.6016          ?        ?      301.9        2.7       ?       ? 
1 1 1   36   28   24 o    244.3    2.9    0.0000   0.0000          ?        ?   597.0177  14.0475          ?        ?      244.3        2.9       ?       ? 
1 1 1   36   28   25 o    318.1    2.5    0.0000   0.0000          ?        ?  1012.6953  15.9630          ?        ?      318.1        2.5       ?       ? 
1 1 1   36   28   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   28   27 o    226.5    3.2    0.0000   0.0000          ?        ?   513.3714  14.6860          ?        ?      226.5        3.2       ?       ? 
1 1 1   36   28   28 o    420.2    2.5    0.0000   0.0000          ?        ?  1766.7894  21.0712          ?        ?      420.2        2.5       ?       ? 
1 1 1   36   28   29 o    191.3    3.7    0.0000   0.0000          ?        ?   366.5114  14.0475          ?        ?      191.3        3.7       ?       ? 
1 1 1   36   28   30 f    370.7    2.7    0.0000   0.0000          ?        ?  1375.3755  19.7942          ?        ?      370.7        2.7       ?       ? 
1 1 1   36   28   31 o    224.5    3.6    0.0000   0.0000          ?        ?   504.4321  15.9630          ?        ?      224.5        3.6       ?       ? 
1 1 1   36   28   32 o    184.5    4.2    0.0000   0.0000          ?        ?   340.9706  15.3245          ?        ?      184.5        4.2       ?       ? 
1 1 1   36   28   33 o    178.7    4.5    0.0000   0.0000          ?        ?   319.8993  15.9630          ?        ?      178.7        4.5       ?       ? 
1 1 1   36   28   34 o    216.9    3.8    0.0000   0.0000          ?        ?   471.2290  16.6016          ?        ?      216.9        3.8       ?       ? 
1 1 1   36   28   35 o    165.7    4.8    0.0000   0.0000          ?        ?   275.2028  15.9630          ?        ?      165.7        4.8       ?       ? 
1 1 1   36   28   36 o     18.5    9.3    0.0000   0.0000          ?        ?   -55.5514  16.6016          ?        ?       18.5        9.3       ?       ? 
1 1 1   36   28   37 o     34.8   14.3    0.0000   0.0000          ?        ?     4.4697  15.9630          ?        ?       34.8       14.3       ?       ? 
1 1 1   36   28   38 f    129.7    6.6    0.0000   0.0000          ?        ?   169.2082  17.2401          ?        ?      129.7        6.6       ?       ? 
1 1 1   36   28   39 o    173.0    4.8    0.0000   0.0000          ?        ?   300.1052  16.6016          ?        ?      173.0        4.8       ?       ? 
1 1 1   36   28   40 o    162.2    5.3    0.0000   0.0000          ?        ?   264.3480  17.2401          ?        ?      162.2        5.3       ?       ? 
1 1 1   36   28   41 o    227.4    3.8    0.0000   0.0000          ?        ?   518.4796  17.2401          ?        ?      227.4        3.8       ?       ? 
1 1 1   36   28   42 o    175.6    4.9    0.0000   0.0000          ?        ?   309.6830  17.2401          ?        ?      175.6        4.9       ?       ? 
1 1 1   36   28   43 o     88.6    9.4    0.0000   0.0000          ?        ?    79.8152  16.6016          ?        ?       88.6        9.4       ?       ? 
1 1 1   36   28   44 o    204.5    4.2    0.0000   0.0000          ?        ?   419.5087  17.2401          ?        ?      204.5        4.2       ?       ? 
1 1 1   36   28   45 o    198.4    4.2    0.0000   0.0000          ?        ?   395.2449  16.6016          ?        ?      198.4        4.2       ?       ? 
1 1 1   36   29    0 o     82.9   23.6   84.2849  33.8416    84.2849  33.8416    84.2849  33.8416       82.9     23.6       82.9       23.6     0.0     0.0 
1 1 1   36   29    1 o    152.2    8.0    0.0000   0.0000          ?        ?   232.4219  24.2638          ?        ?      152.2        8.0       ?       ? 
1 1 1   36   29    2 o     95.2   10.7    0.0000   0.0000          ?        ?    91.3086  20.4327          ?        ?       95.2       10.7       ?       ? 
1 1 1   36   29    3 o     44.2   18.4    0.0000   0.0000          ?        ?     5.1082  26.8179          ?        ?       44.2       18.4       ?       ? 
1 1 1   36   29    4 o    149.8   11.3    0.0000   0.0000          ?        ?   226.0367  33.8416          ?        ?      149.8       11.3       ?       ? 
1 1 1   36   29    5 o    125.1   10.7    0.0000   0.0000          ?        ?   157.7148  26.8179          ?        ?      125.1       10.7       ?       ? 
1 1 1   36   29    6 o    270.2    4.8    0.0000   0.0000          ?        ?   731.1072  26.1794          ?        ?      270.2        4.8       ?       ? 
1 1 1   36   29    7 o    346.1    4.4    0.0000   0.0000          ?        ?  1199.1437  30.6490          ?        ?      346.1        4.4       ?       ? 
1 1 1   36   29    8 o    149.5   10.0    0.0000   0.0000          ?        ?   224.7596  30.0105          ?        ?      149.5       10.0       ?       ? 
1 1 1   36   29    9 o     80.9    7.9    0.0000   0.0000          ?        ?    65.7677  12.7704          ?        ?       80.9        7.9       ?       ? 
1 1 1   36   29   10 o     61.6   11.8    0.0000   0.0000          ?        ?    39.5883  14.0475          ?        ?       61.6       11.8       ?       ? 
1 1 1   36   29   11 o    117.6    5.7    0.0000   0.0000          ?        ?   138.5592  13.4090          ?        ?      117.6        5.7       ?       ? 
1 1 1   36   29   12 o    358.8    4.3    0.0000   0.0000          ?        ?  1289.1752  30.6490          ?        ?      358.8        4.3       ?       ? 
1 1 1   36   29   13 o     86.5    9.6    0.0000   0.0000          ?        ?    75.3456  16.6016          ?        ?       86.5        9.6       ?       ? 
1 1 1   36   29   14 o    392.3    3.3    0.0000   0.0000          ?        ?  1540.1141  26.1794          ?        ?      392.3        3.3       ?       ? 
1 1 1   36   29   15 o     49.4   13.3    0.0000   0.0000          ?        ?    25.5409  13.4090          ?        ?       49.4       13.3       ?       ? 
1 1 1   36   29   16 o    192.2    3.3    0.0000   0.0000          ?        ?   369.7040  12.7704          ?        ?      192.2        3.3       ?       ? 
1 1 1   36   29   17 o     18.4    9.0    0.0000   0.0000          ?        ?   -23.6253  11.4934          ?        ?       18.4        9.0       ?       ? 
1 1 1   36   29   18 o    319.2    3.0    0.0000   0.0000          ?        ?  1019.7190  19.1556          ?        ?      319.2        3.0       ?       ? 
1 1 1   36   29   19 o    173.7    4.0    0.0000   0.0000          ?        ?   302.0207  14.0475          ?        ?      173.7        4.0       ?       ? 
1 1 1   36   29   20 o    190.4    2.9    0.0000   0.0000          ?        ?   362.6803  10.8549          ?        ?      190.4        2.9       ?       ? 
1 1 1   36   29   21 o    304.8    2.6    0.0000   0.0000          ?        ?   929.6875  15.9630          ?        ?      304.8        2.6       ?       ? 
1 1 1   36   29   22 o     97.4    5.9    0.0000   0.0000          ?        ?    95.1397  11.4934          ?        ?       97.4        5.9       ?       ? 
1 1 1   36   29   23 o    116.0    5.0    0.0000   0.0000          ?        ?   134.7281  11.4934          ?        ?      116.0        5.0       ?       ? 
1 1 1   36   29   24 o    146.6    4.4    0.0000   0.0000          ?        ?   215.1818  12.7704          ?        ?      146.6        4.4       ?       ? 
1 1 1   36   29   25 o    278.7    2.6    0.0000   0.0000          ?        ?   777.0808  14.6860          ?        ?      278.7        2.6       ?       ? 
1 1 1   36   29   26 o    214.6    3.3    0.0000   0.0000          ?        ?   461.0126  14.0475          ?        ?      214.6        3.3       ?       ? 
1 1 1   36   29   27 o     16.5    8.3    0.0000   0.0000          ?        ?   -40.8654  12.7704          ?        ?       16.5        8.3       ?       ? 
1 1 1   36   29   28 o     37.4   13.7    0.0000   0.0000          ?        ?    11.4934  13.4090          ?        ?       37.4       13.7       ?       ? 
1 1 1   36   29   29 o    273.4    3.0    0.0000   0.0000          ?        ?   748.3474  16.6016          ?        ?      273.4        3.0       ?       ? 
1 1 1   36   29   30 o    420.3    2.7    0.0000   0.0000          ?        ?  1768.0663  22.3483          ?        ?      420.3        2.7       ?       ? 
1 1 1   36   29   31 o     69.2   11.1    0.0000   0.0000          ?        ?    48.5276  15.3245          ?        ?       69.2       11.1       ?       ? 
1 1 1   36   29   32 o    110.7    6.6    0.0000   0.0000          ?        ?   123.2347  14.6860          ?        ?      110.7        6.6       ?       ? 
1 1 1   36   29   33 o    192.4    4.1    0.0000   0.0000          ?        ?   370.9810  15.9630          ?        ?      192.4        4.1       ?       ? 
1 1 1   36   29   34 o    205.4    3.9    0.0000   0.0000          ?        ?   422.7013  15.9630          ?        ?      205.4        3.9       ?       ? 
1 1 1   36   29   35 o    222.3    3.6    0.0000   0.0000          ?        ?   494.8542  15.9630          ?        ?      222.3        3.6       ?       ? 
1 1 1   36   29   36 o    409.8    2.8    0.0000   0.0000          ?        ?  1681.2274  22.9868          ?        ?      409.8        2.8       ?       ? 
1 1 1   36   29   37 o    104.1    7.4    0.0000   0.0000          ?        ?   109.1872  15.3245          ?        ?      104.1        7.4       ?       ? 
1 1 1   36   29   38 o    198.9    4.3    0.0000   0.0000          ?        ?   396.5219  17.2401          ?        ?      198.9        4.3       ?       ? 
1 1 1   36   29   39 f     28.2   12.7    0.0000   0.0000          ?        ?    -7.6623  15.3245          ?        ?       28.2       12.7       ?       ? 
1 1 1   36   29   40 o     54.6   14.8    0.0000   0.0000          ?        ?    31.9261  16.6016          ?        ?       54.6       14.8       ?       ? 
1 1 1   36   29   41 o    217.9    4.1    0.0000   0.0000          ?        ?   476.3371  17.8786          ?        ?      217.9        4.1       ?       ? 
1 1 1   36   29   42 o    228.9    3.8    0.0000   0.0000          ?        ?   525.5033  17.2401          ?        ?      228.9        3.8       ?       ? 
1 1 1   36   29   43 o    148.3    5.8    0.0000   0.0000          ?        ?   221.5670  17.2401          ?        ?      148.3        5.8       ?       ? 
1 1 1   36   30    0 o    189.9    8.8  363.9573  33.2031   363.9573  33.2031   363.9573  33.2031      189.9      8.8      189.9        8.8     0.0     0.0 
1 1 1   36   30    1 o    311.6    4.5    0.0000   0.0000          ?        ?   972.4684  28.0950          ?        ?      311.6        4.5       ?       ? 
1 1 1   36   30    2 o    185.1    7.9    0.0000   0.0000          ?        ?   344.1632  29.3720          ?        ?      185.1        7.9       ?       ? 
1 1 1   36   30    3 f    327.6    5.5    0.0000   0.0000          ?        ?  1075.2704  35.7572          ?        ?      327.6        5.5       ?       ? 
1 1 1   36   30    4 o    352.9    3.8    0.0000   0.0000          ?        ?  1246.3942  26.8179          ?        ?      352.9        3.8       ?       ? 
1 1 1   36   30    5 o    247.5    5.2    0.0000   0.0000          ?        ?   613.6193  25.5409          ?        ?      247.5        5.2       ?       ? 
1 1 1   36   30    6 o    256.8    5.6    0.0000   0.0000          ?        ?   660.8699  28.7335          ?        ?      256.8        5.6       ?       ? 
1 1 1   36   30    7 o    361.3    4.2    0.0000   0.0000          ?        ?  1307.0537  30.6490          ?        ?      361.3        4.2       ?       ? 
1 1 1   36   30    8 o    273.4    5.7    0.0000   0.0000          ?        ?   748.9859  31.2876          ?        ?      273.4        5.7       ?       ? 
1 1 1   36   30    9 o    194.3    6.7    0.0000   0.0000          ?        ?   378.6433  26.1794          ?        ?      194.3        6.7       ?       ? 
1 1 1   36   30   10 o    225.2    3.7    0.0000   0.0000          ?        ?   507.6247  16.6016          ?        ?      225.2        3.7       ?       ? 
1 1 1   36   30   11 o    136.7    5.1    0.0000   0.0000          ?        ?   187.0868  14.0475          ?        ?      136.7        5.1       ?       ? 
1 1 1   36   30   12 f    310.6    3.8    0.0000   0.0000          ?        ?   965.4447  23.6253          ?        ?      310.6        3.8       ?       ? 
1 1 1   36   30   13 o    240.2    4.7    0.0000   0.0000          ?        ?   577.8621  22.3483          ?        ?      240.2        4.7       ?       ? 
1 1 1   36   30   14 f     55.4   10.2    0.0000   0.0000          ?        ?    31.9261  10.8549          ?        ?       55.4       10.2       ?       ? 
1 1 1   36   30   15 o     82.0    8.6    0.0000   0.0000          ?        ?    67.6833  14.0475          ?        ?       82.0        8.6       ?       ? 
1 1 1   36   30   16 o    205.9    4.0    0.0000   0.0000          ?        ?   424.6169  16.6016          ?        ?      205.9        4.0       ?       ? 
1 1 1   36   30   17 o    425.9    3.1    0.0000   0.0000          ?        ?  1815.3169  26.1794          ?        ?      425.9        3.1       ?       ? 
1 1 1   36   30   18 o     86.3    6.7    0.0000   0.0000          ?        ?    74.7070  11.4934          ?        ?       86.3        6.7       ?       ? 
1 1 1   36   30   19 o    137.8    4.9    0.0000   0.0000          ?        ?   190.2794  13.4090          ?        ?      137.8        4.9       ?       ? 
1 1 1   36   30   20 o     70.3   10.0    0.0000   0.0000          ?        ?    49.8047  14.0475          ?        ?       70.3       10.0       ?       ? 
1 1 1   36   30   21 o     89.2    5.7    0.0000   0.0000          ?        ?    79.8152  10.2163          ?        ?       89.2        5.7       ?       ? 
1 1 1   36   30   22 o    218.3    2.9    0.0000   0.0000          ?        ?   476.9756  12.7704          ?        ?      218.3        2.9       ?       ? 
1 1 1   36   30   23 o    251.0    2.8    0.0000   0.0000          ?        ?   630.2208  14.0475          ?        ?      251.0        2.8       ?       ? 
1 1 1   36   30   24 o     28.1   12.0    0.0000   0.0000          ?        ?    -0.6385  12.1319          ?        ?       28.1       12.0       ?       ? 
1 1 1   36   30   25 o    219.2    3.2    0.0000   0.0000          ?        ?   480.8068  14.0475          ?        ?      219.2        3.2       ?       ? 
1 1 1   36   30   26 o    293.5    2.7    0.0000   0.0000          ?        ?   862.0042  15.9630          ?        ?      293.5        2.7       ?       ? 
1 1 1   36   30   27 o    152.3    4.4    0.0000   0.0000          ?        ?   232.4219  13.4090          ?        ?      152.3        4.4       ?       ? 
1 1 1   36   30   28 o    139.6    4.8    0.0000   0.0000          ?        ?   195.3876  13.4090          ?        ?      139.6        4.8       ?       ? 
1 1 1   36   30   29 o    142.1    5.2    0.0000   0.0000          ?        ?   202.4114  14.6860          ?        ?      142.1        5.2       ?       ? 
1 1 1   36   30   30 o     50.4   13.6    0.0000   0.0000          ?        ?    26.8179  14.0475          ?        ?       50.4       13.6       ?       ? 
1 1 1   36   30   31 o    319.3    2.9    0.0000   0.0000          ?        ?  1020.3576  18.5171          ?        ?      319.3        2.9       ?       ? 
1 1 1   36   30   32 o    136.5    5.6    0.0000   0.0000          ?        ?   187.0868  15.3245          ?        ?      136.5        5.6       ?       ? 
1 1 1   36   30   33 o    100.1    7.3    0.0000   0.0000          ?        ?   100.8864  14.6860          ?        ?      100.1        7.3       ?       ? 
1 1 1   36   30   34 o    223.3    3.6    0.0000   0.0000          ?        ?   499.3239  15.9630          ?        ?      223.3        3.6       ?       ? 
1 1 1   36   30   35 o    145.8    5.3    0.0000   0.0000          ?        ?   213.2662  15.3245          ?        ?      145.8        5.3       ?       ? 
1 1 1   36   30   36 o     24.0   11.5    0.0000   0.0000          ?        ?   -19.7942  15.3245          ?        ?       24.0       11.5       ?       ? 
1 1 1   36   30   37 o    253.1    3.5    0.0000   0.0000          ?        ?   641.7142  17.8786          ?        ?      253.1        3.5       ?       ? 
1 1 1   36   30   38 o    167.1    5.2    0.0000   0.0000          ?        ?   280.3110  17.2401          ?        ?      167.1        5.2       ?       ? 
1 1 1   36   30   39 o     21.3   10.6    0.0000   0.0000          ?        ?   -40.8654  17.2401          ?        ?       21.3       10.6       ?       ? 
1 1 1   36   30   40 o    378.4    3.0    0.0000   0.0000          ?        ?  1434.1196  22.3483          ?        ?      378.4        3.0       ?       ? 
1 1 1   36   30   41 o    270.3    3.3    0.0000   0.0000          ?        ?   732.3843  17.8786          ?        ?      270.3        3.3       ?       ? 
1 1 1   36   30   42 o     62.3   12.7    0.0000   0.0000          ?        ?    41.5039  15.3245          ?        ?       62.3       12.7       ?       ? 
1 1 1   36   31    0 o     94.4   27.7  111.1028  45.3350   111.1028  45.3350   111.1028  45.3350       94.4     27.7       94.4       27.7     0.0     0.0 
1 1 1   36   31    1 o    108.6   13.5    0.0000   0.0000          ?        ?   119.4035  29.3720          ?        ?      108.6       13.5       ?       ? 
1 1 1   36   31    2 o    328.0    4.9    0.0000   0.0000          ?        ?  1077.8246  31.9261          ?        ?      328.0        4.9       ?       ? 
1 1 1   36   31    3 o    183.7    8.0    0.0000   0.0000          ?        ?   339.0550  29.3720          ?        ?      183.7        8.0       ?       ? 
1 1 1   36   31    4 o    218.2    6.9    0.0000   0.0000          ?        ?   477.6142  30.0105          ?        ?      218.2        6.9       ?       ? 
1 1 1   36   31    5 o    139.4    8.5    0.0000   0.0000          ?        ?   195.3876  23.6253          ?        ?      139.4        8.5       ?       ? 
1 1 1   36   31    6 o    256.2    6.7    0.0000   0.0000          ?        ?   658.3158  34.4802          ?        ?      256.2        6.7       ?       ? 
1 1 1   36   31    7 o    192.9    8.6    0.0000   0.0000          ?        ?   374.1737  33.2031          ?        ?      192.9        8.6       ?       ? 
1 1 1   36   31    8 o    363.0    7.7    0.0000   0.0000          ?        ?  1323.6554  55.5514          ?        ?      363.0        7.7       ?       ? 
1 1 1   36   31    9 o    145.5   10.1    0.0000   0.0000          ?        ?   213.2662  29.3720          ?        ?      145.5       10.1       ?       ? 
1 1 1   36   31   10 o    189.5    7.9    0.0000   0.0000          ?        ?   360.7647  30.0105          ?        ?      189.5        7.9       ?       ? 
1 1 1   36   31   11 o     23.4   11.1    0.0000   0.0000          ?        ?   -17.2401  14.0475          ?        ?       23.4       11.1       ?       ? 
1 1 1   36   31   12 o    250.5    4.2    0.0000   0.0000          ?        ?   628.3053  21.0712          ?        ?      250.5        4.2       ?       ? 
1 1 1   36   31   13 o    444.2    4.2    0.0000   0.0000          ?        ?  1975.5858  37.0343          ?        ?      444.2        4.2       ?       ? 
1 1 1   36   31   14 o    218.4    3.4    0.0000   0.0000          ?        ?   477.6142  14.6860          ?        ?      218.4        3.4       ?       ? 
1 1 1   36   31   15 o    254.2    3.1    0.0000   0.0000          ?        ?   646.8224  15.9630          ?        ?      254.2        3.1       ?       ? 
1 1 1   36   31   16 o    410.4    3.4    0.0000   0.0000          ?        ?  1685.6971  28.0950          ?        ?      410.4        3.4       ?       ? 
1 1 1   36   31   17 o    574.5    3.7    0.0000   0.0000          ?        ?  3303.7109  42.1424          ?        ?      574.5        3.7       ?       ? 
1 1 1   36   31   18 o    112.6    4.8    0.0000   0.0000          ?        ?   127.0658  10.8549          ?        ?      112.6        4.8       ?       ? 
1 1 1   36   31   19 o    389.3    2.8    0.0000   0.0000          ?        ?  1516.4889  21.7097          ?        ?      389.3        2.8       ?       ? 
1 1 1   36   31   20 o    191.2    3.5    0.0000   0.0000          ?        ?   365.8729  13.4090          ?        ?      191.2        3.5       ?       ? 
1 1 1   36   31   21 o    146.8    3.5    0.0000   0.0000          ?        ?   215.8203  10.2163          ?        ?      146.8        3.5       ?       ? 
1 1 1   36   31   22 o    239.4    2.8    0.0000   0.0000          ?        ?   573.3925  13.4090          ?        ?      239.4        2.8       ?       ? 
1 1 1   36   31   23 o    300.8    2.5    0.0000   0.0000          ?        ?   905.4237  15.3245          ?        ?      300.8        2.5       ?       ? 
1 1 1   36   31   24 o    122.6    4.9    0.0000   0.0000          ?        ?   150.6911  12.1319          ?        ?      122.6        4.9       ?       ? 
1 1 1   36   31   25 o    284.7    2.7    0.0000   0.0000          ?        ?   810.9225  15.3245          ?        ?      284.7        2.7       ?       ? 
1 1 1   36   31   26 o     17.7    8.8    0.0000   0.0000          ?        ?   -33.8416  12.7704          ?        ?       17.7        8.8       ?       ? 
1 1 1   36   31   27 o    298.8    2.9    0.0000   0.0000          ?        ?   893.9303  17.2401          ?        ?      298.8        2.9       ?       ? 
1 1 1   36   31   28 o    133.5    5.0    0.0000   0.0000          ?        ?   178.7861  13.4090          ?        ?      133.5        5.0       ?       ? 
1 1 1   36   31   29 o    171.2    4.1    0.0000   0.0000          ?        ?   293.7199  14.0475          ?        ?      171.2        4.1       ?       ? 
1 1 1   36   31   30 o    169.3    4.5    0.0000   0.0000          ?        ?   287.3347  15.3245          ?        ?      169.3        4.5       ?       ? 
1 1 1   36   31   31 o     21.5   10.4    0.0000   0.0000          ?        ?   -23.6253  14.0475          ?        ?       21.5       10.4       ?       ? 
1 1 1   36   31   32 o    161.2    4.6    0.0000   0.0000          ?        ?   260.5168  14.6860          ?        ?      161.2        4.6       ?       ? 
1 1 1   36   31   33 o     72.3   10.2    0.0000   0.0000          ?        ?    52.9973  14.6860          ?        ?       72.3       10.2       ?       ? 
1 1 1   36   31   34 o     76.5    9.6    0.0000   0.0000          ?        ?    59.3825  14.6860          ?        ?       76.5        9.6       ?       ? 
1 1 1   36   31   35 f     28.8   12.7    0.0000   0.0000          ?        ?    -3.1926  14.0475          ?        ?       28.8       12.7       ?       ? 
1 1 1   36   31   36 o     70.4   10.4    0.0000   0.0000          ?        ?    50.4432  14.6860          ?        ?       70.4       10.4       ?       ? 
1 1 1   36   31   37 o    171.4    4.7    0.0000   0.0000          ?        ?   294.9970  15.9630          ?        ?      171.4        4.7       ?       ? 
1 1 1   36   31   38 o    132.3    6.0    0.0000   0.0000          ?        ?   176.2320  15.9630          ?        ?      132.3        6.0       ?       ? 
1 1 1   36   31   39 o    142.3    5.6    0.0000   0.0000          ?        ?   203.6884  15.9630          ?        ?      142.3        5.6       ?       ? 
1 1 1   36   31   40 o     90.1    8.5    0.0000   0.0000          ?        ?    82.3693  15.3245          ?        ?       90.1        8.5       ?       ? 
1 1 1   36   32    0 o    308.7    6.7  955.8669  41.5039   955.8669  41.5039   955.8669  41.5039      308.7      6.7      308.7        6.7     0.0     0.0 
1 1 1   36   32    1 o    399.1    5.5    0.0000   0.0000          ?        ?  1596.9426  44.0580          ?        ?      399.1        5.5       ?       ? 
1 1 1   36   32    2 o    287.5    4.9    0.0000   0.0000          ?        ?   828.1625  28.0950          ?        ?      287.5        4.9       ?       ? 
1 1 1   36   32    3 o    106.0   17.2    0.0000   0.0000          ?        ?   114.9339  36.3957          ?        ?      106.0       17.2       ?       ? 
1 1 1   36   32    4 o     93.9   20.9    0.0000   0.0000          ?        ?    94.5012  38.3113          ?        ?       93.9       20.9       ?       ? 
1 1 1   36   32    5 o    320.5    6.4    0.0000   0.0000          ?        ?  1030.5739  40.8654          ?        ?      320.5        6.4       ?       ? 
1 1 1   36   32    6 o    233.0    6.3    0.0000   0.0000          ?        ?   544.6590  29.3720          ?        ?      233.0        6.3       ?       ? 
1 1 1   36   32    7 o    315.7    5.5    0.0000   0.0000          ?        ?   999.2863  34.4802          ?        ?      315.7        5.5       ?       ? 
1 1 1   36   32    8 o    143.8   11.3    0.0000   0.0000          ?        ?   208.7966  32.5646          ?        ?      143.8       11.3       ?       ? 
1 1 1   36   32    9 o    107.2   16.4    0.0000   0.0000          ?        ?   117.4880  35.1187          ?        ?      107.2       16.4       ?       ? 
1 1 1   36   32   10 o    169.2    8.9    0.0000   0.0000          ?        ?   287.9732  30.0105          ?        ?      169.2        8.9       ?       ? 
1 1 1   36   32   11 o     76.9   21.3    0.0000   0.0000          ?        ?    63.2136  33.8416          ?        ?       76.9       21.3       ?       ? 
1 1 1   36   32   12 o    134.4    6.2    0.0000   0.0000          ?        ?   181.3401  16.6016          ?        ?      134.4        6.2       ?       ? 
1 1 1   36   32   13 o     23.6   11.3    0.0000   0.0000          ?        ?   -21.7097  15.3245          ?        ?       23.6       11.3       ?       ? 
1 1 1   36   32   14 o    196.5    5.2    0.0000   0.0000          ?        ?   386.9441  20.4327          ?        ?      196.5        5.2       ?       ? 
1 1 1   36   32   15 o    211.9    3.8    0.0000   0.0000          ?        ?   449.5192  15.9630          ?        ?      211.9        3.8       ?       ? 
1 1 1   36   32   16 o    431.4    3.6    0.0000   0.0000          ?        ?  1863.2061  30.6490          ?        ?      431.4        3.6       ?       ? 
1 1 1   36   32   17 o     73.7   10.4    0.0000   0.0000          ?        ?    54.9129  15.3245          ?        ?       73.7       10.4       ?       ? 
1 1 1   36   32   18 o    276.3    3.8    0.0000   0.0000          ?        ?   764.3104  21.0712          ?        ?      276.3        3.8       ?       ? 
1 1 1   36   32   19 o    240.2    2.9    0.0000   0.0000          ?        ?   577.2236  14.0475          ?        ?      240.2        2.9       ?       ? 
1 1 1   36   32   20 o    271.0    2.9    0.0000   0.0000          ?        ?   734.9384  15.9630          ?        ?      271.0        2.9       ?       ? 
1 1 1   36   32   21 o    247.1    3.1    0.0000   0.0000          ?        ?   611.0652  15.3245          ?        ?      247.1        3.1       ?       ? 
1 1 1   36   32   22 o     93.4    5.5    0.0000   0.0000          ?        ?    87.4775  10.2163          ?        ?       93.4        5.5       ?       ? 
1 1 1   36   32   23 o     18.9    9.2    0.0000   0.0000          ?        ?   -18.5171  10.8549          ?        ?       18.9        9.2       ?       ? 
1 1 1   36   32   24 o    202.8    3.3    0.0000   0.0000          ?        ?   411.8464  13.4090          ?        ?      202.8        3.3       ?       ? 
1 1 1   36   32   25 o    125.2    4.8    0.0000   0.0000          ?        ?   157.0763  12.1319          ?        ?      125.2        4.8       ?       ? 
1 1 1   36   32   26 o    378.7    2.5    0.0000   0.0000          ?        ?  1435.3966  19.1556          ?        ?      378.7        2.5       ?       ? 
1 1 1   36   32   27 o     98.6    6.5    0.0000   0.0000          ?        ?    97.6938  12.7704          ?        ?       98.6        6.5       ?       ? 
1 1 1   36   32   28 o    235.7    3.3    0.0000   0.0000          ?        ?   556.1523  15.3245          ?        ?      235.7        3.3       ?       ? 
1 1 1   36   32   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   32   30 o    132.8    5.1    0.0000   0.0000          ?        ?   176.8705  13.4090          ?        ?      132.8        5.1       ?       ? 
1 1 1   36   32   31 o     66.9   10.0    0.0000   0.0000          ?        ?    45.3350  13.4090          ?        ?       66.9       10.0       ?       ? 
1 1 1   36   32   32 o    120.8    6.1    0.0000   0.0000          ?        ?   146.8600  14.6860          ?        ?      120.8        6.1       ?       ? 
1 1 1   36   32   33 o    170.4    4.5    0.0000   0.0000          ?        ?   291.1659  15.3245          ?        ?      170.4        4.5       ?       ? 
1 1 1   36   32   34 o    142.2    5.2    0.0000   0.0000          ?        ?   203.0499  14.6860          ?        ?      142.2        5.2       ?       ? 
1 1 1   36   32   35 f     81.0    8.7    0.0000   0.0000          ?        ?    66.4062  14.0475          ?        ?       81.0        8.7       ?       ? 
1 1 1   36   32   36 o     20.4   10.0    0.0000   0.0000          ?        ?   -28.0950  14.0475          ?        ?       20.4       10.0       ?       ? 
1 1 1   36   32   37 o    119.1    6.2    0.0000   0.0000          ?        ?   143.0288  14.6860          ?        ?      119.1        6.2       ?       ? 
1 1 1   36   32   38 o    127.9    6.0    0.0000   0.0000          ?        ?   164.7386  15.3245          ?        ?      127.9        6.0       ?       ? 
1 1 1   36   33    0 o    152.6   27.4  258.6013  75.9841   258.6013  75.9841   258.6013  75.9841      152.6     27.4      152.6       27.4     0.0     0.0 
1 1 1   36   33    1 o    502.5    5.5    0.0000   0.0000          ?        ?  2531.7383  54.9129          ?        ?      502.5        5.5       ?       ? 
1 1 1   36   33    2 o    353.4    6.0    0.0000   0.0000          ?        ?  1252.7794  42.1424          ?        ?      353.4        6.0       ?       ? 
1 1 1   36   33    3 o    445.0    5.9    0.0000   0.0000          ?        ?  1985.8022  52.3588          ?        ?      445.0        5.9       ?       ? 
1 1 1   36   33    4 o     99.7   13.1    0.0000   0.0000          ?        ?   100.8864  26.1794          ?        ?       99.7       13.1       ?       ? 
1 1 1   36   33    5 o     48.3   19.4    0.0000   0.0000          ?        ?    12.1319  28.7335          ?        ?       48.3       19.4       ?       ? 
1 1 1   36   33    6 o     49.2   20.3    0.0000   0.0000          ?        ?     8.3008  32.5646          ?        ?       49.2       20.3       ?       ? 
1 1 1   36   33    7 f    150.4   11.0    0.0000   0.0000          ?        ?   228.5907  33.2031          ?        ?      150.4       11.0       ?       ? 
1 1 1   36   33    8 o    411.2    7.0    0.0000   0.0000          ?        ?  1698.4675  57.4669          ?        ?      411.2        7.0       ?       ? 
1 1 1   36   33    9 o    238.2    9.9    0.0000   0.0000          ?        ?   572.1154  47.2506          ?        ?      238.2        9.9       ?       ? 
1 1 1   36   33   10 o     55.4   22.0    0.0000   0.0000          ?        ?    18.5171  36.3957          ?        ?       55.4       22.0       ?       ? 
1 1 1   36   33   11 o    199.5    8.2    0.0000   0.0000          ?        ?   400.3531  32.5646          ?        ?      199.5        8.2       ?       ? 
1 1 1   36   33   12 o     71.5   23.9    0.0000   0.0000          ?        ?    51.7203  40.2269          ?        ?       71.5       23.9       ?       ? 
1 1 1   36   33   13 o    200.9    5.2    0.0000   0.0000          ?        ?   404.8227  21.0712          ?        ?      200.9        5.2       ?       ? 
1 1 1   36   33   14 o    203.7    4.9    0.0000   0.0000          ?        ?   415.6776  19.7942          ?        ?      203.7        4.9       ?       ? 
1 1 1   36   33   15 o    321.7    3.2    0.0000   0.0000          ?        ?  1035.6820  20.4327          ?        ?      321.7        3.2       ?       ? 
1 1 1   36   33   16 o    158.8    4.6    0.0000   0.0000          ?        ?   252.8546  14.6860          ?        ?      158.8        4.6       ?       ? 
1 1 1   36   33   17 o    161.0    4.8    0.0000   0.0000          ?        ?   259.8783  15.3245          ?        ?      161.0        4.8       ?       ? 
1 1 1   36   33   18 o     48.9   14.2    0.0000   0.0000          ?        ?    24.9023  14.6860          ?        ?       48.9       14.2       ?       ? 
1 1 1   36   33   19 o     62.7   13.1    0.0000   0.0000          ?        ?    41.5039  15.9630          ?        ?       62.7       13.1       ?       ? 
1 1 1   36   33   20 o    180.2    3.4    0.0000   0.0000          ?        ?   325.0075  12.1319          ?        ?      180.2        3.4       ?       ? 
1 1 1   36   33   21 o    203.1    3.5    0.0000   0.0000          ?        ?   413.1235  14.0475          ?        ?      203.1        3.5       ?       ? 
1 1 1   36   33   22 o     20.5    9.5    0.0000   0.0000          ?        ?    -8.9393   9.5778          ?        ?       20.5        9.5       ?       ? 
1 1 1   36   33   23 o    334.4    2.4    0.0000   0.0000          ?        ?  1118.6898  15.9630          ?        ?      334.4        2.4       ?       ? 
1 1 1   36   33   24 o    124.1    4.6    0.0000   0.0000          ?        ?   154.5222  11.4934          ?        ?      124.1        4.6       ?       ? 
1 1 1   36   33   25 f    195.1    3.3    0.0000   0.0000          ?        ?   381.1974  12.7704          ?        ?      195.1        3.3       ?       ? 
1 1 1   36   33   26 o    279.8    2.6    0.0000   0.0000          ?        ?   783.4660  14.6860          ?        ?      279.8        2.6       ?       ? 
1 1 1   36   33   27 o     49.7   12.3    0.0000   0.0000          ?        ?    26.1794  12.1319          ?        ?       49.7       12.3       ?       ? 
1 1 1   36   33   28 o     89.7    7.5    0.0000   0.0000          ?        ?    81.0922  13.4090          ?        ?       89.7        7.5       ?       ? 
1 1 1   36   33   29 o    277.8    2.9    0.0000   0.0000          ?        ?   772.6111  15.9630          ?        ?      277.8        2.9       ?       ? 
1 1 1   36   33   30 o     56.5   12.2    0.0000   0.0000          ?        ?    33.8416  13.4090          ?        ?       56.5       12.2       ?       ? 
1 1 1   36   33   31 f     47.8   13.0    0.0000   0.0000          ?        ?    24.2638  12.7704          ?        ?       47.8       13.0       ?       ? 
1 1 1   36   33   32 f     50.7   13.1    0.0000   0.0000          ?        ?    27.4564  13.4090          ?        ?       50.7       13.1       ?       ? 
1 1 1   36   33   33 o     91.6    8.0    0.0000   0.0000          ?        ?    84.9234  14.6860          ?        ?       91.6        8.0       ?       ? 
1 1 1   36   33   34 o    183.7    4.0    0.0000   0.0000          ?        ?   338.4165  14.6860          ?        ?      183.7        4.0       ?       ? 
1 1 1   36   33   35 o     31.0   13.1    0.0000   0.0000          ?        ?     1.2770  14.0475          ?        ?       31.0       13.1       ?       ? 
1 1 1   36   33   36 o     65.1   10.8    0.0000   0.0000          ?        ?    43.4195  14.0475          ?        ?       65.1       10.8       ?       ? 
1 1 1   36   34    0 o    269.0   12.6  733.6614  67.6833   733.6614  67.6833   733.6614  67.6833      269.0     12.6      269.0       12.6     0.0     0.0 
1 1 1   36   34    1 o    201.0   13.7    0.0000   0.0000          ?        ?   411.2079  54.9129          ?        ?      201.0       13.7       ?       ? 
1 1 1   36   34    2 o    244.7    7.0    0.0000   0.0000          ?        ?   601.4874  34.4802          ?        ?      244.7        7.0       ?       ? 
1 1 1   36   34    3 o    142.3    9.6    0.0000   0.0000          ?        ?   204.3269  27.4564          ?        ?      142.3        9.6       ?       ? 
1 1 1   36   34    4 o    259.1    6.7    0.0000   0.0000          ?        ?   674.2788  34.4802          ?        ?      259.1        6.7       ?       ? 
1 1 1   36   34    5 o     53.4   22.8    0.0000   0.0000          ?        ?     3.1926  42.7809          ?        ?       53.4       22.8       ?       ? 
1 1 1   36   34    6 o    100.3   15.3    0.0000   0.0000          ?        ?   102.8020  30.6490          ?        ?      100.3       15.3       ?       ? 
1 1 1   36   34    7 f     83.7   23.0    0.0000   0.0000          ?        ?    75.9841  39.5883          ?        ?       83.7       23.0       ?       ? 
1 1 1   36   34    8 o    256.3   10.0    0.0000   0.0000          ?        ?   663.4240  51.0817          ?        ?      256.3       10.0       ?       ? 
1 1 1   36   34    9 o    144.2   10.2    0.0000   0.0000          ?        ?   210.0736  29.3720          ?        ?      144.2       10.2       ?       ? 
1 1 1   36   34   10 o    304.1    8.3    0.0000   0.0000          ?        ?   930.9645  50.4432          ?        ?      304.1        8.3       ?       ? 
1 1 1   36   34   11 f    174.6   13.5    0.0000   0.0000          ?        ?   310.3215  47.2506          ?        ?      174.6       13.5       ?       ? 
1 1 1   36   34   12 o     51.9   23.1    0.0000   0.0000          ?        ?   -14.0475  48.5276          ?        ?       51.9       23.1       ?       ? 
1 1 1   36   34   13 o    117.3   25.5    0.0000   0.0000          ?        ?   151.9681  58.1055          ?        ?      117.3       25.5       ?       ? 
1 1 1   36   34   14 o     67.8   13.7    0.0000   0.0000          ?        ?    48.5276  17.8786          ?        ?       67.8       13.7       ?       ? 
1 1 1   36   34   15 o    454.6    3.4    0.0000   0.0000          ?        ?  2068.8101  31.2876          ?        ?      454.6        3.4       ?       ? 
1 1 1   36   34   16 o    186.4    3.9    0.0000   0.0000          ?        ?   347.9943  14.6860          ?        ?      186.4        3.9       ?       ? 
1 1 1   36   34   17 o    390.6    3.4    0.0000   0.0000          ?        ?  1527.3438  26.8179          ?        ?      390.6        3.4       ?       ? 
1 1 1   36   34   18 o     48.1   15.0    0.0000   0.0000          ?        ?    23.6253  15.9630          ?        ?       48.1       15.0       ?       ? 
1 1 1   36   34   19 o    132.9    6.2    0.0000   0.0000          ?        ?   177.5090  16.6016          ?        ?      132.9        6.2       ?       ? 
1 1 1   36   34   20 o    107.4    7.4    0.0000   0.0000          ?        ?   116.2109  15.9630          ?        ?      107.4        7.4       ?       ? 
1 1 1   36   34   21 o     40.7   11.8    0.0000   0.0000          ?        ?    17.2401  10.2163          ?        ?       40.7       11.8       ?       ? 
1 1 1   36   34   22 o    100.6    4.4    0.0000   0.0000          ?        ?   101.5249   8.9393          ?        ?      100.6        4.4       ?       ? 
1 1 1   36   34   23 o     22.5   10.4    0.0000   0.0000          ?        ?    -8.3008  10.8549          ?        ?       22.5       10.4       ?       ? 
1 1 1   36   34   24 o     60.0    9.0    0.0000   0.0000          ?        ?    36.3957  10.8549          ?        ?       60.0        9.0       ?       ? 
1 1 1   36   34   25 o    180.8    3.4    0.0000   0.0000          ?        ?   327.5616  12.1319          ?        ?      180.8        3.4       ?       ? 
1 1 1   36   34   26 o     29.9   12.4    0.0000   0.0000          ?        ?     2.5541  12.1319          ?        ?       29.9       12.4       ?       ? 
1 1 1   36   34   27 o     96.2    6.6    0.0000   0.0000          ?        ?    93.2242  12.7704          ?        ?       96.2        6.6       ?       ? 
1 1 1   36   34   28 o    184.8    3.6    0.0000   0.0000          ?        ?   342.2476  13.4090          ?        ?      184.8        3.6       ?       ? 
1 1 1   36   34   29 o    154.7    4.3    0.0000   0.0000          ?        ?   240.0841  13.4090          ?        ?      154.7        4.3       ?       ? 
1 1 1   36   34   30 o    293.4    2.8    0.0000   0.0000          ?        ?   862.0042  16.6016          ?        ?      293.4        2.8       ?       ? 
1 1 1   36   34   31 o     95.8    6.7    0.0000   0.0000          ?        ?    92.5856  12.7704          ?        ?       95.8        6.7       ?       ? 
1 1 1   36   34   32 o     82.1    8.6    0.0000   0.0000          ?        ?    68.3218  14.0475          ?        ?       82.1        8.6       ?       ? 
1 1 1   36   34   33 o     47.9   14.3    0.0000   0.0000          ?        ?    24.2638  14.6860          ?        ?       47.9       14.3       ?       ? 
1 1 1   36   34   34 o     31.0   13.0    0.0000   0.0000          ?        ?     2.5541  13.4090          ?        ?       31.0       13.0       ?       ? 
1 1 1   36   35    0 o     34.3   24.9 -141.1133  84.9234  -141.1133  84.9234  -141.1133  84.9234       34.3     24.9       34.3       24.9     0.0     0.0 
1 1 1   36   35    1 o    140.4   11.4    0.0000   0.0000          ?        ?   199.8573  31.9261          ?        ?      140.4       11.4       ?       ? 
1 1 1   36   35    2 o    286.6    7.6    0.0000   0.0000          ?        ?   826.2469  43.4195          ?        ?      286.6        7.6       ?       ? 
1 1 1   36   35    3 o    236.1    9.5    0.0000   0.0000          ?        ?   562.5375  44.6965          ?        ?      236.1        9.5       ?       ? 
1 1 1   36   35    4 o    265.6    9.3    0.0000   0.0000          ?        ?   711.9516  49.1662          ?        ?      265.6        9.3       ?       ? 
1 1 1   36   35    5 o    326.2    8.5    0.0000   0.0000          ?        ?  1072.0778  55.5514          ?        ?      326.2        8.5       ?       ? 
1 1 1   36   35    6 f    186.3    9.9    0.0000   0.0000          ?        ?   350.5484  37.0343          ?        ?      186.3        9.9       ?       ? 
1 1 1   36   35    7 o    218.5    8.0    0.0000   0.0000          ?        ?   480.8068  35.1187          ?        ?      218.5        8.0       ?       ? 
1 1 1   36   35    8 o    122.5   16.7    0.0000   0.0000          ?        ?   154.5222  40.8654          ?        ?      122.5       16.7       ?       ? 
1 1 1   36   35    9 o    287.7    8.4    0.0000   0.0000          ?        ?   833.9093  48.5276          ?        ?      287.7        8.4       ?       ? 
1 1 1   36   35   10 o    161.5   13.8    0.0000   0.0000          ?        ?   266.2635  44.6965          ?        ?      161.5       13.8       ?       ? 
1 1 1   36   35   11 o    267.3    6.8    0.0000   0.0000          ?        ?   718.3369  36.3957          ?        ?      267.3        6.8       ?       ? 
1 1 1   36   35   12 o    261.1   11.5    0.0000   0.0000          ?        ?   692.1575  60.0210          ?        ?      261.1       11.5       ?       ? 
1 1 1   36   35   13 o    171.1   16.6    0.0000   0.0000          ?        ?   302.0207  56.8284          ?        ?      171.1       16.6       ?       ? 
1 1 1   36   35   14 o    335.6    8.5    0.0000   0.0000          ?        ?  1135.9299  56.8284          ?        ?      335.6        8.5       ?       ? 
1 1 1   36   35   15 o    166.5    3.8    0.0000   0.0000          ?        ?   277.7569  12.7704          ?        ?      166.5        3.8       ?       ? 
1 1 1   36   35   16 o    257.3    3.1    0.0000   0.0000          ?        ?   662.7855  15.9630          ?        ?      257.3        3.1       ?       ? 
1 1 1   36   35   17 o    108.7    6.8    0.0000   0.0000          ?        ?   118.7650  14.6860          ?        ?      108.7        6.8       ?       ? 
1 1 1   36   35   18 o    203.3    4.6    0.0000   0.0000          ?        ?   414.4005  18.5171          ?        ?      203.3        4.6       ?       ? 
1 1 1   36   35   19 o    122.6    6.8    0.0000   0.0000          ?        ?   151.3296  16.6016          ?        ?      122.6        6.8       ?       ? 
1 1 1   36   35   20 o    193.0    4.3    0.0000   0.0000          ?        ?   373.5352  16.6016          ?        ?      193.0        4.3       ?       ? 
1 1 1   36   35   21 o    168.5    4.9    0.0000   0.0000          ?        ?   284.7806  16.6016          ?        ?      168.5        4.9       ?       ? 
1 1 1   36   35   22 o     18.3    8.9    0.0000   0.0000          ?        ?   -20.4327  10.8549          ?        ?       18.3        8.9       ?       ? 
1 1 1   36   35   23 o    169.6    3.2    0.0000   0.0000          ?        ?   287.9732  10.8549          ?        ?      169.6        3.2       ?       ? 
1 1 1   36   35   24 o    350.8    2.5    0.0000   0.0000          ?        ?  1231.7081  17.8786          ?        ?      350.8        2.5       ?       ? 
1 1 1   36   35   25 o    158.0    3.6    0.0000   0.0000          ?        ?   250.3005  11.4934          ?        ?      158.0        3.6       ?       ? 
1 1 1   36   35   26 o    139.8    4.3    0.0000   0.0000          ?        ?   196.0261  12.1319          ?        ?      139.8        4.3       ?       ? 
1 1 1   36   35   27 o     98.2    6.2    0.0000   0.0000          ?        ?    97.0553  12.1319          ?        ?       98.2        6.2       ?       ? 
1 1 1   36   35   28 o    111.6    5.4    0.0000   0.0000          ?        ?   125.1502  12.1319          ?        ?      111.6        5.4       ?       ? 
1 1 1   36   35   29 o    190.4    3.5    0.0000   0.0000          ?        ?   363.3188  13.4090          ?        ?      190.4        3.5       ?       ? 
1 1 1   36   35   30 o     36.6   13.4    0.0000   0.0000          ?        ?    11.4934  12.7704          ?        ?       36.6       13.4       ?       ? 
1 1 1   36   35   31 o     25.4   11.6    0.0000   0.0000          ?        ?    -8.9393  13.4090          ?        ?       25.4       11.6       ?       ? 
1 1 1   36   36    0 o    282.5   16.9  812.8381  94.5012   812.8381  94.5012   812.8381  94.5012      282.5     16.9      282.5       16.9     0.0     0.0 
1 1 1   36   36    1 o    267.0   16.4  731.7458  86.8389   731.7458  86.8389   731.7458  86.8389      267.0     16.4      267.0       16.4     0.0     0.0 
1 1 1   36   36    2 o     51.2   33.7    0.6385  84.2849     0.6385  84.2849     0.6385  84.2849       51.2     33.7       51.2       33.7     0.0     0.0 
1 1 1   36   36    3 o    170.6   16.8  303.9363  56.1899   303.9363  56.1899   303.9363  56.1899      170.6     16.8      170.6       16.8     0.0     0.0 
1 1 1   36   36    4 o    236.8    8.5  565.0916  40.2269   565.0916  40.2269   565.0916  40.2269      236.8      8.5      236.8        8.5     0.0     0.0 
1 1 1   36   36    5 o    206.9   21.4  452.7119  86.8389   452.7119  86.8389   452.7119  86.8389      206.9     21.4      206.9       21.4     0.0     0.0 
1 1 1   36   36    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   36    7 o    180.5   23.6  342.2476  84.9234   342.2476  84.9234   342.2476  84.9234      180.5     23.6      180.5       23.6     0.0     0.0 
1 1 1   36   36    8 o    420.7    7.5 1777.6442  63.2136  1777.6442  63.2136  1777.6442  63.2136      420.7      7.5      420.7        7.5     0.0     0.0 
1 1 1   36   36    9 o     89.2   34.7  114.2954  58.7440   114.2954  58.7440   114.2954  58.7440       89.2     34.7       89.2       34.7     0.0     0.0 
1 1 1   36   36   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   36   11 o    491.0   13.7 2444.2607 134.0895  2444.2607 134.0895  2444.2607 134.0895      491.0     13.7      491.0       13.7     0.0     0.0 
1 1 1   36   36   12 o    194.3   26.2  413.1235  98.9709   413.1235  98.9709   413.1235  98.9709      194.3     26.2      194.3       26.2     0.0     0.0 
1 1 1   36   36   13 o    106.7   32.0  146.2215  59.3825   146.2215  59.3825   146.2215  59.3825      106.7     32.0      106.7       32.0     0.0     0.0 
1 1 1   36   36   14 o    244.3   14.2  610.4266  68.9603   610.4266  68.9603   610.4266  68.9603      244.3     14.2      244.3       14.2     0.0     0.0 
1 1 1   36   36   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   36   36   16 o     27.0   16.3    7.6623  15.9630     7.6623  15.9630     7.6623  15.9630       27.0     16.3       27.0       16.3     0.0     0.0 
1 1 1   36   36   17 o    293.4    4.9  863.2812  28.7335   863.2812  28.7335   863.2812  28.7335      293.4      4.9      293.4        4.9     0.0     0.0 
1 1 1   36   36   18 o    127.3    8.1  164.7386  20.4327   164.7386  20.4327   164.7386  20.4327      127.3      8.1      127.3        8.1     0.0     0.0 
1 1 1   36   36   19 o    218.1    5.7  477.6142  24.9023   477.6142  24.9023   477.6142  24.9023      218.1      5.7      218.1        5.7     0.0     0.0 
1 1 1   36   36   20 o    450.5    5.0 2034.3300  45.3350  2034.3300  45.3350  2034.3300  45.3350      450.5      5.0      450.5        5.0     0.0     0.0 
1 1 1   36   36   21 o    109.9   12.2  126.4273  26.1794   126.4273  26.1794   126.4273  26.1794      109.9     12.2      109.9       12.2     0.0     0.0 
1 1 1   36   36   22 o    247.3    5.6  614.2578  27.4564   614.2578  27.4564   614.2578  27.4564      247.3      5.6      247.3        5.6     0.0     0.0 
1 1 1   36   36   23 o    289.7    3.4  840.2945  19.7942   840.2945  19.7942   840.2945  19.7942      289.7      3.4      289.7        3.4     0.0     0.0 
1 1 1   36   36   24 f    120.3    6.1  146.2215  14.6860   146.2215  14.6860   146.2215  14.6860      120.3      6.1      120.3        6.1     0.0     0.0 
1 1 1   36   36   25 o    276.8    3.7  767.5030  20.4327   767.5030  20.4327   767.5030  20.4327      276.8      3.7      276.8        3.7     0.0     0.0 
1 1 1   36   36   26 o     93.0    8.7   89.3930  15.9630    89.3930  15.9630    89.3930  15.9630       93.0      8.7       93.0        8.7     0.0     0.0 
1 1 1   36   36   27 o     20.7   13.9   -5.1082  15.9630    -5.1082  15.9630    -5.1082  15.9630       20.7     13.9       20.7       13.9     0.0     0.0 
1 1 1   36   36   28 o     17.4   12.4  -19.7942  17.2401   -19.7942  17.2401   -19.7942  17.2401       17.4     12.4       17.4       12.4     0.0     0.0 
1 1 1   37    0    0 o     33.9   21.9    1.9156  33.2031     1.9156  33.2031     1.9156  33.2031       33.9     21.9       33.9       21.9     0.0     0.0 
1 1 1   37    0    1 o    597.4    3.8 3569.3359  45.9736  3569.3359  45.9736  3569.3359  45.9736      597.4      3.8      597.4        3.8     0.0     0.0 
1 1 1   37    0    2 o    639.1    3.8 4085.2612  48.5276  4085.2612  48.5276  4085.2612  48.5276      639.1      3.8      639.1        3.8     0.0     0.0 
1 1 1   37    0    3 o    348.4    3.2 1214.4681  22.3483  1214.4681  22.3483  1214.4681  22.3483      348.4      3.2      348.4        3.2     0.0     0.0 
1 1 1   37    0    4 o    770.5    4.3 5938.2510  66.4062  5938.2510  66.4062  5938.2510  66.4062      770.5      4.3      770.5        4.3     0.0     0.0 
1 1 1   37    0    5 o    257.1    3.9  661.5084  19.7942   661.5084  19.7942   661.5084  19.7942      257.1      3.9      257.1        3.9     0.0     0.0 
1 1 1   37    0    6 o    662.6    3.8 4390.4746  50.4432  4390.4746  50.4432  4390.4746  50.4432      662.6      3.8      662.6        3.8     0.0     0.0 
1 1 1   37    0    7 o    486.1    3.5 2363.1685  34.4802  2363.1685  34.4802  2363.1685  34.4802      486.1      3.5      486.1        3.5     0.0     0.0 
1 1 1   37    0    8 o    885.4    4.8 7841.0454  84.9234  7841.0454  84.9234  7841.0454  84.9234      885.4      4.8      885.4        4.8     0.0     0.0 
1 1 1   37    0    9 o    456.3    3.6 2082.8577  32.5646  2082.8577  32.5646  2082.8577  32.5646      456.3      3.6      456.3        3.6     0.0     0.0 
1 1 1   37    0   10 f     97.3    7.6   96.4168  14.6860    96.4168  14.6860    96.4168  14.6860       97.3      7.6       97.3        7.6     0.0     0.0 
1 1 1   37    0   11 o     71.1   12.2   54.2743  15.9630    54.2743  15.9630    54.2743  15.9630       71.1     12.2       71.1       12.2     0.0     0.0 
1 1 1   37    0   12 o    985.5    5.1 9714.4678 100.8864  9714.4678 100.8864  9714.4678 100.8864      985.5      5.1      985.5        5.1     0.0     0.0 
1 1 1   37    0   13 o    207.0    4.2  429.0865  17.2401   429.0865  17.2401   429.0865  17.2401      207.0      4.2      207.0        4.2     0.0     0.0 
1 1 1   37    0   14 o     16.7   12.3  -70.2374  26.8179   -70.2374  26.8179   -70.2374  26.8179       16.7     12.3       16.7       12.3     0.0     0.0 
1 1 1   37    0   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    0   16 o    671.2    4.1 4505.4082  55.5514  4505.4082  55.5514  4505.4082  55.5514      671.2      4.1      671.2        4.1     0.0     0.0 
1 1 1   37    0   17 o   1127.2    5.6 12708.4961 127.0658 12708.4961 127.0658 12708.4961 127.0658     1127.2      5.6     1127.2        5.6     0.0     0.0 
1 1 1   37    0   18 o    979.0    5.4 9586.7637 106.6331  9586.7637 106.6331  9586.7637 106.6331      979.0      5.4      979.0        5.4     0.0     0.0 
1 1 1   37    0   19 o   1061.4    5.6 11267.3525 118.7650 11267.3525 118.7650 11267.3525 118.7650     1061.4      5.6     1061.4        5.6     0.0     0.0 
1 1 1   37    0   20 o    534.2    4.2 2854.1917  45.3350  2854.1917  45.3350  2854.1917  45.3350      534.2      4.2      534.2        4.2     0.0     0.0 
1 1 1   37    0   21 o   1444.8    7.3 20881.5723 210.7121 20881.5723 210.7121 20881.5723 210.7121     1444.8      7.3     1444.8        7.3     0.0     0.0 
1 1 1   37    0   22 o    591.5    3.7 3499.7368  43.4195  3499.7368  43.4195  3499.7368  43.4195      591.5      3.7      591.5        3.7     0.0     0.0 
1 1 1   37    0   23 o    493.0    3.6 2430.8518  35.7572  2430.8518  35.7572  2430.8518  35.7572      493.0      3.6      493.0        3.6     0.0     0.0 
1 1 1   37    0   24 o    259.3    4.6  673.0018  23.6253   673.0018  23.6253   673.0018  23.6253      259.3      4.6      259.3        4.6     0.0     0.0 
1 1 1   37    0   25 o    749.8    4.3 5622.8213  64.4907  5622.8213  64.4907  5622.8213  64.4907      749.8      4.3      749.8        4.3     0.0     0.0 
1 1 1   37    0   26 o    510.7    3.8 2608.3608  38.3113  2608.3608  38.3113  2608.3608  38.3113      510.7      3.8      510.7        3.8     0.0     0.0 
1 1 1   37    0   27 o    586.2    3.9 3436.5234  45.3350  3436.5234  45.3350  3436.5234  45.3350      586.2      3.9      586.2        3.9     0.0     0.0 
1 1 1   37    0   28 o    179.0    6.4  321.8149  22.9868   321.8149  22.9868   321.8149  22.9868      179.0      6.4      179.0        6.4     0.0     0.0 
1 1 1   37    0   29 o    571.2    3.7 3263.4841  42.7809  3263.4841  42.7809  3263.4841  42.7809      571.2      3.7      571.2        3.7     0.0     0.0 
1 1 1   37    0   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    0   31 o    670.9    4.0 4501.5776  53.6358  4501.5776  53.6358  4501.5776  53.6358      670.9      4.0      670.9        4.0     0.0     0.0 
1 1 1   37    0   32 o    512.6    3.7 2628.1550  38.3113  2628.1550  38.3113  2628.1550  38.3113      512.6      3.7      512.6        3.7     0.0     0.0 
1 1 1   37    0   33 o    808.5    4.5 6538.4614  72.1529  6538.4614  72.1529  6538.4614  72.1529      808.5      4.5      808.5        4.5     0.0     0.0 
1 1 1   37    0   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    0   35 o    106.9   10.0  117.4880  21.0712   117.4880  21.0712   117.4880  21.0712      106.9     10.0      106.9       10.0     0.0     0.0 
1 1 1   37    0   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    0   37 o     98.9    9.9  100.8864  19.1556   100.8864  19.1556   100.8864  19.1556       98.9      9.9       98.9        9.9     0.0     0.0 
1 1 1   37    0   38 o     19.0   13.6  -28.0950  21.7097   -28.0950  21.7097   -28.0950  21.7097       19.0     13.6       19.0       13.6     0.0     0.0 
1 1 1   37    0   39 o    618.5    3.7 3826.6599  45.9736  3826.6599  45.9736  3826.6599  45.9736      618.5      3.7      618.5        3.7     0.0     0.0 
1 1 1   37    0   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    0   41 f    428.0    3.8 1832.5571  32.5646  1832.5571  32.5646  1832.5571  32.5646      428.0      3.8      428.0        3.8     0.0     0.0 
1 1 1   37    0   42 o    853.3    4.6 7284.2549  77.8996  7284.2549  77.8996  7284.2549  77.8996      853.3      4.6      853.3        4.6     0.0     0.0 
1 1 1   37    0   43 o    315.7    4.5  997.3708  28.0950   997.3708  28.0950   997.3708  28.0950      315.7      4.5      315.7        4.5     0.0     0.0 
1 1 1   37    0   44 o    534.2    3.9 2854.8303  42.1424  2854.8303  42.1424  2854.8303  42.1424      534.2      3.9      534.2        3.9     0.0     0.0 
1 1 1   37    0   45 o     41.4   23.2   23.6253  28.7335    23.6253  28.7335    23.6253  28.7335       41.4     23.2       41.4       23.2     0.0     0.0 
1 1 1   37    0   46 o    216.8    5.6  471.2290  24.2638   471.2290  24.2638   471.2290  24.2638      216.8      5.6      216.8        5.6     0.0     0.0 
1 1 1   37    0   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    0   48 o    393.9    4.0 1552.8845  31.2876  1552.8845  31.2876  1552.8845  31.2876      393.9      4.0      393.9        4.0     0.0     0.0 
1 1 1   37    0   49 o    575.4    4.0 3313.2888  45.9736  3313.2888  45.9736  3313.2888  45.9736      575.4      4.0      575.4        4.0     0.0     0.0 
1 1 1   37    0   50 o    296.6    5.0  881.1599  29.3720   881.1599  29.3720   881.1599  29.3720      296.6      5.0      296.6        5.0     0.0     0.0 
1 1 1   37    0   51 o    376.2    4.1 1416.2410  30.6490  1416.2410  30.6490  1416.2410  30.6490      376.2      4.1      376.2        4.1     0.0     0.0 
1 1 1   37    0   52 o    403.5    4.0 1629.5072  32.5646  1629.5072  32.5646  1629.5072  32.5646      403.5      4.0      403.5        4.0     0.0     0.0 
1 1 1   37    0   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    0   54 o    219.2    5.8  482.0838  25.5409   482.0838  25.5409   482.0838  25.5409      219.2      5.8      219.2        5.8     0.0     0.0 
1 1 1   37    0   55 o     14.9   11.1  -74.0685  24.2638   -74.0685  24.2638   -74.0685  24.2638       14.9     11.1       14.9       11.1     0.0     0.0 
1 1 1   37    0   56 o     18.5   13.5  -46.6121  25.5409   -46.6121  25.5409   -46.6121  25.5409       18.5     13.5       18.5       13.5     0.0     0.0 
1 1 1   37    0   57 f    102.7   13.1  111.1028  26.1794   111.1028  26.1794   111.1028  26.1794      102.7     13.1      102.7       13.1     0.0     0.0 
1 1 1   37    0   58 o     26.8   18.1   -8.9393  26.8179    -8.9393  26.8179    -8.9393  26.8179       26.8     18.1       26.8       18.1     0.0     0.0 
1 1 1   37    0   59 o     68.0   21.9   59.3825  26.1794    59.3825  26.1794    59.3825  26.1794       68.0     21.9       68.0       21.9     0.0     0.0 
1 1 1   37    0   60 o    553.9    3.9 3071.2891  43.4195  3071.2891  43.4195  3071.2891  43.4195      553.9      3.9      553.9        3.9     0.0     0.0 
1 1 1   37    0   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    0   62 o    211.9    7.2  452.0733  30.6490   452.0733  30.6490   452.0733  30.6490      211.9      7.2      211.9        7.2     0.0     0.0 
1 1 1   37    0   63 o    222.2    6.6  496.1313  29.3720   496.1313  29.3720   496.1313  29.3720      222.2      6.6      222.2        6.6     0.0     0.0 
1 1 1   37    0   64 o     21.0   15.1  -37.0343  27.4564   -37.0343  27.4564   -37.0343  27.4564       21.0     15.1       21.0       15.1     0.0     0.0 
1 1 1   37    0   65 o    131.3   11.1  177.5090  28.7335   177.5090  28.7335   177.5090  28.7335      131.3     11.1      131.3       11.1     0.0     0.0 
1 1 1   37    0   66 o     19.6   14.4  -57.4669  30.0105   -57.4669  30.0105   -57.4669  30.0105       19.6     14.4       19.6       14.4     0.0     0.0 
1 1 1   37    0   67 o    309.7    5.0  962.2521  30.6490   962.2521  30.6490   962.2521  30.6490      309.7      5.0      309.7        5.0     0.0     0.0 
1 1 1   37    0   68 o    286.2    5.2  822.4159  30.0105   822.4159  30.0105   822.4159  30.0105      286.2      5.2      286.2        5.2     0.0     0.0 
1 1 1   37    1    0 o    163.4    4.7  267.5406  15.3245   267.5406  15.3245   267.5406  15.3245      163.4      4.7      163.4        4.7     0.0     0.0 
1 1 1   37    1    1 o    500.2    2.5    0.0000   0.0000          ?        ?  2502.3662  24.9023          ?        ?      500.2        2.5       ?       ? 
1 1 1   37    1    2 o    450.4    2.7    0.0000   0.0000          ?        ?  2028.5833  24.2638          ?        ?      450.4        2.7       ?       ? 
1 1 1   37    1    3 o   1325.3    4.6    0.0000   0.0000          ?        ? 17565.7305 122.5962          ?        ?     1325.3        4.6       ?       ? 
1 1 1   37    1    4 o    607.1    2.6    0.0000   0.0000          ?        ?  3685.5469  31.2876          ?        ?      607.1        2.6       ?       ? 
1 1 1   37    1    5 o    700.8    2.9    0.0000   0.0000          ?        ?  4911.5083  40.8654          ?        ?      700.8        2.9       ?       ? 
1 1 1   37    1    6 o    143.2    4.2    0.0000   0.0000          ?        ?   204.9654  12.1319          ?        ?      143.2        4.2       ?       ? 
1 1 1   37    1    7 o   1389.7    4.8    0.0000   0.0000          ?        ? 19314.6406 133.4510          ?        ?     1389.7        4.8       ?       ? 
1 1 1   37    1    8 o    887.3    3.4    0.0000   0.0000          ?        ?  7874.2485  60.6596          ?        ?      887.3        3.4       ?       ? 
1 1 1   37    1    9 o    587.5    2.7    0.0000   0.0000          ?        ?  3451.8477  31.2876          ?        ?      587.5        2.7       ?       ? 
1 1 1   37    1   10 o    482.6    2.4    0.0000   0.0000          ?        ?  2329.3269  22.9868          ?        ?      482.6        2.4       ?       ? 
1 1 1   37    1   11 o    908.5    3.4    0.0000   0.0000          ?        ?  8253.5303  61.2981          ?        ?      908.5        3.4       ?       ? 
1 1 1   37    1   12 o    635.1    2.8    0.0000   0.0000          ?        ?  4033.5413  35.1187          ?        ?      635.1        2.8       ?       ? 
1 1 1   37    1   13 o    296.6    2.5    0.0000   0.0000          ?        ?   879.8828  14.6860          ?        ?      296.6        2.5       ?       ? 
1 1 1   37    1   14 o    506.3    2.6    0.0000   0.0000          ?        ?  2563.6643  26.1794          ?        ?      506.3        2.6       ?       ? 
1 1 1   37    1   15 o    974.6    3.6    0.0000   0.0000          ?        ?  9499.9248  69.5989          ?        ?      974.6        3.6       ?       ? 
1 1 1   37    1   16 o   1036.1    3.7    0.0000   0.0000          ?        ? 10736.1025  77.2611          ?        ?     1036.1        3.7       ?       ? 
1 1 1   37    1   17 o    872.1    3.3    0.0000   0.0000          ?        ?  7606.0693  58.1055          ?        ?      872.1        3.3       ?       ? 
1 1 1   37    1   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    1   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    1   20 o   1080.5    3.8    0.0000   0.0000          ?        ? 11677.2842  83.0078          ?        ?     1080.5        3.8       ?       ? 
1 1 1   37    1   21 o    853.3    3.6    0.0000   0.0000          ?        ?  7281.7007  61.2981          ?        ?      853.3        3.6       ?       ? 
1 1 1   37    1   22 o    402.8    2.5    0.0000   0.0000          ?        ?  1622.4835  20.4327          ?        ?      402.8        2.5       ?       ? 
1 1 1   37    1   23 o     44.3   16.1    0.0000   0.0000          ?        ?    15.9630  18.5171          ?        ?       44.3       16.1       ?       ? 
1 1 1   37    1   24 o    225.0    3.0    0.0000   0.0000          ?        ?   506.3477  13.4090          ?        ?      225.0        3.0       ?       ? 
1 1 1   37    1   25 o    955.9    3.6    0.0000   0.0000          ?        ?  9139.7988  68.9603          ?        ?      955.9        3.6       ?       ? 
1 1 1   37    1   26 o    332.7    2.6    0.0000   0.0000          ?        ?  1107.1964  17.2401          ?        ?      332.7        2.6       ?       ? 
1 1 1   37    1   27 o    771.6    3.1    0.0000   0.0000          ?        ?  5954.8525  47.8891          ?        ?      771.6        3.1       ?       ? 
1 1 1   37    1   28 o    513.1    2.5    0.0000   0.0000          ?        ?  2632.6245  25.5409          ?        ?      513.1        2.5       ?       ? 
1 1 1   37    1   29 o    413.0    2.6    0.0000   0.0000          ?        ?  1706.1299  21.0712          ?        ?      413.0        2.6       ?       ? 
1 1 1   37    1   30 o    665.3    2.9    0.0000   0.0000          ?        ?  4426.8701  38.3113          ?        ?      665.3        2.9       ?       ? 
1 1 1   37    1   31 o    142.2    5.2    0.0000   0.0000          ?        ?   202.4114  14.6860          ?        ?      142.2        5.2       ?       ? 
1 1 1   37    1   32 o    541.0    2.5    0.0000   0.0000          ?        ?  2927.6216  27.4564          ?        ?      541.0        2.5       ?       ? 
1 1 1   37    1   33 o    613.1    2.7    0.0000   0.0000          ?        ?  3759.6152  33.2031          ?        ?      613.1        2.7       ?       ? 
1 1 1   37    1   34 o    370.9    2.8    0.0000   0.0000          ?        ?  1376.0142  20.4327          ?        ?      370.9        2.8       ?       ? 
1 1 1   37    1   35 o    119.8    6.1    0.0000   0.0000          ?        ?   143.6674  14.6860          ?        ?      119.8        6.1       ?       ? 
1 1 1   37    1   36 o    525.1    2.6    0.0000   0.0000          ?        ?  2757.7749  26.8179          ?        ?      525.1        2.6       ?       ? 
1 1 1   37    1   37 o     21.5   10.4    0.0000   0.0000          ?        ?   -24.2638  14.0475          ?        ?       21.5       10.4       ?       ? 
1 1 1   37    1   38 o    134.4    5.5    0.0000   0.0000          ?        ?   180.7016  14.6860          ?        ?      134.4        5.5       ?       ? 
1 1 1   37    1   39 o     62.6   13.2    0.0000   0.0000          ?        ?    40.8654  15.9630          ?        ?       62.6       13.2       ?       ? 
1 1 1   37    1   40 o    311.3    3.0    0.0000   0.0000          ?        ?   969.2759  18.5171          ?        ?      311.3        3.0       ?       ? 
1 1 1   37    1   41 o    460.8    2.6    0.0000   0.0000          ?        ?  2123.7229  23.6253          ?        ?      460.8        2.6       ?       ? 
1 1 1   37    1   42 f    485.1    2.7    0.0000   0.0000          ?        ?  2354.2292  26.1794          ?        ?      485.1        2.7       ?       ? 
1 1 1   37    1   43 o    405.0    2.7    0.0000   0.0000          ?        ?  1641.0006  21.7097          ?        ?      405.0        2.7       ?       ? 
1 1 1   37    1   44 o    286.5    3.1    0.0000   0.0000          ?        ?   821.1389  17.8786          ?        ?      286.5        3.1       ?       ? 
1 1 1   37    1   45 o    337.5    2.8    0.0000   0.0000          ?        ?  1139.1226  19.1556          ?        ?      337.5        2.8       ?       ? 
1 1 1   37    1   46 o    234.5    3.7    0.0000   0.0000          ?        ?   550.4056  17.2401          ?        ?      234.5        3.7       ?       ? 
1 1 1   37    1   47 o    308.7    2.9    0.0000   0.0000          ?        ?   953.3128  17.8786          ?        ?      308.7        2.9       ?       ? 
1 1 1   37    1   48 o    272.3    3.3    0.0000   0.0000          ?        ?   741.9621  17.8786          ?        ?      272.3        3.3       ?       ? 
1 1 1   37    1   49 o    310.1    3.0    0.0000   0.0000          ?        ?   962.2521  18.5171          ?        ?      310.1        3.0       ?       ? 
1 1 1   37    1   50 o    458.4    2.6    0.0000   0.0000          ?        ?  2102.0132  24.2638          ?        ?      458.4        2.6       ?       ? 
1 1 1   37    1   51 o    330.3    3.2    0.0000   0.0000          ?        ?  1091.8719  21.0712          ?        ?      330.3        3.2       ?       ? 
1 1 1   37    1   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    1   53 o    227.7    4.1    0.0000   0.0000          ?        ?   519.1181  18.5171          ?        ?      227.7        4.1       ?       ? 
1 1 1   37    1   54 f    282.9    3.5    0.0000   0.0000          ?        ?   800.7061  19.7942          ?        ?      282.9        3.5       ?       ? 
1 1 1   37    1   55 o    190.3    5.0    0.0000   0.0000          ?        ?   362.6803  19.1556          ?        ?      190.3        5.0       ?       ? 
1 1 1   37    1   56 o    144.7    6.4    0.0000   0.0000          ?        ?   210.0736  18.5171          ?        ?      144.7        6.4       ?       ? 
1 1 1   37    1   57 o     42.3   16.0    0.0000   0.0000          ?        ?    13.4090  18.5171          ?        ?       42.3       16.0       ?       ? 
1 1 1   37    1   58 o     27.4   12.9    0.0000   0.0000          ?        ?   -20.4327  18.5171          ?        ?       27.4       12.9       ?       ? 
1 1 1   37    1   59 o    112.4    8.5    0.0000   0.0000          ?        ?   127.0658  19.1556          ?        ?      112.4        8.5       ?       ? 
1 1 1   37    1   60 o    293.4    3.8    0.0000   0.0000          ?        ?   862.0042  22.3483          ?        ?      293.4        3.8       ?       ? 
1 1 1   37    1   61 o     66.5   16.0    0.0000   0.0000          ?        ?    47.2506  21.0712          ?        ?       66.5       16.0       ?       ? 
1 1 1   37    1   62 o    150.2    6.6    0.0000   0.0000          ?        ?   226.6752  19.7942          ?        ?      150.2        6.6       ?       ? 
1 1 1   37    1   63 o     21.2   10.7    0.0000   0.0000          ?        ?   -57.4669  19.7942          ?        ?       21.2       10.7       ?       ? 
1 1 1   37    1   64 o    251.1    4.2    0.0000   0.0000          ?        ?   632.1364  21.0712          ?        ?      251.1        4.2       ?       ? 
1 1 1   37    1   65 o     73.6   14.0    0.0000   0.0000          ?        ?    57.4669  19.7942          ?        ?       73.6       14.0       ?       ? 
1 1 1   37    1   66 f     79.3   12.1    0.0000   0.0000          ?        ?    64.4907  19.1556          ?        ?       79.3       12.1       ?       ? 
1 1 1   37    1   67 o    154.8    6.4    0.0000   0.0000          ?        ?   241.3612  19.7942          ?        ?      154.8        6.4       ?       ? 
1 1 1   37    1   68 o    114.4    8.7    0.0000   0.0000          ?        ?   132.8125  19.7942          ?        ?      114.4        8.7       ?       ? 
1 1 1   37    2    0 o    168.9    4.9  286.0577  16.6016   286.0577  16.6016   286.0577  16.6016      168.9      4.9      168.9        4.9     0.0     0.0 
1 1 1   37    2    1 o   1173.4    4.2    0.0000   0.0000          ?        ? 13770.3584  97.6938          ?        ?     1173.4        4.2       ?       ? 
1 1 1   37    2    2 o    651.0    2.7    0.0000   0.0000          ?        ?  4237.8682  35.7572          ?        ?      651.0        2.7       ?       ? 
1 1 1   37    2    3 o    577.7    2.7    0.0000   0.0000          ?        ?  3337.5527  31.2876          ?        ?      577.7        2.7       ?       ? 
1 1 1   37    2    4 o   1311.1    4.7    0.0000   0.0000          ?        ? 17192.1953 123.2347          ?        ?     1311.1        4.7       ?       ? 
1 1 1   37    2    5 o   1389.0    4.9    0.0000   0.0000          ?        ? 19297.4004 136.0051          ?        ?     1389.0        4.9       ?       ? 
1 1 1   37    2    6 o   1133.2    4.1    0.0000   0.0000          ?        ? 12841.9463  93.2242          ?        ?     1133.2        4.1       ?       ? 
1 1 1   37    2    7 o    288.5    3.0    0.0000   0.0000          ?        ?   832.6321  17.2401          ?        ?      288.5        3.0       ?       ? 
1 1 1   37    2    8 o    929.1    3.5    0.0000   0.0000          ?        ?  8632.8125  64.4907          ?        ?      929.1        3.5       ?       ? 
1 1 1   37    2    9 o    889.8    3.5    0.0000   0.0000          ?        ?  7918.9448  62.5751          ?        ?      889.8        3.5       ?       ? 
1 1 1   37    2   10 o   1060.2    3.9    0.0000   0.0000          ?        ? 11241.8115  82.3693          ?        ?     1060.2        3.9       ?       ? 
1 1 1   37    2   11 o    341.7    2.5    0.0000   0.0000          ?        ?  1167.8560  17.2401          ?        ?      341.7        2.5       ?       ? 
1 1 1   37    2   12 o    435.4    2.4    0.0000   0.0000          ?        ?  1895.7706  21.0712          ?        ?      435.4        2.4       ?       ? 
1 1 1   37    2   13 o   1059.3    3.8    0.0000   0.0000          ?        ? 11222.6562  80.4537          ?        ?     1059.3        3.8       ?       ? 
1 1 1   37    2   14 o    817.3    3.1    0.0000   0.0000          ?        ?  6679.5747  51.0817          ?        ?      817.3        3.1       ?       ? 
1 1 1   37    2   15 o    726.5    2.9    0.0000   0.0000          ?        ?  5278.6582  42.7809          ?        ?      726.5        2.9       ?       ? 
1 1 1   37    2   16 o    329.5    2.9    0.0000   0.0000          ?        ?  1085.4868  19.1556          ?        ?      329.5        2.9       ?       ? 
1 1 1   37    2   17 o    830.3    3.2    0.0000   0.0000          ?        ?  6895.3950  53.6358          ?        ?      830.3        3.2       ?       ? 
1 1 1   37    2   18 o    322.7    2.6    0.0000   0.0000          ?        ?  1041.4288  16.6016          ?        ?      322.7        2.6       ?       ? 
1 1 1   37    2   19 o    669.0    2.9    0.0000   0.0000          ?        ?  4476.0366  38.3113          ?        ?      669.0        2.9       ?       ? 
1 1 1   37    2   20 o   1301.7    4.5    0.0000   0.0000          ?        ? 16948.2793 116.2109          ?        ?     1301.7        4.5       ?       ? 
1 1 1   37    2   21 f    104.2    7.0    0.0000   0.0000          ?        ?   108.5487  14.6860          ?        ?      104.2        7.0       ?       ? 
1 1 1   37    2   22 o    346.8    2.9    0.0000   0.0000          ?        ?  1202.9747  19.7942          ?        ?      346.8        2.9       ?       ? 
1 1 1   37    2   23 o    925.4    3.4    0.0000   0.0000          ?        ?  8565.7676  63.8522          ?        ?      925.4        3.4       ?       ? 
1 1 1   37    2   24 o    277.0    2.7    0.0000   0.0000          ?        ?   767.5030  14.6860          ?        ?      277.0        2.7       ?       ? 
1 1 1   37    2   25 o    664.4    3.0    0.0000   0.0000          ?        ?  4414.7388  39.5883          ?        ?      664.4        3.0       ?       ? 
1 1 1   37    2   26 o    982.8    3.6    0.0000   0.0000          ?        ?  9661.4707  71.5144          ?        ?      982.8        3.6       ?       ? 
1 1 1   37    2   27 o    400.3    2.6    0.0000   0.0000          ?        ?  1602.6893  20.4327          ?        ?      400.3        2.6       ?       ? 
1 1 1   37    2   28 o    345.3    2.6    0.0000   0.0000          ?        ?  1192.1199  17.8786          ?        ?      345.3        2.6       ?       ? 
1 1 1   37    2   29 o   1239.4    4.6    0.0000   0.0000          ?        ? 15367.2998 113.6568          ?        ?     1239.4        4.6       ?       ? 
1 1 1   37    2   30 o    300.3    2.9    0.0000   0.0000          ?        ?   902.2311  17.2401          ?        ?      300.3        2.9       ?       ? 
1 1 1   37    2   31 o    986.8    3.6    0.0000   0.0000          ?        ?  9740.0088  70.8759          ?        ?      986.8        3.6       ?       ? 
1 1 1   37    2   32 o    106.8    8.1    0.0000   0.0000          ?        ?   114.2954  17.2401          ?        ?      106.8        8.1       ?       ? 
1 1 1   37    2   33 o    135.8    5.4    0.0000   0.0000          ?        ?   184.5327  14.6860          ?        ?      135.8        5.4       ?       ? 
1 1 1   37    2   34 o    475.8    2.6    0.0000   0.0000          ?        ?  2264.1978  24.9023          ?        ?      475.8        2.6       ?       ? 
1 1 1   37    2   35 o    495.4    2.5    0.0000   0.0000          ?        ?  2454.4771  24.9023          ?        ?      495.4        2.5       ?       ? 
1 1 1   37    2   36 o     25.0   11.8    0.0000   0.0000          ?        ?   -19.7942  15.9630          ?        ?       25.0       11.8       ?       ? 
1 1 1   37    2   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    2   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    2   39 o    271.5    3.3    0.0000   0.0000          ?        ?   737.4925  17.8786          ?        ?      271.5        3.3       ?       ? 
1 1 1   37    2   40 o    555.4    2.8    0.0000   0.0000          ?        ?  3085.9749  30.6490          ?        ?      555.4        2.8       ?       ? 
1 1 1   37    2   41 o    288.2    3.0    0.0000   0.0000          ?        ?   830.7167  17.2401          ?        ?      288.2        3.0       ?       ? 
1 1 1   37    2   42 o    700.9    2.8    0.0000   0.0000          ?        ?  4913.4238  39.5883          ?        ?      700.9        2.8       ?       ? 
1 1 1   37    2   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    2   44 o    128.7    6.4    0.0000   0.0000          ?        ?   166.0156  16.6016          ?        ?      128.7        6.4       ?       ? 
1 1 1   37    2   45 o    231.1    3.6    0.0000   0.0000          ?        ?   534.4426  16.6016          ?        ?      231.1        3.6       ?       ? 
1 1 1   37    2   46 o     38.2   14.7    0.0000   0.0000          ?        ?     9.5778  15.9630          ?        ?       38.2       14.7       ?       ? 
1 1 1   37    2   47 o    348.3    2.8    0.0000   0.0000          ?        ?  1213.8297  19.7942          ?        ?      348.3        2.8       ?       ? 
1 1 1   37    2   48 o    306.7    3.0    0.0000   0.0000          ?        ?   941.1808  18.5171          ?        ?      306.7        3.0       ?       ? 
1 1 1   37    2   49 o    304.4    3.1    0.0000   0.0000          ?        ?   927.1334  19.1556          ?        ?      304.4        3.1       ?       ? 
1 1 1   37    2   50 o    200.3    4.5    0.0000   0.0000          ?        ?   401.6301  17.8786          ?        ?      200.3        4.5       ?       ? 
1 1 1   37    2   51 o    145.2    6.2    0.0000   0.0000          ?        ?   211.3506  17.8786          ?        ?      145.2        6.2       ?       ? 
1 1 1   37    2   52 o     97.0    8.9    0.0000   0.0000          ?        ?    94.5012  17.2401          ?        ?       97.0        8.9       ?       ? 
1 1 1   37    2   53 o    325.9    3.1    0.0000   0.0000          ?        ?  1062.5000  20.4327          ?        ?      325.9        3.1       ?       ? 
1 1 1   37    2   54 o    295.5    3.3    0.0000   0.0000          ?        ?   874.1360  19.7942          ?        ?      295.5        3.3       ?       ? 
1 1 1   37    2   55 o     23.6   11.5    0.0000   0.0000          ?        ?   -33.2031  17.8786          ?        ?       23.6       11.5       ?       ? 
1 1 1   37    2   56 o     20.2   10.2    0.0000   0.0000          ?        ?   -56.8284  18.5171          ?        ?       20.2       10.2       ?       ? 
1 1 1   37    2   57 o    108.1    8.6    0.0000   0.0000          ?        ?   117.4880  18.5171          ?        ?      108.1        8.6       ?       ? 
1 1 1   37    2   58 o    158.0    5.9    0.0000   0.0000          ?        ?   250.3005  18.5171          ?        ?      158.0        5.9       ?       ? 
1 1 1   37    2   59 o    297.6    3.5    0.0000   0.0000          ?        ?   886.9065  21.0712          ?        ?      297.6        3.5       ?       ? 
1 1 1   37    2   60 o    343.4    3.3    0.0000   0.0000          ?        ?  1180.6265  22.9868          ?        ?      343.4        3.3       ?       ? 
1 1 1   37    2   61 o    161.2    6.3    0.0000   0.0000          ?        ?   261.1554  20.4327          ?        ?      161.2        6.3       ?       ? 
1 1 1   37    2   62 o    117.0    8.2    0.0000   0.0000          ?        ?   137.9207  19.1556          ?        ?      117.0        8.2       ?       ? 
1 1 1   37    2   63 o    173.4    5.5    0.0000   0.0000          ?        ?   302.0207  19.1556          ?        ?      173.4        5.5       ?       ? 
1 1 1   37    2   64 o     75.4   13.6    0.0000   0.0000          ?        ?    60.0210  19.7942          ?        ?       75.4       13.6       ?       ? 
1 1 1   37    2   65 o     32.6   14.7    0.0000   0.0000          ?        ?    -9.5778  20.4327          ?        ?       32.6       14.7       ?       ? 
1 1 1   37    2   66 o     38.0   15.6    0.0000   0.0000          ?        ?     5.7467  19.1556          ?        ?       38.0       15.6       ?       ? 
1 1 1   37    2   67 o     95.2   10.4    0.0000   0.0000          ?        ?    92.5856  19.7942          ?        ?       95.2       10.4       ?       ? 
1 1 1   37    3    0 o    402.4    3.4 1619.9293  27.4564  1619.9293  27.4564  1619.9293  27.4564      402.4      3.4      402.4        3.4     0.0     0.0 
1 1 1   37    3    1 o    541.8    2.7    0.0000   0.0000          ?        ?  2935.9224  28.7335          ?        ?      541.8        2.7       ?       ? 
1 1 1   37    3    2 o    767.3    3.0    0.0000   0.0000          ?        ?  5887.8076  46.6121          ?        ?      767.3        3.0       ?       ? 
1 1 1   37    3    3 o    525.9    2.6    0.0000   0.0000          ?        ?  2765.4373  27.4564          ?        ?      525.9        2.6       ?       ? 
1 1 1   37    3    4 o    903.4    3.5    0.0000   0.0000          ?        ?  8161.5830  62.5751          ?        ?      903.4        3.5       ?       ? 
1 1 1   37    3    5 o    335.8    2.6    0.0000   0.0000          ?        ?  1127.6293  17.2401          ?        ?      335.8        2.6       ?       ? 
1 1 1   37    3    6 o   1111.0    4.0    0.0000   0.0000          ?        ? 12345.1777  88.7545          ?        ?     1111.0        4.0       ?       ? 
1 1 1   37    3    7 f    552.0    2.6    0.0000   0.0000          ?        ?  3047.6636  28.7335          ?        ?      552.0        2.6       ?       ? 
1 1 1   37    3    8 o    256.8    2.9    0.0000   0.0000          ?        ?   659.5928  14.6860          ?        ?      256.8        2.9       ?       ? 
1 1 1   37    3    9 o    234.6    3.0    0.0000   0.0000          ?        ?   550.4056  14.0475          ?        ?      234.6        3.0       ?       ? 
1 1 1   37    3   10 o    750.1    3.0    0.0000   0.0000          ?        ?  5627.2910  45.3350          ?        ?      750.1        3.0       ?       ? 
1 1 1   37    3   11 f    437.6    2.5    0.0000   0.0000          ?        ?  1914.9263  21.7097          ?        ?      437.6        2.5       ?       ? 
1 1 1   37    3   12 o    528.9    2.5    0.0000   0.0000          ?        ?  2798.0020  26.1794          ?        ?      528.9        2.5       ?       ? 
1 1 1   37    3   13 o    698.8    3.0    0.0000   0.0000          ?        ?  4883.4131  42.1424          ?        ?      698.8        3.0       ?       ? 
1 1 1   37    3   14 o    499.5    2.6    0.0000   0.0000          ?        ?  2495.3425  25.5409          ?        ?      499.5        2.6       ?       ? 
1 1 1   37    3   15 o    602.5    2.7    0.0000   0.0000          ?        ?  3630.6338  32.5646          ?        ?      602.5        2.7       ?       ? 
1 1 1   37    3   16 o    703.6    2.9    0.0000   0.0000          ?        ?  4950.4580  40.8654          ?        ?      703.6        2.9       ?       ? 
1 1 1   37    3   17 o    321.4    2.5    0.0000   0.0000          ?        ?  1033.1281  15.9630          ?        ?      321.4        2.5       ?       ? 
1 1 1   37    3   18 o    560.9    2.7    0.0000   0.0000          ?        ?  3145.9961  30.0105          ?        ?      560.9        2.7       ?       ? 
1 1 1   37    3   19 o    500.9    2.5    0.0000   0.0000          ?        ?  2508.7515  24.9023          ?        ?      500.9        2.5       ?       ? 
1 1 1   37    3   20 o   1034.1    3.9    0.0000   0.0000          ?        ? 10696.5137  80.4537          ?        ?     1034.1        3.9       ?       ? 
1 1 1   37    3   21 o    720.8    2.9    0.0000   0.0000          ?        ?  5196.2891  42.1424          ?        ?      720.8        2.9       ?       ? 
1 1 1   37    3   22 o    818.9    3.3    0.0000   0.0000          ?        ?  6706.3931  54.2743          ?        ?      818.9        3.3       ?       ? 
1 1 1   37    3   23 o    478.1    2.4    0.0000   0.0000          ?        ?  2285.9075  22.9868          ?        ?      478.1        2.4       ?       ? 
1 1 1   37    3   24 o    468.0    2.5    0.0000   0.0000          ?        ?  2190.7678  23.6253          ?        ?      468.0        2.5       ?       ? 
1 1 1   37    3   25 o     69.1   10.2    0.0000   0.0000          ?        ?    47.8891  14.0475          ?        ?       69.1       10.2       ?       ? 
1 1 1   37    3   26 o    253.8    2.9    0.0000   0.0000          ?        ?   644.2683  14.6860          ?        ?      253.8        2.9       ?       ? 
1 1 1   37    3   27 o    326.0    2.5    0.0000   0.0000          ?        ?  1063.1385  16.6016          ?        ?      326.0        2.5       ?       ? 
1 1 1   37    3   28 o    478.0    2.6    0.0000   0.0000          ?        ?  2285.2688  24.9023          ?        ?      478.0        2.6       ?       ? 
1 1 1   37    3   29 o    287.1    2.8    0.0000   0.0000          ?        ?   824.3315  15.9630          ?        ?      287.1        2.8       ?       ? 
1 1 1   37    3   30 o    395.0    2.5    0.0000   0.0000          ?        ?  1560.5469  19.7942          ?        ?      395.0        2.5       ?       ? 
1 1 1   37    3   31 o    339.4    2.5    0.0000   0.0000          ?        ?  1151.8929  17.2401          ?        ?      339.4        2.5       ?       ? 
1 1 1   37    3   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    3   33 o    723.7    3.0    0.0000   0.0000          ?        ?  5238.4316  43.4195          ?        ?      723.7        3.0       ?       ? 
1 1 1   37    3   34 o    376.4    2.6    0.0000   0.0000          ?        ?  1416.8794  19.7942          ?        ?      376.4        2.6       ?       ? 
1 1 1   37    3   35 o    437.9    2.6    0.0000   0.0000          ?        ?  1918.1189  22.3483          ?        ?      437.9        2.6       ?       ? 
1 1 1   37    3   36 o    146.0    5.5    0.0000   0.0000          ?        ?   213.2662  15.9630          ?        ?      146.0        5.5       ?       ? 
1 1 1   37    3   37 o    368.8    2.6    0.0000   0.0000          ?        ?  1360.0510  19.1556          ?        ?      368.8        2.6       ?       ? 
1 1 1   37    3   38 o    420.1    2.6    0.0000   0.0000          ?        ?  1765.5123  21.7097          ?        ?      420.1        2.6       ?       ? 
1 1 1   37    3   39 o    274.2    3.1    0.0000   0.0000          ?        ?   752.1785  17.2401          ?        ?      274.2        3.1       ?       ? 
1 1 1   37    3   40 o    399.0    2.6    0.0000   0.0000          ?        ?  1592.4729  21.0712          ?        ?      399.0        2.6       ?       ? 
1 1 1   37    3   41 o    555.9    2.6    0.0000   0.0000          ?        ?  3091.0833  29.3720          ?        ?      555.9        2.6       ?       ? 
1 1 1   37    3   42 o     32.7   13.8    0.0000   0.0000          ?        ?     1.2770  15.3245          ?        ?       32.7       13.8       ?       ? 
1 1 1   37    3   43 o    464.6    2.7    0.0000   0.0000          ?        ?  2159.4802  24.9023          ?        ?      464.6        2.7       ?       ? 
1 1 1   37    3   44 o    331.9    2.8    0.0000   0.0000          ?        ?  1102.0884  18.5171          ?        ?      331.9        2.8       ?       ? 
1 1 1   37    3   45 o     27.5   12.7    0.0000   0.0000          ?        ?   -14.0475  16.6016          ?        ?       27.5       12.7       ?       ? 
1 1 1   37    3   46 o    286.4    3.3    0.0000   0.0000          ?        ?   820.5003  19.1556          ?        ?      286.4        3.3       ?       ? 
1 1 1   37    3   47 f    180.5    4.8    0.0000   0.0000          ?        ?   326.2845  17.2401          ?        ?      180.5        4.8       ?       ? 
1 1 1   37    3   48 o    655.3    2.9    0.0000   0.0000          ?        ?  4296.6123  37.6728          ?        ?      655.3        2.9       ?       ? 
1 1 1   37    3   49 o    346.1    3.0    0.0000   0.0000          ?        ?  1198.5051  20.4327          ?        ?      346.1        3.0       ?       ? 
1 1 1   37    3   50 o     97.3    8.5    0.0000   0.0000          ?        ?    95.1397  16.6016          ?        ?       97.3        8.5       ?       ? 
1 1 1   37    3   51 f    156.0    5.7    0.0000   0.0000          ?        ?   243.9153  17.8786          ?        ?      156.0        5.7       ?       ? 
1 1 1   37    3   52 o    166.1    5.6    0.0000   0.0000          ?        ?   276.4799  18.5171          ?        ?      166.1        5.6       ?       ? 
1 1 1   37    3   53 o    325.7    3.2    0.0000   0.0000          ?        ?  1061.8615  21.0712          ?        ?      325.7        3.2       ?       ? 
1 1 1   37    3   54 o     95.6    9.7    0.0000   0.0000          ?        ?    91.9471  18.5171          ?        ?       95.6        9.7       ?       ? 
1 1 1   37    3   55 o    213.8    4.3    0.0000   0.0000          ?        ?   457.8200  18.5171          ?        ?      213.8        4.3       ?       ? 
1 1 1   37    3   56 o    158.6    5.6    0.0000   0.0000          ?        ?   252.2160  17.8786          ?        ?      158.6        5.6       ?       ? 
1 1 1   37    3   57 o    289.9    3.6    0.0000   0.0000          ?        ?   841.5715  21.0712          ?        ?      289.9        3.6       ?       ? 
1 1 1   37    3   58 o     61.1   16.0    0.0000   0.0000          ?        ?    39.5883  19.7942          ?        ?       61.1       16.0       ?       ? 
1 1 1   37    3   59 o    116.0    8.3    0.0000   0.0000          ?        ?   135.3666  19.1556          ?        ?      116.0        8.3       ?       ? 
1 1 1   37    3   60 o    168.3    5.9    0.0000   0.0000          ?        ?   284.1421  19.7942          ?        ?      168.3        5.9       ?       ? 
1 1 1   37    3   61 o     29.2   13.7    0.0000   0.0000          ?        ?   -18.5171  19.7942          ?        ?       29.2       13.7       ?       ? 
1 1 1   37    3   62 o    128.4    7.7    0.0000   0.0000          ?        ?   166.0156  19.7942          ?        ?      128.4        7.7       ?       ? 
1 1 1   37    3   63 o    134.9    7.1    0.0000   0.0000          ?        ?   183.2557  19.1556          ?        ?      134.9        7.1       ?       ? 
1 1 1   37    3   64 o     40.3   16.5    0.0000   0.0000          ?        ?     7.0237  21.0712          ?        ?       40.3       16.5       ?       ? 
1 1 1   37    3   65 o     76.9   12.5    0.0000   0.0000          ?        ?    60.6596  19.1556          ?        ?       76.9       12.5       ?       ? 
1 1 1   37    3   66 o     73.8   13.9    0.0000   0.0000          ?        ?    58.1055  19.7942          ?        ?       73.8       13.9       ?       ? 
1 1 1   37    3   67 o    106.4    8.7    0.0000   0.0000          ?        ?   114.9339  18.5171          ?        ?      106.4        8.7       ?       ? 
1 1 1   37    4    0 o    136.0    6.8  186.4483  18.5171   186.4483  18.5171   186.4483  18.5171      136.0      6.8      136.0        6.8     0.0     0.0 
1 1 1   37    4    1 o    113.3    5.4    0.0000   0.0000          ?        ?   128.3428  12.1319          ?        ?      113.3        5.4       ?       ? 
1 1 1   37    4    2 o    378.4    2.5    0.0000   0.0000          ?        ?  1432.2040  19.1556          ?        ?      378.4        2.5       ?       ? 
1 1 1   37    4    3 o    248.7    3.2    0.0000   0.0000          ?        ?   618.7275  15.9630          ?        ?      248.7        3.2       ?       ? 
1 1 1   37    4    4 o    382.7    2.6    0.0000   0.0000          ?        ?  1464.7686  19.7942          ?        ?      382.7        2.6       ?       ? 
1 1 1   37    4    5 o    844.2    3.4    0.0000   0.0000          ?        ?  7127.8174  57.4669          ?        ?      844.2        3.4       ?       ? 
1 1 1   37    4    6 o    458.9    2.7    0.0000   0.0000          ?        ?  2105.8442  24.9023          ?        ?      458.9        2.7       ?       ? 
1 1 1   37    4    7 o    311.5    2.6    0.0000   0.0000          ?        ?   970.5529  15.9630          ?        ?      311.5        2.6       ?       ? 
1 1 1   37    4    8 o    904.5    3.5    0.0000   0.0000          ?        ?  8182.0161  63.2136          ?        ?      904.5        3.5       ?       ? 
1 1 1   37    4    9 o    753.4    3.2    0.0000   0.0000          ?        ?  5676.4570  48.5276          ?        ?      753.4        3.2       ?       ? 
1 1 1   37    4   10 o    214.6    3.0    0.0000   0.0000          ?        ?   460.3741  12.7704          ?        ?      214.6        3.0       ?       ? 
1 1 1   37    4   11 o    913.5    3.4    0.0000   0.0000          ?        ?  8344.8389  62.5751          ?        ?      913.5        3.4       ?       ? 
1 1 1   37    4   12 o    910.7    3.4    0.0000   0.0000          ?        ?  8294.3955  62.5751          ?        ?      910.7        3.4       ?       ? 
1 1 1   37    4   13 o    331.2    2.6    0.0000   0.0000          ?        ?  1096.9802  17.2401          ?        ?      331.2        2.6       ?       ? 
1 1 1   37    4   14 f    478.6    2.7    0.0000   0.0000          ?        ?  2291.0156  26.1794          ?        ?      478.6        2.7       ?       ? 
1 1 1   37    4   15 o    379.9    2.4    0.0000   0.0000          ?        ?  1443.6974  18.5171          ?        ?      379.9        2.4       ?       ? 
1 1 1   37    4   16 o   1392.9    5.1    0.0000   0.0000          ?        ? 19407.8652 142.3903          ?        ?     1392.9        5.1       ?       ? 
1 1 1   37    4   17 o    692.3    2.9    0.0000   0.0000          ?        ?  4792.7432  40.2269          ?        ?      692.3        2.9       ?       ? 
1 1 1   37    4   18 o    333.7    2.6    0.0000   0.0000          ?        ?  1113.5817  17.2401          ?        ?      333.7        2.6       ?       ? 
1 1 1   37    4   19 o    923.7    3.6    0.0000   0.0000          ?        ?  8533.8418  65.7677          ?        ?      923.7        3.6       ?       ? 
1 1 1   37    4   20 o    972.4    3.6    0.0000   0.0000          ?        ?  9457.1436  69.5989          ?        ?      972.4        3.6       ?       ? 
1 1 1   37    4   21 o   1032.3    3.7    0.0000   0.0000          ?        ? 10657.5645  77.2611          ?        ?     1032.3        3.7       ?       ? 
1 1 1   37    4   22 o    428.2    2.4    0.0000   0.0000          ?        ?  1833.8342  20.4327          ?        ?      428.2        2.4       ?       ? 
1 1 1   37    4   23 o    539.0    2.7    0.0000   0.0000          ?        ?  2905.9119  29.3720          ?        ?      539.0        2.7       ?       ? 
1 1 1   37    4   24 o    690.6    2.7    0.0000   0.0000          ?        ?  4770.3950  37.6728          ?        ?      690.6        2.7       ?       ? 
1 1 1   37    4   25 o    392.1    2.4    0.0000   0.0000          ?        ?  1537.5601  19.1556          ?        ?      392.1        2.4       ?       ? 
1 1 1   37    4   26 o    685.0    2.8    0.0000   0.0000          ?        ?  4692.4956  38.3113          ?        ?      685.0        2.8       ?       ? 
1 1 1   37    4   27 o    274.8    2.9    0.0000   0.0000          ?        ?   755.3711  15.9630          ?        ?      274.8        2.9       ?       ? 
1 1 1   37    4   28 o    379.0    2.5    0.0000   0.0000          ?        ?  1436.6737  19.1556          ?        ?      379.0        2.5       ?       ? 
1 1 1   37    4   29 o    415.0    2.4    0.0000   0.0000          ?        ?  1722.7313  19.7942          ?        ?      415.0        2.4       ?       ? 
1 1 1   37    4   30 o    697.8    2.8    0.0000   0.0000          ?        ?  4870.0044  39.5883          ?        ?      697.8        2.8       ?       ? 
1 1 1   37    4   31 o    383.8    2.6    0.0000   0.0000          ?        ?  1473.0693  19.7942          ?        ?      383.8        2.6       ?       ? 
1 1 1   37    4   32 o     70.0   10.9    0.0000   0.0000          ?        ?    49.1662  15.3245          ?        ?       70.0       10.9       ?       ? 
1 1 1   37    4   33 f    270.0    3.0    0.0000   0.0000          ?        ?   729.1917  15.9630          ?        ?      270.0        3.0       ?       ? 
1 1 1   37    4   34 o    164.3    4.9    0.0000   0.0000          ?        ?   270.0946  15.9630          ?        ?      164.3        4.9       ?       ? 
1 1 1   37    4   35 o     34.5   13.7    0.0000   0.0000          ?        ?     6.3852  14.0475          ?        ?       34.5       13.7       ?       ? 
1 1 1   37    4   36 o   1003.6    3.7    0.0000   0.0000          ?        ? 10077.1484  74.0685          ?        ?     1003.6        3.7       ?       ? 
1 1 1   37    4   37 o    340.7    2.8    0.0000   0.0000          ?        ?  1160.8323  19.1556          ?        ?      340.7        2.8       ?       ? 
1 1 1   37    4   38 o     96.5    7.9    0.0000   0.0000          ?        ?    93.2242  15.3245          ?        ?       96.5        7.9       ?       ? 
1 1 1   37    4   39 o    454.2    2.5    0.0000   0.0000          ?        ?  2063.0635  22.3483          ?        ?      454.2        2.5       ?       ? 
1 1 1   37    4   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    4   41 o     22.3   10.9    0.0000   0.0000          ?        ?   -33.2031  16.6016          ?        ?       22.3       10.9       ?       ? 
1 1 1   37    4   42 o    693.8    2.9    0.0000   0.0000          ?        ?  4815.0913  40.8654          ?        ?      693.8        2.9       ?       ? 
1 1 1   37    4   43 o    170.7    4.7    0.0000   0.0000          ?        ?   291.8044  15.9630          ?        ?      170.7        4.7       ?       ? 
1 1 1   37    4   44 o    259.2    3.3    0.0000   0.0000          ?        ?   672.3633  17.2401          ?        ?      259.2        3.3       ?       ? 
1 1 1   37    4   45 o    372.3    2.8    0.0000   0.0000          ?        ?  1386.8689  21.0712          ?        ?      372.3        2.8       ?       ? 
1 1 1   37    4   46 o    202.2    4.3    0.0000   0.0000          ?        ?   409.2924  17.2401          ?        ?      202.2        4.3       ?       ? 
1 1 1   37    4   47 f    496.2    2.6    0.0000   0.0000          ?        ?  2462.7781  25.5409          ?        ?      496.2        2.6       ?       ? 
1 1 1   37    4   48 o    125.7    6.9    0.0000   0.0000          ?        ?   158.3534  17.2401          ?        ?      125.7        6.9       ?       ? 
1 1 1   37    4   49 o    117.5    7.6    0.0000   0.0000          ?        ?   138.5592  17.8786          ?        ?      117.5        7.6       ?       ? 
1 1 1   37    4   50 f    227.2    4.1    0.0000   0.0000          ?        ?   516.5640  18.5171          ?        ?      227.2        4.1       ?       ? 
1 1 1   37    4   51 o    149.8    6.0    0.0000   0.0000          ?        ?   224.7596  17.8786          ?        ?      149.8        6.0       ?       ? 
1 1 1   37    4   52 o    177.8    5.0    0.0000   0.0000          ?        ?   316.7067  17.8786          ?        ?      177.8        5.0       ?       ? 
1 1 1   37    4   53 o    276.3    3.5    0.0000   0.0000          ?        ?   764.3104  19.1556          ?        ?      276.3        3.5       ?       ? 
1 1 1   37    4   54 o    308.1    3.2    0.0000   0.0000          ?        ?   950.1202  19.7942          ?        ?      308.1        3.2       ?       ? 
1 1 1   37    4   55 o    237.6    4.0    0.0000   0.0000          ?        ?   565.0916  19.1556          ?        ?      237.6        4.0       ?       ? 
1 1 1   37    4   56 o    232.8    4.1    0.0000   0.0000          ?        ?   542.7434  19.1556          ?        ?      232.8        4.1       ?       ? 
1 1 1   37    4   57 o    196.2    5.0    0.0000   0.0000          ?        ?   385.6671  19.7942          ?        ?      196.2        5.0       ?       ? 
1 1 1   37    4   58 o    181.4    5.3    0.0000   0.0000          ?        ?   330.1157  19.1556          ?        ?      181.4        5.3       ?       ? 
1 1 1   37    4   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    4   60 o    240.1    4.3    0.0000   0.0000          ?        ?   577.8621  20.4327          ?        ?      240.1        4.3       ?       ? 
1 1 1   37    4   61 o    109.6    9.0    0.0000   0.0000          ?        ?   121.3191  19.7942          ?        ?      109.6        9.0       ?       ? 
1 1 1   37    4   62 o     54.2   16.7    0.0000   0.0000          ?        ?    30.6490  19.7942          ?        ?       54.2       16.7       ?       ? 
1 1 1   37    4   63 o    232.9    4.4    0.0000   0.0000          ?        ?   544.0204  20.4327          ?        ?      232.9        4.4       ?       ? 
1 1 1   37    4   64 o    319.0    3.5    0.0000   0.0000          ?        ?  1019.7190  22.3483          ?        ?      319.0        3.5       ?       ? 
1 1 1   37    4   65 o    227.7    4.5    0.0000   0.0000          ?        ?   520.3951  20.4327          ?        ?      227.7        4.5       ?       ? 
1 1 1   37    4   66 o    120.4    8.2    0.0000   0.0000          ?        ?   146.8600  19.7942          ?        ?      120.4        8.2       ?       ? 
1 1 1   37    5    0 o    173.3    6.1  301.3822  21.0712   301.3822  21.0712   301.3822  21.0712      173.3      6.1      173.3        6.1     0.0     0.0 
1 1 1   37    5    1 o   1380.6    4.9    0.0000   0.0000          ?        ? 19063.0625 134.7281          ?        ?     1380.6        4.9       ?       ? 
1 1 1   37    5    2 o   1665.7    5.7    0.0000   0.0000          ?        ? 27752.7031 188.3639          ?        ?     1665.7        5.7       ?       ? 
1 1 1   37    5    3 o   1106.4    4.2    0.0000   0.0000          ?        ? 12243.6523  93.2242          ?        ?     1106.4        4.2       ?       ? 
1 1 1   37    5    4 o    357.1    2.4    0.0000   0.0000          ?        ?  1275.1277  17.2401          ?        ?      357.1        2.4       ?       ? 
1 1 1   37    5    5 o    591.1    2.9    0.0000   0.0000          ?        ?  3493.9905  33.8416          ?        ?      591.1        2.9       ?       ? 
1 1 1   37    5    6 o   1259.3    4.4    0.0000   0.0000          ?        ? 15862.1543 111.7413          ?        ?     1259.3        4.4       ?       ? 
1 1 1   37    5    7 o   1094.5    4.0    0.0000   0.0000          ?        ? 11981.2197  86.8389          ?        ?     1094.5        4.0       ?       ? 
1 1 1   37    5    8 o    322.2    2.8    0.0000   0.0000          ?        ?  1038.2362  17.8786          ?        ?      322.2        2.8       ?       ? 
1 1 1   37    5    9 f    532.7    2.6    0.0000   0.0000          ?        ?  2837.5901  27.4564          ?        ?      532.7        2.6       ?       ? 
1 1 1   37    5   10 o    557.7    2.7    0.0000   0.0000          ?        ?  3110.2388  30.0105          ?        ?      557.7        2.7       ?       ? 
1 1 1   37    5   11 o    732.1    3.0    0.0000   0.0000          ?        ?  5359.7505  43.4195          ?        ?      732.1        3.0       ?       ? 
1 1 1   37    5   12 o    302.3    2.5    0.0000   0.0000          ?        ?   913.7245  15.3245          ?        ?      302.3        2.5       ?       ? 
1 1 1   37    5   13 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    5   14 o    612.5    2.7    0.0000   0.0000          ?        ?  3751.9529  33.2031          ?        ?      612.5        2.7       ?       ? 
1 1 1   37    5   15 o    175.8    3.3    0.0000   0.0000          ?        ?   309.0445  11.4934          ?        ?      175.8        3.3       ?       ? 
1 1 1   37    5   16 o    593.8    2.7    0.0000   0.0000          ?        ?  3526.5549  32.5646          ?        ?      593.8        2.7       ?       ? 
1 1 1   37    5   17 o    490.4    2.4    0.0000   0.0000          ?        ?  2405.3110  23.6253          ?        ?      490.4        2.4       ?       ? 
1 1 1   37    5   18 o    647.6    2.9    0.0000   0.0000          ?        ?  4193.8101  37.0343          ?        ?      647.6        2.9       ?       ? 
1 1 1   37    5   19 o    492.2    2.7    0.0000   0.0000          ?        ?  2422.5510  26.1794          ?        ?      492.2        2.7       ?       ? 
1 1 1   37    5   20 o   1050.0    3.8    0.0000   0.0000          ?        ? 11026.6299  79.1767          ?        ?     1050.0        3.8       ?       ? 
1 1 1   37    5   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    5   22 o    531.4    2.5    0.0000   0.0000          ?        ?  2824.1812  26.1794          ?        ?      531.4        2.5       ?       ? 
1 1 1   37    5   23 o    309.7    2.7    0.0000   0.0000          ?        ?   959.0594  16.6016          ?        ?      309.7        2.7       ?       ? 
1 1 1   37    5   24 o    184.6    3.8    0.0000   0.0000          ?        ?   340.9706  14.0475          ?        ?      184.6        3.8       ?       ? 
1 1 1   37    5   25 o    578.3    2.7    0.0000   0.0000          ?        ?  3345.2148  31.2876          ?        ?      578.3        2.7       ?       ? 
1 1 1   37    5   26 o    549.4    2.6    0.0000   0.0000          ?        ?  3018.2917  28.0950          ?        ?      549.4        2.6       ?       ? 
1 1 1   37    5   27 o    204.8    3.6    0.0000   0.0000          ?        ?   419.5087  14.6860          ?        ?      204.8        3.6       ?       ? 
1 1 1   37    5   28 f    580.4    2.6    0.0000   0.0000          ?        ?  3369.4788  30.0105          ?        ?      580.4        2.6       ?       ? 
1 1 1   37    5   29 o    541.4    2.5    0.0000   0.0000          ?        ?  2932.0913  27.4564          ?        ?      541.4        2.5       ?       ? 
1 1 1   37    5   30 o    174.3    4.4    0.0000   0.0000          ?        ?   303.9363  15.3245          ?        ?      174.3        4.4       ?       ? 
1 1 1   37    5   31 o    150.1    5.1    0.0000   0.0000          ?        ?   225.3981  15.3245          ?        ?      150.1        5.1       ?       ? 
1 1 1   37    5   32 o    799.0    3.2    0.0000   0.0000          ?        ?  6385.2163  50.4432          ?        ?      799.0        3.2       ?       ? 
1 1 1   37    5   33 o    333.8    3.0    0.0000   0.0000          ?        ?  1114.2202  19.7942          ?        ?      333.8        3.0       ?       ? 
1 1 1   37    5   34 o    800.9    3.2    0.0000   0.0000          ?        ?  6416.5039  51.0817          ?        ?      800.9        3.2       ?       ? 
1 1 1   37    5   35 o    308.5    2.9    0.0000   0.0000          ?        ?   952.0358  17.8786          ?        ?      308.5        2.9       ?       ? 
1 1 1   37    5   36 f     41.8   14.7    0.0000   0.0000          ?        ?    15.3245  15.3245          ?        ?       41.8       14.7       ?       ? 
1 1 1   37    5   37 o    216.6    3.8    0.0000   0.0000          ?        ?   469.3134  16.6016          ?        ?      216.6        3.8       ?       ? 
1 1 1   37    5   38 o    364.1    2.7    0.0000   0.0000          ?        ?  1326.2094  19.7942          ?        ?      364.1        2.7       ?       ? 
1 1 1   37    5   39 o    340.5    2.9    0.0000   0.0000          ?        ?  1159.5553  19.7942          ?        ?      340.5        2.9       ?       ? 
1 1 1   37    5   40 o    420.4    2.6    0.0000   0.0000          ?        ?  1767.4277  21.7097          ?        ?      420.4        2.6       ?       ? 
1 1 1   37    5   41 o    259.5    3.2    0.0000   0.0000          ?        ?   673.6403  16.6016          ?        ?      259.5        3.2       ?       ? 
1 1 1   37    5   42 o    328.9    2.9    0.0000   0.0000          ?        ?  1082.2942  19.1556          ?        ?      328.9        2.9       ?       ? 
1 1 1   37    5   43 o    472.4    2.6    0.0000   0.0000          ?        ?  2232.2717  24.9023          ?        ?      472.4        2.6       ?       ? 
1 1 1   37    5   44 o    248.4    3.3    0.0000   0.0000          ?        ?   617.4504  16.6016          ?        ?      248.4        3.3       ?       ? 
1 1 1   37    5   45 o    230.4    3.7    0.0000   0.0000          ?        ?   531.2500  17.2401          ?        ?      230.4        3.7       ?       ? 
1 1 1   37    5   46 o    155.5    5.1    0.0000   0.0000          ?        ?   241.9997  15.9630          ?        ?      155.5        5.1       ?       ? 
1 1 1   37    5   47 o    254.5    3.4    0.0000   0.0000          ?        ?   648.0994  17.2401          ?        ?      254.5        3.4       ?       ? 
1 1 1   37    5   48 o     24.7   11.8    0.0000   0.0000          ?        ?   -22.9868  16.6016          ?        ?       24.7       11.8       ?       ? 
1 1 1   37    5   49 o    115.6    7.5    0.0000   0.0000          ?        ?   134.0895  17.2401          ?        ?      115.6        7.5       ?       ? 
1 1 1   37    5   50 o     36.1   15.0    0.0000   0.0000          ?        ?     3.1926  17.8786          ?        ?       36.1       15.0       ?       ? 
1 1 1   37    5   51 o    226.3    4.1    0.0000   0.0000          ?        ?   512.7329  18.5171          ?        ?      226.3        4.1       ?       ? 
1 1 1   37    5   52 o    225.2    4.1    0.0000   0.0000          ?        ?   507.6247  18.5171          ?        ?      225.2        4.1       ?       ? 
1 1 1   37    5   53 o     19.7    9.9    0.0000   0.0000          ?        ?   -56.1899  17.8786          ?        ?       19.7        9.9       ?       ? 
1 1 1   37    5   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    5   55 f     19.6    9.9    0.0000   0.0000          ?        ?   -56.8284  17.8786          ?        ?       19.6        9.9       ?       ? 
1 1 1   37    5   56 o    153.3    6.0    0.0000   0.0000          ?        ?   235.6145  18.5171          ?        ?      153.3        6.0       ?       ? 
1 1 1   37    5   57 f    296.8    3.6    0.0000   0.0000          ?        ?   881.7984  21.0712          ?        ?      296.8        3.6       ?       ? 
1 1 1   37    5   58 o    270.7    3.8    0.0000   0.0000          ?        ?   733.6614  20.4327          ?        ?      270.7        3.8       ?       ? 
1 1 1   37    5   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    5   60 o     80.4   11.9    0.0000   0.0000          ?        ?    65.7677  19.1556          ?        ?       80.4       11.9       ?       ? 
1 1 1   37    5   61 f    263.6    4.2    0.0000   0.0000          ?        ?   696.6271  22.3483          ?        ?      263.6        4.2       ?       ? 
1 1 1   37    5   62 o     26.6   12.7    0.0000   0.0000          ?        ?   -25.5409  19.1556          ?        ?       26.6       12.7       ?       ? 
1 1 1   37    5   63 o    163.9    6.0    0.0000   0.0000          ?        ?   270.0946  19.7942          ?        ?      163.9        6.0       ?       ? 
1 1 1   37    5   64 o     44.6   16.6    0.0000   0.0000          ?        ?    16.6016  19.7942          ?        ?       44.6       16.6       ?       ? 
1 1 1   37    5   65 o    187.7    5.4    0.0000   0.0000          ?        ?   354.3795  20.4327          ?        ?      187.7        5.4       ?       ? 
1 1 1   37    5   66 o     27.4   13.0    0.0000   0.0000          ?        ?   -21.7097  19.1556          ?        ?       27.4       13.0       ?       ? 
1 1 1   37    6    0 o    515.8    3.6 2660.7197  37.0343  2660.7197  37.0343  2660.7197  37.0343      515.8      3.6      515.8        3.6     0.0     0.0 
1 1 1   37    6    1 o    260.0    2.8    0.0000   0.0000          ?        ?   676.1944  14.6860          ?        ?      260.0        2.8       ?       ? 
1 1 1   37    6    2 o   1054.2    4.0    0.0000   0.0000          ?        ? 11114.1074  83.6463          ?        ?     1054.2        4.0       ?       ? 
1 1 1   37    6    3 o    583.2    2.8    0.0000   0.0000          ?        ?  3402.0432  33.2031          ?        ?      583.2        2.8       ?       ? 
1 1 1   37    6    4 o    853.0    3.4    0.0000   0.0000          ?        ?  7276.5923  58.1055          ?        ?      853.0        3.4       ?       ? 
1 1 1   37    6    5 o    389.9    2.5    0.0000   0.0000          ?        ?  1520.3201  19.7942          ?        ?      389.9        2.5       ?       ? 
1 1 1   37    6    6 o    703.2    3.0    0.0000   0.0000          ?        ?  4945.3501  41.5039          ?        ?      703.2        3.0       ?       ? 
1 1 1   37    6    7 o    194.9    3.3    0.0000   0.0000          ?        ?   379.9204  12.7704          ?        ?      194.9        3.3       ?       ? 
1 1 1   37    6    8 o    694.3    3.3    0.0000   0.0000          ?        ?  4821.4766  45.9736          ?        ?      694.3        3.3       ?       ? 
1 1 1   37    6    9 o   1160.9    4.3    0.0000   0.0000          ?        ? 13478.5527  98.9709          ?        ?     1160.9        4.3       ?       ? 
1 1 1   37    6   10 f    655.4    3.0    0.0000   0.0000          ?        ?  4295.9736  38.9498          ?        ?      655.4        3.0       ?       ? 
1 1 1   37    6   11 o    498.1    2.5    0.0000   0.0000          ?        ?  2481.2952  24.9023          ?        ?      498.1        2.5       ?       ? 
1 1 1   37    6   12 o    601.6    2.7    0.0000   0.0000          ?        ?  3619.1404  32.5646          ?        ?      601.6        2.7       ?       ? 
1 1 1   37    6   13 o    379.8    2.4    0.0000   0.0000          ?        ?  1442.4203  17.8786          ?        ?      379.8        2.4       ?       ? 
1 1 1   37    6   14 f    819.9    3.5    0.0000   0.0000          ?        ?  6723.6328  56.8284          ?        ?      819.9        3.5       ?       ? 
1 1 1   37    6   15 o    651.8    2.7    0.0000   0.0000          ?        ?  4249.3613  35.7572          ?        ?      651.8        2.7       ?       ? 
1 1 1   37    6   16 o    342.2    2.4    0.0000   0.0000          ?        ?  1171.0486  16.6016          ?        ?      342.2        2.4       ?       ? 
1 1 1   37    6   17 o    258.8    2.6    0.0000   0.0000          ?        ?   669.8092  13.4090          ?        ?      258.8        2.6       ?       ? 
1 1 1   37    6   18 o    493.8    2.5    0.0000   0.0000          ?        ?  2438.5142  24.2638          ?        ?      493.8        2.5       ?       ? 
1 1 1   37    6   19 o    320.8    2.7    0.0000   0.0000          ?        ?  1029.2969  17.2401          ?        ?      320.8        2.7       ?       ? 
1 1 1   37    6   20 o    565.5    2.8    0.0000   0.0000          ?        ?  3197.7163  31.2876          ?        ?      565.5        2.8       ?       ? 
1 1 1   37    6   21 o    496.4    2.6    0.0000   0.0000          ?        ?  2464.6934  25.5409          ?        ?      496.4        2.6       ?       ? 
1 1 1   37    6   22 o    237.6    3.1    0.0000   0.0000          ?        ?   564.4531  14.6860          ?        ?      237.6        3.1       ?       ? 
1 1 1   37    6   23 o    404.8    2.5    0.0000   0.0000          ?        ?  1638.4465  20.4327          ?        ?      404.8        2.5       ?       ? 
1 1 1   37    6   24 o    272.8    3.0    0.0000   0.0000          ?        ?   744.5162  16.6016          ?        ?      272.8        3.0       ?       ? 
1 1 1   37    6   25 o    232.7    3.0    0.0000   0.0000          ?        ?   541.4664  14.0475          ?        ?      232.7        3.0       ?       ? 
1 1 1   37    6   26 o    308.8    2.7    0.0000   0.0000          ?        ?   953.9513  16.6016          ?        ?      308.8        2.7       ?       ? 
1 1 1   37    6   27 o    393.2    2.5    0.0000   0.0000          ?        ?  1546.4994  19.7942          ?        ?      393.2        2.5       ?       ? 
1 1 1   37    6   28 o    175.0    4.6    0.0000   0.0000          ?        ?   306.4904  15.9630          ?        ?      175.0        4.6       ?       ? 
1 1 1   37    6   29 o    531.3    2.8    0.0000   0.0000          ?        ?  2822.9041  29.3720          ?        ?      531.3        2.8       ?       ? 
1 1 1   37    6   30 o    442.1    2.5    0.0000   0.0000          ?        ?  1954.5148  21.7097          ?        ?      442.1        2.5       ?       ? 
1 1 1   37    6   31 o    321.6    2.7    0.0000   0.0000          ?        ?  1034.4050  17.2401          ?        ?      321.6        2.7       ?       ? 
1 1 1   37    6   32 f     42.3   14.7    0.0000   0.0000          ?        ?    15.9630  15.3245          ?        ?       42.3       14.7       ?       ? 
1 1 1   37    6   33 o    216.3    3.5    0.0000   0.0000          ?        ?   468.0364  15.3245          ?        ?      216.3        3.5       ?       ? 
1 1 1   37    6   34 o    259.1    3.1    0.0000   0.0000          ?        ?   671.7247  15.9630          ?        ?      259.1        3.1       ?       ? 
1 1 1   37    6   35 o    400.3    2.6    0.0000   0.0000          ?        ?  1602.6893  20.4327          ?        ?      400.3        2.6       ?       ? 
1 1 1   37    6   36 o    441.2    2.5    0.0000   0.0000          ?        ?  1946.8524  22.3483          ?        ?      441.2        2.5       ?       ? 
1 1 1   37    6   37 o    386.1    2.6    0.0000   0.0000          ?        ?  1490.9480  19.7942          ?        ?      386.1        2.6       ?       ? 
1 1 1   37    6   38 o    367.4    2.6    0.0000   0.0000          ?        ?  1349.8347  19.1556          ?        ?      367.4        2.6       ?       ? 
1 1 1   37    6   39 o    470.2    2.6    0.0000   0.0000          ?        ?  2211.8389  24.2638          ?        ?      470.2        2.6       ?       ? 
1 1 1   37    6   40 o    298.2    3.0    0.0000   0.0000          ?        ?   889.4606  17.8786          ?        ?      298.2        3.0       ?       ? 
1 1 1   37    6   41 o     28.5   12.8    0.0000   0.0000          ?        ?    -7.6623  15.3245          ?        ?       28.5       12.8       ?       ? 
1 1 1   37    6   42 o    462.3    2.6    0.0000   0.0000          ?        ?  2137.7703  23.6253          ?        ?      462.3        2.6       ?       ? 
1 1 1   37    6   43 o     17.6    8.9    0.0000   0.0000          ?        ?   -57.4669  15.9630          ?        ?       17.6        8.9       ?       ? 
1 1 1   37    6   44 o    416.4    2.8    0.0000   0.0000          ?        ?  1734.2247  22.9868          ?        ?      416.4        2.8       ?       ? 
1 1 1   37    6   45 o    431.8    2.5    0.0000   0.0000          ?        ?  1865.1217  21.7097          ?        ?      431.8        2.5       ?       ? 
1 1 1   37    6   46 o    136.2    6.1    0.0000   0.0000          ?        ?   185.8098  16.6016          ?        ?      136.2        6.1       ?       ? 
1 1 1   37    6   47 o    113.4    7.3    0.0000   0.0000          ?        ?   128.9814  16.6016          ?        ?      113.4        7.3       ?       ? 
1 1 1   37    6   48 o    459.1    2.6    0.0000   0.0000          ?        ?  2108.3984  23.6253          ?        ?      459.1        2.6       ?       ? 
1 1 1   37    6   49 o    241.3    3.7    0.0000   0.0000          ?        ?   582.9703  17.8786          ?        ?      241.3        3.7       ?       ? 
1 1 1   37    6   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    6   51 o    380.9    2.8    0.0000   0.0000          ?        ?  1451.3596  21.0712          ?        ?      380.9        2.8       ?       ? 
1 1 1   37    6   52 o    205.4    4.5    0.0000   0.0000          ?        ?   422.7013  18.5171          ?        ?      205.4        4.5       ?       ? 
1 1 1   37    6   53 o    215.0    4.2    0.0000   0.0000          ?        ?   462.9282  17.8786          ?        ?      215.0        4.2       ?       ? 
1 1 1   37    6   54 o    340.8    3.1    0.0000   0.0000          ?        ?  1162.1094  21.0712          ?        ?      340.8        3.1       ?       ? 
1 1 1   37    6   55 o    332.4    3.1    0.0000   0.0000          ?        ?  1105.9194  20.4327          ?        ?      332.4        3.1       ?       ? 
1 1 1   37    6   56 o    204.2    4.5    0.0000   0.0000          ?        ?   417.5931  18.5171          ?        ?      204.2        4.5       ?       ? 
1 1 1   37    6   57 o     85.2   11.2    0.0000   0.0000          ?        ?    73.4300  19.1556          ?        ?       85.2       11.2       ?       ? 
1 1 1   37    6   58 o    116.8    7.9    0.0000   0.0000          ?        ?   137.2822  18.5171          ?        ?      116.8        7.9       ?       ? 
1 1 1   37    6   59 o    260.3    3.9    0.0000   0.0000          ?        ?   678.7485  20.4327          ?        ?      260.3        3.9       ?       ? 
1 1 1   37    6   60 o     27.8   13.0    0.0000   0.0000          ?        ?   -16.6016  17.8786          ?        ?       27.8       13.0       ?       ? 
1 1 1   37    6   61 o     32.5   14.5    0.0000   0.0000          ?        ?    -7.0237  19.1556          ?        ?       32.5       14.5       ?       ? 
1 1 1   37    6   62 o     46.3   16.7    0.0000   0.0000          ?        ?    19.1556  19.7942          ?        ?       46.3       16.7       ?       ? 
1 1 1   37    6   63 o     35.0   15.1    0.0000   0.0000          ?        ?    -0.6385  19.1556          ?        ?       35.0       15.1       ?       ? 
1 1 1   37    6   64 o    233.0    4.4    0.0000   0.0000          ?        ?   544.6590  20.4327          ?        ?      233.0        4.4       ?       ? 
1 1 1   37    6   65 o    206.2    4.8    0.0000   0.0000          ?        ?   427.1710  19.7942          ?        ?      206.2        4.8       ?       ? 
1 1 1   37    7    0 o     44.1   17.4   26.8179  14.6860    26.8179  14.6860    26.8179  14.6860       44.1     17.4       44.1       17.4     0.0     0.0 
1 1 1   37    7    1 o    867.8    3.5    0.0000   0.0000          ?        ?  7531.3628  60.6596          ?        ?      867.8        3.5       ?       ? 
1 1 1   37    7    2 o    420.0    2.5    0.0000   0.0000          ?        ?  1764.2352  21.0712          ?        ?      420.0        2.5       ?       ? 
1 1 1   37    7    3 o    609.8    2.9    0.0000   0.0000          ?        ?  3718.7500  35.7572          ?        ?      609.8        2.9       ?       ? 
1 1 1   37    7    4 o    564.1    2.8    0.0000   0.0000          ?        ?  3182.3918  31.2876          ?        ?      564.1        2.8       ?       ? 
1 1 1   37    7    5 o   1278.5    4.6    0.0000   0.0000          ?        ? 16348.7070 118.7650          ?        ?     1278.5        4.6       ?       ? 
1 1 1   37    7    6 o    638.9    2.8    0.0000   0.0000          ?        ?  4082.0686  35.7572          ?        ?      638.9        2.8       ?       ? 
1 1 1   37    7    7 o    389.6    2.5    0.0000   0.0000          ?        ?  1517.7659  19.1556          ?        ?      389.6        2.5       ?       ? 
1 1 1   37    7    8 o    793.8    3.2    0.0000   0.0000          ?        ?  6302.2085  51.0817          ?        ?      793.8        3.2       ?       ? 
1 1 1   37    7    9 o    761.8    3.1    0.0000   0.0000          ?        ?  5804.1616  46.6121          ?        ?      761.8        3.1       ?       ? 
1 1 1   37    7   10 o    250.6    2.7    0.0000   0.0000          ?        ?   628.3053  13.4090          ?        ?      250.6        2.7       ?       ? 
1 1 1   37    7   11 f    384.8    2.4    0.0000   0.0000          ?        ?  1480.7316  18.5171          ?        ?      384.8        2.4       ?       ? 
1 1 1   37    7   12 o    546.5    2.6    0.0000   0.0000          ?        ?  2986.3657  28.0950          ?        ?      546.5        2.6       ?       ? 
1 1 1   37    7   13 o    158.0    3.6    0.0000   0.0000          ?        ?   249.6619  11.4934          ?        ?      158.0        3.6       ?       ? 
1 1 1   37    7   14 o    685.8    2.9    0.0000   0.0000          ?        ?  4703.9888  40.2269          ?        ?      685.8        2.9       ?       ? 
1 1 1   37    7   15 o    654.8    2.8    0.0000   0.0000          ?        ?  4288.3110  37.0343          ?        ?      654.8        2.8       ?       ? 
1 1 1   37    7   16 o    434.9    2.3    0.0000   0.0000          ?        ?  1891.9395  20.4327          ?        ?      434.9        2.3       ?       ? 
1 1 1   37    7   17 f    151.0    4.0    0.0000   0.0000          ?        ?   227.9522  12.1319          ?        ?      151.0        4.0       ?       ? 
1 1 1   37    7   18 o    269.5    2.8    0.0000   0.0000          ?        ?   726.6376  15.3245          ?        ?      269.5        2.8       ?       ? 
1 1 1   37    7   19 o    585.0    2.6    0.0000   0.0000          ?        ?  3423.1143  30.6490          ?        ?      585.0        2.6       ?       ? 
1 1 1   37    7   20 o    112.1    6.0    0.0000   0.0000          ?        ?   125.7888  13.4090          ?        ?      112.1        6.0       ?       ? 
1 1 1   37    7   21 o    451.9    2.5    0.0000   0.0000          ?        ?  2042.6306  22.3483          ?        ?      451.9        2.5       ?       ? 
1 1 1   37    7   22 f     86.0    7.4    0.0000   0.0000          ?        ?    74.0685  12.7704          ?        ?       86.0        7.4       ?       ? 
1 1 1   37    7   23 o    229.2    3.1    0.0000   0.0000          ?        ?   525.5033  14.0475          ?        ?      229.2        3.1       ?       ? 
1 1 1   37    7   24 o    429.9    2.5    0.0000   0.0000          ?        ?  1848.5201  21.7097          ?        ?      429.9        2.5       ?       ? 
1 1 1   37    7   25 o    261.4    2.8    0.0000   0.0000          ?        ?   683.2181  14.6860          ?        ?      261.4        2.8       ?       ? 
1 1 1   37    7   26 o    232.7    3.2    0.0000   0.0000          ?        ?   541.4664  14.6860          ?        ?      232.7        3.2       ?       ? 
1 1 1   37    7   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    7   28 f    784.2    3.2    0.0000   0.0000          ?        ?  6150.8789  49.8047          ?        ?      784.2        3.2       ?       ? 
1 1 1   37    7   29 o    408.4    2.7    0.0000   0.0000          ?        ?  1667.8186  21.7097          ?        ?      408.4        2.7       ?       ? 
1 1 1   37    7   30 o    224.3    3.3    0.0000   0.0000          ?        ?   503.1551  14.6860          ?        ?      224.3        3.3       ?       ? 
1 1 1   37    7   31 o    245.2    3.1    0.0000   0.0000          ?        ?   601.4874  15.3245          ?        ?      245.2        3.1       ?       ? 
1 1 1   37    7   32 o    518.7    2.7    0.0000   0.0000          ?        ?  2690.7300  28.0950          ?        ?      518.7        2.7       ?       ? 
1 1 1   37    7   33 o    384.4    2.4    0.0000   0.0000          ?        ?  1478.1776  18.5171          ?        ?      384.4        2.4       ?       ? 
1 1 1   37    7   34 o    519.5    2.6    0.0000   0.0000          ?        ?  2699.6694  26.8179          ?        ?      519.5        2.6       ?       ? 
1 1 1   37    7   35 o    397.3    2.5    0.0000   0.0000          ?        ?  1579.0640  19.7942          ?        ?      397.3        2.5       ?       ? 
1 1 1   37    7   36 o    130.2    5.9    0.0000   0.0000          ?        ?   169.8468  15.3245          ?        ?      130.2        5.9       ?       ? 
1 1 1   37    7   37 o    289.6    3.0    0.0000   0.0000          ?        ?   839.0174  17.2401          ?        ?      289.6        3.0       ?       ? 
1 1 1   37    7   38 o    607.5    2.6    0.0000   0.0000          ?        ?  3691.2935  31.9261          ?        ?      607.5        2.6       ?       ? 
1 1 1   37    7   39 o    214.1    3.6    0.0000   0.0000          ?        ?   458.4586  15.3245          ?        ?      214.1        3.6       ?       ? 
1 1 1   37    7   40 o    317.3    2.9    0.0000   0.0000          ?        ?  1006.9486  18.5171          ?        ?      317.3        2.9       ?       ? 
1 1 1   37    7   41 o    416.7    2.5    0.0000   0.0000          ?        ?  1736.7788  21.0712          ?        ?      416.7        2.5       ?       ? 
1 1 1   37    7   42 o    291.5    3.0    0.0000   0.0000          ?        ?   849.8723  17.2401          ?        ?      291.5        3.0       ?       ? 
1 1 1   37    7   43 o    246.1    3.5    0.0000   0.0000          ?        ?   605.9570  17.2401          ?        ?      246.1        3.5       ?       ? 
1 1 1   37    7   44 o    195.3    4.3    0.0000   0.0000          ?        ?   381.8359  16.6016          ?        ?      195.3        4.3       ?       ? 
1 1 1   37    7   45 o    464.7    2.7    0.0000   0.0000          ?        ?  2160.1187  25.5409          ?        ?      464.7        2.7       ?       ? 
1 1 1   37    7   46 o    381.4    2.7    0.0000   0.0000          ?        ?  1455.1908  20.4327          ?        ?      381.4        2.7       ?       ? 
1 1 1   37    7   47 o    125.9    6.6    0.0000   0.0000          ?        ?   158.9919  16.6016          ?        ?      125.9        6.6       ?       ? 
1 1 1   37    7   48 o    168.1    5.1    0.0000   0.0000          ?        ?   282.8651  17.2401          ?        ?      168.1        5.1       ?       ? 
1 1 1   37    7   49 o    354.1    3.0    0.0000   0.0000          ?        ?  1254.6949  21.0712          ?        ?      354.1        3.0       ?       ? 
1 1 1   37    7   50 o    271.2    3.5    0.0000   0.0000          ?        ?   736.2155  19.1556          ?        ?      271.2        3.5       ?       ? 
1 1 1   37    7   51 o    227.3    4.1    0.0000   0.0000          ?        ?   517.2025  18.5171          ?        ?      227.3        4.1       ?       ? 
1 1 1   37    7   52 o     82.3   10.5    0.0000   0.0000          ?        ?    68.3218  17.2401          ?        ?       82.3       10.5       ?       ? 
1 1 1   37    7   53 o    124.3    7.4    0.0000   0.0000          ?        ?   155.1608  18.5171          ?        ?      124.3        7.4       ?       ? 
1 1 1   37    7   54 o     37.0   15.2    0.0000   0.0000          ?        ?     5.1082  17.8786          ?        ?       37.0       15.2       ?       ? 
1 1 1   37    7   55 o     95.2    9.4    0.0000   0.0000          ?        ?    91.3086  17.8786          ?        ?       95.2        9.4       ?       ? 
1 1 1   37    7   56 o     93.7   10.2    0.0000   0.0000          ?        ?    88.7545  19.1556          ?        ?       93.7       10.2       ?       ? 
1 1 1   37    7   57 o    306.9    3.4    0.0000   0.0000          ?        ?   943.0964  21.0712          ?        ?      306.9        3.4       ?       ? 
1 1 1   37    7   58 o    226.5    4.4    0.0000   0.0000          ?        ?   514.0099  19.7942          ?        ?      226.5        4.4       ?       ? 
1 1 1   37    7   59 o    171.6    5.8    0.0000   0.0000          ?        ?   295.6355  19.7942          ?        ?      171.6        5.8       ?       ? 
1 1 1   37    7   60 o     70.6   14.5    0.0000   0.0000          ?        ?    52.9973  19.7942          ?        ?       70.6       14.5       ?       ? 
1 1 1   37    7   61 o    217.9    4.5    0.0000   0.0000          ?        ?   476.3371  19.7942          ?        ?      217.9        4.5       ?       ? 
1 1 1   37    7   62 f     34.3   15.0    0.0000   0.0000          ?        ?    -3.8311  19.7942          ?        ?       34.3       15.0       ?       ? 
1 1 1   37    7   63 o     33.2   14.8    0.0000   0.0000          ?        ?    -6.3852  19.7942          ?        ?       33.2       14.8       ?       ? 
1 1 1   37    7   64 o    202.8    4.7    0.0000   0.0000          ?        ?   413.1235  19.1556          ?        ?      202.8        4.7       ?       ? 
1 1 1   37    7   65 f     78.7   12.2    0.0000   0.0000          ?        ?    63.8522  19.1556          ?        ?       78.7       12.2       ?       ? 
1 1 1   37    8    0 o    611.6    4.2 3741.0984  51.0817  3741.0984  51.0817  3741.0984  51.0817      611.6      4.2      611.6        4.2     0.0     0.0 
1 1 1   37    8    1 o    843.4    3.4    0.0000   0.0000          ?        ?  7113.7690  57.4669          ?        ?      843.4        3.4       ?       ? 
1 1 1   37    8    2 o    255.2    2.8    0.0000   0.0000          ?        ?   651.2921  14.0475          ?        ?      255.2        2.8       ?       ? 
1 1 1   37    8    3 o   1246.5    4.6    0.0000   0.0000          ?        ? 15540.9775 114.9339          ?        ?     1246.5        4.6       ?       ? 
1 1 1   37    8    4 o    886.6    3.5    0.0000   0.0000          ?        ?  7862.1172  62.5751          ?        ?      886.6        3.5       ?       ? 
1 1 1   37    8    5 o    164.3    3.5    0.0000   0.0000          ?        ?   270.0946  11.4934          ?        ?      164.3        3.5       ?       ? 
1 1 1   37    8    6 o    158.6    3.6    0.0000   0.0000          ?        ?   251.5775  11.4934          ?        ?      158.6        3.6       ?       ? 
1 1 1   37    8    7 o    988.9    3.7    0.0000   0.0000          ?        ?  9780.8750  73.4300          ?        ?      988.9        3.7       ?       ? 
1 1 1   37    8    8 o    413.1    2.5    0.0000   0.0000          ?        ?  1706.7682  20.4327          ?        ?      413.1        2.5       ?       ? 
1 1 1   37    8    9 o    168.4    3.2    0.0000   0.0000          ?        ?   283.5036  10.8549          ?        ?      168.4        3.2       ?       ? 
1 1 1   37    8   10 o    630.5    2.8    0.0000   0.0000          ?        ?  3976.0742  35.1187          ?        ?      630.5        2.8       ?       ? 
1 1 1   37    8   11 o    296.8    2.6    0.0000   0.0000          ?        ?   881.1599  15.3245          ?        ?      296.8        2.6       ?       ? 
1 1 1   37    8   12 o    400.4    2.5    0.0000   0.0000          ?        ?  1603.3279  19.7942          ?        ?      400.4        2.5       ?       ? 
1 1 1   37    8   13 o    909.6    3.4    0.0000   0.0000          ?        ?  8275.2402  62.5751          ?        ?      909.6        3.4       ?       ? 
1 1 1   37    8   14 o    634.6    2.8    0.0000   0.0000          ?        ?  4027.1560  35.7572          ?        ?      634.6        2.8       ?       ? 
1 1 1   37    8   15 o    205.3    3.3    0.0000   0.0000          ?        ?   421.4243  13.4090          ?        ?      205.3        3.3       ?       ? 
1 1 1   37    8   16 o    235.0    3.0    0.0000   0.0000          ?        ?   552.3212  14.0475          ?        ?      235.0        3.0       ?       ? 
1 1 1   37    8   17 o    405.9    2.3    0.0000   0.0000          ?        ?  1648.0244  18.5171          ?        ?      405.9        2.3       ?       ? 
1 1 1   37    8   18 o    662.8    2.7    0.0000   0.0000          ?        ?  4393.6670  36.3957          ?        ?      662.8        2.7       ?       ? 
1 1 1   37    8   19 o    172.5    3.7    0.0000   0.0000          ?        ?   297.5511  12.7704          ?        ?      172.5        3.7       ?       ? 
1 1 1   37    8   20 o    701.7    3.0    0.0000   0.0000          ?        ?  4924.9170  42.1424          ?        ?      701.7        3.0       ?       ? 
1 1 1   37    8   21 o    561.6    2.6    0.0000   0.0000          ?        ?  3154.2969  29.3720          ?        ?      561.6        2.6       ?       ? 
1 1 1   37    8   22 o    506.4    2.5    0.0000   0.0000          ?        ?  2564.3030  25.5409          ?        ?      506.4        2.5       ?       ? 
1 1 1   37    8   23 o     82.6    7.7    0.0000   0.0000          ?        ?    68.3218  12.7704          ?        ?       82.6        7.7       ?       ? 
1 1 1   37    8   24 o    378.3    2.4    0.0000   0.0000          ?        ?  1430.9270  18.5171          ?        ?      378.3        2.4       ?       ? 
1 1 1   37    8   25 o    221.7    3.2    0.0000   0.0000          ?        ?   491.6617  14.0475          ?        ?      221.7        3.2       ?       ? 
1 1 1   37    8   26 o    292.5    2.8    0.0000   0.0000          ?        ?   855.6190  16.6016          ?        ?      292.5        2.8       ?       ? 
1 1 1   37    8   27 o    193.4    3.8    0.0000   0.0000          ?        ?   374.1737  14.6860          ?        ?      193.4        3.8       ?       ? 
1 1 1   37    8   28 o    306.6    2.6    0.0000   0.0000          ?        ?   939.9038  15.9630          ?        ?      306.6        2.6       ?       ? 
1 1 1   37    8   29 o    371.5    2.6    0.0000   0.0000          ?        ?  1380.4838  19.1556          ?        ?      371.5        2.6       ?       ? 
1 1 1   37    8   30 o    154.9    4.5    0.0000   0.0000          ?        ?   240.0841  14.0475          ?        ?      154.9        4.5       ?       ? 
1 1 1   37    8   31 o     28.3   12.7    0.0000   0.0000          ?        ?    -6.3852  14.6860          ?        ?       28.3       12.7       ?       ? 
1 1 1   37    8   32 o    324.8    2.7    0.0000   0.0000          ?        ?  1055.4763  17.2401          ?        ?      324.8        2.7       ?       ? 
1 1 1   37    8   33 o    199.6    3.8    0.0000   0.0000          ?        ?   398.4375  15.3245          ?        ?      199.6        3.8       ?       ? 
1 1 1   37    8   34 o    298.8    2.8    0.0000   0.0000          ?        ?   893.2917  16.6016          ?        ?      298.8        2.8       ?       ? 
1 1 1   37    8   35 o    177.7    4.1    0.0000   0.0000          ?        ?   316.0682  14.6860          ?        ?      177.7        4.1       ?       ? 
1 1 1   37    8   36 o    254.0    3.1    0.0000   0.0000          ?        ?   645.5453  15.9630          ?        ?      254.0        3.1       ?       ? 
1 1 1   37    8   37 o    186.7    4.1    0.0000   0.0000          ?        ?   348.6328  15.3245          ?        ?      186.7        4.1       ?       ? 
1 1 1   37    8   38 o    717.9    2.8    0.0000   0.0000          ?        ?  5156.0620  40.8654          ?        ?      717.9        2.8       ?       ? 
1 1 1   37    8   39 f    226.5    3.5    0.0000   0.0000          ?        ?   513.3714  15.9630          ?        ?      226.5        3.5       ?       ? 
1 1 1   37    8   40 o    312.5    2.9    0.0000   0.0000          ?        ?   976.9381  17.8786          ?        ?      312.5        2.9       ?       ? 
1 1 1   37    8   41 o    250.9    3.3    0.0000   0.0000          ?        ?   629.5823  16.6016          ?        ?      250.9        3.3       ?       ? 
1 1 1   37    8   42 o    301.8    3.1    0.0000   0.0000          ?        ?   911.1703  18.5171          ?        ?      301.8        3.1       ?       ? 
1 1 1   37    8   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    8   44 o    185.9    4.6    0.0000   0.0000          ?        ?   346.0787  17.2401          ?        ?      185.9        4.6       ?       ? 
1 1 1   37    8   45 o    125.7    6.6    0.0000   0.0000          ?        ?   158.3534  16.6016          ?        ?      125.7        6.6       ?       ? 
1 1 1   37    8   46 o    423.8    2.6    0.0000   0.0000          ?        ?  1796.7998  22.3483          ?        ?      423.8        2.6       ?       ? 
1 1 1   37    8   47 o    133.5    6.9    0.0000   0.0000          ?        ?   178.7861  18.5171          ?        ?      133.5        6.9       ?       ? 
1 1 1   37    8   48 o    248.1    3.7    0.0000   0.0000          ?        ?   616.1733  18.5171          ?        ?      248.1        3.7       ?       ? 
1 1 1   37    8   49 o    273.9    3.4    0.0000   0.0000          ?        ?   750.9014  18.5171          ?        ?      273.9        3.4       ?       ? 
1 1 1   37    8   50 o    363.4    3.0    0.0000   0.0000          ?        ?  1321.7397  21.7097          ?        ?      363.4        3.0       ?       ? 
1 1 1   37    8   51 o    425.1    2.8    0.0000   0.0000          ?        ?  1808.2933  23.6253          ?        ?      425.1        2.8       ?       ? 
1 1 1   37    8   52 o    199.1    4.6    0.0000   0.0000          ?        ?   397.1605  18.5171          ?        ?      199.1        4.6       ?       ? 
1 1 1   37    8   53 o    295.1    3.4    0.0000   0.0000          ?        ?   871.5820  19.7942          ?        ?      295.1        3.4       ?       ? 
1 1 1   37    8   54 f    124.2    7.7    0.0000   0.0000          ?        ?   155.1608  19.1556          ?        ?      124.2        7.7       ?       ? 
1 1 1   37    8   55 o    170.6    5.4    0.0000   0.0000          ?        ?   291.8044  18.5171          ?        ?      170.6        5.4       ?       ? 
1 1 1   37    8   56 o     54.3   16.3    0.0000   0.0000          ?        ?    30.6490  19.1556          ?        ?       54.3       16.3       ?       ? 
1 1 1   37    8   57 o    170.5    5.6    0.0000   0.0000          ?        ?   291.8044  19.1556          ?        ?      170.5        5.6       ?       ? 
1 1 1   37    8   58 o    135.9    7.5    0.0000   0.0000          ?        ?   185.8098  20.4327          ?        ?      135.9        7.5       ?       ? 
1 1 1   37    8   59 o     91.2   10.5    0.0000   0.0000          ?        ?    84.2849  19.1556          ?        ?       91.2       10.5       ?       ? 
1 1 1   37    8   60 o     41.4   16.3    0.0000   0.0000          ?        ?    10.8549  19.7942          ?        ?       41.4       16.3       ?       ? 
1 1 1   37    8   61 o     37.5   15.6    0.0000   0.0000          ?        ?     4.4697  19.1556          ?        ?       37.5       15.6       ?       ? 
1 1 1   37    8   62 f     53.9   16.4    0.0000   0.0000          ?        ?    30.6490  19.1556          ?        ?       53.9       16.4       ?       ? 
1 1 1   37    8   63 o    170.1    5.8    0.0000   0.0000          ?        ?   291.1659  19.7942          ?        ?      170.1        5.8       ?       ? 
1 1 1   37    8   64 o     51.3   16.5    0.0000   0.0000          ?        ?    27.4564  19.1556          ?        ?       51.3       16.5       ?       ? 
1 1 1   37    9    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    9    1 o    325.0    2.5    0.0000   0.0000          ?        ?  1056.1147  15.9630          ?        ?      325.0        2.5       ?       ? 
1 1 1   37    9    2 o    163.2    3.3    0.0000   0.0000          ?        ?   266.2635  10.8549          ?        ?      163.2        3.3       ?       ? 
1 1 1   37    9    3 f     52.0   10.8    0.0000   0.0000          ?        ?    28.0950  10.8549          ?        ?       52.0       10.8       ?       ? 
1 1 1   37    9    4 o    335.5    2.4    0.0000   0.0000          ?        ?  1125.7136  15.9630          ?        ?      335.5        2.4       ?       ? 
1 1 1   37    9    5 o    205.0    2.8    0.0000   0.0000          ?        ?   420.1472  11.4934          ?        ?      205.0        2.8       ?       ? 
1 1 1   37    9    6 o    296.2    2.6    0.0000   0.0000          ?        ?   877.3287  15.3245          ?        ?      296.2        2.6       ?       ? 
1 1 1   37    9    7 o    183.8    3.3    0.0000   0.0000          ?        ?   337.7780  12.1319          ?        ?      183.8        3.3       ?       ? 
1 1 1   37    9    8 o    521.0    2.5    0.0000   0.0000          ?        ?  2714.3555  26.1794          ?        ?      521.0        2.5       ?       ? 
1 1 1   37    9    9 o     86.4    5.9    0.0000   0.0000          ?        ?    74.7070  10.2163          ?        ?       86.4        5.9       ?       ? 
1 1 1   37    9   10 o    236.4    2.7    0.0000   0.0000          ?        ?   558.7064  12.7704          ?        ?      236.4        2.7       ?       ? 
1 1 1   37    9   11 o    577.2    2.6    0.0000   0.0000          ?        ?  3332.4446  30.0105          ?        ?      577.2        2.6       ?       ? 
1 1 1   37    9   12 o    657.1    2.7    0.0000   0.0000          ?        ?  4318.3218  35.7572          ?        ?      657.1        2.7       ?       ? 
1 1 1   37    9   13 o    101.4    5.7    0.0000   0.0000          ?        ?   102.8020  11.4934          ?        ?      101.4        5.7       ?       ? 
1 1 1   37    9   14 o    715.7    3.0    0.0000   0.0000          ?        ?  5122.8589  42.7809          ?        ?      715.7        3.0       ?       ? 
1 1 1   37    9   15 o    356.7    2.4    0.0000   0.0000          ?        ?  1272.5736  17.2401          ?        ?      356.7        2.4       ?       ? 
1 1 1   37    9   16 o    661.6    2.9    0.0000   0.0000          ?        ?  4378.3428  38.3113          ?        ?      661.6        2.9       ?       ? 
1 1 1   37    9   17 o    116.6    4.9    0.0000   0.0000          ?        ?   136.0051  11.4934          ?        ?      116.6        4.9       ?       ? 
1 1 1   37    9   18 f    413.3    2.4    0.0000   0.0000          ?        ?  1708.0454  19.7942          ?        ?      413.3        2.4       ?       ? 
1 1 1   37    9   19 o    556.9    2.5    0.0000   0.0000          ?        ?  3101.9380  28.0950          ?        ?      556.9        2.5       ?       ? 
1 1 1   37    9   20 o    148.6    4.9    0.0000   0.0000          ?        ?   220.9285  14.6860          ?        ?      148.6        4.9       ?       ? 
1 1 1   37    9   21 o   1220.9    4.3    0.0000   0.0000          ?        ? 14912.6729 105.9946          ?        ?     1220.9        4.3       ?       ? 
1 1 1   37    9   22 o    370.9    2.5    0.0000   0.0000          ?        ?  1376.0142  18.5171          ?        ?      370.9        2.5       ?       ? 
1 1 1   37    9   23 o    282.9    2.7    0.0000   0.0000          ?        ?   800.7061  15.3245          ?        ?      282.9        2.7       ?       ? 
1 1 1   37    9   24 o     39.6   13.8    0.0000   0.0000          ?        ?    14.0475  13.4090          ?        ?       39.6       13.8       ?       ? 
1 1 1   37    9   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    9   26 o    241.2    3.0    0.0000   0.0000          ?        ?   581.6932  14.6860          ?        ?      241.2        3.0       ?       ? 
1 1 1   37    9   27 f    604.7    2.6    0.0000   0.0000          ?        ?  3656.8135  31.9261          ?        ?      604.7        2.6       ?       ? 
1 1 1   37    9   28 o     95.8    7.0    0.0000   0.0000          ?        ?    91.9471  13.4090          ?        ?       95.8        7.0       ?       ? 
1 1 1   37    9   29 o    345.1    2.5    0.0000   0.0000          ?        ?  1191.4814  17.2401          ?        ?      345.1        2.5       ?       ? 
1 1 1   37    9   30 o     95.1    7.4    0.0000   0.0000          ?        ?    90.6701  14.0475          ?        ?       95.1        7.4       ?       ? 
1 1 1   37    9   31 o    283.7    2.8    0.0000   0.0000          ?        ?   805.1758  15.9630          ?        ?      283.7        2.8       ?       ? 
1 1 1   37    9   32 o    226.0    3.4    0.0000   0.0000          ?        ?   510.8173  15.3245          ?        ?      226.0        3.4       ?       ? 
1 1 1   37    9   33 o    234.8    3.3    0.0000   0.0000          ?        ?   551.6827  15.3245          ?        ?      234.8        3.3       ?       ? 
1 1 1   37    9   34 o    268.7    2.9    0.0000   0.0000          ?        ?   722.1680  15.3245          ?        ?      268.7        2.9       ?       ? 
1 1 1   37    9   35 o    182.0    4.2    0.0000   0.0000          ?        ?   331.3927  15.3245          ?        ?      182.0        4.2       ?       ? 
1 1 1   37    9   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    9   37 o    255.0    3.1    0.0000   0.0000          ?        ?   650.6536  15.9630          ?        ?      255.0        3.1       ?       ? 
1 1 1   37    9   38 o    269.9    3.1    0.0000   0.0000          ?        ?   728.5532  16.6016          ?        ?      269.9        3.1       ?       ? 
1 1 1   37    9   39 o    383.1    2.6    0.0000   0.0000          ?        ?  1467.9612  19.7942          ?        ?      383.1        2.6       ?       ? 
1 1 1   37    9   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    9   41 f    403.9    2.7    0.0000   0.0000          ?        ?  1632.0613  21.7097          ?        ?      403.9        2.7       ?       ? 
1 1 1   37    9   42 o     22.6   10.9    0.0000   0.0000          ?        ?   -25.5409  15.3245          ?        ?       22.6       10.9       ?       ? 
1 1 1   37    9   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37    9   44 o    334.4    2.9    0.0000   0.0000          ?        ?  1118.6898  19.1556          ?        ?      334.4        2.9       ?       ? 
1 1 1   37    9   45 o    265.2    3.4    0.0000   0.0000          ?        ?   703.6508  17.8786          ?        ?      265.2        3.4       ?       ? 
1 1 1   37    9   46 o    477.2    2.7    0.0000   0.0000          ?        ?  2278.2451  25.5409          ?        ?      477.2        2.7       ?       ? 
1 1 1   37    9   47 o    163.0    5.3    0.0000   0.0000          ?        ?   266.2635  17.2401          ?        ?      163.0        5.3       ?       ? 
1 1 1   37    9   48 o    179.6    5.0    0.0000   0.0000          ?        ?   323.0919  17.8786          ?        ?      179.6        5.0       ?       ? 
1 1 1   37    9   49 o    150.8    5.9    0.0000   0.0000          ?        ?   227.9522  17.8786          ?        ?      150.8        5.9       ?       ? 
1 1 1   37    9   50 o     74.1   12.1    0.0000   0.0000          ?        ?    55.5514  17.8786          ?        ?       74.1       12.1       ?       ? 
1 1 1   37    9   51 o    372.3    3.0    0.0000   0.0000          ?        ?  1386.8689  22.3483          ?        ?      372.3        3.0       ?       ? 
1 1 1   37    9   52 o    183.8    5.2    0.0000   0.0000          ?        ?   338.4165  19.1556          ?        ?      183.8        5.2       ?       ? 
1 1 1   37    9   53 o    229.8    4.2    0.0000   0.0000          ?        ?   528.6959  19.1556          ?        ?      229.8        4.2       ?       ? 
1 1 1   37    9   54 o     81.8   10.9    0.0000   0.0000          ?        ?    67.6833  17.8786          ?        ?       81.8       10.9       ?       ? 
1 1 1   37    9   55 o    113.8    8.1    0.0000   0.0000          ?        ?   130.2584  18.5171          ?        ?      113.8        8.1       ?       ? 
1 1 1   37    9   56 o     21.9   10.9    0.0000   0.0000          ?        ?   -49.1662  19.1556          ?        ?       21.9       10.9       ?       ? 
1 1 1   37    9   57 o    331.4    3.2    0.0000   0.0000          ?        ?  1099.5342  21.0712          ?        ?      331.4        3.2       ?       ? 
1 1 1   37    9   58 o    221.9    4.3    0.0000   0.0000          ?        ?   493.5772  19.1556          ?        ?      221.9        4.3       ?       ? 
1 1 1   37    9   59 o     20.3   10.2    0.0000   0.0000          ?        ?   -60.0210  19.1556          ?        ?       20.3       10.2       ?       ? 
1 1 1   37    9   60 o     99.5    9.6    0.0000   0.0000          ?        ?   100.2479  19.1556          ?        ?       99.5        9.6       ?       ? 
1 1 1   37    9   61 o    158.1    6.1    0.0000   0.0000          ?        ?   251.5775  19.1556          ?        ?      158.1        6.1       ?       ? 
1 1 1   37    9   62 o    153.3    6.5    0.0000   0.0000          ?        ?   236.8915  19.7942          ?        ?      153.3        6.5       ?       ? 
1 1 1   37    9   63 o    174.0    5.5    0.0000   0.0000          ?        ?   304.5748  19.1556          ?        ?      174.0        5.5       ?       ? 
1 1 1   37    9   64 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   10    0 o    836.6    4.6 7000.1128  76.6226  7000.1128  76.6226  7000.1128  76.6226      836.6      4.6      836.6        4.6     0.0     0.0 
1 1 1   37   10    1 o    472.6    2.6    0.0000   0.0000          ?        ?  2233.5486  24.2638          ?        ?      472.6        2.6       ?       ? 
1 1 1   37   10    2 o    475.3    2.5    0.0000   0.0000          ?        ?  2259.7280  23.6253          ?        ?      475.3        2.5       ?       ? 
1 1 1   37   10    3 o    111.6    4.3    0.0000   0.0000          ?        ?   124.5117   9.5778          ?        ?      111.6        4.3       ?       ? 
1 1 1   37   10    4 o    875.7    3.5    0.0000   0.0000          ?        ?  7669.2832  61.2981          ?        ?      875.7        3.5       ?       ? 
1 1 1   37   10    5 o    674.8    3.0    0.0000   0.0000          ?        ?  4553.9365  40.2269          ?        ?      674.8        3.0       ?       ? 
1 1 1   37   10    6 o    921.2    3.5    0.0000   0.0000          ?        ?  8487.2295  65.1292          ?        ?      921.2        3.5       ?       ? 
1 1 1   37   10    7 o   1077.4    4.0    0.0000   0.0000          ?        ? 11611.5156  86.2004          ?        ?     1077.4        4.0       ?       ? 
1 1 1   37   10    8 o    255.6    3.0    0.0000   0.0000          ?        ?   653.2076  15.3245          ?        ?      255.6        3.0       ?       ? 
1 1 1   37   10    9 o    781.7    3.1    0.0000   0.0000          ?        ?  6111.9292  48.5276          ?        ?      781.7        3.1       ?       ? 
1 1 1   37   10   10 o    621.4    2.7    0.0000   0.0000          ?        ?  3861.7788  33.8416          ?        ?      621.4        2.7       ?       ? 
1 1 1   37   10   11 o    245.0    2.6    0.0000   0.0000          ?        ?   600.2103  12.7704          ?        ?      245.0        2.6       ?       ? 
1 1 1   37   10   12 o    269.4    2.6    0.0000   0.0000          ?        ?   725.9991  14.0475          ?        ?      269.4        2.6       ?       ? 
1 1 1   37   10   13 o    299.1    2.5    0.0000   0.0000          ?        ?   894.5688  14.6860          ?        ?      299.1        2.5       ?       ? 
1 1 1   37   10   14 o    424.8    2.4    0.0000   0.0000          ?        ?  1805.1007  20.4327          ?        ?      424.8        2.4       ?       ? 
1 1 1   37   10   15 o    119.8    5.6    0.0000   0.0000          ?        ?   143.6674  13.4090          ?        ?      119.8        5.6       ?       ? 
1 1 1   37   10   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   10   17 o    455.1    2.5    0.0000   0.0000          ?        ?  2071.3640  22.3483          ?        ?      455.1        2.5       ?       ? 
1 1 1   37   10   18 o    474.1    2.4    0.0000   0.0000          ?        ?  2248.2346  22.9868          ?        ?      474.1        2.4       ?       ? 
1 1 1   37   10   19 o    440.0    2.4    0.0000   0.0000          ?        ?  1935.9977  21.0712          ?        ?      440.0        2.4       ?       ? 
1 1 1   37   10   20 o    121.2    5.0    0.0000   0.0000          ?        ?   146.8600  12.1319          ?        ?      121.2        5.0       ?       ? 
1 1 1   37   10   21 o    192.6    3.5    0.0000   0.0000          ?        ?   370.9810  13.4090          ?        ?      192.6        3.5       ?       ? 
1 1 1   37   10   22 o    258.9    2.8    0.0000   0.0000          ?        ?   670.4477  14.6860          ?        ?      258.9        2.8       ?       ? 
1 1 1   37   10   23 o    277.9    2.5    0.0000   0.0000          ?        ?   772.6111  14.0475          ?        ?      277.9        2.5       ?       ? 
1 1 1   37   10   24 o    290.6    2.6    0.0000   0.0000          ?        ?   844.7642  15.3245          ?        ?      290.6        2.6       ?       ? 
1 1 1   37   10   25 o    424.8    2.6    0.0000   0.0000          ?        ?  1805.1007  21.7097          ?        ?      424.8        2.6       ?       ? 
1 1 1   37   10   26 o    385.6    2.4    0.0000   0.0000          ?        ?  1487.1168  18.5171          ?        ?      385.6        2.4       ?       ? 
1 1 1   37   10   27 o    325.1    2.7    0.0000   0.0000          ?        ?  1057.3918  17.8786          ?        ?      325.1        2.7       ?       ? 
1 1 1   37   10   28 o    235.3    3.1    0.0000   0.0000          ?        ?   553.5982  14.6860          ?        ?      235.3        3.1       ?       ? 
1 1 1   37   10   29 o    383.4    2.4    0.0000   0.0000          ?        ?  1470.5154  18.5171          ?        ?      383.4        2.4       ?       ? 
1 1 1   37   10   30 o     60.8   11.4    0.0000   0.0000          ?        ?    38.3113  13.4090          ?        ?       60.8       11.4       ?       ? 
1 1 1   37   10   31 o    266.9    2.9    0.0000   0.0000          ?        ?   712.5901  15.3245          ?        ?      266.9        2.9       ?       ? 
1 1 1   37   10   32 o    297.7    2.7    0.0000   0.0000          ?        ?   886.2681  15.9630          ?        ?      297.7        2.7       ?       ? 
1 1 1   37   10   33 o    289.4    3.0    0.0000   0.0000          ?        ?   837.7404  17.2401          ?        ?      289.4        3.0       ?       ? 
1 1 1   37   10   34 o    170.8    4.5    0.0000   0.0000          ?        ?   291.8044  15.3245          ?        ?      170.8        4.5       ?       ? 
1 1 1   37   10   35 o    364.3    2.6    0.0000   0.0000          ?        ?  1327.4865  19.1556          ?        ?      364.3        2.6       ?       ? 
1 1 1   37   10   36 o     17.4    8.8    0.0000   0.0000          ?        ?   -49.1662  14.6860          ?        ?       17.4        8.8       ?       ? 
1 1 1   37   10   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   10   38 o    363.0    2.6    0.0000   0.0000          ?        ?  1317.9086  19.1556          ?        ?      363.0        2.6       ?       ? 
1 1 1   37   10   39 o    418.6    2.5    0.0000   0.0000          ?        ?  1752.7418  21.0712          ?        ?      418.6        2.5       ?       ? 
1 1 1   37   10   40 o    260.6    3.3    0.0000   0.0000          ?        ?   679.3870  17.2401          ?        ?      260.6        3.3       ?       ? 
1 1 1   37   10   41 o    261.3    3.2    0.0000   0.0000          ?        ?   683.2181  16.6016          ?        ?      261.3        3.2       ?       ? 
1 1 1   37   10   42 o    374.5    2.6    0.0000   0.0000          ?        ?  1402.8320  19.7942          ?        ?      374.5        2.6       ?       ? 
1 1 1   37   10   43 o     51.1   15.2    0.0000   0.0000          ?        ?    26.8179  16.6016          ?        ?       51.1       15.2       ?       ? 
1 1 1   37   10   44 o    337.9    2.8    0.0000   0.0000          ?        ?  1142.3152  19.1556          ?        ?      337.9        2.8       ?       ? 
1 1 1   37   10   45 o     95.4    8.4    0.0000   0.0000          ?        ?    91.3086  15.9630          ?        ?       95.4        8.4       ?       ? 
1 1 1   37   10   46 o    338.3    3.0    0.0000   0.0000          ?        ?  1144.8693  20.4327          ?        ?      338.3        3.0       ?       ? 
1 1 1   37   10   47 o    228.7    3.9    0.0000   0.0000          ?        ?   523.5877  17.8786          ?        ?      228.7        3.9       ?       ? 
1 1 1   37   10   48 o    252.8    3.7    0.0000   0.0000          ?        ?   639.7986  18.5171          ?        ?      252.8        3.7       ?       ? 
1 1 1   37   10   49 f     61.2   14.8    0.0000   0.0000          ?        ?    39.5883  17.8786          ?        ?       61.2       14.8       ?       ? 
1 1 1   37   10   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   10   51 o    249.5    3.8    0.0000   0.0000          ?        ?   623.1971  19.1556          ?        ?      249.5        3.8       ?       ? 
1 1 1   37   10   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   10   53 o    264.7    3.6    0.0000   0.0000          ?        ?   701.7353  19.1556          ?        ?      264.7        3.6       ?       ? 
1 1 1   37   10   54 o    212.1    4.5    0.0000   0.0000          ?        ?   450.7963  19.1556          ?        ?      212.1        4.5       ?       ? 
1 1 1   37   10   55 o    224.8    4.4    0.0000   0.0000          ?        ?   506.3477  19.7942          ?        ?      224.8        4.4       ?       ? 
1 1 1   37   10   56 o     30.5   13.9    0.0000   0.0000          ?        ?   -10.8549  18.5171          ?        ?       30.5       13.9       ?       ? 
1 1 1   37   10   57 o    141.0    6.8    0.0000   0.0000          ?        ?   199.8573  19.1556          ?        ?      141.0        6.8       ?       ? 
1 1 1   37   10   58 o    181.3    5.5    0.0000   0.0000          ?        ?   330.1157  19.7942          ?        ?      181.3        5.5       ?       ? 
1 1 1   37   10   59 o    157.6    5.9    0.0000   0.0000          ?        ?   249.6619  18.5171          ?        ?      157.6        5.9       ?       ? 
1 1 1   37   10   60 o    286.1    3.7    0.0000   0.0000          ?        ?   820.5003  21.0712          ?        ?      286.1        3.7       ?       ? 
1 1 1   37   10   61 o    301.2    3.5    0.0000   0.0000          ?        ?   909.2548  21.0712          ?        ?      301.2        3.5       ?       ? 
1 1 1   37   10   62 o     70.5   13.6    0.0000   0.0000          ?        ?    52.9973  18.5171          ?        ?       70.5       13.6       ?       ? 
1 1 1   37   10   63 o     48.6   16.5    0.0000   0.0000          ?        ?    23.6253  19.1556          ?        ?       48.6       16.5       ?       ? 
1 1 1   37   11    0 o    824.3    4.8 6797.0625  78.5382  6797.0625  78.5382  6797.0625  78.5382      824.3      4.8      824.3        4.8     0.0     0.0 
1 1 1   37   11    1 o    829.2    3.1    0.0000   0.0000          ?        ?  6877.5161  51.7203          ?        ?      829.2        3.1       ?       ? 
1 1 1   37   11    2 o    354.7    2.3    0.0000   0.0000          ?        ?  1257.8876  16.6016          ?        ?      354.7        2.3       ?       ? 
1 1 1   37   11    3 o    214.3    2.7    0.0000   0.0000          ?        ?   459.0970  11.4934          ?        ?      214.3        2.7       ?       ? 
1 1 1   37   11    4 o    104.2    4.6    0.0000   0.0000          ?        ?   108.5487   9.5778          ?        ?      104.2        4.6       ?       ? 
1 1 1   37   11    5 o    559.8    2.6    0.0000   0.0000          ?        ?  3133.8640  29.3720          ?        ?      559.8        2.6       ?       ? 
1 1 1   37   11    6 o    670.9    2.8    0.0000   0.0000          ?        ?  4501.5776  37.6728          ?        ?      670.9        2.8       ?       ? 
1 1 1   37   11    7 o    140.0    3.9    0.0000   0.0000          ?        ?   196.0261  10.8549          ?        ?      140.0        3.9       ?       ? 
1 1 1   37   11    8 o    231.2    2.6    0.0000   0.0000          ?        ?   534.4426  12.1319          ?        ?      231.2        2.6       ?       ? 
1 1 1   37   11    9 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   11   10 o    501.9    2.5    0.0000   0.0000          ?        ?  2518.9678  24.9023          ?        ?      501.9        2.5       ?       ? 
1 1 1   37   11   11 o    150.5    3.6    0.0000   0.0000          ?        ?   226.6752  10.8549          ?        ?      150.5        3.6       ?       ? 
1 1 1   37   11   12 o    282.3    2.5    0.0000   0.0000          ?        ?   796.8750  14.0475          ?        ?      282.3        2.5       ?       ? 
1 1 1   37   11   13 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   11   14 f    653.6    2.8    0.0000   0.0000          ?        ?  4272.3481  36.3957          ?        ?      653.6        2.8       ?       ? 
1 1 1   37   11   15 o    347.9    2.4    0.0000   0.0000          ?        ?  1210.6371  16.6016          ?        ?      347.9        2.4       ?       ? 
1 1 1   37   11   16 o    263.8    2.5    0.0000   0.0000          ?        ?   695.9886  13.4090          ?        ?      263.8        2.5       ?       ? 
1 1 1   37   11   17 o    355.7    2.3    0.0000   0.0000          ?        ?  1265.5498  16.6016          ?        ?      355.7        2.3       ?       ? 
1 1 1   37   11   18 o    184.8    3.3    0.0000   0.0000          ?        ?   341.6091  12.1319          ?        ?      184.8        3.3       ?       ? 
1 1 1   37   11   19 o    373.7    2.5    0.0000   0.0000          ?        ?  1396.4468  18.5171          ?        ?      373.7        2.5       ?       ? 
1 1 1   37   11   20 o    189.6    3.4    0.0000   0.0000          ?        ?   359.4877  12.7704          ?        ?      189.6        3.4       ?       ? 
1 1 1   37   11   21 o    263.1    2.7    0.0000   0.0000          ?        ?   692.1575  14.0475          ?        ?      263.1        2.7       ?       ? 
1 1 1   37   11   22 o    163.9    4.3    0.0000   0.0000          ?        ?   268.8176  14.0475          ?        ?      163.9        4.3       ?       ? 
1 1 1   37   11   23 o    197.5    3.2    0.0000   0.0000          ?        ?   390.1367  12.7704          ?        ?      197.5        3.2       ?       ? 
1 1 1   37   11   24 o     87.1    7.3    0.0000   0.0000          ?        ?    75.9841  12.7704          ?        ?       87.1        7.3       ?       ? 
1 1 1   37   11   25 o    209.3    3.4    0.0000   0.0000          ?        ?   438.0258  14.0475          ?        ?      209.3        3.4       ?       ? 
1 1 1   37   11   26 o    386.5    2.6    0.0000   0.0000          ?        ?  1494.1406  19.7942          ?        ?      386.5        2.6       ?       ? 
1 1 1   37   11   27 o    170.8    4.1    0.0000   0.0000          ?        ?   291.8044  14.0475          ?        ?      170.8        4.1       ?       ? 
1 1 1   37   11   28 o    142.2    4.9    0.0000   0.0000          ?        ?   202.4114  14.0475          ?        ?      142.2        4.9       ?       ? 
1 1 1   37   11   29 o    161.4    4.2    0.0000   0.0000          ?        ?   260.5168  13.4090          ?        ?      161.4        4.2       ?       ? 
1 1 1   37   11   30 o    443.6    2.5    0.0000   0.0000          ?        ?  1968.5621  22.3483          ?        ?      443.6        2.5       ?       ? 
1 1 1   37   11   31 o    228.2    3.2    0.0000   0.0000          ?        ?   521.0336  14.6860          ?        ?      228.2        3.2       ?       ? 
1 1 1   37   11   32 f    396.7    2.4    0.0000   0.0000          ?        ?  1573.9558  19.1556          ?        ?      396.7        2.4       ?       ? 
1 1 1   37   11   33 o    203.7    3.6    0.0000   0.0000          ?        ?   415.0391  14.6860          ?        ?      203.7        3.6       ?       ? 
1 1 1   37   11   34 o    222.3    3.4    0.0000   0.0000          ?        ?   494.2158  15.3245          ?        ?      222.3        3.4       ?       ? 
1 1 1   37   11   35 o    131.2    5.6    0.0000   0.0000          ?        ?   172.4008  14.6860          ?        ?      131.2        5.6       ?       ? 
1 1 1   37   11   36 o    289.1    3.0    0.0000   0.0000          ?        ?   835.8248  17.2401          ?        ?      289.1        3.0       ?       ? 
1 1 1   37   11   37 o    384.7    2.7    0.0000   0.0000          ?        ?  1480.7316  20.4327          ?        ?      384.7        2.7       ?       ? 
1 1 1   37   11   38 o    279.8    3.0    0.0000   0.0000          ?        ?   783.4660  16.6016          ?        ?      279.8        3.0       ?       ? 
1 1 1   37   11   39 o     65.6   12.1    0.0000   0.0000          ?        ?    44.6965  15.3245          ?        ?       65.6       12.1       ?       ? 
1 1 1   37   11   40 o     45.1   14.8    0.0000   0.0000          ?        ?    19.7942  15.3245          ?        ?       45.1       14.8       ?       ? 
1 1 1   37   11   41 o     61.9   13.3    0.0000   0.0000          ?        ?    40.2269  15.9630          ?        ?       61.9       13.3       ?       ? 
1 1 1   37   11   42 o     17.6    8.9    0.0000   0.0000          ?        ?   -52.3588  15.3245          ?        ?       17.6        8.9       ?       ? 
1 1 1   37   11   43 o     79.3   10.1    0.0000   0.0000          ?        ?    63.2136  15.9630          ?        ?       79.3       10.1       ?       ? 
1 1 1   37   11   44 o    127.7    6.3    0.0000   0.0000          ?        ?   163.4615  15.9630          ?        ?      127.7        6.3       ?       ? 
1 1 1   37   11   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   11   46 f    246.3    3.5    0.0000   0.0000          ?        ?   607.2341  17.2401          ?        ?      246.3        3.5       ?       ? 
1 1 1   37   11   47 o    209.3    4.3    0.0000   0.0000          ?        ?   438.6643  17.8786          ?        ?      209.3        4.3       ?       ? 
1 1 1   37   11   48 o     30.2   13.6    0.0000   0.0000          ?        ?    -8.3008  17.2401          ?        ?       30.2       13.6       ?       ? 
1 1 1   37   11   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   11   50 o    359.6    2.9    0.0000   0.0000          ?        ?  1294.2833  21.0712          ?        ?      359.6        2.9       ?       ? 
1 1 1   37   11   51 o     33.0   14.4    0.0000   0.0000          ?        ?    -3.1926  17.8786          ?        ?       33.0       14.4       ?       ? 
1 1 1   37   11   52 o    302.9    3.3    0.0000   0.0000          ?        ?   918.1941  19.7942          ?        ?      302.9        3.3       ?       ? 
1 1 1   37   11   53 o    306.5    3.3    0.0000   0.0000          ?        ?   940.5424  20.4327          ?        ?      306.5        3.3       ?       ? 
1 1 1   37   11   54 o     19.4    9.8    0.0000   0.0000          ?        ?   -58.1055  17.8786          ?        ?       19.4        9.8       ?       ? 
1 1 1   37   11   55 o    191.5    5.2    0.0000   0.0000          ?        ?   367.7885  19.7942          ?        ?      191.5        5.2       ?       ? 
1 1 1   37   11   56 o     88.4   10.8    0.0000   0.0000          ?        ?    79.1767  19.1556          ?        ?       88.4       10.8       ?       ? 
1 1 1   37   11   57 o    363.3    3.0    0.0000   0.0000          ?        ?  1321.1012  21.7097          ?        ?      363.3        3.0       ?       ? 
1 1 1   37   11   58 o     86.4   11.1    0.0000   0.0000          ?        ?    75.9841  19.1556          ?        ?       86.4       11.1       ?       ? 
1 1 1   37   11   59 o    100.4    9.5    0.0000   0.0000          ?        ?   102.1635  19.1556          ?        ?      100.4        9.5       ?       ? 
1 1 1   37   11   60 o     84.7   11.7    0.0000   0.0000          ?        ?    73.4300  19.7942          ?        ?       84.7       11.7       ?       ? 
1 1 1   37   11   61 o     58.0   15.6    0.0000   0.0000          ?        ?    36.3957  18.5171          ?        ?       58.0       15.6       ?       ? 
1 1 1   37   11   62 f    211.5    4.7    0.0000   0.0000          ?        ?   449.5192  19.7942          ?        ?      211.5        4.7       ?       ? 
1 1 1   37   12    0 o     21.5   13.9    0.6385  13.4090     0.6385  13.4090     0.6385  13.4090       21.5     13.9       21.5       13.9     0.0     0.0 
1 1 1   37   12    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   12    2 o    329.7    2.3    0.0000   0.0000          ?        ?  1087.4023  15.3245          ?        ?      329.7        2.3       ?       ? 
1 1 1   37   12    3 o    861.7    3.4    0.0000   0.0000          ?        ?  7426.0063  58.1055          ?        ?      861.7        3.4       ?       ? 
1 1 1   37   12    4 o    394.9    2.4    0.0000   0.0000          ?        ?  1559.2698  19.1556          ?        ?      394.9        2.4       ?       ? 
1 1 1   37   12    5 o    326.4    2.3    0.0000   0.0000          ?        ?  1065.6925  15.3245          ?        ?      326.4        2.3       ?       ? 
1 1 1   37   12    6 o    734.5    3.0    0.0000   0.0000          ?        ?  5395.5078  43.4195          ?        ?      734.5        3.0       ?       ? 
1 1 1   37   12    7 o    322.1    2.3    0.0000   0.0000          ?        ?  1037.5977  14.6860          ?        ?      322.1        2.3       ?       ? 
1 1 1   37   12    8 o    657.3    2.8    0.0000   0.0000          ?        ?  4320.8760  36.3957          ?        ?      657.3        2.8       ?       ? 
1 1 1   37   12    9 o    494.2    2.4    0.0000   0.0000          ?        ?  2442.9839  23.6253          ?        ?      494.2        2.4       ?       ? 
1 1 1   37   12   10 o    657.8    2.8    0.0000   0.0000          ?        ?  4327.2612  36.3957          ?        ?      657.8        2.8       ?       ? 
1 1 1   37   12   11 f    338.6    2.6    0.0000   0.0000          ?        ?  1146.7849  17.8786          ?        ?      338.6        2.6       ?       ? 
1 1 1   37   12   12 o    965.9    3.5    0.0000   0.0000          ?        ?  9331.9932  67.6833          ?        ?      965.9        3.5       ?       ? 
1 1 1   37   12   13 o    149.9    3.6    0.0000   0.0000          ?        ?   224.7596  10.8549          ?        ?      149.9        3.6       ?       ? 
1 1 1   37   12   14 o    277.7    2.5    0.0000   0.0000          ?        ?   771.3342  14.0475          ?        ?      277.7        2.5       ?       ? 
1 1 1   37   12   15 o    333.9    2.4    0.0000   0.0000          ?        ?  1114.8588  15.9630          ?        ?      333.9        2.4       ?       ? 
1 1 1   37   12   16 o    219.4    2.9    0.0000   0.0000          ?        ?   481.4453  12.7704          ?        ?      219.4        2.9       ?       ? 
1 1 1   37   12   17 o    475.1    2.5    0.0000   0.0000          ?        ?  2257.1738  23.6253          ?        ?      475.1        2.5       ?       ? 
1 1 1   37   12   18 o    294.7    2.7    0.0000   0.0000          ?        ?   868.3894  15.9630          ?        ?      294.7        2.7       ?       ? 
1 1 1   37   12   19 f    648.2    2.7    0.0000   0.0000          ?        ?  4202.1108  35.1187          ?        ?      648.2        2.7       ?       ? 
1 1 1   37   12   20 o    982.5    3.6    0.0000   0.0000          ?        ?  9657.0010  70.2374          ?        ?      982.5        3.6       ?       ? 
1 1 1   37   12   21 o    488.4    2.5    0.0000   0.0000          ?        ?  2385.5168  24.9023          ?        ?      488.4        2.5       ?       ? 
1 1 1   37   12   22 f    289.4    2.6    0.0000   0.0000          ?        ?   837.7404  15.3245          ?        ?      289.4        2.6       ?       ? 
1 1 1   37   12   23 o     41.1   13.1    0.0000   0.0000          ?        ?    16.6016  12.1319          ?        ?       41.1       13.1       ?       ? 
1 1 1   37   12   24 o    142.7    4.5    0.0000   0.0000          ?        ?   203.6884  12.7704          ?        ?      142.7        4.5       ?       ? 
1 1 1   37   12   25 o    386.3    2.4    0.0000   0.0000          ?        ?  1492.2250  18.5171          ?        ?      386.3        2.4       ?       ? 
1 1 1   37   12   26 o    610.5    2.8    0.0000   0.0000          ?        ?  3727.6892  33.8416          ?        ?      610.5        2.8       ?       ? 
1 1 1   37   12   27 o    124.5    5.4    0.0000   0.0000          ?        ?   155.1608  13.4090          ?        ?      124.5        5.4       ?       ? 
1 1 1   37   12   28 o    111.5    6.3    0.0000   0.0000          ?        ?   124.5117  14.0475          ?        ?      111.5        6.3       ?       ? 
1 1 1   37   12   29 o    193.6    3.6    0.0000   0.0000          ?        ?   374.8122  14.0475          ?        ?      193.6        3.6       ?       ? 
1 1 1   37   12   30 o    140.9    5.0    0.0000   0.0000          ?        ?   198.5802  14.0475          ?        ?      140.9        5.0       ?       ? 
1 1 1   37   12   31 f    502.2    2.5    0.0000   0.0000          ?        ?  2522.1604  25.5409          ?        ?      502.2        2.5       ?       ? 
1 1 1   37   12   32 o    449.2    2.4    0.0000   0.0000          ?        ?  2018.3669  21.7097          ?        ?      449.2        2.4       ?       ? 
1 1 1   37   12   33 o     27.6   12.3    0.0000   0.0000          ?        ?    -6.3852  14.0475          ?        ?       27.6       12.3       ?       ? 
1 1 1   37   12   34 o    253.9    3.0    0.0000   0.0000          ?        ?   644.9069  15.3245          ?        ?      253.9        3.0       ?       ? 
1 1 1   37   12   35 o     19.7    9.7    0.0000   0.0000          ?        ?   -31.9261  14.0475          ?        ?       19.7        9.7       ?       ? 
1 1 1   37   12   36 o    223.2    3.6    0.0000   0.0000          ?        ?   498.6854  15.9630          ?        ?      223.2        3.6       ?       ? 
1 1 1   37   12   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   12   38 o    208.9    3.7    0.0000   0.0000          ?        ?   436.7488  15.3245          ?        ?      208.9        3.7       ?       ? 
1 1 1   37   12   39 o    289.8    3.1    0.0000   0.0000          ?        ?   840.2945  17.8786          ?        ?      289.8        3.1       ?       ? 
1 1 1   37   12   40 o    340.5    2.8    0.0000   0.0000          ?        ?  1160.1937  19.1556          ?        ?      340.5        2.8       ?       ? 
1 1 1   37   12   41 f    179.6    4.4    0.0000   0.0000          ?        ?   323.0919  15.9630          ?        ?      179.6        4.4       ?       ? 
1 1 1   37   12   42 o    256.0    3.4    0.0000   0.0000          ?        ?   655.7617  17.2401          ?        ?      256.0        3.4       ?       ? 
1 1 1   37   12   43 o    287.1    3.2    0.0000   0.0000          ?        ?   824.9699  18.5171          ?        ?      287.1        3.2       ?       ? 
1 1 1   37   12   44 o    120.0    6.9    0.0000   0.0000          ?        ?   144.3059  16.6016          ?        ?      120.0        6.9       ?       ? 
1 1 1   37   12   45 o    144.6    6.0    0.0000   0.0000          ?        ?   209.4351  17.2401          ?        ?      144.6        6.0       ?       ? 
1 1 1   37   12   46 o    428.1    2.7    0.0000   0.0000          ?        ?  1833.8342  22.9868          ?        ?      428.1        2.7       ?       ? 
1 1 1   37   12   47 o    231.3    3.9    0.0000   0.0000          ?        ?   535.7197  17.8786          ?        ?      231.3        3.9       ?       ? 
1 1 1   37   12   48 o     27.8   13.1    0.0000   0.0000          ?        ?   -19.1556  18.5171          ?        ?       27.8       13.1       ?       ? 
1 1 1   37   12   49 o     99.8    8.6    0.0000   0.0000          ?        ?   100.2479  17.2401          ?        ?       99.8        8.6       ?       ? 
1 1 1   37   12   50 o    177.8    5.0    0.0000   0.0000          ?        ?   316.7067  17.8786          ?        ?      177.8        5.0       ?       ? 
1 1 1   37   12   51 o    293.9    3.4    0.0000   0.0000          ?        ?   864.5582  19.7942          ?        ?      293.9        3.4       ?       ? 
1 1 1   37   12   52 f    238.3    4.2    0.0000   0.0000          ?        ?   568.9227  19.7942          ?        ?      238.3        4.2       ?       ? 
1 1 1   37   12   53 o    118.7    7.8    0.0000   0.0000          ?        ?   141.7518  18.5171          ?        ?      118.7        7.8       ?       ? 
1 1 1   37   12   54 o     74.8   12.4    0.0000   0.0000          ?        ?    56.8284  18.5171          ?        ?       74.8       12.4       ?       ? 
1 1 1   37   12   55 o     68.1   14.1    0.0000   0.0000          ?        ?    49.1662  18.5171          ?        ?       68.1       14.1       ?       ? 
1 1 1   37   12   56 o    278.2    3.8    0.0000   0.0000          ?        ?   775.1653  21.0712          ?        ?      278.2        3.8       ?       ? 
1 1 1   37   12   57 o    124.3    7.4    0.0000   0.0000          ?        ?   155.7993  18.5171          ?        ?      124.3        7.4       ?       ? 
1 1 1   37   12   58 o     24.8   12.0    0.0000   0.0000          ?        ?   -30.0105  18.5171          ?        ?       24.8       12.0       ?       ? 
1 1 1   37   12   59 o    112.3    8.5    0.0000   0.0000          ?        ?   127.7043  19.1556          ?        ?      112.3        8.5       ?       ? 
1 1 1   37   12   60 o    200.3    4.8    0.0000   0.0000          ?        ?   402.9071  19.1556          ?        ?      200.3        4.8       ?       ? 
1 1 1   37   12   61 o     94.0    9.9    0.0000   0.0000          ?        ?    90.0316  18.5171          ?        ?       94.0        9.9       ?       ? 
1 1 1   37   13    0 o    302.9    3.6  918.1941  21.7097   918.1941  21.7097   918.1941  21.7097      302.9      3.6      302.9        3.6     0.0     0.0 
1 1 1   37   13    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   13    2 o    386.8    2.5    0.0000   0.0000          ?        ?  1496.0562  19.1556          ?        ?      386.8        2.5       ?       ? 
1 1 1   37   13    3 f    389.9    2.4    0.0000   0.0000          ?        ?  1520.3201  18.5171          ?        ?      389.9        2.4       ?       ? 
1 1 1   37   13    4 o    328.7    2.3    0.0000   0.0000          ?        ?  1080.3785  15.3245          ?        ?      328.7        2.3       ?       ? 
1 1 1   37   13    5 f    366.1    2.4    0.0000   0.0000          ?        ?  1340.2568  17.2401          ?        ?      366.1        2.4       ?       ? 
1 1 1   37   13    6 o    722.9    3.0    0.0000   0.0000          ?        ?  5226.2993  44.0580          ?        ?      722.9        3.0       ?       ? 
1 1 1   37   13    7 o    169.1    3.4    0.0000   0.0000          ?        ?   286.0577  11.4934          ?        ?      169.1        3.4       ?       ? 
1 1 1   37   13    8 o     43.6   10.4    0.0000   0.0000          ?        ?    19.7942   8.9393          ?        ?       43.6       10.4       ?       ? 
1 1 1   37   13    9 o    341.0    2.2    0.0000   0.0000          ?        ?  1162.7479  15.3245          ?        ?      341.0        2.2       ?       ? 
1 1 1   37   13   10 o    557.1    2.6    0.0000   0.0000          ?        ?  3104.4922  28.7335          ?        ?      557.1        2.6       ?       ? 
1 1 1   37   13   11 o    673.9    2.8    0.0000   0.0000          ?        ?  4541.8042  37.6728          ?        ?      673.9        2.8       ?       ? 
1 1 1   37   13   12 o    353.2    2.4    0.0000   0.0000          ?        ?  1247.6713  16.6016          ?        ?      353.2        2.4       ?       ? 
1 1 1   37   13   13 o    706.4    2.8    0.0000   0.0000          ?        ?  4990.6851  39.5883          ?        ?      706.4        2.8       ?       ? 
1 1 1   37   13   14 o    371.6    2.3    0.0000   0.0000          ?        ?  1381.1223  17.2401          ?        ?      371.6        2.3       ?       ? 
1 1 1   37   13   15 o    585.5    2.6    0.0000   0.0000          ?        ?  3428.8611  30.0105          ?        ?      585.5        2.6       ?       ? 
1 1 1   37   13   16 o    858.2    3.3    0.0000   0.0000          ?        ?  7366.6235  57.4669          ?        ?      858.2        3.3       ?       ? 
1 1 1   37   13   17 o    490.3    2.5    0.0000   0.0000          ?        ?  2404.6724  24.9023          ?        ?      490.3        2.5       ?       ? 
1 1 1   37   13   18 f    419.5    2.4    0.0000   0.0000          ?        ?  1760.4042  19.7942          ?        ?      419.5        2.4       ?       ? 
1 1 1   37   13   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   13   20 o    284.9    2.7    0.0000   0.0000          ?        ?   811.5610  15.3245          ?        ?      284.9        2.7       ?       ? 
1 1 1   37   13   21 o    537.7    2.5    0.0000   0.0000          ?        ?  2891.8645  26.8179          ?        ?      537.7        2.5       ?       ? 
1 1 1   37   13   22 o    173.4    3.5    0.0000   0.0000          ?        ?   300.7437  12.1319          ?        ?      173.4        3.5       ?       ? 
1 1 1   37   13   23 o    263.7    2.8    0.0000   0.0000          ?        ?   695.3500  14.6860          ?        ?      263.7        2.8       ?       ? 
1 1 1   37   13   24 o    409.1    2.4    0.0000   0.0000          ?        ?  1674.2037  19.7942          ?        ?      409.1        2.4       ?       ? 
1 1 1   37   13   25 o    628.0    2.7    0.0000   0.0000          ?        ?  3944.1482  34.4802          ?        ?      628.0        2.7       ?       ? 
1 1 1   37   13   26 o     17.6    8.8    0.0000   0.0000          ?        ?   -38.9498  13.4090          ?        ?       17.6        8.8       ?       ? 
1 1 1   37   13   27 o    291.3    2.7    0.0000   0.0000          ?        ?   848.5952  15.9630          ?        ?      291.3        2.7       ?       ? 
1 1 1   37   13   28 o     16.0    8.1    0.0000   0.0000          ?        ?   -49.1662  13.4090          ?        ?       16.0        8.1       ?       ? 
1 1 1   37   13   29 o    507.1    2.6    0.0000   0.0000          ?        ?  2571.9651  26.1794          ?        ?      507.1        2.6       ?       ? 
1 1 1   37   13   30 o     17.5    8.8    0.0000   0.0000          ?        ?   -44.0580  14.0475          ?        ?       17.5        8.8       ?       ? 
1 1 1   37   13   31 o    296.5    3.0    0.0000   0.0000          ?        ?   879.2443  17.8786          ?        ?      296.5        3.0       ?       ? 
1 1 1   37   13   32 o    273.5    2.9    0.0000   0.0000          ?        ?   748.3474  15.9630          ?        ?      273.5        2.9       ?       ? 
1 1 1   37   13   33 o    376.2    2.5    0.0000   0.0000          ?        ?  1415.6024  18.5171          ?        ?      376.2        2.5       ?       ? 
1 1 1   37   13   34 o    451.2    2.5    0.0000   0.0000          ?        ?  2036.2455  22.3483          ?        ?      451.2        2.5       ?       ? 
1 1 1   37   13   35 o    257.3    3.0    0.0000   0.0000          ?        ?   662.1469  15.3245          ?        ?      257.3        3.0       ?       ? 
1 1 1   37   13   36 o     26.7   12.3    0.0000   0.0000          ?        ?   -12.1319  15.3245          ?        ?       26.7       12.3       ?       ? 
1 1 1   37   13   37 o    244.4    3.3    0.0000   0.0000          ?        ?   597.6562  15.9630          ?        ?      244.4        3.3       ?       ? 
1 1 1   37   13   38 o    113.2    6.5    0.0000   0.0000          ?        ?   128.3428  14.6860          ?        ?      113.2        6.5       ?       ? 
1 1 1   37   13   39 o    351.4    2.7    0.0000   0.0000          ?        ?  1235.5393  19.1556          ?        ?      351.4        2.7       ?       ? 
1 1 1   37   13   40 o    299.5    3.0    0.0000   0.0000          ?        ?   897.7615  17.8786          ?        ?      299.5        3.0       ?       ? 
1 1 1   37   13   41 o    466.5    2.7    0.0000   0.0000          ?        ?  2177.3586  24.9023          ?        ?      466.5        2.7       ?       ? 
1 1 1   37   13   42 o    191.5    4.2    0.0000   0.0000          ?        ?   367.1499  15.9630          ?        ?      191.5        4.2       ?       ? 
1 1 1   37   13   43 o     18.5    9.3    0.0000   0.0000          ?        ?   -51.0817  15.9630          ?        ?       18.5        9.3       ?       ? 
1 1 1   37   13   44 o    228.4    3.8    0.0000   0.0000          ?        ?   522.3107  17.2401          ?        ?      228.4        3.8       ?       ? 
1 1 1   37   13   45 f    249.5    3.7    0.0000   0.0000          ?        ?   623.1971  18.5171          ?        ?      249.5        3.7       ?       ? 
1 1 1   37   13   46 o    227.3    4.1    0.0000   0.0000          ?        ?   517.2025  18.5171          ?        ?      227.3        4.1       ?       ? 
1 1 1   37   13   47 o    142.3    6.3    0.0000   0.0000          ?        ?   203.0499  17.8786          ?        ?      142.3        6.3       ?       ? 
1 1 1   37   13   48 f    134.9    6.6    0.0000   0.0000          ?        ?   182.6172  17.8786          ?        ?      134.9        6.6       ?       ? 
1 1 1   37   13   49 o    209.1    4.6    0.0000   0.0000          ?        ?   438.0258  19.1556          ?        ?      209.1        4.6       ?       ? 
1 1 1   37   13   50 o     61.6   15.1    0.0000   0.0000          ?        ?    40.2269  18.5171          ?        ?       61.6       15.1       ?       ? 
1 1 1   37   13   51 o    139.5    6.6    0.0000   0.0000          ?        ?   195.3876  18.5171          ?        ?      139.5        6.6       ?       ? 
1 1 1   37   13   52 o     79.8   11.6    0.0000   0.0000          ?        ?    64.4907  18.5171          ?        ?       79.8       11.6       ?       ? 
1 1 1   37   13   53 o    200.0    4.8    0.0000   0.0000          ?        ?   400.9916  19.1556          ?        ?      200.0        4.8       ?       ? 
1 1 1   37   13   54 o     72.3   13.3    0.0000   0.0000          ?        ?    54.9129  18.5171          ?        ?       72.3       13.3       ?       ? 
1 1 1   37   13   55 o    163.4    5.9    0.0000   0.0000          ?        ?   268.1791  19.1556          ?        ?      163.4        5.9       ?       ? 
1 1 1   37   13   56 o     29.7   13.6    0.0000   0.0000          ?        ?   -12.7704  18.5171          ?        ?       29.7       13.6       ?       ? 
1 1 1   37   13   57 o    125.3    7.6    0.0000   0.0000          ?        ?   158.3534  19.1556          ?        ?      125.3        7.6       ?       ? 
1 1 1   37   13   58 o    327.2    3.2    0.0000   0.0000          ?        ?  1072.0778  21.0712          ?        ?      327.2        3.2       ?       ? 
1 1 1   37   13   59 o    132.6    7.5    0.0000   0.0000          ?        ?   177.5090  19.7942          ?        ?      132.6        7.5       ?       ? 
1 1 1   37   13   60 o     30.5   13.9    0.0000   0.0000          ?        ?   -10.2163  18.5171          ?        ?       30.5       13.9       ?       ? 
1 1 1   37   13   61 o     83.4   11.5    0.0000   0.0000          ?        ?    71.5144  19.1556          ?        ?       83.4       11.5       ?       ? 
1 1 1   37   14    0 o    379.6    4.0 1441.7819  30.0105  1441.7819  30.0105  1441.7819  30.0105      379.6      4.0      379.6        4.0     0.0     0.0 
1 1 1   37   14    1 o    203.5    3.5    0.0000   0.0000          ?        ?   414.4005  14.0475          ?        ?      203.5        3.5       ?       ? 
1 1 1   37   14    2 o    492.7    2.7    0.0000   0.0000          ?        ?  2428.2976  26.8179          ?        ?      492.7        2.7       ?       ? 
1 1 1   37   14    3 o    339.3    2.5    0.0000   0.0000          ?        ?  1151.2545  17.2401          ?        ?      339.3        2.5       ?       ? 
1 1 1   37   14    4 o    163.4    3.1    0.0000   0.0000          ?        ?   266.9020  10.2163          ?        ?      163.4        3.1       ?       ? 
1 1 1   37   14    5 o    698.9    3.0    0.0000   0.0000          ?        ?  4885.9678  41.5039          ?        ?      698.9        3.0       ?       ? 
1 1 1   37   14    6 f    487.5    2.6    0.0000   0.0000          ?        ?  2376.5776  24.9023          ?        ?      487.5        2.6       ?       ? 
1 1 1   37   14    7 f    326.5    2.3    0.0000   0.0000          ?        ?  1066.3312  15.3245          ?        ?      326.5        2.3       ?       ? 
1 1 1   37   14    8 o    195.4    2.8    0.0000   0.0000          ?        ?   381.8359  10.8549          ?        ?      195.4        2.8       ?       ? 
1 1 1   37   14    9 o    390.5    2.2    0.0000   0.0000          ?        ?  1524.7897  17.2401          ?        ?      390.5        2.2       ?       ? 
1 1 1   37   14   10 o    137.7    3.5    0.0000   0.0000          ?        ?   189.6409   9.5778          ?        ?      137.7        3.5       ?       ? 
1 1 1   37   14   11 o    677.9    2.8    0.0000   0.0000          ?        ?  4596.0786  37.6728          ?        ?      677.9        2.8       ?       ? 
1 1 1   37   14   12 o    666.9    2.9    0.0000   0.0000          ?        ?  4448.5801  38.3113          ?        ?      666.9        2.9       ?       ? 
1 1 1   37   14   13 o    585.0    2.7    0.0000   0.0000          ?        ?  3423.1143  31.2876          ?        ?      585.0        2.7       ?       ? 
1 1 1   37   14   14 o    294.6    2.5    0.0000   0.0000          ?        ?   867.7509  14.6860          ?        ?      294.6        2.5       ?       ? 
1 1 1   37   14   15 o    607.0    2.7    0.0000   0.0000          ?        ?  3684.9082  32.5646          ?        ?      607.0        2.7       ?       ? 
1 1 1   37   14   16 o    745.6    2.9    0.0000   0.0000          ?        ?  5560.8848  43.4195          ?        ?      745.6        2.9       ?       ? 
1 1 1   37   14   17 o    502.6    2.5    0.0000   0.0000          ?        ?  2526.6301  24.9023          ?        ?      502.6        2.5       ?       ? 
1 1 1   37   14   18 o    371.1    2.4    0.0000   0.0000          ?        ?  1377.2911  17.8786          ?        ?      371.1        2.4       ?       ? 
1 1 1   37   14   19 o    204.0    3.1    0.0000   0.0000          ?        ?   416.3161  12.7704          ?        ?      204.0        3.1       ?       ? 
1 1 1   37   14   20 o    673.0    2.8    0.0000   0.0000          ?        ?  4530.3110  37.0343          ?        ?      673.0        2.8       ?       ? 
1 1 1   37   14   21 f    643.1    2.7    0.0000   0.0000          ?        ?  4136.3433  34.4802          ?        ?      643.1        2.7       ?       ? 
1 1 1   37   14   22 f    228.2    2.9    0.0000   0.0000          ?        ?   521.0336  13.4090          ?        ?      228.2        2.9       ?       ? 
1 1 1   37   14   23 o    334.1    2.5    0.0000   0.0000          ?        ?  1116.7743  16.6016          ?        ?      334.1        2.5       ?       ? 
1 1 1   37   14   24 o    581.3    2.6    0.0000   0.0000          ?        ?  3379.6948  30.0105          ?        ?      581.3        2.6       ?       ? 
1 1 1   37   14   25 o    344.7    2.5    0.0000   0.0000          ?        ?  1188.2888  17.2401          ?        ?      344.7        2.5       ?       ? 
1 1 1   37   14   26 o    110.1    6.1    0.0000   0.0000          ?        ?   121.3191  13.4090          ?        ?      110.1        6.1       ?       ? 
1 1 1   37   14   27 o    543.1    2.5    0.0000   0.0000          ?        ?  2949.9700  27.4564          ?        ?      543.1        2.5       ?       ? 
1 1 1   37   14   28 o    283.7    2.7    0.0000   0.0000          ?        ?   805.1758  15.3245          ?        ?      283.7        2.7       ?       ? 
1 1 1   37   14   29 o    143.8    5.1    0.0000   0.0000          ?        ?   206.8810  14.6860          ?        ?      143.8        5.1       ?       ? 
1 1 1   37   14   30 o    690.3    2.8    0.0000   0.0000          ?        ?  4767.2021  38.3113          ?        ?      690.3        2.8       ?       ? 
1 1 1   37   14   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   14   32 o    266.3    3.1    0.0000   0.0000          ?        ?   709.3975  16.6016          ?        ?      266.3        3.1       ?       ? 
1 1 1   37   14   33 o     78.2    9.0    0.0000   0.0000          ?        ?    61.2981  14.0475          ?        ?       78.2        9.0       ?       ? 
1 1 1   37   14   34 o    123.2    5.7    0.0000   0.0000          ?        ?   151.9681  14.0475          ?        ?      123.2        5.7       ?       ? 
1 1 1   37   14   35 o    517.5    2.7    0.0000   0.0000          ?        ?  2678.5981  27.4564          ?        ?      517.5        2.7       ?       ? 
1 1 1   37   14   36 o    430.2    2.5    0.0000   0.0000          ?        ?  1851.0741  21.7097          ?        ?      430.2        2.5       ?       ? 
1 1 1   37   14   37 o    240.3    3.3    0.0000   0.0000          ?        ?   577.8621  15.9630          ?        ?      240.3        3.3       ?       ? 
1 1 1   37   14   38 o     38.0   14.3    0.0000   0.0000          ?        ?    10.8549  14.6860          ?        ?       38.0       14.3       ?       ? 
1 1 1   37   14   39 o    151.5    5.3    0.0000   0.0000          ?        ?   229.8678  15.9630          ?        ?      151.5        5.3       ?       ? 
1 1 1   37   14   40 o    401.4    2.6    0.0000   0.0000          ?        ?  1612.2671  21.0712          ?        ?      401.4        2.6       ?       ? 
1 1 1   37   14   41 o    190.8    4.2    0.0000   0.0000          ?        ?   364.5958  15.9630          ?        ?      190.8        4.2       ?       ? 
1 1 1   37   14   42 o    183.3    4.4    0.0000   0.0000          ?        ?   336.5009  15.9630          ?        ?      183.3        4.4       ?       ? 
1 1 1   37   14   43 o    313.8    3.0    0.0000   0.0000          ?        ?   985.2389  18.5171          ?        ?      313.8        3.0       ?       ? 
1 1 1   37   14   44 o    222.1    3.9    0.0000   0.0000          ?        ?   493.5772  17.2401          ?        ?      222.1        3.9       ?       ? 
1 1 1   37   14   45 o    208.5    4.4    0.0000   0.0000          ?        ?   435.4717  18.5171          ?        ?      208.5        4.4       ?       ? 
1 1 1   37   14   46 o    620.9    2.7    0.0000   0.0000          ?        ?  3857.9478  33.8416          ?        ?      620.9        2.7       ?       ? 
1 1 1   37   14   47 o     22.7   11.1    0.0000   0.0000          ?        ?   -34.4802  17.2401          ?        ?       22.7       11.1       ?       ? 
1 1 1   37   14   48 o    289.1    3.3    0.0000   0.0000          ?        ?   836.4633  19.1556          ?        ?      289.1        3.3       ?       ? 
1 1 1   37   14   49 o    322.4    3.1    0.0000   0.0000          ?        ?  1040.1517  19.7942          ?        ?      322.4        3.1       ?       ? 
1 1 1   37   14   50 o     22.9   11.3    0.0000   0.0000          ?        ?   -36.3957  17.8786          ?        ?       22.9       11.3       ?       ? 
1 1 1   37   14   51 o    151.7    6.1    0.0000   0.0000          ?        ?   231.1448  18.5171          ?        ?      151.7        6.1       ?       ? 
1 1 1   37   14   52 o     23.3   11.4    0.0000   0.0000          ?        ?   -34.4802  17.8786          ?        ?       23.3       11.4       ?       ? 
1 1 1   37   14   53 o    167.1    5.5    0.0000   0.0000          ?        ?   280.3110  18.5171          ?        ?      167.1        5.5       ?       ? 
1 1 1   37   14   54 o     67.0   15.1    0.0000   0.0000          ?        ?    47.8891  19.7942          ?        ?       67.0       15.1       ?       ? 
1 1 1   37   14   55 o    123.6    7.5    0.0000   0.0000          ?        ?   153.8837  18.5171          ?        ?      123.6        7.5       ?       ? 
1 1 1   37   14   56 o    202.8    4.7    0.0000   0.0000          ?        ?   412.4850  19.1556          ?        ?      202.8        4.7       ?       ? 
1 1 1   37   14   57 o    208.9    4.7    0.0000   0.0000          ?        ?   438.0258  19.7942          ?        ?      208.9        4.7       ?       ? 
1 1 1   37   14   58 o    300.8    3.5    0.0000   0.0000          ?        ?   906.7007  21.0712          ?        ?      300.8        3.5       ?       ? 
1 1 1   37   14   59 o    285.1    3.5    0.0000   0.0000          ?        ?   814.7536  19.7942          ?        ?      285.1        3.5       ?       ? 
1 1 1   37   14   60 o    144.3    6.4    0.0000   0.0000          ?        ?   210.0736  18.5171          ?        ?      144.3        6.4       ?       ? 
1 1 1   37   15    0 f    542.3    4.2 2942.3076  45.3350  2942.3076  45.3350  2942.3076  45.3350      542.3      4.2      542.3        4.2     0.0     0.0 
1 1 1   37   15    1 o    320.9    2.8    0.0000   0.0000          ?        ?  1029.9354  17.8786          ?        ?      320.9        2.8       ?       ? 
1 1 1   37   15    2 o    311.7    2.9    0.0000   0.0000          ?        ?   971.8299  17.8786          ?        ?      311.7        2.9       ?       ? 
1 1 1   37   15    3 o    479.4    2.8    0.0000   0.0000          ?        ?  2298.6777  26.8179          ?        ?      479.4        2.8       ?       ? 
1 1 1   37   15    4 o    388.6    2.7    0.0000   0.0000          ?        ?  1510.7422  21.0712          ?        ?      388.6        2.7       ?       ? 
1 1 1   37   15    5 o    353.6    2.5    0.0000   0.0000          ?        ?  1250.8638  17.8786          ?        ?      353.6        2.5       ?       ? 
1 1 1   37   15    6 o    282.7    2.5    0.0000   0.0000          ?        ?   799.4291  14.0475          ?        ?      282.7        2.5       ?       ? 
1 1 1   37   15    7 o    496.0    2.6    0.0000   0.0000          ?        ?  2460.2236  26.1794          ?        ?      496.0        2.6       ?       ? 
1 1 1   37   15    8 f    204.8    3.0    0.0000   0.0000          ?        ?   419.5087  12.1319          ?        ?      204.8        3.0       ?       ? 
1 1 1   37   15    9 o    743.6    3.0    0.0000   0.0000          ?        ?  5530.8745  45.3350          ?        ?      743.6        3.0       ?       ? 
1 1 1   37   15   10 o    551.8    2.5    0.0000   0.0000          ?        ?  3045.7480  28.0950          ?        ?      551.8        2.5       ?       ? 
1 1 1   37   15   11 o    506.6    2.5    0.0000   0.0000          ?        ?  2566.8569  24.9023          ?        ?      506.6        2.5       ?       ? 
1 1 1   37   15   12 o    253.6    2.5    0.0000   0.0000          ?        ?   642.9913  12.7704          ?        ?      253.6        2.5       ?       ? 
1 1 1   37   15   13 o    248.6    2.4    0.0000   0.0000          ?        ?   618.0889  12.1319          ?        ?      248.6        2.4       ?       ? 
1 1 1   37   15   14 o    225.4    2.7    0.0000   0.0000          ?        ?   508.2632  12.1319          ?        ?      225.4        2.7       ?       ? 
1 1 1   37   15   15 o    594.0    2.6    0.0000   0.0000          ?        ?  3528.4705  31.2876          ?        ?      594.0        2.6       ?       ? 
1 1 1   37   15   16 o    178.1    3.4    0.0000   0.0000          ?        ?   317.3452  12.1319          ?        ?      178.1        3.4       ?       ? 
1 1 1   37   15   17 o    361.9    2.5    0.0000   0.0000          ?        ?  1310.2463  17.8786          ?        ?      361.9        2.5       ?       ? 
1 1 1   37   15   18 o    226.0    2.8    0.0000   0.0000          ?        ?   510.8173  12.7704          ?        ?      226.0        2.8       ?       ? 
1 1 1   37   15   19 o     87.8    6.5    0.0000   0.0000          ?        ?    77.2611  11.4934          ?        ?       87.8        6.5       ?       ? 
1 1 1   37   15   20 o    671.2    2.9    0.0000   0.0000          ?        ?  4506.0474  39.5883          ?        ?      671.2        2.9       ?       ? 
1 1 1   37   15   21 o    455.4    2.5    0.0000   0.0000          ?        ?  2074.5566  22.3483          ?        ?      455.4        2.5       ?       ? 
1 1 1   37   15   22 o    345.6    2.4    0.0000   0.0000          ?        ?  1194.6740  16.6016          ?        ?      345.6        2.4       ?       ? 
1 1 1   37   15   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   15   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   15   25 o    498.9    2.5    0.0000   0.0000          ?        ?  2489.5957  24.9023          ?        ?      498.9        2.5       ?       ? 
1 1 1   37   15   26 o     62.3    9.7    0.0000   0.0000          ?        ?    38.9498  12.1319          ?        ?       62.3        9.7       ?       ? 
1 1 1   37   15   27 f    460.2    2.4    0.0000   0.0000          ?        ?  2117.9763  22.3483          ?        ?      460.2        2.4       ?       ? 
1 1 1   37   15   28 o    191.4    3.7    0.0000   0.0000          ?        ?   366.5114  14.0475          ?        ?      191.4        3.7       ?       ? 
1 1 1   37   15   29 o    516.2    2.5    0.0000   0.0000          ?        ?  2665.1892  26.1794          ?        ?      516.2        2.5       ?       ? 
1 1 1   37   15   30 o     38.1   14.3    0.0000   0.0000          ?        ?    10.8549  14.6860          ?        ?       38.1       14.3       ?       ? 
1 1 1   37   15   31 o    166.2    4.4    0.0000   0.0000          ?        ?   276.4799  14.6860          ?        ?      166.2        4.4       ?       ? 
1 1 1   37   15   32 o    305.6    2.7    0.0000   0.0000          ?        ?   934.1572  16.6016          ?        ?      305.6        2.7       ?       ? 
1 1 1   37   15   33 o    115.7    6.1    0.0000   0.0000          ?        ?   134.0895  14.0475          ?        ?      115.7        6.1       ?       ? 
1 1 1   37   15   34 o    297.3    2.8    0.0000   0.0000          ?        ?   884.3525  16.6016          ?        ?      297.3        2.8       ?       ? 
1 1 1   37   15   35 o    434.9    2.6    0.0000   0.0000          ?        ?  1891.9395  22.9868          ?        ?      434.9        2.6       ?       ? 
1 1 1   37   15   36 o     22.7   10.9    0.0000   0.0000          ?        ?   -22.3483  14.6860          ?        ?       22.7       10.9       ?       ? 
1 1 1   37   15   37 o    203.6    3.9    0.0000   0.0000          ?        ?   415.0391  15.9630          ?        ?      203.6        3.9       ?       ? 
1 1 1   37   15   38 o    148.5    4.9    0.0000   0.0000          ?        ?   220.9285  14.6860          ?        ?      148.5        4.9       ?       ? 
1 1 1   37   15   39 o    221.6    3.6    0.0000   0.0000          ?        ?   491.6617  15.9630          ?        ?      221.6        3.6       ?       ? 
1 1 1   37   15   40 o    307.1    3.0    0.0000   0.0000          ?        ?   943.7350  18.5171          ?        ?      307.1        3.0       ?       ? 
1 1 1   37   15   41 o     70.8   10.8    0.0000   0.0000          ?        ?    50.4432  15.3245          ?        ?       70.8       10.8       ?       ? 
1 1 1   37   15   42 o     25.8   12.0    0.0000   0.0000          ?        ?   -14.6860  15.3245          ?        ?       25.8       12.0       ?       ? 
1 1 1   37   15   43 o     72.5   11.0    0.0000   0.0000          ?        ?    52.9973  15.9630          ?        ?       72.5       11.0       ?       ? 
1 1 1   37   15   44 o    425.0    2.7    0.0000   0.0000          ?        ?  1807.0162  22.9868          ?        ?      425.0        2.7       ?       ? 
1 1 1   37   15   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   15   46 o     18.7    9.5    0.0000   0.0000          ?        ?   -58.7440  17.2401          ?        ?       18.7        9.5       ?       ? 
1 1 1   37   15   47 o    177.8    5.0    0.0000   0.0000          ?        ?   316.7067  17.8786          ?        ?      177.8        5.0       ?       ? 
1 1 1   37   15   48 o    113.8    7.9    0.0000   0.0000          ?        ?   130.2584  17.8786          ?        ?      113.8        7.9       ?       ? 
1 1 1   37   15   49 o    215.0    4.2    0.0000   0.0000          ?        ?   462.9282  17.8786          ?        ?      215.0        4.2       ?       ? 
1 1 1   37   15   50 o    356.0    3.0    0.0000   0.0000          ?        ?  1268.7424  21.0712          ?        ?      356.0        3.0       ?       ? 
1 1 1   37   15   51 o    188.5    4.9    0.0000   0.0000          ?        ?   356.2951  18.5171          ?        ?      188.5        4.9       ?       ? 
1 1 1   37   15   52 o    193.3    4.8    0.0000   0.0000          ?        ?   374.8122  18.5171          ?        ?      193.3        4.8       ?       ? 
1 1 1   37   15   53 o    132.9    6.7    0.0000   0.0000          ?        ?   177.5090  17.8786          ?        ?      132.9        6.7       ?       ? 
1 1 1   37   15   54 o    221.4    4.5    0.0000   0.0000          ?        ?   491.6617  19.7942          ?        ?      221.4        4.5       ?       ? 
1 1 1   37   15   55 o    120.4    7.7    0.0000   0.0000          ?        ?   146.2215  18.5171          ?        ?      120.4        7.7       ?       ? 
1 1 1   37   15   56 o     32.3   14.3    0.0000   0.0000          ?        ?    -5.7467  18.5171          ?        ?       32.3       14.3       ?       ? 
1 1 1   37   15   57 o    105.3    8.8    0.0000   0.0000          ?        ?   112.3798  18.5171          ?        ?      105.3        8.8       ?       ? 
1 1 1   37   15   58 o     51.2   16.2    0.0000   0.0000          ?        ?    27.4564  18.5171          ?        ?       51.2       16.2       ?       ? 
1 1 1   37   15   59 o     72.5   13.7    0.0000   0.0000          ?        ?    56.1899  19.1556          ?        ?       72.5       13.7       ?       ? 
1 1 1   37   16    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   16    1 o    176.9    3.8    0.0000   0.0000          ?        ?   312.8756  13.4090          ?        ?      176.9        3.8       ?       ? 
1 1 1   37   16    2 o    176.8    3.8    0.0000   0.0000          ?        ?   312.8756  13.4090          ?        ?      176.8        3.8       ?       ? 
1 1 1   37   16    3 o    101.3    6.0    0.0000   0.0000          ?        ?   102.8020  12.1319          ?        ?      101.3        6.0       ?       ? 
1 1 1   37   16    4 o    434.0    2.7    0.0000   0.0000          ?        ?  1884.2773  23.6253          ?        ?      434.0        2.7       ?       ? 
1 1 1   37   16    5 o    420.4    2.7    0.0000   0.0000          ?        ?  1768.0663  22.9868          ?        ?      420.4        2.7       ?       ? 
1 1 1   37   16    6 o    352.1    2.5    0.0000   0.0000          ?        ?  1240.0090  17.8786          ?        ?      352.1        2.5       ?       ? 
1 1 1   37   16    7 o    495.6    2.6    0.0000   0.0000          ?        ?  2456.3928  25.5409          ?        ?      495.6        2.6       ?       ? 
1 1 1   37   16    8 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   16    9 o    547.2    3.0    0.0000   0.0000          ?        ?  2994.6665  32.5646          ?        ?      547.2        3.0       ?       ? 
1 1 1   37   16   10 f    418.1    2.7    0.0000   0.0000          ?        ?  1748.2721  22.3483          ?        ?      418.1        2.7       ?       ? 
1 1 1   37   16   11 f    256.8    2.5    0.0000   0.0000          ?        ?   659.5928  12.7704          ?        ?      256.8        2.5       ?       ? 
1 1 1   37   16   12 o     88.6    5.8    0.0000   0.0000          ?        ?    78.5382  10.2163          ?        ?       88.6        5.8       ?       ? 
1 1 1   37   16   13 o    241.4    2.6    0.0000   0.0000          ?        ?   582.9703  12.7704          ?        ?      241.4        2.6       ?       ? 
1 1 1   37   16   14 o    402.7    2.4    0.0000   0.0000          ?        ?  1621.8450  19.1556          ?        ?      402.7        2.4       ?       ? 
1 1 1   37   16   15 o    153.9    3.5    0.0000   0.0000          ?        ?   236.8915  10.8549          ?        ?      153.9        3.5       ?       ? 
1 1 1   37   16   16 o    332.1    2.4    0.0000   0.0000          ?        ?  1103.3654  15.9630          ?        ?      332.1        2.4       ?       ? 
1 1 1   37   16   17 o    328.6    2.2    0.0000   0.0000          ?        ?  1079.7401  14.6860          ?        ?      328.6        2.2       ?       ? 
1 1 1   37   16   18 o    289.0    2.4    0.0000   0.0000          ?        ?   835.1863  14.0475          ?        ?      289.0        2.4       ?       ? 
1 1 1   37   16   19 o    121.1    4.7    0.0000   0.0000          ?        ?   146.8600  11.4934          ?        ?      121.1        4.7       ?       ? 
1 1 1   37   16   20 o    551.1    2.6    0.0000   0.0000          ?        ?  3038.0859  28.7335          ?        ?      551.1        2.6       ?       ? 
1 1 1   37   16   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   16   22 o    330.2    2.4    0.0000   0.0000          ?        ?  1090.5950  15.9630          ?        ?      330.2        2.4       ?       ? 
1 1 1   37   16   23 o    497.2    2.4    0.0000   0.0000          ?        ?  2472.9941  23.6253          ?        ?      497.2        2.4       ?       ? 
1 1 1   37   16   24 o    371.2    2.5    0.0000   0.0000          ?        ?  1377.9297  18.5171          ?        ?      371.2        2.5       ?       ? 
1 1 1   37   16   25 o    366.3    2.5    0.0000   0.0000          ?        ?  1342.1725  18.5171          ?        ?      366.3        2.5       ?       ? 
1 1 1   37   16   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   16   27 o    110.1    6.4    0.0000   0.0000          ?        ?   121.3191  14.0475          ?        ?      110.1        6.4       ?       ? 
1 1 1   37   16   28 o    258.4    2.8    0.0000   0.0000          ?        ?   667.8936  14.6860          ?        ?      258.4        2.8       ?       ? 
1 1 1   37   16   29 o    519.5    2.5    0.0000   0.0000          ?        ?  2699.0310  26.1794          ?        ?      519.5        2.5       ?       ? 
1 1 1   37   16   30 o    212.6    3.5    0.0000   0.0000          ?        ?   452.0733  14.6860          ?        ?      212.6        3.5       ?       ? 
1 1 1   37   16   31 o    289.9    2.8    0.0000   0.0000          ?        ?   840.9330  15.9630          ?        ?      289.9        2.8       ?       ? 
1 1 1   37   16   32 o    213.2    3.4    0.0000   0.0000          ?        ?   454.6274  14.6860          ?        ?      213.2        3.4       ?       ? 
1 1 1   37   16   33 f    269.1    3.1    0.0000   0.0000          ?        ?   724.7220  16.6016          ?        ?      269.1        3.1       ?       ? 
1 1 1   37   16   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   16   35 o    239.2    3.3    0.0000   0.0000          ?        ?   572.7539  15.9630          ?        ?      239.2        3.3       ?       ? 
1 1 1   37   16   36 o     55.1   13.9    0.0000   0.0000          ?        ?    31.9261  15.3245          ?        ?       55.1       13.9       ?       ? 
1 1 1   37   16   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   16   38 o    220.1    3.6    0.0000   0.0000          ?        ?   484.6379  15.9630          ?        ?      220.1        3.6       ?       ? 
1 1 1   37   16   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   16   40 f    266.5    3.2    0.0000   0.0000          ?        ?   710.6746  17.2401          ?        ?      266.5        3.2       ?       ? 
1 1 1   37   16   41 o    169.2    4.9    0.0000   0.0000          ?        ?   286.6962  16.6016          ?        ?      169.2        4.9       ?       ? 
1 1 1   37   16   42 o    208.1    4.1    0.0000   0.0000          ?        ?   433.5562  17.2401          ?        ?      208.1        4.1       ?       ? 
1 1 1   37   16   43 o    135.4    6.4    0.0000   0.0000          ?        ?   183.8942  17.2401          ?        ?      135.4        6.4       ?       ? 
1 1 1   37   16   44 o    222.5    4.0    0.0000   0.0000          ?        ?   495.4928  17.8786          ?        ?      222.5        4.0       ?       ? 
1 1 1   37   16   45 o    146.7    5.9    0.0000   0.0000          ?        ?   215.8203  17.2401          ?        ?      146.7        5.9       ?       ? 
1 1 1   37   16   46 f     85.7   10.4    0.0000   0.0000          ?        ?    74.0685  17.8786          ?        ?       85.7       10.4       ?       ? 
1 1 1   37   16   47 o    222.4    4.0    0.0000   0.0000          ?        ?   495.4928  17.8786          ?        ?      222.4        4.0       ?       ? 
1 1 1   37   16   48 o    253.4    3.8    0.0000   0.0000          ?        ?   642.9913  19.1556          ?        ?      253.4        3.8       ?       ? 
1 1 1   37   16   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   16   50 o    240.0    4.0    0.0000   0.0000          ?        ?   577.2236  19.1556          ?        ?      240.0        4.0       ?       ? 
1 1 1   37   16   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   16   52 o    186.2    5.1    0.0000   0.0000          ?        ?   347.9943  19.1556          ?        ?      186.2        5.1       ?       ? 
1 1 1   37   16   53 o    240.0    4.0    0.0000   0.0000          ?        ?   577.2236  19.1556          ?        ?      240.0        4.0       ?       ? 
1 1 1   37   16   54 o    224.4    4.4    0.0000   0.0000          ?        ?   505.0706  19.7942          ?        ?      224.4        4.4       ?       ? 
1 1 1   37   16   55 o    151.1    6.3    0.0000   0.0000          ?        ?   229.8678  19.1556          ?        ?      151.1        6.3       ?       ? 
1 1 1   37   16   56 o    105.4    8.5    0.0000   0.0000          ?        ?   112.3798  17.8786          ?        ?      105.4        8.5       ?       ? 
1 1 1   37   16   57 o     94.4    9.8    0.0000   0.0000          ?        ?    90.6701  18.5171          ?        ?       94.4        9.8       ?       ? 
1 1 1   37   16   58 o     21.7   10.8    0.0000   0.0000          ?        ?   -45.9736  18.5171          ?        ?       21.7       10.8       ?       ? 
1 1 1   37   17    0 o     25.7   16.1    4.4697  16.6016     4.4697  16.6016     4.4697  16.6016       25.7     16.1       25.7       16.1     0.0     0.0 
1 1 1   37   17    1 o    230.0    3.2    0.0000   0.0000          ?        ?   529.3344  14.6860          ?        ?      230.0        3.2       ?       ? 
1 1 1   37   17    2 o    180.6    3.5    0.0000   0.0000          ?        ?   326.2845  12.7704          ?        ?      180.6        3.5       ?       ? 
1 1 1   37   17    3 o    412.5    2.6    0.0000   0.0000          ?        ?  1701.6602  21.7097          ?        ?      412.5        2.6       ?       ? 
1 1 1   37   17    4 o    274.6    2.8    0.0000   0.0000          ?        ?   754.0941  15.3245          ?        ?      274.6        2.8       ?       ? 
1 1 1   37   17    5 o     91.8    6.6    0.0000   0.0000          ?        ?    84.2849  12.1319          ?        ?       91.8        6.6       ?       ? 
1 1 1   37   17    6 o    182.9    3.7    0.0000   0.0000          ?        ?   334.5853  13.4090          ?        ?      182.9        3.7       ?       ? 
1 1 1   37   17    7 o    168.1    4.2    0.0000   0.0000          ?        ?   282.8651  14.0475          ?        ?      168.1        4.2       ?       ? 
1 1 1   37   17    8 o    741.9    3.2    0.0000   0.0000          ?        ?  5505.9717  47.2506          ?        ?      741.9        3.2       ?       ? 
1 1 1   37   17    9 o    324.8    2.5    0.0000   0.0000          ?        ?  1054.8376  15.9630          ?        ?      324.8        2.5       ?       ? 
1 1 1   37   17   10 o    501.8    2.5    0.0000   0.0000          ?        ?  2518.9678  25.5409          ?        ?      501.8        2.5       ?       ? 
1 1 1   37   17   11 o    211.1    3.2    0.0000   0.0000          ?        ?   445.6881  13.4090          ?        ?      211.1        3.2       ?       ? 
1 1 1   37   17   12 o    854.2    3.3    0.0000   0.0000          ?        ?  7298.3022  56.8284          ?        ?      854.2        3.3       ?       ? 
1 1 1   37   17   13 o    267.3    2.6    0.0000   0.0000          ?        ?   714.5057  14.0475          ?        ?      267.3        2.6       ?       ? 
1 1 1   37   17   14 o    447.1    2.6    0.0000   0.0000          ?        ?  1999.2113  23.6253          ?        ?      447.1        2.6       ?       ? 
1 1 1   37   17   15 o    321.4    2.6    0.0000   0.0000          ?        ?  1033.1281  16.6016          ?        ?      321.4        2.6       ?       ? 
1 1 1   37   17   16 o    346.4    2.5    0.0000   0.0000          ?        ?  1200.4207  17.2401          ?        ?      346.4        2.5       ?       ? 
1 1 1   37   17   17 o    575.0    2.7    0.0000   0.0000          ?        ?  3307.5420  30.6490          ?        ?      575.0        2.7       ?       ? 
1 1 1   37   17   18 o    140.4    4.1    0.0000   0.0000          ?        ?   197.3032  11.4934          ?        ?      140.4        4.1       ?       ? 
1 1 1   37   17   19 o    539.8    2.5    0.0000   0.0000          ?        ?  2914.8513  26.8179          ?        ?      539.8        2.5       ?       ? 
1 1 1   37   17   20 o    268.9    2.6    0.0000   0.0000          ?        ?   723.4450  14.0475          ?        ?      268.9        2.6       ?       ? 
1 1 1   37   17   21 o    632.9    2.7    0.0000   0.0000          ?        ?  4006.0850  34.4802          ?        ?      632.9        2.7       ?       ? 
1 1 1   37   17   22 o    587.8    2.6    0.0000   0.0000          ?        ?  3456.3174  30.6490          ?        ?      587.8        2.6       ?       ? 
1 1 1   37   17   23 o    389.1    2.5    0.0000   0.0000          ?        ?  1514.5732  19.1556          ?        ?      389.1        2.5       ?       ? 
1 1 1   37   17   24 o    297.8    2.7    0.0000   0.0000          ?        ?   886.9065  15.9630          ?        ?      297.8        2.7       ?       ? 
1 1 1   37   17   25 o    691.4    2.9    0.0000   0.0000          ?        ?  4781.2500  39.5883          ?        ?      691.4        2.9       ?       ? 
1 1 1   37   17   26 o    108.9    6.2    0.0000   0.0000          ?        ?   118.7650  13.4090          ?        ?      108.9        6.2       ?       ? 
1 1 1   37   17   27 o    332.5    2.4    0.0000   0.0000          ?        ?  1105.9194  15.9630          ?        ?      332.5        2.4       ?       ? 
1 1 1   37   17   28 o    113.5    5.9    0.0000   0.0000          ?        ?   128.9814  13.4090          ?        ?      113.5        5.9       ?       ? 
1 1 1   37   17   29 o     54.1   12.6    0.0000   0.0000          ?        ?    30.6490  13.4090          ?        ?       54.1       12.6       ?       ? 
1 1 1   37   17   30 o    455.4    2.5    0.0000   0.0000          ?        ?  2074.5566  22.3483          ?        ?      455.4        2.5       ?       ? 
1 1 1   37   17   31 o    140.1    5.0    0.0000   0.0000          ?        ?   196.6647  14.0475          ?        ?      140.1        5.0       ?       ? 
1 1 1   37   17   32 o    503.8    2.5    0.0000   0.0000          ?        ?  2539.4006  25.5409          ?        ?      503.8        2.5       ?       ? 
1 1 1   37   17   33 o    379.7    2.6    0.0000   0.0000          ?        ?  1442.4203  19.7942          ?        ?      379.7        2.6       ?       ? 
1 1 1   37   17   34 o    587.2    2.7    0.0000   0.0000          ?        ?  3449.2939  31.2876          ?        ?      587.2        2.7       ?       ? 
1 1 1   37   17   35 o    310.7    2.8    0.0000   0.0000          ?        ?   966.0833  17.2401          ?        ?      310.7        2.8       ?       ? 
1 1 1   37   17   36 o    209.8    3.8    0.0000   0.0000          ?        ?   440.5799  15.9630          ?        ?      209.8        3.8       ?       ? 
1 1 1   37   17   37 o    139.4    5.3    0.0000   0.0000          ?        ?   194.7491  14.6860          ?        ?      139.4        5.3       ?       ? 
1 1 1   37   17   38 o    423.4    2.6    0.0000   0.0000          ?        ?  1793.6072  22.3483          ?        ?      423.4        2.6       ?       ? 
1 1 1   37   17   39 o    332.7    2.8    0.0000   0.0000          ?        ?  1107.1964  18.5171          ?        ?      332.7        2.8       ?       ? 
1 1 1   37   17   40 o     82.8    9.3    0.0000   0.0000          ?        ?    68.9603  15.3245          ?        ?       82.8        9.3       ?       ? 
1 1 1   37   17   41 o     63.4   13.0    0.0000   0.0000          ?        ?    42.1424  15.9630          ?        ?       63.4       13.0       ?       ? 
1 1 1   37   17   42 o     67.3   12.8    0.0000   0.0000          ?        ?    47.2506  16.6016          ?        ?       67.3       12.8       ?       ? 
1 1 1   37   17   43 o    231.6    4.0    0.0000   0.0000          ?        ?   536.9967  18.5171          ?        ?      231.6        4.0       ?       ? 
1 1 1   37   17   44 o     52.1   15.5    0.0000   0.0000          ?        ?    28.0950  17.2401          ?        ?       52.1       15.5       ?       ? 
1 1 1   37   17   45 o    404.9    2.8    0.0000   0.0000          ?        ?  1640.3621  22.3483          ?        ?      404.9        2.8       ?       ? 
1 1 1   37   17   46 o    258.9    3.8    0.0000   0.0000          ?        ?   671.0862  19.7942          ?        ?      258.9        3.8       ?       ? 
1 1 1   37   17   47 o    186.0    5.2    0.0000   0.0000          ?        ?   346.7172  19.1556          ?        ?      186.0        5.2       ?       ? 
1 1 1   37   17   48 o     21.4   10.6    0.0000   0.0000          ?        ?   -44.6965  17.8786          ?        ?       21.4       10.6       ?       ? 
1 1 1   37   17   49 o    115.4    8.0    0.0000   0.0000          ?        ?   134.0895  18.5171          ?        ?      115.4        8.0       ?       ? 
1 1 1   37   17   50 o    261.3    3.8    0.0000   0.0000          ?        ?   683.8566  19.7942          ?        ?      261.3        3.8       ?       ? 
1 1 1   37   17   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   17   52 o     27.3   12.9    0.0000   0.0000          ?        ?   -20.4327  18.5171          ?        ?       27.3       12.9       ?       ? 
1 1 1   37   17   53 o    140.9    6.6    0.0000   0.0000          ?        ?   199.8573  18.5171          ?        ?      140.9        6.6       ?       ? 
1 1 1   37   17   54 o     87.9   10.5    0.0000   0.0000          ?        ?    78.5382  18.5171          ?        ?       87.9       10.5       ?       ? 
1 1 1   37   17   55 o     28.6   13.4    0.0000   0.0000          ?        ?   -17.8786  19.1556          ?        ?       28.6       13.4       ?       ? 
1 1 1   37   17   56 o    101.0    8.9    0.0000   0.0000          ?        ?   103.4405  17.8786          ?        ?      101.0        8.9       ?       ? 
1 1 1   37   17   57 o     92.6    9.6    0.0000   0.0000          ?        ?    87.4775  17.8786          ?        ?       92.6        9.6       ?       ? 
1 1 1   37   18    0 o     20.4   13.8   -6.3852  15.9630    -6.3852  15.9630    -6.3852  15.9630       20.4     13.8       20.4       13.8     0.0     0.0 
1 1 1   37   18    1 o     84.9    6.8    0.0000   0.0000          ?        ?    72.1529  11.4934          ?        ?       84.9        6.8       ?       ? 
1 1 1   37   18    2 o    312.4    2.7    0.0000   0.0000          ?        ?   976.2995  16.6016          ?        ?      312.4        2.7       ?       ? 
1 1 1   37   18    3 o    105.7    5.1    0.0000   0.0000          ?        ?   111.7413  10.8549          ?        ?      105.7        5.1       ?       ? 
1 1 1   37   18    4 o     15.2    7.7    0.0000   0.0000          ?        ?   -39.5883  11.4934          ?        ?       15.2        7.7       ?       ? 
1 1 1   37   18    5 o    150.5    4.2    0.0000   0.0000          ?        ?   226.6752  12.7704          ?        ?      150.5        4.2       ?       ? 
1 1 1   37   18    6 o    297.8    2.8    0.0000   0.0000          ?        ?   886.9065  16.6016          ?        ?      297.8        2.8       ?       ? 
1 1 1   37   18    7 o    564.7    2.9    0.0000   0.0000          ?        ?  3189.4155  33.2031          ?        ?      564.7        2.9       ?       ? 
1 1 1   37   18    8 o    602.1    3.0    0.0000   0.0000          ?        ?  3626.1646  35.7572          ?        ?      602.1        3.0       ?       ? 
1 1 1   37   18    9 o    370.5    2.3    0.0000   0.0000          ?        ?  1372.8215  17.2401          ?        ?      370.5        2.3       ?       ? 
1 1 1   37   18   10 o    487.9    2.6    0.0000   0.0000          ?        ?  2381.0471  24.9023          ?        ?      487.9        2.6       ?       ? 
1 1 1   37   18   11 o    578.6    2.8    0.0000   0.0000          ?        ?  3349.0459  32.5646          ?        ?      578.6        2.8       ?       ? 
1 1 1   37   18   12 o    563.2    2.8    0.0000   0.0000          ?        ?  3172.1753  31.2876          ?        ?      563.2        2.8       ?       ? 
1 1 1   37   18   13 o    209.7    2.4    0.0000   0.0000          ?        ?   439.9414  10.2163          ?        ?      209.7        2.4       ?       ? 
1 1 1   37   18   14 o    303.5    2.3    0.0000   0.0000          ?        ?   921.3867  14.0475          ?        ?      303.5        2.3       ?       ? 
1 1 1   37   18   15 o    170.8    3.2    0.0000   0.0000          ?        ?   291.8044  10.8549          ?        ?      170.8        3.2       ?       ? 
1 1 1   37   18   16 o     57.5    8.9    0.0000   0.0000          ?        ?    33.2031  10.2163          ?        ?       57.5        8.9       ?       ? 
1 1 1   37   18   17 o    216.8    2.9    0.0000   0.0000          ?        ?   469.9519  12.7704          ?        ?      216.8        2.9       ?       ? 
1 1 1   37   18   18 o    344.3    2.5    0.0000   0.0000          ?        ?  1185.7346  17.2401          ?        ?      344.3        2.5       ?       ? 
1 1 1   37   18   19 o    194.5    3.4    0.0000   0.0000          ?        ?   378.6433  13.4090          ?        ?      194.5        3.4       ?       ? 
1 1 1   37   18   20 o    330.2    2.5    0.0000   0.0000          ?        ?  1090.5950  16.6016          ?        ?      330.2        2.5       ?       ? 
1 1 1   37   18   21 o    309.3    2.5    0.0000   0.0000          ?        ?   957.1439  15.3245          ?        ?      309.3        2.5       ?       ? 
1 1 1   37   18   22 o    206.6    2.9    0.0000   0.0000          ?        ?   427.1710  12.1319          ?        ?      206.6        2.9       ?       ? 
1 1 1   37   18   23 o    217.6    2.9    0.0000   0.0000          ?        ?   473.7830  12.7704          ?        ?      217.6        2.9       ?       ? 
1 1 1   37   18   24 o    435.1    2.3    0.0000   0.0000          ?        ?  1893.2167  20.4327          ?        ?      435.1        2.3       ?       ? 
1 1 1   37   18   25 o    288.5    2.7    0.0000   0.0000          ?        ?   832.6321  15.3245          ?        ?      288.5        2.7       ?       ? 
1 1 1   37   18   26 o    254.3    2.9    0.0000   0.0000          ?        ?   646.8224  14.6860          ?        ?      254.3        2.9       ?       ? 
1 1 1   37   18   27 o    301.6    2.8    0.0000   0.0000          ?        ?   909.8933  16.6016          ?        ?      301.6        2.8       ?       ? 
1 1 1   37   18   28 o    102.5    6.5    0.0000   0.0000          ?        ?   105.3561  13.4090          ?        ?      102.5        6.5       ?       ? 
1 1 1   37   18   29 o     53.5   13.2    0.0000   0.0000          ?        ?    30.0105  14.0475          ?        ?       53.5       13.2       ?       ? 
1 1 1   37   18   30 f    278.0    3.0    0.0000   0.0000          ?        ?   773.2497  16.6016          ?        ?      278.0        3.0       ?       ? 
1 1 1   37   18   31 o     89.2    7.9    0.0000   0.0000          ?        ?    79.8152  14.0475          ?        ?       89.2        7.9       ?       ? 
1 1 1   37   18   32 o    148.7    5.2    0.0000   0.0000          ?        ?   221.5670  15.3245          ?        ?      148.7        5.2       ?       ? 
1 1 1   37   18   33 o    126.2    5.6    0.0000   0.0000          ?        ?   159.6304  14.0475          ?        ?      126.2        5.6       ?       ? 
1 1 1   37   18   34 o    344.5    2.7    0.0000   0.0000          ?        ?  1187.6503  18.5171          ?        ?      344.5        2.7       ?       ? 
1 1 1   37   18   35 o    499.8    2.6    0.0000   0.0000          ?        ?  2499.1736  25.5409          ?        ?      499.8        2.6       ?       ? 
1 1 1   37   18   36 o    296.5    3.0    0.0000   0.0000          ?        ?   879.8828  17.8786          ?        ?      296.5        3.0       ?       ? 
1 1 1   37   18   37 o    311.3    2.9    0.0000   0.0000          ?        ?   969.2759  17.8786          ?        ?      311.3        2.9       ?       ? 
1 1 1   37   18   38 o    217.6    4.0    0.0000   0.0000          ?        ?   473.7830  17.2401          ?        ?      217.6        4.0       ?       ? 
1 1 1   37   18   39 o    156.0    5.3    0.0000   0.0000          ?        ?   243.9153  16.6016          ?        ?      156.0        5.3       ?       ? 
1 1 1   37   18   40 o    344.0    3.0    0.0000   0.0000          ?        ?  1183.8191  20.4327          ?        ?      344.0        3.0       ?       ? 
1 1 1   37   18   41 o     41.1   15.0    0.0000   0.0000          ?        ?    14.0475  15.9630          ?        ?       41.1       15.0       ?       ? 
1 1 1   37   18   42 o    226.4    3.8    0.0000   0.0000          ?        ?   513.3714  17.2401          ?        ?      226.4        3.8       ?       ? 
1 1 1   37   18   43 o     43.6   15.3    0.0000   0.0000          ?        ?    17.2401  16.6016          ?        ?       43.6       15.3       ?       ? 
1 1 1   37   18   44 o    459.4    2.8    0.0000   0.0000          ?        ?  2111.5911  25.5409          ?        ?      459.4        2.8       ?       ? 
1 1 1   37   18   45 o    244.8    3.9    0.0000   0.0000          ?        ?   600.2103  19.1556          ?        ?      244.8        3.9       ?       ? 
1 1 1   37   18   46 o     89.2   10.7    0.0000   0.0000          ?        ?    80.4537  19.1556          ?        ?       89.2       10.7       ?       ? 
1 1 1   37   18   47 o    561.3    2.7    0.0000   0.0000          ?        ?  3153.0198  30.6490          ?        ?      561.3        2.7       ?       ? 
1 1 1   37   18   48 o    329.5    3.1    0.0000   0.0000          ?        ?  1086.7638  20.4327          ?        ?      329.5        3.1       ?       ? 
1 1 1   37   18   49 o    321.5    3.3    0.0000   0.0000          ?        ?  1035.0436  21.0712          ?        ?      321.5        3.3       ?       ? 
1 1 1   37   18   50 f    169.0    5.3    0.0000   0.0000          ?        ?   286.6962  17.8786          ?        ?      169.0        5.3       ?       ? 
1 1 1   37   18   51 o    122.1    7.3    0.0000   0.0000          ?        ?   150.0526  17.8786          ?        ?      122.1        7.3       ?       ? 
1 1 1   37   18   52 o    223.3    4.3    0.0000   0.0000          ?        ?   499.9625  19.1556          ?        ?      223.3        4.3       ?       ? 
1 1 1   37   18   53 o    334.8    3.1    0.0000   0.0000          ?        ?  1122.5210  21.0712          ?        ?      334.8        3.1       ?       ? 
1 1 1   37   18   54 o    239.3    3.7    0.0000   0.0000          ?        ?   574.0309  17.8786          ?        ?      239.3        3.7       ?       ? 
1 1 1   37   18   55 o    154.0    5.8    0.0000   0.0000          ?        ?   238.8071  17.8786          ?        ?      154.0        5.8       ?       ? 
1 1 1   37   18   56 o    226.2    4.1    0.0000   0.0000          ?        ?   513.3714  18.5171          ?        ?      226.2        4.1       ?       ? 
1 1 1   37   19    0 o     83.2    9.8   72.1529  15.9630    72.1529  15.9630    72.1529  15.9630       83.2      9.8       83.2        9.8     0.0     0.0 
1 1 1   37   19    1 o    278.0    2.9    0.0000   0.0000          ?        ?   773.2497  15.9630          ?        ?      278.0        2.9       ?       ? 
1 1 1   37   19    2 o    232.1    3.0    0.0000   0.0000          ?        ?   538.9123  14.0475          ?        ?      232.1        3.0       ?       ? 
1 1 1   37   19    3 o    179.7    3.6    0.0000   0.0000          ?        ?   323.0919  12.7704          ?        ?      179.7        3.6       ?       ? 
1 1 1   37   19    4 o     77.4    7.4    0.0000   0.0000          ?        ?    60.0210  11.4934          ?        ?       77.4        7.4       ?       ? 
1 1 1   37   19    5 o    577.7    2.9    0.0000   0.0000          ?        ?  3338.1909  33.8416          ?        ?      577.7        2.9       ?       ? 
1 1 1   37   19    6 o    478.7    2.9    0.0000   0.0000          ?        ?  2292.2927  27.4564          ?        ?      478.7        2.9       ?       ? 
1 1 1   37   19    7 o    397.8    2.7    0.0000   0.0000          ?        ?  1582.8950  21.7097          ?        ?      397.8        2.7       ?       ? 
1 1 1   37   19    8 o    183.1    3.7    0.0000   0.0000          ?        ?   335.2238  13.4090          ?        ?      183.1        3.7       ?       ? 
1 1 1   37   19    9 o    414.7    2.5    0.0000   0.0000          ?        ?  1720.1772  20.4327          ?        ?      414.7        2.5       ?       ? 
1 1 1   37   19   10 o    102.9    5.3    0.0000   0.0000          ?        ?   105.9946  10.8549          ?        ?      102.9        5.3       ?       ? 
1 1 1   37   19   11 o    247.2    2.7    0.0000   0.0000          ?        ?   611.0652  13.4090          ?        ?      247.2        2.7       ?       ? 
1 1 1   37   19   12 o    340.4    2.5    0.0000   0.0000          ?        ?  1158.9167  17.2401          ?        ?      340.4        2.5       ?       ? 
1 1 1   37   19   13 o     23.3   10.7    0.0000   0.0000          ?        ?    -8.9393  11.4934          ?        ?       23.3       10.7       ?       ? 
1 1 1   37   19   14 o    339.5    2.2    0.0000   0.0000          ?        ?  1152.5315  14.6860          ?        ?      339.5        2.2       ?       ? 
1 1 1   37   19   15 o    517.5    2.5    0.0000   0.0000          ?        ?  2678.5981  26.1794          ?        ?      517.5        2.5       ?       ? 
1 1 1   37   19   16 o    694.6    2.9    0.0000   0.0000          ?        ?  4826.5850  40.2269          ?        ?      694.6        2.9       ?       ? 
1 1 1   37   19   17 o    294.0    2.5    0.0000   0.0000          ?        ?   864.5582  14.6860          ?        ?      294.0        2.5       ?       ? 
1 1 1   37   19   18 o    475.3    2.6    0.0000   0.0000          ?        ?  2259.7280  24.2638          ?        ?      475.3        2.6       ?       ? 
1 1 1   37   19   19 o    262.1    2.6    0.0000   0.0000          ?        ?   687.0493  13.4090          ?        ?      262.1        2.6       ?       ? 
1 1 1   37   19   20 o    465.9    2.3    0.0000   0.0000          ?        ?  2170.9736  21.0712          ?        ?      465.9        2.3       ?       ? 
1 1 1   37   19   21 o    182.9    3.5    0.0000   0.0000          ?        ?   334.5853  12.7704          ?        ?      182.9        3.5       ?       ? 
1 1 1   37   19   22 o    257.9    2.8    0.0000   0.0000          ?        ?   665.3395  14.6860          ?        ?      257.9        2.8       ?       ? 
1 1 1   37   19   23 o    321.7    2.5    0.0000   0.0000          ?        ?  1035.0436  15.9630          ?        ?      321.7        2.5       ?       ? 
1 1 1   37   19   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   19   25 f    162.3    3.9    0.0000   0.0000          ?        ?   263.7094  12.7704          ?        ?      162.3        3.9       ?       ? 
1 1 1   37   19   26 o    135.8    4.7    0.0000   0.0000          ?        ?   184.5327  12.7704          ?        ?      135.8        4.7       ?       ? 
1 1 1   37   19   27 o    170.0    3.9    0.0000   0.0000          ?        ?   289.2503  13.4090          ?        ?      170.0        3.9       ?       ? 
1 1 1   37   19   28 o    120.8    5.5    0.0000   0.0000          ?        ?   146.2215  13.4090          ?        ?      120.8        5.5       ?       ? 
1 1 1   37   19   29 o    401.4    2.5    0.0000   0.0000          ?        ?  1611.6285  19.7942          ?        ?      401.4        2.5       ?       ? 
1 1 1   37   19   30 o    329.6    2.7    0.0000   0.0000          ?        ?  1086.7638  17.8786          ?        ?      329.6        2.7       ?       ? 
1 1 1   37   19   31 o    279.3    3.0    0.0000   0.0000          ?        ?   780.2734  16.6016          ?        ?      279.3        3.0       ?       ? 
1 1 1   37   19   32 o    324.1    2.8    0.0000   0.0000          ?        ?  1051.0066  17.8786          ?        ?      324.1        2.8       ?       ? 
1 1 1   37   19   33 o    255.4    3.1    0.0000   0.0000          ?        ?   652.5691  15.9630          ?        ?      255.4        3.1       ?       ? 
1 1 1   37   19   34 o    428.4    2.6    0.0000   0.0000          ?        ?  1836.3882  22.3483          ?        ?      428.4        2.6       ?       ? 
1 1 1   37   19   35 o    219.0    3.8    0.0000   0.0000          ?        ?   480.1682  16.6016          ?        ?      219.0        3.8       ?       ? 
1 1 1   37   19   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   19   37 o    121.3    6.3    0.0000   0.0000          ?        ?   147.4985  15.3245          ?        ?      121.3        6.3       ?       ? 
1 1 1   37   19   38 o    174.9    4.9    0.0000   0.0000          ?        ?   306.4904  17.2401          ?        ?      174.9        4.9       ?       ? 
1 1 1   37   19   39 o     47.8   15.0    0.0000   0.0000          ?        ?    22.9868  15.9630          ?        ?       47.8       15.0       ?       ? 
1 1 1   37   19   40 o    113.6    7.0    0.0000   0.0000          ?        ?   129.6199  15.9630          ?        ?      113.6        7.0       ?       ? 
1 1 1   37   19   41 o     72.9   11.4    0.0000   0.0000          ?        ?    53.6358  16.6016          ?        ?       72.9       11.4       ?       ? 
1 1 1   37   19   42 o    103.0    8.1    0.0000   0.0000          ?        ?   106.6331  16.6016          ?        ?      103.0        8.1       ?       ? 
1 1 1   37   19   43 o    135.1    6.1    0.0000   0.0000          ?        ?   183.2557  16.6016          ?        ?      135.1        6.1       ?       ? 
1 1 1   37   19   44 o     72.8   11.8    0.0000   0.0000          ?        ?    53.6358  17.2401          ?        ?       72.8       11.8       ?       ? 
1 1 1   37   19   45 o    234.3    4.0    0.0000   0.0000          ?        ?   549.7671  18.5171          ?        ?      234.3        4.0       ?       ? 
1 1 1   37   19   46 o    127.8    7.0    0.0000   0.0000          ?        ?   164.1001  17.8786          ?        ?      127.8        7.0       ?       ? 
1 1 1   37   19   47 o    187.8    4.9    0.0000   0.0000          ?        ?   353.7410  18.5171          ?        ?      187.8        4.9       ?       ? 
1 1 1   37   19   48 o     70.7   12.7    0.0000   0.0000          ?        ?    52.3588  17.2401          ?        ?       70.7       12.7       ?       ? 
1 1 1   37   19   49 f     19.4    9.8    0.0000   0.0000          ?        ?   -58.1055  17.8786          ?        ?       19.4        9.8       ?       ? 
1 1 1   37   19   50 o    251.6    3.8    0.0000   0.0000          ?        ?   634.0520  19.1556          ?        ?      251.6        3.8       ?       ? 
1 1 1   37   19   51 o     44.8   16.1    0.0000   0.0000          ?        ?    17.8786  18.5171          ?        ?       44.8       16.1       ?       ? 
1 1 1   37   19   52 o     56.2   15.8    0.0000   0.0000          ?        ?    33.8416  18.5171          ?        ?       56.2       15.8       ?       ? 
1 1 1   37   19   53 o    104.4    8.6    0.0000   0.0000          ?        ?   110.4642  17.8786          ?        ?      104.4        8.6       ?       ? 
1 1 1   37   19   54 o    163.1    5.7    0.0000   0.0000          ?        ?   267.5406  18.5171          ?        ?      163.1        5.7       ?       ? 
1 1 1   37   19   55 o     41.7   15.7    0.0000   0.0000          ?        ?    14.0475  17.8786          ?        ?       41.7       15.7       ?       ? 
1 1 1   37   20    0 o    313.2    3.6  981.4077  22.3483   981.4077  22.3483   981.4077  22.3483      313.2      3.6      313.2        3.6     0.0     0.0 
1 1 1   37   20    1 o    430.6    2.6    0.0000   0.0000          ?        ?  1854.2667  22.3483          ?        ?      430.6        2.6       ?       ? 
1 1 1   37   20    2 o    324.9    2.7    0.0000   0.0000          ?        ?  1056.1147  17.2401          ?        ?      324.9        2.7       ?       ? 
1 1 1   37   20    3 o    304.8    3.9    0.0000   0.0000          ?        ?   929.6875  23.6253          ?        ?      304.8        3.9       ?       ? 
1 1 1   37   20    4 o    760.8    3.7    0.0000   0.0000          ?        ?  5790.7529  55.5514          ?        ?      760.8        3.7       ?       ? 
1 1 1   37   20    5 o    360.8    2.9    0.0000   0.0000          ?        ?  1301.9456  21.0712          ?        ?      360.8        2.9       ?       ? 
1 1 1   37   20    6 o    149.7    4.3    0.0000   0.0000          ?        ?   224.1211  12.7704          ?        ?      149.7        4.3       ?       ? 
1 1 1   37   20    7 o    184.8    4.0    0.0000   0.0000          ?        ?   341.6091  14.6860          ?        ?      184.8        4.0       ?       ? 
1 1 1   37   20    8 o    349.4    3.1    0.0000   0.0000          ?        ?  1221.4919  21.7097          ?        ?      349.4        3.1       ?       ? 
1 1 1   37   20    9 o    128.8    3.7    0.0000   0.0000          ?        ?   166.0156   9.5778          ?        ?      128.8        3.7       ?       ? 
1 1 1   37   20   10 o    137.4    3.9    0.0000   0.0000          ?        ?   189.0024  10.8549          ?        ?      137.4        3.9       ?       ? 
1 1 1   37   20   11 o     64.8    9.4    0.0000   0.0000          ?        ?    42.1424  12.1319          ?        ?       64.8        9.4       ?       ? 
1 1 1   37   20   12 f    277.2    2.5    0.0000   0.0000          ?        ?   768.7800  14.0475          ?        ?      277.2        2.5       ?       ? 
1 1 1   37   20   13 o    207.4    2.9    0.0000   0.0000          ?        ?   430.3636  12.1319          ?        ?      207.4        2.9       ?       ? 
1 1 1   37   20   14 o    329.8    2.6    0.0000   0.0000          ?        ?  1088.0408  17.2401          ?        ?      329.8        2.6       ?       ? 
1 1 1   37   20   15 o    242.2    2.2    0.0000   0.0000          ?        ?   586.8014  10.8549          ?        ?      242.2        2.2       ?       ? 
1 1 1   37   20   16 o    259.1    2.5    0.0000   0.0000          ?        ?   671.7247  12.7704          ?        ?      259.1        2.5       ?       ? 
1 1 1   37   20   17 o    276.1    2.5    0.0000   0.0000          ?        ?   762.3948  14.0475          ?        ?      276.1        2.5       ?       ? 
1 1 1   37   20   18 o    442.2    2.6    0.0000   0.0000          ?        ?  1955.7916  22.9868          ?        ?      442.2        2.6       ?       ? 
1 1 1   37   20   19 o    234.6    2.9    0.0000   0.0000          ?        ?   550.4056  13.4090          ?        ?      234.6        2.9       ?       ? 
1 1 1   37   20   20 o    250.4    2.6    0.0000   0.0000          ?        ?   627.0282  12.7704          ?        ?      250.4        2.6       ?       ? 
1 1 1   37   20   21 o    229.1    2.9    0.0000   0.0000          ?        ?   524.8647  13.4090          ?        ?      229.1        2.9       ?       ? 
1 1 1   37   20   22 o    189.6    3.2    0.0000   0.0000          ?        ?   359.4877  12.1319          ?        ?      189.6        3.2       ?       ? 
1 1 1   37   20   23 o    388.5    2.4    0.0000   0.0000          ?        ?  1510.1036  18.5171          ?        ?      388.5        2.4       ?       ? 
1 1 1   37   20   24 f    260.5    2.7    0.0000   0.0000          ?        ?   678.7485  14.0475          ?        ?      260.5        2.7       ?       ? 
1 1 1   37   20   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   20   26 o    127.0    5.3    0.0000   0.0000          ?        ?   161.5460  13.4090          ?        ?      127.0        5.3       ?       ? 
1 1 1   37   20   27 o    262.4    3.0    0.0000   0.0000          ?        ?   688.9648  15.9630          ?        ?      262.4        3.0       ?       ? 
1 1 1   37   20   28 o     16.4    8.3    0.0000   0.0000          ?        ?   -46.6121  13.4090          ?        ?       16.4        8.3       ?       ? 
1 1 1   37   20   29 o     79.7    8.4    0.0000   0.0000          ?        ?    63.8522  13.4090          ?        ?       79.7        8.4       ?       ? 
1 1 1   37   20   30 o    381.3    2.7    0.0000   0.0000          ?        ?  1454.5522  20.4327          ?        ?      381.3        2.7       ?       ? 
1 1 1   37   20   31 o    153.2    4.6    0.0000   0.0000          ?        ?   234.9760  14.0475          ?        ?      153.2        4.6       ?       ? 
1 1 1   37   20   32 o    115.9    6.6    0.0000   0.0000          ?        ?   134.7281  15.3245          ?        ?      115.9        6.6       ?       ? 
1 1 1   37   20   33 o    180.2    4.1    0.0000   0.0000          ?        ?   325.0075  14.6860          ?        ?      180.2        4.1       ?       ? 
1 1 1   37   20   34 o    311.9    2.9    0.0000   0.0000          ?        ?   973.1069  17.8786          ?        ?      311.9        2.9       ?       ? 
1 1 1   37   20   35 o    104.0    7.4    0.0000   0.0000          ?        ?   108.5487  15.3245          ?        ?      104.0        7.4       ?       ? 
1 1 1   37   20   36 o    394.2    2.7    0.0000   0.0000          ?        ?  1554.8002  21.0712          ?        ?      394.2        2.7       ?       ? 
1 1 1   37   20   37 o    159.1    4.8    0.0000   0.0000          ?        ?   253.4931  15.3245          ?        ?      159.1        4.8       ?       ? 
1 1 1   37   20   38 o    204.7    4.1    0.0000   0.0000          ?        ?   419.5087  16.6016          ?        ?      204.7        4.1       ?       ? 
1 1 1   37   20   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   20   40 o     82.7   10.0    0.0000   0.0000          ?        ?    68.9603  16.6016          ?        ?       82.7       10.0       ?       ? 
1 1 1   37   20   41 o    267.0    3.5    0.0000   0.0000          ?        ?   713.8672  18.5171          ?        ?      267.0        3.5       ?       ? 
1 1 1   37   20   42 o     27.9   12.9    0.0000   0.0000          ?        ?   -14.6860  17.2401          ?        ?       27.9       12.9       ?       ? 
1 1 1   37   20   43 o    205.7    4.2    0.0000   0.0000          ?        ?   423.9784  17.2401          ?        ?      205.7        4.2       ?       ? 
1 1 1   37   20   44 o     62.1   13.7    0.0000   0.0000          ?        ?    40.8654  16.6016          ?        ?       62.1       13.7       ?       ? 
1 1 1   37   20   45 o    185.6    4.8    0.0000   0.0000          ?        ?   345.4402  17.8786          ?        ?      185.6        4.8       ?       ? 
1 1 1   37   20   46 o    160.5    5.8    0.0000   0.0000          ?        ?   258.6013  18.5171          ?        ?      160.5        5.8       ?       ? 
1 1 1   37   20   47 o     19.7    9.9    0.0000   0.0000          ?        ?   -55.5514  17.8786          ?        ?       19.7        9.9       ?       ? 
1 1 1   37   20   48 o    148.7    6.0    0.0000   0.0000          ?        ?   222.2055  17.8786          ?        ?      148.7        6.0       ?       ? 
1 1 1   37   20   49 f     44.6   15.6    0.0000   0.0000          ?        ?    18.5171  17.2401          ?        ?       44.6       15.6       ?       ? 
1 1 1   37   20   50 o     27.9   12.9    0.0000   0.0000          ?        ?   -14.0475  17.2401          ?        ?       27.9       12.9       ?       ? 
1 1 1   37   20   51 o    200.4    4.6    0.0000   0.0000          ?        ?   402.9071  18.5171          ?        ?      200.4        4.6       ?       ? 
1 1 1   37   20   52 o    120.1    7.4    0.0000   0.0000          ?        ?   145.5829  17.8786          ?        ?      120.1        7.4       ?       ? 
1 1 1   37   20   53 o     97.7    9.1    0.0000   0.0000          ?        ?    97.0553  17.8786          ?        ?       97.7        9.1       ?       ? 
1 1 1   37   20   54 o     85.9   10.0    0.0000   0.0000          ?        ?    75.3456  17.2401          ?        ?       85.9       10.0       ?       ? 
1 1 1   37   21    0 o    236.2    4.3  558.7064  20.4327   558.7064  20.4327   558.7064  20.4327      236.2      4.3      236.2        4.3     0.0     0.0 
1 1 1   37   21    1 o    339.0    2.7    0.0000   0.0000          ?        ?  1149.3389  18.5171          ?        ?      339.0        2.7       ?       ? 
1 1 1   37   21    2 o    633.8    3.0    0.0000   0.0000          ?        ?  4018.2166  37.6728          ?        ?      633.8        3.0       ?       ? 
1 1 1   37   21    3 o    687.3    3.2    0.0000   0.0000          ?        ?  4725.0601  43.4195          ?        ?      687.3        3.2       ?       ? 
1 1 1   37   21    4 o    644.5    3.2    0.0000   0.0000          ?        ?  4154.8604  40.8654          ?        ?      644.5        3.2       ?       ? 
1 1 1   37   21    5 o    295.4    3.1    0.0000   0.0000          ?        ?   872.8591  18.5171          ?        ?      295.4        3.1       ?       ? 
1 1 1   37   21    6 o    434.0    3.1    0.0000   0.0000          ?        ?  1884.2773  26.8179          ?        ?      434.0        3.1       ?       ? 
1 1 1   37   21    7 o     20.9   10.1    0.0000   0.0000          ?        ?   -20.4327  12.7704          ?        ?       20.9       10.1       ?       ? 
1 1 1   37   21    8 o    234.6    3.4    0.0000   0.0000          ?        ?   550.4056  15.9630          ?        ?      234.6        3.4       ?       ? 
1 1 1   37   21    9 o    228.5    3.2    0.0000   0.0000          ?        ?   522.3107  14.6860          ?        ?      228.5        3.2       ?       ? 
1 1 1   37   21   10 o    250.6    2.5    0.0000   0.0000          ?        ?   628.3053  12.7704          ?        ?      250.6        2.5       ?       ? 
1 1 1   37   21   11 o    315.7    2.6    0.0000   0.0000          ?        ?   996.7323  16.6016          ?        ?      315.7        2.6       ?       ? 
1 1 1   37   21   12 o    483.8    2.6    0.0000   0.0000          ?        ?  2340.8203  25.5409          ?        ?      483.8        2.6       ?       ? 
1 1 1   37   21   13 o    572.6    2.6    0.0000   0.0000          ?        ?  3280.0857  30.0105          ?        ?      572.6        2.6       ?       ? 
1 1 1   37   21   14 o     77.0    7.1    0.0000   0.0000          ?        ?    59.3825  10.8549          ?        ?       77.0        7.1       ?       ? 
1 1 1   37   21   15 o    260.5    2.7    0.0000   0.0000          ?        ?   678.7485  14.0475          ?        ?      260.5        2.7       ?       ? 
1 1 1   37   21   16 o    121.9    3.7    0.0000   0.0000          ?        ?   148.7755   8.9393          ?        ?      121.9        3.7       ?       ? 
1 1 1   37   21   17 o    158.4    3.2    0.0000   0.0000          ?        ?   250.9390  10.2163          ?        ?      158.4        3.2       ?       ? 
1 1 1   37   21   18 o    282.4    2.6    0.0000   0.0000          ?        ?   797.5135  14.6860          ?        ?      282.4        2.6       ?       ? 
1 1 1   37   21   19 o    210.8    2.9    0.0000   0.0000          ?        ?   444.4110  12.1319          ?        ?      210.8        2.9       ?       ? 
1 1 1   37   21   20 o    216.4    3.0    0.0000   0.0000          ?        ?   468.6749  12.7704          ?        ?      216.4        3.0       ?       ? 
1 1 1   37   21   21 o    273.5    2.6    0.0000   0.0000          ?        ?   748.3474  14.0475          ?        ?      273.5        2.6       ?       ? 
1 1 1   37   21   22 o     79.4    7.6    0.0000   0.0000          ?        ?    63.2136  12.1319          ?        ?       79.4        7.6       ?       ? 
1 1 1   37   21   23 o    251.9    2.8    0.0000   0.0000          ?        ?   634.6905  14.0475          ?        ?      251.9        2.8       ?       ? 
1 1 1   37   21   24 o    312.5    2.6    0.0000   0.0000          ?        ?   976.9381  15.9630          ?        ?      312.5        2.6       ?       ? 
1 1 1   37   21   25 o    463.2    2.5    0.0000   0.0000          ?        ?  2146.7097  22.9868          ?        ?      463.2        2.5       ?       ? 
1 1 1   37   21   26 o    177.3    4.0    0.0000   0.0000          ?        ?   314.7912  14.0475          ?        ?      177.3        4.0       ?       ? 
1 1 1   37   21   27 o    313.6    2.6    0.0000   0.0000          ?        ?   983.9619  16.6016          ?        ?      313.6        2.6       ?       ? 
1 1 1   37   21   28 o    363.9    2.5    0.0000   0.0000          ?        ?  1324.9324  18.5171          ?        ?      363.9        2.5       ?       ? 
1 1 1   37   21   29 o    246.7    3.4    0.0000   0.0000          ?        ?   609.1497  16.6016          ?        ?      246.7        3.4       ?       ? 
1 1 1   37   21   30 o    126.7    6.0    0.0000   0.0000          ?        ?   160.9075  15.3245          ?        ?      126.7        6.0       ?       ? 
1 1 1   37   21   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   21   32 o    253.1    3.5    0.0000   0.0000          ?        ?   641.0757  17.8786          ?        ?      253.1        3.5       ?       ? 
1 1 1   37   21   33 o    179.8    4.3    0.0000   0.0000          ?        ?   323.7305  15.3245          ?        ?      179.8        4.3       ?       ? 
1 1 1   37   21   34 o    213.7    3.7    0.0000   0.0000          ?        ?   457.1815  15.9630          ?        ?      213.7        3.7       ?       ? 
1 1 1   37   21   35 o    244.8    3.4    0.0000   0.0000          ?        ?   599.5718  16.6016          ?        ?      244.8        3.4       ?       ? 
1 1 1   37   21   36 o     30.7   13.4    0.0000   0.0000          ?        ?    -2.5541  15.3245          ?        ?       30.7       13.4       ?       ? 
1 1 1   37   21   37 o    221.8    3.7    0.0000   0.0000          ?        ?   492.3002  16.6016          ?        ?      221.8        3.7       ?       ? 
1 1 1   37   21   38 o    440.3    2.8    0.0000   0.0000          ?        ?  1939.8286  24.2638          ?        ?      440.3        2.8       ?       ? 
1 1 1   37   21   39 o    104.8    7.6    0.0000   0.0000          ?        ?   110.4642  15.9630          ?        ?      104.8        7.6       ?       ? 
1 1 1   37   21   40 o    274.5    3.3    0.0000   0.0000          ?        ?   754.0941  17.8786          ?        ?      274.5        3.3       ?       ? 
1 1 1   37   21   41 o     66.7   12.9    0.0000   0.0000          ?        ?    46.6121  16.6016          ?        ?       66.7       12.9       ?       ? 
1 1 1   37   21   42 o     89.3    9.3    0.0000   0.0000          ?        ?    80.4537  16.6016          ?        ?       89.3        9.3       ?       ? 
1 1 1   37   21   43 o    181.5    4.9    0.0000   0.0000          ?        ?   330.1157  17.8786          ?        ?      181.5        4.9       ?       ? 
1 1 1   37   21   44 o    213.8    4.2    0.0000   0.0000          ?        ?   457.8200  17.8786          ?        ?      213.8        4.2       ?       ? 
1 1 1   37   21   45 o    206.9    4.5    0.0000   0.0000          ?        ?   429.0865  18.5171          ?        ?      206.9        4.5       ?       ? 
1 1 1   37   21   46 o     40.0   15.3    0.0000   0.0000          ?        ?    11.4934  17.2401          ?        ?       40.0       15.3       ?       ? 
1 1 1   37   21   47 o    421.6    2.8    0.0000   0.0000          ?        ?  1779.5598  23.6253          ?        ?      421.6        2.8       ?       ? 
1 1 1   37   21   48 o     80.8   10.7    0.0000   0.0000          ?        ?    66.4062  17.2401          ?        ?       80.8       10.7       ?       ? 
1 1 1   37   21   49 o    208.7    4.3    0.0000   0.0000          ?        ?   436.7488  17.8786          ?        ?      208.7        4.3       ?       ? 
1 1 1   37   21   50 o    181.0    5.1    0.0000   0.0000          ?        ?   328.8386  18.5171          ?        ?      181.0        5.1       ?       ? 
1 1 1   37   21   51 o     94.1    9.5    0.0000   0.0000          ?        ?    90.0316  17.8786          ?        ?       94.1        9.5       ?       ? 
1 1 1   37   21   52 o    206.8    4.3    0.0000   0.0000          ?        ?   429.0865  17.8786          ?        ?      206.8        4.3       ?       ? 
1 1 1   37   21   53 o     38.5   15.2    0.0000   0.0000          ?        ?     9.5778  17.2401          ?        ?       38.5       15.2       ?       ? 
1 1 1   37   22    0 o    312.6    3.5  977.5767  21.7097   977.5767  21.7097   977.5767  21.7097      312.6      3.5      312.6        3.5     0.0     0.0 
1 1 1   37   22    1 o    280.8    2.6    0.0000   0.0000          ?        ?   788.5742  14.6860          ?        ?      280.8        2.6       ?       ? 
1 1 1   37   22    2 o    246.6    3.0    0.0000   0.0000          ?        ?   608.5111  14.6860          ?        ?      246.6        3.0       ?       ? 
1 1 1   37   22    3 o    224.8    4.0    0.0000   0.0000          ?        ?   505.7091  17.8786          ?        ?      224.8        4.0       ?       ? 
1 1 1   37   22    4 o    572.4    3.4    0.0000   0.0000          ?        ?  3278.1702  38.9498          ?        ?      572.4        3.4       ?       ? 
1 1 1   37   22    5 o    150.1    4.9    0.0000   0.0000          ?        ?   225.3981  14.6860          ?        ?      150.1        4.9       ?       ? 
1 1 1   37   22    6 o    339.3    2.8    0.0000   0.0000          ?        ?  1151.8929  19.1556          ?        ?      339.3        2.8       ?       ? 
1 1 1   37   22    7 o     34.6   12.4    0.0000   0.0000          ?        ?    10.2163  10.8549          ?        ?       34.6       12.4       ?       ? 
1 1 1   37   22    8 o    325.6    2.8    0.0000   0.0000          ?        ?  1060.5845  18.5171          ?        ?      325.6        2.8       ?       ? 
1 1 1   37   22    9 o    285.0    3.2    0.0000   0.0000          ?        ?   812.8381  18.5171          ?        ?      285.0        3.2       ?       ? 
1 1 1   37   22   10 o    324.9    3.1    0.0000   0.0000          ?        ?  1056.1147  20.4327          ?        ?      324.9        3.1       ?       ? 
1 1 1   37   22   11 o    185.5    2.9    0.0000   0.0000          ?        ?   344.1632  10.8549          ?        ?      185.5        2.9       ?       ? 
1 1 1   37   22   12 o     97.5    5.6    0.0000   0.0000          ?        ?    95.1397  10.8549          ?        ?       97.5        5.6       ?       ? 
1 1 1   37   22   13 o    305.9    2.7    0.0000   0.0000          ?        ?   936.0728  16.6016          ?        ?      305.9        2.7       ?       ? 
1 1 1   37   22   14 o     15.1    7.7    0.0000   0.0000          ?        ?   -40.2269  11.4934          ?        ?       15.1        7.7       ?       ? 
1 1 1   37   22   15 o     22.5   10.8    0.0000   0.0000          ?        ?   -20.4327  14.0475          ?        ?       22.5       10.8       ?       ? 
1 1 1   37   22   16 o    104.1    6.1    0.0000   0.0000          ?        ?   108.5487  12.7704          ?        ?      104.1        6.1       ?       ? 
1 1 1   37   22   17 o    530.0    2.6    0.0000   0.0000          ?        ?  2810.1338  27.4564          ?        ?      530.0        2.6       ?       ? 
1 1 1   37   22   18 o    249.1    2.4    0.0000   0.0000          ?        ?   620.6430  12.1319          ?        ?      249.1        2.4       ?       ? 
1 1 1   37   22   19 o    366.0    2.4    0.0000   0.0000          ?        ?  1339.6184  17.2401          ?        ?      366.0        2.4       ?       ? 
1 1 1   37   22   20 o    430.4    2.5    0.0000   0.0000          ?        ?  1852.9899  21.7097          ?        ?      430.4        2.5       ?       ? 
1 1 1   37   22   21 o    267.1    2.7    0.0000   0.0000          ?        ?   713.8672  14.6860          ?        ?      267.1        2.7       ?       ? 
1 1 1   37   22   22 f    391.8    2.5    0.0000   0.0000          ?        ?  1535.6445  19.7942          ?        ?      391.8        2.5       ?       ? 
1 1 1   37   22   23 o    346.4    2.4    0.0000   0.0000          ?        ?  1200.4207  16.6016          ?        ?      346.4        2.4       ?       ? 
1 1 1   37   22   24 o    122.4    5.0    0.0000   0.0000          ?        ?   150.0526  12.1319          ?        ?      122.4        5.0       ?       ? 
1 1 1   37   22   25 o    418.8    2.4    0.0000   0.0000          ?        ?  1754.6573  20.4327          ?        ?      418.8        2.4       ?       ? 
1 1 1   37   22   26 o     84.0    7.6    0.0000   0.0000          ?        ?    70.8759  12.7704          ?        ?       84.0        7.6       ?       ? 
1 1 1   37   22   27 o    245.8    3.0    0.0000   0.0000          ?        ?   604.6799  14.6860          ?        ?      245.8        3.0       ?       ? 
1 1 1   37   22   28 o     18.5    9.2    0.0000   0.0000          ?        ?   -33.8416  13.4090          ?        ?       18.5        9.2       ?       ? 
1 1 1   37   22   29 o    105.6    6.7    0.0000   0.0000          ?        ?   111.7413  14.0475          ?        ?      105.6        6.7       ?       ? 
1 1 1   37   22   30 o    424.6    2.6    0.0000   0.0000          ?        ?  1803.8236  21.7097          ?        ?      424.6        2.6       ?       ? 
1 1 1   37   22   31 o    330.0    2.6    0.0000   0.0000          ?        ?  1089.3180  17.2401          ?        ?      330.0        2.6       ?       ? 
1 1 1   37   22   32 o    219.9    3.5    0.0000   0.0000          ?        ?   483.9994  15.3245          ?        ?      219.9        3.5       ?       ? 
1 1 1   37   22   33 o    213.6    3.7    0.0000   0.0000          ?        ?   456.5430  15.9630          ?        ?      213.6        3.7       ?       ? 
1 1 1   37   22   34 o    113.9    6.7    0.0000   0.0000          ?        ?   130.2584  15.3245          ?        ?      113.9        6.7       ?       ? 
1 1 1   37   22   35 o     32.9   14.0    0.0000   0.0000          ?        ?     0.6385  15.9630          ?        ?       32.9       14.0       ?       ? 
1 1 1   37   22   36 o    191.3    4.2    0.0000   0.0000          ?        ?   366.5114  15.9630          ?        ?      191.3        4.2       ?       ? 
1 1 1   37   22   37 o    320.8    3.0    0.0000   0.0000          ?        ?  1029.9354  19.1556          ?        ?      320.8        3.0       ?       ? 
1 1 1   37   22   38 o    253.2    3.4    0.0000   0.0000          ?        ?   641.7142  17.2401          ?        ?      253.2        3.4       ?       ? 
1 1 1   37   22   39 o    349.1    3.0    0.0000   0.0000          ?        ?  1219.5763  21.0712          ?        ?      349.1        3.0       ?       ? 
1 1 1   37   22   40 o    224.9    3.8    0.0000   0.0000          ?        ?   506.3477  17.2401          ?        ?      224.9        3.8       ?       ? 
1 1 1   37   22   41 o    222.7    3.9    0.0000   0.0000          ?        ?   496.7698  17.2401          ?        ?      222.7        3.9       ?       ? 
1 1 1   37   22   42 f     64.7   12.8    0.0000   0.0000          ?        ?    44.0580  15.9630          ?        ?       64.7       12.8       ?       ? 
1 1 1   37   22   43 o     56.4   14.6    0.0000   0.0000          ?        ?    33.8416  16.6016          ?        ?       56.4       14.6       ?       ? 
1 1 1   37   22   44 o     50.4   15.6    0.0000   0.0000          ?        ?    26.1794  17.2401          ?        ?       50.4       15.6       ?       ? 
1 1 1   37   22   45 o    260.2    3.6    0.0000   0.0000          ?        ?   678.1099  18.5171          ?        ?      260.2        3.6       ?       ? 
1 1 1   37   22   46 o     19.8    9.9    0.0000   0.0000          ?        ?   -50.4432  17.2401          ?        ?       19.8        9.9       ?       ? 
1 1 1   37   22   47 o    205.8    4.5    0.0000   0.0000          ?        ?   424.6169  18.5171          ?        ?      205.8        4.5       ?       ? 
1 1 1   37   22   48 o    295.5    3.3    0.0000   0.0000          ?        ?   874.7747  19.7942          ?        ?      295.5        3.3       ?       ? 
1 1 1   37   22   49 o    129.5    7.1    0.0000   0.0000          ?        ?   169.2082  18.5171          ?        ?      129.5        7.1       ?       ? 
1 1 1   37   22   50 o    152.2    5.7    0.0000   0.0000          ?        ?   233.0604  17.2401          ?        ?      152.2        5.7       ?       ? 
1 1 1   37   22   51 o    199.8    4.6    0.0000   0.0000          ?        ?   400.9916  18.5171          ?        ?      199.8        4.6       ?       ? 
1 1 1   37   22   52 o    110.3    7.5    0.0000   0.0000          ?        ?   123.2347  16.6016          ?        ?      110.3        7.5       ?       ? 
1 1 1   37   23    0 o    402.8    4.4 1623.7605  35.1187  1623.7605  35.1187  1623.7605  35.1187      402.8      4.4      402.8        4.4     0.0     0.0 
1 1 1   37   23    1 o     96.5    5.3    0.0000   0.0000          ?        ?    93.2242  10.2163          ?        ?       96.5        5.3       ?       ? 
1 1 1   37   23    2 f    449.5    2.8    0.0000   0.0000          ?        ?  2020.9209  25.5409          ?        ?      449.5        2.8       ?       ? 
1 1 1   37   23    3 o    464.1    2.9    0.0000   0.0000          ?        ?  2155.0105  26.8179          ?        ?      464.1        2.9       ?       ? 
1 1 1   37   23    4 o    111.2    5.7    0.0000   0.0000          ?        ?   123.8732  12.7704          ?        ?      111.2        5.7       ?       ? 
1 1 1   37   23    5 o     76.6    7.1    0.0000   0.0000          ?        ?    58.7440  10.8549          ?        ?       76.6        7.1       ?       ? 
1 1 1   37   23    6 o    295.3    3.6    0.0000   0.0000          ?        ?   872.2206  21.0712          ?        ?      295.3        3.6       ?       ? 
1 1 1   37   23    7 o     36.2   12.7    0.0000   0.0000          ?        ?    11.4934  11.4934          ?        ?       36.2       12.7       ?       ? 
1 1 1   37   23    8 o    136.5    4.4    0.0000   0.0000          ?        ?   186.4483  12.1319          ?        ?      136.5        4.4       ?       ? 
1 1 1   37   23    9 o    278.4    3.0    0.0000   0.0000          ?        ?   775.1653  16.6016          ?        ?      278.4        3.0       ?       ? 
1 1 1   37   23   10 o    324.0    3.1    0.0000   0.0000          ?        ?  1050.3680  19.7942          ?        ?      324.0        3.1       ?       ? 
1 1 1   37   23   11 o     95.8    5.3    0.0000   0.0000          ?        ?    91.9471  10.2163          ?        ?       95.8        5.3       ?       ? 
1 1 1   37   23   12 o     85.6    6.0    0.0000   0.0000          ?        ?    73.4300  10.2163          ?        ?       85.6        6.0       ?       ? 
1 1 1   37   23   13 o    571.4    3.1    0.0000   0.0000          ?        ?  3266.6768  35.1187          ?        ?      571.4        3.1       ?       ? 
1 1 1   37   23   14 o    491.4    3.1    0.0000   0.0000          ?        ?  2415.5273  30.0105          ?        ?      491.4        3.1       ?       ? 
1 1 1   37   23   15 o    570.4    2.9    0.0000   0.0000          ?        ?  3254.5449  32.5646          ?        ?      570.4        2.9       ?       ? 
1 1 1   37   23   16 o    127.8    4.7    0.0000   0.0000          ?        ?   163.4615  12.1319          ?        ?      127.8        4.7       ?       ? 
1 1 1   37   23   17 o    338.5    2.4    0.0000   0.0000          ?        ?  1146.1464  15.9630          ?        ?      338.5        2.4       ?       ? 
1 1 1   37   23   18 o    492.7    2.7    0.0000   0.0000          ?        ?  2428.2976  26.8179          ?        ?      492.7        2.7       ?       ? 
1 1 1   37   23   19 o    745.3    3.3    0.0000   0.0000          ?        ?  5557.6924  48.5276          ?        ?      745.3        3.3       ?       ? 
1 1 1   37   23   20 o    241.3    2.8    0.0000   0.0000          ?        ?   582.3317  13.4090          ?        ?      241.3        2.8       ?       ? 
1 1 1   37   23   21 o    299.8    2.6    0.0000   0.0000          ?        ?   899.0385  15.3245          ?        ?      299.8        2.6       ?       ? 
1 1 1   37   23   22 o    391.2    2.5    0.0000   0.0000          ?        ?  1531.1749  19.7942          ?        ?      391.2        2.5       ?       ? 
1 1 1   37   23   23 o    480.3    2.5    0.0000   0.0000          ?        ?  2307.6172  24.2638          ?        ?      480.3        2.5       ?       ? 
1 1 1   37   23   24 o    715.1    2.9    0.0000   0.0000          ?        ?  5115.8354  42.1424          ?        ?      715.1        2.9       ?       ? 
1 1 1   37   23   25 o    283.8    2.7    0.0000   0.0000          ?        ?   805.8143  15.3245          ?        ?      283.8        2.7       ?       ? 
1 1 1   37   23   26 o     74.0    8.2    0.0000   0.0000          ?        ?    54.9129  12.1319          ?        ?       74.0        8.2       ?       ? 
1 1 1   37   23   27 o    331.6    2.7    0.0000   0.0000          ?        ?  1100.1727  17.8786          ?        ?      331.6        2.7       ?       ? 
1 1 1   37   23   28 o    183.4    3.7    0.0000   0.0000          ?        ?   336.5009  13.4090          ?        ?      183.4        3.7       ?       ? 
1 1 1   37   23   29 o    293.4    2.8    0.0000   0.0000          ?        ?   861.3657  16.6016          ?        ?      293.4        2.8       ?       ? 
1 1 1   37   23   30 o    301.0    2.8    0.0000   0.0000          ?        ?   906.7007  16.6016          ?        ?      301.0        2.8       ?       ? 
1 1 1   37   23   31 o    170.0    4.3    0.0000   0.0000          ?        ?   289.2503  14.6860          ?        ?      170.0        4.3       ?       ? 
1 1 1   37   23   32 o    200.8    3.8    0.0000   0.0000          ?        ?   403.5457  15.3245          ?        ?      200.8        3.8       ?       ? 
1 1 1   37   23   33 o     47.9   14.3    0.0000   0.0000          ?        ?    23.6253  14.6860          ?        ?       47.9       14.3       ?       ? 
1 1 1   37   23   34 o    196.4    4.1    0.0000   0.0000          ?        ?   386.3056  15.9630          ?        ?      196.4        4.1       ?       ? 
1 1 1   37   23   35 o    129.4    5.9    0.0000   0.0000          ?        ?   167.9312  15.3245          ?        ?      129.4        5.9       ?       ? 
1 1 1   37   23   36 o    139.1    5.7    0.0000   0.0000          ?        ?   194.1106  15.9630          ?        ?      139.1        5.7       ?       ? 
1 1 1   37   23   37 o    232.8    3.8    0.0000   0.0000          ?        ?   542.7434  17.8786          ?        ?      232.8        3.8       ?       ? 
1 1 1   37   23   38 o    361.3    2.8    0.0000   0.0000          ?        ?  1306.4153  20.4327          ?        ?      361.3        2.8       ?       ? 
1 1 1   37   23   39 o    172.7    5.0    0.0000   0.0000          ?        ?   298.8281  17.2401          ?        ?      172.7        5.0       ?       ? 
1 1 1   37   23   40 o    253.0    3.4    0.0000   0.0000          ?        ?   641.0757  17.2401          ?        ?      253.0        3.4       ?       ? 
1 1 1   37   23   41 o     28.0   12.8    0.0000   0.0000          ?        ?   -10.2163  15.9630          ?        ?       28.0       12.8       ?       ? 
1 1 1   37   23   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   23   43 o     28.2   12.9    0.0000   0.0000          ?        ?   -11.4934  16.6016          ?        ?       28.2       12.9       ?       ? 
1 1 1   37   23   44 o    303.2    3.5    0.0000   0.0000          ?        ?   920.7482  21.0712          ?        ?      303.2        3.5       ?       ? 
1 1 1   37   23   45 o    148.5    6.2    0.0000   0.0000          ?        ?   221.5670  18.5171          ?        ?      148.5        6.2       ?       ? 
1 1 1   37   23   46 o    263.2    3.9    0.0000   0.0000          ?        ?   694.0730  20.4327          ?        ?      263.2        3.9       ?       ? 
1 1 1   37   23   47 o     72.4   11.9    0.0000   0.0000          ?        ?    53.6358  17.2401          ?        ?       72.4       11.9       ?       ? 
1 1 1   37   23   48 o     75.7   11.8    0.0000   0.0000          ?        ?    58.7440  17.8786          ?        ?       75.7       11.8       ?       ? 
1 1 1   37   23   49 o    194.7    4.6    0.0000   0.0000          ?        ?   380.5589  17.8786          ?        ?      194.7        4.6       ?       ? 
1 1 1   37   23   50 o     24.0   11.6    0.0000   0.0000          ?        ?   -27.4564  17.2401          ?        ?       24.0       11.6       ?       ? 
1 1 1   37   24    0 o    545.0    4.9 2972.3181  53.6358  2972.3181  53.6358  2972.3181  53.6358      545.0      4.9      545.0        4.9     0.0     0.0 
1 1 1   37   24    1 o    226.3    4.7    0.0000   0.0000          ?        ?   512.7329  21.0712          ?        ?      226.3        4.7       ?       ? 
1 1 1   37   24    2 o    405.7    3.1    0.0000   0.0000          ?        ?  1646.7472  24.9023          ?        ?      405.7        3.1       ?       ? 
1 1 1   37   24    3 o    379.3    2.8    0.0000   0.0000          ?        ?  1439.2277  21.0712          ?        ?      379.3        2.8       ?       ? 
1 1 1   37   24    4 o    427.5    2.8    0.0000   0.0000          ?        ?  1828.0873  23.6253          ?        ?      427.5        2.8       ?       ? 
1 1 1   37   24    5 o    348.4    2.8    0.0000   0.0000          ?        ?  1214.4681  19.7942          ?        ?      348.4        2.8       ?       ? 
1 1 1   37   24    6 f    101.3    5.0    0.0000   0.0000          ?        ?   102.8020  10.2163          ?        ?      101.3        5.0       ?       ? 
1 1 1   37   24    7 o    275.7    2.9    0.0000   0.0000          ?        ?   760.4792  15.9630          ?        ?      275.7        2.9       ?       ? 
1 1 1   37   24    8 o    299.0    3.0    0.0000   0.0000          ?        ?   894.5688  17.8786          ?        ?      299.0        3.0       ?       ? 
1 1 1   37   24    9 o    248.9    3.3    0.0000   0.0000          ?        ?   620.0045  16.6016          ?        ?      248.9        3.3       ?       ? 
1 1 1   37   24   10 o    522.2    3.0    0.0000   0.0000          ?        ?  2727.7644  31.2876          ?        ?      522.2        3.0       ?       ? 
1 1 1   37   24   11 f     57.6   10.9    0.0000   0.0000          ?        ?    34.4802  12.1319          ?        ?       57.6       10.9       ?       ? 
1 1 1   37   24   12 o    320.0    2.4    0.0000   0.0000          ?        ?  1024.1886  15.3245          ?        ?      320.0        2.4       ?       ? 
1 1 1   37   24   13 o    384.5    3.0    0.0000   0.0000          ?        ?  1478.8162  22.9868          ?        ?      384.5        3.0       ?       ? 
1 1 1   37   24   14 o     17.0    8.4    0.0000   0.0000          ?        ?   -30.0105  11.4934          ?        ?       17.0        8.4       ?       ? 
1 1 1   37   24   15 o     56.4   11.7    0.0000   0.0000          ?        ?    33.2031  12.7704          ?        ?       56.4       11.7       ?       ? 
1 1 1   37   24   16 o    221.1    3.3    0.0000   0.0000          ?        ?   489.1075  14.6860          ?        ?      221.1        3.3       ?       ? 
1 1 1   37   24   17 o     89.9    7.5    0.0000   0.0000          ?        ?    81.0922  13.4090          ?        ?       89.9        7.5       ?       ? 
1 1 1   37   24   18 o    405.7    2.4    0.0000   0.0000          ?        ?  1646.7472  19.7942          ?        ?      405.7        2.4       ?       ? 
1 1 1   37   24   19 o    114.9    4.4    0.0000   0.0000          ?        ?   132.1740  10.2163          ?        ?      114.9        4.4       ?       ? 
1 1 1   37   24   20 o    266.5    2.5    0.0000   0.0000          ?        ?   710.6746  13.4090          ?        ?      266.5        2.5       ?       ? 
1 1 1   37   24   21 o     51.8   11.4    0.0000   0.0000          ?        ?    28.0950  11.4934          ?        ?       51.8       11.4       ?       ? 
1 1 1   37   24   22 o     33.1   12.8    0.0000   0.0000          ?        ?     7.0237  12.1319          ?        ?       33.1       12.8       ?       ? 
1 1 1   37   24   23 o    337.8    2.6    0.0000   0.0000          ?        ?  1141.6766  17.2401          ?        ?      337.8        2.6       ?       ? 
1 1 1   37   24   24 o    181.6    3.7    0.0000   0.0000          ?        ?   330.1157  13.4090          ?        ?      181.6        3.7       ?       ? 
1 1 1   37   24   25 o    172.8    3.9    0.0000   0.0000          ?        ?   298.8281  13.4090          ?        ?      172.8        3.9       ?       ? 
1 1 1   37   24   26 o    307.1    2.7    0.0000   0.0000          ?        ?   943.7350  16.6016          ?        ?      307.1        2.7       ?       ? 
1 1 1   37   24   27 o    131.2    5.1    0.0000   0.0000          ?        ?   172.4008  13.4090          ?        ?      131.2        5.1       ?       ? 
1 1 1   37   24   28 o    316.7    2.7    0.0000   0.0000          ?        ?  1003.7560  17.2401          ?        ?      316.7        2.7       ?       ? 
1 1 1   37   24   29 o    470.3    2.5    0.0000   0.0000          ?        ?  2213.1160  23.6253          ?        ?      470.3        2.5       ?       ? 
1 1 1   37   24   30 o     34.8   13.7    0.0000   0.0000          ?        ?     7.0237  14.0475          ?        ?       34.8       13.7       ?       ? 
1 1 1   37   24   31 o    157.7    4.7    0.0000   0.0000          ?        ?   249.0234  14.6860          ?        ?      157.7        4.7       ?       ? 
1 1 1   37   24   32 o     36.6   14.1    0.0000   0.0000          ?        ?     8.9393  14.6860          ?        ?       36.6       14.1       ?       ? 
1 1 1   37   24   33 o    161.7    4.7    0.0000   0.0000          ?        ?   261.7939  15.3245          ?        ?      161.7        4.7       ?       ? 
1 1 1   37   24   34 o     76.3   10.0    0.0000   0.0000          ?        ?    58.7440  15.3245          ?        ?       76.3       10.0       ?       ? 
1 1 1   37   24   35 o    206.6    3.7    0.0000   0.0000          ?        ?   427.1710  15.3245          ?        ?      206.6        3.7       ?       ? 
1 1 1   37   24   36 o    164.2    4.9    0.0000   0.0000          ?        ?   270.0946  15.9630          ?        ?      164.2        4.9       ?       ? 
1 1 1   37   24   37 o     22.1   10.8    0.0000   0.0000          ?        ?   -30.6490  15.9630          ?        ?       22.1       10.8       ?       ? 
1 1 1   37   24   38 o    125.1    6.4    0.0000   0.0000          ?        ?   157.0763  15.9630          ?        ?      125.1        6.4       ?       ? 
1 1 1   37   24   39 o    363.1    2.9    0.0000   0.0000          ?        ?  1319.8242  21.0712          ?        ?      363.1        2.9       ?       ? 
1 1 1   37   24   40 o     63.6   13.5    0.0000   0.0000          ?        ?    42.7809  16.6016          ?        ?       63.6       13.5       ?       ? 
1 1 1   37   24   41 o    119.0    7.0    0.0000   0.0000          ?        ?   142.3903  16.6016          ?        ?      119.0        7.0       ?       ? 
1 1 1   37   24   42 o     26.9   12.5    0.0000   0.0000          ?        ?   -15.3245  16.6016          ?        ?       26.9       12.5       ?       ? 
1 1 1   37   24   43 o    397.4    2.8    0.0000   0.0000          ?        ?  1580.9796  22.3483          ?        ?      397.4        2.8       ?       ? 
1 1 1   37   24   44 o    432.7    2.7    0.0000   0.0000          ?        ?  1874.6996  23.6253          ?        ?      432.7        2.7       ?       ? 
1 1 1   37   24   45 o    156.0    5.7    0.0000   0.0000          ?        ?   244.5538  17.8786          ?        ?      156.0        5.7       ?       ? 
1 1 1   37   24   46 o     74.6   11.6    0.0000   0.0000          ?        ?    56.8284  17.2401          ?        ?       74.6       11.6       ?       ? 
1 1 1   37   24   47 o    182.9    4.7    0.0000   0.0000          ?        ?   335.8624  17.2401          ?        ?      182.9        4.7       ?       ? 
1 1 1   37   24   48 o    198.3    4.5    0.0000   0.0000          ?        ?   394.6064  17.8786          ?        ?      198.3        4.5       ?       ? 
1 1 1   37   24   49 o     80.9   11.1    0.0000   0.0000          ?        ?    67.0448  17.8786          ?        ?       80.9       11.1       ?       ? 
1 1 1   37   25    0 o    108.5   15.9  123.2347  33.2031   123.2347  33.2031   123.2347  33.2031      108.5     15.9      108.5       15.9     0.0     0.0 
1 1 1   37   25    1 o    172.6    4.6    0.0000   0.0000          ?        ?   298.1896  15.9630          ?        ?      172.6        4.6       ?       ? 
1 1 1   37   25    2 o    345.2    3.9    0.0000   0.0000          ?        ?  1192.7584  26.8179          ?        ?      345.2        3.9       ?       ? 
1 1 1   37   25    3 o    153.0    5.6    0.0000   0.0000          ?        ?   234.3374  17.2401          ?        ?      153.0        5.6       ?       ? 
1 1 1   37   25    4 o    147.0    6.1    0.0000   0.0000          ?        ?   216.4588  17.8786          ?        ?      147.0        6.1       ?       ? 
1 1 1   37   25    5 o    323.5    3.2    0.0000   0.0000          ?        ?  1047.1754  20.4327          ?        ?      323.5        3.2       ?       ? 
1 1 1   37   25    6 f     54.1   12.6    0.0000   0.0000          ?        ?    30.6490  13.4090          ?        ?       54.1       12.6       ?       ? 
1 1 1   37   25    7 o     61.3    7.8    0.0000   0.0000          ?        ?    37.6728   9.5778          ?        ?       61.3        7.8       ?       ? 
1 1 1   37   25    8 o    310.5    2.8    0.0000   0.0000          ?        ?   964.8062  17.2401          ?        ?      310.5        2.8       ?       ? 
1 1 1   37   25    9 o    137.4    3.9    0.0000   0.0000          ?        ?   189.0024  10.8549          ?        ?      137.4        3.9       ?       ? 
1 1 1   37   25   10 o    129.3    4.2    0.0000   0.0000          ?        ?   167.2927  10.8549          ?        ?      129.3        4.2       ?       ? 
1 1 1   37   25   11 o    138.6    4.6    0.0000   0.0000          ?        ?   192.1950  12.7704          ?        ?      138.6        4.6       ?       ? 
1 1 1   37   25   12 o    410.0    2.9    0.0000   0.0000          ?        ?  1681.8660  23.6253          ?        ?      410.0        2.9       ?       ? 
1 1 1   37   25   13 o    298.9    2.6    0.0000   0.0000          ?        ?   893.9303  15.3245          ?        ?      298.9        2.6       ?       ? 
1 1 1   37   25   14 o    336.0    2.6    0.0000   0.0000          ?        ?  1129.5447  17.2401          ?        ?      336.0        2.6       ?       ? 
1 1 1   37   25   15 o    138.6    4.1    0.0000   0.0000          ?        ?   192.1950  11.4934          ?        ?      138.6        4.1       ?       ? 
1 1 1   37   25   16 o    233.0    3.0    0.0000   0.0000          ?        ?   543.3819  14.0475          ?        ?      233.0        3.0       ?       ? 
1 1 1   37   25   17 o    259.6    3.1    0.0000   0.0000          ?        ?   674.2788  15.9630          ?        ?      259.6        3.1       ?       ? 
1 1 1   37   25   18 o    144.2    4.9    0.0000   0.0000          ?        ?   208.1580  14.0475          ?        ?      144.2        4.9       ?       ? 
1 1 1   37   25   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   25   20 o    113.2    4.5    0.0000   0.0000          ?        ?   128.3428  10.2163          ?        ?      113.2        4.5       ?       ? 
1 1 1   37   25   21 o    269.0    2.6    0.0000   0.0000          ?        ?   724.0836  14.0475          ?        ?      269.0        2.6       ?       ? 
1 1 1   37   25   22 o    152.2    3.8    0.0000   0.0000          ?        ?   231.7833  11.4934          ?        ?      152.2        3.8       ?       ? 
1 1 1   37   25   23 o    241.5    2.8    0.0000   0.0000          ?        ?   583.6088  13.4090          ?        ?      241.5        2.8       ?       ? 
1 1 1   37   25   24 o    128.0    5.2    0.0000   0.0000          ?        ?   164.1001  13.4090          ?        ?      128.0        5.2       ?       ? 
1 1 1   37   25   25 o    256.6    2.9    0.0000   0.0000          ?        ?   658.9543  14.6860          ?        ?      256.6        2.9       ?       ? 
1 1 1   37   25   26 f    461.0    2.5    0.0000   0.0000          ?        ?  2126.2771  22.9868          ?        ?      461.0        2.5       ?       ? 
1 1 1   37   25   27 o    280.4    2.8    0.0000   0.0000          ?        ?   786.6586  15.9630          ?        ?      280.4        2.8       ?       ? 
1 1 1   37   25   28 o    175.0    4.0    0.0000   0.0000          ?        ?   306.4904  14.0475          ?        ?      175.0        4.0       ?       ? 
1 1 1   37   25   29 o    194.6    3.8    0.0000   0.0000          ?        ?   379.2819  14.6860          ?        ?      194.6        3.8       ?       ? 
1 1 1   37   25   30 f    232.9    3.4    0.0000   0.0000          ?        ?   542.7434  15.9630          ?        ?      232.9        3.4       ?       ? 
1 1 1   37   25   31 o    249.4    3.2    0.0000   0.0000          ?        ?   622.5586  15.9630          ?        ?      249.4        3.2       ?       ? 
1 1 1   37   25   32 o    384.0    2.7    0.0000   0.0000          ?        ?  1475.6235  20.4327          ?        ?      384.0        2.7       ?       ? 
1 1 1   37   25   33 o    153.1    5.0    0.0000   0.0000          ?        ?   234.9760  15.3245          ?        ?      153.1        5.0       ?       ? 
1 1 1   37   25   34 o    217.4    3.7    0.0000   0.0000          ?        ?   473.1445  15.9630          ?        ?      217.4        3.7       ?       ? 
1 1 1   37   25   35 o    270.6    3.3    0.0000   0.0000          ?        ?   733.0228  17.8786          ?        ?      270.6        3.3       ?       ? 
1 1 1   37   25   36 o    205.3    3.9    0.0000   0.0000          ?        ?   422.0628  15.9630          ?        ?      205.3        3.9       ?       ? 
1 1 1   37   25   37 o    337.1    2.9    0.0000   0.0000          ?        ?  1137.2070  19.7942          ?        ?      337.1        2.9       ?       ? 
1 1 1   37   25   38 o     71.5   10.7    0.0000   0.0000          ?        ?    51.7203  15.3245          ?        ?       71.5       10.7       ?       ? 
1 1 1   37   25   39 f    325.5    2.8    0.0000   0.0000          ?        ?  1060.5845  18.5171          ?        ?      325.5        2.8       ?       ? 
1 1 1   37   25   40 o    263.2    3.3    0.0000   0.0000          ?        ?   693.4344  17.2401          ?        ?      263.2        3.3       ?       ? 
1 1 1   37   25   41 o    115.2    6.9    0.0000   0.0000          ?        ?   133.4510  15.9630          ?        ?      115.2        6.9       ?       ? 
1 1 1   37   25   42 o     62.5   13.7    0.0000   0.0000          ?        ?    41.5039  16.6016          ?        ?       62.5       13.7       ?       ? 
1 1 1   37   25   43 o     97.0    8.9    0.0000   0.0000          ?        ?    95.1397  17.2401          ?        ?       97.0        8.9       ?       ? 
1 1 1   37   25   44 o     33.6   14.2    0.0000   0.0000          ?        ?     1.2770  16.6016          ?        ?       33.6       14.2       ?       ? 
1 1 1   37   25   45 o     18.2    9.2    0.0000   0.0000          ?        ?   -56.8284  16.6016          ?        ?       18.2        9.2       ?       ? 
1 1 1   37   25   46 o    167.8    5.3    0.0000   0.0000          ?        ?   282.8651  17.8786          ?        ?      167.8        5.3       ?       ? 
1 1 1   37   25   47 o     33.1   14.3    0.0000   0.0000          ?        ?    -0.6385  17.2401          ?        ?       33.1       14.3       ?       ? 
1 1 1   37   25   48 o    264.9    3.5    0.0000   0.0000          ?        ?   703.6508  18.5171          ?        ?      264.9        3.5       ?       ? 
1 1 1   37   26    0 o    405.8    4.8 1648.6630  38.9498  1648.6630  38.9498  1648.6630  38.9498      405.8      4.8      405.8        4.8     0.0     0.0 
1 1 1   37   26    1 o    276.7    4.2    0.0000   0.0000          ?        ?   766.2260  22.9868          ?        ?      276.7        4.2       ?       ? 
1 1 1   37   26    2 o     77.5   12.4    0.0000   0.0000          ?        ?    60.6596  19.1556          ?        ?       77.5       12.4       ?       ? 
1 1 1   37   26    3 o    174.7    6.8    0.0000   0.0000          ?        ?   305.8519  23.6253          ?        ?      174.7        6.8       ?       ? 
1 1 1   37   26    4 o    472.9    3.4    0.0000   0.0000          ?        ?  2237.3796  31.9261          ?        ?      472.9        3.4       ?       ? 
1 1 1   37   26    5 o     74.7   11.1    0.0000   0.0000          ?        ?    56.1899  16.6016          ?        ?       74.7       11.1       ?       ? 
1 1 1   37   26    6 o     48.9   13.3    0.0000   0.0000          ?        ?    24.9023  13.4090          ?        ?       48.9       13.3       ?       ? 
1 1 1   37   26    7 o    383.2    3.5    0.0000   0.0000          ?        ?  1469.2383  26.8179          ?        ?      383.2        3.5       ?       ? 
1 1 1   37   26    8 f    393.1    3.8    0.0000   0.0000          ?        ?  1546.4994  30.0105          ?        ?      393.1        3.8       ?       ? 
1 1 1   37   26    9 o    244.4    3.9    0.0000   0.0000          ?        ?   597.6562  19.1556          ?        ?      244.4        3.9       ?       ? 
1 1 1   37   26   10 o    160.7    5.0    0.0000   0.0000          ?        ?   258.6013  15.9630          ?        ?      160.7        5.0       ?       ? 
1 1 1   37   26   11 o    260.8    2.8    0.0000   0.0000          ?        ?   680.6641  14.6860          ?        ?      260.8        2.8       ?       ? 
1 1 1   37   26   12 o     30.0   12.0    0.0000   0.0000          ?        ?     4.4697  10.8549          ?        ?       30.0       12.0       ?       ? 
1 1 1   37   26   13 o    295.8    2.5    0.0000   0.0000          ?        ?   875.4132  14.6860          ?        ?      295.8        2.5       ?       ? 
1 1 1   37   26   14 o    154.5    3.5    0.0000   0.0000          ?        ?   238.8071  10.8549          ?        ?      154.5        3.5       ?       ? 
1 1 1   37   26   15 o    306.2    2.8    0.0000   0.0000          ?        ?   937.9882  17.2401          ?        ?      306.2        2.8       ?       ? 
1 1 1   37   26   16 o    181.6    3.5    0.0000   0.0000          ?        ?   330.1157  12.7704          ?        ?      181.6        3.5       ?       ? 
1 1 1   37   26   17 f    102.8    5.9    0.0000   0.0000          ?        ?   105.9946  12.1319          ?        ?      102.8        5.9       ?       ? 
1 1 1   37   26   18 o    122.4    5.2    0.0000   0.0000          ?        ?   150.0526  12.7704          ?        ?      122.4        5.2       ?       ? 
1 1 1   37   26   19 o    445.4    2.6    0.0000   0.0000          ?        ?  1984.5251  22.9868          ?        ?      445.4        2.6       ?       ? 
1 1 1   37   26   20 o    496.2    2.6    0.0000   0.0000          ?        ?  2462.7781  26.1794          ?        ?      496.2        2.6       ?       ? 
1 1 1   37   26   21 o    135.8    4.2    0.0000   0.0000          ?        ?   184.5327  11.4934          ?        ?      135.8        4.2       ?       ? 
1 1 1   37   26   22 o    204.4    3.1    0.0000   0.0000          ?        ?   418.2317  12.7704          ?        ?      204.4        3.1       ?       ? 
1 1 1   37   26   23 o     82.5    7.4    0.0000   0.0000          ?        ?    68.3218  12.1319          ?        ?       82.5        7.4       ?       ? 
1 1 1   37   26   24 o    285.8    2.8    0.0000   0.0000          ?        ?   817.3077  15.9630          ?        ?      285.8        2.8       ?       ? 
1 1 1   37   26   25 o     23.3   10.8    0.0000   0.0000          ?        ?   -10.8549  12.1319          ?        ?       23.3       10.8       ?       ? 
1 1 1   37   26   26 o     41.0   13.8    0.0000   0.0000          ?        ?    15.9630  13.4090          ?        ?       41.0       13.8       ?       ? 
1 1 1   37   26   27 o    287.9    2.9    0.0000   0.0000          ?        ?   829.4396  16.6016          ?        ?      287.9        2.9       ?       ? 
1 1 1   37   26   28 o    401.6    2.6    0.0000   0.0000          ?        ?  1613.5442  21.0712          ?        ?      401.6        2.6       ?       ? 
1 1 1   37   26   29 o    334.5    2.8    0.0000   0.0000          ?        ?  1119.3285  18.5171          ?        ?      334.5        2.8       ?       ? 
1 1 1   37   26   30 o    144.6    5.1    0.0000   0.0000          ?        ?   209.4351  14.6860          ?        ?      144.6        5.1       ?       ? 
1 1 1   37   26   31 o    292.3    2.9    0.0000   0.0000          ?        ?   854.9804  17.2401          ?        ?      292.3        2.9       ?       ? 
1 1 1   37   26   32 o     40.1   14.7    0.0000   0.0000          ?        ?    13.4090  15.3245          ?        ?       40.1       14.7       ?       ? 
1 1 1   37   26   33 o    269.8    3.3    0.0000   0.0000          ?        ?   728.5532  17.8786          ?        ?      269.8        3.3       ?       ? 
1 1 1   37   26   34 o    221.9    3.6    0.0000   0.0000          ?        ?   492.9387  15.9630          ?        ?      221.9        3.6       ?       ? 
1 1 1   37   26   35 o    282.8    3.2    0.0000   0.0000          ?        ?   800.7061  17.8786          ?        ?      282.8        3.2       ?       ? 
1 1 1   37   26   36 o    269.3    3.3    0.0000   0.0000          ?        ?   725.9991  17.8786          ?        ?      269.3        3.3       ?       ? 
1 1 1   37   26   37 o     40.4   14.9    0.0000   0.0000          ?        ?    13.4090  15.9630          ?        ?       40.4       14.9       ?       ? 
1 1 1   37   26   38 o    126.5    6.3    0.0000   0.0000          ?        ?   160.9075  15.9630          ?        ?      126.5        6.3       ?       ? 
1 1 1   37   26   39 o    162.5    5.1    0.0000   0.0000          ?        ?   264.9865  16.6016          ?        ?      162.5        5.1       ?       ? 
1 1 1   37   26   40 o     19.9   10.0    0.0000   0.0000          ?        ?   -45.3350  16.6016          ?        ?       19.9       10.0       ?       ? 
1 1 1   37   26   41 o     76.8   10.8    0.0000   0.0000          ?        ?    60.0210  16.6016          ?        ?       76.8       10.8       ?       ? 
1 1 1   37   26   42 o    124.4    6.9    0.0000   0.0000          ?        ?   155.7993  17.2401          ?        ?      124.4        6.9       ?       ? 
1 1 1   37   26   43 o    207.2    4.2    0.0000   0.0000          ?        ?   430.3636  17.2401          ?        ?      207.2        4.2       ?       ? 
1 1 1   37   26   44 o    112.8    7.4    0.0000   0.0000          ?        ?   128.3428  16.6016          ?        ?      112.8        7.4       ?       ? 
1 1 1   37   26   45 o    142.9    6.0    0.0000   0.0000          ?        ?   205.6040  17.2401          ?        ?      142.9        6.0       ?       ? 
1 1 1   37   26   46 o    116.5    7.4    0.0000   0.0000          ?        ?   137.2822  17.2401          ?        ?      116.5        7.4       ?       ? 
1 1 1   37   27    0 o    234.7    6.8  552.9597  31.9261   552.9597  31.9261   552.9597  31.9261      234.7      6.8      234.7        6.8     0.0     0.0 
1 1 1   37   27    1 o     73.1   15.3    0.0000   0.0000          ?        ?    56.1899  21.7097          ?        ?       73.1       15.3       ?       ? 
1 1 1   37   27    2 o     36.2   16.3    0.0000   0.0000          ?        ?   -12.1319  24.9023          ?        ?       36.2       16.3       ?       ? 
1 1 1   37   27    3 o     25.7   12.8    0.0000   0.0000          ?        ?   -74.7070  27.4564          ?        ?       25.7       12.8       ?       ? 
1 1 1   37   27    4 o    113.4   12.1    0.0000   0.0000          ?        ?   129.6199  27.4564          ?        ?      113.4       12.1       ?       ? 
1 1 1   37   27    5 o    228.6    4.1    0.0000   0.0000          ?        ?   522.9492  18.5171          ?        ?      228.6        4.1       ?       ? 
1 1 1   37   27    6 o    290.8    3.8    0.0000   0.0000          ?        ?   846.6797  22.3483          ?        ?      290.8        3.8       ?       ? 
1 1 1   37   27    7 o    113.1    7.1    0.0000   0.0000          ?        ?   128.3428  15.9630          ?        ?      113.1        7.1       ?       ? 
1 1 1   37   27    8 o    120.3    5.6    0.0000   0.0000          ?        ?   144.9444  13.4090          ?        ?      120.3        5.6       ?       ? 
1 1 1   37   27    9 o    123.9    5.9    0.0000   0.0000          ?        ?   153.8837  14.6860          ?        ?      123.9        5.9       ?       ? 
1 1 1   37   27   10 o    270.4    3.9    0.0000   0.0000          ?        ?   731.7458  21.0712          ?        ?      270.4        3.9       ?       ? 
1 1 1   37   27   11 o    567.3    4.6    0.0000   0.0000          ?        ?  3221.9802  51.7203          ?        ?      567.3        4.6       ?       ? 
1 1 1   37   27   12 o    249.7    3.5    0.0000   0.0000          ?        ?   623.8356  17.2401          ?        ?      249.7        3.5       ?       ? 
1 1 1   37   27   13 o    271.7    2.8    0.0000   0.0000          ?        ?   738.7695  15.3245          ?        ?      271.7        2.8       ?       ? 
1 1 1   37   27   14 o     57.5    8.3    0.0000   0.0000          ?        ?    33.2031   9.5778          ?        ?       57.5        8.3       ?       ? 
1 1 1   37   27   15 o     17.5    8.6    0.0000   0.0000          ?        ?   -20.4327  10.2163          ?        ?       17.5        8.6       ?       ? 
1 1 1   37   27   16 o    294.9    2.8    0.0000   0.0000          ?        ?   870.3050  16.6016          ?        ?      294.9        2.8       ?       ? 
1 1 1   37   27   17 o    345.5    2.7    0.0000   0.0000          ?        ?  1194.0354  18.5171          ?        ?      345.5        2.7       ?       ? 
1 1 1   37   27   18 o    291.7    2.8    0.0000   0.0000          ?        ?   851.1494  16.6016          ?        ?      291.7        2.8       ?       ? 
1 1 1   37   27   19 o    229.8    3.3    0.0000   0.0000          ?        ?   528.6959  15.3245          ?        ?      229.8        3.3       ?       ? 
1 1 1   37   27   20 o     16.6    8.2    0.0000   0.0000          ?        ?   -20.4327   9.5778          ?        ?       16.6        8.2       ?       ? 
1 1 1   37   27   21 o     34.0   12.9    0.0000   0.0000          ?        ?     8.3008  12.1319          ?        ?       34.0       12.9       ?       ? 
1 1 1   37   27   22 o    202.9    3.1    0.0000   0.0000          ?        ?   411.8464  12.7704          ?        ?      202.9        3.1       ?       ? 
1 1 1   37   27   23 o    267.6    2.7    0.0000   0.0000          ?        ?   716.4213  14.6860          ?        ?      267.6        2.7       ?       ? 
1 1 1   37   27   24 o    195.2    3.3    0.0000   0.0000          ?        ?   381.1974  12.7704          ?        ?      195.2        3.3       ?       ? 
1 1 1   37   27   25 o    187.5    3.4    0.0000   0.0000          ?        ?   351.8254  12.7704          ?        ?      187.5        3.4       ?       ? 
1 1 1   37   27   26 o    223.1    3.1    0.0000   0.0000          ?        ?   498.0469  14.0475          ?        ?      223.1        3.1       ?       ? 
1 1 1   37   27   27 o    121.3    5.5    0.0000   0.0000          ?        ?   147.4985  13.4090          ?        ?      121.3        5.5       ?       ? 
1 1 1   37   27   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   27   29 o     19.4    9.5    0.0000   0.0000          ?        ?   -26.1794  12.7704          ?        ?       19.4        9.5       ?       ? 
1 1 1   37   27   30 o    150.4    4.9    0.0000   0.0000          ?        ?   226.6752  14.6860          ?        ?      150.4        4.9       ?       ? 
1 1 1   37   27   31 f    198.8    4.0    0.0000   0.0000          ?        ?   395.8834  15.9630          ?        ?      198.8        4.0       ?       ? 
1 1 1   37   27   32 o    306.4    2.9    0.0000   0.0000          ?        ?   939.9038  17.8786          ?        ?      306.4        2.9       ?       ? 
1 1 1   37   27   33 o    131.6    5.8    0.0000   0.0000          ?        ?   173.6779  15.3245          ?        ?      131.6        5.8       ?       ? 
1 1 1   37   27   34 o    118.5    6.5    0.0000   0.0000          ?        ?   141.1133  15.3245          ?        ?      118.5        6.5       ?       ? 
1 1 1   37   27   35 o    300.2    3.0    0.0000   0.0000          ?        ?   902.2311  17.8786          ?        ?      300.2        3.0       ?       ? 
1 1 1   37   27   36 o     85.7    8.9    0.0000   0.0000          ?        ?    74.0685  15.3245          ?        ?       85.7        8.9       ?       ? 
1 1 1   37   27   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   27   38 o     51.6   14.7    0.0000   0.0000          ?        ?    28.0950  15.9630          ?        ?       51.6       14.7       ?       ? 
1 1 1   37   27   39 o     71.3   11.2    0.0000   0.0000          ?        ?    51.7203  15.9630          ?        ?       71.3       11.2       ?       ? 
1 1 1   37   27   40 o    152.3    5.4    0.0000   0.0000          ?        ?   233.0604  16.6016          ?        ?      152.3        5.4       ?       ? 
1 1 1   37   27   41 f     20.3   10.1    0.0000   0.0000          ?        ?   -38.9498  15.9630          ?        ?       20.3       10.1       ?       ? 
1 1 1   37   27   42 o    229.8    3.6    0.0000   0.0000          ?        ?   529.3344  16.6016          ?        ?      229.8        3.6       ?       ? 
1 1 1   37   27   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   27   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   27   45 o     26.0   12.2    0.0000   0.0000          ?        ?   -15.3245  15.9630          ?        ?       26.0       12.2       ?       ? 
1 1 1   37   28    0 o     68.3   29.9   68.3218  42.1424    68.3218  42.1424    68.3218  42.1424       68.3     29.9       68.3       29.9     0.0     0.0 
1 1 1   37   28    1 o    280.7    5.9    0.0000   0.0000          ?        ?   789.8513  33.2031          ?        ?      280.7        5.9       ?       ? 
1 1 1   37   28    2 o    183.6    6.4    0.0000   0.0000          ?        ?   337.7780  23.6253          ?        ?      183.6        6.4       ?       ? 
1 1 1   37   28    3 o    190.9    6.0    0.0000   0.0000          ?        ?   365.2344  22.9868          ?        ?      190.9        6.0       ?       ? 
1 1 1   37   28    4 o    171.1    7.5    0.0000   0.0000          ?        ?   293.7199  25.5409          ?        ?      171.1        7.5       ?       ? 
1 1 1   37   28    5 o    206.1    6.4    0.0000   0.0000          ?        ?   425.8939  26.1794          ?        ?      206.1        6.4       ?       ? 
1 1 1   37   28    6 o    151.5    7.8    0.0000   0.0000          ?        ?   230.5063  23.6253          ?        ?      151.5        7.8       ?       ? 
1 1 1   37   28    7 o    162.4    9.0    0.0000   0.0000          ?        ?   264.9865  29.3720          ?        ?      162.4        9.0       ?       ? 
1 1 1   37   28    8 o    263.9    3.9    0.0000   0.0000          ?        ?   697.2656  20.4327          ?        ?      263.9        3.9       ?       ? 
1 1 1   37   28    9 o    216.7    4.1    0.0000   0.0000          ?        ?   469.9519  17.8786          ?        ?      216.7        4.1       ?       ? 
1 1 1   37   28   10 f    125.4    6.4    0.0000   0.0000          ?        ?   157.7148  15.9630          ?        ?      125.4        6.4       ?       ? 
1 1 1   37   28   11 o    438.4    4.5    0.0000   0.0000          ?        ?  1924.5042  39.5883          ?        ?      438.4        4.5       ?       ? 
1 1 1   37   28   12 o    229.1    4.5    0.0000   0.0000          ?        ?   525.5033  20.4327          ?        ?      229.1        4.5       ?       ? 
1 1 1   37   28   13 o    242.2    4.3    0.0000   0.0000          ?        ?   587.4399  21.0712          ?        ?      242.2        4.3       ?       ? 
1 1 1   37   28   14 o    150.9    3.0    0.0000   0.0000          ?        ?   227.9522   8.9393          ?        ?      150.9        3.0       ?       ? 
1 1 1   37   28   15 o    320.3    2.7    0.0000   0.0000          ?        ?  1026.7428  17.2401          ?        ?      320.3        2.7       ?       ? 
1 1 1   37   28   16 o    267.7    3.1    0.0000   0.0000          ?        ?   717.0598  16.6016          ?        ?      267.7        3.1       ?       ? 
1 1 1   37   28   17 o    227.1    3.2    0.0000   0.0000          ?        ?   515.9255  14.6860          ?        ?      227.1        3.2       ?       ? 
1 1 1   37   28   18 o    236.0    3.1    0.0000   0.0000          ?        ?   557.4294  14.6860          ?        ?      236.0        3.1       ?       ? 
1 1 1   37   28   19 o    316.8    2.8    0.0000   0.0000          ?        ?  1004.3945  17.8786          ?        ?      316.8        2.8       ?       ? 
1 1 1   37   28   20 o     22.1    9.9    0.0000   0.0000          ?        ?    -3.8311   8.9393          ?        ?       22.1        9.9       ?       ? 
1 1 1   37   28   21 o     81.3    6.7    0.0000   0.0000          ?        ?    66.4062  10.8549          ?        ?       81.3        6.7       ?       ? 
1 1 1   37   28   22 o    458.1    2.6    0.0000   0.0000          ?        ?  2100.0977  23.6253          ?        ?      458.1        2.6       ?       ? 
1 1 1   37   28   23 o    128.0    4.7    0.0000   0.0000          ?        ?   164.1001  12.1319          ?        ?      128.0        4.7       ?       ? 
1 1 1   37   28   24 o    184.9    3.3    0.0000   0.0000          ?        ?   342.2476  12.1319          ?        ?      184.9        3.3       ?       ? 
1 1 1   37   28   25 o    140.3    4.5    0.0000   0.0000          ?        ?   197.3032  12.7704          ?        ?      140.3        4.5       ?       ? 
1 1 1   37   28   26 o     62.1   10.3    0.0000   0.0000          ?        ?    38.9498  12.7704          ?        ?       62.1       10.3       ?       ? 
1 1 1   37   28   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   28   28 o    140.5    4.8    0.0000   0.0000          ?        ?   197.9417  13.4090          ?        ?      140.5        4.8       ?       ? 
1 1 1   37   28   29 o    240.1    3.2    0.0000   0.0000          ?        ?   577.2236  15.3245          ?        ?      240.1        3.2       ?       ? 
1 1 1   37   28   30 o    230.6    3.3    0.0000   0.0000          ?        ?   532.5270  15.3245          ?        ?      230.6        3.3       ?       ? 
1 1 1   37   28   31 o     20.1    9.9    0.0000   0.0000          ?        ?   -33.2031  14.6860          ?        ?       20.1        9.9       ?       ? 
1 1 1   37   28   32 o     29.5   12.8    0.0000   0.0000          ?        ?    -1.9156  14.0475          ?        ?       29.5       12.8       ?       ? 
1 1 1   37   28   33 o    108.4    7.1    0.0000   0.0000          ?        ?   118.1265  15.3245          ?        ?      108.4        7.1       ?       ? 
1 1 1   37   28   34 o     59.7   12.7    0.0000   0.0000          ?        ?    37.6728  14.6860          ?        ?       59.7       12.7       ?       ? 
1 1 1   37   28   35 o    125.0    6.1    0.0000   0.0000          ?        ?   157.0763  15.3245          ?        ?      125.0        6.1       ?       ? 
1 1 1   37   28   36 o    126.5    6.6    0.0000   0.0000          ?        ?   160.9075  16.6016          ?        ?      126.5        6.6       ?       ? 
1 1 1   37   28   37 o    225.5    3.7    0.0000   0.0000          ?        ?   509.5403  16.6016          ?        ?      225.5        3.7       ?       ? 
1 1 1   37   28   38 o     78.0   11.1    0.0000   0.0000          ?        ?    61.9366  17.2401          ?        ?       78.0       11.1       ?       ? 
1 1 1   37   28   39 o    173.1    4.6    0.0000   0.0000          ?        ?   300.7437  15.9630          ?        ?      173.1        4.6       ?       ? 
1 1 1   37   28   40 o    289.3    3.2    0.0000   0.0000          ?        ?   838.3789  18.5171          ?        ?      289.3        3.2       ?       ? 
1 1 1   37   28   41 o    118.0    6.8    0.0000   0.0000          ?        ?   140.4748  15.9630          ?        ?      118.0        6.8       ?       ? 
1 1 1   37   28   42 o    186.5    4.4    0.0000   0.0000          ?        ?   349.2713  16.6016          ?        ?      186.5        4.4       ?       ? 
1 1 1   37   28   43 o     23.6   11.3    0.0000   0.0000          ?        ?   -21.0712  15.3245          ?        ?       23.6       11.3       ?       ? 
1 1 1   37   29    0 o     43.7   26.7   19.1556  43.4195    19.1556  43.4195    19.1556  43.4195       43.7     26.7       43.7       26.7     0.0     0.0 
1 1 1   37   29    1 o     34.0   16.4    0.0000   0.0000          ?        ?   -47.2506  32.5646          ?        ?       34.0       16.4       ?       ? 
1 1 1   37   29    2 o     88.0   19.7    0.0000   0.0000          ?        ?    82.3693  33.8416          ?        ?       88.0       19.7       ?       ? 
1 1 1   37   29    3 o     70.3   16.6    0.0000   0.0000          ?        ?    52.3588  22.9868          ?        ?       70.3       16.6       ?       ? 
1 1 1   37   29    4 f    169.6    7.0    0.0000   0.0000          ?        ?   288.6118  23.6253          ?        ?      169.6        7.0       ?       ? 
1 1 1   37   29    5 f    257.6    5.5    0.0000   0.0000          ?        ?   664.7010  28.0950          ?        ?      257.6        5.5       ?       ? 
1 1 1   37   29    6 o    244.1    5.4    0.0000   0.0000          ?        ?   597.0177  26.1794          ?        ?      244.1        5.4       ?       ? 
1 1 1   37   29    7 o    151.5    7.8    0.0000   0.0000          ?        ?   230.5063  23.6253          ?        ?      151.5        7.8       ?       ? 
1 1 1   37   29    8 o    195.0    6.4    0.0000   0.0000          ?        ?   381.1974  24.9023          ?        ?      195.0        6.4       ?       ? 
1 1 1   37   29    9 o    328.9    4.2    0.0000   0.0000          ?        ?  1082.9327  27.4564          ?        ?      328.9        4.2       ?       ? 
1 1 1   37   29   10 o    211.8    3.3    0.0000   0.0000          ?        ?   448.8807  14.0475          ?        ?      211.8        3.3       ?       ? 
1 1 1   37   29   11 o    183.1    4.5    0.0000   0.0000          ?        ?   335.8624  16.6016          ?        ?      183.1        4.5       ?       ? 
1 1 1   37   29   12 o    195.5    5.4    0.0000   0.0000          ?        ?   383.1130  21.0712          ?        ?      195.5        5.4       ?       ? 
1 1 1   37   29   13 o    240.7    4.5    0.0000   0.0000          ?        ?   580.4161  21.7097          ?        ?      240.7        4.5       ?       ? 
1 1 1   37   29   14 o     18.1    9.1    0.0000   0.0000          ?        ?   -49.1662  15.3245          ?        ?       18.1        9.1       ?       ? 
1 1 1   37   29   15 o    153.6    4.6    0.0000   0.0000          ?        ?   236.2530  14.0475          ?        ?      153.6        4.6       ?       ? 
1 1 1   37   29   16 o    327.1    2.9    0.0000   0.0000          ?        ?  1070.8008  19.1556          ?        ?      327.1        2.9       ?       ? 
1 1 1   37   29   17 o    288.1    2.9    0.0000   0.0000          ?        ?   830.7167  16.6016          ?        ?      288.1        2.9       ?       ? 
1 1 1   37   29   18 o    423.8    2.8    0.0000   0.0000          ?        ?  1797.4384  23.6253          ?        ?      423.8        2.8       ?       ? 
1 1 1   37   29   19 o    139.0    4.8    0.0000   0.0000          ?        ?   193.4720  13.4090          ?        ?      139.0        4.8       ?       ? 
1 1 1   37   29   20 o    130.7    5.4    0.0000   0.0000          ?        ?   171.1238  14.0475          ?        ?      130.7        5.4       ?       ? 
1 1 1   37   29   21 o    390.8    2.5    0.0000   0.0000          ?        ?  1527.9823  19.1556          ?        ?      390.8        2.5       ?       ? 
1 1 1   37   29   22 o    260.0    2.7    0.0000   0.0000          ?        ?   676.1944  14.0475          ?        ?      260.0        2.7       ?       ? 
1 1 1   37   29   23 o    300.5    2.7    0.0000   0.0000          ?        ?   903.5081  15.9630          ?        ?      300.5        2.7       ?       ? 
1 1 1   37   29   24 o    229.0    2.9    0.0000   0.0000          ?        ?   524.8647  13.4090          ?        ?      229.0        2.9       ?       ? 
1 1 1   37   29   25 o    284.9    2.7    0.0000   0.0000          ?        ?   812.1995  15.3245          ?        ?      284.9        2.7       ?       ? 
1 1 1   37   29   26 o    341.5    2.5    0.0000   0.0000          ?        ?  1167.2175  17.2401          ?        ?      341.5        2.5       ?       ? 
1 1 1   37   29   27 o    309.0    2.7    0.0000   0.0000          ?        ?   955.2284  16.6016          ?        ?      309.0        2.7       ?       ? 
1 1 1   37   29   28 o     32.9   13.2    0.0000   0.0000          ?        ?     5.1082  13.4090          ?        ?       32.9       13.2       ?       ? 
1 1 1   37   29   29 o    173.6    4.2    0.0000   0.0000          ?        ?   302.0207  14.6860          ?        ?      173.6        4.2       ?       ? 
1 1 1   37   29   30 o    293.2    2.9    0.0000   0.0000          ?        ?   860.7272  17.2401          ?        ?      293.2        2.9       ?       ? 
1 1 1   37   29   31 o     58.8   11.8    0.0000   0.0000          ?        ?    36.3957  13.4090          ?        ?       58.8       11.8       ?       ? 
1 1 1   37   29   32 o     35.1   13.8    0.0000   0.0000          ?        ?     7.6623  14.0475          ?        ?       35.1       13.8       ?       ? 
1 1 1   37   29   33 o    122.2    6.3    0.0000   0.0000          ?        ?   150.0526  15.3245          ?        ?      122.2        6.3       ?       ? 
1 1 1   37   29   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   29   35 o     36.5   14.4    0.0000   0.0000          ?        ?     8.3008  15.3245          ?        ?       36.5       14.4       ?       ? 
1 1 1   37   29   36 o    102.8    7.8    0.0000   0.0000          ?        ?   106.6331  15.9630          ?        ?      102.8        7.8       ?       ? 
1 1 1   37   29   37 f    137.6    5.6    0.0000   0.0000          ?        ?   190.2794  15.3245          ?        ?      137.6        5.6       ?       ? 
1 1 1   37   29   38 o    122.6    6.5    0.0000   0.0000          ?        ?   151.3296  15.9630          ?        ?      122.6        6.5       ?       ? 
1 1 1   37   29   39 o    168.6    4.7    0.0000   0.0000          ?        ?   285.4192  15.9630          ?        ?      168.6        4.7       ?       ? 
1 1 1   37   29   40 o     85.0    9.0    0.0000   0.0000          ?        ?    73.4300  15.3245          ?        ?       85.0        9.0       ?       ? 
1 1 1   37   29   41 o     29.8   13.1    0.0000   0.0000          ?        ?    -3.8311  15.3245          ?        ?       29.8       13.1       ?       ? 
1 1 1   37   29   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   30    0 f    397.4    7.3 1584.1722  58.1055  1584.1722  58.1055  1584.1722  58.1055      397.4      7.3      397.4        7.3     0.0     0.0 
1 1 1   37   30    1 o    252.3    5.2    0.0000   0.0000          ?        ?   637.8831  26.1794          ?        ?      252.3        5.2       ?       ? 
1 1 1   37   30    2 o    102.0   13.5    0.0000   0.0000          ?        ?   105.3561  27.4564          ?        ?      102.0       13.5       ?       ? 
1 1 1   37   30    3 o    191.2   10.4    0.0000   0.0000          ?        ?   368.4270  39.5883          ?        ?      191.2       10.4       ?       ? 
1 1 1   37   30    4 o    316.2    6.9    0.0000   0.0000          ?        ?  1003.1175  43.4195          ?        ?      316.2        6.9       ?       ? 
1 1 1   37   30    5 o    267.9    6.1    0.0000   0.0000          ?        ?   719.6138  32.5646          ?        ?      267.9        6.1       ?       ? 
1 1 1   37   30    6 o    402.4    5.0    0.0000   0.0000          ?        ?  1622.4835  40.2269          ?        ?      402.4        5.0       ?       ? 
1 1 1   37   30    7 o    226.5    6.3    0.0000   0.0000          ?        ?   514.6484  28.7335          ?        ?      226.5        6.3       ?       ? 
1 1 1   37   30    8 o    204.7    6.4    0.0000   0.0000          ?        ?   420.1472  26.1794          ?        ?      204.7        6.4       ?       ? 
1 1 1   37   30    9 o    248.1    8.1    0.0000   0.0000          ?        ?   618.7275  40.2269          ?        ?      248.1        8.1       ?       ? 
1 1 1   37   30   10 o    104.3    7.0    0.0000   0.0000          ?        ?   109.1872  14.6860          ?        ?      104.3        7.0       ?       ? 
1 1 1   37   30   11 o    299.9    3.8    0.0000   0.0000          ?        ?   900.3155  22.9868          ?        ?      299.9        3.8       ?       ? 
1 1 1   37   30   12 o    543.8    4.1    0.0000   0.0000          ?        ?  2961.4631  44.6965          ?        ?      543.8        4.1       ?       ? 
1 1 1   37   30   13 o    230.0    4.9    0.0000   0.0000          ?        ?   529.9730  22.3483          ?        ?      230.0        4.9       ?       ? 
1 1 1   37   30   14 o    312.6    4.7    0.0000   0.0000          ?        ?   978.8537  29.3720          ?        ?      312.6        4.7       ?       ? 
1 1 1   37   30   15 o    111.7    6.0    0.0000   0.0000          ?        ?   125.1502  13.4090          ?        ?      111.7        6.0       ?       ? 
1 1 1   37   30   16 o    262.8    3.8    0.0000   0.0000          ?        ?   691.5189  19.7942          ?        ?      262.8        3.8       ?       ? 
1 1 1   37   30   17 o    615.4    3.4    0.0000   0.0000          ?        ?  3790.9031  41.5039          ?        ?      615.4        3.4       ?       ? 
1 1 1   37   30   18 o    204.6    3.4    0.0000   0.0000          ?        ?   418.8702  14.0475          ?        ?      204.6        3.4       ?       ? 
1 1 1   37   30   19 o    298.5    3.0    0.0000   0.0000          ?        ?   892.0147  17.8786          ?        ?      298.5        3.0       ?       ? 
1 1 1   37   30   20 o    199.5    3.5    0.0000   0.0000          ?        ?   398.4375  14.0475          ?        ?      199.5        3.5       ?       ? 
1 1 1   37   30   21 o     63.3    7.1    0.0000   0.0000          ?        ?    40.2269   8.9393          ?        ?       63.3        7.1       ?       ? 
1 1 1   37   30   22 o    133.8    4.1    0.0000   0.0000          ?        ?   179.4246  10.8549          ?        ?      133.8        4.1       ?       ? 
1 1 1   37   30   23 o    283.9    2.6    0.0000   0.0000          ?        ?   806.4528  14.6860          ?        ?      283.9        2.6       ?       ? 
1 1 1   37   30   24 o    104.9    5.5    0.0000   0.0000          ?        ?   110.4642  11.4934          ?        ?      104.9        5.5       ?       ? 
1 1 1   37   30   25 o    141.7    4.3    0.0000   0.0000          ?        ?   201.1343  12.1319          ?        ?      141.7        4.3       ?       ? 
1 1 1   37   30   26 o    161.9    3.9    0.0000   0.0000          ?        ?   262.4324  12.7704          ?        ?      161.9        3.9       ?       ? 
1 1 1   37   30   27 o     78.4    8.1    0.0000   0.0000          ?        ?    61.9366  12.7704          ?        ?       78.4        8.1       ?       ? 
1 1 1   37   30   28 o    196.4    3.6    0.0000   0.0000          ?        ?   386.3056  14.0475          ?        ?      196.4        3.6       ?       ? 
1 1 1   37   30   29 o    249.2    3.1    0.0000   0.0000          ?        ?   621.9200  15.3245          ?        ?      249.2        3.1       ?       ? 
1 1 1   37   30   30 o     39.8   13.8    0.0000   0.0000          ?        ?    14.6860  13.4090          ?        ?       39.8       13.8       ?       ? 
1 1 1   37   30   31 o    250.6    3.2    0.0000   0.0000          ?        ?   628.9438  15.9630          ?        ?      250.6        3.2       ?       ? 
1 1 1   37   30   32 o    190.2    4.0    0.0000   0.0000          ?        ?   362.6803  15.3245          ?        ?      190.2        4.0       ?       ? 
1 1 1   37   30   33 o     72.7   10.1    0.0000   0.0000          ?        ?    53.6358  14.6860          ?        ?       72.7       10.1       ?       ? 
1 1 1   37   30   34 o    232.1    3.3    0.0000   0.0000          ?        ?   539.5508  15.3245          ?        ?      232.1        3.3       ?       ? 
1 1 1   37   30   35 o    164.1    4.5    0.0000   0.0000          ?        ?   270.0946  14.6860          ?        ?      164.1        4.5       ?       ? 
1 1 1   37   30   36 o    160.7    4.6    0.0000   0.0000          ?        ?   259.2398  14.6860          ?        ?      160.7        4.6       ?       ? 
1 1 1   37   30   37 o     48.7   14.6    0.0000   0.0000          ?        ?    24.9023  15.3245          ?        ?       48.7       14.6       ?       ? 
1 1 1   37   30   38 o    161.4    4.9    0.0000   0.0000          ?        ?   261.7939  15.9630          ?        ?      161.4        4.9       ?       ? 
1 1 1   37   30   39 o    157.6    5.1    0.0000   0.0000          ?        ?   249.6619  15.9630          ?        ?      157.6        5.1       ?       ? 
1 1 1   37   30   40 o     50.1   14.5    0.0000   0.0000          ?        ?    26.8179  15.3245          ?        ?       50.1       14.5       ?       ? 
1 1 1   37   31    0 o    247.2    8.5  614.8964  42.1424   614.8964  42.1424   614.8964  42.1424      247.2      8.5      247.2        8.5     0.0     0.0 
1 1 1   37   31    1 o    223.7    5.9    0.0000   0.0000          ?        ?   501.8780  26.1794          ?        ?      223.7        5.9       ?       ? 
1 1 1   37   31    2 o    233.1    6.4    0.0000   0.0000          ?        ?   545.2975  30.0105          ?        ?      233.1        6.4       ?       ? 
1 1 1   37   31    3 o    253.4    5.5    0.0000   0.0000          ?        ?   643.6298  28.0950          ?        ?      253.4        5.5       ?       ? 
1 1 1   37   31    4 o     97.2   16.1    0.0000   0.0000          ?        ?    96.4168  31.2876          ?        ?       97.2       16.1       ?       ? 
1 1 1   37   31    5 o    236.4    9.0    0.0000   0.0000          ?        ?   562.5375  42.7809          ?        ?      236.4        9.0       ?       ? 
1 1 1   37   31    6 o    266.5    6.3    0.0000   0.0000          ?        ?   712.5901  33.8416          ?        ?      266.5        6.3       ?       ? 
1 1 1   37   31    7 o     91.7   18.8    0.0000   0.0000          ?        ?    89.3930  33.2031          ?        ?       91.7       18.8       ?       ? 
1 1 1   37   31    8 o    176.5    8.9    0.0000   0.0000          ?        ?   313.5141  31.2876          ?        ?      176.5        8.9       ?       ? 
1 1 1   37   31    9 o    347.6    5.5    0.0000   0.0000          ?        ?  1211.2755  38.3113          ?        ?      347.6        5.5       ?       ? 
1 1 1   37   31   10 o    162.6   14.1    0.0000   0.0000          ?        ?   268.8176  45.9736          ?        ?      162.6       14.1       ?       ? 
1 1 1   37   31   11 o    323.4    6.0    0.0000   0.0000          ?        ?  1049.0911  38.9498          ?        ?      323.4        6.0       ?       ? 
1 1 1   37   31   12 o     70.3    9.5    0.0000   0.0000          ?        ?    49.8047  13.4090          ?        ?       70.3        9.5       ?       ? 
1 1 1   37   31   13 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   31   14 o    214.1    4.6    0.0000   0.0000          ?        ?   459.0970  19.7942          ?        ?      214.1        4.6       ?       ? 
1 1 1   37   31   15 o    179.4    3.9    0.0000   0.0000          ?        ?   322.4534  14.0475          ?        ?      179.4        3.9       ?       ? 
1 1 1   37   31   16 o    310.0    3.3    0.0000   0.0000          ?        ?   962.2521  20.4327          ?        ?      310.0        3.3       ?       ? 
1 1 1   37   31   17 o    286.6    3.5    0.0000   0.0000          ?        ?   822.4159  19.7942          ?        ?      286.6        3.5       ?       ? 
1 1 1   37   31   18 o    436.9    2.8    0.0000   0.0000          ?        ?  1909.8182  24.2638          ?        ?      436.9        2.8       ?       ? 
1 1 1   37   31   19 o    188.7    3.4    0.0000   0.0000          ?        ?   356.2951  12.7704          ?        ?      188.7        3.4       ?       ? 
1 1 1   37   31   20 o    258.4    3.1    0.0000   0.0000          ?        ?   668.5321  15.9630          ?        ?      258.4        3.1       ?       ? 
1 1 1   37   31   21 o    357.6    2.9    0.0000   0.0000          ?        ?  1279.5973  20.4327          ?        ?      357.6        2.9       ?       ? 
1 1 1   37   31   22 o    258.2    2.6    0.0000   0.0000          ?        ?   667.2551  13.4090          ?        ?      258.2        2.6       ?       ? 
1 1 1   37   31   23 o    221.2    2.9    0.0000   0.0000          ?        ?   489.7461  12.7704          ?        ?      221.2        2.9       ?       ? 
1 1 1   37   31   24 f    560.3    2.8    0.0000   0.0000          ?        ?  3142.1650  31.2876          ?        ?      560.3        2.8       ?       ? 
1 1 1   37   31   25 o    249.0    2.9    0.0000   0.0000          ?        ?   620.6430  14.6860          ?        ?      249.0        2.9       ?       ? 
1 1 1   37   31   26 o    203.4    3.5    0.0000   0.0000          ?        ?   414.4005  14.0475          ?        ?      203.4        3.5       ?       ? 
1 1 1   37   31   27 f     22.8   10.7    0.0000   0.0000          ?        ?   -14.0475  12.7704          ?        ?       22.8       10.7       ?       ? 
1 1 1   37   31   28 f     24.2   11.2    0.0000   0.0000          ?        ?   -10.2163  12.7704          ?        ?       24.2       11.2       ?       ? 
1 1 1   37   31   29 o    133.9    5.2    0.0000   0.0000          ?        ?   180.0631  14.0475          ?        ?      133.9        5.2       ?       ? 
1 1 1   37   31   30 o    277.0    2.9    0.0000   0.0000          ?        ?   768.1415  15.9630          ?        ?      277.0        2.9       ?       ? 
1 1 1   37   31   31 o    140.4    5.0    0.0000   0.0000          ?        ?   197.9417  14.0475          ?        ?      140.4        5.0       ?       ? 
1 1 1   37   31   32 o     58.6   12.4    0.0000   0.0000          ?        ?    36.3957  14.0475          ?        ?       58.6       12.4       ?       ? 
1 1 1   37   31   33 o    192.4    4.0    0.0000   0.0000          ?        ?   370.9810  15.3245          ?        ?      192.4        4.0       ?       ? 
1 1 1   37   31   34 o     43.6   14.1    0.0000   0.0000          ?        ?    19.1556  14.0475          ?        ?       43.6       14.1       ?       ? 
1 1 1   37   31   35 o     20.7   10.2    0.0000   0.0000          ?        ?   -30.0105  14.6860          ?        ?       20.7       10.2       ?       ? 
1 1 1   37   31   36 o     26.2   12.1    0.0000   0.0000          ?        ?   -10.8549  14.6860          ?        ?       26.2       12.1       ?       ? 
1 1 1   37   31   37 o     73.3   10.5    0.0000   0.0000          ?        ?    54.9129  15.3245          ?        ?       73.3       10.5       ?       ? 
1 1 1   37   31   38 o     62.5   12.2    0.0000   0.0000          ?        ?    41.5039  14.6860          ?        ?       62.5       12.2       ?       ? 
1 1 1   37   32    0 o     63.1   30.2   60.6596  43.4195    60.6596  43.4195    60.6596  43.4195       63.1     30.2       63.1       30.2     0.0     0.0 
1 1 1   37   32    1 o    267.3    6.8    0.0000   0.0000          ?        ?   717.0598  36.3957          ?        ?      267.3        6.8       ?       ? 
1 1 1   37   32    2 o    188.2    8.7    0.0000   0.0000          ?        ?   356.2951  32.5646          ?        ?      188.2        8.7       ?       ? 
1 1 1   37   32    3 o    304.2    6.1    0.0000   0.0000          ?        ?   928.4104  37.0343          ?        ?      304.2        6.1       ?       ? 
1 1 1   37   32    4 f    202.2    7.1    0.0000   0.0000          ?        ?   410.5694  28.7335          ?        ?      202.2        7.1       ?       ? 
1 1 1   37   32    5 o    239.9   10.6    0.0000   0.0000          ?        ?   581.0547  51.0817          ?        ?      239.9       10.6       ?       ? 
1 1 1   37   32    6 o     52.4   23.2    0.0000   0.0000          ?        ?   -12.7704  48.5276          ?        ?       52.4       23.2       ?       ? 
1 1 1   37   32    7 o    136.2   11.5    0.0000   0.0000          ?        ?   187.7254  31.2876          ?        ?      136.2       11.5       ?       ? 
1 1 1   37   32    8 o    220.1    6.8    0.0000   0.0000          ?        ?   486.5535  30.0105          ?        ?      220.1        6.8       ?       ? 
1 1 1   37   32    9 o    223.9    8.6    0.0000   0.0000          ?        ?   504.4321  38.3113          ?        ?      223.9        8.6       ?       ? 
1 1 1   37   32   10 o    101.6   15.1    0.0000   0.0000          ?        ?   105.3561  30.6490          ?        ?      101.6       15.1       ?       ? 
1 1 1   37   32   11 o     51.2   21.9    0.0000   0.0000          ?        ?     1.9156  39.5883          ?        ?       51.2       21.9       ?       ? 
1 1 1   37   32   12 o     58.6   22.9    0.0000   0.0000          ?        ?    23.6253  38.9498          ?        ?       58.6       22.9       ?       ? 
1 1 1   37   32   13 o    145.2    5.5    0.0000   0.0000          ?        ?   211.3506  15.9630          ?        ?      145.2        5.5       ?       ? 
1 1 1   37   32   14 f    249.5    4.3    0.0000   0.0000          ?        ?   623.8356  21.7097          ?        ?      249.5        4.3       ?       ? 
1 1 1   37   32   15 o    325.6    3.7    0.0000   0.0000          ?        ?  1061.8615  24.2638          ?        ?      325.6        3.7       ?       ? 
1 1 1   37   32   16 o    296.2    3.2    0.0000   0.0000          ?        ?   877.9672  19.1556          ?        ?      296.2        3.2       ?       ? 
1 1 1   37   32   17 o    375.9    3.6    0.0000   0.0000          ?        ?  1414.9640  26.8179          ?        ?      375.9        3.6       ?       ? 
1 1 1   37   32   18 o    141.3    5.9    0.0000   0.0000          ?        ?   200.4958  16.6016          ?        ?      141.3        5.9       ?       ? 
1 1 1   37   32   19 o    336.6    2.6    0.0000   0.0000          ?        ?  1134.0144  17.2401          ?        ?      336.6        2.6       ?       ? 
1 1 1   37   32   20 o     18.7    9.2    0.0000   0.0000          ?        ?   -25.5409  12.1319          ?        ?       18.7        9.2       ?       ? 
1 1 1   37   32   21 f    156.2    4.3    0.0000   0.0000          ?        ?   244.5538  13.4090          ?        ?      156.2        4.3       ?       ? 
1 1 1   37   32   22 o     94.4    5.1    0.0000   0.0000          ?        ?    89.3930   9.5778          ?        ?       94.4        5.1       ?       ? 
1 1 1   37   32   23 o    265.4    2.6    0.0000   0.0000          ?        ?   704.9279  14.0475          ?        ?      265.4        2.6       ?       ? 
1 1 1   37   32   24 o     15.3    7.7    0.0000   0.0000          ?        ?   -38.9498  11.4934          ?        ?       15.3        7.7       ?       ? 
1 1 1   37   32   25 o    171.2    3.7    0.0000   0.0000          ?        ?   293.7199  12.7704          ?        ?      171.2        3.7       ?       ? 
1 1 1   37   32   26 f    190.8    3.5    0.0000   0.0000          ?        ?   364.5958  13.4090          ?        ?      190.8        3.5       ?       ? 
1 1 1   37   32   27 o    242.6    2.9    0.0000   0.0000          ?        ?   589.3555  14.0475          ?        ?      242.6        2.9       ?       ? 
1 1 1   37   32   28 o    185.5    3.6    0.0000   0.0000          ?        ?   344.8017  13.4090          ?        ?      185.5        3.6       ?       ? 
1 1 1   37   32   29 o    206.3    3.6    0.0000   0.0000          ?        ?   426.5325  14.6860          ?        ?      206.3        3.6       ?       ? 
1 1 1   37   32   30 o     84.9    7.5    0.0000   0.0000          ?        ?    72.7915  12.7704          ?        ?       84.9        7.5       ?       ? 
1 1 1   37   32   31 o     19.3    9.5    0.0000   0.0000          ?        ?   -29.3720  13.4090          ?        ?       19.3        9.5       ?       ? 
1 1 1   37   32   32 o     23.6   11.3    0.0000   0.0000          ?        ?   -18.5171  14.6860          ?        ?       23.6       11.3       ?       ? 
1 1 1   37   32   33 o    115.1    6.1    0.0000   0.0000          ?        ?   133.4510  14.0475          ?        ?      115.1        6.1       ?       ? 
1 1 1   37   32   34 o     24.0   11.3    0.0000   0.0000          ?        ?   -14.6860  14.0475          ?        ?       24.0       11.3       ?       ? 
1 1 1   37   32   35 o     32.3   13.5    0.0000   0.0000          ?        ?     2.5541  14.6860          ?        ?       32.3       13.5       ?       ? 
1 1 1   37   32   36 o     33.4   13.7    0.0000   0.0000          ?        ?     4.4697  14.6860          ?        ?       33.4       13.7       ?       ? 
1 1 1   37   33    0 o    141.1   11.7  204.3269  32.5646   204.3269  32.5646   204.3269  32.5646      141.1     11.7      141.1       11.7     0.0     0.0 
1 1 1   37   33    1 o    237.9    7.4    0.0000   0.0000          ?        ?   568.9227  35.1187          ?        ?      237.9        7.4       ?       ? 
1 1 1   37   33    2 o     98.8   14.9    0.0000   0.0000          ?        ?    99.6094  29.3720          ?        ?       98.8       14.9       ?       ? 
1 1 1   37   33    3 o     58.1   24.9    0.0000   0.0000          ?        ?     2.5541  51.7203          ?        ?       58.1       24.9       ?       ? 
1 1 1   37   33    4 o    113.7   22.1    0.0000   0.0000          ?        ?   139.1977  48.5276          ?        ?      113.7       22.1       ?       ? 
1 1 1   37   33    5 o    256.3    7.5    0.0000   0.0000          ?        ?   660.2314  38.3113          ?        ?      256.3        7.5       ?       ? 
1 1 1   37   33    6 o    147.5   14.1    0.0000   0.0000          ?        ?   221.5670  41.5039          ?        ?      147.5       14.1       ?       ? 
1 1 1   37   33    7 o    390.2   10.1    0.0000   0.0000          ?        ?  1537.5601  78.5382          ?        ?      390.2       10.1       ?       ? 
1 1 1   37   33    8 f    142.4   13.5    0.0000   0.0000          ?        ?   206.2425  38.3113          ?        ?      142.4       13.5       ?       ? 
1 1 1   37   33    9 o    123.9   15.5    0.0000   0.0000          ?        ?   157.0763  38.3113          ?        ?      123.9       15.5       ?       ? 
1 1 1   37   33   10 o     91.2   22.2    0.0000   0.0000          ?        ?    90.6701  40.2269          ?        ?       91.2       22.2       ?       ? 
1 1 1   37   33   11 o     39.2   18.4    0.0000   0.0000          ?        ?   -32.5646  35.7572          ?        ?       39.2       18.4       ?       ? 
1 1 1   37   33   12 o     50.6   21.7    0.0000   0.0000          ?        ?     0.6385  39.5883          ?        ?       50.6       21.7       ?       ? 
1 1 1   37   33   13 o    168.8    6.1    0.0000   0.0000          ?        ?   286.0577  20.4327          ?        ?      168.8        6.1       ?       ? 
1 1 1   37   33   14 o     52.7   13.8    0.0000   0.0000          ?        ?    29.3720  14.6860          ?        ?       52.7       13.8       ?       ? 
1 1 1   37   33   15 o    148.3    6.9    0.0000   0.0000          ?        ?   220.9285  20.4327          ?        ?      148.3        6.9       ?       ? 
1 1 1   37   33   16 o    115.9    5.8    0.0000   0.0000          ?        ?   134.7281  13.4090          ?        ?      115.9        5.8       ?       ? 
1 1 1   37   33   17 o     94.6    7.8    0.0000   0.0000          ?        ?    90.0316  14.6860          ?        ?       94.6        7.8       ?       ? 
1 1 1   37   33   18 o    417.0    3.8    0.0000   0.0000          ?        ?  1741.8870  31.2876          ?        ?      417.0        3.8       ?       ? 
1 1 1   37   33   19 o    196.0    4.6    0.0000   0.0000          ?        ?   385.0285  17.8786          ?        ?      196.0        4.6       ?       ? 
1 1 1   37   33   20 o    182.6    3.1    0.0000   0.0000          ?        ?   333.9468  11.4934          ?        ?      182.6        3.1       ?       ? 
1 1 1   37   33   21 o     43.0   12.6    0.0000   0.0000          ?        ?    19.1556  11.4934          ?        ?       43.0       12.6       ?       ? 
1 1 1   37   33   22 o     27.0   11.8    0.0000   0.0000          ?        ?    -2.5541  12.1319          ?        ?       27.0       11.8       ?       ? 
1 1 1   37   33   23 o    204.6    2.8    0.0000   0.0000          ?        ?   418.8702  11.4934          ?        ?      204.6        2.8       ?       ? 
1 1 1   37   33   24 o    144.1    4.0    0.0000   0.0000          ?        ?   208.1580  11.4934          ?        ?      144.1        4.0       ?       ? 
1 1 1   37   33   25 f    330.7    2.4    0.0000   0.0000          ?        ?  1094.4260  15.9630          ?        ?      330.7        2.4       ?       ? 
1 1 1   37   33   26 o    118.8    5.1    0.0000   0.0000          ?        ?   141.7518  12.1319          ?        ?      118.8        5.1       ?       ? 
1 1 1   37   33   27 o    109.9    5.5    0.0000   0.0000          ?        ?   121.3191  12.1319          ?        ?      109.9        5.5       ?       ? 
1 1 1   37   33   28 o    163.9    4.1    0.0000   0.0000          ?        ?   269.4561  13.4090          ?        ?      163.9        4.1       ?       ? 
1 1 1   37   33   29 o    124.0    5.1    0.0000   0.0000          ?        ?   154.5222  12.7704          ?        ?      124.0        5.1       ?       ? 
1 1 1   37   33   30 o    167.7    4.2    0.0000   0.0000          ?        ?   282.2266  14.0475          ?        ?      167.7        4.2       ?       ? 
1 1 1   37   33   31 o    251.5    2.9    0.0000   0.0000          ?        ?   633.4135  14.6860          ?        ?      251.5        2.9       ?       ? 
1 1 1   37   33   32 o    100.0    7.0    0.0000   0.0000          ?        ?   100.8864  14.0475          ?        ?      100.0        7.0       ?       ? 
1 1 1   37   33   33 f    192.3    3.8    0.0000   0.0000          ?        ?   370.9810  14.6860          ?        ?      192.3        3.8       ?       ? 
1 1 1   37   33   34 o     54.4   13.1    0.0000   0.0000          ?        ?    31.9261  14.0475          ?        ?       54.4       13.1       ?       ? 
1 1 1   37   34    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   34    1 o    178.5    8.8    0.0000   0.0000          ?        ?   321.1764  31.2876          ?        ?      178.5        8.8       ?       ? 
1 1 1   37   34    2 o    244.8    7.4    0.0000   0.0000          ?        ?   602.7644  36.3957          ?        ?      244.8        7.4       ?       ? 
1 1 1   37   34    3 o    199.4    9.1    0.0000   0.0000          ?        ?   400.9916  36.3957          ?        ?      199.4        9.1       ?       ? 
1 1 1   37   34    4 o    203.0    9.1    0.0000   0.0000          ?        ?   415.6776  37.0343          ?        ?      203.0        9.1       ?       ? 
1 1 1   37   34    5 o    274.3    9.3    0.0000   0.0000          ?        ?   759.2022  51.0817          ?        ?      274.3        9.3       ?       ? 
1 1 1   37   34    6 o    151.9   28.8    0.0000   0.0000          ?        ?   257.3242  84.2849          ?        ?      151.9       28.8       ?       ? 
1 1 1   37   34    7 o    329.1    8.7    0.0000   0.0000          ?        ?  1091.8719  57.4669          ?        ?      329.1        8.7       ?       ? 
1 1 1   37   34    8 o    162.7   14.5    0.0000   0.0000          ?        ?   270.7332  47.2506          ?        ?      162.7       14.5       ?       ? 
1 1 1   37   34    9 o     93.8   20.3    0.0000   0.0000          ?        ?    95.1397  37.0343          ?        ?       93.8       20.3       ?       ? 
1 1 1   37   34   10 o    216.2   18.3    0.0000   0.0000          ?        ?   484.6379  79.1767          ?        ?      216.2       18.3       ?       ? 
1 1 1   37   34   11 o    131.8   17.9    0.0000   0.0000          ?        ?   180.0631  47.2506          ?        ?      131.8       17.9       ?       ? 
1 1 1   37   34   12 o    441.8    5.8    0.0000   0.0000          ?        ?  1958.9843  51.0817          ?        ?      441.8        5.8       ?       ? 
1 1 1   37   34   13 o    141.1   16.7    0.0000   0.0000          ?        ?   205.6040  47.2506          ?        ?      141.1       16.7       ?       ? 
1 1 1   37   34   14 o    164.0    5.8    0.0000   0.0000          ?        ?   270.0946  19.1556          ?        ?      164.0        5.8       ?       ? 
1 1 1   37   34   15 f    151.3    5.9    0.0000   0.0000          ?        ?   229.8678  17.8786          ?        ?      151.3        5.9       ?       ? 
1 1 1   37   34   16 o    176.2    3.8    0.0000   0.0000          ?        ?   310.9600  13.4090          ?        ?      176.2        3.8       ?       ? 
1 1 1   37   34   17 o    137.5    5.3    0.0000   0.0000          ?        ?   189.6409  14.6860          ?        ?      137.5        5.3       ?       ? 
1 1 1   37   34   18 o    222.8    3.9    0.0000   0.0000          ?        ?   497.4084  17.2401          ?        ?      222.8        3.9       ?       ? 
1 1 1   37   34   19 o    224.1    4.0    0.0000   0.0000          ?        ?   503.1551  17.8786          ?        ?      224.1        4.0       ?       ? 
1 1 1   37   34   20 o    156.3    5.5    0.0000   0.0000          ?        ?   245.1923  17.2401          ?        ?      156.3        5.5       ?       ? 
1 1 1   37   34   21 f    108.5    7.6    0.0000   0.0000          ?        ?   118.7650  16.6016          ?        ?      108.5        7.6       ?       ? 
1 1 1   37   34   22 o    159.4    3.8    0.0000   0.0000          ?        ?   254.7701  12.1319          ?        ?      159.4        3.8       ?       ? 
1 1 1   37   34   23 o    197.1    2.8    0.0000   0.0000          ?        ?   388.8597  10.8549          ?        ?      197.1        2.8       ?       ? 
1 1 1   37   34   24 o    167.3    3.4    0.0000   0.0000          ?        ?   280.3110  11.4934          ?        ?      167.3        3.4       ?       ? 
1 1 1   37   34   25 o     25.1   11.2    0.0000   0.0000          ?        ?    -4.4697  11.4934          ?        ?       25.1       11.2       ?       ? 
1 1 1   37   34   26 o    119.9    4.8    0.0000   0.0000          ?        ?   144.3059  11.4934          ?        ?      119.9        4.8       ?       ? 
1 1 1   37   34   27 o    193.8    3.1    0.0000   0.0000          ?        ?   376.0892  12.1319          ?        ?      193.8        3.1       ?       ? 
1 1 1   37   34   28 o    204.5    3.3    0.0000   0.0000          ?        ?   418.8702  13.4090          ?        ?      204.5        3.3       ?       ? 
1 1 1   37   34   29 o    113.2    5.6    0.0000   0.0000          ?        ?   128.9814  12.7704          ?        ?      113.2        5.6       ?       ? 
1 1 1   37   34   30 o    171.7    3.9    0.0000   0.0000          ?        ?   295.6355  13.4090          ?        ?      171.7        3.9       ?       ? 
1 1 1   37   34   31 o     16.0    8.1    0.0000   0.0000          ?        ?   -48.5276  13.4090          ?        ?       16.0        8.1       ?       ? 
1 1 1   37   35    0 o     35.2   25.5 -138.5592  87.4775  -138.5592  87.4775  -138.5592  87.4775       35.2     25.5       35.2       25.5     0.0     0.0 
1 1 1   37   35    1 o    123.3   31.1    0.0000   0.0000          ?        ?   174.9549  76.6226          ?        ?      123.3       31.1       ?       ? 
1 1 1   37   35    2 o    221.6    7.9    0.0000   0.0000          ?        ?   494.8542  35.1187          ?        ?      221.6        7.9       ?       ? 
1 1 1   37   35    3 o    128.2   12.2    0.0000   0.0000          ?        ?   167.2927  31.2876          ?        ?      128.2       12.2       ?       ? 
1 1 1   37   35    4 o    213.7   13.0    0.0000   0.0000          ?        ?   465.4823  55.5514          ?        ?      213.7       13.0       ?       ? 
1 1 1   37   35    5 o    173.2   11.2    0.0000   0.0000          ?        ?   304.5748  38.9498          ?        ?      173.2       11.2       ?       ? 
1 1 1   37   35    6 o    140.0   15.1    0.0000   0.0000          ?        ?   201.1343  42.1424          ?        ?      140.0       15.1       ?       ? 
1 1 1   37   35    7 o    127.9   20.5    0.0000   0.0000          ?        ?   171.7623  52.3588          ?        ?      127.9       20.5       ?       ? 
1 1 1   37   35    8 o    208.6   14.7    0.0000   0.0000          ?        ?   446.3266  61.2981          ?        ?      208.6       14.7       ?       ? 
1 1 1   37   35    9 o    166.1   22.7    0.0000   0.0000          ?        ?   293.0815  75.3456          ?        ?      166.1       22.7       ?       ? 
1 1 1   37   35   10 o    278.0    8.4    0.0000   0.0000          ?        ?   779.6349  46.6121          ?        ?      278.0        8.4       ?       ? 
1 1 1   37   35   11 f     83.2   25.1    0.0000   0.0000          ?        ?    75.9841  45.3350          ?        ?       83.2       25.1       ?       ? 
1 1 1   37   35   12 o    219.0   11.2    0.0000   0.0000          ?        ?   487.1920  49.1662          ?        ?      219.0       11.2       ?       ? 
1 1 1   37   35   13 o    402.7    8.5    0.0000   0.0000          ?        ?  1636.5309  68.3218          ?        ?      402.7        8.5       ?       ? 
1 1 1   37   35   14 o    221.2   22.1    0.0000   0.0000          ?        ?   520.3951  97.6938          ?        ?      221.2       22.1       ?       ? 
1 1 1   37   35   15 o    118.8    8.1    0.0000   0.0000          ?        ?   142.3903  19.1556          ?        ?      118.8        8.1       ?       ? 
1 1 1   37   35   16 o     49.1   12.9    0.0000   0.0000          ?        ?    25.5409  12.7704          ?        ?       49.1       12.9       ?       ? 
1 1 1   37   35   17 o    127.6    5.3    0.0000   0.0000          ?        ?   163.4615  13.4090          ?        ?      127.6        5.3       ?       ? 
1 1 1   37   35   18 f    148.6    4.9    0.0000   0.0000          ?        ?   221.5670  14.6860          ?        ?      148.6        4.9       ?       ? 
1 1 1   37   35   19 o     88.1    8.7    0.0000   0.0000          ?        ?    78.5382  15.3245          ?        ?       88.1        8.7       ?       ? 
1 1 1   37   35   20 o    220.4    4.1    0.0000   0.0000          ?        ?   487.1920  17.8786          ?        ?      220.4        4.1       ?       ? 
1 1 1   37   35   21 o    112.2    7.4    0.0000   0.0000          ?        ?   127.0658  16.6016          ?        ?      112.2        7.4       ?       ? 
1 1 1   37   35   22 o    285.7    3.6    0.0000   0.0000          ?        ?   817.9462  20.4327          ?        ?      285.7        3.6       ?       ? 
1 1 1   37   35   23 f    196.7    3.4    0.0000   0.0000          ?        ?   387.5826  13.4090          ?        ?      196.7        3.4       ?       ? 
1 1 1   37   35   24 o     95.3    5.4    0.0000   0.0000          ?        ?    91.3086  10.2163          ?        ?       95.3        5.4       ?       ? 
1 1 1   37   35   25 o    166.1    3.3    0.0000   0.0000          ?        ?   276.4799  10.8549          ?        ?      166.1        3.3       ?       ? 
1 1 1   37   35   26 o    299.5    2.6    0.0000   0.0000          ?        ?   898.3999  15.3245          ?        ?      299.5        2.6       ?       ? 
1 1 1   37   35   27 o     85.7    6.7    0.0000   0.0000          ?        ?    74.0685  11.4934          ?        ?       85.7        6.7       ?       ? 
1 1 1   37   35   28 o     34.6   13.0    0.0000   0.0000          ?        ?     9.5778  12.1319          ?        ?       34.6       13.0       ?       ? 
1 1 1   37   36    0 o    377.3   12.6 1442.4203  94.5012  1442.4203  94.5012  1442.4203  94.5012      377.3     12.6      377.3       12.6     0.0     0.0 
1 1 1   37   36    1 o    148.2   11.6    0.0000   0.0000          ?        ?   223.4826  34.4802          ?        ?      148.2       11.6       ?       ? 
1 1 1   37   36    2 o     98.1   32.9    0.0000   0.0000          ?        ?   108.5487  75.9841          ?        ?       98.1       32.9       ?       ? 
1 1 1   37   36    3 o    134.2   15.7    0.0000   0.0000          ?        ?   185.8098  42.1424          ?        ?      134.2       15.7       ?       ? 
1 1 1   37   36    4 o    104.4   33.9    0.0000   0.0000          ?        ?   126.4273  81.0922          ?        ?      104.4       33.9       ?       ? 
1 1 1   37   36    5 o    207.7    9.2    0.0000   0.0000          ?        ?   436.1103  38.3113          ?        ?      207.7        9.2       ?       ? 
1 1 1   37   36    6 o     96.0   26.7    0.0000   0.0000          ?        ?   104.0790  52.9973          ?        ?       96.0       26.7       ?       ? 
1 1 1   37   36    7 o    184.8   23.5    0.0000   0.0000          ?        ?   366.5114  86.8389          ?        ?      184.8       23.5       ?       ? 
1 1 1   37   36    8 o    236.6   14.6    0.0000   0.0000          ?        ?   575.9465  68.9603          ?        ?      236.6       14.6       ?       ? 
1 1 1   37   36    9 o    197.6    9.4    0.0000   0.0000          ?        ?   395.2449  37.0343          ?        ?      197.6        9.4       ?       ? 
1 1 1   37   36   10 o     73.0   27.0    0.0000   0.0000          ?        ?    50.4432  52.3588          ?        ?       73.0       27.0       ?       ? 
1 1 1   37   36   11 o    244.6   10.7    0.0000   0.0000          ?        ?   607.8726  52.3588          ?        ?      244.6       10.7       ?       ? 
1 1 1   37   36   12 o    199.6   15.0    0.0000   0.0000          ?        ?   411.2079  60.0210          ?        ?      199.6       15.0       ?       ? 
1 1 1   37   36   13 o    159.0   18.1    0.0000   0.0000          ?        ?   264.9865  57.4669          ?        ?      159.0       18.1       ?       ? 
1 1 1   37   36   14 o    219.3   18.2    0.0000   0.0000          ?        ?   504.4321  79.8152          ?        ?      219.3       18.2       ?       ? 
1 1 1   37   36   15 o    248.6   11.4    0.0000   0.0000          ?        ?   630.2208  56.8284          ?        ?      248.6       11.4       ?       ? 
1 1 1   37   36   16 o    323.1    4.3    0.0000   0.0000          ?        ?  1047.1754  28.0950          ?        ?      323.1        4.3       ?       ? 
1 1 1   37   36   17 o     15.6    7.9    0.0000   0.0000          ?        ?   -46.6121  12.7704          ?        ?       15.6        7.9       ?       ? 
1 1 1   37   36   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   36   19 o     64.0   12.4    0.0000   0.0000          ?        ?    43.4195  15.3245          ?        ?       64.0       12.4       ?       ? 
1 1 1   37   36   20 o    115.0    7.2    0.0000   0.0000          ?        ?   133.4510  16.6016          ?        ?      115.0        7.2       ?       ? 
1 1 1   37   36   21 o     45.2   15.1    0.0000   0.0000          ?        ?    20.4327  15.9630          ?        ?       45.2       15.1       ?       ? 
1 1 1   37   36   22 o    105.4    7.9    0.0000   0.0000          ?        ?   112.3798  16.6016          ?        ?      105.4        7.9       ?       ? 
1 1 1   37   36   23 o    129.1    6.4    0.0000   0.0000          ?        ?   167.9312  16.6016          ?        ?      129.1        6.4       ?       ? 
1 1 1   37   36   24 o    181.7    2.8    0.0000   0.0000          ?        ?   330.7542  10.2163          ?        ?      181.7        2.8       ?       ? 
1 1 1   37   36   25 o     92.2    5.5    0.0000   0.0000          ?        ?    85.5619  10.2163          ?        ?       92.2        5.5       ?       ? 
1 1 1   37   37    0 o     37.9   26.6  -63.8522  72.7915   -63.8522  72.7915   -63.8522  72.7915       37.9     26.6       37.9       26.6     0.0     0.0 
1 1 1   37   37    1 o     43.3   29.5  -24.2638  74.0685   -24.2638  74.0685   -24.2638  74.0685       43.3     29.5       43.3       29.5     0.0     0.0 
1 1 1   37   37    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   37    3 o     58.4   35.7   42.7809  77.2611    42.7809  77.2611    42.7809  77.2611       58.4     35.7       58.4       35.7     0.0     0.0 
1 1 1   37   37    4 o    100.6   30.9  131.5355  54.2743   131.5355  54.2743   131.5355  54.2743      100.6     30.9      100.6       30.9     0.0     0.0 
1 1 1   37   37    5 o     40.7   28.4  -56.1899  80.4537   -56.1899  80.4537   -56.1899  80.4537       40.7     28.4       40.7       28.4     0.0     0.0 
1 1 1   37   37    6 o     57.5   35.8   37.0343  80.4537    37.0343  80.4537    37.0343  80.4537       57.5     35.8       57.5       35.8     0.0     0.0 
1 1 1   37   37    7 o     61.6   34.0   60.0210  60.0210    60.0210  60.0210    60.0210  60.0210       61.6     34.0       61.6       34.0     0.0     0.0 
1 1 1   37   37    8 o     38.1   27.4 -106.6331  89.3930  -106.6331  89.3930  -106.6331  89.3930       38.1     27.4       38.1       27.4     0.0     0.0 
1 1 1   37   37    9 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   37   10 o     86.1   41.1  121.9576  80.4537   121.9576  80.4537   121.9576  80.4537       86.1     41.1       86.1       41.1     0.0     0.0 
1 1 1   37   37   11 o     54.3   31.8   42.1424  56.8284    42.1424  56.8284    42.1424  56.8284       54.3     31.8       54.3       31.8     0.0     0.0 
1 1 1   37   37   12 o     39.6   28.0  -67.6833  81.7308   -67.6833  81.7308   -67.6833  81.7308       39.6     28.0       39.6       28.0     0.0     0.0 
1 1 1   37   37   13 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   37   14 o    151.1   27.8  261.1554  75.9841   261.1554  75.9841   261.1554  75.9841      151.1     27.8      151.1       27.8     0.0     0.0 
1 1 1   37   37   15 o     63.8   34.4   66.4062  60.0210    66.4062  60.0210    66.4062  60.0210       63.8     34.4       63.8       34.4     0.0     0.0 
1 1 1   37   37   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   37   37   17 o    105.3    7.3  113.0183  15.3245   113.0183  15.3245   113.0183  15.3245      105.3      7.3      105.3        7.3     0.0     0.0 
1 1 1   37   37   18 o    294.4    4.8  869.0280  28.0950   869.0280  28.0950   869.0280  28.0950      294.4      4.8      294.4        4.8     0.0     0.0 
1 1 1   37   37   19 o     65.2   17.6   51.7203  19.7942    51.7203  19.7942    51.7203  19.7942       65.2     17.6       65.2       17.6     0.0     0.0 
1 1 1   37   37   20 o    200.1    5.9  402.9071  23.6253   402.9071  23.6253   402.9071  23.6253      200.1      5.9      200.1        5.9     0.0     0.0 
1 1 1   37   37   21 o    347.9    4.9 1213.8297  33.8416  1213.8297  33.8416  1213.8297  33.8416      347.9      4.9      347.9        4.9     0.0     0.0 
1 1 1   37   37   22 o     36.2   20.3   19.1556  21.7097    19.1556  21.7097    19.1556  21.7097       36.2     20.3       36.2       20.3     0.0     0.0 
1 1 1   38    0    0 o     72.6   15.5   59.3825  19.7942    59.3825  19.7942    59.3825  19.7942       72.6     15.5       72.6       15.5     0.0     0.0 
1 1 1   38    0    1 o    799.1    4.5 6386.4932  71.5144  6386.4932  71.5144  6386.4932  71.5144      799.1      4.5      799.1        4.5     0.0     0.0 
1 1 1   38    0    2 o    265.8    3.4  706.8434  17.8786   706.8434  17.8786   706.8434  17.8786      265.8      3.4      265.8        3.4     0.0     0.0 
1 1 1   38    0    3 o     15.9   11.4  -20.4327  15.3245   -20.4327  15.3245   -20.4327  15.3245       15.9     11.4       15.9       11.4     0.0     0.0 
1 1 1   38    0    4 f   1100.5    6.0 12114.0322 131.5355 12114.0322 131.5355 12114.0322 131.5355     1100.5      6.0     1100.5        6.0     0.0     0.0 
1 1 1   38    0    5 f   1121.9    5.7 12588.4541 128.9814 12588.4541 128.9814 12588.4541 128.9814     1121.9      5.7     1121.9        5.7     0.0     0.0 
1 1 1   38    0    6 o    713.3    4.3 5089.0176  60.6596  5089.0176  60.6596  5089.0176  60.6596      713.3      4.3      713.3        4.3     0.0     0.0 
1 1 1   38    0    7 o    346.0    3.7 1197.8666  25.5409  1197.8666  25.5409  1197.8666  25.5409      346.0      3.7      346.0        3.7     0.0     0.0 
1 1 1   38    0    8 o    282.9    3.6  800.7061  20.4327   800.7061  20.4327   800.7061  20.4327      282.9      3.6      282.9        3.6     0.0     0.0 
1 1 1   38    0    9 o    623.8    3.9 3892.4277  48.5276  3892.4277  48.5276  3892.4277  48.5276      623.8      3.9      623.8        3.9     0.0     0.0 
1 1 1   38    0   10 o    400.4    3.3 1603.9663  26.8179  1603.9663  26.8179  1603.9663  26.8179      400.4      3.3      400.4        3.3     0.0     0.0 
1 1 1   38    0   11 o    373.4    3.3 1394.5312  24.9023  1394.5312  24.9023  1394.5312  24.9023      373.4      3.3      373.4        3.3     0.0     0.0 
1 1 1   38    0   12 o    526.7    3.5 2775.0151  36.3957  2775.0151  36.3957  2775.0151  36.3957      526.7      3.5      526.7        3.5     0.0     0.0 
1 1 1   38    0   13 o    602.1    3.7 3626.1646  44.6965  3626.1646  44.6965  3626.1646  44.6965      602.1      3.7      602.1        3.7     0.0     0.0 
1 1 1   38    0   14 o    178.1    4.7  317.9838  16.6016   317.9838  16.6016   317.9838  16.6016      178.1      4.7      178.1        4.7     0.0     0.0 
1 1 1   38    0   15 o    159.5    5.6  255.4086  17.8786   255.4086  17.8786   255.4086  17.8786      159.5      5.6      159.5        5.6     0.0     0.0 
1 1 1   38    0   16 o     27.6   17.6    2.5541  21.0712     2.5541  21.0712     2.5541  21.0712       27.6     17.6       27.6       17.6     0.0     0.0 
1 1 1   38    0   17 o     26.7   18.9  -40.2269  38.3113   -40.2269  38.3113   -40.2269  38.3113       26.7     18.9       26.7       18.9     0.0     0.0 
1 1 1   38    0   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    0   19 o    429.7    3.8 1847.2430  32.5646  1847.2430  32.5646  1847.2430  32.5646      429.7      3.8      429.7        3.8     0.0     0.0 
1 1 1   38    0   20 o    557.1    3.8 3104.4922  42.7809  3104.4922  42.7809  3104.4922  42.7809      557.1      3.8      557.1        3.8     0.0     0.0 
1 1 1   38    0   21 o    630.1    4.0 3970.9661  49.8047  3970.9661  49.8047  3970.9661  49.8047      630.1      4.0      630.1        4.0     0.0     0.0 
1 1 1   38    0   22 o    562.5    3.6 3164.5132  40.2269  3164.5132  40.2269  3164.5132  40.2269      562.5      3.6      562.5        3.6     0.0     0.0 
1 1 1   38    0   23 o   1058.3    5.6 11202.2236 118.7650 11202.2236 118.7650 11202.2236 118.7650     1058.3      5.6     1058.3        5.6     0.0     0.0 
1 1 1   38    0   24 o     14.6   10.7  -35.7572  17.2401   -35.7572  17.2401   -35.7572  17.2401       14.6     10.7       14.6       10.7     0.0     0.0 
1 1 1   38    0   25 o    261.1    4.2  682.5797  21.7097   682.5797  21.7097   682.5797  21.7097      261.1      4.2      261.1        4.2     0.0     0.0 
1 1 1   38    0   26 o    463.9    3.6 2152.4565  33.8416  2152.4565  33.8416  2152.4565  33.8416      463.9      3.6      463.9        3.6     0.0     0.0 
1 1 1   38    0   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    0   28 o    830.3    4.8 6896.0337  79.1767  6896.0337  79.1767  6896.0337  79.1767      830.3      4.8      830.3        4.8     0.0     0.0 
1 1 1   38    0   29 o    429.0    3.7 1840.8578  31.9261  1840.8578  31.9261  1840.8578  31.9261      429.0      3.7      429.0        3.7     0.0     0.0 
1 1 1   38    0   30 f    485.1    3.6 2353.5908  35.1187  2353.5908  35.1187  2353.5908  35.1187      485.1      3.6      485.1        3.6     0.0     0.0 
1 1 1   38    0   31 o    632.2    3.7 3997.1453  47.2506  3997.1453  47.2506  3997.1453  47.2506      632.2      3.7      632.2        3.7     0.0     0.0 
1 1 1   38    0   32 o    525.2    3.6 2759.0520  38.3113  2759.0520  38.3113  2759.0520  38.3113      525.2      3.6      525.2        3.6     0.0     0.0 
1 1 1   38    0   33 o    396.0    3.6 1568.8477  28.7335  1568.8477  28.7335  1568.8477  28.7335      396.0      3.6      396.0        3.6     0.0     0.0 
1 1 1   38    0   34 o    251.5    4.7  633.4135  23.6253   633.4135  23.6253   633.4135  23.6253      251.5      4.7      251.5        4.7     0.0     0.0 
1 1 1   38    0   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    0   36 o    398.2    3.7 1586.0876  29.3720  1586.0876  29.3720  1586.0876  29.3720      398.2      3.7      398.2        3.7     0.0     0.0 
1 1 1   38    0   37 o    437.8    3.5 1917.4803  30.6490  1917.4803  30.6490  1917.4803  30.6490      437.8      3.5      437.8        3.5     0.0     0.0 
1 1 1   38    0   38 f    117.7    9.1  141.1133  21.0712   141.1133  21.0712   141.1133  21.0712      117.7      9.1      117.7        9.1     0.0     0.0 
1 1 1   38    0   39 o    332.2    3.7 1104.0039  24.9023  1104.0039  24.9023  1104.0039  24.9023      332.2      3.7      332.2        3.7     0.0     0.0 
1 1 1   38    0   40 o    305.6    4.4  934.7956  26.8179   934.7956  26.8179   934.7956  26.8179      305.6      4.4      305.6        4.4     0.0     0.0 
1 1 1   38    0   41 o     14.6   11.0  -95.7782  26.8179   -95.7782  26.8179   -95.7782  26.8179       14.6     11.0       14.6       11.0     0.0     0.0 
1 1 1   38    0   42 o    513.8    4.0 2641.5640  40.8654  2641.5640  40.8654  2641.5640  40.8654      513.8      4.0      513.8        4.0     0.0     0.0 
1 1 1   38    0   43 o    206.7    5.9  428.4480  24.2638   428.4480  24.2638   428.4480  24.2638      206.7      5.9      206.7        5.9     0.0     0.0 
1 1 1   38    0   44 o    174.0    7.0  304.5748  24.2638   304.5748  24.2638   304.5748  24.2638      174.0      7.0      174.0        7.0     0.0     0.0 
1 1 1   38    0   45 o     19.5   13.9  -28.0950  22.3483   -28.0950  22.3483   -28.0950  22.3483       19.5     13.9       19.5       13.9     0.0     0.0 
1 1 1   38    0   46 o    733.8    4.1 5387.8452  60.6596  5387.8452  60.6596  5387.8452  60.6596      733.8      4.1      733.8        4.1     0.0     0.0 
1 1 1   38    0   47 o     13.2    9.9  -82.3693  22.3483   -82.3693  22.3483   -82.3693  22.3483       13.2      9.9       13.2        9.9     0.0     0.0 
1 1 1   38    0   48 o    443.0    3.7 1963.4540  33.2031  1963.4540  33.2031  1963.4540  33.2031      443.0      3.7      443.0        3.7     0.0     0.0 
1 1 1   38    0   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    0   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    0   51 o    101.6   12.9  108.5487  25.5409   108.5487  25.5409   108.5487  25.5409      101.6     12.9      101.6       12.9     0.0     0.0 
1 1 1   38    0   52 f    159.0    8.3  255.4086  26.1794   255.4086  26.1794   255.4086  26.1794      159.0      8.3      159.0        8.3     0.0     0.0 
1 1 1   38    0   53 o    258.7    5.3  670.4477  27.4564   670.4477  27.4564   670.4477  27.4564      258.7      5.3      258.7        5.3     0.0     0.0 
1 1 1   38    0   54 o     28.2   18.5   -1.2770  24.9023    -1.2770  24.9023    -1.2770  24.9023       28.2     18.5       28.2       18.5     0.0     0.0 
1 1 1   38    0   55 f    315.5    4.6  996.7323  28.7335   996.7323  28.7335   996.7323  28.7335      315.5      4.6      315.5        4.6     0.0     0.0 
1 1 1   38    0   56 o    143.0    9.9  208.1580  28.0950   208.1580  28.0950   208.1580  28.0950      143.0      9.9      143.0        9.9     0.0     0.0 
1 1 1   38    0   57 o     25.0   17.2  -14.0475  26.1794   -14.0475  26.1794   -14.0475  26.1794       25.0     17.2       25.0       17.2     0.0     0.0 
1 1 1   38    0   58 o    197.2    7.1  391.4138  28.0950   391.4138  28.0950   391.4138  28.0950      197.2      7.1      197.2        7.1     0.0     0.0 
1 1 1   38    0   59 o    254.6    5.8  650.0150  29.3720   650.0150  29.3720   650.0150  29.3720      254.6      5.8      254.6        5.8     0.0     0.0 
1 1 1   38    0   60 o    182.5    7.9  335.8624  28.7335   335.8624  28.7335   335.8624  28.7335      182.5      7.9      182.5        7.9     0.0     0.0 
1 1 1   38    0   61 o    454.0    4.3 2063.7019  38.9498  2063.7019  38.9498  2063.7019  38.9498      454.0      4.3      454.0        4.3     0.0     0.0 
1 1 1   38    0   62 o    225.4    6.2  510.1788  28.0950   510.1788  28.0950   510.1788  28.0950      225.4      6.2      225.4        6.2     0.0     0.0 
1 1 1   38    0   63 o     17.7   13.1  -68.9603  28.7335   -68.9603  28.7335   -68.9603  28.7335       17.7     13.1       17.7       13.1     0.0     0.0 
1 1 1   38    0   64 o     51.0   24.0   39.5883  27.4564    39.5883  27.4564    39.5883  27.4564       51.0     24.0       51.0       24.0     0.0     0.0 
1 1 1   38    0   65 o     23.5   16.5  -24.9023  28.0950   -24.9023  28.0950   -24.9023  28.0950       23.5     16.5       23.5       16.5     0.0     0.0 
1 1 1   38    0   66 o    171.4    8.4  297.5511  28.7335   297.5511  28.7335   297.5511  28.7335      171.4      8.4      171.4        8.4     0.0     0.0 
1 1 1   38    0   67 o     42.1   23.1   26.8179  27.4564    26.8179  27.4564    26.8179  27.4564       42.1     23.1       42.1       23.1     0.0     0.0 
1 1 1   38    1    0 o    841.3    4.6 7078.6504  77.8996  7078.6504  77.8996  7078.6504  77.8996      841.3      4.6      841.3        4.6     0.0     0.0 
1 1 1   38    1    1 o    840.4    3.4    0.0000   0.0000          ?        ?  7063.3257  57.4669          ?        ?      840.4        3.4       ?       ? 
1 1 1   38    1    2 o   1004.2    3.7    0.0000   0.0000          ?        ? 10084.8105  74.0685          ?        ?     1004.2        3.7       ?       ? 
1 1 1   38    1    3 f    940.3    3.5    0.0000   0.0000          ?        ?  8842.2480  66.4062          ?        ?      940.3        3.5       ?       ? 
1 1 1   38    1    4 o    933.5    3.5    0.0000   0.0000          ?        ?  8714.5439  65.7677          ?        ?      933.5        3.5       ?       ? 
1 1 1   38    1    5 o    691.5    2.9    0.0000   0.0000          ?        ?  4782.5269  40.2269          ?        ?      691.5        2.9       ?       ? 
1 1 1   38    1    6 o    525.9    2.5    0.0000   0.0000          ?        ?  2765.4373  26.1794          ?        ?      525.9        2.5       ?       ? 
1 1 1   38    1    7 o    717.3    2.9    0.0000   0.0000          ?        ?  5145.2070  41.5039          ?        ?      717.3        2.9       ?       ? 
1 1 1   38    1    8 o    708.6    2.9    0.0000   0.0000          ?        ?  5021.9727  41.5039          ?        ?      708.6        2.9       ?       ? 
1 1 1   38    1    9 o    187.0    3.6    0.0000   0.0000          ?        ?   349.9099  13.4090          ?        ?      187.0        3.6       ?       ? 
1 1 1   38    1   10 o    951.4    3.5    0.0000   0.0000          ?        ?  9051.6826  66.4062          ?        ?      951.4        3.5       ?       ? 
1 1 1   38    1   11 o    779.9    3.0    0.0000   0.0000          ?        ?  6082.5566  47.2506          ?        ?      779.9        3.0       ?       ? 
1 1 1   38    1   12 o    715.9    2.9    0.0000   0.0000          ?        ?  5124.7744  41.5039          ?        ?      715.9        2.9       ?       ? 
1 1 1   38    1   13 o    251.8    2.7    0.0000   0.0000          ?        ?   634.0520  13.4090          ?        ?      251.8        2.7       ?       ? 
1 1 1   38    1   14 o    277.0    2.7    0.0000   0.0000          ?        ?   767.5030  14.6860          ?        ?      277.0        2.7       ?       ? 
1 1 1   38    1   15 o    178.8    3.4    0.0000   0.0000          ?        ?   319.8993  12.1319          ?        ?      178.8        3.4       ?       ? 
1 1 1   38    1   16 o    555.2    2.6    0.0000   0.0000          ?        ?  3082.1440  29.3720          ?        ?      555.2        2.6       ?       ? 
1 1 1   38    1   17 o   1069.5    4.0    0.0000   0.0000          ?        ? 11439.7529  86.2004          ?        ?     1069.5        4.0       ?       ? 
1 1 1   38    1   18 f    678.9    3.0    0.0000   0.0000          ?        ?  4608.8491  40.2269          ?        ?      678.9        3.0       ?       ? 
1 1 1   38    1   19 o   1278.9    4.5    0.0000   0.0000          ?        ? 16358.2852 115.5724          ?        ?     1278.9        4.5       ?       ? 
1 1 1   38    1   20 o    348.7    2.7    0.0000   0.0000          ?        ?  1215.7451  18.5171          ?        ?      348.7        2.7       ?       ? 
1 1 1   38    1   21 o    448.9    2.4    0.0000   0.0000          ?        ?  2015.1743  21.7097          ?        ?      448.9        2.4       ?       ? 
1 1 1   38    1   22 f    553.6    2.6    0.0000   0.0000          ?        ?  3065.5425  28.7335          ?        ?      553.6        2.6       ?       ? 
1 1 1   38    1   23 o    572.8    2.6    0.0000   0.0000          ?        ?  3281.3628  29.3720          ?        ?      572.8        2.6       ?       ? 
1 1 1   38    1   24 o    541.0    2.6    0.0000   0.0000          ?        ?  2927.6216  28.0950          ?        ?      541.0        2.6       ?       ? 
1 1 1   38    1   25 o    587.3    2.7    0.0000   0.0000          ?        ?  3449.9324  31.2876          ?        ?      587.3        2.7       ?       ? 
1 1 1   38    1   26 o    388.6    2.4    0.0000   0.0000          ?        ?  1510.1036  18.5171          ?        ?      388.6        2.4       ?       ? 
1 1 1   38    1   27 o    752.2    3.1    0.0000   0.0000          ?        ?  5659.2173  47.2506          ?        ?      752.2        3.1       ?       ? 
1 1 1   38    1   28 o    604.4    2.7    0.0000   0.0000          ?        ?  3653.6208  32.5646          ?        ?      604.4        2.7       ?       ? 
1 1 1   38    1   29 o    221.3    3.5    0.0000   0.0000          ?        ?   489.7461  15.3245          ?        ?      221.3        3.5       ?       ? 
1 1 1   38    1   30 o    566.1    2.6    0.0000   0.0000          ?        ?  3204.7400  29.3720          ?        ?      566.1        2.6       ?       ? 
1 1 1   38    1   31 o    164.5    4.7    0.0000   0.0000          ?        ?   270.7332  15.3245          ?        ?      164.5        4.7       ?       ? 
1 1 1   38    1   32 o    239.6    3.3    0.0000   0.0000          ?        ?   574.0309  15.9630          ?        ?      239.6        3.3       ?       ? 
1 1 1   38    1   33 o    225.8    3.4    0.0000   0.0000          ?        ?   510.1788  15.3245          ?        ?      225.8        3.4       ?       ? 
1 1 1   38    1   34 o    390.5    2.5    0.0000   0.0000          ?        ?  1525.4281  19.7942          ?        ?      390.5        2.5       ?       ? 
1 1 1   38    1   35 o    385.3    2.7    0.0000   0.0000          ?        ?  1484.5627  20.4327          ?        ?      385.3        2.7       ?       ? 
1 1 1   38    1   36 o    233.3    3.3    0.0000   0.0000          ?        ?   544.6590  15.3245          ?        ?      233.3        3.3       ?       ? 
1 1 1   38    1   37 o    498.3    2.6    0.0000   0.0000          ?        ?  2483.8491  26.1794          ?        ?      498.3        2.6       ?       ? 
1 1 1   38    1   38 o    160.0    4.6    0.0000   0.0000          ?        ?   256.0471  14.6860          ?        ?      160.0        4.6       ?       ? 
1 1 1   38    1   39 o    227.5    3.5    0.0000   0.0000          ?        ?   517.8410  15.9630          ?        ?      227.5        3.5       ?       ? 
1 1 1   38    1   40 o    333.4    2.8    0.0000   0.0000          ?        ?  1111.6661  18.5171          ?        ?      333.4        2.8       ?       ? 
1 1 1   38    1   41 o    221.1    3.9    0.0000   0.0000          ?        ?   489.1075  17.2401          ?        ?      221.1        3.9       ?       ? 
1 1 1   38    1   42 o    738.6    3.1    0.0000   0.0000          ?        ?  5456.8057  45.3350          ?        ?      738.6        3.1       ?       ? 
1 1 1   38    1   43 o    202.6    3.9    0.0000   0.0000          ?        ?   410.5694  15.9630          ?        ?      202.6        3.9       ?       ? 
1 1 1   38    1   44 o    399.9    2.7    0.0000   0.0000          ?        ?  1599.4967  21.7097          ?        ?      399.9        2.7       ?       ? 
1 1 1   38    1   45 o    107.4    7.4    0.0000   0.0000          ?        ?   115.5724  15.9630          ?        ?      107.4        7.4       ?       ? 
1 1 1   38    1   46 o     32.0   13.8    0.0000   0.0000          ?        ?    -1.2770  15.9630          ?        ?       32.0       13.8       ?       ? 
1 1 1   38    1   47 o    361.5    2.7    0.0000   0.0000          ?        ?  1307.0537  19.7942          ?        ?      361.5        2.7       ?       ? 
1 1 1   38    1   48 o     77.6   11.1    0.0000   0.0000          ?        ?    60.6596  17.2401          ?        ?       77.6       11.1       ?       ? 
1 1 1   38    1   49 o     30.9   13.7    0.0000   0.0000          ?        ?    -5.1082  16.6016          ?        ?       30.9       13.7       ?       ? 
1 1 1   38    1   50 o    189.6    4.9    0.0000   0.0000          ?        ?   360.1262  18.5171          ?        ?      189.6        4.9       ?       ? 
1 1 1   38    1   51 o    647.1    2.9    0.0000   0.0000          ?        ?  4189.3403  37.0343          ?        ?      647.1        2.9       ?       ? 
1 1 1   38    1   52 o    201.1    4.6    0.0000   0.0000          ?        ?   404.8227  18.5171          ?        ?      201.1        4.6       ?       ? 
1 1 1   38    1   53 o    397.4    2.7    0.0000   0.0000          ?        ?  1579.7025  21.7097          ?        ?      397.4        2.7       ?       ? 
1 1 1   38    1   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    1   55 f    354.8    3.0    0.0000   0.0000          ?        ?  1259.8032  21.0712          ?        ?      354.8        3.0       ?       ? 
1 1 1   38    1   56 o     26.4   12.6    0.0000   0.0000          ?        ?   -24.2638  18.5171          ?        ?       26.4       12.6       ?       ? 
1 1 1   38    1   57 o    133.0    7.0    0.0000   0.0000          ?        ?   177.5090  18.5171          ?        ?      133.0        7.0       ?       ? 
1 1 1   38    1   58 o     22.4   11.1    0.0000   0.0000          ?        ?   -42.7809  18.5171          ?        ?       22.4       11.1       ?       ? 
1 1 1   38    1   59 o    325.5    3.4    0.0000   0.0000          ?        ?  1060.5845  22.3483          ?        ?      325.5        3.4       ?       ? 
1 1 1   38    1   60 o    255.5    4.0    0.0000   0.0000          ?        ?   653.8461  20.4327          ?        ?      255.5        4.0       ?       ? 
1 1 1   38    1   61 o    168.4    6.3    0.0000   0.0000          ?        ?   284.7806  21.0712          ?        ?      168.4        6.3       ?       ? 
1 1 1   38    1   62 o     47.4   16.5    0.0000   0.0000          ?        ?    21.0712  19.1556          ?        ?       47.4       16.5       ?       ? 
1 1 1   38    1   63 o     41.5   16.5    0.0000   0.0000          ?        ?    10.2163  20.4327          ?        ?       41.5       16.5       ?       ? 
1 1 1   38    1   64 o     87.4   11.3    0.0000   0.0000          ?        ?    77.8996  19.7942          ?        ?       87.4       11.3       ?       ? 
1 1 1   38    1   65 o    132.4    7.5    0.0000   0.0000          ?        ?   176.8705  19.7942          ?        ?      132.4        7.5       ?       ? 
1 1 1   38    1   66 o     86.6   10.7    0.0000   0.0000          ?        ?    76.6226  18.5171          ?        ?       86.6       10.7       ?       ? 
1 1 1   38    1   67 o    161.8    6.1    0.0000   0.0000          ?        ?   263.7094  19.7942          ?        ?      161.8        6.1       ?       ? 
1 1 1   38    2    0 o    578.6    3.8 3348.4075  44.0580  3348.4075  44.0580  3348.4075  44.0580      578.6      3.8      578.6        3.8     0.0     0.0 
1 1 1   38    2    1 o    353.1    2.4    0.0000   0.0000          ?        ?  1247.0327  17.2401          ?        ?      353.1        2.4       ?       ? 
1 1 1   38    2    2 o    650.3    2.8    0.0000   0.0000          ?        ?  4228.9287  36.3957          ?        ?      650.3        2.8       ?       ? 
1 1 1   38    2    3 o    439.6    2.4    0.0000   0.0000          ?        ?  1932.1665  21.0712          ?        ?      439.6        2.4       ?       ? 
1 1 1   38    2    4 f    367.8    2.6    0.0000   0.0000          ?        ?  1353.0273  19.1556          ?        ?      367.8        2.6       ?       ? 
1 1 1   38    2    5 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    2    6 o    225.6    3.3    0.0000   0.0000          ?        ?   508.9017  14.6860          ?        ?      225.6        3.3       ?       ? 
1 1 1   38    2    7 o    569.0    2.7    0.0000   0.0000          ?        ?  3237.9431  30.6490          ?        ?      569.0        2.7       ?       ? 
1 1 1   38    2    8 o    269.3    2.7    0.0000   0.0000          ?        ?   725.3605  14.6860          ?        ?      269.3        2.7       ?       ? 
1 1 1   38    2    9 o    977.1    3.8    0.0000   0.0000          ?        ?  9549.0908  74.0685          ?        ?      977.1        3.8       ?       ? 
1 1 1   38    2   10 o   1397.2    4.9    0.0000   0.0000          ?        ? 19525.9922 137.9207          ?        ?     1397.2        4.9       ?       ? 
1 1 1   38    2   11 o   1139.9    4.1    0.0000   0.0000          ?        ? 12994.5537  94.5012          ?        ?     1139.9        4.1       ?       ? 
1 1 1   38    2   12 o    372.7    2.3    0.0000   0.0000          ?        ?  1388.7845  17.2401          ?        ?      372.7        2.3       ?       ? 
1 1 1   38    2   13 o    442.4    2.7    0.0000   0.0000          ?        ?  1957.7074  23.6253          ?        ?      442.4        2.7       ?       ? 
1 1 1   38    2   14 o    595.1    2.7    0.0000   0.0000          ?        ?  3541.2407  31.9261          ?        ?      595.1        2.7       ?       ? 
1 1 1   38    2   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    2   16 o    619.0    2.7    0.0000   0.0000          ?        ?  3831.7681  33.8416          ?        ?      619.0        2.7       ?       ? 
1 1 1   38    2   17 o    206.7    3.2    0.0000   0.0000          ?        ?   427.1710  13.4090          ?        ?      206.7        3.2       ?       ? 
1 1 1   38    2   18 o    147.5    4.5    0.0000   0.0000          ?        ?   217.7359  13.4090          ?        ?      147.5        4.5       ?       ? 
1 1 1   38    2   19 o    676.7    2.9    0.0000   0.0000          ?        ?  4579.4771  39.5883          ?        ?      676.7        2.9       ?       ? 
1 1 1   38    2   20 o     51.4   16.8    0.0000   0.0000          ?        ?    25.5409  19.7942          ?        ?       51.4       16.8       ?       ? 
1 1 1   38    2   21 o    421.8    2.6    0.0000   0.0000          ?        ?  1778.9213  22.3483          ?        ?      421.8        2.6       ?       ? 
1 1 1   38    2   22 o    618.8    2.6    0.0000   0.0000          ?        ?  3829.2144  32.5646          ?        ?      618.8        2.6       ?       ? 
1 1 1   38    2   23 o    588.3    2.6    0.0000   0.0000          ?        ?  3460.7871  30.6490          ?        ?      588.3        2.6       ?       ? 
1 1 1   38    2   24 o    186.5    3.8    0.0000   0.0000          ?        ?   347.9943  14.0475          ?        ?      186.5        3.8       ?       ? 
1 1 1   38    2   25 o    130.1    5.2    0.0000   0.0000          ?        ?   169.2082  13.4090          ?        ?      130.1        5.2       ?       ? 
1 1 1   38    2   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    2   27 o    610.0    2.7    0.0000   0.0000          ?        ?  3721.3040  32.5646          ?        ?      610.0        2.7       ?       ? 
1 1 1   38    2   28 f    435.2    2.6    0.0000   0.0000          ?        ?  1893.8552  22.3483          ?        ?      435.2        2.6       ?       ? 
1 1 1   38    2   29 o    425.4    2.6    0.0000   0.0000          ?        ?  1809.5702  22.3483          ?        ?      425.4        2.6       ?       ? 
1 1 1   38    2   30 o    288.6    3.0    0.0000   0.0000          ?        ?   833.2708  17.2401          ?        ?      288.6        3.0       ?       ? 
1 1 1   38    2   31 o    367.3    2.7    0.0000   0.0000          ?        ?  1349.1962  19.7942          ?        ?      367.3        2.7       ?       ? 
1 1 1   38    2   32 o    785.9    3.0    0.0000   0.0000          ?        ?  6177.0586  47.8891          ?        ?      785.9        3.0       ?       ? 
1 1 1   38    2   33 o    127.6    5.3    0.0000   0.0000          ?        ?   162.8230  13.4090          ?        ?      127.6        5.3       ?       ? 
1 1 1   38    2   34 o    805.3    3.2    0.0000   0.0000          ?        ?  6486.1025  51.0817          ?        ?      805.3        3.2       ?       ? 
1 1 1   38    2   35 o    456.8    2.5    0.0000   0.0000          ?        ?  2086.6885  22.9868          ?        ?      456.8        2.5       ?       ? 
1 1 1   38    2   36 o    434.5    2.7    0.0000   0.0000          ?        ?  1888.7469  23.6253          ?        ?      434.5        2.7       ?       ? 
1 1 1   38    2   37 o    392.2    2.5    0.0000   0.0000          ?        ?  1538.8372  19.7942          ?        ?      392.2        2.5       ?       ? 
1 1 1   38    2   38 o    370.1    2.6    0.0000   0.0000          ?        ?  1370.2675  19.1556          ?        ?      370.1        2.6       ?       ? 
1 1 1   38    2   39 o    233.7    3.6    0.0000   0.0000          ?        ?   546.5745  16.6016          ?        ?      233.7        3.6       ?       ? 
1 1 1   38    2   40 o    204.3    3.9    0.0000   0.0000          ?        ?   417.5931  15.9630          ?        ?      204.3        3.9       ?       ? 
1 1 1   38    2   41 o    292.7    3.1    0.0000   0.0000          ?        ?   856.8960  17.8786          ?        ?      292.7        3.1       ?       ? 
1 1 1   38    2   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    2   43 o    391.4    2.7    0.0000   0.0000          ?        ?  1532.4519  21.0712          ?        ?      391.4        2.7       ?       ? 
1 1 1   38    2   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    2   45 o    150.7    5.5    0.0000   0.0000          ?        ?   227.3137  16.6016          ?        ?      150.7        5.5       ?       ? 
1 1 1   38    2   46 o     17.6    8.9    0.0000   0.0000          ?        ?   -57.4669  15.9630          ?        ?       17.6        8.9       ?       ? 
1 1 1   38    2   47 o    274.9    3.5    0.0000   0.0000          ?        ?   756.0096  19.1556          ?        ?      274.9        3.5       ?       ? 
1 1 1   38    2   48 o    190.2    4.4    0.0000   0.0000          ?        ?   362.0418  16.6016          ?        ?      190.2        4.4       ?       ? 
1 1 1   38    2   49 o    184.0    4.5    0.0000   0.0000          ?        ?   339.0550  16.6016          ?        ?      184.0        4.5       ?       ? 
1 1 1   38    2   50 o    242.4    3.8    0.0000   0.0000          ?        ?   588.0784  18.5171          ?        ?      242.4        3.8       ?       ? 
1 1 1   38    2   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    2   52 o    257.2    3.8    0.0000   0.0000          ?        ?   662.1469  19.7942          ?        ?      257.2        3.8       ?       ? 
1 1 1   38    2   53 o    144.5    6.2    0.0000   0.0000          ?        ?   209.4351  17.8786          ?        ?      144.5        6.2       ?       ? 
1 1 1   38    2   54 o     23.9   11.6    0.0000   0.0000          ?        ?   -31.9261  17.8786          ?        ?       23.9       11.6       ?       ? 
1 1 1   38    2   55 o    124.3    7.4    0.0000   0.0000          ?        ?   155.1608  18.5171          ?        ?      124.3        7.4       ?       ? 
1 1 1   38    2   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    2   57 o     24.7   12.0    0.0000   0.0000          ?        ?   -31.2876  18.5171          ?        ?       24.7       12.0       ?       ? 
1 1 1   38    2   58 o     41.9   16.1    0.0000   0.0000          ?        ?    12.1319  19.1556          ?        ?       41.9       16.1       ?       ? 
1 1 1   38    2   59 o    236.6    4.2    0.0000   0.0000          ?        ?   560.6220  19.7942          ?        ?      236.6        4.2       ?       ? 
1 1 1   38    2   60 o    122.8    8.3    0.0000   0.0000          ?        ?   151.9681  20.4327          ?        ?      122.8        8.3       ?       ? 
1 1 1   38    2   61 o    354.3    3.3    0.0000   0.0000          ?        ?  1257.2490  23.6253          ?        ?      354.3        3.3       ?       ? 
1 1 1   38    2   62 o    281.0    3.6    0.0000   0.0000          ?        ?   791.1283  20.4327          ?        ?      281.0        3.6       ?       ? 
1 1 1   38    2   63 o     19.9   10.1    0.0000   0.0000          ?        ?   -72.7915  20.4327          ?        ?       19.9       10.1       ?       ? 
1 1 1   38    2   64 o     93.1   10.3    0.0000   0.0000          ?        ?    88.1160  19.1556          ?        ?       93.1       10.3       ?       ? 
1 1 1   38    2   65 o     96.1   10.0    0.0000   0.0000          ?        ?    93.8627  19.1556          ?        ?       96.1       10.0       ?       ? 
1 1 1   38    2   66 f    118.0    8.4    0.0000   0.0000          ?        ?   141.1133  19.7942          ?        ?      118.0        8.4       ?       ? 
1 1 1   38    2   67 o    154.3    6.2    0.0000   0.0000          ?        ?   240.0841  19.1556          ?        ?      154.3        6.2       ?       ? 
1 1 1   38    3    0 o    438.4    3.4 1922.5886  30.0105  1922.5886  30.0105  1922.5886  30.0105      438.4      3.4      438.4        3.4     0.0     0.0 
1 1 1   38    3    1 o    447.8    2.4    0.0000   0.0000          ?        ?  2004.9579  21.7097          ?        ?      447.8        2.4       ?       ? 
1 1 1   38    3    2 o    735.3    3.0    0.0000   0.0000          ?        ?  5407.6396  44.0580          ?        ?      735.3        3.0       ?       ? 
1 1 1   38    3    3 o    480.8    2.5    0.0000   0.0000          ?        ?  2311.4482  24.2638          ?        ?      480.8        2.5       ?       ? 
1 1 1   38    3    4 o    956.6    3.5    0.0000   0.0000          ?        ?  9151.2920  67.6833          ?        ?      956.6        3.5       ?       ? 
1 1 1   38    3    5 o    330.9    2.7    0.0000   0.0000          ?        ?  1095.0646  17.8786          ?        ?      330.9        2.7       ?       ? 
1 1 1   38    3    6 o   1232.2    4.5    0.0000   0.0000          ?        ? 15185.3213 110.4642          ?        ?     1232.2        4.5       ?       ? 
1 1 1   38    3    7 o    147.5    4.3    0.0000   0.0000          ?        ?   217.7359  12.7704          ?        ?      147.5        4.3       ?       ? 
1 1 1   38    3    8 o    999.9    3.6    0.0000   0.0000          ?        ?  9999.2490  72.7915          ?        ?      999.9        3.6       ?       ? 
1 1 1   38    3    9 o    400.1    2.4    0.0000   0.0000          ?        ?  1600.7737  19.1556          ?        ?      400.1        2.4       ?       ? 
1 1 1   38    3   10 o    859.1    3.3    0.0000   0.0000          ?        ?  7381.9482  57.4669          ?        ?      859.1        3.3       ?       ? 
1 1 1   38    3   11 o    639.9    2.7    0.0000   0.0000          ?        ?  4094.8391  35.1187          ?        ?      639.9        2.7       ?       ? 
1 1 1   38    3   12 f    501.7    2.5    0.0000   0.0000          ?        ?  2517.0522  25.5409          ?        ?      501.7        2.5       ?       ? 
1 1 1   38    3   13 o   1149.8    4.1    0.0000   0.0000          ?        ? 13223.1436  95.1397          ?        ?     1149.8        4.1       ?       ? 
1 1 1   38    3   14 o    863.9    3.5    0.0000   0.0000          ?        ?  7464.9561  60.0210          ?        ?      863.9        3.5       ?       ? 
1 1 1   38    3   15 o    928.0    3.5    0.0000   0.0000          ?        ?  8612.3799  65.7677          ?        ?      928.0        3.5       ?       ? 
1 1 1   38    3   16 o    596.7    2.7    0.0000   0.0000          ?        ?  3560.3965  31.9261          ?        ?      596.7        2.7       ?       ? 
1 1 1   38    3   17 o    860.4    3.4    0.0000   0.0000          ?        ?  7403.0200  58.1055          ?        ?      860.4        3.4       ?       ? 
1 1 1   38    3   18 o   1328.2    4.6    0.0000   0.0000          ?        ? 17646.8223 121.3191          ?        ?     1328.2        4.6       ?       ? 
1 1 1   38    3   19 o    478.6    2.5    0.0000   0.0000          ?        ?  2291.0156  24.2638          ?        ?      478.6        2.5       ?       ? 
1 1 1   38    3   20 o    973.4    3.7    0.0000   0.0000          ?        ?  9476.9375  71.5144          ?        ?      973.4        3.7       ?       ? 
1 1 1   38    3   21 o    530.7    2.7    0.0000   0.0000          ?        ?  2817.1575  28.7335          ?        ?      530.7        2.7       ?       ? 
1 1 1   38    3   22 o    416.5    2.5    0.0000   0.0000          ?        ?  1734.8633  20.4327          ?        ?      416.5        2.5       ?       ? 
1 1 1   38    3   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    3   24 o    209.7    3.3    0.0000   0.0000          ?        ?   439.9414  14.0475          ?        ?      209.7        3.3       ?       ? 
1 1 1   38    3   25 o    531.3    2.6    0.0000   0.0000          ?        ?  2823.5427  27.4564          ?        ?      531.3        2.6       ?       ? 
1 1 1   38    3   26 o    310.7    2.5    0.0000   0.0000          ?        ?   965.4447  15.3245          ?        ?      310.7        2.5       ?       ? 
1 1 1   38    3   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    3   28 o    304.4    2.6    0.0000   0.0000          ?        ?   926.4949  15.9630          ?        ?      304.4        2.6       ?       ? 
1 1 1   38    3   29 o    374.3    2.5    0.0000   0.0000          ?        ?  1401.5549  18.5171          ?        ?      374.3        2.5       ?       ? 
1 1 1   38    3   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    3   31 o    118.5    5.9    0.0000   0.0000          ?        ?   140.4748  14.0475          ?        ?      118.5        5.9       ?       ? 
1 1 1   38    3   32 o    306.8    2.7    0.0000   0.0000          ?        ?   941.1808  16.6016          ?        ?      306.8        2.7       ?       ? 
1 1 1   38    3   33 o    553.8    2.7    0.0000   0.0000          ?        ?  3068.0964  30.0105          ?        ?      553.8        2.7       ?       ? 
1 1 1   38    3   34 f    572.8    2.6    0.0000   0.0000          ?        ?  3282.0012  29.3720          ?        ?      572.8        2.6       ?       ? 
1 1 1   38    3   35 o    531.6    2.6    0.0000   0.0000          ?        ?  2826.7354  27.4564          ?        ?      531.6        2.6       ?       ? 
1 1 1   38    3   36 o    339.5    2.6    0.0000   0.0000          ?        ?  1153.1700  17.8786          ?        ?      339.5        2.6       ?       ? 
1 1 1   38    3   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    3   38 o     21.9   10.7    0.0000   0.0000          ?        ?   -28.7335  15.3245          ?        ?       21.9       10.7       ?       ? 
1 1 1   38    3   39 o    375.2    2.6    0.0000   0.0000          ?        ?  1407.9402  19.7942          ?        ?      375.2        2.6       ?       ? 
1 1 1   38    3   40 o    552.8    2.8    0.0000   0.0000          ?        ?  3056.6030  30.6490          ?        ?      552.8        2.8       ?       ? 
1 1 1   38    3   41 o    645.8    3.0    0.0000   0.0000          ?        ?  4172.1006  38.3113          ?        ?      645.8        3.0       ?       ? 
1 1 1   38    3   42 o    357.1    2.7    0.0000   0.0000          ?        ?  1275.7662  19.1556          ?        ?      357.1        2.7       ?       ? 
1 1 1   38    3   43 o     48.2   14.6    0.0000   0.0000          ?        ?    23.6253  15.3245          ?        ?       48.2       14.6       ?       ? 
1 1 1   38    3   44 o    168.3    4.7    0.0000   0.0000          ?        ?   283.5036  15.9630          ?        ?      168.3        4.7       ?       ? 
1 1 1   38    3   45 o    297.3    3.1    0.0000   0.0000          ?        ?   884.3525  18.5171          ?        ?      297.3        3.1       ?       ? 
1 1 1   38    3   46 o    229.6    3.6    0.0000   0.0000          ?        ?   527.4188  16.6016          ?        ?      229.6        3.6       ?       ? 
1 1 1   38    3   47 o     19.1    9.6    0.0000   0.0000          ?        ?   -46.6121  15.9630          ?        ?       19.1        9.6       ?       ? 
1 1 1   38    3   48 o    296.2    3.2    0.0000   0.0000          ?        ?   877.9672  19.1556          ?        ?      296.2        3.2       ?       ? 
1 1 1   38    3   49 o    340.1    3.0    0.0000   0.0000          ?        ?  1157.6398  20.4327          ?        ?      340.1        3.0       ?       ? 
1 1 1   38    3   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    3   51 o    176.9    4.9    0.0000   0.0000          ?        ?   313.5141  17.2401          ?        ?      176.9        4.9       ?       ? 
1 1 1   38    3   52 o     33.0   14.4    0.0000   0.0000          ?        ?    -3.1926  17.8786          ?        ?       33.0       14.4       ?       ? 
1 1 1   38    3   53 o    327.8    3.2    0.0000   0.0000          ?        ?  1075.2704  21.0712          ?        ?      327.8        3.2       ?       ? 
1 1 1   38    3   54 o     28.8   13.4    0.0000   0.0000          ?        ?   -15.9630  18.5171          ?        ?       28.8       13.4       ?       ? 
1 1 1   38    3   55 o     34.1   14.6    0.0000   0.0000          ?        ?    -0.6385  17.8786          ?        ?       34.1       14.6       ?       ? 
1 1 1   38    3   56 o    210.0    4.6    0.0000   0.0000          ?        ?   441.8569  19.1556          ?        ?      210.0        4.6       ?       ? 
1 1 1   38    3   57 f     79.4   12.1    0.0000   0.0000          ?        ?    63.8522  19.1556          ?        ?       79.4       12.1       ?       ? 
1 1 1   38    3   58 o    343.4    3.3    0.0000   0.0000          ?        ?  1180.6265  22.3483          ?        ?      343.4        3.3       ?       ? 
1 1 1   38    3   59 o     65.7   15.3    0.0000   0.0000          ?        ?    45.9736  19.7942          ?        ?       65.7       15.3       ?       ? 
1 1 1   38    3   60 o    167.8    6.1    0.0000   0.0000          ?        ?   282.8651  20.4327          ?        ?      167.8        6.1       ?       ? 
1 1 1   38    3   61 o     79.2   12.1    0.0000   0.0000          ?        ?    63.8522  19.1556          ?        ?       79.2       12.1       ?       ? 
1 1 1   38    3   62 o    128.1    7.7    0.0000   0.0000          ?        ?   165.3771  19.7942          ?        ?      128.1        7.7       ?       ? 
1 1 1   38    3   63 o    223.7    4.6    0.0000   0.0000          ?        ?   501.8780  20.4327          ?        ?      223.7        4.6       ?       ? 
1 1 1   38    3   64 o     74.5   13.3    0.0000   0.0000          ?        ?    58.7440  19.1556          ?        ?       74.5       13.3       ?       ? 
1 1 1   38    3   65 o     73.1   13.6    0.0000   0.0000          ?        ?    56.8284  19.1556          ?        ?       73.1       13.6       ?       ? 
1 1 1   38    3   66 o     25.1   12.2    0.0000   0.0000          ?        ?   -31.2876  19.1556          ?        ?       25.1       12.2       ?       ? 
1 1 1   38    4    0 o   1694.6    8.5 28727.0879 288.6118 28727.0879 288.6118 28727.0879 288.6118     1694.6      8.5     1694.6        8.5     0.0     0.0 
1 1 1   38    4    1 o    245.2    3.3    0.0000   0.0000          ?        ?   601.4874  15.9630          ?        ?      245.2        3.3       ?       ? 
1 1 1   38    4    2 o    924.2    3.7    0.0000   0.0000          ?        ?  8542.7812  67.6833          ?        ?      924.2        3.7       ?       ? 
1 1 1   38    4    3 o   1518.2    5.3    0.0000   0.0000          ?        ? 23055.7383 160.9075          ?        ?     1518.2        5.3       ?       ? 
1 1 1   38    4    4 o    822.7    3.7    0.0000   0.0000          ?        ?  6769.6060  61.2981          ?        ?      822.7        3.7       ?       ? 
1 1 1   38    4    5 o   1058.3    4.0    0.0000   0.0000          ?        ? 11200.9463  83.6463          ?        ?     1058.3        4.0       ?       ? 
1 1 1   38    4    6 o    656.8    2.7    0.0000   0.0000          ?        ?  4313.8521  35.7572          ?        ?      656.8        2.7       ?       ? 
1 1 1   38    4    7 o    765.4    3.3    0.0000   0.0000          ?        ?  5858.4360  50.4432          ?        ?      765.4        3.3       ?       ? 
1 1 1   38    4    8 o   1531.9    5.2    0.0000   0.0000          ?        ? 23473.9707 160.2689          ?        ?     1531.9        5.2       ?       ? 
1 1 1   38    4    9 o    536.2    2.6    0.0000   0.0000          ?        ?  2875.2627  27.4564          ?        ?      536.2        2.6       ?       ? 
1 1 1   38    4   10 o    408.6    2.5    0.0000   0.0000          ?        ?  1669.7340  20.4327          ?        ?      408.6        2.5       ?       ? 
1 1 1   38    4   11 o   1049.9    3.9    0.0000   0.0000          ?        ? 11024.0762  81.7308          ?        ?     1049.9        3.9       ?       ? 
1 1 1   38    4   12 o    333.9    2.5    0.0000   0.0000          ?        ?  1114.8588  16.6016          ?        ?      333.9        2.5       ?       ? 
1 1 1   38    4   13 o    886.4    3.4    0.0000   0.0000          ?        ?  7858.2852  60.6596          ?        ?      886.4        3.4       ?       ? 
1 1 1   38    4   14 o    219.3    3.1    0.0000   0.0000          ?        ?   480.8068  13.4090          ?        ?      219.3        3.1       ?       ? 
1 1 1   38    4   15 o    846.2    3.3    0.0000   0.0000          ?        ?  7161.0200  55.5514          ?        ?      846.2        3.3       ?       ? 
1 1 1   38    4   16 o    652.0    2.8    0.0000   0.0000          ?        ?  4251.2769  37.0343          ?        ?      652.0        2.8       ?       ? 
1 1 1   38    4   17 o    826.3    3.2    0.0000   0.0000          ?        ?  6828.9888  52.9973          ?        ?      826.3        3.2       ?       ? 
1 1 1   38    4   18 o    697.2    2.9    0.0000   0.0000          ?        ?  4861.7036  40.2269          ?        ?      697.2        2.9       ?       ? 
1 1 1   38    4   19 o    539.3    2.6    0.0000   0.0000          ?        ?  2909.1045  28.0950          ?        ?      539.3        2.6       ?       ? 
1 1 1   38    4   20 o    524.6    2.6    0.0000   0.0000          ?        ?  2752.0283  26.8179          ?        ?      524.6        2.6       ?       ? 
1 1 1   38    4   21 o    370.1    2.6    0.0000   0.0000          ?        ?  1369.6289  19.1556          ?        ?      370.1        2.6       ?       ? 
1 1 1   38    4   22 o    186.9    3.9    0.0000   0.0000          ?        ?   349.2713  14.6860          ?        ?      186.9        3.9       ?       ? 
1 1 1   38    4   23 o     17.0    8.6    0.0000   0.0000          ?        ?   -42.7809  13.4090          ?        ?       17.0        8.6       ?       ? 
1 1 1   38    4   24 o    104.2    6.1    0.0000   0.0000          ?        ?   108.5487  12.7704          ?        ?      104.2        6.1       ?       ? 
1 1 1   38    4   25 o     27.3   12.0    0.0000   0.0000          ?        ?    -3.8311  12.7704          ?        ?       27.3       12.0       ?       ? 
1 1 1   38    4   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    4   27 f    132.7    5.3    0.0000   0.0000          ?        ?   176.2320  14.0475          ?        ?      132.7        5.3       ?       ? 
1 1 1   38    4   28 o    722.2    2.9    0.0000   0.0000          ?        ?  5216.0835  41.5039          ?        ?      722.2        2.9       ?       ? 
1 1 1   38    4   29 o    100.7    6.7    0.0000   0.0000          ?        ?   101.5249  13.4090          ?        ?      100.7        6.7       ?       ? 
1 1 1   38    4   30 o    492.7    2.7    0.0000   0.0000          ?        ?  2428.2976  26.1794          ?        ?      492.7        2.7       ?       ? 
1 1 1   38    4   31 o     37.1   13.7    0.0000   0.0000          ?        ?    10.8549  13.4090          ?        ?       37.1       13.7       ?       ? 
1 1 1   38    4   32 o    773.4    3.1    0.0000   0.0000          ?        ?  5983.5859  47.2506          ?        ?      773.4        3.1       ?       ? 
1 1 1   38    4   33 o    199.1    3.8    0.0000   0.0000          ?        ?   396.5219  15.3245          ?        ?      199.1        3.8       ?       ? 
1 1 1   38    4   34 o    406.9    2.5    0.0000   0.0000          ?        ?  1655.6865  20.4327          ?        ?      406.9        2.5       ?       ? 
1 1 1   38    4   35 o     21.3   10.5    0.0000   0.0000          ?        ?   -31.2876  15.3245          ?        ?       21.3       10.5       ?       ? 
1 1 1   38    4   36 o    383.8    2.7    0.0000   0.0000          ?        ?  1473.0693  20.4327          ?        ?      383.8        2.7       ?       ? 
1 1 1   38    4   37 o    273.3    2.9    0.0000   0.0000          ?        ?   747.0703  15.9630          ?        ?      273.3        2.9       ?       ? 
1 1 1   38    4   38 f    472.3    2.6    0.0000   0.0000          ?        ?  2230.9946  24.2638          ?        ?      472.3        2.6       ?       ? 
1 1 1   38    4   39 o    331.6    2.7    0.0000   0.0000          ?        ?  1100.1727  17.8786          ?        ?      331.6        2.7       ?       ? 
1 1 1   38    4   40 o    373.6    2.7    0.0000   0.0000          ?        ?  1395.8083  20.4327          ?        ?      373.6        2.7       ?       ? 
1 1 1   38    4   41 f    239.9    3.6    0.0000   0.0000          ?        ?   575.9465  17.2401          ?        ?      239.9        3.6       ?       ? 
1 1 1   38    4   42 o    131.0    6.1    0.0000   0.0000          ?        ?   171.7623  15.9630          ?        ?      131.0        6.1       ?       ? 
1 1 1   38    4   43 o    168.9    4.7    0.0000   0.0000          ?        ?   285.4192  15.9630          ?        ?      168.9        4.7       ?       ? 
1 1 1   38    4   44 o    168.6    5.1    0.0000   0.0000          ?        ?   284.7806  17.2401          ?        ?      168.6        5.1       ?       ? 
1 1 1   38    4   45 o     76.0   10.5    0.0000   0.0000          ?        ?    58.1055  15.9630          ?        ?       76.0       10.5       ?       ? 
1 1 1   38    4   46 o    132.6    6.3    0.0000   0.0000          ?        ?   176.2320  16.6016          ?        ?      132.6        6.3       ?       ? 
1 1 1   38    4   47 o    112.5    7.4    0.0000   0.0000          ?        ?   127.0658  16.6016          ?        ?      112.5        7.4       ?       ? 
1 1 1   38    4   48 o    300.2    3.2    0.0000   0.0000          ?        ?   901.5925  19.1556          ?        ?      300.2        3.2       ?       ? 
1 1 1   38    4   49 o    186.3    4.6    0.0000   0.0000          ?        ?   347.3558  17.2401          ?        ?      186.3        4.6       ?       ? 
1 1 1   38    4   50 f    182.1    4.9    0.0000   0.0000          ?        ?   332.0312  17.8786          ?        ?      182.1        4.9       ?       ? 
1 1 1   38    4   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    4   52 o    406.1    2.8    0.0000   0.0000          ?        ?  1649.9398  22.3483          ?        ?      406.1        2.8       ?       ? 
1 1 1   38    4   53 o    174.1    5.5    0.0000   0.0000          ?        ?   303.9363  19.1556          ?        ?      174.1        5.5       ?       ? 
1 1 1   38    4   54 o     26.6   12.7    0.0000   0.0000          ?        ?   -23.6253  18.5171          ?        ?       26.6       12.7       ?       ? 
1 1 1   38    4   55 o    293.6    3.5    0.0000   0.0000          ?        ?   862.6428  20.4327          ?        ?      293.6        3.5       ?       ? 
1 1 1   38    4   56 o    329.0    3.3    0.0000   0.0000          ?        ?  1083.5712  21.7097          ?        ?      329.0        3.3       ?       ? 
1 1 1   38    4   57 f    202.9    4.7    0.0000   0.0000          ?        ?   412.4850  19.1556          ?        ?      202.9        4.7       ?       ? 
1 1 1   38    4   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    4   59 o     41.8   16.1    0.0000   0.0000          ?        ?    12.1319  19.1556          ?        ?       41.8       16.1       ?       ? 
1 1 1   38    4   60 o    152.9    6.5    0.0000   0.0000          ?        ?   234.9760  19.7942          ?        ?      152.9        6.5       ?       ? 
1 1 1   38    4   61 o    316.5    3.4    0.0000   0.0000          ?        ?  1003.1175  21.7097          ?        ?      316.5        3.4       ?       ? 
1 1 1   38    4   62 o    187.7    5.4    0.0000   0.0000          ?        ?   353.7410  20.4327          ?        ?      187.7        5.4       ?       ? 
1 1 1   38    4   63 o    208.9    5.0    0.0000   0.0000          ?        ?   438.0258  21.0712          ?        ?      208.9        5.0       ?       ? 
1 1 1   38    4   64 o     41.1   16.1    0.0000   0.0000          ?        ?    11.4934  19.1556          ?        ?       41.1       16.1       ?       ? 
1 1 1   38    4   65 o    244.4    4.2    0.0000   0.0000          ?        ?   599.5718  20.4327          ?        ?      244.4        4.2       ?       ? 
1 1 1   38    4   66 o    137.2    7.0    0.0000   0.0000          ?        ?   190.2794  19.1556          ?        ?      137.2        7.0       ?       ? 
1 1 1   38    5    0 o    699.3    4.1 4891.0757  57.4669  4891.0757  57.4669  4891.0757  57.4669      699.3      4.1      699.3        4.1     0.0     0.0 
1 1 1   38    5    1 o    319.5    2.6    0.0000   0.0000          ?        ?  1020.9960  16.6016          ?        ?      319.5        2.6       ?       ? 
1 1 1   38    5    2 o    380.5    2.7    0.0000   0.0000          ?        ?  1448.1671  20.4327          ?        ?      380.5        2.7       ?       ? 
1 1 1   38    5    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    5    4 o    516.6    2.5    0.0000   0.0000          ?        ?  2669.0205  26.1794          ?        ?      516.6        2.5       ?       ? 
1 1 1   38    5    5 o    224.4    3.0    0.0000   0.0000          ?        ?   503.7936  13.4090          ?        ?      224.4        3.0       ?       ? 
1 1 1   38    5    6 o    305.6    2.5    0.0000   0.0000          ?        ?   934.1572  15.3245          ?        ?      305.6        2.5       ?       ? 
1 1 1   38    5    7 o    668.2    2.9    0.0000   0.0000          ?        ?  4465.1816  38.3113          ?        ?      668.2        2.9       ?       ? 
1 1 1   38    5    8 o    677.9    2.9    0.0000   0.0000          ?        ?  4595.4404  39.5883          ?        ?      677.9        2.9       ?       ? 
1 1 1   38    5    9 o    481.5    2.5    0.0000   0.0000          ?        ?  2318.4722  24.2638          ?        ?      481.5        2.5       ?       ? 
1 1 1   38    5   10 o     28.0   11.5    0.0000   0.0000          ?        ?     2.5541  10.2163          ?        ?       28.0       11.5       ?       ? 
1 1 1   38    5   11 o    642.4    2.8    0.0000   0.0000          ?        ?  4126.7651  36.3957          ?        ?      642.4        2.8       ?       ? 
1 1 1   38    5   12 o    172.5    3.5    0.0000   0.0000          ?        ?   297.5511  12.1319          ?        ?      172.5        3.5       ?       ? 
1 1 1   38    5   13 o    777.8    3.2    0.0000   0.0000          ?        ?  6050.6309  49.8047          ?        ?      777.8        3.2       ?       ? 
1 1 1   38    5   14 o    779.3    3.2    0.0000   0.0000          ?        ?  6074.2563  49.1662          ?        ?      779.3        3.2       ?       ? 
1 1 1   38    5   15 o    471.0    2.4    0.0000   0.0000          ?        ?  2218.8625  22.9868          ?        ?      471.0        2.4       ?       ? 
1 1 1   38    5   16 o    750.4    2.9    0.0000   0.0000          ?        ?  5631.1226  44.0580          ?        ?      750.4        2.9       ?       ? 
1 1 1   38    5   17 o    382.8    2.5    0.0000   0.0000          ?        ?  1465.4071  19.1556          ?        ?      382.8        2.5       ?       ? 
1 1 1   38    5   18 f    441.6    2.5    0.0000   0.0000          ?        ?  1950.0450  22.3483          ?        ?      441.6        2.5       ?       ? 
1 1 1   38    5   19 o    492.9    2.5    0.0000   0.0000          ?        ?  2429.5747  24.2638          ?        ?      492.9        2.5       ?       ? 
1 1 1   38    5   20 o   1081.3    4.0    0.0000   0.0000          ?        ? 11695.1621  85.5619          ?        ?     1081.3        4.0       ?       ? 
1 1 1   38    5   21 o    352.4    2.6    0.0000   0.0000          ?        ?  1241.9246  18.5171          ?        ?      352.4        2.6       ?       ? 
1 1 1   38    5   22 o    294.3    2.7    0.0000   0.0000          ?        ?   866.4738  15.9630          ?        ?      294.3        2.7       ?       ? 
1 1 1   38    5   23 f    987.0    3.7    0.0000   0.0000          ?        ?  9743.8398  72.1529          ?        ?      987.0        3.7       ?       ? 
1 1 1   38    5   24 o    376.9    2.4    0.0000   0.0000          ?        ?  1420.7106  17.8786          ?        ?      376.9        2.4       ?       ? 
1 1 1   38    5   25 o    556.1    2.6    0.0000   0.0000          ?        ?  3092.9988  28.7335          ?        ?      556.1        2.6       ?       ? 
1 1 1   38    5   26 o     27.4   12.2    0.0000   0.0000          ?        ?    -5.1082  13.4090          ?        ?       27.4       12.2       ?       ? 
1 1 1   38    5   27 o    618.8    2.7    0.0000   0.0000          ?        ?  3829.8525  33.8416          ?        ?      618.8        2.7       ?       ? 
1 1 1   38    5   28 o    423.6    2.5    0.0000   0.0000          ?        ?  1794.2457  21.0712          ?        ?      423.6        2.5       ?       ? 
1 1 1   38    5   29 o    219.7    3.3    0.0000   0.0000          ?        ?   482.7224  14.6860          ?        ?      219.7        3.3       ?       ? 
1 1 1   38    5   30 o    625.1    2.8    0.0000   0.0000          ?        ?  3907.7524  35.1187          ?        ?      625.1        2.8       ?       ? 
1 1 1   38    5   31 o    507.0    2.6    0.0000   0.0000          ?        ?  2570.6880  26.8179          ?        ?      507.0        2.6       ?       ? 
1 1 1   38    5   32 o    804.7    3.1    0.0000   0.0000          ?        ?  6477.1636  49.8047          ?        ?      804.7        3.1       ?       ? 
1 1 1   38    5   33 o    534.8    2.7    0.0000   0.0000          ?        ?  2860.5769  29.3720          ?        ?      534.8        2.7       ?       ? 
1 1 1   38    5   34 f    162.5    4.9    0.0000   0.0000          ?        ?   264.3480  15.9630          ?        ?      162.5        4.9       ?       ? 
1 1 1   38    5   35 o    888.8    3.3    0.0000   0.0000          ?        ?  7901.7051  58.7440          ?        ?      888.8        3.3       ?       ? 
1 1 1   38    5   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    5   37 o    444.7    2.6    0.0000   0.0000          ?        ?  1978.1399  22.9868          ?        ?      444.7        2.6       ?       ? 
1 1 1   38    5   38 o    156.3    4.9    0.0000   0.0000          ?        ?   244.5538  15.3245          ?        ?      156.3        4.9       ?       ? 
1 1 1   38    5   39 o    266.5    3.1    0.0000   0.0000          ?        ?   710.6746  16.6016          ?        ?      266.5        3.1       ?       ? 
1 1 1   38    5   40 o    293.3    3.0    0.0000   0.0000          ?        ?   860.7272  17.8786          ?        ?      293.3        3.0       ?       ? 
1 1 1   38    5   41 o    350.0    2.7    0.0000   0.0000          ?        ?  1225.3230  19.1556          ?        ?      350.0        2.7       ?       ? 
1 1 1   38    5   42 f    321.1    3.0    0.0000   0.0000          ?        ?  1031.2124  19.1556          ?        ?      321.1        3.0       ?       ? 
1 1 1   38    5   43 o    253.1    3.4    0.0000   0.0000          ?        ?   641.0757  17.2401          ?        ?      253.1        3.4       ?       ? 
1 1 1   38    5   44 o     53.1   14.6    0.0000   0.0000          ?        ?    29.3720  15.9630          ?        ?       53.1       14.6       ?       ? 
1 1 1   38    5   45 o    266.5    3.4    0.0000   0.0000          ?        ?   710.6746  17.8786          ?        ?      266.5        3.4       ?       ? 
1 1 1   38    5   46 o    217.9    4.0    0.0000   0.0000          ?        ?   475.0601  17.2401          ?        ?      217.9        4.0       ?       ? 
1 1 1   38    5   47 o    402.6    2.7    0.0000   0.0000          ?        ?  1621.8450  21.7097          ?        ?      402.6        2.7       ?       ? 
1 1 1   38    5   48 o    147.4    5.6    0.0000   0.0000          ?        ?   217.7359  16.6016          ?        ?      147.4        5.6       ?       ? 
1 1 1   38    5   49 o    221.5    4.2    0.0000   0.0000          ?        ?   491.0231  18.5171          ?        ?      221.5        4.2       ?       ? 
1 1 1   38    5   50 o    201.2    4.4    0.0000   0.0000          ?        ?   405.4612  17.8786          ?        ?      201.2        4.4       ?       ? 
1 1 1   38    5   51 o    174.5    5.3    0.0000   0.0000          ?        ?   305.2133  18.5171          ?        ?      174.5        5.3       ?       ? 
1 1 1   38    5   52 o    178.3    5.2    0.0000   0.0000          ?        ?   318.6223  18.5171          ?        ?      178.3        5.2       ?       ? 
1 1 1   38    5   53 o     21.4   10.6    0.0000   0.0000          ?        ?   -40.8654  17.2401          ?        ?       21.4       10.6       ?       ? 
1 1 1   38    5   54 f     25.9   12.4    0.0000   0.0000          ?        ?   -23.6253  17.8786          ?        ?       25.9       12.4       ?       ? 
1 1 1   38    5   55 f    286.6    3.5    0.0000   0.0000          ?        ?   822.4159  19.7942          ?        ?      286.6        3.5       ?       ? 
1 1 1   38    5   56 o    140.6    6.8    0.0000   0.0000          ?        ?   198.5802  19.1556          ?        ?      140.6        6.8       ?       ? 
1 1 1   38    5   57 o    227.9    4.3    0.0000   0.0000          ?        ?   520.3951  19.7942          ?        ?      227.9        4.3       ?       ? 
1 1 1   38    5   58 o    132.6    7.2    0.0000   0.0000          ?        ?   176.8705  19.1556          ?        ?      132.6        7.2       ?       ? 
1 1 1   38    5   59 o     99.5    9.9    0.0000   0.0000          ?        ?   100.2479  19.7942          ?        ?       99.5        9.9       ?       ? 
1 1 1   38    5   60 o    141.9    6.8    0.0000   0.0000          ?        ?   202.4114  19.1556          ?        ?      141.9        6.8       ?       ? 
1 1 1   38    5   61 o     57.9   16.0    0.0000   0.0000          ?        ?    35.7572  19.1556          ?        ?       57.9       16.0       ?       ? 
1 1 1   38    5   62 o    199.5    5.4    0.0000   0.0000          ?        ?   399.7145  21.7097          ?        ?      199.5        5.4       ?       ? 
1 1 1   38    5   63 o     31.3   14.4    0.0000   0.0000          ?        ?   -15.3245  21.0712          ?        ?       31.3       14.4       ?       ? 
1 1 1   38    5   64 o     32.8   14.8    0.0000   0.0000          ?        ?    -8.9393  20.4327          ?        ?       32.8       14.8       ?       ? 
1 1 1   38    5   65 o     83.1   11.5    0.0000   0.0000          ?        ?    70.8759  19.1556          ?        ?       83.1       11.5       ?       ? 
1 1 1   38    6    0 o    986.6    5.5 9735.5391 108.5487  9735.5391 108.5487  9735.5391 108.5487      986.6      5.5      986.6        5.5     0.0     0.0 
1 1 1   38    6    1 o   1010.6    3.9    0.0000   0.0000          ?        ? 10214.4297  78.5382          ?        ?     1010.6        3.9       ?       ? 
1 1 1   38    6    2 o    285.2    4.0    0.0000   0.0000          ?        ?   813.4766  22.9868          ?        ?      285.2        4.0       ?       ? 
1 1 1   38    6    3 o   1388.8    5.1    0.0000   0.0000          ?        ? 19294.2070 143.0288          ?        ?     1388.8        5.1       ?       ? 
1 1 1   38    6    4 o    337.5    2.7    0.0000   0.0000          ?        ?  1139.1226  18.5171          ?        ?      337.5        2.7       ?       ? 
1 1 1   38    6    5 o     21.8   10.0    0.0000   0.0000          ?        ?    -8.3008  10.2163          ?        ?       21.8       10.0       ?       ? 
1 1 1   38    6    6 o    635.4    2.8    0.0000   0.0000          ?        ?  4037.3721  35.7572          ?        ?      635.4        2.8       ?       ? 
1 1 1   38    6    7 o    349.3    2.5    0.0000   0.0000          ?        ?  1220.2148  17.2401          ?        ?      349.3        2.5       ?       ? 
1 1 1   38    6    8 o   1128.8    4.2    0.0000   0.0000          ?        ? 12744.2529  95.1397          ?        ?     1128.8        4.2       ?       ? 
1 1 1   38    6    9 o    840.1    3.5    0.0000   0.0000          ?        ?  7058.8564  58.7440          ?        ?      840.1        3.5       ?       ? 
1 1 1   38    6   10 o    253.1    2.6    0.0000   0.0000          ?        ?   640.4372  13.4090          ?        ?      253.1        2.6       ?       ? 
1 1 1   38    6   11 o    775.3    3.1    0.0000   0.0000          ?        ?  6011.6812  47.8891          ?        ?      775.3        3.1       ?       ? 
1 1 1   38    6   12 o    417.0    2.4    0.0000   0.0000          ?        ?  1739.3329  19.7942          ?        ?      417.0        2.4       ?       ? 
1 1 1   38    6   13 o    635.9    2.8    0.0000   0.0000          ?        ?  4044.3962  35.1187          ?        ?      635.9        2.8       ?       ? 
1 1 1   38    6   14 o    899.9    3.4    0.0000   0.0000          ?        ?  8099.6470  61.2981          ?        ?      899.9        3.4       ?       ? 
1 1 1   38    6   15 o    174.7    3.7    0.0000   0.0000          ?        ?   305.2133  12.7704          ?        ?      174.7        3.7       ?       ? 
1 1 1   38    6   16 o    247.8    2.8    0.0000   0.0000          ?        ?   614.2578  14.0475          ?        ?      247.8        2.8       ?       ? 
1 1 1   38    6   17 o    612.3    2.7    0.0000   0.0000          ?        ?  3749.3992  33.2031          ?        ?      612.3        2.7       ?       ? 
1 1 1   38    6   18 o    674.7    2.8    0.0000   0.0000          ?        ?  4552.6592  38.3113          ?        ?      674.7        2.8       ?       ? 
1 1 1   38    6   19 o    361.8    2.6    0.0000   0.0000          ?        ?  1308.9694  18.5171          ?        ?      361.8        2.6       ?       ? 
1 1 1   38    6   20 o    398.4    2.6    0.0000   0.0000          ?        ?  1587.3647  21.0712          ?        ?      398.4        2.6       ?       ? 
1 1 1   38    6   21 o   1047.3    3.8    0.0000   0.0000          ?        ? 10971.0781  79.8152          ?        ?     1047.3        3.8       ?       ? 
1 1 1   38    6   22 o    654.5    2.7    0.0000   0.0000          ?        ?  4283.8418  35.7572          ?        ?      654.5        2.7       ?       ? 
1 1 1   38    6   23 o   1003.5    3.8    0.0000   0.0000          ?        ? 10073.9551  77.2611          ?        ?     1003.5        3.8       ?       ? 
1 1 1   38    6   24 o    212.6    3.3    0.0000   0.0000          ?        ?   452.0733  14.0475          ?        ?      212.6        3.3       ?       ? 
1 1 1   38    6   25 o    106.0    6.3    0.0000   0.0000          ?        ?   112.3798  13.4090          ?        ?      106.0        6.3       ?       ? 
1 1 1   38    6   26 o    727.2    3.0    0.0000   0.0000          ?        ?  5289.5132  44.0580          ?        ?      727.2        3.0       ?       ? 
1 1 1   38    6   27 o    521.3    2.6    0.0000   0.0000          ?        ?  2718.1865  27.4564          ?        ?      521.3        2.6       ?       ? 
1 1 1   38    6   28 o    650.0    2.8    0.0000   0.0000          ?        ?  4226.3750  35.7572          ?        ?      650.0        2.8       ?       ? 
1 1 1   38    6   29 o    554.3    2.6    0.0000   0.0000          ?        ?  3073.2046  28.7335          ?        ?      554.3        2.6       ?       ? 
1 1 1   38    6   30 o    162.7    4.5    0.0000   0.0000          ?        ?   264.9865  14.6860          ?        ?      162.7        4.5       ?       ? 
1 1 1   38    6   31 o     16.9    8.6    0.0000   0.0000          ?        ?   -47.8891  14.0475          ?        ?       16.9        8.6       ?       ? 
1 1 1   38    6   32 o    297.5    2.7    0.0000   0.0000          ?        ?   884.9910  15.9630          ?        ?      297.5        2.7       ?       ? 
1 1 1   38    6   33 o    718.6    3.0    0.0000   0.0000          ?        ?  5165.0015  43.4195          ?        ?      718.6        3.0       ?       ? 
1 1 1   38    6   34 o    613.8    2.7    0.0000   0.0000          ?        ?  3768.5547  32.5646          ?        ?      613.8        2.7       ?       ? 
1 1 1   38    6   35 o     66.1   12.0    0.0000   0.0000          ?        ?    45.3350  15.3245          ?        ?       66.1       12.0       ?       ? 
1 1 1   38    6   36 o    428.2    2.5    0.0000   0.0000          ?        ?  1833.8342  21.7097          ?        ?      428.2        2.5       ?       ? 
1 1 1   38    6   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    6   38 o    241.3    3.6    0.0000   0.0000          ?        ?   582.3317  17.2401          ?        ?      241.3        3.6       ?       ? 
1 1 1   38    6   39 f    112.1    6.8    0.0000   0.0000          ?        ?   125.7888  15.3245          ?        ?      112.1        6.8       ?       ? 
1 1 1   38    6   40 o     87.4    8.8    0.0000   0.0000          ?        ?    76.6226  15.3245          ?        ?       87.4        8.8       ?       ? 
1 1 1   38    6   41 o    194.0    4.1    0.0000   0.0000          ?        ?   376.7278  15.9630          ?        ?      194.0        4.1       ?       ? 
1 1 1   38    6   42 f    224.8    3.6    0.0000   0.0000          ?        ?   505.7091  15.9630          ?        ?      224.8        3.6       ?       ? 
1 1 1   38    6   43 o    254.1    3.4    0.0000   0.0000          ?        ?   646.1838  17.2401          ?        ?      254.1        3.4       ?       ? 
1 1 1   38    6   44 o     67.9   12.2    0.0000   0.0000          ?        ?    47.8891  15.9630          ?        ?       67.9       12.2       ?       ? 
1 1 1   38    6   45 o    147.4    5.4    0.0000   0.0000          ?        ?   217.7359  15.9630          ?        ?      147.4        5.4       ?       ? 
1 1 1   38    6   46 o    472.1    2.6    0.0000   0.0000          ?        ?  2229.7175  24.2638          ?        ?      472.1        2.6       ?       ? 
1 1 1   38    6   47 f    252.3    3.7    0.0000   0.0000          ?        ?   637.2446  18.5171          ?        ?      252.3        3.7       ?       ? 
1 1 1   38    6   48 o    332.6    3.1    0.0000   0.0000          ?        ?  1106.5580  20.4327          ?        ?      332.6        3.1       ?       ? 
1 1 1   38    6   49 o    165.2    5.2    0.0000   0.0000          ?        ?   273.2873  17.2401          ?        ?      165.2        5.2       ?       ? 
1 1 1   38    6   50 o    433.5    2.7    0.0000   0.0000          ?        ?  1880.4462  23.6253          ?        ?      433.5        2.7       ?       ? 
1 1 1   38    6   51 o    247.2    3.9    0.0000   0.0000          ?        ?   611.7037  19.1556          ?        ?      247.2        3.9       ?       ? 
1 1 1   38    6   52 o    103.3    8.7    0.0000   0.0000          ?        ?   107.2716  17.8786          ?        ?      103.3        8.7       ?       ? 
1 1 1   38    6   53 o    243.8    3.9    0.0000   0.0000          ?        ?   595.1021  19.1556          ?        ?      243.8        3.9       ?       ? 
1 1 1   38    6   54 o    241.7    4.1    0.0000   0.0000          ?        ?   584.8858  19.7942          ?        ?      241.7        4.1       ?       ? 
1 1 1   38    6   55 o     36.9   15.3    0.0000   0.0000          ?        ?     3.8311  18.5171          ?        ?       36.9       15.3       ?       ? 
1 1 1   38    6   56 o     43.8   16.3    0.0000   0.0000          ?        ?    15.3245  19.1556          ?        ?       43.8       16.3       ?       ? 
1 1 1   38    6   57 o    129.0    7.4    0.0000   0.0000          ?        ?   167.2927  19.1556          ?        ?      129.0        7.4       ?       ? 
1 1 1   38    6   58 o     98.7    9.4    0.0000   0.0000          ?        ?    98.3323  18.5171          ?        ?       98.7        9.4       ?       ? 
1 1 1   38    6   59 o    147.1    6.7    0.0000   0.0000          ?        ?   217.7359  19.7942          ?        ?      147.1        6.7       ?       ? 
1 1 1   38    6   60 o    148.0    6.5    0.0000   0.0000          ?        ?   220.2900  19.1556          ?        ?      148.0        6.5       ?       ? 
1 1 1   38    6   61 o    261.5    3.9    0.0000   0.0000          ?        ?   685.1337  20.4327          ?        ?      261.5        3.9       ?       ? 
1 1 1   38    6   62 f    150.5    6.6    0.0000   0.0000          ?        ?   227.9522  19.7942          ?        ?      150.5        6.6       ?       ? 
1 1 1   38    6   63 f     73.9   13.9    0.0000   0.0000          ?        ?    58.1055  19.7942          ?        ?       73.9       13.9       ?       ? 
1 1 1   38    6   64 f    194.7    5.2    0.0000   0.0000          ?        ?   381.1974  20.4327          ?        ?      194.7        5.2       ?       ? 
1 1 1   38    7    0 o    354.4    3.5 1256.6106  24.9023  1256.6106  24.9023  1256.6106  24.9023      354.4      3.5      354.4        3.5     0.0     0.0 
1 1 1   38    7    1 o    595.7    2.6    0.0000   0.0000          ?        ?  3548.9031  31.2876          ?        ?      595.7        2.6       ?       ? 
1 1 1   38    7    2 o    476.2    2.5    0.0000   0.0000          ?        ?  2268.0288  23.6253          ?        ?      476.2        2.5       ?       ? 
1 1 1   38    7    3 o    531.2    2.6    0.0000   0.0000          ?        ?  2821.6270  27.4564          ?        ?      531.2        2.6       ?       ? 
1 1 1   38    7    4 o    910.7    3.5    0.0000   0.0000          ?        ?  8294.3955  64.4907          ?        ?      910.7        3.5       ?       ? 
1 1 1   38    7    5 o    193.6    3.3    0.0000   0.0000          ?        ?   374.8122  12.7704          ?        ?      193.6        3.3       ?       ? 
1 1 1   38    7    6 o   1291.9    4.7    0.0000   0.0000          ?        ? 16694.1484 122.5962          ?        ?     1291.9        4.7       ?       ? 
1 1 1   38    7    7 o    730.3    3.1    0.0000   0.0000          ?        ?  5334.2100  45.3350          ?        ?      730.3        3.1       ?       ? 
1 1 1   38    7    8 o    855.0    3.3    0.0000   0.0000          ?        ?  7311.7109  56.8284          ?        ?      855.0        3.3       ?       ? 
1 1 1   38    7    9 o    394.5    2.4    0.0000   0.0000          ?        ?  1556.7157  19.1556          ?        ?      394.5        2.4       ?       ? 
1 1 1   38    7   10 o    507.4    2.5    0.0000   0.0000          ?        ?  2574.5193  25.5409          ?        ?      507.4        2.5       ?       ? 
1 1 1   38    7   11 o    412.0    2.3    0.0000   0.0000          ?        ?  1697.1904  19.1556          ?        ?      412.0        2.3       ?       ? 
1 1 1   38    7   12 o    564.6    2.5    0.0000   0.0000          ?        ?  3188.1384  28.0950          ?        ?      564.6        2.5       ?       ? 
1 1 1   38    7   13 o    473.6    2.5    0.0000   0.0000          ?        ?  2243.1265  23.6253          ?        ?      473.6        2.5       ?       ? 
1 1 1   38    7   14 o    773.8    3.1    0.0000   0.0000          ?        ?  5988.6943  48.5276          ?        ?      773.8        3.1       ?       ? 
1 1 1   38    7   15 o    194.7    3.4    0.0000   0.0000          ?        ?   379.2819  13.4090          ?        ?      194.7        3.4       ?       ? 
1 1 1   38    7   16 o    832.2    3.3    0.0000   0.0000          ?        ?  6927.3213  55.5514          ?        ?      832.2        3.3       ?       ? 
1 1 1   38    7   17 o    966.6    3.8    0.0000   0.0000          ?        ?  9345.4023  72.7915          ?        ?      966.6        3.8       ?       ? 
1 1 1   38    7   18 o    703.9    3.1    0.0000   0.0000          ?        ?  4955.5664  43.4195          ?        ?      703.9        3.1       ?       ? 
1 1 1   38    7   19 o    339.7    2.4    0.0000   0.0000          ?        ?  1153.8086  16.6016          ?        ?      339.7        2.4       ?       ? 
1 1 1   38    7   20 o    890.8    3.4    0.0000   0.0000          ?        ?  7937.4624  60.6596          ?        ?      890.8        3.4       ?       ? 
1 1 1   38    7   21 o    548.5    2.6    0.0000   0.0000          ?        ?  3009.3523  28.0950          ?        ?      548.5        2.6       ?       ? 
1 1 1   38    7   22 o    313.0    2.7    0.0000   0.0000          ?        ?   980.1307  16.6016          ?        ?      313.0        2.7       ?       ? 
1 1 1   38    7   23 o    235.1    3.1    0.0000   0.0000          ?        ?   552.9597  14.6860          ?        ?      235.1        3.1       ?       ? 
1 1 1   38    7   24 o    225.8    3.3    0.0000   0.0000          ?        ?   510.1788  14.6860          ?        ?      225.8        3.3       ?       ? 
1 1 1   38    7   25 o    159.8    4.0    0.0000   0.0000          ?        ?   255.4086  12.7704          ?        ?      159.8        4.0       ?       ? 
1 1 1   38    7   26 o    265.1    2.9    0.0000   0.0000          ?        ?   703.0123  15.3245          ?        ?      265.1        2.9       ?       ? 
1 1 1   38    7   27 o    583.4    2.7    0.0000   0.0000          ?        ?  3404.5974  31.2876          ?        ?      583.4        2.7       ?       ? 
1 1 1   38    7   28 o    373.6    2.6    0.0000   0.0000          ?        ?  1395.8083  19.1556          ?        ?      373.6        2.6       ?       ? 
1 1 1   38    7   29 o    529.5    2.7    0.0000   0.0000          ?        ?  2803.7485  28.0950          ?        ?      529.5        2.7       ?       ? 
1 1 1   38    7   30 o    585.8    2.6    0.0000   0.0000          ?        ?  3432.6921  30.6490          ?        ?      585.8        2.6       ?       ? 
1 1 1   38    7   31 o    430.6    2.4    0.0000   0.0000          ?        ?  1854.9053  21.0712          ?        ?      430.6        2.4       ?       ? 
1 1 1   38    7   32 o    363.3    2.7    0.0000   0.0000          ?        ?  1320.4628  19.7942          ?        ?      363.3        2.7       ?       ? 
1 1 1   38    7   33 o    485.5    2.5    0.0000   0.0000          ?        ?  2358.0603  24.2638          ?        ?      485.5        2.5       ?       ? 
1 1 1   38    7   34 o    317.6    2.8    0.0000   0.0000          ?        ?  1008.8642  17.8786          ?        ?      317.6        2.8       ?       ? 
1 1 1   38    7   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    7   36 o    144.6    5.3    0.0000   0.0000          ?        ?   209.4351  15.3245          ?        ?      144.6        5.3       ?       ? 
1 1 1   38    7   37 o    642.4    2.7    0.0000   0.0000          ?        ?  4127.4038  35.1187          ?        ?      642.4        2.7       ?       ? 
1 1 1   38    7   38 o    244.0    3.4    0.0000   0.0000          ?        ?   595.7407  16.6016          ?        ?      244.0        3.4       ?       ? 
1 1 1   38    7   39 o    263.0    3.2    0.0000   0.0000          ?        ?   692.1575  16.6016          ?        ?      263.0        3.2       ?       ? 
1 1 1   38    7   40 o    474.8    2.5    0.0000   0.0000          ?        ?  2254.6199  23.6253          ?        ?      474.8        2.5       ?       ? 
1 1 1   38    7   41 o    370.2    2.8    0.0000   0.0000          ?        ?  1370.9059  20.4327          ?        ?      370.2        2.8       ?       ? 
1 1 1   38    7   42 o    182.3    4.6    0.0000   0.0000          ?        ?   332.6698  16.6016          ?        ?      182.3        4.6       ?       ? 
1 1 1   38    7   43 o    389.5    2.7    0.0000   0.0000          ?        ?  1517.7659  21.0712          ?        ?      389.5        2.7       ?       ? 
1 1 1   38    7   44 o    189.0    4.4    0.0000   0.0000          ?        ?   357.5721  16.6016          ?        ?      189.0        4.4       ?       ? 
1 1 1   38    7   45 o     73.8   11.7    0.0000   0.0000          ?        ?    54.9129  17.2401          ?        ?       73.8       11.7       ?       ? 
1 1 1   38    7   46 o    302.0    3.3    0.0000   0.0000          ?        ?   912.4474  19.7942          ?        ?      302.0        3.3       ?       ? 
1 1 1   38    7   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    7   48 o    201.2    4.6    0.0000   0.0000          ?        ?   405.4612  18.5171          ?        ?      201.2        4.6       ?       ? 
1 1 1   38    7   49 o    198.3    4.7    0.0000   0.0000          ?        ?   393.9678  18.5171          ?        ?      198.3        4.7       ?       ? 
1 1 1   38    7   50 o    437.3    2.8    0.0000   0.0000          ?        ?  1913.6494  24.2638          ?        ?      437.3        2.8       ?       ? 
1 1 1   38    7   51 o    162.2    5.7    0.0000   0.0000          ?        ?   263.7094  18.5171          ?        ?      162.2        5.7       ?       ? 
1 1 1   38    7   52 o     94.2    9.8    0.0000   0.0000          ?        ?    89.3930  18.5171          ?        ?       94.2        9.8       ?       ? 
1 1 1   38    7   53 o    133.7    6.9    0.0000   0.0000          ?        ?   179.4246  18.5171          ?        ?      133.7        6.9       ?       ? 
1 1 1   38    7   54 o    297.0    3.4    0.0000   0.0000          ?        ?   883.0754  20.4327          ?        ?      297.0        3.4       ?       ? 
1 1 1   38    7   55 o     49.7   15.9    0.0000   0.0000          ?        ?    24.9023  17.8786          ?        ?       49.7       15.9       ?       ? 
1 1 1   38    7   56 o     20.1   10.1    0.0000   0.0000          ?        ?   -57.4669  18.5171          ?        ?       20.1       10.1       ?       ? 
1 1 1   38    7   57 o    129.5    7.2    0.0000   0.0000          ?        ?   168.5697  18.5171          ?        ?      129.5        7.2       ?       ? 
1 1 1   38    7   58 o    112.5    8.2    0.0000   0.0000          ?        ?   127.7043  18.5171          ?        ?      112.5        8.2       ?       ? 
1 1 1   38    7   59 o    204.4    4.8    0.0000   0.0000          ?        ?   418.8702  19.7942          ?        ?      204.4        4.8       ?       ? 
1 1 1   38    7   60 f    194.9    5.1    0.0000   0.0000          ?        ?   381.1974  19.7942          ?        ?      194.9        5.1       ?       ? 
1 1 1   38    7   61 o    228.9    4.3    0.0000   0.0000          ?        ?   525.5033  19.7942          ?        ?      228.9        4.3       ?       ? 
1 1 1   38    7   62 f     23.3   11.5    0.0000   0.0000          ?        ?   -37.0343  18.5171          ?        ?       23.3       11.5       ?       ? 
1 1 1   38    7   63 o    124.7    7.4    0.0000   0.0000          ?        ?   157.0763  18.5171          ?        ?      124.7        7.4       ?       ? 
1 1 1   38    7   64 o    173.5    5.3    0.0000   0.0000          ?        ?   302.6593  18.5171          ?        ?      173.5        5.3       ?       ? 
1 1 1   38    8    0 f   1381.0    6.8 19078.3867 187.0868 19078.3867 187.0868 19078.3867 187.0868     1381.0      6.8     1381.0        6.8     0.0     0.0 
1 1 1   38    8    1 f    375.1    2.8    0.0000   0.0000          ?        ?  1407.3016  21.0712          ?        ?      375.1        2.8       ?       ? 
1 1 1   38    8    2 o    177.2    3.2    0.0000   0.0000          ?        ?   314.1526  11.4934          ?        ?      177.2        3.2       ?       ? 
1 1 1   38    8    3 o    386.4    2.5    0.0000   0.0000          ?        ?  1492.8635  19.1556          ?        ?      386.4        2.5       ?       ? 
1 1 1   38    8    4 o    496.1    2.6    0.0000   0.0000          ?        ?  2461.5010  25.5409          ?        ?      496.1        2.6       ?       ? 
1 1 1   38    8    5 o    862.3    3.4    0.0000   0.0000          ?        ?  7437.5000  58.1055          ?        ?      862.3        3.4       ?       ? 
1 1 1   38    8    6 o    607.3    2.7    0.0000   0.0000          ?        ?  3688.1008  33.2031          ?        ?      607.3        2.7       ?       ? 
1 1 1   38    8    7 o    630.5    2.8    0.0000   0.0000          ?        ?  3975.4355  35.7572          ?        ?      630.5        2.8       ?       ? 
1 1 1   38    8    8 o     27.5   11.6    0.0000   0.0000          ?        ?     0.6385  10.8549          ?        ?       27.5       11.6       ?       ? 
1 1 1   38    8    9 o    291.7    2.3    0.0000   0.0000          ?        ?   851.1494  13.4090          ?        ?      291.7        2.3       ?       ? 
1 1 1   38    8   10 o    127.8    4.5    0.0000   0.0000          ?        ?   163.4615  11.4934          ?        ?      127.8        4.5       ?       ? 
1 1 1   38    8   11 o    185.7    3.3    0.0000   0.0000          ?        ?   344.8017  12.1319          ?        ?      185.7        3.3       ?       ? 
1 1 1   38    8   12 o    424.1    2.3    0.0000   0.0000          ?        ?  1798.7155  19.7942          ?        ?      424.1        2.3       ?       ? 
1 1 1   38    8   13 o    160.0    3.6    0.0000   0.0000          ?        ?   256.0471  11.4934          ?        ?      160.0        3.6       ?       ? 
1 1 1   38    8   14 o    520.1    2.5    0.0000   0.0000          ?        ?  2705.4163  26.1794          ?        ?      520.1        2.5       ?       ? 
1 1 1   38    8   15 o    489.4    2.5    0.0000   0.0000          ?        ?  2395.0947  24.9023          ?        ?      489.4        2.5       ?       ? 
1 1 1   38    8   16 o    536.1    2.6    0.0000   0.0000          ?        ?  2874.6245  27.4564          ?        ?      536.1        2.6       ?       ? 
1 1 1   38    8   17 o     88.2    6.2    0.0000   0.0000          ?        ?    77.8996  10.8549          ?        ?       88.2        6.2       ?       ? 
1 1 1   38    8   18 o    466.9    2.4    0.0000   0.0000          ?        ?  2179.9128  22.3483          ?        ?      466.9        2.4       ?       ? 
1 1 1   38    8   19 o    569.2    2.6    0.0000   0.0000          ?        ?  3239.8586  29.3720          ?        ?      569.2        2.6       ?       ? 
1 1 1   38    8   20 o    572.8    2.7    0.0000   0.0000          ?        ?  3282.0012  30.6490          ?        ?      572.8        2.7       ?       ? 
1 1 1   38    8   21 o    300.2    2.7    0.0000   0.0000          ?        ?   901.5925  15.9630          ?        ?      300.2        2.7       ?       ? 
1 1 1   38    8   22 o    436.3    2.3    0.0000   0.0000          ?        ?  1904.0715  20.4327          ?        ?      436.3        2.3       ?       ? 
1 1 1   38    8   23 o    425.7    2.4    0.0000   0.0000          ?        ?  1812.1243  20.4327          ?        ?      425.7        2.4       ?       ? 
1 1 1   38    8   24 o    285.5    2.6    0.0000   0.0000          ?        ?   815.3921  14.6860          ?        ?      285.5        2.6       ?       ? 
1 1 1   38    8   25 o    297.1    2.7    0.0000   0.0000          ?        ?   883.0754  15.9630          ?        ?      297.1        2.7       ?       ? 
1 1 1   38    8   26 o    954.7    3.5    0.0000   0.0000          ?        ?  9118.0889  66.4062          ?        ?      954.7        3.5       ?       ? 
1 1 1   38    8   27 o    465.2    2.7    0.0000   0.0000          ?        ?  2164.5884  24.9023          ?        ?      465.2        2.7       ?       ? 
1 1 1   38    8   28 o    232.1    3.3    0.0000   0.0000          ?        ?   538.9123  15.3245          ?        ?      232.1        3.3       ?       ? 
1 1 1   38    8   29 f    324.9    2.7    0.0000   0.0000          ?        ?  1056.1147  17.2401          ?        ?      324.9        2.7       ?       ? 
1 1 1   38    8   30 o    235.3    3.1    0.0000   0.0000          ?        ?   553.5982  14.6860          ?        ?      235.3        3.1       ?       ? 
1 1 1   38    8   31 o    133.2    5.3    0.0000   0.0000          ?        ?   177.5090  14.0475          ?        ?      133.2        5.3       ?       ? 
1 1 1   38    8   32 o     36.8   14.1    0.0000   0.0000          ?        ?     8.9393  14.6860          ?        ?       36.8       14.1       ?       ? 
1 1 1   38    8   33 o    115.2    6.1    0.0000   0.0000          ?        ?   132.8125  14.0475          ?        ?      115.2        6.1       ?       ? 
1 1 1   38    8   34 o    347.6    2.8    0.0000   0.0000          ?        ?  1208.7214  19.1556          ?        ?      347.6        2.8       ?       ? 
1 1 1   38    8   35 o    370.2    2.6    0.0000   0.0000          ?        ?  1370.9059  19.1556          ?        ?      370.2        2.6       ?       ? 
1 1 1   38    8   36 o    512.3    2.7    0.0000   0.0000          ?        ?  2624.9624  27.4564          ?        ?      512.3        2.7       ?       ? 
1 1 1   38    8   37 o    547.9    2.6    0.0000   0.0000          ?        ?  3002.9670  28.0950          ?        ?      547.9        2.6       ?       ? 
1 1 1   38    8   38 o    181.4    4.4    0.0000   0.0000          ?        ?   329.4771  15.9630          ?        ?      181.4        4.4       ?       ? 
1 1 1   38    8   39 o     33.7   14.1    0.0000   0.0000          ?        ?     1.9156  15.9630          ?        ?       33.7       14.1       ?       ? 
1 1 1   38    8   40 o     23.6   11.3    0.0000   0.0000          ?        ?   -21.7097  15.3245          ?        ?       23.6       11.3       ?       ? 
1 1 1   38    8   41 o    352.0    2.7    0.0000   0.0000          ?        ?  1239.3705  19.1556          ?        ?      352.0        2.7       ?       ? 
1 1 1   38    8   42 o    430.8    2.5    0.0000   0.0000          ?        ?  1856.1825  21.7097          ?        ?      430.8        2.5       ?       ? 
1 1 1   38    8   43 o     98.7    8.1    0.0000   0.0000          ?        ?    97.6938  15.9630          ?        ?       98.7        8.1       ?       ? 
1 1 1   38    8   44 o    103.4    7.7    0.0000   0.0000          ?        ?   107.2716  15.9630          ?        ?      103.4        7.7       ?       ? 
1 1 1   38    8   45 o    221.9    3.9    0.0000   0.0000          ?        ?   492.9387  17.2401          ?        ?      221.9        3.9       ?       ? 
1 1 1   38    8   46 f    126.7    6.8    0.0000   0.0000          ?        ?   160.9075  17.2401          ?        ?      126.7        6.8       ?       ? 
1 1 1   38    8   47 f     39.6   15.5    0.0000   0.0000          ?        ?     9.5778  17.8786          ?        ?       39.6       15.5       ?       ? 
1 1 1   38    8   48 o    321.1    3.1    0.0000   0.0000          ?        ?  1031.8510  19.7942          ?        ?      321.1        3.1       ?       ? 
1 1 1   38    8   49 o     51.7   15.5    0.0000   0.0000          ?        ?    27.4564  17.2401          ?        ?       51.7       15.5       ?       ? 
1 1 1   38    8   50 o    237.7    3.9    0.0000   0.0000          ?        ?   565.7302  18.5171          ?        ?      237.7        3.9       ?       ? 
1 1 1   38    8   51 o     37.2   15.0    0.0000   0.0000          ?        ?     6.3852  17.2401          ?        ?       37.2       15.0       ?       ? 
1 1 1   38    8   52 f    135.8    6.3    0.0000   0.0000          ?        ?   185.1713  17.2401          ?        ?      135.8        6.3       ?       ? 
1 1 1   38    8   53 o     66.0   14.0    0.0000   0.0000          ?        ?    45.9736  17.8786          ?        ?       66.0       14.0       ?       ? 
1 1 1   38    8   54 o    179.1    5.3    0.0000   0.0000          ?        ?   321.8149  19.1556          ?        ?      179.1        5.3       ?       ? 
1 1 1   38    8   55 o     64.9   14.6    0.0000   0.0000          ?        ?    44.6965  18.5171          ?        ?       64.9       14.6       ?       ? 
1 1 1   38    8   56 o     35.8   15.1    0.0000   0.0000          ?        ?     1.9156  18.5171          ?        ?       35.8       15.1       ?       ? 
1 1 1   38    8   57 o    125.9    7.4    0.0000   0.0000          ?        ?   159.6304  18.5171          ?        ?      125.9        7.4       ?       ? 
1 1 1   38    8   58 o    137.3    6.7    0.0000   0.0000          ?        ?   189.6409  18.5171          ?        ?      137.3        6.7       ?       ? 
1 1 1   38    8   59 f     26.3   12.6    0.0000   0.0000          ?        ?   -26.8179  19.1556          ?        ?       26.3       12.6       ?       ? 
1 1 1   38    8   60 o    100.4    9.2    0.0000   0.0000          ?        ?   102.1635  18.5171          ?        ?      100.4        9.2       ?       ? 
1 1 1   38    8   61 o     64.4   15.1    0.0000   0.0000          ?        ?    44.6965  19.1556          ?        ?       64.4       15.1       ?       ? 
1 1 1   38    8   62 o    172.9    5.5    0.0000   0.0000          ?        ?   300.7437  19.1556          ?        ?      172.9        5.5       ?       ? 
1 1 1   38    8   63 o     27.9   13.1    0.0000   0.0000          ?        ?   -17.8786  18.5171          ?        ?       27.9       13.1       ?       ? 
1 1 1   38    9    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    9    1 o    429.9    2.5    0.0000   0.0000          ?        ?  1847.8816  21.0712          ?        ?      429.9        2.5       ?       ? 
1 1 1   38    9    2 o    521.2    2.5    0.0000   0.0000          ?        ?  2716.2710  25.5409          ?        ?      521.2        2.5       ?       ? 
1 1 1   38    9    3 o    244.5    2.5    0.0000   0.0000          ?        ?   597.6562  12.1319          ?        ?      244.5        2.5       ?       ? 
1 1 1   38    9    4 o    375.8    2.3    0.0000   0.0000          ?        ?  1412.4098  17.2401          ?        ?      375.8        2.3       ?       ? 
1 1 1   38    9    5 f    803.7    3.1    0.0000   0.0000          ?        ?  6460.5615  49.8047          ?        ?      803.7        3.1       ?       ? 
1 1 1   38    9    6 o    266.7    2.6    0.0000   0.0000          ?        ?   711.3131  14.0475          ?        ?      266.7        2.6       ?       ? 
1 1 1   38    9    7 o    970.5    3.7    0.0000   0.0000          ?        ?  9420.7480  70.8759          ?        ?      970.5        3.7       ?       ? 
1 1 1   38    9    8 o    394.7    2.4    0.0000   0.0000          ?        ?  1557.9928  19.1556          ?        ?      394.7        2.4       ?       ? 
1 1 1   38    9    9 o     85.7    6.3    0.0000   0.0000          ?        ?    73.4300  10.8549          ?        ?       85.7        6.3       ?       ? 
1 1 1   38    9   10 o    197.3    3.1    0.0000   0.0000          ?        ?   389.4982  12.1319          ?        ?      197.3        3.1       ?       ? 
1 1 1   38    9   11 o    944.4    3.8    0.0000   0.0000          ?        ?  8920.1475  70.8759          ?        ?      944.4        3.8       ?       ? 
1 1 1   38    9   12 o    379.5    2.4    0.0000   0.0000          ?        ?  1440.5049  18.5171          ?        ?      379.5        2.4       ?       ? 
1 1 1   38    9   13 o    676.4    2.9    0.0000   0.0000          ?        ?  4576.2847  38.9498          ?        ?      676.4        2.9       ?       ? 
1 1 1   38    9   14 o    661.4    2.8    0.0000   0.0000          ?        ?  4374.5117  36.3957          ?        ?      661.4        2.8       ?       ? 
1 1 1   38    9   15 o    585.9    2.6    0.0000   0.0000          ?        ?  3433.3308  30.6490          ?        ?      585.9        2.6       ?       ? 
1 1 1   38    9   16 o     67.3    8.5    0.0000   0.0000          ?        ?    45.3350  11.4934          ?        ?       67.3        8.5       ?       ? 
1 1 1   38    9   17 o    259.2    2.7    0.0000   0.0000          ?        ?   671.7247  14.0475          ?        ?      259.2        2.7       ?       ? 
1 1 1   38    9   18 o    462.4    2.4    0.0000   0.0000          ?        ?  2138.4089  22.3483          ?        ?      462.4        2.4       ?       ? 
1 1 1   38    9   19 o    334.2    2.4    0.0000   0.0000          ?        ?  1116.7743  15.9630          ?        ?      334.2        2.4       ?       ? 
1 1 1   38    9   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    9   21 o    654.7    2.8    0.0000   0.0000          ?        ?  4287.0342  37.0343          ?        ?      654.7        2.8       ?       ? 
1 1 1   38    9   22 o    817.2    3.1    0.0000   0.0000          ?        ?  6680.2129  51.0817          ?        ?      817.2        3.1       ?       ? 
1 1 1   38    9   23 f    348.2    2.5    0.0000   0.0000          ?        ?  1212.5525  17.2401          ?        ?      348.2        2.5       ?       ? 
1 1 1   38    9   24 f    329.1    2.5    0.0000   0.0000          ?        ?  1082.9327  16.6016          ?        ?      329.1        2.5       ?       ? 
1 1 1   38    9   25 o    166.0    4.0    0.0000   0.0000          ?        ?   275.8413  13.4090          ?        ?      166.0        4.0       ?       ? 
1 1 1   38    9   26 o    493.4    2.7    0.0000   0.0000          ?        ?  2435.3215  26.1794          ?        ?      493.4        2.7       ?       ? 
1 1 1   38    9   27 o    246.0    3.0    0.0000   0.0000          ?        ?   605.3185  14.6860          ?        ?      246.0        3.0       ?       ? 
1 1 1   38    9   28 o    637.0    2.7    0.0000   0.0000          ?        ?  4058.4434  34.4802          ?        ?      637.0        2.7       ?       ? 
1 1 1   38    9   29 o    393.2    2.5    0.0000   0.0000          ?        ?  1546.4994  19.7942          ?        ?      393.2        2.5       ?       ? 
1 1 1   38    9   30 o    646.2    2.8    0.0000   0.0000          ?        ?  4177.2085  35.7572          ?        ?      646.2        2.8       ?       ? 
1 1 1   38    9   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    9   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38    9   33 o     69.5   10.1    0.0000   0.0000          ?        ?    48.5276  14.0475          ?        ?       69.5       10.1       ?       ? 
1 1 1   38    9   34 o     67.2   10.5    0.0000   0.0000          ?        ?    45.3350  14.0475          ?        ?       67.2       10.5       ?       ? 
1 1 1   38    9   35 o    157.5    5.1    0.0000   0.0000          ?        ?   248.3849  15.9630          ?        ?      157.5        5.1       ?       ? 
1 1 1   38    9   36 o    172.6    4.3    0.0000   0.0000          ?        ?   298.1896  14.6860          ?        ?      172.6        4.3       ?       ? 
1 1 1   38    9   37 o    347.7    2.6    0.0000   0.0000          ?        ?  1209.3599  17.8786          ?        ?      347.7        2.6       ?       ? 
1 1 1   38    9   38 o    102.5    7.5    0.0000   0.0000          ?        ?   105.3561  15.3245          ?        ?      102.5        7.5       ?       ? 
1 1 1   38    9   39 o    182.7    4.2    0.0000   0.0000          ?        ?   333.9468  15.3245          ?        ?      182.7        4.2       ?       ? 
1 1 1   38    9   40 o    357.7    2.9    0.0000   0.0000          ?        ?  1280.2358  20.4327          ?        ?      357.7        2.9       ?       ? 
1 1 1   38    9   41 o    103.7    7.7    0.0000   0.0000          ?        ?   107.9102  15.9630          ?        ?      103.7        7.7       ?       ? 
1 1 1   38    9   42 o     51.6   15.1    0.0000   0.0000          ?        ?    27.4564  16.6016          ?        ?       51.6       15.1       ?       ? 
1 1 1   38    9   43 o     23.0   11.1    0.0000   0.0000          ?        ?   -26.8179  15.9630          ?        ?       23.0       11.1       ?       ? 
1 1 1   38    9   44 o    315.5    2.9    0.0000   0.0000          ?        ?   996.0938  18.5171          ?        ?      315.5        2.9       ?       ? 
1 1 1   38    9   45 o    199.0    4.3    0.0000   0.0000          ?        ?   396.5219  17.2401          ?        ?      199.0        4.3       ?       ? 
1 1 1   38    9   46 o     18.9    9.6    0.0000   0.0000          ?        ?   -52.3588  16.6016          ?        ?       18.9        9.6       ?       ? 
1 1 1   38    9   47 o    537.2    2.7    0.0000   0.0000          ?        ?  2886.7563  28.7335          ?        ?      537.2        2.7       ?       ? 
1 1 1   38    9   48 o    256.7    3.7    0.0000   0.0000          ?        ?   659.5928  19.1556          ?        ?      256.7        3.7       ?       ? 
1 1 1   38    9   49 o     20.2   10.1    0.0000   0.0000          ?        ?   -52.3588  17.8786          ?        ?       20.2       10.1       ?       ? 
1 1 1   38    9   50 o    130.3    7.1    0.0000   0.0000          ?        ?   170.4853  18.5171          ?        ?      130.3        7.1       ?       ? 
1 1 1   38    9   51 o    314.6    3.2    0.0000   0.0000          ?        ?   990.3471  20.4327          ?        ?      314.6        3.2       ?       ? 
1 1 1   38    9   52 o     42.7   15.8    0.0000   0.0000          ?        ?    14.6860  17.8786          ?        ?       42.7       15.8       ?       ? 
1 1 1   38    9   53 o    277.1    3.6    0.0000   0.0000          ?        ?   768.7800  19.7942          ?        ?      277.1        3.6       ?       ? 
1 1 1   38    9   54 o     18.8    9.6    0.0000   0.0000          ?        ?   -67.6833  18.5171          ?        ?       18.8        9.6       ?       ? 
1 1 1   38    9   55 o    227.7    4.5    0.0000   0.0000          ?        ?   519.7566  20.4327          ?        ?      227.7        4.5       ?       ? 
1 1 1   38    9   56 o    319.9    3.2    0.0000   0.0000          ?        ?  1024.8273  20.4327          ?        ?      319.9        3.2       ?       ? 
1 1 1   38    9   57 o    343.6    3.3    0.0000   0.0000          ?        ?  1182.5420  22.9868          ?        ?      343.6        3.3       ?       ? 
1 1 1   38    9   58 o    173.6    5.5    0.0000   0.0000          ?        ?   302.6593  19.1556          ?        ?      173.6        5.5       ?       ? 
1 1 1   38    9   59 o     23.2   11.4    0.0000   0.0000          ?        ?   -41.5039  19.1556          ?        ?       23.2       11.4       ?       ? 
1 1 1   38    9   60 o     29.7   13.7    0.0000   0.0000          ?        ?   -14.6860  19.1556          ?        ?       29.7       13.7       ?       ? 
1 1 1   38    9   61 o    234.9    4.3    0.0000   0.0000          ?        ?   553.5982  20.4327          ?        ?      234.9        4.3       ?       ? 
1 1 1   38    9   62 o     23.4   11.5    0.0000   0.0000          ?        ?   -39.5883  19.1556          ?        ?       23.4       11.5       ?       ? 
1 1 1   38   10    0 o     10.5    7.8  -51.7203  14.0475   -51.7203  14.0475   -51.7203  14.0475       10.5      7.8       10.5        7.8     0.0     0.0 
1 1 1   38   10    1 o    318.9    2.5    0.0000   0.0000          ?        ?  1017.1650  15.9630          ?        ?      318.9        2.5       ?       ? 
1 1 1   38   10    2 o    543.7    2.7    0.0000   0.0000          ?        ?  2956.3552  29.3720          ?        ?      543.7        2.7       ?       ? 
1 1 1   38   10    3 o    229.1    2.6    0.0000   0.0000          ?        ?   524.8647  12.1319          ?        ?      229.1        2.6       ?       ? 
1 1 1   38   10    4 o    173.2    3.3    0.0000   0.0000          ?        ?   300.1052  11.4934          ?        ?      173.2        3.3       ?       ? 
1 1 1   38   10    5 o    851.9    3.4    0.0000   0.0000          ?        ?  7258.0752  58.1055          ?        ?      851.9        3.4       ?       ? 
1 1 1   38   10    6 o    913.1    3.6    0.0000   0.0000          ?        ?  8338.4541  66.4062          ?        ?      913.1        3.6       ?       ? 
1 1 1   38   10    7 o    883.5    3.5    0.0000   0.0000          ?        ?  7806.5654  61.2981          ?        ?      883.5        3.5       ?       ? 
1 1 1   38   10    8 o    420.5    2.4    0.0000   0.0000          ?        ?  1768.0663  19.7942          ?        ?      420.5        2.4       ?       ? 
1 1 1   38   10    9 o    521.5    2.6    0.0000   0.0000          ?        ?  2720.1021  26.8179          ?        ?      521.5        2.6       ?       ? 
1 1 1   38   10   10 o    855.4    3.3    0.0000   0.0000          ?        ?  7319.3735  56.8284          ?        ?      855.4        3.3       ?       ? 
1 1 1   38   10   11 o    609.8    2.7    0.0000   0.0000          ?        ?  3718.7500  32.5646          ?        ?      609.8        2.7       ?       ? 
1 1 1   38   10   12 o    323.2    2.3    0.0000   0.0000          ?        ?  1044.6215  14.6860          ?        ?      323.2        2.3       ?       ? 
1 1 1   38   10   13 o    543.5    2.6    0.0000   0.0000          ?        ?  2954.4397  28.0950          ?        ?      543.5        2.6       ?       ? 
1 1 1   38   10   14 o    773.4    3.3    0.0000   0.0000          ?        ?  5982.3091  50.4432          ?        ?      773.4        3.3       ?       ? 
1 1 1   38   10   15 o    812.8    3.4    0.0000   0.0000          ?        ?  6608.0605  54.9129          ?        ?      812.8        3.4       ?       ? 
1 1 1   38   10   16 o    330.2    2.4    0.0000   0.0000          ?        ?  1090.5950  15.9630          ?        ?      330.2        2.4       ?       ? 
1 1 1   38   10   17 o    124.3    4.6    0.0000   0.0000          ?        ?   154.5222  11.4934          ?        ?      124.3        4.6       ?       ? 
1 1 1   38   10   18 o    138.8    4.4    0.0000   0.0000          ?        ?   192.8335  12.1319          ?        ?      138.8        4.4       ?       ? 
1 1 1   38   10   19 o    440.7    2.3    0.0000   0.0000          ?        ?  1942.3828  20.4327          ?        ?      440.7        2.3       ?       ? 
1 1 1   38   10   20 o    504.8    2.4    0.0000   0.0000          ?        ?  2548.9785  24.2638          ?        ?      504.8        2.4       ?       ? 
1 1 1   38   10   21 o    484.9    2.4    0.0000   0.0000          ?        ?  2351.6750  23.6253          ?        ?      484.9        2.4       ?       ? 
1 1 1   38   10   22 o    279.8    2.6    0.0000   0.0000          ?        ?   782.8275  14.6860          ?        ?      279.8        2.6       ?       ? 
1 1 1   38   10   23 o     35.6   13.0    0.0000   0.0000          ?        ?    10.2163  12.1319          ?        ?       35.6       13.0       ?       ? 
1 1 1   38   10   24 o     65.8   10.2    0.0000   0.0000          ?        ?    43.4195  13.4090          ?        ?       65.8       10.2       ?       ? 
1 1 1   38   10   25 o    526.5    2.5    0.0000   0.0000          ?        ?  2772.4609  26.1794          ?        ?      526.5        2.5       ?       ? 
1 1 1   38   10   26 o    157.2    4.3    0.0000   0.0000          ?        ?   247.1079  13.4090          ?        ?      157.2        4.3       ?       ? 
1 1 1   38   10   27 o    158.4    4.0    0.0000   0.0000          ?        ?   250.9390  12.7704          ?        ?      158.4        4.0       ?       ? 
1 1 1   38   10   28 o    261.2    2.9    0.0000   0.0000          ?        ?   682.5797  15.3245          ?        ?      261.2        2.9       ?       ? 
1 1 1   38   10   29 o    200.5    3.7    0.0000   0.0000          ?        ?   402.2686  14.6860          ?        ?      200.5        3.7       ?       ? 
1 1 1   38   10   30 o    133.9    5.2    0.0000   0.0000          ?        ?   179.4246  14.0475          ?        ?      133.9        5.2       ?       ? 
1 1 1   38   10   31 f    190.7    3.7    0.0000   0.0000          ?        ?   363.9573  14.0475          ?        ?      190.7        3.7       ?       ? 
1 1 1   38   10   32 o    425.9    2.5    0.0000   0.0000          ?        ?  1814.0400  21.0712          ?        ?      425.9        2.5       ?       ? 
1 1 1   38   10   33 f    150.7    4.9    0.0000   0.0000          ?        ?   227.3137  14.6860          ?        ?      150.7        4.9       ?       ? 
1 1 1   38   10   34 o    310.2    2.8    0.0000   0.0000          ?        ?   962.2521  17.2401          ?        ?      310.2        2.8       ?       ? 
1 1 1   38   10   35 o    376.2    2.6    0.0000   0.0000          ?        ?  1415.6024  19.7942          ?        ?      376.2        2.6       ?       ? 
1 1 1   38   10   36 o    320.2    2.7    0.0000   0.0000          ?        ?  1025.4658  17.2401          ?        ?      320.2        2.7       ?       ? 
1 1 1   38   10   37 o    465.3    2.5    0.0000   0.0000          ?        ?  2165.2268  23.6253          ?        ?      465.3        2.5       ?       ? 
1 1 1   38   10   38 o    247.9    3.2    0.0000   0.0000          ?        ?   614.8964  15.9630          ?        ?      247.9        3.2       ?       ? 
1 1 1   38   10   39 o    447.7    2.6    0.0000   0.0000          ?        ?  2004.9579  22.9868          ?        ?      447.7        2.6       ?       ? 
1 1 1   38   10   40 o    329.1    2.9    0.0000   0.0000          ?        ?  1083.5712  19.1556          ?        ?      329.1        2.9       ?       ? 
1 1 1   38   10   41 o    294.6    2.9    0.0000   0.0000          ?        ?   868.3894  17.2401          ?        ?      294.6        2.9       ?       ? 
1 1 1   38   10   42 o    574.8    2.6    0.0000   0.0000          ?        ?  3304.9878  30.0105          ?        ?      574.8        2.6       ?       ? 
1 1 1   38   10   43 f    154.6    5.4    0.0000   0.0000          ?        ?   239.4456  16.6016          ?        ?      154.6        5.4       ?       ? 
1 1 1   38   10   44 o     33.6   14.2    0.0000   0.0000          ?        ?     0.6385  16.6016          ?        ?       33.6       14.2       ?       ? 
1 1 1   38   10   45 o    173.1    5.0    0.0000   0.0000          ?        ?   300.1052  17.2401          ?        ?      173.1        5.0       ?       ? 
1 1 1   38   10   46 o     20.2   10.1    0.0000   0.0000          ?        ?   -47.8891  17.2401          ?        ?       20.2       10.1       ?       ? 
1 1 1   38   10   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   10   48 o    186.4    5.0    0.0000   0.0000          ?        ?   347.9943  18.5171          ?        ?      186.4        5.0       ?       ? 
1 1 1   38   10   49 f    276.1    3.7    0.0000   0.0000          ?        ?   763.0333  20.4327          ?        ?      276.1        3.7       ?       ? 
1 1 1   38   10   50 o    481.4    2.9    0.0000   0.0000          ?        ?  2319.1106  27.4564          ?        ?      481.4        2.9       ?       ? 
1 1 1   38   10   51 o     41.0   15.7    0.0000   0.0000          ?        ?    12.1319  17.8786          ?        ?       41.0       15.7       ?       ? 
1 1 1   38   10   52 o     20.2   10.1    0.0000   0.0000          ?        ?   -56.8284  18.5171          ?        ?       20.2       10.1       ?       ? 
1 1 1   38   10   53 o    406.3    2.9    0.0000   0.0000          ?        ?  1652.4939  23.6253          ?        ?      406.3        2.9       ?       ? 
1 1 1   38   10   54 o     82.1   11.3    0.0000   0.0000          ?        ?    68.3218  18.5171          ?        ?       82.1       11.3       ?       ? 
1 1 1   38   10   55 o    147.4    6.5    0.0000   0.0000          ?        ?   218.3744  19.1556          ?        ?      147.4        6.5       ?       ? 
1 1 1   38   10   56 o    200.4    4.8    0.0000   0.0000          ?        ?   402.9071  19.1556          ?        ?      200.4        4.8       ?       ? 
1 1 1   38   10   57 o     42.0   16.0    0.0000   0.0000          ?        ?    13.4090  18.5171          ?        ?       42.0       16.0       ?       ? 
1 1 1   38   10   58 o     21.2   10.6    0.0000   0.0000          ?        ?   -49.1662  18.5171          ?        ?       21.2       10.6       ?       ? 
1 1 1   38   10   59 o    182.3    5.3    0.0000   0.0000          ?        ?   333.9468  19.1556          ?        ?      182.3        5.3       ?       ? 
1 1 1   38   10   60 o    129.2    7.7    0.0000   0.0000          ?        ?   168.5697  19.7942          ?        ?      129.2        7.7       ?       ? 
1 1 1   38   10   61 o     38.6   15.7    0.0000   0.0000          ?        ?     7.0237  19.1556          ?        ?       38.6       15.7       ?       ? 
1 1 1   38   10   62 o     21.5   10.7    0.0000   0.0000          ?        ?   -43.4195  17.8786          ?        ?       21.5       10.7       ?       ? 
1 1 1   38   11    0 o    180.0    3.9  324.3690  14.0475   324.3690  14.0475   324.3690  14.0475      180.0      3.9      180.0        3.9     0.0     0.0 
1 1 1   38   11    1 o    224.7    2.7    0.0000   0.0000          ?        ?   505.0706  12.1319          ?        ?      224.7        2.7       ?       ? 
1 1 1   38   11    2 o    162.0    3.2    0.0000   0.0000          ?        ?   262.4324  10.2163          ?        ?      162.0        3.2       ?       ? 
1 1 1   38   11    3 o    482.5    2.4    0.0000   0.0000          ?        ?  2328.0498  23.6253          ?        ?      482.5        2.4       ?       ? 
1 1 1   38   11    4 o    337.9    2.3    0.0000   0.0000          ?        ?  1141.6766  15.3245          ?        ?      337.9        2.3       ?       ? 
1 1 1   38   11    5 o    470.0    2.4    0.0000   0.0000          ?        ?  2209.2849  22.9868          ?        ?      470.0        2.4       ?       ? 
1 1 1   38   11    6 o    191.6    2.8    0.0000   0.0000          ?        ?   367.1499  10.8549          ?        ?      191.6        2.8       ?       ? 
1 1 1   38   11    7 o    580.6    2.6    0.0000   0.0000          ?        ?  3371.3943  30.6490          ?        ?      580.6        2.6       ?       ? 
1 1 1   38   11    8 o    123.3    3.9    0.0000   0.0000          ?        ?   151.9681   9.5778          ?        ?      123.3        3.9       ?       ? 
1 1 1   38   11    9 o    261.6    2.4    0.0000   0.0000          ?        ?   684.4952  12.7704          ?        ?      261.6        2.4       ?       ? 
1 1 1   38   11   10 o    428.5    2.5    0.0000   0.0000          ?        ?  1836.3882  21.0712          ?        ?      428.5        2.5       ?       ? 
1 1 1   38   11   11 o    447.1    2.4    0.0000   0.0000          ?        ?  1999.2113  21.7097          ?        ?      447.1        2.4       ?       ? 
1 1 1   38   11   12 o    282.4    2.4    0.0000   0.0000          ?        ?   797.5135  13.4090          ?        ?      282.4        2.4       ?       ? 
1 1 1   38   11   13 o     24.3   10.7    0.0000   0.0000          ?        ?    -3.1926  10.2163          ?        ?       24.3       10.7       ?       ? 
1 1 1   38   11   14 o    467.8    2.4    0.0000   0.0000          ?        ?  2188.2136  22.3483          ?        ?      467.8        2.4       ?       ? 
1 1 1   38   11   15 o    223.4    2.9    0.0000   0.0000          ?        ?   499.3239  12.7704          ?        ?      223.4        2.9       ?       ? 
1 1 1   38   11   16 o    165.3    3.7    0.0000   0.0000          ?        ?   273.2873  12.1319          ?        ?      165.3        3.7       ?       ? 
1 1 1   38   11   17 o    510.0    2.6    0.0000   0.0000          ?        ?  2601.3372  26.1794          ?        ?      510.0        2.6       ?       ? 
1 1 1   38   11   18 o    478.1    2.4    0.0000   0.0000          ?        ?  2286.5459  22.9868          ?        ?      478.1        2.4       ?       ? 
1 1 1   38   11   19 o    102.3    5.9    0.0000   0.0000          ?        ?   104.7175  12.1319          ?        ?      102.3        5.9       ?       ? 
1 1 1   38   11   20 o    125.5    4.8    0.0000   0.0000          ?        ?   157.7148  12.1319          ?        ?      125.5        4.8       ?       ? 
1 1 1   38   11   21 o    378.1    2.4    0.0000   0.0000          ?        ?  1429.6499  17.8786          ?        ?      378.1        2.4       ?       ? 
1 1 1   38   11   22 o    507.4    2.5    0.0000   0.0000          ?        ?  2575.1577  25.5409          ?        ?      507.4        2.5       ?       ? 
1 1 1   38   11   23 o    302.6    2.6    0.0000   0.0000          ?        ?   915.6400  15.9630          ?        ?      302.6        2.6       ?       ? 
1 1 1   38   11   24 o    462.3    2.5    0.0000   0.0000          ?        ?  2137.7703  22.9868          ?        ?      462.3        2.5       ?       ? 
1 1 1   38   11   25 o    381.3    2.3    0.0000   0.0000          ?        ?  1453.9137  17.8786          ?        ?      381.3        2.3       ?       ? 
1 1 1   38   11   26 o    379.8    2.4    0.0000   0.0000          ?        ?  1442.4203  18.5171          ?        ?      379.8        2.4       ?       ? 
1 1 1   38   11   27 f    470.9    2.5    0.0000   0.0000          ?        ?  2218.2241  23.6253          ?        ?      470.9        2.5       ?       ? 
1 1 1   38   11   28 o    305.7    2.7    0.0000   0.0000          ?        ?   934.7956  16.6016          ?        ?      305.7        2.7       ?       ? 
1 1 1   38   11   29 o    153.2    4.6    0.0000   0.0000          ?        ?   234.9760  14.0475          ?        ?      153.2        4.6       ?       ? 
1 1 1   38   11   30 o    225.0    3.5    0.0000   0.0000          ?        ?   506.3477  15.9630          ?        ?      225.0        3.5       ?       ? 
1 1 1   38   11   31 o    245.0    3.0    0.0000   0.0000          ?        ?   600.2103  14.6860          ?        ?      245.0        3.0       ?       ? 
1 1 1   38   11   32 o    221.0    3.5    0.0000   0.0000          ?        ?   488.4691  15.3245          ?        ?      221.0        3.5       ?       ? 
1 1 1   38   11   33 o    152.0    4.6    0.0000   0.0000          ?        ?   231.1448  14.0475          ?        ?      152.0        4.6       ?       ? 
1 1 1   38   11   34 o    315.7    2.7    0.0000   0.0000          ?        ?   996.7323  17.2401          ?        ?      315.7        2.7       ?       ? 
1 1 1   38   11   35 o    308.2    2.7    0.0000   0.0000          ?        ?   950.1202  16.6016          ?        ?      308.2        2.7       ?       ? 
1 1 1   38   11   36 o    236.8    3.4    0.0000   0.0000          ?        ?   561.2605  15.9630          ?        ?      236.8        3.4       ?       ? 
1 1 1   38   11   37 o    386.0    2.6    0.0000   0.0000          ?        ?  1490.3094  19.7942          ?        ?      386.0        2.6       ?       ? 
1 1 1   38   11   38 o    196.4    4.4    0.0000   0.0000          ?        ?   386.3056  17.2401          ?        ?      196.4        4.4       ?       ? 
1 1 1   38   11   39 o    474.9    2.6    0.0000   0.0000          ?        ?  2255.8967  24.2638          ?        ?      474.9        2.6       ?       ? 
1 1 1   38   11   40 o    474.0    2.6    0.0000   0.0000          ?        ?  2247.5962  24.9023          ?        ?      474.0        2.6       ?       ? 
1 1 1   38   11   41 o    284.8    3.1    0.0000   0.0000          ?        ?   811.5610  17.8786          ?        ?      284.8        3.1       ?       ? 
1 1 1   38   11   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   11   43 o    256.7    3.4    0.0000   0.0000          ?        ?   659.5928  17.2401          ?        ?      256.7        3.4       ?       ? 
1 1 1   38   11   44 o    168.0    5.1    0.0000   0.0000          ?        ?   282.8651  17.2401          ?        ?      168.0        5.1       ?       ? 
1 1 1   38   11   45 o    298.9    3.1    0.0000   0.0000          ?        ?   893.9303  18.5171          ?        ?      298.9        3.1       ?       ? 
1 1 1   38   11   46 o     22.8   11.2    0.0000   0.0000          ?        ?   -37.0343  17.8786          ?        ?       22.8       11.2       ?       ? 
1 1 1   38   11   47 o    462.6    2.8    0.0000   0.0000          ?        ?  2141.6016  26.1794          ?        ?      462.6        2.8       ?       ? 
1 1 1   38   11   48 o    364.5    3.0    0.0000   0.0000          ?        ?  1329.4020  21.7097          ?        ?      364.5        3.0       ?       ? 
1 1 1   38   11   49 o    413.9    2.8    0.0000   0.0000          ?        ?  1714.4305  22.9868          ?        ?      413.9        2.8       ?       ? 
1 1 1   38   11   50 f    311.5    3.3    0.0000   0.0000          ?        ?   971.1914  20.4327          ?        ?      311.5        3.3       ?       ? 
1 1 1   38   11   51 o    335.3    3.2    0.0000   0.0000          ?        ?  1125.0751  21.7097          ?        ?      335.3        3.2       ?       ? 
1 1 1   38   11   52 o     25.4   12.3    0.0000   0.0000          ?        ?   -30.6490  19.1556          ?        ?       25.4       12.3       ?       ? 
1 1 1   38   11   53 o     92.7   10.0    0.0000   0.0000          ?        ?    86.8389  18.5171          ?        ?       92.7       10.0       ?       ? 
1 1 1   38   11   54 o    101.5    9.4    0.0000   0.0000          ?        ?   104.0790  19.1556          ?        ?      101.5        9.4       ?       ? 
1 1 1   38   11   55 o    134.8    6.9    0.0000   0.0000          ?        ?   182.6172  18.5171          ?        ?      134.8        6.9       ?       ? 
1 1 1   38   11   56 o    132.8    7.0    0.0000   0.0000          ?        ?   177.5090  18.5171          ?        ?      132.8        7.0       ?       ? 
1 1 1   38   11   57 o     41.3   16.1    0.0000   0.0000          ?        ?    11.4934  19.1556          ?        ?       41.3       16.1       ?       ? 
1 1 1   38   11   58 o    184.8    5.4    0.0000   0.0000          ?        ?   342.8861  19.7942          ?        ?      184.8        5.4       ?       ? 
1 1 1   38   11   59 o    192.2    4.8    0.0000   0.0000          ?        ?   370.9810  18.5171          ?        ?      192.2        4.8       ?       ? 
1 1 1   38   11   60 o     67.7   14.1    0.0000   0.0000          ?        ?    49.1662  18.5171          ?        ?       67.7       14.1       ?       ? 
1 1 1   38   11   61 o     78.6   12.6    0.0000   0.0000          ?        ?    63.8522  19.7942          ?        ?       78.6       12.6       ?       ? 
1 1 1   38   12    0 o    331.4    5.7 1099.5342  37.6728  1099.5342  37.6728  1099.5342  37.6728      331.4      5.7      331.4        5.7     0.0     0.0 
1 1 1   38   12    1 o    859.1    3.3    0.0000   0.0000          ?        ?  7381.9482  56.8284          ?        ?      859.1        3.3       ?       ? 
1 1 1   38   12    2 o    324.4    3.9    0.0000   0.0000          ?        ?  1052.9221  25.5409          ?        ?      324.4        3.9       ?       ? 
1 1 1   38   12    3 o    903.2    3.4    0.0000   0.0000          ?        ?  8160.3062  61.9366          ?        ?      903.2        3.4       ?       ? 
1 1 1   38   12    4 o    312.8    2.3    0.0000   0.0000          ?        ?   978.8537  14.6860          ?        ?      312.8        2.3       ?       ? 
1 1 1   38   12    5 o    549.6    2.6    0.0000   0.0000          ?        ?  3021.4844  28.0950          ?        ?      549.6        2.6       ?       ? 
1 1 1   38   12    6 o    202.1    2.7    0.0000   0.0000          ?        ?   408.6538  10.8549          ?        ?      202.1        2.7       ?       ? 
1 1 1   38   12    7 o    258.5    2.5    0.0000   0.0000          ?        ?   668.5321  12.7704          ?        ?      258.5        2.5       ?       ? 
1 1 1   38   12    8 o    525.8    2.5    0.0000   0.0000          ?        ?  2764.7986  26.1794          ?        ?      525.8        2.5       ?       ? 
1 1 1   38   12    9 o    499.5    2.5    0.0000   0.0000          ?        ?  2495.3425  24.9023          ?        ?      499.5        2.5       ?       ? 
1 1 1   38   12   10 o    380.5    2.3    0.0000   0.0000          ?        ?  1448.1671  17.2401          ?        ?      380.5        2.3       ?       ? 
1 1 1   38   12   11 o    454.7    2.4    0.0000   0.0000          ?        ?  2067.5330  21.7097          ?        ?      454.7        2.4       ?       ? 
1 1 1   38   12   12 o    590.8    2.6    0.0000   0.0000          ?        ?  3490.7979  31.2876          ?        ?      590.8        2.6       ?       ? 
1 1 1   38   12   13 o    607.8    2.6    0.0000   0.0000          ?        ?  3695.1248  31.9261          ?        ?      607.8        2.6       ?       ? 
1 1 1   38   12   14 o    337.8    2.5    0.0000   0.0000          ?        ?  1141.0381  16.6016          ?        ?      337.8        2.5       ?       ? 
1 1 1   38   12   15 o    212.0    2.9    0.0000   0.0000          ?        ?   449.5192  12.1319          ?        ?      212.0        2.9       ?       ? 
1 1 1   38   12   16 o    548.5    2.7    0.0000   0.0000          ?        ?  3008.7139  29.3720          ?        ?      548.5        2.7       ?       ? 
1 1 1   38   12   17 o    612.4    2.7    0.0000   0.0000          ?        ?  3750.6763  33.2031          ?        ?      612.4        2.7       ?       ? 
1 1 1   38   12   18 o    294.0    2.5    0.0000   0.0000          ?        ?   864.5582  14.6860          ?        ?      294.0        2.5       ?       ? 
1 1 1   38   12   19 o    348.2    2.4    0.0000   0.0000          ?        ?  1212.5525  16.6016          ?        ?      348.2        2.4       ?       ? 
1 1 1   38   12   20 o    552.8    2.5    0.0000   0.0000          ?        ?  3055.9646  27.4564          ?        ?      552.8        2.5       ?       ? 
1 1 1   38   12   21 o    389.1    2.5    0.0000   0.0000          ?        ?  1513.9348  19.1556          ?        ?      389.1        2.5       ?       ? 
1 1 1   38   12   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   12   23 o    117.7    5.2    0.0000   0.0000          ?        ?   138.5592  12.1319          ?        ?      117.7        5.2       ?       ? 
1 1 1   38   12   24 o    526.1    2.5    0.0000   0.0000          ?        ?  2767.9912  26.8179          ?        ?      526.1        2.5       ?       ? 
1 1 1   38   12   25 o     24.8   11.6    0.0000   0.0000          ?        ?   -13.4090  14.0475          ?        ?       24.8       11.6       ?       ? 
1 1 1   38   12   26 o     96.2    6.6    0.0000   0.0000          ?        ?    92.5856  12.7704          ?        ?       96.2        6.6       ?       ? 
1 1 1   38   12   27 o    105.9    6.6    0.0000   0.0000          ?        ?   112.3798  14.0475          ?        ?      105.9        6.6       ?       ? 
1 1 1   38   12   28 o    155.7    4.5    0.0000   0.0000          ?        ?   242.6382  14.0475          ?        ?      155.7        4.5       ?       ? 
1 1 1   38   12   29 o    235.9    3.1    0.0000   0.0000          ?        ?   556.7908  14.6860          ?        ?      235.9        3.1       ?       ? 
1 1 1   38   12   30 o    345.8    2.5    0.0000   0.0000          ?        ?  1195.9510  17.2401          ?        ?      345.8        2.5       ?       ? 
1 1 1   38   12   31 o    449.2    2.5    0.0000   0.0000          ?        ?  2018.3669  22.3483          ?        ?      449.2        2.5       ?       ? 
1 1 1   38   12   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   12   33 o    239.7    3.3    0.0000   0.0000          ?        ?   574.6694  15.9630          ?        ?      239.7        3.3       ?       ? 
1 1 1   38   12   34 o    290.6    2.9    0.0000   0.0000          ?        ?   844.7642  16.6016          ?        ?      290.6        2.9       ?       ? 
1 1 1   38   12   35 o    306.6    2.9    0.0000   0.0000          ?        ?   940.5424  17.8786          ?        ?      306.6        2.9       ?       ? 
1 1 1   38   12   36 o    158.3    5.0    0.0000   0.0000          ?        ?   250.9390  15.9630          ?        ?      158.3        5.0       ?       ? 
1 1 1   38   12   37 o     30.1   13.1    0.0000   0.0000          ?        ?    -2.5541  14.6860          ?        ?       30.1       13.1       ?       ? 
1 1 1   38   12   38 o    345.8    2.7    0.0000   0.0000          ?        ?  1196.5895  18.5171          ?        ?      345.8        2.7       ?       ? 
1 1 1   38   12   39 o    390.0    2.6    0.0000   0.0000          ?        ?  1521.5970  20.4327          ?        ?      390.0        2.6       ?       ? 
1 1 1   38   12   40 o     61.9   13.3    0.0000   0.0000          ?        ?    40.2269  15.9630          ?        ?       61.9       13.3       ?       ? 
1 1 1   38   12   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   12   42 o    173.5    4.8    0.0000   0.0000          ?        ?   301.3822  16.6016          ?        ?      173.5        4.8       ?       ? 
1 1 1   38   12   43 f    145.4    5.7    0.0000   0.0000          ?        ?   211.9892  16.6016          ?        ?      145.4        5.7       ?       ? 
1 1 1   38   12   44 f    178.7    4.8    0.0000   0.0000          ?        ?   319.8993  17.2401          ?        ?      178.7        4.8       ?       ? 
1 1 1   38   12   45 o     20.7   10.3    0.0000   0.0000          ?        ?   -41.5039  16.6016          ?        ?       20.7       10.3       ?       ? 
1 1 1   38   12   46 o    213.8    4.2    0.0000   0.0000          ?        ?   457.8200  17.8786          ?        ?      213.8        4.2       ?       ? 
1 1 1   38   12   47 o    298.2    3.2    0.0000   0.0000          ?        ?   890.0991  19.1556          ?        ?      298.2        3.2       ?       ? 
1 1 1   38   12   48 o     25.9   12.4    0.0000   0.0000          ?        ?   -23.6253  17.8786          ?        ?       25.9       12.4       ?       ? 
1 1 1   38   12   49 o     41.5   15.9    0.0000   0.0000          ?        ?    12.1319  18.5171          ?        ?       41.5       15.9       ?       ? 
1 1 1   38   12   50 o     47.0   15.9    0.0000   0.0000          ?        ?    21.0712  17.8786          ?        ?       47.0       15.9       ?       ? 
1 1 1   38   12   51 o    149.6    6.4    0.0000   0.0000          ?        ?   224.7596  19.1556          ?        ?      149.6        6.4       ?       ? 
1 1 1   38   12   52 o    218.5    4.4    0.0000   0.0000          ?        ?   478.2527  19.1556          ?        ?      218.5        4.4       ?       ? 
1 1 1   38   12   53 o    135.9    7.0    0.0000   0.0000          ?        ?   185.8098  19.1556          ?        ?      135.9        7.0       ?       ? 
1 1 1   38   12   54 o    136.6    7.0    0.0000   0.0000          ?        ?   187.7254  19.1556          ?        ?      136.6        7.0       ?       ? 
1 1 1   38   12   55 o    135.7    6.8    0.0000   0.0000          ?        ?   185.1713  18.5171          ?        ?      135.7        6.8       ?       ? 
1 1 1   38   12   56 o     23.6   11.6    0.0000   0.0000          ?        ?   -35.7572  18.5171          ?        ?       23.6       11.6       ?       ? 
1 1 1   38   12   57 o    204.8    4.7    0.0000   0.0000          ?        ?   420.7858  19.1556          ?        ?      204.8        4.7       ?       ? 
1 1 1   38   12   58 o     61.5   15.6    0.0000   0.0000          ?        ?    40.8654  19.1556          ?        ?       61.5       15.6       ?       ? 
1 1 1   38   12   59 o    108.0    8.6    0.0000   0.0000          ?        ?   118.1265  18.5171          ?        ?      108.0        8.6       ?       ? 
1 1 1   38   12   60 o    160.8    6.0    0.0000   0.0000          ?        ?   260.5168  19.1556          ?        ?      160.8        6.0       ?       ? 
1 1 1   38   13    0 o    392.9    3.4 1543.9453  26.8179  1543.9453  26.8179  1543.9453  26.8179      392.9      3.4      392.9        3.4     0.0     0.0 
1 1 1   38   13    1 o    307.8    2.7    0.0000   0.0000          ?        ?   947.5660  16.6016          ?        ?      307.8        2.7       ?       ? 
1 1 1   38   13    2 f    245.8    2.6    0.0000   0.0000          ?        ?   604.0414  12.7704          ?        ?      245.8        2.6       ?       ? 
1 1 1   38   13    3 o    177.8    3.2    0.0000   0.0000          ?        ?   316.0682  11.4934          ?        ?      177.8        3.2       ?       ? 
1 1 1   38   13    4 o    264.9    2.4    0.0000   0.0000          ?        ?   701.7353  12.7704          ?        ?      264.9        2.4       ?       ? 
1 1 1   38   13    5 o    327.7    2.3    0.0000   0.0000          ?        ?  1073.9934  15.3245          ?        ?      327.7        2.3       ?       ? 
1 1 1   38   13    6 o    709.9    2.8    0.0000   0.0000          ?        ?  5039.8511  40.2269          ?        ?      709.9        2.8       ?       ? 
1 1 1   38   13    7 o    571.8    2.6    0.0000   0.0000          ?        ?  3269.8691  29.3720          ?        ?      571.8        2.6       ?       ? 
1 1 1   38   13    8 o    159.0    3.0    0.0000   0.0000          ?        ?   252.8546   9.5778          ?        ?      159.0        3.0       ?       ? 
1 1 1   38   13    9 o    240.4    2.4    0.0000   0.0000          ?        ?   577.8621  11.4934          ?        ?      240.4        2.4       ?       ? 
1 1 1   38   13   10 o    342.1    2.3    0.0000   0.0000          ?        ?  1170.4102  15.9630          ?        ?      342.1        2.3       ?       ? 
1 1 1   38   13   11 o    250.4    2.7    0.0000   0.0000          ?        ?   627.0282  13.4090          ?        ?      250.4        2.7       ?       ? 
1 1 1   38   13   12 o    240.6    2.7    0.0000   0.0000          ?        ?   579.1391  12.7704          ?        ?      240.6        2.7       ?       ? 
1 1 1   38   13   13 o    116.0    4.7    0.0000   0.0000          ?        ?   134.7281  10.8549          ?        ?      116.0        4.7       ?       ? 
1 1 1   38   13   14 o    213.2    2.7    0.0000   0.0000          ?        ?   454.6274  11.4934          ?        ?      213.2        2.7       ?       ? 
1 1 1   38   13   15 o     34.2   12.9    0.0000   0.0000          ?        ?     8.3008  12.1319          ?        ?       34.2       12.9       ?       ? 
1 1 1   38   13   16 o    547.7    2.6    0.0000   0.0000          ?        ?  3000.4131  28.7335          ?        ?      547.7        2.6       ?       ? 
1 1 1   38   13   17 o    291.4    2.6    0.0000   0.0000          ?        ?   849.2338  15.3245          ?        ?      291.4        2.6       ?       ? 
1 1 1   38   13   18 o    196.0    2.9    0.0000   0.0000          ?        ?   384.3900  11.4934          ?        ?      196.0        2.9       ?       ? 
1 1 1   38   13   19 f    324.0    2.4    0.0000   0.0000          ?        ?  1049.7295  15.3245          ?        ?      324.0        2.4       ?       ? 
1 1 1   38   13   20 o    390.9    2.5    0.0000   0.0000          ?        ?  1527.9823  19.7942          ?        ?      390.9        2.5       ?       ? 
1 1 1   38   13   21 o    615.8    2.6    0.0000   0.0000          ?        ?  3793.4568  32.5646          ?        ?      615.8        2.6       ?       ? 
1 1 1   38   13   22 o    374.9    2.4    0.0000   0.0000          ?        ?  1406.0247  17.8786          ?        ?      374.9        2.4       ?       ? 
1 1 1   38   13   23 o    402.4    2.4    0.0000   0.0000          ?        ?  1619.2909  19.1556          ?        ?      402.4        2.4       ?       ? 
1 1 1   38   13   24 o    205.1    3.3    0.0000   0.0000          ?        ?   420.7858  13.4090          ?        ?      205.1        3.3       ?       ? 
1 1 1   38   13   25 o    516.8    2.5    0.0000   0.0000          ?        ?  2670.9358  25.5409          ?        ?      516.8        2.5       ?       ? 
1 1 1   38   13   26 o    320.4    2.7    0.0000   0.0000          ?        ?  1026.7428  17.2401          ?        ?      320.4        2.7       ?       ? 
1 1 1   38   13   27 o    157.3    4.3    0.0000   0.0000          ?        ?   247.7464  13.4090          ?        ?      157.3        4.3       ?       ? 
1 1 1   38   13   28 o    616.9    2.8    0.0000   0.0000          ?        ?  3806.2273  34.4802          ?        ?      616.9        2.8       ?       ? 
1 1 1   38   13   29 o     16.5    8.4    0.0000   0.0000          ?        ?   -51.0817  14.0475          ?        ?       16.5        8.4       ?       ? 
1 1 1   38   13   30 o    275.4    2.8    0.0000   0.0000          ?        ?   758.5637  15.3245          ?        ?      275.4        2.8       ?       ? 
1 1 1   38   13   31 o    244.0    3.1    0.0000   0.0000          ?        ?   595.7407  15.3245          ?        ?      244.0        3.1       ?       ? 
1 1 1   38   13   32 o    348.9    2.6    0.0000   0.0000          ?        ?  1217.6608  17.8786          ?        ?      348.9        2.6       ?       ? 
1 1 1   38   13   33 o    354.0    2.7    0.0000   0.0000          ?        ?  1253.4180  19.1556          ?        ?      354.0        2.7       ?       ? 
1 1 1   38   13   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   13   35 o    227.2    3.5    0.0000   0.0000          ?        ?   516.5640  15.9630          ?        ?      227.2        3.5       ?       ? 
1 1 1   38   13   36 o    405.2    2.5    0.0000   0.0000          ?        ?  1642.2777  20.4327          ?        ?      405.2        2.5       ?       ? 
1 1 1   38   13   37 o    265.4    3.1    0.0000   0.0000          ?        ?   704.9279  16.6016          ?        ?      265.4        3.1       ?       ? 
1 1 1   38   13   38 o    224.1    3.7    0.0000   0.0000          ?        ?   502.5165  16.6016          ?        ?      224.1        3.7       ?       ? 
1 1 1   38   13   39 o    258.1    3.2    0.0000   0.0000          ?        ?   666.6166  16.6016          ?        ?      258.1        3.2       ?       ? 
1 1 1   38   13   40 o    301.8    3.0    0.0000   0.0000          ?        ?   911.1703  17.8786          ?        ?      301.8        3.0       ?       ? 
1 1 1   38   13   41 o     18.2    9.2    0.0000   0.0000          ?        ?   -58.1055  16.6016          ?        ?       18.2        9.2       ?       ? 
1 1 1   38   13   42 o    257.6    3.5    0.0000   0.0000          ?        ?   664.0625  17.8786          ?        ?      257.6        3.5       ?       ? 
1 1 1   38   13   43 o    153.5    5.6    0.0000   0.0000          ?        ?   236.2530  17.2401          ?        ?      153.5        5.6       ?       ? 
1 1 1   38   13   44 o     26.2   12.3    0.0000   0.0000          ?        ?   -17.8786  16.6016          ?        ?       26.2       12.3       ?       ? 
1 1 1   38   13   45 o    106.4    7.8    0.0000   0.0000          ?        ?   113.6568  16.6016          ?        ?      106.4        7.8       ?       ? 
1 1 1   38   13   46 o     40.2   15.2    0.0000   0.0000          ?        ?    12.1319  16.6016          ?        ?       40.2       15.2       ?       ? 
1 1 1   38   13   47 o    243.9    3.8    0.0000   0.0000          ?        ?   595.7407  18.5171          ?        ?      243.9        3.8       ?       ? 
1 1 1   38   13   48 o    311.9    3.2    0.0000   0.0000          ?        ?   973.7455  19.7942          ?        ?      311.9        3.2       ?       ? 
1 1 1   38   13   49 o    108.7    7.9    0.0000   0.0000          ?        ?   118.7650  17.2401          ?        ?      108.7        7.9       ?       ? 
1 1 1   38   13   50 o    299.6    3.4    0.0000   0.0000          ?        ?   898.3999  20.4327          ?        ?      299.6        3.4       ?       ? 
1 1 1   38   13   51 o     99.4    9.3    0.0000   0.0000          ?        ?    99.6094  18.5171          ?        ?       99.4        9.3       ?       ? 
1 1 1   38   13   52 o    292.3    3.5    0.0000   0.0000          ?        ?   855.6190  20.4327          ?        ?      292.3        3.5       ?       ? 
1 1 1   38   13   53 o    250.7    4.1    0.0000   0.0000          ?        ?   629.5823  20.4327          ?        ?      250.7        4.1       ?       ? 
1 1 1   38   13   54 o    199.3    4.6    0.0000   0.0000          ?        ?   398.4375  18.5171          ?        ?      199.3        4.6       ?       ? 
1 1 1   38   13   55 f     79.6   11.2    0.0000   0.0000          ?        ?    64.4907  17.8786          ?        ?       79.6       11.2       ?       ? 
1 1 1   38   13   56 o     34.5   14.8    0.0000   0.0000          ?        ?    -0.6385  18.5171          ?        ?       34.5       14.8       ?       ? 
1 1 1   38   13   57 o     59.1   15.5    0.0000   0.0000          ?        ?    37.6728  18.5171          ?        ?       59.1       15.5       ?       ? 
1 1 1   38   13   58 o     21.2   10.6    0.0000   0.0000          ?        ?   -49.1662  18.5171          ?        ?       21.2       10.6       ?       ? 
1 1 1   38   13   59 o     75.1   12.3    0.0000   0.0000          ?        ?    58.1055  18.5171          ?        ?       75.1       12.3       ?       ? 
1 1 1   38   14    0 o    338.4    3.8 1145.5078  25.5409  1145.5078  25.5409  1145.5078  25.5409      338.4      3.8      338.4        3.8     0.0     0.0 
1 1 1   38   14    1 o    514.6    2.7    0.0000   0.0000          ?        ?  2648.5876  28.0950          ?        ?      514.6        2.7       ?       ? 
1 1 1   38   14    2 o    769.6    3.4    0.0000   0.0000          ?        ?  5924.2036  52.3588          ?        ?      769.6        3.4       ?       ? 
1 1 1   38   14    3 o    562.2    2.7    0.0000   0.0000          ?        ?  3161.3206  30.6490          ?        ?      562.2        2.7       ?       ? 
1 1 1   38   14    4 o    347.3    2.5    0.0000   0.0000          ?        ?  1206.1674  17.2401          ?        ?      347.3        2.5       ?       ? 
1 1 1   38   14    5 o    220.7    2.7    0.0000   0.0000          ?        ?   487.1920  12.1319          ?        ?      220.7        2.7       ?       ? 
1 1 1   38   14    6 o    231.0    3.0    0.0000   0.0000          ?        ?   533.8041  14.0475          ?        ?      231.0        3.0       ?       ? 
1 1 1   38   14    7 o    658.0    2.8    0.0000   0.0000          ?        ?  4331.0923  37.0343          ?        ?      658.0        2.8       ?       ? 
1 1 1   38   14    8 o    203.7    2.7    0.0000   0.0000          ?        ?   415.0391  10.8549          ?        ?      203.7        2.7       ?       ? 
1 1 1   38   14    9 o    109.3    3.8    0.0000   0.0000          ?        ?   119.4035   8.3008          ?        ?      109.3        3.8       ?       ? 
1 1 1   38   14   10 o    298.5    2.2    0.0000   0.0000          ?        ?   891.3762  13.4090          ?        ?      298.5        2.2       ?       ? 
1 1 1   38   14   11 o    219.4    2.8    0.0000   0.0000          ?        ?   481.4453  12.1319          ?        ?      219.4        2.8       ?       ? 
1 1 1   38   14   12 o    391.8    2.4    0.0000   0.0000          ?        ?  1535.6445  18.5171          ?        ?      391.8        2.4       ?       ? 
1 1 1   38   14   13 o    262.1    2.6    0.0000   0.0000          ?        ?   687.0493  13.4090          ?        ?      262.1        2.6       ?       ? 
1 1 1   38   14   14 o    340.2    2.3    0.0000   0.0000          ?        ?  1157.6398  15.9630          ?        ?      340.2        2.3       ?       ? 
1 1 1   38   14   15 o    183.1    3.1    0.0000   0.0000          ?        ?   335.2238  11.4934          ?        ?      183.1        3.1       ?       ? 
1 1 1   38   14   16 o    149.5    3.6    0.0000   0.0000          ?        ?   223.4826  10.8549          ?        ?      149.5        3.6       ?       ? 
1 1 1   38   14   17 o    600.9    2.6    0.0000   0.0000          ?        ?  3611.4783  31.2876          ?        ?      600.9        2.6       ?       ? 
1 1 1   38   14   18 o    256.8    2.7    0.0000   0.0000          ?        ?   659.5928  14.0475          ?        ?      256.8        2.7       ?       ? 
1 1 1   38   14   19 o    235.0    2.9    0.0000   0.0000          ?        ?   552.3212  13.4090          ?        ?      235.0        2.9       ?       ? 
1 1 1   38   14   20 o     45.9   13.2    0.0000   0.0000          ?        ?    21.7097  12.7704          ?        ?       45.9       13.2       ?       ? 
1 1 1   38   14   21 o    360.9    2.4    0.0000   0.0000          ?        ?  1302.5841  17.2401          ?        ?      360.9        2.4       ?       ? 
1 1 1   38   14   22 o    168.7    3.8    0.0000   0.0000          ?        ?   284.7806  12.7704          ?        ?      168.7        3.8       ?       ? 
1 1 1   38   14   23 o    112.1    6.0    0.0000   0.0000          ?        ?   125.7888  13.4090          ?        ?      112.1        6.0       ?       ? 
1 1 1   38   14   24 o    344.6    2.5    0.0000   0.0000          ?        ?  1187.6503  17.2401          ?        ?      344.6        2.5       ?       ? 
1 1 1   38   14   25 o    154.5    4.3    0.0000   0.0000          ?        ?   238.8071  13.4090          ?        ?      154.5        4.3       ?       ? 
1 1 1   38   14   26 o    311.9    2.6    0.0000   0.0000          ?        ?   973.1069  15.9630          ?        ?      311.9        2.6       ?       ? 
1 1 1   38   14   27 o    312.8    2.8    0.0000   0.0000          ?        ?   978.8537  17.2401          ?        ?      312.8        2.8       ?       ? 
1 1 1   38   14   28 o    473.9    2.5    0.0000   0.0000          ?        ?  2246.3191  23.6253          ?        ?      473.9        2.5       ?       ? 
1 1 1   38   14   29 o    414.8    2.5    0.0000   0.0000          ?        ?  1720.8158  21.0712          ?        ?      414.8        2.5       ?       ? 
1 1 1   38   14   30 o     72.6   10.1    0.0000   0.0000          ?        ?    52.9973  14.6860          ?        ?       72.6       10.1       ?       ? 
1 1 1   38   14   31 o    351.6    2.6    0.0000   0.0000          ?        ?  1236.8164  18.5171          ?        ?      351.6        2.6       ?       ? 
1 1 1   38   14   32 o    348.6    2.6    0.0000   0.0000          ?        ?  1215.7451  17.8786          ?        ?      348.6        2.6       ?       ? 
1 1 1   38   14   33 o    116.5    6.3    0.0000   0.0000          ?        ?   136.0051  14.6860          ?        ?      116.5        6.3       ?       ? 
1 1 1   38   14   34 o    170.4    4.5    0.0000   0.0000          ?        ?   290.5273  15.3245          ?        ?      170.4        4.5       ?       ? 
1 1 1   38   14   35 o    255.9    3.4    0.0000   0.0000          ?        ?   655.1232  17.2401          ?        ?      255.9        3.4       ?       ? 
1 1 1   38   14   36 o    330.1    2.8    0.0000   0.0000          ?        ?  1089.9564  18.5171          ?        ?      330.1        2.8       ?       ? 
1 1 1   38   14   37 o     19.0    9.5    0.0000   0.0000          ?        ?   -43.4195  15.3245          ?        ?       19.0        9.5       ?       ? 
1 1 1   38   14   38 o    146.8    5.4    0.0000   0.0000          ?        ?   215.8203  15.9630          ?        ?      146.8        5.4       ?       ? 
1 1 1   38   14   39 o    287.8    3.0    0.0000   0.0000          ?        ?   828.8011  17.2401          ?        ?      287.8        3.0       ?       ? 
1 1 1   38   14   40 o     18.4    9.3    0.0000   0.0000          ?        ?   -51.7203  15.9630          ?        ?       18.4        9.3       ?       ? 
1 1 1   38   14   41 f    306.1    3.1    0.0000   0.0000          ?        ?   937.3498  19.1556          ?        ?      306.1        3.1       ?       ? 
1 1 1   38   14   42 o    119.7    6.7    0.0000   0.0000          ?        ?   143.6674  15.9630          ?        ?      119.7        6.7       ?       ? 
1 1 1   38   14   43 o    269.1    3.3    0.0000   0.0000          ?        ?   724.7220  17.8786          ?        ?      269.1        3.3       ?       ? 
1 1 1   38   14   44 o    101.1    8.8    0.0000   0.0000          ?        ?   102.8020  17.8786          ?        ?      101.1        8.8       ?       ? 
1 1 1   38   14   45 o    269.7    3.3    0.0000   0.0000          ?        ?   727.9147  17.8786          ?        ?      269.7        3.3       ?       ? 
1 1 1   38   14   46 o     54.6   15.2    0.0000   0.0000          ?        ?    31.2876  17.2401          ?        ?       54.6       15.2       ?       ? 
1 1 1   38   14   47 o     25.0   12.0    0.0000   0.0000          ?        ?   -24.2638  17.2401          ?        ?       25.0       12.0       ?       ? 
1 1 1   38   14   48 o    135.1    6.1    0.0000   0.0000          ?        ?   183.2557  16.6016          ?        ?      135.1        6.1       ?       ? 
1 1 1   38   14   49 o    281.8    3.4    0.0000   0.0000          ?        ?   794.9594  19.1556          ?        ?      281.8        3.4       ?       ? 
1 1 1   38   14   50 o     92.7    9.6    0.0000   0.0000          ?        ?    86.8389  17.8786          ?        ?       92.7        9.6       ?       ? 
1 1 1   38   14   51 o     61.0   14.8    0.0000   0.0000          ?        ?    39.5883  17.8786          ?        ?       61.0       14.8       ?       ? 
1 1 1   38   14   52 f    289.7    3.4    0.0000   0.0000          ?        ?   840.2945  19.7942          ?        ?      289.7        3.4       ?       ? 
1 1 1   38   14   53 o     98.3    9.1    0.0000   0.0000          ?        ?    97.6938  17.8786          ?        ?       98.3        9.1       ?       ? 
1 1 1   38   14   54 o    363.8    3.2    0.0000   0.0000          ?        ?  1325.5709  22.9868          ?        ?      363.8        3.2       ?       ? 
1 1 1   38   14   55 o    101.1    8.8    0.0000   0.0000          ?        ?   103.4405  17.8786          ?        ?      101.1        8.8       ?       ? 
1 1 1   38   14   56 o     24.0   11.7    0.0000   0.0000          ?        ?   -33.8416  18.5171          ?        ?       24.0       11.7       ?       ? 
1 1 1   38   14   57 o    117.3    7.9    0.0000   0.0000          ?        ?   139.1977  18.5171          ?        ?      117.3        7.9       ?       ? 
1 1 1   38   14   58 o     20.9   10.4    0.0000   0.0000          ?        ?   -51.0817  18.5171          ?        ?       20.9       10.4       ?       ? 
1 1 1   38   14   59 o    173.4    5.5    0.0000   0.0000          ?        ?   302.6593  19.1556          ?        ?      173.4        5.5       ?       ? 
1 1 1   38   15    0 o    492.2    3.9 2423.8281  38.3113  2423.8281  38.3113  2423.8281  38.3113      492.2      3.9      492.2        3.9     0.0     0.0 
1 1 1   38   15    1 o    246.1    3.0    0.0000   0.0000          ?        ?   605.9570  14.6860          ?        ?      246.1        3.0       ?       ? 
1 1 1   38   15    2 o    325.7    2.7    0.0000   0.0000          ?        ?  1061.2229  17.8786          ?        ?      325.7        2.7       ?       ? 
1 1 1   38   15    3 o    320.7    2.7    0.0000   0.0000          ?        ?  1028.6583  17.2401          ?        ?      320.7        2.7       ?       ? 
1 1 1   38   15    4 o    489.4    2.7    0.0000   0.0000          ?        ?  2395.7332  26.1794          ?        ?      489.4        2.7       ?       ? 
1 1 1   38   15    5 o    369.7    2.6    0.0000   0.0000          ?        ?  1367.0748  19.1556          ?        ?      369.7        2.6       ?       ? 
1 1 1   38   15    6 o    324.9    2.5    0.0000   0.0000          ?        ?  1055.4763  15.9630          ?        ?      324.9        2.5       ?       ? 
1 1 1   38   15    7 o    618.4    2.8    0.0000   0.0000          ?        ?  3825.3828  35.1187          ?        ?      618.4        2.8       ?       ? 
1 1 1   38   15    8 o    102.9    5.3    0.0000   0.0000          ?        ?   105.9946  10.8549          ?        ?      102.9        5.3       ?       ? 
1 1 1   38   15    9 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   15   10 o    380.9    2.4    0.0000   0.0000          ?        ?  1451.3596  18.5171          ?        ?      380.9        2.4       ?       ? 
1 1 1   38   15   11 o    293.6    2.4    0.0000   0.0000          ?        ?   862.0042  14.0475          ?        ?      293.6        2.4       ?       ? 
1 1 1   38   15   12 o    127.1    4.3    0.0000   0.0000          ?        ?   161.5460  10.8549          ?        ?      127.1        4.3       ?       ? 
1 1 1   38   15   13 o    646.6    2.7    0.0000   0.0000          ?        ?  4181.6782  34.4802          ?        ?      646.6        2.7       ?       ? 
1 1 1   38   15   14 o    283.4    2.5    0.0000   0.0000          ?        ?   803.2603  14.0475          ?        ?      283.4        2.5       ?       ? 
1 1 1   38   15   15 o    127.8    4.0    0.0000   0.0000          ?        ?   163.4615  10.2163          ?        ?      127.8        4.0       ?       ? 
1 1 1   38   15   16 o    318.9    2.4    0.0000   0.0000          ?        ?  1017.1650  15.3245          ?        ?      318.9        2.4       ?       ? 
1 1 1   38   15   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   15   18 o    214.5    3.0    0.0000   0.0000          ?        ?   460.3741  12.7704          ?        ?      214.5        3.0       ?       ? 
1 1 1   38   15   19 o    531.8    2.5    0.0000   0.0000          ?        ?  2828.6509  26.8179          ?        ?      531.8        2.5       ?       ? 
1 1 1   38   15   20 o    702.6    2.9    0.0000   0.0000          ?        ?  4938.3262  40.8654          ?        ?      702.6        2.9       ?       ? 
1 1 1   38   15   21 o    245.6    3.0    0.0000   0.0000          ?        ?   603.4030  14.6860          ?        ?      245.6        3.0       ?       ? 
1 1 1   38   15   22 o    242.2    2.9    0.0000   0.0000          ?        ?   586.8014  14.0475          ?        ?      242.2        2.9       ?       ? 
1 1 1   38   15   23 o    364.4    2.4    0.0000   0.0000          ?        ?  1328.1250  17.2401          ?        ?      364.4        2.4       ?       ? 
1 1 1   38   15   24 o    436.4    2.5    0.0000   0.0000          ?        ?  1904.7100  21.7097          ?        ?      436.4        2.5       ?       ? 
1 1 1   38   15   25 o    528.7    2.5    0.0000   0.0000          ?        ?  2795.4475  26.8179          ?        ?      528.7        2.5       ?       ? 
1 1 1   38   15   26 o    323.1    2.5    0.0000   0.0000          ?        ?  1043.9829  15.9630          ?        ?      323.1        2.5       ?       ? 
1 1 1   38   15   27 o    203.0    3.5    0.0000   0.0000          ?        ?   412.4850  14.0475          ?        ?      203.0        3.5       ?       ? 
1 1 1   38   15   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   15   29 f    118.4    5.9    0.0000   0.0000          ?        ?   140.4748  14.0475          ?        ?      118.4        5.9       ?       ? 
1 1 1   38   15   30 o    534.9    2.5    0.0000   0.0000          ?        ?  2861.8540  26.8179          ?        ?      534.9        2.5       ?       ? 
1 1 1   38   15   31 o    380.5    2.6    0.0000   0.0000          ?        ?  1448.1671  19.7942          ?        ?      380.5        2.6       ?       ? 
1 1 1   38   15   32 o    130.2    5.6    0.0000   0.0000          ?        ?   169.8468  14.6860          ?        ?      130.2        5.6       ?       ? 
1 1 1   38   15   33 o     86.2    8.9    0.0000   0.0000          ?        ?    74.7070  15.3245          ?        ?       86.2        8.9       ?       ? 
1 1 1   38   15   34 o    342.5    2.7    0.0000   0.0000          ?        ?  1173.6028  18.5171          ?        ?      342.5        2.7       ?       ? 
1 1 1   38   15   35 o    325.8    2.8    0.0000   0.0000          ?        ?  1061.8615  18.5171          ?        ?      325.8        2.8       ?       ? 
1 1 1   38   15   36 o    146.8    5.2    0.0000   0.0000          ?        ?   215.8203  15.3245          ?        ?      146.8        5.2       ?       ? 
1 1 1   38   15   37 o    425.2    2.6    0.0000   0.0000          ?        ?  1808.9316  21.7097          ?        ?      425.2        2.6       ?       ? 
1 1 1   38   15   38 o     42.6   14.7    0.0000   0.0000          ?        ?    16.6016  15.3245          ?        ?       42.6       14.7       ?       ? 
1 1 1   38   15   39 o    142.8    5.6    0.0000   0.0000          ?        ?   204.3269  15.9630          ?        ?      142.8        5.6       ?       ? 
1 1 1   38   15   40 o    279.0    3.2    0.0000   0.0000          ?        ?   778.9964  17.8786          ?        ?      279.0        3.2       ?       ? 
1 1 1   38   15   41 o     99.9    7.7    0.0000   0.0000          ?        ?   100.2479  15.3245          ?        ?       99.9        7.7       ?       ? 
1 1 1   38   15   42 o    204.4    3.9    0.0000   0.0000          ?        ?   418.2317  15.9630          ?        ?      204.4        3.9       ?       ? 
1 1 1   38   15   43 o    172.5    5.0    0.0000   0.0000          ?        ?   298.1896  17.2401          ?        ?      172.5        5.0       ?       ? 
1 1 1   38   15   44 o    105.1    8.5    0.0000   0.0000          ?        ?   111.1028  17.8786          ?        ?      105.1        8.5       ?       ? 
1 1 1   38   15   45 o    342.4    3.1    0.0000   0.0000          ?        ?  1172.9642  21.0712          ?        ?      342.4        3.1       ?       ? 
1 1 1   38   15   46 o    269.5    3.6    0.0000   0.0000          ?        ?   727.2761  19.1556          ?        ?      269.5        3.6       ?       ? 
1 1 1   38   15   47 o     76.2   11.7    0.0000   0.0000          ?        ?    58.7440  17.8786          ?        ?       76.2       11.7       ?       ? 
1 1 1   38   15   48 o    199.2    4.6    0.0000   0.0000          ?        ?   397.7990  18.5171          ?        ?      199.2        4.6       ?       ? 
1 1 1   38   15   49 f    167.5    5.5    0.0000   0.0000          ?        ?   281.5880  18.5171          ?        ?      167.5        5.5       ?       ? 
1 1 1   38   15   50 o    252.0    3.7    0.0000   0.0000          ?        ?   635.9675  18.5171          ?        ?      252.0        3.7       ?       ? 
1 1 1   38   15   51 o    201.1    4.6    0.0000   0.0000          ?        ?   405.4612  18.5171          ?        ?      201.1        4.6       ?       ? 
1 1 1   38   15   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   15   53 o    100.8    9.2    0.0000   0.0000          ?        ?   102.8020  18.5171          ?        ?      100.8        9.2       ?       ? 
1 1 1   38   15   54 o    297.9    3.4    0.0000   0.0000          ?        ?   888.8221  20.4327          ?        ?      297.9        3.4       ?       ? 
1 1 1   38   15   55 o    111.8    8.3    0.0000   0.0000          ?        ?   126.4273  18.5171          ?        ?      111.8        8.3       ?       ? 
1 1 1   38   15   56 o     52.1   15.8    0.0000   0.0000          ?        ?    28.7335  17.8786          ?        ?       52.1       15.8       ?       ? 
1 1 1   38   15   57 o     85.9   10.4    0.0000   0.0000          ?        ?    75.3456  17.8786          ?        ?       85.9       10.4       ?       ? 
1 1 1   38   15   58 o    145.2    6.4    0.0000   0.0000          ?        ?   212.6277  18.5171          ?        ?      145.2        6.4       ?       ? 
1 1 1   38   16    0 o    103.7    8.4  109.8257  17.2401   109.8257  17.2401   109.8257  17.2401      103.7      8.4      103.7        8.4     0.0     0.0 
1 1 1   38   16    1 o    501.7    2.7    0.0000   0.0000          ?        ?  2517.6907  26.8179          ?        ?      501.7        2.7       ?       ? 
1 1 1   38   16    2 o    318.6    2.8    0.0000   0.0000          ?        ?  1015.2494  17.8786          ?        ?      318.6        2.8       ?       ? 
1 1 1   38   16    3 o    474.4    2.7    0.0000   0.0000          ?        ?  2251.4272  25.5409          ?        ?      474.4        2.7       ?       ? 
1 1 1   38   16    4 o    274.2    3.0    0.0000   0.0000          ?        ?   752.1785  16.6016          ?        ?      274.2        3.0       ?       ? 
1 1 1   38   16    5 o    631.6    3.0    0.0000   0.0000          ?        ?  3990.7603  37.6728          ?        ?      631.6        3.0       ?       ? 
1 1 1   38   16    6 o    202.4    2.8    0.0000   0.0000          ?        ?   409.9309  11.4934          ?        ?      202.4        2.8       ?       ? 
1 1 1   38   16    7 o    356.2    2.5    0.0000   0.0000          ?        ?  1268.7424  17.8786          ?        ?      356.2        2.5       ?       ? 
1 1 1   38   16    8 o    810.7    3.3    0.0000   0.0000          ?        ?  6574.8569  52.9973          ?        ?      810.7        3.3       ?       ? 
1 1 1   38   16    9 o    609.2    2.9    0.0000   0.0000          ?        ?  3711.7261  35.7572          ?        ?      609.2        2.9       ?       ? 
1 1 1   38   16   10 o    744.3    3.2    0.0000   0.0000          ?        ?  5541.7295  47.8891          ?        ?      744.3        3.2       ?       ? 
1 1 1   38   16   11 o    548.7    2.7    0.0000   0.0000          ?        ?  3011.2681  30.0105          ?        ?      548.7        2.7       ?       ? 
1 1 1   38   16   12 o    261.1    2.6    0.0000   0.0000          ?        ?   681.9411  13.4090          ?        ?      261.1        2.6       ?       ? 
1 1 1   38   16   13 o    381.3    2.5    0.0000   0.0000          ?        ?  1453.9137  19.1556          ?        ?      381.3        2.5       ?       ? 
1 1 1   38   16   14 o    348.5    2.4    0.0000   0.0000          ?        ?  1214.4681  16.6016          ?        ?      348.5        2.4       ?       ? 
1 1 1   38   16   15 o    419.2    2.4    0.0000   0.0000          ?        ?  1757.8500  19.7942          ?        ?      419.2        2.4       ?       ? 
1 1 1   38   16   16 o    300.4    2.4    0.0000   0.0000          ?        ?   902.8696  14.6860          ?        ?      300.4        2.4       ?       ? 
1 1 1   38   16   17 o    452.7    2.5    0.0000   0.0000          ?        ?  2049.6545  22.3483          ?        ?      452.7        2.5       ?       ? 
1 1 1   38   16   18 o    361.4    2.4    0.0000   0.0000          ?        ?  1306.4153  17.2401          ?        ?      361.4        2.4       ?       ? 
1 1 1   38   16   19 o    208.5    3.2    0.0000   0.0000          ?        ?   434.8332  13.4090          ?        ?      208.5        3.2       ?       ? 
1 1 1   38   16   20 o    534.2    2.6    0.0000   0.0000          ?        ?  2854.8303  27.4564          ?        ?      534.2        2.6       ?       ? 
1 1 1   38   16   21 o    345.0    2.5    0.0000   0.0000          ?        ?  1190.2042  17.2401          ?        ?      345.0        2.5       ?       ? 
1 1 1   38   16   22 o     18.8    9.2    0.0000   0.0000          ?        ?   -25.5409  12.1319          ?        ?       18.8        9.2       ?       ? 
1 1 1   38   16   23 o    296.4    2.6    0.0000   0.0000          ?        ?   878.6058  15.3245          ?        ?      296.4        2.6       ?       ? 
1 1 1   38   16   24 o    309.0    2.6    0.0000   0.0000          ?        ?   955.2284  15.9630          ?        ?      309.0        2.6       ?       ? 
1 1 1   38   16   25 o    416.9    2.6    0.0000   0.0000          ?        ?  1738.6943  21.7097          ?        ?      416.9        2.6       ?       ? 
1 1 1   38   16   26 o    389.8    2.4    0.0000   0.0000          ?        ?  1519.6815  18.5171          ?        ?      389.8        2.4       ?       ? 
1 1 1   38   16   27 o    192.4    3.5    0.0000   0.0000          ?        ?   370.3425  13.4090          ?        ?      192.4        3.5       ?       ? 
1 1 1   38   16   28 o    103.2    6.5    0.0000   0.0000          ?        ?   106.6331  13.4090          ?        ?      103.2        6.5       ?       ? 
1 1 1   38   16   29 o    348.5    2.7    0.0000   0.0000          ?        ?  1215.1067  18.5171          ?        ?      348.5        2.7       ?       ? 
1 1 1   38   16   30 f    323.3    2.8    0.0000   0.0000          ?        ?  1045.8984  17.8786          ?        ?      323.3        2.8       ?       ? 
1 1 1   38   16   31 o    297.5    2.8    0.0000   0.0000          ?        ?   885.6295  16.6016          ?        ?      297.5        2.8       ?       ? 
1 1 1   38   16   32 o    288.9    2.8    0.0000   0.0000          ?        ?   835.1863  15.9630          ?        ?      288.9        2.8       ?       ? 
1 1 1   38   16   33 o    146.1    5.0    0.0000   0.0000          ?        ?   213.9047  14.6860          ?        ?      146.1        5.0       ?       ? 
1 1 1   38   16   34 o    120.8    6.1    0.0000   0.0000          ?        ?   146.2215  14.6860          ?        ?      120.8        6.1       ?       ? 
1 1 1   38   16   35 o    345.0    2.7    0.0000   0.0000          ?        ?  1190.8428  18.5171          ?        ?      345.0        2.7       ?       ? 
1 1 1   38   16   36 o    425.3    2.6    0.0000   0.0000          ?        ?  1809.5702  22.3483          ?        ?      425.3        2.6       ?       ? 
1 1 1   38   16   37 o    213.4    3.9    0.0000   0.0000          ?        ?   455.9044  16.6016          ?        ?      213.4        3.9       ?       ? 
1 1 1   38   16   38 o    221.1    3.8    0.0000   0.0000          ?        ?   489.1075  16.6016          ?        ?      221.1        3.8       ?       ? 
1 1 1   38   16   39 o    379.8    2.7    0.0000   0.0000          ?        ?  1443.0588  20.4327          ?        ?      379.8        2.7       ?       ? 
1 1 1   38   16   40 o     33.6   14.1    0.0000   0.0000          ?        ?     1.9156  15.9630          ?        ?       33.6       14.1       ?       ? 
1 1 1   38   16   41 o     32.9   14.0    0.0000   0.0000          ?        ?     0.6385  15.9630          ?        ?       32.9       14.0       ?       ? 
1 1 1   38   16   42 o    165.2    5.0    0.0000   0.0000          ?        ?   273.2873  16.6016          ?        ?      165.2        5.0       ?       ? 
1 1 1   38   16   43 o    266.5    3.5    0.0000   0.0000          ?        ?   710.6746  18.5171          ?        ?      266.5        3.5       ?       ? 
1 1 1   38   16   44 o    349.6    2.9    0.0000   0.0000          ?        ?  1222.7689  20.4327          ?        ?      349.6        2.9       ?       ? 
1 1 1   38   16   45 o    370.7    2.8    0.0000   0.0000          ?        ?  1375.3755  21.0712          ?        ?      370.7        2.8       ?       ? 
1 1 1   38   16   46 o    166.2    5.8    0.0000   0.0000          ?        ?   277.1184  19.1556          ?        ?      166.2        5.8       ?       ? 
1 1 1   38   16   47 o     41.0   15.6    0.0000   0.0000          ?        ?    12.1319  17.8786          ?        ?       41.0       15.6       ?       ? 
1 1 1   38   16   48 o    265.8    3.7    0.0000   0.0000          ?        ?   707.4820  19.7942          ?        ?      265.8        3.7       ?       ? 
1 1 1   38   16   49 o    188.0    5.1    0.0000   0.0000          ?        ?   354.3795  19.1556          ?        ?      188.0        5.1       ?       ? 
1 1 1   38   16   50 o    258.9    3.6    0.0000   0.0000          ?        ?   671.0862  18.5171          ?        ?      258.9        3.6       ?       ? 
1 1 1   38   16   51 o    158.9    5.8    0.0000   0.0000          ?        ?   253.4931  18.5171          ?        ?      158.9        5.8       ?       ? 
1 1 1   38   16   52 o    190.1    4.9    0.0000   0.0000          ?        ?   362.6803  18.5171          ?        ?      190.1        4.9       ?       ? 
1 1 1   38   16   53 o    254.5    3.9    0.0000   0.0000          ?        ?   649.3765  19.7942          ?        ?      254.5        3.9       ?       ? 
1 1 1   38   16   54 o    154.5    6.0    0.0000   0.0000          ?        ?   240.0841  18.5171          ?        ?      154.5        6.0       ?       ? 
1 1 1   38   16   55 o    205.1    4.4    0.0000   0.0000          ?        ?   422.0628  17.8786          ?        ?      205.1        4.4       ?       ? 
1 1 1   38   16   56 o     26.5   12.6    0.0000   0.0000          ?        ?   -22.9868  18.5171          ?        ?       26.5       12.6       ?       ? 
1 1 1   38   16   57 o     57.8   15.6    0.0000   0.0000          ?        ?    36.3957  18.5171          ?        ?       57.8       15.6       ?       ? 
1 1 1   38   17    0 o    352.0    3.7 1239.3705  26.1794  1239.3705  26.1794  1239.3705  26.1794      352.0      3.7      352.0        3.7     0.0     0.0 
1 1 1   38   17    1 o    365.0    2.7    0.0000   0.0000          ?        ?  1332.5946  19.7942          ?        ?      365.0        2.7       ?       ? 
1 1 1   38   17    2 o    340.6    2.7    0.0000   0.0000          ?        ?  1160.1937  18.5171          ?        ?      340.6        2.7       ?       ? 
1 1 1   38   17    3 o    180.2    3.7    0.0000   0.0000          ?        ?   325.0075  13.4090          ?        ?      180.2        3.7       ?       ? 
1 1 1   38   17    4 o    513.2    2.8    0.0000   0.0000          ?        ?  2633.9016  28.7335          ?        ?      513.2        2.8       ?       ? 
1 1 1   38   17    5 o    365.2    2.6    0.0000   0.0000          ?        ?  1333.8716  19.1556          ?        ?      365.2        2.6       ?       ? 
1 1 1   38   17    6 o    238.1    3.2    0.0000   0.0000          ?        ?   567.0072  15.3245          ?        ?      238.1        3.2       ?       ? 
1 1 1   38   17    7 o    261.7    2.8    0.0000   0.0000          ?        ?   685.1337  14.6860          ?        ?      261.7        2.8       ?       ? 
1 1 1   38   17    8 o    635.2    2.9    0.0000   0.0000          ?        ?  4035.4568  36.3957          ?        ?      635.2        2.9       ?       ? 
1 1 1   38   17    9 f    265.1    2.6    0.0000   0.0000          ?        ?   703.0123  14.0475          ?        ?      265.1        2.6       ?       ? 
1 1 1   38   17   10 o    689.7    3.1    0.0000   0.0000          ?        ?  4757.6245  42.1424          ?        ?      689.7        3.1       ?       ? 
1 1 1   38   17   11 o    241.2    2.8    0.0000   0.0000          ?        ?   581.6932  13.4090          ?        ?      241.2        2.8       ?       ? 
1 1 1   38   17   12 o    503.7    2.4    0.0000   0.0000          ?        ?  2537.4849  24.2638          ?        ?      503.7        2.4       ?       ? 
1 1 1   38   17   13 f    195.1    2.6    0.0000   0.0000          ?        ?   380.5589  10.2163          ?        ?      195.1        2.6       ?       ? 
1 1 1   38   17   14 o    308.9    2.6    0.0000   0.0000          ?        ?   954.5898  15.9630          ?        ?      308.9        2.6       ?       ? 
1 1 1   38   17   15 o     35.1   12.7    0.0000   0.0000          ?        ?    10.2163  11.4934          ?        ?       35.1       12.7       ?       ? 
1 1 1   38   17   16 o    261.7    2.7    0.0000   0.0000          ?        ?   685.1337  14.0475          ?        ?      261.7        2.7       ?       ? 
1 1 1   38   17   17 o    255.7    2.6    0.0000   0.0000          ?        ?   653.8461  13.4090          ?        ?      255.7        2.6       ?       ? 
1 1 1   38   17   18 o    246.6    3.0    0.0000   0.0000          ?        ?   608.5111  14.6860          ?        ?      246.6        3.0       ?       ? 
1 1 1   38   17   19 o    736.5    3.0    0.0000   0.0000          ?        ?  5426.1567  44.0580          ?        ?      736.5        3.0       ?       ? 
1 1 1   38   17   20 o    202.4    3.2    0.0000   0.0000          ?        ?   409.9309  12.7704          ?        ?      202.4        3.2       ?       ? 
1 1 1   38   17   21 o    347.9    2.5    0.0000   0.0000          ?        ?  1210.6371  17.2401          ?        ?      347.9        2.5       ?       ? 
1 1 1   38   17   22 o    237.7    2.8    0.0000   0.0000          ?        ?   565.0916  13.4090          ?        ?      237.7        2.8       ?       ? 
1 1 1   38   17   23 o    133.2    4.6    0.0000   0.0000          ?        ?   177.5090  12.1319          ?        ?      133.2        4.6       ?       ? 
1 1 1   38   17   24 o     65.2   10.8    0.0000   0.0000          ?        ?    42.7809  14.0475          ?        ?       65.2       10.8       ?       ? 
1 1 1   38   17   25 o    381.5    2.4    0.0000   0.0000          ?        ?  1455.8293  18.5171          ?        ?      381.5        2.4       ?       ? 
1 1 1   38   17   26 o    408.7    2.3    0.0000   0.0000          ?        ?  1671.0112  19.1556          ?        ?      408.7        2.3       ?       ? 
1 1 1   38   17   27 o    432.1    2.5    0.0000   0.0000          ?        ?  1867.6758  21.7097          ?        ?      432.1        2.5       ?       ? 
1 1 1   38   17   28 o    548.0    2.6    0.0000   0.0000          ?        ?  3003.6057  28.0950          ?        ?      548.0        2.6       ?       ? 
1 1 1   38   17   29 o    451.2    2.5    0.0000   0.0000          ?        ?  2036.8840  22.3483          ?        ?      451.2        2.5       ?       ? 
1 1 1   38   17   30 o    573.1    2.7    0.0000   0.0000          ?        ?  3285.1938  30.6490          ?        ?      573.1        2.7       ?       ? 
1 1 1   38   17   31 o    353.4    2.6    0.0000   0.0000          ?        ?  1249.5868  18.5171          ?        ?      353.4        2.6       ?       ? 
1 1 1   38   17   32 f    263.9    3.0    0.0000   0.0000          ?        ?   696.6271  15.9630          ?        ?      263.9        3.0       ?       ? 
1 1 1   38   17   33 o    560.4    2.6    0.0000   0.0000          ?        ?  3141.5264  29.3720          ?        ?      560.4        2.6       ?       ? 
1 1 1   38   17   34 o    247.2    3.2    0.0000   0.0000          ?        ?   611.7037  15.9630          ?        ?      247.2        3.2       ?       ? 
1 1 1   38   17   35 o    476.5    2.7    0.0000   0.0000          ?        ?  2271.2214  26.1794          ?        ?      476.5        2.7       ?       ? 
1 1 1   38   17   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   17   37 o    116.5    6.6    0.0000   0.0000          ?        ?   136.0051  15.3245          ?        ?      116.5        6.6       ?       ? 
1 1 1   38   17   38 o     92.6    8.3    0.0000   0.0000          ?        ?    86.2004  15.3245          ?        ?       92.6        8.3       ?       ? 
1 1 1   38   17   39 o    170.1    4.7    0.0000   0.0000          ?        ?   289.8888  15.9630          ?        ?      170.1        4.7       ?       ? 
1 1 1   38   17   40 o    175.3    4.6    0.0000   0.0000          ?        ?   307.7674  15.9630          ?        ?      175.3        4.6       ?       ? 
1 1 1   38   17   41 f    126.1    6.6    0.0000   0.0000          ?        ?   159.6304  16.6016          ?        ?      126.1        6.6       ?       ? 
1 1 1   38   17   42 o    185.0    4.5    0.0000   0.0000          ?        ?   342.8861  16.6016          ?        ?      185.0        4.5       ?       ? 
1 1 1   38   17   43 o     22.6   11.1    0.0000   0.0000          ?        ?   -31.2876  16.6016          ?        ?       22.6       11.1       ?       ? 
1 1 1   38   17   44 o    232.7    3.8    0.0000   0.0000          ?        ?   542.1049  17.8786          ?        ?      232.7        3.8       ?       ? 
1 1 1   38   17   45 o    108.7    7.6    0.0000   0.0000          ?        ?   118.7650  16.6016          ?        ?      108.7        7.6       ?       ? 
1 1 1   38   17   46 o    177.4    4.9    0.0000   0.0000          ?        ?   315.4297  17.2401          ?        ?      177.4        4.9       ?       ? 
1 1 1   38   17   47 o    150.5    5.9    0.0000   0.0000          ?        ?   227.3137  17.8786          ?        ?      150.5        5.9       ?       ? 
1 1 1   38   17   48 o    386.7    2.9    0.0000   0.0000          ?        ?  1496.6947  22.3483          ?        ?      386.7        2.9       ?       ? 
1 1 1   38   17   49 f    100.3    8.9    0.0000   0.0000          ?        ?   101.5249  17.8786          ?        ?      100.3        8.9       ?       ? 
1 1 1   38   17   50 o    188.3    5.3    0.0000   0.0000          ?        ?   355.6566  19.7942          ?        ?      188.3        5.3       ?       ? 
1 1 1   38   17   51 o    199.2    4.6    0.0000   0.0000          ?        ?   397.7990  18.5171          ?        ?      199.2        4.6       ?       ? 
1 1 1   38   17   52 f     98.5    9.4    0.0000   0.0000          ?        ?    98.3323  18.5171          ?        ?       98.5        9.4       ?       ? 
1 1 1   38   17   53 o    191.9    5.0    0.0000   0.0000          ?        ?   369.7040  19.1556          ?        ?      191.9        5.0       ?       ? 
1 1 1   38   17   54 o     19.6    9.9    0.0000   0.0000          ?        ?   -60.6596  18.5171          ?        ?       19.6        9.9       ?       ? 
1 1 1   38   17   55 o    225.5    4.2    0.0000   0.0000          ?        ?   510.1788  19.1556          ?        ?      225.5        4.2       ?       ? 
1 1 1   38   17   56 o     88.3   10.5    0.0000   0.0000          ?        ?    79.8152  18.5171          ?        ?       88.3       10.5       ?       ? 
1 1 1   38   18    0 f    292.7    3.8  857.5345  22.3483   857.5345  22.3483   857.5345  22.3483      292.7      3.8      292.7        3.8     0.0     0.0 
1 1 1   38   18    1 o     87.1    6.6    0.0000   0.0000          ?        ?    75.9841  11.4934          ?        ?       87.1        6.6       ?       ? 
1 1 1   38   18    2 o    236.2    3.1    0.0000   0.0000          ?        ?   558.0679  14.6860          ?        ?      236.2        3.1       ?       ? 
1 1 1   38   18    3 o    205.9    3.3    0.0000   0.0000          ?        ?   423.9784  13.4090          ?        ?      205.9        3.3       ?       ? 
1 1 1   38   18    4 o    129.5    4.9    0.0000   0.0000          ?        ?   167.9312  12.7704          ?        ?      129.5        4.9       ?       ? 
1 1 1   38   18    5 o    206.2    3.4    0.0000   0.0000          ?        ?   425.2554  14.0475          ?        ?      206.2        3.4       ?       ? 
1 1 1   38   18    6 o    197.5    3.7    0.0000   0.0000          ?        ?   390.1367  14.6860          ?        ?      197.5        3.7       ?       ? 
1 1 1   38   18    7 o    235.0    3.3    0.0000   0.0000          ?        ?   552.3212  15.3245          ?        ?      235.0        3.3       ?       ? 
1 1 1   38   18    8 o    346.2    2.7    0.0000   0.0000          ?        ?  1199.1437  18.5171          ?        ?      346.2        2.7       ?       ? 
1 1 1   38   18    9 o    171.5    3.2    0.0000   0.0000          ?        ?   294.3585  10.8549          ?        ?      171.5        3.2       ?       ? 
1 1 1   38   18   10 o    321.5    2.6    0.0000   0.0000          ?        ?  1033.7665  16.6016          ?        ?      321.5        2.6       ?       ? 
1 1 1   38   18   11 o    407.3    2.5    0.0000   0.0000          ?        ?  1659.5177  20.4327          ?        ?      407.3        2.5       ?       ? 
1 1 1   38   18   12 o    279.3    2.7    0.0000   0.0000          ?        ?   780.2734  15.3245          ?        ?      279.3        2.7       ?       ? 
1 1 1   38   18   13 o    391.9    2.7    0.0000   0.0000          ?        ?  1536.2831  21.0712          ?        ?      391.9        2.7       ?       ? 
1 1 1   38   18   14 f    539.4    2.7    0.0000   0.0000          ?        ?  2909.7432  28.7335          ?        ?      539.4        2.7       ?       ? 
1 1 1   38   18   15 o     66.3    7.2    0.0000   0.0000          ?        ?    44.0580   9.5778          ?        ?       66.3        7.2       ?       ? 
1 1 1   38   18   16 o    298.5    2.6    0.0000   0.0000          ?        ?   891.3762  15.3245          ?        ?      298.5        2.6       ?       ? 
1 1 1   38   18   17 o    166.0    3.5    0.0000   0.0000          ?        ?   275.8413  11.4934          ?        ?      166.0        3.5       ?       ? 
1 1 1   38   18   18 o    201.3    3.2    0.0000   0.0000          ?        ?   405.4612  12.7704          ?        ?      201.3        3.2       ?       ? 
1 1 1   38   18   19 o    397.1    2.5    0.0000   0.0000          ?        ?  1577.1484  19.7942          ?        ?      397.1        2.5       ?       ? 
1 1 1   38   18   20 o    265.5    2.8    0.0000   0.0000          ?        ?   704.9279  14.6860          ?        ?      265.5        2.8       ?       ? 
1 1 1   38   18   21 o    277.7    2.6    0.0000   0.0000          ?        ?   771.3342  14.6860          ?        ?      277.7        2.6       ?       ? 
1 1 1   38   18   22 o    264.9    2.7    0.0000   0.0000          ?        ?   701.7353  14.0475          ?        ?      264.9        2.7       ?       ? 
1 1 1   38   18   23 o    183.9    3.6    0.0000   0.0000          ?        ?   338.4165  13.4090          ?        ?      183.9        3.6       ?       ? 
1 1 1   38   18   24 o    225.0    3.0    0.0000   0.0000          ?        ?   506.3477  13.4090          ?        ?      225.0        3.0       ?       ? 
1 1 1   38   18   25 o    303.9    2.5    0.0000   0.0000          ?        ?   923.9408  15.3245          ?        ?      303.9        2.5       ?       ? 
1 1 1   38   18   26 f    201.6    3.5    0.0000   0.0000          ?        ?   406.7383  14.0475          ?        ?      201.6        3.5       ?       ? 
1 1 1   38   18   27 o    240.6    3.1    0.0000   0.0000          ?        ?   579.1391  14.6860          ?        ?      240.6        3.1       ?       ? 
1 1 1   38   18   28 o    310.7    2.7    0.0000   0.0000          ?        ?   965.4447  16.6016          ?        ?      310.7        2.7       ?       ? 
1 1 1   38   18   29 o     82.9    8.1    0.0000   0.0000          ?        ?    68.9603  13.4090          ?        ?       82.9        8.1       ?       ? 
1 1 1   38   18   30 o    345.6    2.6    0.0000   0.0000          ?        ?  1194.6740  17.8786          ?        ?      345.6        2.6       ?       ? 
1 1 1   38   18   31 o    257.9    3.1    0.0000   0.0000          ?        ?   665.3395  15.9630          ?        ?      257.9        3.1       ?       ? 
1 1 1   38   18   32 o    107.7    6.8    0.0000   0.0000          ?        ?   116.2109  14.6860          ?        ?      107.7        6.8       ?       ? 
1 1 1   38   18   33 o    278.1    3.0    0.0000   0.0000          ?        ?   773.8882  16.6016          ?        ?      278.1        3.0       ?       ? 
1 1 1   38   18   34 o    325.6    2.7    0.0000   0.0000          ?        ?  1060.5845  17.8786          ?        ?      325.6        2.7       ?       ? 
1 1 1   38   18   35 o     95.7    7.7    0.0000   0.0000          ?        ?    91.9471  14.6860          ?        ?       95.7        7.7       ?       ? 
1 1 1   38   18   36 o    193.3    4.1    0.0000   0.0000          ?        ?   374.1737  15.9630          ?        ?      193.3        4.1       ?       ? 
1 1 1   38   18   37 o    187.3    4.3    0.0000   0.0000          ?        ?   351.1869  15.9630          ?        ?      187.3        4.3       ?       ? 
1 1 1   38   18   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   18   39 o     20.4   10.1    0.0000   0.0000          ?        ?   -38.9498  15.9630          ?        ?       20.4       10.1       ?       ? 
1 1 1   38   18   40 o    107.0    7.5    0.0000   0.0000          ?        ?   114.9339  15.9630          ?        ?      107.0        7.5       ?       ? 
1 1 1   38   18   41 o    340.2    2.9    0.0000   0.0000          ?        ?  1158.2782  19.7942          ?        ?      340.2        2.9       ?       ? 
1 1 1   38   18   42 o    151.4    5.7    0.0000   0.0000          ?        ?   229.8678  17.2401          ?        ?      151.4        5.7       ?       ? 
1 1 1   38   18   43 o     63.1   14.0    0.0000   0.0000          ?        ?    42.1424  17.2401          ?        ?       63.1       14.0       ?       ? 
1 1 1   38   18   44 o    158.4    5.6    0.0000   0.0000          ?        ?   251.5775  17.8786          ?        ?      158.4        5.6       ?       ? 
1 1 1   38   18   45 o    335.8    3.0    0.0000   0.0000          ?        ?  1128.9062  20.4327          ?        ?      335.8        3.0       ?       ? 
1 1 1   38   18   46 o     67.9   13.2    0.0000   0.0000          ?        ?    48.5276  17.2401          ?        ?       67.9       13.2       ?       ? 
1 1 1   38   18   47 o    131.2    7.1    0.0000   0.0000          ?        ?   173.0394  18.5171          ?        ?      131.2        7.1       ?       ? 
1 1 1   38   18   48 o     20.7   10.4    0.0000   0.0000          ?        ?   -48.5276  17.8786          ?        ?       20.7       10.4       ?       ? 
1 1 1   38   18   49 o    353.6    3.1    0.0000   0.0000          ?        ?  1251.5024  21.7097          ?        ?      353.6        3.1       ?       ? 
1 1 1   38   18   50 o     41.2   15.7    0.0000   0.0000          ?        ?    12.7704  17.8786          ?        ?       41.2       15.7       ?       ? 
1 1 1   38   18   51 o    215.7    4.3    0.0000   0.0000          ?        ?   466.7593  18.5171          ?        ?      215.7        4.3       ?       ? 
1 1 1   38   18   52 o     37.6   15.4    0.0000   0.0000          ?        ?     5.7467  18.5171          ?        ?       37.6       15.4       ?       ? 
1 1 1   38   18   53 o    323.3    3.3    0.0000   0.0000          ?        ?  1047.1754  21.0712          ?        ?      323.3        3.3       ?       ? 
1 1 1   38   18   54 o     98.1    9.1    0.0000   0.0000          ?        ?    97.6938  17.8786          ?        ?       98.1        9.1       ?       ? 
1 1 1   38   18   55 o     27.1   12.8    0.0000   0.0000          ?        ?   -20.4327  18.5171          ?        ?       27.1       12.8       ?       ? 
1 1 1   38   19    0 o    269.0    3.9  724.0836  21.0712   724.0836  21.0712   724.0836  21.0712      269.0      3.9      269.0        3.9     0.0     0.0 
1 1 1   38   19    1 o    263.3    2.8    0.0000   0.0000          ?        ?   693.4344  14.6860          ?        ?      263.3        2.8       ?       ? 
1 1 1   38   19    2 o    502.8    2.8    0.0000   0.0000          ?        ?  2529.1841  28.0950          ?        ?      502.8        2.8       ?       ? 
1 1 1   38   19    3 o    262.9    2.9    0.0000   0.0000          ?        ?   691.5189  15.3245          ?        ?      262.9        2.9       ?       ? 
1 1 1   38   19    4 o    189.4    3.5    0.0000   0.0000          ?        ?   358.8492  13.4090          ?        ?      189.4        3.5       ?       ? 
1 1 1   38   19    5 o    570.7    2.9    0.0000   0.0000          ?        ?  3258.3757  33.2031          ?        ?      570.7        2.9       ?       ? 
1 1 1   38   19    6 o    296.8    2.9    0.0000   0.0000          ?        ?   881.1599  17.2401          ?        ?      296.8        2.9       ?       ? 
1 1 1   38   19    7 o    590.2    3.0    0.0000   0.0000          ?        ?  3484.4126  35.1187          ?        ?      590.2        3.0       ?       ? 
1 1 1   38   19    8 o    210.8    3.5    0.0000   0.0000          ?        ?   444.4110  14.6860          ?        ?      210.8        3.5       ?       ? 
1 1 1   38   19    9 o    278.2    2.8    0.0000   0.0000          ?        ?   773.8882  15.3245          ?        ?      278.2        2.8       ?       ? 
1 1 1   38   19   10 o    362.5    2.6    0.0000   0.0000          ?        ?  1314.0775  18.5171          ?        ?      362.5        2.6       ?       ? 
1 1 1   38   19   11 o    587.6    3.2    0.0000   0.0000          ?        ?  3453.7637  37.0343          ?        ?      587.6        3.2       ?       ? 
1 1 1   38   19   12 o    445.1    2.7    0.0000   0.0000          ?        ?  1981.3325  24.2638          ?        ?      445.1        2.7       ?       ? 
1 1 1   38   19   13 o    397.6    2.6    0.0000   0.0000          ?        ?  1580.9796  20.4327          ?        ?      397.6        2.6       ?       ? 
1 1 1   38   19   14 o    250.1    2.8    0.0000   0.0000          ?        ?   625.7512  14.0475          ?        ?      250.1        2.8       ?       ? 
1 1 1   38   19   15 o    493.9    2.5    0.0000   0.0000          ?        ?  2439.7913  24.2638          ?        ?      493.9        2.5       ?       ? 
1 1 1   38   19   16 o    301.9    2.4    0.0000   0.0000          ?        ?   911.8089  14.6860          ?        ?      301.9        2.4       ?       ? 
1 1 1   38   19   17 o    398.4    2.5    0.0000   0.0000          ?        ?  1588.0033  19.7942          ?        ?      398.4        2.5       ?       ? 
1 1 1   38   19   18 o    318.1    2.4    0.0000   0.0000          ?        ?  1012.0568  15.3245          ?        ?      318.1        2.4       ?       ? 
1 1 1   38   19   19 o    355.0    2.4    0.0000   0.0000          ?        ?  1260.4417  17.2401          ?        ?      355.0        2.4       ?       ? 
1 1 1   38   19   20 o    298.4    2.6    0.0000   0.0000          ?        ?   890.7377  15.3245          ?        ?      298.4        2.6       ?       ? 
1 1 1   38   19   21 o    160.8    4.0    0.0000   0.0000          ?        ?   258.6013  12.7704          ?        ?      160.8        4.0       ?       ? 
1 1 1   38   19   22 f    280.0    2.6    0.0000   0.0000          ?        ?   784.1046  14.6860          ?        ?      280.0        2.6       ?       ? 
1 1 1   38   19   23 o    450.5    2.5    0.0000   0.0000          ?        ?  2030.4988  22.3483          ?        ?      450.5        2.5       ?       ? 
1 1 1   38   19   24 o    289.1    2.7    0.0000   0.0000          ?        ?   835.8248  15.3245          ?        ?      289.1        2.7       ?       ? 
1 1 1   38   19   25 o    194.0    3.6    0.0000   0.0000          ?        ?   376.7278  14.0475          ?        ?      194.0        3.6       ?       ? 
1 1 1   38   19   26 o    120.6    5.3    0.0000   0.0000          ?        ?   145.5829  12.7704          ?        ?      120.6        5.3       ?       ? 
1 1 1   38   19   27 o    162.1    4.1    0.0000   0.0000          ?        ?   263.0709  13.4090          ?        ?      162.1        4.1       ?       ? 
1 1 1   38   19   28 o    295.2    2.7    0.0000   0.0000          ?        ?   871.5820  15.9630          ?        ?      295.2        2.7       ?       ? 
1 1 1   38   19   29 o    445.3    2.5    0.0000   0.0000          ?        ?  1983.8867  22.3483          ?        ?      445.3        2.5       ?       ? 
1 1 1   38   19   30 o     62.6   12.2    0.0000   0.0000          ?        ?    40.8654  14.6860          ?        ?       62.6       12.2       ?       ? 
1 1 1   38   19   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   19   32 o    409.5    2.6    0.0000   0.0000          ?        ?  1677.3964  21.0712          ?        ?      409.5        2.6       ?       ? 
1 1 1   38   19   33 f    144.8    5.1    0.0000   0.0000          ?        ?   210.0736  14.6860          ?        ?      144.8        5.1       ?       ? 
1 1 1   38   19   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   19   35 o    194.1    4.1    0.0000   0.0000          ?        ?   377.3663  15.9630          ?        ?      194.1        4.1       ?       ? 
1 1 1   38   19   36 o    194.1    4.1    0.0000   0.0000          ?        ?   377.3663  15.9630          ?        ?      194.1        4.1       ?       ? 
1 1 1   38   19   37 o     29.5   13.1    0.0000   0.0000          ?        ?    -5.1082  15.3245          ?        ?       29.5       13.1       ?       ? 
1 1 1   38   19   38 o    222.8    3.9    0.0000   0.0000          ?        ?   496.7698  17.2401          ?        ?      222.8        3.9       ?       ? 
1 1 1   38   19   39 o    159.5    4.8    0.0000   0.0000          ?        ?   254.7701  15.3245          ?        ?      159.5        4.8       ?       ? 
1 1 1   38   19   40 o    331.4    2.9    0.0000   0.0000          ?        ?  1098.8958  19.1556          ?        ?      331.4        2.9       ?       ? 
1 1 1   38   19   41 o    220.7    3.9    0.0000   0.0000          ?        ?   487.8305  17.2401          ?        ?      220.7        3.9       ?       ? 
1 1 1   38   19   42 o     23.8   11.4    0.0000   0.0000          ?        ?   -23.6253  15.9630          ?        ?       23.8       11.4       ?       ? 
1 1 1   38   19   43 o    182.2    4.7    0.0000   0.0000          ?        ?   332.6698  17.2401          ?        ?      182.2        4.7       ?       ? 
1 1 1   38   19   44 o     88.9    9.3    0.0000   0.0000          ?        ?    79.8152  16.6016          ?        ?       88.9        9.3       ?       ? 
1 1 1   38   19   45 o     90.3    9.9    0.0000   0.0000          ?        ?    82.3693  17.8786          ?        ?       90.3        9.9       ?       ? 
1 1 1   38   19   46 o    392.7    2.8    0.0000   0.0000          ?        ?  1543.3068  21.7097          ?        ?      392.7        2.8       ?       ? 
1 1 1   38   19   47 o     41.3   15.5    0.0000   0.0000          ?        ?    13.4090  17.2401          ?        ?       41.3       15.5       ?       ? 
1 1 1   38   19   48 o     47.7   15.9    0.0000   0.0000          ?        ?    22.3483  17.8786          ?        ?       47.7       15.9       ?       ? 
1 1 1   38   19   49 o     88.3   10.1    0.0000   0.0000          ?        ?    79.1767  17.8786          ?        ?       88.3       10.1       ?       ? 
1 1 1   38   19   50 o    168.9    5.5    0.0000   0.0000          ?        ?   286.6962  18.5171          ?        ?      168.9        5.5       ?       ? 
1 1 1   38   19   51 o    153.2    6.3    0.0000   0.0000          ?        ?   236.2530  19.1556          ?        ?      153.2        6.3       ?       ? 
1 1 1   38   19   52 o    113.5    7.9    0.0000   0.0000          ?        ?   130.2584  17.8786          ?        ?      113.5        7.9       ?       ? 
1 1 1   38   19   53 o    277.7    3.6    0.0000   0.0000          ?        ?   773.2497  19.7942          ?        ?      277.7        3.6       ?       ? 
1 1 1   38   19   54 o     94.4    9.1    0.0000   0.0000          ?        ?    90.6701  17.2401          ?        ?       94.4        9.1       ?       ? 
1 1 1   38   20    0 o    116.9    7.4  138.5592  17.2401   138.5592  17.2401   138.5592  17.2401      116.9      7.4      116.9        7.4     0.0     0.0 
1 1 1   38   20    1 o    428.0    2.8    0.0000   0.0000          ?        ?  1832.5571  24.2638          ?        ?      428.0        2.8       ?       ? 
1 1 1   38   20    2 o    245.1    2.9    0.0000   0.0000          ?        ?   600.8488  14.0475          ?        ?      245.1        2.9       ?       ? 
1 1 1   38   20    3 o    265.9    2.9    0.0000   0.0000          ?        ?   707.4820  15.3245          ?        ?      265.9        2.9       ?       ? 
1 1 1   38   20    4 o    428.3    2.7    0.0000   0.0000          ?        ?  1835.1111  22.9868          ?        ?      428.3        2.7       ?       ? 
1 1 1   38   20    5 o    108.3    5.3    0.0000   0.0000          ?        ?   117.4880  11.4934          ?        ?      108.3        5.3       ?       ? 
1 1 1   38   20    6 o    398.5    2.8    0.0000   0.0000          ?        ?  1588.6418  22.3483          ?        ?      398.5        2.8       ?       ? 
1 1 1   38   20    7 o    510.8    3.3    0.0000   0.0000          ?        ?  2610.2764  33.8416          ?        ?      510.8        3.3       ?       ? 
1 1 1   38   20    8 o    489.2    3.1    0.0000   0.0000          ?        ?  2393.8176  30.6490          ?        ?      489.2        3.1       ?       ? 
1 1 1   38   20    9 o    200.7    3.7    0.0000   0.0000          ?        ?   402.9071  14.6860          ?        ?      200.7        3.7       ?       ? 
1 1 1   38   20   10 o    158.6    3.4    0.0000   0.0000          ?        ?   251.5775  10.8549          ?        ?      158.6        3.4       ?       ? 
1 1 1   38   20   11 o    697.1    3.2    0.0000   0.0000          ?        ?  4861.7036  44.6965          ?        ?      697.1        3.2       ?       ? 
1 1 1   38   20   12 o    144.7    4.0    0.0000   0.0000          ?        ?   209.4351  11.4934          ?        ?      144.7        4.0       ?       ? 
1 1 1   38   20   13 o    268.9    2.6    0.0000   0.0000          ?        ?   723.4450  14.0475          ?        ?      268.9        2.6       ?       ? 
1 1 1   38   20   14 o    424.5    2.6    0.0000   0.0000          ?        ?  1802.5465  22.3483          ?        ?      424.5        2.6       ?       ? 
1 1 1   38   20   15 o    220.8    2.3    0.0000   0.0000          ?        ?   487.8305  10.2163          ?        ?      220.8        2.3       ?       ? 
1 1 1   38   20   16 o    313.3    2.4    0.0000   0.0000          ?        ?   982.0463  15.3245          ?        ?      313.3        2.4       ?       ? 
1 1 1   38   20   17 o     95.5    5.3    0.0000   0.0000          ?        ?    91.3086  10.2163          ?        ?       95.5        5.3       ?       ? 
1 1 1   38   20   18 o    137.4    4.4    0.0000   0.0000          ?        ?   189.0024  12.1319          ?        ?      137.4        4.4       ?       ? 
1 1 1   38   20   19 o    145.3    4.0    0.0000   0.0000          ?        ?   211.3506  11.4934          ?        ?      145.3        4.0       ?       ? 
1 1 1   38   20   20 o    234.8    2.9    0.0000   0.0000          ?        ?   551.6827  13.4090          ?        ?      234.8        2.9       ?       ? 
1 1 1   38   20   21 o    378.2    2.5    0.0000   0.0000          ?        ?  1430.9270  19.1556          ?        ?      378.2        2.5       ?       ? 
1 1 1   38   20   22 o    227.6    2.9    0.0000   0.0000          ?        ?   518.4796  13.4090          ?        ?      227.6        2.9       ?       ? 
1 1 1   38   20   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   20   24 o    144.2    4.2    0.0000   0.0000          ?        ?   208.1580  12.1319          ?        ?      144.2        4.2       ?       ? 
1 1 1   38   20   25 o     80.1    8.4    0.0000   0.0000          ?        ?    64.4907  13.4090          ?        ?       80.1        8.4       ?       ? 
1 1 1   38   20   26 o    560.1    2.7    0.0000   0.0000          ?        ?  3138.9724  30.0105          ?        ?      560.1        2.7       ?       ? 
1 1 1   38   20   27 o    279.8    2.9    0.0000   0.0000          ?        ?   783.4660  15.9630          ?        ?      279.8        2.9       ?       ? 
1 1 1   38   20   28 f    116.5    6.3    0.0000   0.0000          ?        ?   136.0051  14.6860          ?        ?      116.5        6.3       ?       ? 
1 1 1   38   20   29 o    193.5    4.0    0.0000   0.0000          ?        ?   374.8122  15.3245          ?        ?      193.5        4.0       ?       ? 
1 1 1   38   20   30 o     16.5    8.4    0.0000   0.0000          ?        ?   -50.4432  14.0475          ?        ?       16.5        8.4       ?       ? 
1 1 1   38   20   31 o    309.5    2.7    0.0000   0.0000          ?        ?   958.4210  16.6016          ?        ?      309.5        2.7       ?       ? 
1 1 1   38   20   32 o     71.2   10.8    0.0000   0.0000          ?        ?    51.0817  15.3245          ?        ?       71.2       10.8       ?       ? 
1 1 1   38   20   33 o    296.7    2.8    0.0000   0.0000          ?        ?   880.5213  16.6016          ?        ?      296.7        2.8       ?       ? 
1 1 1   38   20   34 o    112.5    6.8    0.0000   0.0000          ?        ?   127.0658  15.3245          ?        ?      112.5        6.8       ?       ? 
1 1 1   38   20   35 o    377.8    2.7    0.0000   0.0000          ?        ?  1427.7344  20.4327          ?        ?      377.8        2.7       ?       ? 
1 1 1   38   20   36 o     21.1   10.4    0.0000   0.0000          ?        ?   -31.9261  15.3245          ?        ?       21.1       10.4       ?       ? 
1 1 1   38   20   37 o     39.8   15.1    0.0000   0.0000          ?        ?    11.4934  16.6016          ?        ?       39.8       15.1       ?       ? 
1 1 1   38   20   38 o    159.9    5.0    0.0000   0.0000          ?        ?   256.0471  15.9630          ?        ?      159.9        5.0       ?       ? 
1 1 1   38   20   39 o     75.0   10.6    0.0000   0.0000          ?        ?    56.8284  15.9630          ?        ?       75.0       10.6       ?       ? 
1 1 1   38   20   40 o    215.3    4.0    0.0000   0.0000          ?        ?   464.2052  17.2401          ?        ?      215.3        4.0       ?       ? 
1 1 1   38   20   41 o    101.1    8.2    0.0000   0.0000          ?        ?   102.8020  16.6016          ?        ?      101.1        8.2       ?       ? 
1 1 1   38   20   42 o    245.2    3.6    0.0000   0.0000          ?        ?   602.1259  17.8786          ?        ?      245.2        3.6       ?       ? 
1 1 1   38   20   43 o    165.7    5.2    0.0000   0.0000          ?        ?   275.2028  17.2401          ?        ?      165.7        5.2       ?       ? 
1 1 1   38   20   44 o    141.3    6.1    0.0000   0.0000          ?        ?   200.4958  17.2401          ?        ?      141.3        6.1       ?       ? 
1 1 1   38   20   45 o     76.9   11.2    0.0000   0.0000          ?        ?    60.0210  17.2401          ?        ?       76.9       11.2       ?       ? 
1 1 1   38   20   46 o     69.2   12.9    0.0000   0.0000          ?        ?    50.4432  17.2401          ?        ?       69.2       12.9       ?       ? 
1 1 1   38   20   47 o    374.3    2.9    0.0000   0.0000          ?        ?  1402.8320  21.7097          ?        ?      374.3        2.9       ?       ? 
1 1 1   38   20   48 o    278.3    3.6    0.0000   0.0000          ?        ?   775.8038  19.7942          ?        ?      278.3        3.6       ?       ? 
1 1 1   38   20   49 o    117.8    7.3    0.0000   0.0000          ?        ?   139.8362  17.2401          ?        ?      117.8        7.3       ?       ? 
1 1 1   38   20   50 o     94.9    9.4    0.0000   0.0000          ?        ?    91.3086  17.8786          ?        ?       94.9        9.4       ?       ? 
1 1 1   38   20   51 o    187.7    4.6    0.0000   0.0000          ?        ?   353.7410  17.2401          ?        ?      187.7        4.6       ?       ? 
1 1 1   38   20   52 o    122.7    7.0    0.0000   0.0000          ?        ?   151.9681  17.2401          ?        ?      122.7        7.0       ?       ? 
1 1 1   38   20   53 o    181.9    5.1    0.0000   0.0000          ?        ?   332.6698  18.5171          ?        ?      181.9        5.1       ?       ? 
1 1 1   38   21    0 o    469.6    3.7 2206.7307  35.1187  2206.7307  35.1187  2206.7307  35.1187      469.6      3.7      469.6        3.7     0.0     0.0 
1 1 1   38   21    1 o     75.3    7.2    0.0000   0.0000          ?        ?    56.8284  10.8549          ?        ?       75.3        7.2       ?       ? 
1 1 1   38   21    2 o    112.9    5.9    0.0000   0.0000          ?        ?   127.7043  13.4090          ?        ?      112.9        5.9       ?       ? 
1 1 1   38   21    3 o    516.2    3.3    0.0000   0.0000          ?        ?  2665.8279  34.4802          ?        ?      516.2        3.3       ?       ? 
1 1 1   38   21    4 o    353.7    2.9    0.0000   0.0000          ?        ?  1251.5024  20.4327          ?        ?      353.7        2.9       ?       ? 
1 1 1   38   21    5 o     57.7   10.3    0.0000   0.0000          ?        ?    34.4802  11.4934          ?        ?       57.7       10.3       ?       ? 
1 1 1   38   21    6 f    334.8    2.9    0.0000   0.0000          ?        ?  1121.2440  19.1556          ?        ?      334.8        2.9       ?       ? 
1 1 1   38   21    7 f    550.2    3.0    0.0000   0.0000          ?        ?  3028.5081  33.2031          ?        ?      550.2        3.0       ?       ? 
1 1 1   38   21    8 o    730.2    3.6    0.0000   0.0000          ?        ?  5334.2100  52.3588          ?        ?      730.2        3.6       ?       ? 
1 1 1   38   21    9 o    399.3    3.0    0.0000   0.0000          ?        ?  1595.0271  23.6253          ?        ?      399.3        3.0       ?       ? 
1 1 1   38   21   10 o    352.8    2.7    0.0000   0.0000          ?        ?  1245.1172  19.1556          ?        ?      352.8        2.7       ?       ? 
1 1 1   38   21   11 o    136.0    3.8    0.0000   0.0000          ?        ?   185.1713  10.2163          ?        ?      136.0        3.8       ?       ? 
1 1 1   38   21   12 o    286.8    2.7    0.0000   0.0000          ?        ?   823.0543  15.3245          ?        ?      286.8        2.7       ?       ? 
1 1 1   38   21   13 o    431.1    2.5    0.0000   0.0000          ?        ?  1858.7365  21.7097          ?        ?      431.1        2.5       ?       ? 
1 1 1   38   21   14 o    311.0    2.7    0.0000   0.0000          ?        ?   967.3603  16.6016          ?        ?      311.0        2.7       ?       ? 
1 1 1   38   21   15 o    439.8    2.8    0.0000   0.0000          ?        ?  1935.3591  24.2638          ?        ?      439.8        2.8       ?       ? 
1 1 1   38   21   16 o    221.6    2.6    0.0000   0.0000          ?        ?   491.0231  11.4934          ?        ?      221.6        2.6       ?       ? 
1 1 1   38   21   17 o    395.4    2.3    0.0000   0.0000          ?        ?  1563.7394  18.5171          ?        ?      395.4        2.3       ?       ? 
1 1 1   38   21   18 o    388.7    2.4    0.0000   0.0000          ?        ?  1511.3806  18.5171          ?        ?      388.7        2.4       ?       ? 
1 1 1   38   21   19 o    382.7    2.3    0.0000   0.0000          ?        ?  1464.7686  17.8786          ?        ?      382.7        2.3       ?       ? 
1 1 1   38   21   20 o    384.3    2.4    0.0000   0.0000          ?        ?  1477.5391  18.5171          ?        ?      384.3        2.4       ?       ? 
1 1 1   38   21   21 o    183.6    3.5    0.0000   0.0000          ?        ?   337.1394  12.7704          ?        ?      183.6        3.5       ?       ? 
1 1 1   38   21   22 o    115.7    5.2    0.0000   0.0000          ?        ?   134.0895  12.1319          ?        ?      115.7        5.2       ?       ? 
1 1 1   38   21   23 o    385.6    2.4    0.0000   0.0000          ?        ?  1487.1168  18.5171          ?        ?      385.6        2.4       ?       ? 
1 1 1   38   21   24 o    463.9    2.5    0.0000   0.0000          ?        ?  2152.4565  22.9868          ?        ?      463.9        2.5       ?       ? 
1 1 1   38   21   25 o     40.2   13.5    0.0000   0.0000          ?        ?    15.3245  12.7704          ?        ?       40.2       13.5       ?       ? 
1 1 1   38   21   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   21   27 o    212.1    3.5    0.0000   0.0000          ?        ?   450.1577  14.6860          ?        ?      212.1        3.5       ?       ? 
1 1 1   38   21   28 o     33.6   13.6    0.0000   0.0000          ?        ?     5.1082  14.0475          ?        ?       33.6       13.6       ?       ? 
1 1 1   38   21   29 o    158.9    4.8    0.0000   0.0000          ?        ?   252.8546  15.3245          ?        ?      158.9        4.8       ?       ? 
1 1 1   38   21   30 o    156.3    4.9    0.0000   0.0000          ?        ?   244.5538  15.3245          ?        ?      156.3        4.9       ?       ? 
1 1 1   38   21   31 o    200.8    4.0    0.0000   0.0000          ?        ?   403.5457  15.9630          ?        ?      200.8        4.0       ?       ? 
1 1 1   38   21   32 o    234.1    3.7    0.0000   0.0000          ?        ?   548.4901  17.2401          ?        ?      234.1        3.7       ?       ? 
1 1 1   38   21   33 o    221.9    3.7    0.0000   0.0000          ?        ?   492.9387  16.6016          ?        ?      221.9        3.7       ?       ? 
1 1 1   38   21   34 o    117.3    6.3    0.0000   0.0000          ?        ?   137.9207  14.6860          ?        ?      117.3        6.3       ?       ? 
1 1 1   38   21   35 o    149.1    5.1    0.0000   0.0000          ?        ?   222.8441  15.3245          ?        ?      149.1        5.1       ?       ? 
1 1 1   38   21   36 o    163.4    4.7    0.0000   0.0000          ?        ?   267.5406  15.3245          ?        ?      163.4        4.7       ?       ? 
1 1 1   38   21   37 o     18.1    9.2    0.0000   0.0000          ?        ?   -53.6358  15.9630          ?        ?       18.1        9.2       ?       ? 
1 1 1   38   21   38 o     98.3    7.8    0.0000   0.0000          ?        ?    97.0553  15.3245          ?        ?       98.3        7.8       ?       ? 
1 1 1   38   21   39 o    165.9    5.2    0.0000   0.0000          ?        ?   275.8413  17.2401          ?        ?      165.9        5.2       ?       ? 
1 1 1   38   21   40 o     92.9    8.2    0.0000   0.0000          ?        ?    86.8389  15.3245          ?        ?       92.9        8.2       ?       ? 
1 1 1   38   21   41 o    153.9    5.4    0.0000   0.0000          ?        ?   237.5300  16.6016          ?        ?      153.9        5.4       ?       ? 
1 1 1   38   21   42 o    116.3    6.9    0.0000   0.0000          ?        ?   136.0051  15.9630          ?        ?      116.3        6.9       ?       ? 
1 1 1   38   21   43 o    165.1    5.0    0.0000   0.0000          ?        ?   273.2873  16.6016          ?        ?      165.1        5.0       ?       ? 
1 1 1   38   21   44 o     17.7    9.0    0.0000   0.0000          ?        ?   -56.1899  15.9630          ?        ?       17.7        9.0       ?       ? 
1 1 1   38   21   45 o     29.3   13.4    0.0000   0.0000          ?        ?   -10.2163  17.2401          ?        ?       29.3       13.4       ?       ? 
1 1 1   38   21   46 o    152.9    6.1    0.0000   0.0000          ?        ?   234.9760  18.5171          ?        ?      152.9        6.1       ?       ? 
1 1 1   38   21   47 o     80.4   11.1    0.0000   0.0000          ?        ?    65.7677  17.8786          ?        ?       80.4       11.1       ?       ? 
1 1 1   38   21   48 o     46.3   15.7    0.0000   0.0000          ?        ?    21.0712  17.2401          ?        ?       46.3       15.7       ?       ? 
1 1 1   38   21   49 o     47.4   15.9    0.0000   0.0000          ?        ?    22.3483  17.8786          ?        ?       47.4       15.9       ?       ? 
1 1 1   38   21   50 o    126.1    6.6    0.0000   0.0000          ?        ?   160.2689  16.6016          ?        ?      126.1        6.6       ?       ? 
1 1 1   38   21   51 o     26.7   12.5    0.0000   0.0000          ?        ?   -15.3245  16.6016          ?        ?       26.7       12.5       ?       ? 
1 1 1   38   22    0 o    321.9    4.1 1036.9591  26.1794  1036.9591  26.1794  1036.9591  26.1794      321.9      4.1      321.9        4.1     0.0     0.0 
1 1 1   38   22    1 o     97.1    6.2    0.0000   0.0000          ?        ?    94.5012  12.1319          ?        ?       97.1        6.2       ?       ? 
1 1 1   38   22    2 o    482.9    2.9    0.0000   0.0000          ?        ?  2333.1580  28.0950          ?        ?      482.9        2.9       ?       ? 
1 1 1   38   22    3 o    515.6    2.7    0.0000   0.0000          ?        ?  2658.8040  28.0950          ?        ?      515.6        2.7       ?       ? 
1 1 1   38   22    4 o    221.7    3.5    0.0000   0.0000          ?        ?   491.6617  15.3245          ?        ?      221.7        3.5       ?       ? 
1 1 1   38   22    5 o    468.3    3.5    0.0000   0.0000          ?        ?  2193.9604  32.5646          ?        ?      468.3        3.5       ?       ? 
1 1 1   38   22    6 o    275.1    3.4    0.0000   0.0000          ?        ?   757.2866  18.5171          ?        ?      275.1        3.4       ?       ? 
1 1 1   38   22    7 o    126.2    5.8    0.0000   0.0000          ?        ?   159.6304  14.6860          ?        ?      126.2        5.8       ?       ? 
1 1 1   38   22    8 o     68.1    8.9    0.0000   0.0000          ?        ?    46.6121  12.1319          ?        ?       68.1        8.9       ?       ? 
1 1 1   38   22    9 o    211.7    3.6    0.0000   0.0000          ?        ?   448.2422  15.3245          ?        ?      211.7        3.6       ?       ? 
1 1 1   38   22   10 o    380.0    3.2    0.0000   0.0000          ?        ?  1444.9745  24.2638          ?        ?      380.0        3.2       ?       ? 
1 1 1   38   22   11 o    455.7    2.9    0.0000   0.0000          ?        ?  2077.7493  26.8179          ?        ?      455.7        2.9       ?       ? 
1 1 1   38   22   12 o    494.5    2.8    0.0000   0.0000          ?        ?  2446.1763  28.0950          ?        ?      494.5        2.8       ?       ? 
1 1 1   38   22   13 o    310.1    2.7    0.0000   0.0000          ?        ?   962.2521  16.6016          ?        ?      310.1        2.7       ?       ? 
1 1 1   38   22   14 o    522.4    2.9    0.0000   0.0000          ?        ?  2730.3186  30.0105          ?        ?      522.4        2.9       ?       ? 
1 1 1   38   22   15 o    261.2    2.9    0.0000   0.0000          ?        ?   682.5797  15.3245          ?        ?      261.2        2.9       ?       ? 
1 1 1   38   22   16 o    429.4    2.8    0.0000   0.0000          ?        ?  1844.6890  24.2638          ?        ?      429.4        2.8       ?       ? 
1 1 1   38   22   17 o    379.6    2.4    0.0000   0.0000          ?        ?  1441.7819  18.5171          ?        ?      379.6        2.4       ?       ? 
1 1 1   38   22   18 o     86.0    5.9    0.0000   0.0000          ?        ?    74.0685  10.2163          ?        ?       86.0        5.9       ?       ? 
1 1 1   38   22   19 o    294.2    2.5    0.0000   0.0000          ?        ?   865.8354  14.6860          ?        ?      294.2        2.5       ?       ? 
1 1 1   38   22   20 o     93.4    5.8    0.0000   0.0000          ?        ?    87.4775  10.8549          ?        ?       93.4        5.8       ?       ? 
1 1 1   38   22   21 o    644.4    2.9    0.0000   0.0000          ?        ?  4154.2217  37.6728          ?        ?      644.4        2.9       ?       ? 
1 1 1   38   22   22 o    296.0    2.7    0.0000   0.0000          ?        ?   876.6902  15.9630          ?        ?      296.0        2.7       ?       ? 
1 1 1   38   22   23 o    413.2    2.5    0.0000   0.0000          ?        ?  1708.0454  20.4327          ?        ?      413.2        2.5       ?       ? 
1 1 1   38   22   24 o    114.3    5.6    0.0000   0.0000          ?        ?   130.8969  12.7704          ?        ?      114.3        5.6       ?       ? 
1 1 1   38   22   25 o    211.6    3.3    0.0000   0.0000          ?        ?   448.2422  14.0475          ?        ?      211.6        3.3       ?       ? 
1 1 1   38   22   26 o    285.8    2.8    0.0000   0.0000          ?        ?   817.3077  15.9630          ?        ?      285.8        2.8       ?       ? 
1 1 1   38   22   27 o    214.9    3.4    0.0000   0.0000          ?        ?   462.2897  14.6860          ?        ?      214.9        3.4       ?       ? 
1 1 1   38   22   28 o    116.5    6.0    0.0000   0.0000          ?        ?   136.0051  14.0475          ?        ?      116.5        6.0       ?       ? 
1 1 1   38   22   29 o     17.5    8.8    0.0000   0.0000          ?        ?   -44.0580  14.0475          ?        ?       17.5        8.8       ?       ? 
1 1 1   38   22   30 o     23.0   10.9    0.0000   0.0000          ?        ?   -15.9630  13.4090          ?        ?       23.0       10.9       ?       ? 
1 1 1   38   22   31 o     16.4    8.3    0.0000   0.0000          ?        ?   -46.6121  13.4090          ?        ?       16.4        8.3       ?       ? 
1 1 1   38   22   32 o    193.8    3.6    0.0000   0.0000          ?        ?   376.0892  14.0475          ?        ?      193.8        3.6       ?       ? 
1 1 1   38   22   33 o    108.5    7.1    0.0000   0.0000          ?        ?   118.1265  15.3245          ?        ?      108.5        7.1       ?       ? 
1 1 1   38   22   34 o    326.4    2.8    0.0000   0.0000          ?        ?  1066.3312  18.5171          ?        ?      326.4        2.8       ?       ? 
1 1 1   38   22   35 o    141.9    5.6    0.0000   0.0000          ?        ?   201.7728  15.9630          ?        ?      141.9        5.6       ?       ? 
1 1 1   38   22   36 o     31.6   13.5    0.0000   0.0000          ?        ?    -0.6385  15.3245          ?        ?       31.6       13.5       ?       ? 
1 1 1   38   22   37 o    164.5    5.0    0.0000   0.0000          ?        ?   271.3717  16.6016          ?        ?      164.5        5.0       ?       ? 
1 1 1   38   22   38 o    344.5    2.9    0.0000   0.0000          ?        ?  1187.6503  19.7942          ?        ?      344.5        2.9       ?       ? 
1 1 1   38   22   39 o    193.4    4.5    0.0000   0.0000          ?        ?   374.8122  17.2401          ?        ?      193.4        4.5       ?       ? 
1 1 1   38   22   40 o     40.5   15.4    0.0000   0.0000          ?        ?    12.1319  17.2401          ?        ?       40.5       15.4       ?       ? 
1 1 1   38   22   41 o    127.3    6.8    0.0000   0.0000          ?        ?   162.8230  17.2401          ?        ?      127.3        6.8       ?       ? 
1 1 1   38   22   42 o     85.6   10.1    0.0000   0.0000          ?        ?    74.0685  17.2401          ?        ?       85.6       10.1       ?       ? 
1 1 1   38   22   43 o    285.4    3.4    0.0000   0.0000          ?        ?   815.3921  19.1556          ?        ?      285.4        3.4       ?       ? 
1 1 1   38   22   44 o     19.8    9.9    0.0000   0.0000          ?        ?   -50.4432  17.2401          ?        ?       19.8        9.9       ?       ? 
1 1 1   38   22   45 o     60.4   14.5    0.0000   0.0000          ?        ?    38.9498  17.2401          ?        ?       60.4       14.5       ?       ? 
1 1 1   38   22   46 o    195.7    4.7    0.0000   0.0000          ?        ?   384.3900  18.5171          ?        ?      195.7        4.7       ?       ? 
1 1 1   38   22   47 o     41.1   15.7    0.0000   0.0000          ?        ?    12.7704  17.8786          ?        ?       41.1       15.7       ?       ? 
1 1 1   38   22   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   22   49 o     63.2   13.5    0.0000   0.0000          ?        ?    42.7809  16.6016          ?        ?       63.2       13.5       ?       ? 
1 1 1   38   22   50 o     29.7   13.4    0.0000   0.0000          ?        ?    -7.0237  16.6016          ?        ?       29.7       13.4       ?       ? 
1 1 1   38   23    0 o    278.8    4.5  778.3578  24.9023   778.3578  24.9023   778.3578  24.9023      278.8      4.5      278.8        4.5     0.0     0.0 
1 1 1   38   23    1 o    437.1    2.9    0.0000   0.0000          ?        ?  1911.7338  25.5409          ?        ?      437.1        2.9       ?       ? 
1 1 1   38   23    2 o    145.1    4.2    0.0000   0.0000          ?        ?   210.7121  12.1319          ?        ?      145.1        4.2       ?       ? 
1 1 1   38   23    3 o    195.5    3.6    0.0000   0.0000          ?        ?   382.4745  14.0475          ?        ?      195.5        3.6       ?       ? 
1 1 1   38   23    4 o    281.9    3.1    0.0000   0.0000          ?        ?   794.9594  17.2401          ?        ?      281.9        3.1       ?       ? 
1 1 1   38   23    5 o    179.5    3.6    0.0000   0.0000          ?        ?   322.4534  12.7704          ?        ?      179.5        3.6       ?       ? 
1 1 1   38   23    6 o    359.0    2.8    0.0000   0.0000          ?        ?  1289.1752  19.7942          ?        ?      359.0        2.8       ?       ? 
1 1 1   38   23    7 o    378.8    3.1    0.0000   0.0000          ?        ?  1435.3966  23.6253          ?        ?      378.8        3.1       ?       ? 
1 1 1   38   23    8 o    360.8    3.0    0.0000   0.0000          ?        ?  1302.5841  21.7097          ?        ?      360.8        3.0       ?       ? 
1 1 1   38   23    9 o    282.6    2.9    0.0000   0.0000          ?        ?   798.7905  16.6016          ?        ?      282.6        2.9       ?       ? 
1 1 1   38   23   10 o    195.3    3.8    0.0000   0.0000          ?        ?   381.8359  14.6860          ?        ?      195.3        3.8       ?       ? 
1 1 1   38   23   11 o    286.5    3.1    0.0000   0.0000          ?        ?   821.1389  17.8786          ?        ?      286.5        3.1       ?       ? 
1 1 1   38   23   12 o    337.8    2.6    0.0000   0.0000          ?        ?  1141.6766  17.2401          ?        ?      337.8        2.6       ?       ? 
1 1 1   38   23   13 o    618.2    3.7    0.0000   0.0000          ?        ?  3824.7446  45.3350          ?        ?      618.2        3.7       ?       ? 
1 1 1   38   23   14 o    176.3    3.6    0.0000   0.0000          ?        ?   310.9600  12.7704          ?        ?      176.3        3.6       ?       ? 
1 1 1   38   23   15 o    361.7    2.9    0.0000   0.0000          ?        ?  1308.9694  21.0712          ?        ?      361.7        2.9       ?       ? 
1 1 1   38   23   16 o    194.2    3.8    0.0000   0.0000          ?        ?   377.3663  14.6860          ?        ?      194.2        3.8       ?       ? 
1 1 1   38   23   17 o    308.1    3.2    0.0000   0.0000          ?        ?   950.1202  19.7942          ?        ?      308.1        3.2       ?       ? 
1 1 1   38   23   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   23   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   23   20 f    304.5    2.5    0.0000   0.0000          ?        ?   927.7720  15.3245          ?        ?      304.5        2.5       ?       ? 
1 1 1   38   23   21 o    303.6    2.7    0.0000   0.0000          ?        ?   922.0252  16.6016          ?        ?      303.6        2.7       ?       ? 
1 1 1   38   23   22 o    579.8    2.7    0.0000   0.0000          ?        ?  3363.7319  31.2876          ?        ?      579.8        2.7       ?       ? 
1 1 1   38   23   23 o    170.6    3.7    0.0000   0.0000          ?        ?   291.1659  12.7704          ?        ?      170.6        3.7       ?       ? 
1 1 1   38   23   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   23   25 o     74.4    8.6    0.0000   0.0000          ?        ?    55.5514  12.7704          ?        ?       74.4        8.6       ?       ? 
1 1 1   38   23   26 o    151.3    4.4    0.0000   0.0000          ?        ?   229.2293  13.4090          ?        ?      151.3        4.4       ?       ? 
1 1 1   38   23   27 o    315.8    2.7    0.0000   0.0000          ?        ?   998.0093  17.2401          ?        ?      315.8        2.7       ?       ? 
1 1 1   38   23   28 o    504.1    2.6    0.0000   0.0000          ?        ?  2541.9546  26.1794          ?        ?      504.1        2.6       ?       ? 
1 1 1   38   23   29 o    239.6    3.3    0.0000   0.0000          ?        ?   574.6694  15.9630          ?        ?      239.6        3.3       ?       ? 
1 1 1   38   23   30 o    238.2    3.2    0.0000   0.0000          ?        ?   567.6458  15.3245          ?        ?      238.2        3.2       ?       ? 
1 1 1   38   23   31 o    213.0    3.6    0.0000   0.0000          ?        ?   453.9889  15.3245          ?        ?      213.0        3.6       ?       ? 
1 1 1   38   23   32 o    178.9    4.5    0.0000   0.0000          ?        ?   320.5379  15.9630          ?        ?      178.9        4.5       ?       ? 
1 1 1   38   23   33 o    395.8    2.7    0.0000   0.0000          ?        ?  1567.5706  21.7097          ?        ?      395.8        2.7       ?       ? 
1 1 1   38   23   34 o    264.8    3.4    0.0000   0.0000          ?        ?   701.7353  17.8786          ?        ?      264.8        3.4       ?       ? 
1 1 1   38   23   35 o    138.9    5.5    0.0000   0.0000          ?        ?   193.4720  15.3245          ?        ?      138.9        5.5       ?       ? 
1 1 1   38   23   36 o    179.9    4.6    0.0000   0.0000          ?        ?   324.3690  16.6016          ?        ?      179.9        4.6       ?       ? 
1 1 1   38   23   37 o    124.8    6.7    0.0000   0.0000          ?        ?   156.4378  16.6016          ?        ?      124.8        6.7       ?       ? 
1 1 1   38   23   38 o     17.5    8.8    0.0000   0.0000          ?        ?   -52.9973  15.3245          ?        ?       17.5        8.8       ?       ? 
1 1 1   38   23   39 o    107.1    8.6    0.0000   0.0000          ?        ?   115.5724  18.5171          ?        ?      107.1        8.6       ?       ? 
1 1 1   38   23   40 o    308.0    3.4    0.0000   0.0000          ?        ?   950.1202  21.0712          ?        ?      308.0        3.4       ?       ? 
1 1 1   38   23   41 o    251.7    3.6    0.0000   0.0000          ?        ?   634.6905  17.8786          ?        ?      251.7        3.6       ?       ? 
1 1 1   38   23   42 o     69.7   12.9    0.0000   0.0000          ?        ?    51.0817  17.2401          ?        ?       69.7       12.9       ?       ? 
1 1 1   38   23   43 o    304.1    3.3    0.0000   0.0000          ?        ?   925.8564  19.7942          ?        ?      304.1        3.3       ?       ? 
1 1 1   38   23   44 o    394.1    2.9    0.0000   0.0000          ?        ?  1554.8002  22.9868          ?        ?      394.1        2.9       ?       ? 
1 1 1   38   23   45 o    343.5    3.1    0.0000   0.0000          ?        ?  1181.9036  21.0712          ?        ?      343.5        3.1       ?       ? 
1 1 1   38   23   46 o    133.7    6.7    0.0000   0.0000          ?        ?   180.0631  17.8786          ?        ?      133.7        6.7       ?       ? 
1 1 1   38   23   47 o     24.3   11.8    0.0000   0.0000          ?        ?   -29.3720  17.8786          ?        ?       24.3       11.8       ?       ? 
1 1 1   38   23   48 o     31.0   13.9    0.0000   0.0000          ?        ?    -7.0237  17.8786          ?        ?       31.0       13.9       ?       ? 
1 1 1   38   23   49 o    209.3    4.6    0.0000   0.0000          ?        ?   439.9414  19.1556          ?        ?      209.3        4.6       ?       ? 
1 1 1   38   24    0 o    343.8    4.1 1183.1805  28.0950  1183.1805  28.0950  1183.1805  28.0950      343.8      4.1      343.8        4.1     0.0     0.0 
1 1 1   38   24    1 o    250.1    2.8    0.0000   0.0000          ?        ?   625.7512  14.0475          ?        ?      250.1        2.8       ?       ? 
1 1 1   38   24    2 o    361.1    2.8    0.0000   0.0000          ?        ?  1304.4998  20.4327          ?        ?      361.1        2.8       ?       ? 
1 1 1   38   24    3 o    533.7    3.2    0.0000   0.0000          ?        ?  2849.7219  33.8416          ?        ?      533.7        3.2       ?       ? 
1 1 1   38   24    4 o    283.4    2.7    0.0000   0.0000          ?        ?   803.2603  15.3245          ?        ?      283.4        2.7       ?       ? 
1 1 1   38   24    5 o    337.8    2.7    0.0000   0.0000          ?        ?  1141.6766  18.5171          ?        ?      337.8        2.7       ?       ? 
1 1 1   38   24    6 o    338.0    2.5    0.0000   0.0000          ?        ?  1142.9537  16.6016          ?        ?      338.0        2.5       ?       ? 
1 1 1   38   24    7 o    354.6    2.8    0.0000   0.0000          ?        ?  1257.8876  19.7942          ?        ?      354.6        2.8       ?       ? 
1 1 1   38   24    8 o    325.0    2.9    0.0000   0.0000          ?        ?  1056.7533  19.1556          ?        ?      325.0        2.9       ?       ? 
1 1 1   38   24    9 o    354.1    3.2    0.0000   0.0000          ?        ?  1254.6949  22.9868          ?        ?      354.1        3.2       ?       ? 
1 1 1   38   24   10 o    116.0    5.5    0.0000   0.0000          ?        ?   134.7281  12.7704          ?        ?      116.0        5.5       ?       ? 
1 1 1   38   24   11 o    517.5    3.3    0.0000   0.0000          ?        ?  2679.2368  33.8416          ?        ?      517.5        3.3       ?       ? 
1 1 1   38   24   12 o    514.9    3.0    0.0000   0.0000          ?        ?  2653.0574  30.6490          ?        ?      514.9        3.0       ?       ? 
1 1 1   38   24   13 o    111.2    4.6    0.0000   0.0000          ?        ?   123.8732  10.2163          ?        ?      111.2        4.6       ?       ? 
1 1 1   38   24   14 o    103.8    5.5    0.0000   0.0000          ?        ?   107.9102  11.4934          ?        ?      103.8        5.5       ?       ? 
1 1 1   38   24   15 o    351.6    2.9    0.0000   0.0000          ?        ?  1236.8164  20.4327          ?        ?      351.6        2.9       ?       ? 
1 1 1   38   24   16 o    279.9    3.0    0.0000   0.0000          ?        ?   784.1046  16.6016          ?        ?      279.9        3.0       ?       ? 
1 1 1   38   24   17 o    208.6    3.5    0.0000   0.0000          ?        ?   435.4717  14.6860          ?        ?      208.6        3.5       ?       ? 
1 1 1   38   24   18 o    243.3    3.3    0.0000   0.0000          ?        ?   592.5481  15.9630          ?        ?      243.3        3.3       ?       ? 
1 1 1   38   24   19 o    226.7    2.7    0.0000   0.0000          ?        ?   514.0099  12.1319          ?        ?      226.7        2.7       ?       ? 
1 1 1   38   24   20 o    190.6    3.2    0.0000   0.0000          ?        ?   363.3188  12.1319          ?        ?      190.6        3.2       ?       ? 
1 1 1   38   24   21 o    263.4    2.7    0.0000   0.0000          ?        ?   694.0730  14.0475          ?        ?      263.4        2.7       ?       ? 
1 1 1   38   24   22 o    197.3    3.4    0.0000   0.0000          ?        ?   389.4982  13.4090          ?        ?      197.3        3.4       ?       ? 
1 1 1   38   24   23 o     27.1   11.8    0.0000   0.0000          ?        ?    -2.5541  12.1319          ?        ?       27.1       11.8       ?       ? 
1 1 1   38   24   24 o     42.7   13.0    0.0000   0.0000          ?        ?    18.5171  12.1319          ?        ?       42.7       13.0       ?       ? 
1 1 1   38   24   25 o    255.0    2.9    0.0000   0.0000          ?        ?   650.6536  14.6860          ?        ?      255.0        2.9       ?       ? 
1 1 1   38   24   26 o     69.0    9.7    0.0000   0.0000          ?        ?    47.8891  13.4090          ?        ?       69.0        9.7       ?       ? 
1 1 1   38   24   27 o     16.6    8.4    0.0000   0.0000          ?        ?   -49.8047  14.0475          ?        ?       16.6        8.4       ?       ? 
1 1 1   38   24   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   24   29 o    351.0    2.6    0.0000   0.0000          ?        ?  1232.3467  18.5171          ?        ?      351.0        2.6       ?       ? 
1 1 1   38   24   30 o    199.5    3.7    0.0000   0.0000          ?        ?   398.4375  14.6860          ?        ?      199.5        3.7       ?       ? 
1 1 1   38   24   31 o    302.0    2.9    0.0000   0.0000          ?        ?   912.4474  17.2401          ?        ?      302.0        2.9       ?       ? 
1 1 1   38   24   32 o    178.7    4.1    0.0000   0.0000          ?        ?   319.8993  14.6860          ?        ?      178.7        4.1       ?       ? 
1 1 1   38   24   33 o     53.9   14.5    0.0000   0.0000          ?        ?    30.6490  15.9630          ?        ?       53.9       14.5       ?       ? 
1 1 1   38   24   34 o     80.7    9.9    0.0000   0.0000          ?        ?    65.7677  15.9630          ?        ?       80.7        9.9       ?       ? 
1 1 1   38   24   35 o    206.7    3.7    0.0000   0.0000          ?        ?   427.8095  15.3245          ?        ?      206.7        3.7       ?       ? 
1 1 1   38   24   36 o     63.7   13.0    0.0000   0.0000          ?        ?    42.7809  15.9630          ?        ?       63.7       13.0       ?       ? 
1 1 1   38   24   37 o    102.0    7.5    0.0000   0.0000          ?        ?   104.7175  15.3245          ?        ?      102.0        7.5       ?       ? 
1 1 1   38   24   38 o    142.2    5.6    0.0000   0.0000          ?        ?   203.0499  15.9630          ?        ?      142.2        5.6       ?       ? 
1 1 1   38   24   39 o    302.3    3.0    0.0000   0.0000          ?        ?   915.0015  17.8786          ?        ?      302.3        3.0       ?       ? 
1 1 1   38   24   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   24   41 o     89.2    9.3    0.0000   0.0000          ?        ?    80.4537  16.6016          ?        ?       89.2        9.3       ?       ? 
1 1 1   38   24   42 o     86.6    9.6    0.0000   0.0000          ?        ?    75.9841  16.6016          ?        ?       86.6        9.6       ?       ? 
1 1 1   38   24   43 o    271.3    3.3    0.0000   0.0000          ?        ?   737.4925  17.8786          ?        ?      271.3        3.3       ?       ? 
1 1 1   38   24   44 o     91.6    9.1    0.0000   0.0000          ?        ?    84.9234  16.6016          ?        ?       91.6        9.1       ?       ? 
1 1 1   38   24   45 o     54.6   14.8    0.0000   0.0000          ?        ?    31.9261  16.6016          ?        ?       54.6       14.8       ?       ? 
1 1 1   38   24   46 o     73.6   11.7    0.0000   0.0000          ?        ?    55.5514  17.2401          ?        ?       73.6       11.7       ?       ? 
1 1 1   38   24   47 o     37.4   15.0    0.0000   0.0000          ?        ?     7.6623  17.2401          ?        ?       37.4       15.0       ?       ? 
1 1 1   38   24   48 o     24.3   11.8    0.0000   0.0000          ?        ?   -28.7335  17.8786          ?        ?       24.3       11.8       ?       ? 
1 1 1   38   25    0 o    588.5    5.2 3467.1724  60.6596  3467.1724  60.6596  3467.1724  60.6596      588.5      5.2      588.5        5.2     0.0     0.0 
1 1 1   38   25    1 o    194.0    3.5    0.0000   0.0000          ?        ?   376.7278  13.4090          ?        ?      194.0        3.5       ?       ? 
1 1 1   38   25    2 o    179.6    4.8    0.0000   0.0000          ?        ?   323.0919  17.2401          ?        ?      179.6        4.8       ?       ? 
1 1 1   38   25    3 o    140.3    6.6    0.0000   0.0000          ?        ?   197.3032  18.5171          ?        ?      140.3        6.6       ?       ? 
1 1 1   38   25    4 o    144.2    5.1    0.0000   0.0000          ?        ?   208.1580  14.6860          ?        ?      144.2        5.1       ?       ? 
1 1 1   38   25    5 o     90.2    8.1    0.0000   0.0000          ?        ?    81.7308  14.6860          ?        ?       90.2        8.1       ?       ? 
1 1 1   38   25    6 o    372.8    3.5    0.0000   0.0000          ?        ?  1390.7001  26.1794          ?        ?      372.8        3.5       ?       ? 
1 1 1   38   25    7 o    326.2    2.7    0.0000   0.0000          ?        ?  1064.4155  17.8786          ?        ?      326.2        2.7       ?       ? 
1 1 1   38   25    8 o    168.7    3.4    0.0000   0.0000          ?        ?   284.7806  11.4934          ?        ?      168.7        3.4       ?       ? 
1 1 1   38   25    9 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   25   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   25   11 o    268.4    3.3    0.0000   0.0000          ?        ?   720.8909  17.8786          ?        ?      268.4        3.3       ?       ? 
1 1 1   38   25   12 o    711.2    4.0    0.0000   0.0000          ?        ?  5063.4766  56.8284          ?        ?      711.2        4.0       ?       ? 
1 1 1   38   25   13 o    377.9    2.8    0.0000   0.0000          ?        ?  1429.0115  21.0712          ?        ?      377.9        2.8       ?       ? 
1 1 1   38   25   14 o    107.7    5.0    0.0000   0.0000          ?        ?   116.2109  10.8549          ?        ?      107.7        5.0       ?       ? 
1 1 1   38   25   15 o    210.3    3.0    0.0000   0.0000          ?        ?   442.4955  12.7704          ?        ?      210.3        3.0       ?       ? 
1 1 1   38   25   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   25   17 o    263.7    3.1    0.0000   0.0000          ?        ?   695.9886  16.6016          ?        ?      263.7        3.1       ?       ? 
1 1 1   38   25   18 o    136.7    4.9    0.0000   0.0000          ?        ?   187.0868  13.4090          ?        ?      136.7        4.9       ?       ? 
1 1 1   38   25   19 o    210.6    2.6    0.0000   0.0000          ?        ?   443.7725  10.8549          ?        ?      210.6        2.6       ?       ? 
1 1 1   38   25   20 o    194.2    3.0    0.0000   0.0000          ?        ?   377.3663  11.4934          ?        ?      194.2        3.0       ?       ? 
1 1 1   38   25   21 o     24.3   11.2    0.0000   0.0000          ?        ?   -10.2163  12.7704          ?        ?       24.3       11.2       ?       ? 
1 1 1   38   25   22 o    413.0    2.6    0.0000   0.0000          ?        ?  1706.7682  21.0712          ?        ?      413.0        2.6       ?       ? 
1 1 1   38   25   23 o    476.9    2.5    0.0000   0.0000          ?        ?  2275.0525  23.6253          ?        ?      476.9        2.5       ?       ? 
1 1 1   38   25   24 o    233.0    3.2    0.0000   0.0000          ?        ?   543.3819  14.6860          ?        ?      233.0        3.2       ?       ? 
1 1 1   38   25   25 o    179.3    3.7    0.0000   0.0000          ?        ?   321.8149  13.4090          ?        ?      179.3        3.7       ?       ? 
1 1 1   38   25   26 o    276.8    2.8    0.0000   0.0000          ?        ?   766.8644  15.3245          ?        ?      276.8        2.8       ?       ? 
1 1 1   38   25   27 f    305.0    2.8    0.0000   0.0000          ?        ?   930.9645  17.2401          ?        ?      305.0        2.8       ?       ? 
1 1 1   38   25   28 o     80.5    8.3    0.0000   0.0000          ?        ?    65.1292  13.4090          ?        ?       80.5        8.3       ?       ? 
1 1 1   38   25   29 o    293.6    2.9    0.0000   0.0000          ?        ?   862.6428  17.2401          ?        ?      293.6        2.9       ?       ? 
1 1 1   38   25   30 o     87.6    8.7    0.0000   0.0000          ?        ?    77.2611  15.3245          ?        ?       87.6        8.7       ?       ? 
1 1 1   38   25   31 o     20.9   10.3    0.0000   0.0000          ?        ?   -29.3720  14.6860          ?        ?       20.9       10.3       ?       ? 
1 1 1   38   25   32 o    186.8    3.9    0.0000   0.0000          ?        ?   349.2713  14.6860          ?        ?      186.8        3.9       ?       ? 
1 1 1   38   25   33 o    374.6    2.7    0.0000   0.0000          ?        ?  1404.1090  20.4327          ?        ?      374.6        2.7       ?       ? 
1 1 1   38   25   34 o    154.7    5.2    0.0000   0.0000          ?        ?   240.0841  15.9630          ?        ?      154.7        5.2       ?       ? 
1 1 1   38   25   35 o    115.0    6.7    0.0000   0.0000          ?        ?   132.8125  15.3245          ?        ?      115.0        6.7       ?       ? 
1 1 1   38   25   36 o     26.6   12.3    0.0000   0.0000          ?        ?   -12.1319  15.3245          ?        ?       26.6       12.3       ?       ? 
1 1 1   38   25   37 o     60.1   13.6    0.0000   0.0000          ?        ?    38.3113  15.9630          ?        ?       60.1       13.6       ?       ? 
1 1 1   38   25   38 o    243.5    3.7    0.0000   0.0000          ?        ?   593.8251  17.8786          ?        ?      243.5        3.7       ?       ? 
1 1 1   38   25   39 o     96.5    8.3    0.0000   0.0000          ?        ?    93.8627  15.9630          ?        ?       96.5        8.3       ?       ? 
1 1 1   38   25   40 o    295.7    3.1    0.0000   0.0000          ?        ?   875.4132  18.5171          ?        ?      295.7        3.1       ?       ? 
1 1 1   38   25   41 o     85.1    9.8    0.0000   0.0000          ?        ?    73.4300  16.6016          ?        ?       85.1        9.8       ?       ? 
1 1 1   38   25   42 o    201.1    4.3    0.0000   0.0000          ?        ?   405.4612  17.2401          ?        ?      201.1        4.3       ?       ? 
1 1 1   38   25   43 f    115.0    7.2    0.0000   0.0000          ?        ?   133.4510  16.6016          ?        ?      115.0        7.2       ?       ? 
1 1 1   38   25   44 o    281.5    3.2    0.0000   0.0000          ?        ?   793.6824  17.8786          ?        ?      281.5        3.2       ?       ? 
1 1 1   38   25   45 o     33.5   14.1    0.0000   0.0000          ?        ?     2.5541  15.9630          ?        ?       33.5       14.1       ?       ? 
1 1 1   38   25   46 o     50.3   15.2    0.0000   0.0000          ?        ?    26.8179  16.6016          ?        ?       50.3       15.2       ?       ? 
1 1 1   38   26    0 o    151.5   12.2  234.9760  36.3957   234.9760  36.3957   234.9760  36.3957      151.5     12.2      151.5       12.2     0.0     0.0 
1 1 1   38   26    1 o    371.4    5.1    0.0000   0.0000          ?        ?  1381.7607  37.6728          ?        ?      371.4        5.1       ?       ? 
1 1 1   38   26    2 o    177.1    7.9    0.0000   0.0000          ?        ?   314.7912  28.0950          ?        ?      177.1        7.9       ?       ? 
1 1 1   38   26    3 f    167.7    5.1    0.0000   0.0000          ?        ?   281.5880  17.2401          ?        ?      167.7        5.1       ?       ? 
1 1 1   38   26    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   26    5 o    212.6    4.5    0.0000   0.0000          ?        ?   452.7119  19.1556          ?        ?      212.6        4.5       ?       ? 
1 1 1   38   26    6 o    231.5    3.4    0.0000   0.0000          ?        ?   536.3582  15.9630          ?        ?      231.5        3.4       ?       ? 
1 1 1   38   26    7 o    355.3    3.7    0.0000   0.0000          ?        ?  1263.6343  26.1794          ?        ?      355.3        3.7       ?       ? 
1 1 1   38   26    8 o    276.7    4.0    0.0000   0.0000          ?        ?   766.2260  22.3483          ?        ?      276.7        4.0       ?       ? 
1 1 1   38   26    9 o    375.8    3.6    0.0000   0.0000          ?        ?  1413.6869  26.8179          ?        ?      375.8        3.6       ?       ? 
1 1 1   38   26   10 o    395.9    2.9    0.0000   0.0000          ?        ?  1568.2091  22.9868          ?        ?      395.9        2.9       ?       ? 
1 1 1   38   26   11 o    303.5    3.1    0.0000   0.0000          ?        ?   921.3867  18.5171          ?        ?      303.5        3.1       ?       ? 
1 1 1   38   26   12 o    178.4    3.6    0.0000   0.0000          ?        ?   318.6223  12.7704          ?        ?      178.4        3.6       ?       ? 
1 1 1   38   26   13 o    205.5    3.1    0.0000   0.0000          ?        ?   422.7013  12.7704          ?        ?      205.5        3.1       ?       ? 
1 1 1   38   26   14 o    210.4    3.0    0.0000   0.0000          ?        ?   443.1340  12.7704          ?        ?      210.4        3.0       ?       ? 
1 1 1   38   26   15 o    103.8    5.5    0.0000   0.0000          ?        ?   107.9102  11.4934          ?        ?      103.8        5.5       ?       ? 
1 1 1   38   26   16 o    226.4    3.1    0.0000   0.0000          ?        ?   512.7329  14.0475          ?        ?      226.4        3.1       ?       ? 
1 1 1   38   26   17 o    152.2    4.2    0.0000   0.0000          ?        ?   231.7833  12.7704          ?        ?      152.2        4.2       ?       ? 
1 1 1   38   26   18 o    299.4    3.0    0.0000   0.0000          ?        ?   897.1229  17.8786          ?        ?      299.4        3.0       ?       ? 
1 1 1   38   26   19 o     78.5    8.1    0.0000   0.0000          ?        ?    61.9366  12.7704          ?        ?       78.5        8.1       ?       ? 
1 1 1   38   26   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   26   21 o     50.0   11.1    0.0000   0.0000          ?        ?    26.1794  10.8549          ?        ?       50.0       11.1       ?       ? 
1 1 1   38   26   22 o    269.7    2.7    0.0000   0.0000          ?        ?   727.9147  14.6860          ?        ?      269.7        2.7       ?       ? 
1 1 1   38   26   23 o     19.2    9.4    0.0000   0.0000          ?        ?   -23.6253  12.1319          ?        ?       19.2        9.4       ?       ? 
1 1 1   38   26   24 f     44.5   12.9    0.0000   0.0000          ?        ?    20.4327  12.1319          ?        ?       44.5       12.9       ?       ? 
1 1 1   38   26   25 f    370.9    2.7    0.0000   0.0000          ?        ?  1376.6527  19.7942          ?        ?      370.9        2.7       ?       ? 
1 1 1   38   26   26 o    507.1    2.6    0.0000   0.0000          ?        ?  2573.2422  26.1794          ?        ?      507.1        2.6       ?       ? 
1 1 1   38   26   27 o    318.8    2.9    0.0000   0.0000          ?        ?  1017.1650  18.5171          ?        ?      318.8        2.9       ?       ? 
1 1 1   38   26   28 o     63.1   11.6    0.0000   0.0000          ?        ?    41.5039  14.0475          ?        ?       63.1       11.6       ?       ? 
1 1 1   38   26   29 o    606.9    2.7    0.0000   0.0000          ?        ?  3685.5469  33.2031          ?        ?      606.9        2.7       ?       ? 
1 1 1   38   26   30 o    281.7    3.1    0.0000   0.0000          ?        ?   794.3209  17.2401          ?        ?      281.7        3.1       ?       ? 
1 1 1   38   26   31 o    267.0    3.2    0.0000   0.0000          ?        ?   713.8672  17.2401          ?        ?      267.0        3.2       ?       ? 
1 1 1   38   26   32 o     19.3    9.6    0.0000   0.0000          ?        ?   -33.2031  14.0475          ?        ?       19.3        9.6       ?       ? 
1 1 1   38   26   33 o     63.3   12.5    0.0000   0.0000          ?        ?    42.1424  15.3245          ?        ?       63.3       12.5       ?       ? 
1 1 1   38   26   34 o    148.6    5.2    0.0000   0.0000          ?        ?   221.5670  15.3245          ?        ?      148.6        5.2       ?       ? 
1 1 1   38   26   35 o    128.3    6.2    0.0000   0.0000          ?        ?   165.3771  15.9630          ?        ?      128.3        6.2       ?       ? 
1 1 1   38   26   36 o    203.1    3.9    0.0000   0.0000          ?        ?   413.1235  15.9630          ?        ?      203.1        3.9       ?       ? 
1 1 1   38   26   37 o     94.1    8.5    0.0000   0.0000          ?        ?    89.3930  15.9630          ?        ?       94.1        8.5       ?       ? 
1 1 1   38   26   38 o    114.0    7.0    0.0000   0.0000          ?        ?   130.8969  15.9630          ?        ?      114.0        7.0       ?       ? 
1 1 1   38   26   39 o    192.7    4.3    0.0000   0.0000          ?        ?   372.2581  16.6016          ?        ?      192.7        4.3       ?       ? 
1 1 1   38   26   40 o     46.6   15.4    0.0000   0.0000          ?        ?    21.7097  16.6016          ?        ?       46.6       15.4       ?       ? 
1 1 1   38   26   41 o     20.8   10.3    0.0000   0.0000          ?        ?   -36.3957  15.9630          ?        ?       20.8       10.3       ?       ? 
1 1 1   38   26   42 o    113.4    7.0    0.0000   0.0000          ?        ?   129.6199  15.9630          ?        ?      113.4        7.0       ?       ? 
1 1 1   38   26   43 o     55.5   14.3    0.0000   0.0000          ?        ?    33.2031  15.9630          ?        ?       55.5       14.3       ?       ? 
1 1 1   38   26   44 o    162.4    4.9    0.0000   0.0000          ?        ?   264.9865  15.9630          ?        ?      162.4        4.9       ?       ? 
1 1 1   38   26   45 o    143.8    5.6    0.0000   0.0000          ?        ?   208.1580  15.9630          ?        ?      143.8        5.6       ?       ? 
1 1 1   38   27    0 o    322.9    5.5 1044.6215  35.7572  1044.6215  35.7572  1044.6215  35.7572      322.9      5.5      322.9        5.5     0.0     0.0 
1 1 1   38   27    1 o    150.7    8.1    0.0000   0.0000          ?        ?   227.9522  24.2638          ?        ?      150.7        8.1       ?       ? 
1 1 1   38   27    2 o    129.0    9.2    0.0000   0.0000          ?        ?   167.2927  23.6253          ?        ?      129.0        9.2       ?       ? 
1 1 1   38   27    3 o    387.2    4.5    0.0000   0.0000          ?        ?  1501.1644  35.1187          ?        ?      387.2        4.5       ?       ? 
1 1 1   38   27    4 o    438.5    6.6    0.0000   0.0000          ?        ?  1927.6968  57.4669          ?        ?      438.5        6.6       ?       ? 
1 1 1   38   27    5 o    274.9    6.5    0.0000   0.0000          ?        ?   757.9252  35.7572          ?        ?      274.9        6.5       ?       ? 
1 1 1   38   27    6 o    428.8    4.1    0.0000   0.0000          ?        ?  1840.2194  35.1187          ?        ?      428.8        4.1       ?       ? 
1 1 1   38   27    7 o    248.0    3.5    0.0000   0.0000          ?        ?   615.5349  17.2401          ?        ?      248.0        3.5       ?       ? 
1 1 1   38   27    8 o    236.7    3.6    0.0000   0.0000          ?        ?   560.6220  17.2401          ?        ?      236.7        3.6       ?       ? 
1 1 1   38   27    9 o    381.6    3.6    0.0000   0.0000          ?        ?  1457.1063  27.4564          ?        ?      381.6        3.6       ?       ? 
1 1 1   38   27   10 o     44.5   15.6    0.0000   0.0000          ?        ?    17.8786  17.2401          ?        ?       44.5       15.6       ?       ? 
1 1 1   38   27   11 o     24.4   11.9    0.0000   0.0000          ?        ?   -32.5646  18.5171          ?        ?       24.4       11.9       ?       ? 
1 1 1   38   27   12 o    327.0    3.0    0.0000   0.0000          ?        ?  1070.1622  19.7942          ?        ?      327.0        3.0       ?       ? 
1 1 1   38   27   13 o    184.6    3.5    0.0000   0.0000          ?        ?   340.9706  12.7704          ?        ?      184.6        3.5       ?       ? 
1 1 1   38   27   14 o    119.5    4.0    0.0000   0.0000          ?        ?   143.0288   9.5778          ?        ?      119.5        4.0       ?       ? 
1 1 1   38   27   15 o    220.4    3.2    0.0000   0.0000          ?        ?   485.9149  14.0475          ?        ?      220.4        3.2       ?       ? 
1 1 1   38   27   16 o    137.2    4.4    0.0000   0.0000          ?        ?   188.3639  12.1319          ?        ?      137.2        4.4       ?       ? 
1 1 1   38   27   17 o    319.9    2.7    0.0000   0.0000          ?        ?  1024.1886  17.2401          ?        ?      319.9        2.7       ?       ? 
1 1 1   38   27   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   27   19 o     52.8   12.8    0.0000   0.0000          ?        ?    29.3720  13.4090          ?        ?       52.8       12.8       ?       ? 
1 1 1   38   27   20 o     98.1    4.6    0.0000   0.0000          ?        ?    96.4168   8.9393          ?        ?       98.1        4.6       ?       ? 
1 1 1   38   27   21 o    470.0    2.5    0.0000   0.0000          ?        ?  2209.9233  23.6253          ?        ?      470.0        2.5       ?       ? 
1 1 1   38   27   22 o    345.5    2.6    0.0000   0.0000          ?        ?  1194.6740  17.8786          ?        ?      345.5        2.6       ?       ? 
1 1 1   38   27   23 o    261.4    2.7    0.0000   0.0000          ?        ?   683.8566  14.0475          ?        ?      261.4        2.7       ?       ? 
1 1 1   38   27   24 o    513.1    2.6    0.0000   0.0000          ?        ?  2634.5403  26.8179          ?        ?      513.1        2.6       ?       ? 
1 1 1   38   27   25 o    288.7    2.8    0.0000   0.0000          ?        ?   833.9093  15.9630          ?        ?      288.7        2.8       ?       ? 
1 1 1   38   27   26 o     26.8   11.9    0.0000   0.0000          ?        ?    -4.4697  12.7704          ?        ?       26.8       11.9       ?       ? 
1 1 1   38   27   27 o    252.6    2.9    0.0000   0.0000          ?        ?   638.5216  14.6860          ?        ?      252.6        2.9       ?       ? 
1 1 1   38   27   28 f    433.1    2.7    0.0000   0.0000          ?        ?  1877.2535  23.6253          ?        ?      433.1        2.7       ?       ? 
1 1 1   38   27   29 o    199.6    3.7    0.0000   0.0000          ?        ?   399.0760  14.6860          ?        ?      199.6        3.7       ?       ? 
1 1 1   38   27   30 o    240.8    3.2    0.0000   0.0000          ?        ?   580.4161  15.3245          ?        ?      240.8        3.2       ?       ? 
1 1 1   38   27   31 o    344.4    2.7    0.0000   0.0000          ?        ?  1187.0117  18.5171          ?        ?      344.4        2.7       ?       ? 
1 1 1   38   27   32 o    120.7    5.8    0.0000   0.0000          ?        ?   146.2215  14.0475          ?        ?      120.7        5.8       ?       ? 
1 1 1   38   27   33 o    147.8    5.2    0.0000   0.0000          ?        ?   219.0129  15.3245          ?        ?      147.8        5.2       ?       ? 
1 1 1   38   27   34 o     35.2   14.0    0.0000   0.0000          ?        ?     7.0237  14.6860          ?        ?       35.2       14.0       ?       ? 
1 1 1   38   27   35 o    235.6    3.5    0.0000   0.0000          ?        ?   556.1523  16.6016          ?        ?      235.6        3.5       ?       ? 
1 1 1   38   27   36 f    247.1    3.4    0.0000   0.0000          ?        ?   611.7037  16.6016          ?        ?      247.1        3.4       ?       ? 
1 1 1   38   27   37 o    349.7    2.7    0.0000   0.0000          ?        ?  1224.0459  19.1556          ?        ?      349.7        2.7       ?       ? 
1 1 1   38   27   38 o    361.7    2.9    0.0000   0.0000          ?        ?  1310.2463  21.0712          ?        ?      361.7        2.9       ?       ? 
1 1 1   38   27   39 o     67.8   12.7    0.0000   0.0000          ?        ?    48.5276  16.6016          ?        ?       67.8       12.7       ?       ? 
1 1 1   38   27   40 o    192.8    4.1    0.0000   0.0000          ?        ?   372.8966  15.9630          ?        ?      192.8        4.1       ?       ? 
1 1 1   38   27   41 o    202.8    4.3    0.0000   0.0000          ?        ?   412.4850  17.2401          ?        ?      202.8        4.3       ?       ? 
1 1 1   38   27   42 o    247.3    3.5    0.0000   0.0000          ?        ?   612.9808  17.2401          ?        ?      247.3        3.5       ?       ? 
1 1 1   38   27   43 o    229.3    3.6    0.0000   0.0000          ?        ?   527.4188  16.6016          ?        ?      229.3        3.6       ?       ? 
1 1 1   38   28    0 o    130.9   11.6  176.2320  30.0105   176.2320  30.0105   176.2320  30.0105      130.9     11.6      130.9       11.6     0.0     0.0 
1 1 1   38   28    1 o    152.1    8.6    0.0000   0.0000          ?        ?   232.4219  26.1794          ?        ?      152.1        8.6       ?       ? 
1 1 1   38   28    2 o    144.6    8.2    0.0000   0.0000          ?        ?   210.0736  23.6253          ?        ?      144.6        8.2       ?       ? 
1 1 1   38   28    3 o    417.2    4.8    0.0000   0.0000          ?        ?  1743.1641  40.2269          ?        ?      417.2        4.8       ?       ? 
1 1 1   38   28    4 o    188.5    8.5    0.0000   0.0000          ?        ?   356.9336  31.9261          ?        ?      188.5        8.5       ?       ? 
1 1 1   38   28    5 o    256.7    5.3    0.0000   0.0000          ?        ?   660.2314  27.4564          ?        ?      256.7        5.3       ?       ? 
1 1 1   38   28    6 o    221.4    6.8    0.0000   0.0000          ?        ?   491.6617  30.0105          ?        ?      221.4        6.8       ?       ? 
1 1 1   38   28    7 o    213.7    4.6    0.0000   0.0000          ?        ?   457.1815  19.7942          ?        ?      213.7        4.6       ?       ? 
1 1 1   38   28    8 o     92.3    7.3    0.0000   0.0000          ?        ?    85.5619  13.4090          ?        ?       92.3        7.3       ?       ? 
1 1 1   38   28    9 o    316.2    4.1    0.0000   0.0000          ?        ?  1001.2019  26.1794          ?        ?      316.2        4.1       ?       ? 
1 1 1   38   28   10 o    374.7    4.1    0.0000   0.0000          ?        ?  1406.0247  30.6490          ?        ?      374.7        4.1       ?       ? 
1 1 1   38   28   11 o    224.0    4.4    0.0000   0.0000          ?        ?   502.5165  19.7942          ?        ?      224.0        4.4       ?       ? 
1 1 1   38   28   12 o    128.6    7.7    0.0000   0.0000          ?        ?   166.0156  19.7942          ?        ?      128.6        7.7       ?       ? 
1 1 1   38   28   13 o    236.4    5.1    0.0000   0.0000          ?        ?   559.9835  24.2638          ?        ?      236.4        5.1       ?       ? 
1 1 1   38   28   14 o    139.5    3.7    0.0000   0.0000          ?        ?   194.7491  10.2163          ?        ?      139.5        3.7       ?       ? 
1 1 1   38   28   15 o     18.8    9.0    0.0000   0.0000          ?        ?   -13.4090   9.5778          ?        ?       18.8        9.0       ?       ? 
1 1 1   38   28   16 o    190.0    3.4    0.0000   0.0000          ?        ?   361.4032  12.7704          ?        ?      190.0        3.4       ?       ? 
1 1 1   38   28   17 o     25.8   11.5    0.0000   0.0000          ?        ?    -5.1082  12.1319          ?        ?       25.8       11.5       ?       ? 
1 1 1   38   28   18 o    237.5    3.2    0.0000   0.0000          ?        ?   564.4531  15.3245          ?        ?      237.5        3.2       ?       ? 
1 1 1   38   28   19 o    299.4    3.3    0.0000   0.0000          ?        ?   897.1229  19.7942          ?        ?      299.4        3.3       ?       ? 
1 1 1   38   28   20 o    651.0    3.4    0.0000   0.0000          ?        ?  4241.6992  44.0580          ?        ?      651.0        3.4       ?       ? 
1 1 1   38   28   21 o    159.9    3.4    0.0000   0.0000          ?        ?   256.0471  10.8549          ?        ?      159.9        3.4       ?       ? 
1 1 1   38   28   22 o    249.4    2.7    0.0000   0.0000          ?        ?   622.5586  13.4090          ?        ?      249.4        2.7       ?       ? 
1 1 1   38   28   23 o     43.7   12.5    0.0000   0.0000          ?        ?    19.7942  11.4934          ?        ?       43.7       12.5       ?       ? 
1 1 1   38   28   24 o    220.9    3.0    0.0000   0.0000          ?        ?   488.4691  13.4090          ?        ?      220.9        3.0       ?       ? 
1 1 1   38   28   25 o    392.3    2.5    0.0000   0.0000          ?        ?  1540.1141  19.7942          ?        ?      392.3        2.5       ?       ? 
1 1 1   38   28   26 o    128.2    5.0    0.0000   0.0000          ?        ?   164.7386  12.7704          ?        ?      128.2        5.0       ?       ? 
1 1 1   38   28   27 o    326.9    2.6    0.0000   0.0000          ?        ?  1069.5237  17.2401          ?        ?      326.9        2.6       ?       ? 
1 1 1   38   28   28 o    222.6    3.4    0.0000   0.0000          ?        ?   496.1313  15.3245          ?        ?      222.6        3.4       ?       ? 
1 1 1   38   28   29 o    427.3    2.5    0.0000   0.0000          ?        ?  1827.4490  21.7097          ?        ?      427.3        2.5       ?       ? 
1 1 1   38   28   30 o    286.6    2.9    0.0000   0.0000          ?        ?   822.4159  16.6016          ?        ?      286.6        2.9       ?       ? 
1 1 1   38   28   31 f     91.1    7.7    0.0000   0.0000          ?        ?    83.6463  14.0475          ?        ?       91.1        7.7       ?       ? 
1 1 1   38   28   32 o    160.6    4.4    0.0000   0.0000          ?        ?   258.6013  14.0475          ?        ?      160.6        4.4       ?       ? 
1 1 1   38   28   33 f    188.9    4.2    0.0000   0.0000          ?        ?   357.5721  15.9630          ?        ?      188.9        4.2       ?       ? 
1 1 1   38   28   34 o    179.0    4.1    0.0000   0.0000          ?        ?   321.1764  14.6860          ?        ?      179.0        4.1       ?       ? 
1 1 1   38   28   35 o     19.7    9.7    0.0000   0.0000          ?        ?   -31.2876  14.0475          ?        ?       19.7        9.7       ?       ? 
1 1 1   38   28   36 o     42.2   14.7    0.0000   0.0000          ?        ?    16.6016  15.3245          ?        ?       42.2       14.7       ?       ? 
1 1 1   38   28   37 o    192.8    4.1    0.0000   0.0000          ?        ?   372.8966  15.9630          ?        ?      192.8        4.1       ?       ? 
1 1 1   38   28   38 o    104.3    7.7    0.0000   0.0000          ?        ?   109.8257  15.9630          ?        ?      104.3        7.7       ?       ? 
1 1 1   38   28   39 o     23.3   11.2    0.0000   0.0000          ?        ?   -22.3483  15.3245          ?        ?       23.3       11.2       ?       ? 
1 1 1   38   28   40 o     42.0   14.7    0.0000   0.0000          ?        ?    16.6016  15.3245          ?        ?       42.0       14.7       ?       ? 
1 1 1   38   28   41 o    140.5    5.5    0.0000   0.0000          ?        ?   198.5802  15.3245          ?        ?      140.5        5.5       ?       ? 
1 1 1   38   29    0 o    145.6   10.9  216.4588  31.2876   216.4588  31.2876   216.4588  31.2876      145.6     10.9      145.6       10.9     0.0     0.0 
1 1 1   38   29    1 o    224.4    6.4    0.0000   0.0000          ?        ?   505.0706  28.7335          ?        ?      224.4        6.4       ?       ? 
1 1 1   38   29    2 o    244.9    5.9    0.0000   0.0000          ?        ?   601.4874  28.7335          ?        ?      244.9        5.9       ?       ? 
1 1 1   38   29    3 o    141.6    9.0    0.0000   0.0000          ?        ?   201.7728  25.5409          ?        ?      141.6        9.0       ?       ? 
1 1 1   38   29    4 o     89.0   14.3    0.0000   0.0000          ?        ?    80.4537  25.5409          ?        ?       89.0       14.3       ?       ? 
1 1 1   38   29    5 o    287.7    5.7    0.0000   0.0000          ?        ?   829.4396  32.5646          ?        ?      287.7        5.7       ?       ? 
1 1 1   38   29    6 o    143.8    9.3    0.0000   0.0000          ?        ?   208.1580  26.8179          ?        ?      143.8        9.3       ?       ? 
1 1 1   38   29    7 o     34.0   15.7    0.0000   0.0000          ?        ?   -19.1556  24.9023          ?        ?       34.0       15.7       ?       ? 
1 1 1   38   29    8 o    117.3    9.5    0.0000   0.0000          ?        ?   138.5592  22.3483          ?        ?      117.3        9.5       ?       ? 
1 1 1   38   29    9 o    152.3    5.2    0.0000   0.0000          ?        ?   232.4219  15.9630          ?        ?      152.3        5.2       ?       ? 
1 1 1   38   29   10 o    148.7    4.5    0.0000   0.0000          ?        ?   221.5670  13.4090          ?        ?      148.7        4.5       ?       ? 
1 1 1   38   29   11 o    216.0    4.3    0.0000   0.0000          ?        ?   467.3978  18.5171          ?        ?      216.0        4.3       ?       ? 
1 1 1   38   29   12 o    107.6    7.7    0.0000   0.0000          ?        ?   116.2109  16.6016          ?        ?      107.6        7.7       ?       ? 
1 1 1   38   29   13 o    206.8    4.9    0.0000   0.0000          ?        ?   428.4480  20.4327          ?        ?      206.8        4.9       ?       ? 
1 1 1   38   29   14 o    231.7    4.7    0.0000   0.0000          ?        ?   537.6352  21.7097          ?        ?      231.7        4.7       ?       ? 
1 1 1   38   29   15 o    328.4    3.3    0.0000   0.0000          ?        ?  1079.1016  21.7097          ?        ?      328.4        3.3       ?       ? 
1 1 1   38   29   16 o    265.2    2.9    0.0000   0.0000          ?        ?   703.6508  15.3245          ?        ?      265.2        2.9       ?       ? 
1 1 1   38   29   17 o     35.5   12.7    0.0000   0.0000          ?        ?    10.8549  11.4934          ?        ?       35.5       12.7       ?       ? 
1 1 1   38   29   18 o    235.7    3.3    0.0000   0.0000          ?        ?   556.1523  15.3245          ?        ?      235.7        3.3       ?       ? 
1 1 1   38   29   19 o    336.8    2.8    0.0000   0.0000          ?        ?  1135.2915  19.1556          ?        ?      336.8        2.8       ?       ? 
1 1 1   38   29   20 o    129.2    5.4    0.0000   0.0000          ?        ?   167.2927  14.0475          ?        ?      129.2        5.4       ?       ? 
1 1 1   38   29   21 o     22.4   10.6    0.0000   0.0000          ?        ?   -15.3245  12.7704          ?        ?       22.4       10.6       ?       ? 
1 1 1   38   29   22 o    147.5    3.7    0.0000   0.0000          ?        ?   217.7359  10.8549          ?        ?      147.5        3.7       ?       ? 
1 1 1   38   29   23 o    367.1    2.5    0.0000   0.0000          ?        ?  1348.5576  18.5171          ?        ?      367.1        2.5       ?       ? 
1 1 1   38   29   24 o     98.7    5.8    0.0000   0.0000          ?        ?    97.6938  11.4934          ?        ?       98.7        5.8       ?       ? 
1 1 1   38   29   25 o    359.0    2.5    0.0000   0.0000          ?        ?  1289.8137  17.8786          ?        ?      359.0        2.5       ?       ? 
1 1 1   38   29   26 o    155.0    4.3    0.0000   0.0000          ?        ?   240.7227  13.4090          ?        ?      155.0        4.3       ?       ? 
1 1 1   38   29   27 o     19.7    9.6    0.0000   0.0000          ?        ?   -21.7097  12.1319          ?        ?       19.7        9.6       ?       ? 
1 1 1   38   29   28 o    133.3    5.0    0.0000   0.0000          ?        ?   178.1475  13.4090          ?        ?      133.3        5.0       ?       ? 
1 1 1   38   29   29 o    129.4    5.2    0.0000   0.0000          ?        ?   167.9312  13.4090          ?        ?      129.4        5.2       ?       ? 
1 1 1   38   29   30 o    161.0    4.2    0.0000   0.0000          ?        ?   259.8783  13.4090          ?        ?      161.0        4.2       ?       ? 
1 1 1   38   29   31 o     73.6   10.0    0.0000   0.0000          ?        ?    54.9129  14.6860          ?        ?       73.6       10.0       ?       ? 
1 1 1   38   29   32 o    291.7    2.8    0.0000   0.0000          ?        ?   851.7878  16.6016          ?        ?      291.7        2.8       ?       ? 
1 1 1   38   29   33 o    217.7    3.7    0.0000   0.0000          ?        ?   475.0601  15.9630          ?        ?      217.7        3.7       ?       ? 
1 1 1   38   29   34 o    173.4    4.2    0.0000   0.0000          ?        ?   301.3822  14.6860          ?        ?      173.4        4.2       ?       ? 
1 1 1   38   29   35 o    205.8    3.7    0.0000   0.0000          ?        ?   424.6169  15.3245          ?        ?      205.8        3.7       ?       ? 
1 1 1   38   29   36 o    170.5    4.5    0.0000   0.0000          ?        ?   291.8044  15.3245          ?        ?      170.5        4.5       ?       ? 
1 1 1   38   29   37 o    138.5    5.5    0.0000   0.0000          ?        ?   192.8335  15.3245          ?        ?      138.5        5.5       ?       ? 
1 1 1   38   29   38 o    133.8    5.7    0.0000   0.0000          ?        ?   180.0631  15.3245          ?        ?      133.8        5.7       ?       ? 
1 1 1   38   29   39 o    183.8    4.3    0.0000   0.0000          ?        ?   339.0550  15.9630          ?        ?      183.8        4.3       ?       ? 
1 1 1   38   29   40 o     51.2   14.8    0.0000   0.0000          ?        ?    28.0950  15.9630          ?        ?       51.2       14.8       ?       ? 
1 1 1   38   30    0 o     54.5   33.8   28.0950  71.5144    28.0950  71.5144    28.0950  71.5144       54.5     33.8       54.5       33.8     0.0     0.0 
1 1 1   38   30    1 o    272.6    6.1    0.0000   0.0000          ?        ?   745.1547  33.2031          ?        ?      272.6        6.1       ?       ? 
1 1 1   38   30    2 o    344.1    6.0    0.0000   0.0000          ?        ?  1187.6503  41.5039          ?        ?      344.1        6.0       ?       ? 
1 1 1   38   30    3 o    268.0    6.3    0.0000   0.0000          ?        ?   720.2524  33.8416          ?        ?      268.0        6.3       ?       ? 
1 1 1   38   30    4 o     78.2   17.9    0.0000   0.0000          ?        ?    65.1292  27.4564          ?        ?       78.2       17.9       ?       ? 
1 1 1   38   30    5 o    187.9    9.7    0.0000   0.0000          ?        ?   355.6566  36.3957          ?        ?      187.9        9.7       ?       ? 
1 1 1   38   30    6 o    260.8    8.2    0.0000   0.0000          ?        ?   683.8566  42.7809          ?        ?      260.8        8.2       ?       ? 
1 1 1   38   30    7 o    174.4   11.2    0.0000   0.0000          ?        ?   307.1289  38.9498          ?        ?      174.4       11.2       ?       ? 
1 1 1   38   30    8 o    212.7    7.8    0.0000   0.0000          ?        ?   454.6274  33.2031          ?        ?      212.7        7.8       ?       ? 
1 1 1   38   30    9 o    425.6    4.9    0.0000   0.0000          ?        ?  1814.6786  41.5039          ?        ?      425.6        4.9       ?       ? 
1 1 1   38   30   10 o    125.7   11.2    0.0000   0.0000          ?        ?   159.6304  28.0950          ?        ?      125.7       11.2       ?       ? 
1 1 1   38   30   11 o     24.7   11.5    0.0000   0.0000          ?        ?   -13.4090  14.0475          ?        ?       24.7       11.5       ?       ? 
1 1 1   38   30   12 o     58.7   13.3    0.0000   0.0000          ?        ?    36.3957  15.3245          ?        ?       58.7       13.3       ?       ? 
1 1 1   38   30   13 o    263.4    3.6    0.0000   0.0000          ?        ?   694.7115  19.1556          ?        ?      263.4        3.6       ?       ? 
1 1 1   38   30   14 o     78.2   12.7    0.0000   0.0000          ?        ?    61.9366  19.7942          ?        ?       78.2       12.7       ?       ? 
1 1 1   38   30   15 o    435.6    3.3    0.0000   0.0000          ?        ?  1899.6018  28.7335          ?        ?      435.6        3.3       ?       ? 
1 1 1   38   30   16 o    273.2    3.6    0.0000   0.0000          ?        ?   747.0703  19.7942          ?        ?      273.2        3.6       ?       ? 
1 1 1   38   30   17 o    135.0    4.3    0.0000   0.0000          ?        ?   182.6172  11.4934          ?        ?      135.0        4.3       ?       ? 
1 1 1   38   30   18 o    513.5    3.0    0.0000   0.0000          ?        ?  2639.6484  31.2876          ?        ?      513.5        3.0       ?       ? 
1 1 1   38   30   19 o    299.3    3.0    0.0000   0.0000          ?        ?   896.4843  17.8786          ?        ?      299.3        3.0       ?       ? 
1 1 1   38   30   20 o    402.1    2.9    0.0000   0.0000          ?        ?  1618.0138  23.6253          ?        ?      402.1        2.9       ?       ? 
1 1 1   38   30   21 o     85.0    7.9    0.0000   0.0000          ?        ?    72.7915  13.4090          ?        ?       85.0        7.9       ?       ? 
1 1 1   38   30   22 o    209.1    2.7    0.0000   0.0000          ?        ?   437.3873  11.4934          ?        ?      209.1        2.7       ?       ? 
1 1 1   38   30   23 o     22.9   10.5    0.0000   0.0000          ?        ?    -7.6623  10.8549          ?        ?       22.9       10.5       ?       ? 
1 1 1   38   30   24 o    230.4    2.9    0.0000   0.0000          ?        ?   531.2500  13.4090          ?        ?      230.4        2.9       ?       ? 
1 1 1   38   30   25 o    213.7    3.1    0.0000   0.0000          ?        ?   457.1815  13.4090          ?        ?      213.7        3.1       ?       ? 
1 1 1   38   30   26 o    230.1    3.1    0.0000   0.0000          ?        ?   529.9730  14.0475          ?        ?      230.1        3.1       ?       ? 
1 1 1   38   30   27 o     88.0    6.9    0.0000   0.0000          ?        ?    77.8996  12.1319          ?        ?       88.0        6.9       ?       ? 
1 1 1   38   30   28 o    269.1    2.8    0.0000   0.0000          ?        ?   724.7220  15.3245          ?        ?      269.1        2.8       ?       ? 
1 1 1   38   30   29 o    177.2    4.0    0.0000   0.0000          ?        ?   314.7912  14.0475          ?        ?      177.2        4.0       ?       ? 
1 1 1   38   30   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   30   31 o     86.8    7.7    0.0000   0.0000          ?        ?    75.9841  13.4090          ?        ?       86.8        7.7       ?       ? 
1 1 1   38   30   32 o     43.6   14.1    0.0000   0.0000          ?        ?    19.1556  14.0475          ?        ?       43.6       14.1       ?       ? 
1 1 1   38   30   33 o     63.3   11.5    0.0000   0.0000          ?        ?    42.1424  14.0475          ?        ?       63.3       11.5       ?       ? 
1 1 1   38   30   34 o    131.0    5.6    0.0000   0.0000          ?        ?   172.4008  14.6860          ?        ?      131.0        5.6       ?       ? 
1 1 1   38   30   35 o     78.1    9.0    0.0000   0.0000          ?        ?    61.9366  14.0475          ?        ?       78.1        9.0       ?       ? 
1 1 1   38   30   36 o     27.9   12.6    0.0000   0.0000          ?        ?    -6.3852  14.6860          ?        ?       27.9       12.6       ?       ? 
1 1 1   38   30   37 o    131.6    5.8    0.0000   0.0000          ?        ?   174.3164  15.3245          ?        ?      131.6        5.8       ?       ? 
1 1 1   38   30   38 o     27.8   12.6    0.0000   0.0000          ?        ?    -8.3008  15.3245          ?        ?       27.8       12.6       ?       ? 
1 1 1   38   31    0 o    232.1   10.2  544.0204  47.2506   544.0204  47.2506   544.0204  47.2506      232.1     10.2      232.1       10.2     0.0     0.0 
1 1 1   38   31    1 o    126.2   14.4    0.0000   0.0000          ?        ?   162.1845  36.3957          ?        ?      126.2       14.4       ?       ? 
1 1 1   38   31    2 o     55.2   22.3    0.0000   0.0000          ?        ?    15.3245  38.3113          ?        ?       55.2       22.3       ?       ? 
1 1 1   38   31    3 o    158.7   11.9    0.0000   0.0000          ?        ?   254.7701  37.6728          ?        ?      158.7       11.9       ?       ? 
1 1 1   38   31    4 o    244.9    7.4    0.0000   0.0000          ?        ?   602.7644  36.3957          ?        ?      244.9        7.4       ?       ? 
1 1 1   38   31    5 o    220.7    5.4    0.0000   0.0000          ?        ?   488.4691  23.6253          ?        ?      220.7        5.4       ?       ? 
1 1 1   38   31    6 o    130.2   10.8    0.0000   0.0000          ?        ?   171.1238  28.0950          ?        ?      130.2       10.8       ?       ? 
1 1 1   38   31    7 o    272.8    6.6    0.0000   0.0000          ?        ?   747.0703  35.7572          ?        ?      272.8        6.6       ?       ? 
1 1 1   38   31    8 o    230.8    9.7    0.0000   0.0000          ?        ?   536.9967  44.6965          ?        ?      230.8        9.7       ?       ? 
1 1 1   38   31    9 o    143.0   10.0    0.0000   0.0000          ?        ?   206.2425  28.7335          ?        ?      143.0       10.0       ?       ? 
1 1 1   38   31   10 o    113.2   15.2    0.0000   0.0000          ?        ?   130.8969  34.4802          ?        ?      113.2       15.2       ?       ? 
1 1 1   38   31   11 o     74.3   26.9    0.0000   0.0000          ?        ?    51.0817  51.7203          ?        ?       74.3       26.9       ?       ? 
1 1 1   38   31   12 o    176.2    4.7    0.0000   0.0000          ?        ?   310.9600  16.6016          ?        ?      176.2        4.7       ?       ? 
1 1 1   38   31   13 o    140.9    5.7    0.0000   0.0000          ?        ?   199.2188  15.9630          ?        ?      140.9        5.7       ?       ? 
1 1 1   38   31   14 o     59.6   15.4    0.0000   0.0000          ?        ?    37.6728  18.5171          ?        ?       59.6       15.4       ?       ? 
1 1 1   38   31   15 o    214.3    3.6    0.0000   0.0000          ?        ?   459.7356  15.3245          ?        ?      214.3        3.6       ?       ? 
1 1 1   38   31   16 o    186.2    3.8    0.0000   0.0000          ?        ?   347.3558  14.0475          ?        ?      186.2        3.8       ?       ? 
1 1 1   38   31   17 o    351.1    3.4    0.0000   0.0000          ?        ?  1234.2623  23.6253          ?        ?      351.1        3.4       ?       ? 
1 1 1   38   31   18 o     72.2    7.1    0.0000   0.0000          ?        ?    52.3588  10.2163          ?        ?       72.2        7.1       ?       ? 
1 1 1   38   31   19 o    145.0    4.2    0.0000   0.0000          ?        ?   210.7121  12.1319          ?        ?      145.0        4.2       ?       ? 
1 1 1   38   31   20 f    229.2    3.2    0.0000   0.0000          ?        ?   526.1418  14.6860          ?        ?      229.2        3.2       ?       ? 
1 1 1   38   31   21 o     80.4    7.5    0.0000   0.0000          ?        ?    65.1292  12.1319          ?        ?       80.4        7.5       ?       ? 
1 1 1   38   31   22 o    303.8    2.9    0.0000   0.0000          ?        ?   923.9408  17.8786          ?        ?      303.8        2.9       ?       ? 
1 1 1   38   31   23 o    104.3    5.2    0.0000   0.0000          ?        ?   109.1872  10.8549          ?        ?      104.3        5.2       ?       ? 
1 1 1   38   31   24 o     37.0   12.8    0.0000   0.0000          ?        ?    12.7704  11.4934          ?        ?       37.0       12.8       ?       ? 
1 1 1   38   31   25 o    245.2    3.0    0.0000   0.0000          ?        ?   602.1259  14.6860          ?        ?      245.2        3.0       ?       ? 
1 1 1   38   31   26 o    238.8    2.9    0.0000   0.0000          ?        ?   570.8383  14.0475          ?        ?      238.8        2.9       ?       ? 
1 1 1   38   31   27 o    163.4    4.1    0.0000   0.0000          ?        ?   267.5406  13.4090          ?        ?      163.4        4.1       ?       ? 
1 1 1   38   31   28 o    214.5    3.4    0.0000   0.0000          ?        ?   461.0126  14.6860          ?        ?      214.5        3.4       ?       ? 
1 1 1   38   31   29 o     96.9    6.9    0.0000   0.0000          ?        ?    94.5012  13.4090          ?        ?       96.9        6.9       ?       ? 
1 1 1   38   31   30 o    123.8    5.4    0.0000   0.0000          ?        ?   153.8837  13.4090          ?        ?      123.8        5.4       ?       ? 
1 1 1   38   31   31 o     82.6    8.1    0.0000   0.0000          ?        ?    68.9603  13.4090          ?        ?       82.6        8.1       ?       ? 
1 1 1   38   31   32 o    137.8    5.3    0.0000   0.0000          ?        ?   190.9180  14.6860          ?        ?      137.8        5.3       ?       ? 
1 1 1   38   31   33 o    171.7    4.1    0.0000   0.0000          ?        ?   295.6355  14.0475          ?        ?      171.7        4.1       ?       ? 
1 1 1   38   31   34 o    259.0    3.2    0.0000   0.0000          ?        ?   672.3633  16.6016          ?        ?      259.0        3.2       ?       ? 
1 1 1   38   31   35 o     84.7    8.3    0.0000   0.0000          ?        ?    72.7915  14.0475          ?        ?       84.7        8.3       ?       ? 
1 1 1   38   31   36 o    168.4    4.4    0.0000   0.0000          ?        ?   284.7806  14.6860          ?        ?      168.4        4.4       ?       ? 
1 1 1   38   32    0 f    262.4   15.1  702.3738  78.5382   702.3738  78.5382   702.3738  78.5382      262.4     15.1      262.4       15.1     0.0     0.0 
1 1 1   38   32    1 o    264.6    7.4    0.0000   0.0000          ?        ?   703.6508  38.9498          ?        ?      264.6        7.4       ?       ? 
1 1 1   38   32    2 o    218.3    6.4    0.0000   0.0000          ?        ?   478.2527  28.0950          ?        ?      218.3        6.4       ?       ? 
1 1 1   38   32    3 o    393.4    6.8    0.0000   0.0000          ?        ?  1554.8002  53.6358          ?        ?      393.4        6.8       ?       ? 
1 1 1   38   32    4 o    487.6    6.7    0.0000   0.0000          ?        ?  2388.0708  65.1292          ?        ?      487.6        6.7       ?       ? 
1 1 1   38   32    5 o    205.8   11.6    0.0000   0.0000          ?        ?   429.0865  47.8891          ?        ?      205.8       11.6       ?       ? 
1 1 1   38   32    6 o    370.1    5.6    0.0000   0.0000          ?        ?  1374.0985  41.5039          ?        ?      370.1        5.6       ?       ? 
1 1 1   38   32    7 o    272.9    7.1    0.0000   0.0000          ?        ?   748.3474  38.9498          ?        ?      272.9        7.1       ?       ? 
1 1 1   38   32    8 o    265.3    7.5    0.0000   0.0000          ?        ?   707.4820  39.5883          ?        ?      265.3        7.5       ?       ? 
1 1 1   38   32    9 o    105.1   17.3    0.0000   0.0000          ?        ?   113.6568  36.3957          ?        ?      105.1       17.3       ?       ? 
1 1 1   38   32   10 o    124.7   13.3    0.0000   0.0000          ?        ?   158.3534  33.2031          ?        ?      124.7       13.3       ?       ? 
1 1 1   38   32   11 f    202.1   10.7    0.0000   0.0000          ?        ?   413.1235  43.4195          ?        ?      202.1       10.7       ?       ? 
1 1 1   38   32   12 o    118.3   26.3    0.0000   0.0000          ?        ?   155.1608  60.6596          ?        ?      118.3       26.3       ?       ? 
1 1 1   38   32   13 o    312.2    3.9    0.0000   0.0000          ?        ?   976.2995  24.2638          ?        ?      312.2        3.9       ?       ? 
1 1 1   38   32   14 o    248.1    4.6    0.0000   0.0000          ?        ?   616.8119  22.9868          ?        ?      248.1        4.6       ?       ? 
1 1 1   38   32   15 o    224.6    5.0    0.0000   0.0000          ?        ?   505.7091  22.3483          ?        ?      224.6        5.0       ?       ? 
1 1 1   38   32   16 o     78.8    8.5    0.0000   0.0000          ?        ?    62.5751  13.4090          ?        ?       78.8        8.5       ?       ? 
1 1 1   38   32   17 f    127.1    6.0    0.0000   0.0000          ?        ?   162.1845  15.3245          ?        ?      127.1        6.0       ?       ? 
1 1 1   38   32   18 o    297.9    3.3    0.0000   0.0000          ?        ?   888.8221  19.7942          ?        ?      297.9        3.3       ?       ? 
1 1 1   38   32   19 o    201.2    3.8    0.0000   0.0000          ?        ?   405.4612  15.3245          ?        ?      201.2        3.8       ?       ? 
1 1 1   38   32   20 o    144.1    4.2    0.0000   0.0000          ?        ?   208.1580  12.1319          ?        ?      144.1        4.2       ?       ? 
1 1 1   38   32   21 o    168.4    4.2    0.0000   0.0000          ?        ?   284.1421  14.0475          ?        ?      168.4        4.2       ?       ? 
1 1 1   38   32   22 o    391.1    2.8    0.0000   0.0000          ?        ?  1531.1749  21.7097          ?        ?      391.1        2.8       ?       ? 
1 1 1   38   32   23 o    218.4    2.6    0.0000   0.0000          ?        ?   477.6142  11.4934          ?        ?      218.4        2.6       ?       ? 
1 1 1   38   32   24 o    255.5    2.6    0.0000   0.0000          ?        ?   653.2076  13.4090          ?        ?      255.5        2.6       ?       ? 
1 1 1   38   32   25 o     18.8    9.2    0.0000   0.0000          ?        ?   -21.7097  11.4934          ?        ?       18.8        9.2       ?       ? 
1 1 1   38   32   26 o    213.8    3.1    0.0000   0.0000          ?        ?   457.8200  13.4090          ?        ?      213.8        3.1       ?       ? 
1 1 1   38   32   27 o    172.7    3.5    0.0000   0.0000          ?        ?   298.8281  12.1319          ?        ?      172.7        3.5       ?       ? 
1 1 1   38   32   28 o    106.9    6.0    0.0000   0.0000          ?        ?   114.9339  12.7704          ?        ?      106.9        6.0       ?       ? 
1 1 1   38   32   29 o     42.4   13.0    0.0000   0.0000          ?        ?    18.5171  12.1319          ?        ?       42.4       13.0       ?       ? 
1 1 1   38   32   30 o     63.8   10.5    0.0000   0.0000          ?        ?    41.5039  13.4090          ?        ?       63.8       10.5       ?       ? 
1 1 1   38   32   31 o    216.3    3.2    0.0000   0.0000          ?        ?   468.6749  14.0475          ?        ?      216.3        3.2       ?       ? 
1 1 1   38   32   32 o    206.5    3.9    0.0000   0.0000          ?        ?   427.8095  15.9630          ?        ?      206.5        3.9       ?       ? 
1 1 1   38   32   33 o     78.9    8.5    0.0000   0.0000          ?        ?    63.2136  13.4090          ?        ?       78.9        8.5       ?       ? 
1 1 1   38   33    0 o    254.0   11.4  653.2076  57.4669   653.2076  57.4669   653.2076  57.4669      254.0     11.4      254.0       11.4     0.0     0.0 
1 1 1   38   33    1 o     63.0   24.7    0.0000   0.0000          ?        ?    28.0950  45.3350          ?        ?       63.0       24.7       ?       ? 
1 1 1   38   33    2 o    121.7   21.8    0.0000   0.0000          ?        ?   159.6304  51.0817          ?        ?      121.7       21.8       ?       ? 
1 1 1   38   33    3 o     90.4   19.6    0.0000   0.0000          ?        ?    88.1160  34.4802          ?        ?       90.4       19.6       ?       ? 
1 1 1   38   33    4 o     51.8   22.8    0.0000   0.0000          ?        ?    -8.3008  45.9736          ?        ?       51.8       22.8       ?       ? 
1 1 1   38   33    5 o    256.1    7.4    0.0000   0.0000          ?        ?   659.5928  37.6728          ?        ?      256.1        7.4       ?       ? 
1 1 1   38   33    6 o    241.4    6.5    0.0000   0.0000          ?        ?   585.5243  31.2876          ?        ?      241.4        6.5       ?       ? 
1 1 1   38   33    7 o    237.4    8.9    0.0000   0.0000          ?        ?   568.2842  42.1424          ?        ?      237.4        8.9       ?       ? 
1 1 1   38   33    8 o    136.3   17.8    0.0000   0.0000          ?        ?   192.1950  48.5276          ?        ?      136.3       17.8       ?       ? 
1 1 1   38   33    9 o    347.7   10.7    0.0000   0.0000          ?        ?  1224.0459  74.0685          ?        ?      347.7       10.7       ?       ? 
1 1 1   38   33   10 o    494.4    6.8    0.0000   0.0000          ?        ?  2457.0312  67.0448          ?        ?      494.4        6.8       ?       ? 
1 1 1   38   33   11 o    252.0   10.5    0.0000   0.0000          ?        ?   642.9913  52.9973          ?        ?      252.0       10.5       ?       ? 
1 1 1   38   33   12 o    320.9    9.3    0.0000   0.0000          ?        ?  1040.1517  59.3825          ?        ?      320.9        9.3       ?       ? 
1 1 1   38   33   13 o    214.7   12.9    0.0000   0.0000          ?        ?   469.9519  55.5514          ?        ?      214.7       12.9       ?       ? 
1 1 1   38   33   14 o    170.9    5.6    0.0000   0.0000          ?        ?   293.0815  19.1556          ?        ?      170.9        5.6       ?       ? 
1 1 1   38   33   15 o    342.1    4.2    0.0000   0.0000          ?        ?  1172.9642  28.7335          ?        ?      342.1        4.2       ?       ? 
1 1 1   38   33   16 o    124.3    5.6    0.0000   0.0000          ?        ?   155.1608  14.0475          ?        ?      124.3        5.6       ?       ? 
1 1 1   38   33   17 o    120.9    5.8    0.0000   0.0000          ?        ?   146.8600  14.0475          ?        ?      120.9        5.8       ?       ? 
1 1 1   38   33   18 o    152.6    5.2    0.0000   0.0000          ?        ?   233.6989  15.9630          ?        ?      152.6        5.2       ?       ? 
1 1 1   38   33   19 o     38.7   14.8    0.0000   0.0000          ?        ?    10.8549  15.9630          ?        ?       38.7       14.8       ?       ? 
1 1 1   38   33   20 o     96.4    8.3    0.0000   0.0000          ?        ?    93.8627  15.9630          ?        ?       96.4        8.3       ?       ? 
1 1 1   38   33   21 o    104.3    5.5    0.0000   0.0000          ?        ?   109.1872  11.4934          ?        ?      104.3        5.5       ?       ? 
1 1 1   38   33   22 o    265.8    2.8    0.0000   0.0000          ?        ?   707.4820  14.6860          ?        ?      265.8        2.8       ?       ? 
1 1 1   38   33   23 o    230.2    3.2    0.0000   0.0000          ?        ?   530.6115  14.6860          ?        ?      230.2        3.2       ?       ? 
1 1 1   38   33   24 o    166.3    3.5    0.0000   0.0000          ?        ?   277.1184  11.4934          ?        ?      166.3        3.5       ?       ? 
1 1 1   38   33   25 o    141.2    4.1    0.0000   0.0000          ?        ?   199.8573  11.4934          ?        ?      141.2        4.1       ?       ? 
1 1 1   38   33   26 o    191.3    3.3    0.0000   0.0000          ?        ?   366.5114  12.7704          ?        ?      191.3        3.3       ?       ? 
1 1 1   38   33   27 o    350.2    2.6    0.0000   0.0000          ?        ?  1227.8771  17.8786          ?        ?      350.2        2.6       ?       ? 
1 1 1   38   33   28 o    151.4    4.2    0.0000   0.0000          ?        ?   229.8678  12.7704          ?        ?      151.4        4.2       ?       ? 
1 1 1   38   33   29 o     90.0    7.1    0.0000   0.0000          ?        ?    81.7308  12.7704          ?        ?       90.0        7.1       ?       ? 
1 1 1   38   33   30 o     19.6    9.6    0.0000   0.0000          ?        ?   -24.9023  12.7704          ?        ?       19.6        9.6       ?       ? 
1 1 1   38   33   31 o     40.7   13.5    0.0000   0.0000          ?        ?    16.6016  12.7704          ?        ?       40.7       13.5       ?       ? 
1 1 1   38   34    0 o    547.7    8.4 3013.8220  91.9471  3013.8220  91.9471  3013.8220  91.9471      547.7      8.4      547.7        8.4     0.0     0.0 
1 1 1   38   34    1 o    357.6    7.0    0.0000   0.0000          ?        ?  1285.9825  49.8047          ?        ?      357.6        7.0       ?       ? 
1 1 1   38   34    2 o    136.4   28.7    0.0000   0.0000          ?        ?   210.0736  75.9841          ?        ?      136.4       28.7       ?       ? 
1 1 1   38   34    3 o    157.1   25.2    0.0000   0.0000          ?        ?   264.9865  79.1767          ?        ?      157.1       25.2       ?       ? 
1 1 1   38   34    4 o    302.8    9.9    0.0000   0.0000          ?        ?   927.1334  60.0210          ?        ?      302.8        9.9       ?       ? 
1 1 1   38   34    5 o    136.2   15.7    0.0000   0.0000          ?        ?   190.9180  42.7809          ?        ?      136.2       15.7       ?       ? 
1 1 1   38   34    6 f     56.4   22.5    0.0000   0.0000          ?        ?    19.7942  38.3113          ?        ?       56.4       22.5       ?       ? 
1 1 1   38   34    7 o    145.2   13.2    0.0000   0.0000          ?        ?   215.1818  38.3113          ?        ?      145.2       13.2       ?       ? 
1 1 1   38   34    8 o    234.5   10.6    0.0000   0.0000          ?        ?   557.4294  49.8047          ?        ?      234.5       10.6       ?       ? 
1 1 1   38   34    9 o    231.3   11.0    0.0000   0.0000          ?        ?   542.7434  51.0817          ?        ?      231.3       11.0       ?       ? 
1 1 1   38   34   10 o    165.3   17.6    0.0000   0.0000          ?        ?   283.5036  58.1055          ?        ?      165.3       17.6       ?       ? 
1 1 1   38   34   11 o    233.2   13.0    0.0000   0.0000          ?        ?   555.5138  60.6596          ?        ?      233.2       13.0       ?       ? 
1 1 1   38   34   12 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   34   13 o    244.2   10.7    0.0000   0.0000          ?        ?   605.3185  52.3588          ?        ?      244.2       10.7       ?       ? 
1 1 1   38   34   14 o    286.0   10.6    0.0000   0.0000          ?        ?   830.0781  60.6596          ?        ?      286.0       10.6       ?       ? 
1 1 1   38   34   15 o     35.5   14.4    0.0000   0.0000          ?        ?     5.7467  15.9630          ?        ?       35.5       14.4       ?       ? 
1 1 1   38   34   16 f    137.7    7.4    0.0000   0.0000          ?        ?   190.9180  20.4327          ?        ?      137.7        7.4       ?       ? 
1 1 1   38   34   17 f    170.4    4.1    0.0000   0.0000          ?        ?   291.1659  14.0475          ?        ?      170.4        4.1       ?       ? 
1 1 1   38   34   18 o    215.8    4.0    0.0000   0.0000          ?        ?   466.7593  17.2401          ?        ?      215.8        4.0       ?       ? 
1 1 1   38   34   19 o    148.5    5.4    0.0000   0.0000          ?        ?   221.5670  15.9630          ?        ?      148.5        5.4       ?       ? 
1 1 1   38   34   20 o    109.4    7.6    0.0000   0.0000          ?        ?   120.6806  16.6016          ?        ?      109.4        7.6       ?       ? 
1 1 1   38   34   21 o    236.1    3.9    0.0000   0.0000          ?        ?   558.7064  18.5171          ?        ?      236.1        3.9       ?       ? 
1 1 1   38   34   22 o    302.4    2.9    0.0000   0.0000          ?        ?   915.6400  17.2401          ?        ?      302.4        2.9       ?       ? 
1 1 1   38   34   23 o    296.6    3.1    0.0000   0.0000          ?        ?   881.1599  18.5171          ?        ?      296.6        3.1       ?       ? 
1 1 1   38   34   24 o    239.1    2.5    0.0000   0.0000          ?        ?   572.1154  12.1319          ?        ?      239.1        2.5       ?       ? 
1 1 1   38   34   25 o    101.5    5.0    0.0000   0.0000          ?        ?   103.4405  10.2163          ?        ?      101.5        5.0       ?       ? 
1 1 1   38   34   26 o     31.6   12.2    0.0000   0.0000          ?        ?     7.0237  10.8549          ?        ?       31.6       12.2       ?       ? 
1 1 1   38   34   27 o     98.5    6.2    0.0000   0.0000          ?        ?    97.6938  12.1319          ?        ?       98.5        6.2       ?       ? 
1 1 1   38   34   28 o    255.4    2.8    0.0000   0.0000          ?        ?   653.2076  14.0475          ?        ?      255.4        2.8       ?       ? 
1 1 1   38   35    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   35    1 o    409.0    8.2    0.0000   0.0000          ?        ?  1687.6125  67.0448          ?        ?      409.0        8.2       ?       ? 
1 1 1   38   35    2 o    333.7    7.8    0.0000   0.0000          ?        ?  1122.5210  52.3588          ?        ?      333.7        7.8       ?       ? 
1 1 1   38   35    3 f    358.9    8.4    0.0000   0.0000          ?        ?  1300.0300  60.0210          ?        ?      358.9        8.4       ?       ? 
1 1 1   38   35    4 f    185.9   23.2    0.0000   0.0000          ?        ?   369.7040  86.2004          ?        ?      185.9       23.2       ?       ? 
1 1 1   38   35    5 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   35    6 o    279.0    9.0    0.0000   0.0000          ?        ?   786.6586  50.4432          ?        ?      279.0        9.0       ?       ? 
1 1 1   38   35    7 o    209.3   13.6    0.0000   0.0000          ?        ?   448.8807  56.8284          ?        ?      209.3       13.6       ?       ? 
1 1 1   38   35    8 o    125.9   22.6    0.0000   0.0000          ?        ?   173.6779  54.9129          ?        ?      125.9       22.6       ?       ? 
1 1 1   38   35    9 o    174.1   25.3    0.0000   0.0000          ?        ?   329.4771  88.1160          ?        ?      174.1       25.3       ?       ? 
1 1 1   38   35   10 o    192.3   11.1    0.0000   0.0000          ?        ?   376.0892  42.7809          ?        ?      192.3       11.1       ?       ? 
1 1 1   38   35   11 o    103.4   26.0    0.0000   0.0000          ?        ?   121.3191  53.6358          ?        ?      103.4       26.0       ?       ? 
1 1 1   38   35   12 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   35   13 o     39.3   18.7    0.0000   0.0000          ?        ?   -45.9736  40.2269          ?        ?       39.3       18.7       ?       ? 
1 1 1   38   35   14 o     83.2   25.1    0.0000   0.0000          ?        ?    77.2611  45.3350          ?        ?       83.2       25.1       ?       ? 
1 1 1   38   35   15 o    152.8    6.3    0.0000   0.0000          ?        ?   234.9760  19.1556          ?        ?      152.8        6.3       ?       ? 
1 1 1   38   35   16 o    218.2    5.1    0.0000   0.0000          ?        ?   478.2527  22.3483          ?        ?      218.2        5.1       ?       ? 
1 1 1   38   35   17 o     35.7   13.6    0.0000   0.0000          ?        ?     9.5778  13.4090          ?        ?       35.7       13.6       ?       ? 
1 1 1   38   35   18 o     37.1   13.7    0.0000   0.0000          ?        ?    11.4934  13.4090          ?        ?       37.1       13.7       ?       ? 
1 1 1   38   35   19 o    211.4    3.9    0.0000   0.0000          ?        ?   448.2422  16.6016          ?        ?      211.4        3.9       ?       ? 
1 1 1   38   35   20 o     74.3   10.3    0.0000   0.0000          ?        ?    56.1899  15.3245          ?        ?       74.3       10.3       ?       ? 
1 1 1   38   35   21 o    183.8    4.5    0.0000   0.0000          ?        ?   339.0550  16.6016          ?        ?      183.8        4.5       ?       ? 
1 1 1   38   35   22 o     83.5    9.6    0.0000   0.0000          ?        ?    70.8759  15.9630          ?        ?       83.5        9.6       ?       ? 
1 1 1   38   35   23 o    237.8    3.0    0.0000   0.0000          ?        ?   566.3687  14.0475          ?        ?      237.8        3.0       ?       ? 
1 1 1   38   35   24 o    189.4    3.5    0.0000   0.0000          ?        ?   359.4877  13.4090          ?        ?      189.4        3.5       ?       ? 
1 1 1   38   35   25 o    134.9    3.8    0.0000   0.0000          ?        ?   182.6172  10.2163          ?        ?      134.9        3.8       ?       ? 
1 1 1   38   36    0 o     54.6   35.0   21.7097  83.0078    21.7097  83.0078    21.7097  83.0078       54.6     35.0       54.6       35.0     0.0     0.0 
1 1 1   38   36    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   36    2 o    252.8    7.5    0.0000   0.0000          ?        ?   644.2683  37.6728          ?        ?      252.8        7.5       ?       ? 
1 1 1   38   36    3 o    198.1   20.3    0.0000   0.0000          ?        ?   416.3161  80.4537          ?        ?      198.1       20.3       ?       ? 
1 1 1   38   36    4 o    278.5   11.5    0.0000   0.0000          ?        ?   790.4898  63.8522          ?        ?      278.5       11.5       ?       ? 
1 1 1   38   36    5 o     87.8   30.3    0.0000   0.0000          ?        ?    84.9234  64.4907          ?        ?       87.8       30.3       ?       ? 
1 1 1   38   36    6 o     53.5   22.7    0.0000   0.0000          ?        ?     7.0237  42.1424          ?        ?       53.5       22.7       ?       ? 
1 1 1   38   36    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   36    8 o     55.0   24.6    0.0000   0.0000          ?        ?   -13.4090  55.5514          ?        ?       55.0       24.6       ?       ? 
1 1 1   38   36    9 o     83.5   27.8    0.0000   0.0000          ?        ?    77.2611  54.2743          ?        ?       83.5       27.8       ?       ? 
1 1 1   38   36   10 o     72.1   25.3    0.0000   0.0000          ?        ?    53.6358  45.3350          ?        ?       72.1       25.3       ?       ? 
1 1 1   38   36   11 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   36   12 o    145.4   20.0    0.0000   0.0000          ?        ?   225.3981  58.1055          ?        ?      145.4       20.0       ?       ? 
1 1 1   38   36   13 o     63.7   24.8    0.0000   0.0000          ?        ?    33.2031  45.3350          ?        ?       63.7       24.8       ?       ? 
1 1 1   38   36   14 o     76.1   32.4    0.0000   0.0000          ?        ?    30.6490  86.2004          ?        ?       76.1       32.4       ?       ? 
1 1 1   38   36   15 o    101.8   35.1    0.0000   0.0000          ?        ?   126.4273  86.8389          ?        ?      101.8       35.1       ?       ? 
1 1 1   38   36   16 o    211.3    5.3    0.0000   0.0000          ?        ?   448.8807  22.3483          ?        ?      211.3        5.3       ?       ? 
1 1 1   38   36   17 o    129.5    5.2    0.0000   0.0000          ?        ?   168.5697  13.4090          ?        ?      129.5        5.2       ?       ? 
1 1 1   38   36   18 o     35.2   13.3    0.0000   0.0000          ?        ?     9.5778  12.7704          ?        ?       35.2       13.3       ?       ? 
1 1 1   38   36   19 o     33.4   13.7    0.0000   0.0000          ?        ?     4.4697  14.6860          ?        ?       33.4       13.7       ?       ? 
1 1 1   38   36   20 o    238.3    3.8    0.0000   0.0000          ?        ?   569.5613  17.8786          ?        ?      238.3        3.8       ?       ? 
1 1 1   38   36   21 o    228.3    3.8    0.0000   0.0000          ?        ?   522.9492  17.2401          ?        ?      228.3        3.8       ?       ? 
1 1 1   38   36   22 o     93.4    8.9    0.0000   0.0000          ?        ?    88.7545  16.6016          ?        ?       93.4        8.9       ?       ? 
1 1 1   38   37    0 o    116.1   39.4  188.3639  81.7308   188.3639  81.7308   188.3639  81.7308      116.1     39.4      116.1       39.4     0.0     0.0 
1 1 1   38   37    1 o    234.7   19.0    0.0000   0.0000          ?        ?   584.2473  89.3930          ?        ?      234.7       19.0       ?       ? 
1 1 1   38   37    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   37    3 o     77.7   31.7    0.0000   0.0000          ?        ?    46.6121  77.8996          ?        ?       77.7       31.7       ?       ? 
1 1 1   38   37    4 o    207.3   12.6    0.0000   0.0000          ?        ?   441.2184  52.3588          ?        ?      207.3       12.6       ?       ? 
1 1 1   38   37    5 o     68.1   30.2    0.0000   0.0000          ?        ?    -1.2770  81.7308          ?        ?       68.1       30.2       ?       ? 
1 1 1   38   37    6 f     43.1   20.5    0.0000   0.0000          ?        ?   -52.9973  48.5276          ?        ?       43.1       20.5       ?       ? 
1 1 1   38   37    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   37    8 o    119.9   28.6    0.0000   0.0000          ?        ?   169.8468  67.6833          ?        ?      119.9       28.6       ?       ? 
1 1 1   38   37    9 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   37   10 o     73.2   30.3    0.0000   0.0000          ?        ?    37.0343  72.1529          ?        ?       73.2       30.3       ?       ? 
1 1 1   38   37   11 o     76.0   32.2    0.0000   0.0000          ?        ?    34.4802  84.9234          ?        ?       76.0       32.2       ?       ? 
1 1 1   38   37   12 o    106.4   33.4    0.0000   0.0000          ?        ?   141.1133  79.1767          ?        ?      106.4       33.4       ?       ? 
1 1 1   38   37   13 o     69.5   30.5    0.0000   0.0000          ?        ?     8.9393  81.7308          ?        ?       69.5       30.5       ?       ? 
1 1 1   38   37   14 o     95.5   34.1    0.0000   0.0000          ?        ?   110.4642  82.3693          ?        ?       95.5       34.1       ?       ? 
1 1 1   38   37   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   37   16 o     83.1   32.2    0.0000   0.0000          ?        ?    72.7915  76.6226          ?        ?       83.1       32.2       ?       ? 
1 1 1   38   37   17 o    115.3    6.6    0.0000   0.0000          ?        ?   134.0895  15.3245          ?        ?      115.3        6.6       ?       ? 
1 1 1   38   38    0 o    242.2   18.3  605.9570  87.4775   605.9570  87.4775   605.9570  87.4775      242.2     18.3      242.2       18.3     0.0     0.0 
1 1 1   38   38    1 o    113.6   37.7  179.4246  75.9841   179.4246  75.9841   179.4246  75.9841      113.6     37.7      113.6       37.7     0.0     0.0 
1 1 1   38   38    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   38    3 o     70.7   38.8   84.9234  77.8996    84.9234  77.8996    84.9234  77.8996       70.7     38.8       70.7       38.8     0.0     0.0 
1 1 1   38   38    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   38    5 f     43.8   30.3  -37.6728  84.2849   -37.6728  84.2849   -37.6728  84.2849       43.8     30.3       43.8       30.3     0.0     0.0 
1 1 1   38   38    6 o    143.7   29.1  243.2767  74.0685   243.2767  74.0685   243.2767  74.0685      143.7     29.1      143.7       29.1     0.0     0.0 
1 1 1   38   38    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   38    8 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   38    9 o    178.5   23.0  340.9706  82.3693   340.9706  82.3693   340.9706  82.3693      178.5     23.0      178.5       23.0     0.0     0.0 
1 1 1   38   38   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   38   11 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   38   38   12 o    187.4   22.2  383.7515  81.0922   383.7515  81.0922   383.7515  81.0922      187.4     22.2      187.4       22.2     0.0     0.0 
1 1 1   39    0    0 o    539.8    5.6 2914.8513  60.6596  2914.8513  60.6596  2914.8513  60.6596      539.8      5.6      539.8        5.6     0.0     0.0 
1 1 1   39    0    1 o    658.6    4.0 4338.7544  52.9973  4338.7544  52.9973  4338.7544  52.9973      658.6      4.0      658.6        4.0     0.0     0.0 
1 1 1   39    0    2 o    262.3    3.9  688.3264  20.4327   688.3264  20.4327   688.3264  20.4327      262.3      3.9      262.3        3.9     0.0     0.0 
1 1 1   39    0    3 o    382.7    3.3 1464.7686  25.5409  1464.7686  25.5409  1464.7686  25.5409      382.7      3.3      382.7        3.3     0.0     0.0 
1 1 1   39    0    4 o    380.2    3.5 1446.2515  26.8179  1446.2515  26.8179  1446.2515  26.8179      380.2      3.5      380.2        3.5     0.0     0.0 
1 1 1   39    0    5 o    814.3    4.5 6631.6855  72.7915  6631.6855  72.7915  6631.6855  72.7915      814.3      4.5      814.3        4.5     0.0     0.0 
1 1 1   39    0    6 o    261.2    3.9  682.5797  20.4327   682.5797  20.4327   682.5797  20.4327      261.2      3.9      261.2        3.9     0.0     0.0 
1 1 1   39    0    7 o   1057.6    5.4 11186.8984 113.6568 11186.8984 113.6568 11186.8984 113.6568     1057.6      5.4     1057.6        5.4     0.0     0.0 
1 1 1   39    0    8 o    360.8    3.7 1302.5841  26.8179  1302.5841  26.8179  1302.5841  26.8179      360.8      3.7      360.8        3.7     0.0     0.0 
1 1 1   39    0    9 o   1651.5    7.9 27282.1152 261.1554 27282.1152 261.1554 27282.1152 261.1554     1651.5      7.9     1651.5        7.9     0.0     0.0 
1 1 1   39    0   10 o    202.6    5.2  411.2079  21.0712   411.2079  21.0712   411.2079  21.0712      202.6      5.2      202.6        5.2     0.0     0.0 
1 1 1   39    0   11 o    287.6    3.8  827.5240  21.7097   827.5240  21.7097   827.5240  21.7097      287.6      3.8      287.6        3.8     0.0     0.0 
1 1 1   39    0   12 o     76.2   11.4   60.6596  16.6016    60.6596  16.6016    60.6596  16.6016       76.2     11.4       76.2       11.4     0.0     0.0 
1 1 1   39    0   13 o     11.6    8.7  -58.1055  16.6016   -58.1055  16.6016   -58.1055  16.6016       11.6      8.7       11.6        8.7     0.0     0.0 
1 1 1   39    0   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    0   15 o    109.1    7.4  120.6806  15.9630   120.6806  15.9630   120.6806  15.9630      109.1      7.4      109.1        7.4     0.0     0.0 
1 1 1   39    0   16 o     93.6    9.0   90.0316  16.6016    90.0316  16.6016    90.0316  16.6016       93.6      9.0       93.6        9.0     0.0     0.0 
1 1 1   39    0   17 o    431.8    3.8 1865.1217  32.5646  1865.1217  32.5646  1865.1217  32.5646      431.8      3.8      431.8        3.8     0.0     0.0 
1 1 1   39    0   18 o    686.7    4.6 4717.3975  62.5751  4717.3975  62.5751  4717.3975  62.5751      686.7      4.6      686.7        4.6     0.0     0.0 
1 1 1   39    0   19 o     14.2   10.6  -69.5989  22.3483   -69.5989  22.3483   -69.5989  22.3483       14.2     10.6       14.2       10.6     0.0     0.0 
1 1 1   39    0   20 o    192.4    5.2  370.9810  19.7942   370.9810  19.7942   370.9810  19.7942      192.4      5.2      192.4        5.2     0.0     0.0 
1 1 1   39    0   21 o    352.5    3.8 1243.2015  26.8179  1243.2015  26.8179  1243.2015  26.8179      352.5      3.8      352.5        3.8     0.0     0.0 
1 1 1   39    0   22 o    202.1    5.2  409.2924  21.0712   409.2924  21.0712   409.2924  21.0712      202.1      5.2      202.1        5.2     0.0     0.0 
1 1 1   39    0   23 o    192.5    5.5  371.6196  21.0712   371.6196  21.0712   371.6196  21.0712      192.5      5.5      192.5        5.5     0.0     0.0 
1 1 1   39    0   24 o    479.6    3.6 2301.2319  34.4802  2301.2319  34.4802  2301.2319  34.4802      479.6      3.6      479.6        3.6     0.0     0.0 
1 1 1   39    0   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    0   26 o    359.7    3.9 1294.2833  28.0950  1294.2833  28.0950  1294.2833  28.0950      359.7      3.9      359.7        3.9     0.0     0.0 
1 1 1   39    0   27 o    580.7    3.8 3373.3096  44.0580  3373.3096  44.0580  3373.3096  44.0580      580.7      3.8      580.7        3.8     0.0     0.0 
1 1 1   39    0   28 o    399.9    4.2 1600.1353  33.8416  1600.1353  33.8416  1600.1353  33.8416      399.9      4.2      399.9        4.2     0.0     0.0 
1 1 1   39    0   29 o    861.0    4.6 7415.1519  79.1767  7415.1519  79.1767  7415.1519  79.1767      861.0      4.6      861.0        4.6     0.0     0.0 
1 1 1   39    0   30 o    110.6    9.4  125.1502  20.4327   125.1502  20.4327   125.1502  20.4327      110.6      9.4      110.6        9.4     0.0     0.0 
1 1 1   39    0   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    0   32 o    368.1    3.7 1355.5814  27.4564  1355.5814  27.4564  1355.5814  27.4564      368.1      3.7      368.1        3.7     0.0     0.0 
1 1 1   39    0   33 o    416.7    3.5 1736.7788  29.3720  1736.7788  29.3720  1736.7788  29.3720      416.7      3.5      416.7        3.5     0.0     0.0 
1 1 1   39    0   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    0   35 o    140.4    7.8  199.2188  21.7097   199.2188  21.7097   199.2188  21.7097      140.4      7.8      140.4        7.8     0.0     0.0 
1 1 1   39    0   36 o    482.5    3.8 2329.3269  37.0343  2329.3269  37.0343  2329.3269  37.0343      482.5      3.8      482.5        3.8     0.0     0.0 
1 1 1   39    0   37 o     82.0   14.5   72.7915  21.7097    72.7915  21.7097    72.7915  21.7097       82.0     14.5       82.0       14.5     0.0     0.0 
1 1 1   39    0   38 o    168.9    6.4  286.6962  21.7097   286.6962  21.7097   286.6962  21.7097      168.9      6.4      168.9        6.4     0.0     0.0 
1 1 1   39    0   39 o    212.9    5.6  454.6274  23.6253   454.6274  23.6253   454.6274  23.6253      212.9      5.6      212.9        5.6     0.0     0.0 
1 1 1   39    0   40 o    657.3    3.9 4321.5142  51.7203  4321.5142  51.7203  4321.5142  51.7203      657.3      3.9      657.3        3.9     0.0     0.0 
1 1 1   39    0   41 o    770.5    4.4 5939.5283  67.0448  5939.5283  67.0448  5939.5283  67.0448      770.5      4.4      770.5        4.4     0.0     0.0 
1 1 1   39    0   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    0   43 o     69.2   18.7   57.4669  22.3483    57.4669  22.3483    57.4669  22.3483       69.2     18.7       69.2       18.7     0.0     0.0 
1 1 1   39    0   44 o    148.0    8.5  221.5670  24.9023   221.5670  24.9023   221.5670  24.9023      148.0      8.5      148.0        8.5     0.0     0.0 
1 1 1   39    0   45 o    383.1    3.8 1468.5997  28.7335  1468.5997  28.7335  1468.5997  28.7335      383.1      3.8      383.1        3.8     0.0     0.0 
1 1 1   39    0   46 o    217.5    5.4  474.4216  23.6253   474.4216  23.6253   474.4216  23.6253      217.5      5.4      217.5        5.4     0.0     0.0 
1 1 1   39    0   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    0   48 o    170.7    6.9  293.0815  23.6253   293.0815  23.6253   293.0815  23.6253      170.7      6.9      170.7        6.9     0.0     0.0 
1 1 1   39    0   49 o     41.5   21.8   25.5409  23.6253    25.5409  23.6253    25.5409  23.6253       41.5     21.8       41.5       21.8     0.0     0.0 
1 1 1   39    0   50 o    111.0   10.8  127.0658  23.6253   127.0658  23.6253   127.0658  23.6253      111.0     10.8      111.0       10.8     0.0     0.0 
1 1 1   39    0   51 o    174.1    7.4  305.2133  25.5409   305.2133  25.5409   305.2133  25.5409      174.1      7.4      174.1        7.4     0.0     0.0 
1 1 1   39    0   52 o     53.7   22.9   41.5039  24.9023    41.5039  24.9023    41.5039  24.9023       53.7     22.9       53.7       22.9     0.0     0.0 
1 1 1   39    0   53 o    293.7    4.8  863.9198  28.0950   863.9198  28.0950   863.9198  28.0950      293.7      4.8      293.7        4.8     0.0     0.0 
1 1 1   39    0   54 o     24.0   16.6  -16.6016  25.5409   -16.6016  25.5409   -16.6016  25.5409       24.0     16.6       24.0       16.6     0.0     0.0 
1 1 1   39    0   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    0   56 o     67.2   22.5   58.7440  26.8179    58.7440  26.8179    58.7440  26.8179       67.2     22.5       67.2       22.5     0.0     0.0 
1 1 1   39    0   57 o    117.5   11.9  143.0288  27.4564   143.0288  27.4564   143.0288  27.4564      117.5     11.9      117.5       11.9     0.0     0.0 
1 1 1   39    0   58 o     23.6   16.4  -21.7097  26.8179   -21.7097  26.8179   -21.7097  26.8179       23.6     16.4       23.6       16.4     0.0     0.0 
1 1 1   39    0   59 o    409.1    4.3 1675.4807  35.1187  1675.4807  35.1187  1675.4807  35.1187      409.1      4.3      409.1        4.3     0.0     0.0 
1 1 1   39    0   60 o     15.7   11.7  -85.5619  27.4564   -85.5619  27.4564   -85.5619  27.4564       15.7     11.7       15.7       11.7     0.0     0.0 
1 1 1   39    0   61 o     20.4   14.8  -43.4195  28.0950   -43.4195  28.0950   -43.4195  28.0950       20.4     14.8       20.4       14.8     0.0     0.0 
1 1 1   39    0   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    0   63 o    159.6    8.9  258.6013  28.0950   258.6013  28.0950   258.6013  28.0950      159.6      8.9      159.6        8.9     0.0     0.0 
1 1 1   39    0   64 o     18.0   13.2  -52.9973  26.1794   -52.9973  26.1794   -52.9973  26.1794       18.0     13.2       18.0       13.2     0.0     0.0 
1 1 1   39    0   65 o     15.5   11.6  -87.4775  27.4564   -87.4775  27.4564   -87.4775  27.4564       15.5     11.6       15.5       11.6     0.0     0.0 
1 1 1   39    0   66 o    257.5    5.7  665.9781  29.3720   665.9781  29.3720   665.9781  29.3720      257.5      5.7      257.5        5.7     0.0     0.0 
1 1 1   39    0   67 f     15.5   11.6  -81.7308  26.8179   -81.7308  26.8179   -81.7308  26.8179       15.5     11.6       15.5       11.6     0.0     0.0 
1 1 1   39    1    0 o    627.0    3.9 3931.3777  49.1662  3931.3777  49.1662  3931.3777  49.1662      627.0      3.9      627.0        3.9     0.0     0.0 
1 1 1   39    1    1 o    357.6    2.3    0.0000   0.0000          ?        ?  1278.9589  16.6016          ?        ?      357.6        2.3       ?       ? 
1 1 1   39    1    2 o    807.2    3.2    0.0000   0.0000          ?        ?  6515.4746  51.0817          ?        ?      807.2        3.2       ?       ? 
1 1 1   39    1    3 o    185.5    3.1    0.0000   0.0000          ?        ?   344.1632  11.4934          ?        ?      185.5        3.1       ?       ? 
1 1 1   39    1    4 o    123.8    4.6    0.0000   0.0000          ?        ?   153.2452  11.4934          ?        ?      123.8        4.6       ?       ? 
1 1 1   39    1    5 f    513.3    2.6    0.0000   0.0000          ?        ?  2635.1787  26.8179          ?        ?      513.3        2.6       ?       ? 
1 1 1   39    1    6 o    248.0    2.7    0.0000   0.0000          ?        ?   614.8964  13.4090          ?        ?      248.0        2.7       ?       ? 
1 1 1   39    1    7 o    898.8    3.5    0.0000   0.0000          ?        ?  8078.5752  62.5751          ?        ?      898.8        3.5       ?       ? 
1 1 1   39    1    8 o    981.4    3.6    0.0000   0.0000          ?        ?  9632.0986  71.5144          ?        ?      981.4        3.6       ?       ? 
1 1 1   39    1    9 o    241.4    3.0    0.0000   0.0000          ?        ?   582.9703  14.6860          ?        ?      241.4        3.0       ?       ? 
1 1 1   39    1   10 o    543.2    2.6    0.0000   0.0000          ?        ?  2951.2471  28.0950          ?        ?      543.2        2.6       ?       ? 
1 1 1   39    1   11 o    717.9    2.9    0.0000   0.0000          ?        ?  5154.1465  42.1424          ?        ?      717.9        2.9       ?       ? 
1 1 1   39    1   12 o    901.6    3.4    0.0000   0.0000          ?        ?  8129.6572  61.9366          ?        ?      901.6        3.4       ?       ? 
1 1 1   39    1   13 o    817.0    3.3    0.0000   0.0000          ?        ?  6675.7437  53.6358          ?        ?      817.0        3.3       ?       ? 
1 1 1   39    1   14 o   1028.9    3.7    0.0000   0.0000          ?        ? 10587.9648  76.6226          ?        ?     1028.9        3.7       ?       ? 
1 1 1   39    1   15 o    706.5    3.0    0.0000   0.0000          ?        ?  4992.6006  42.7809          ?        ?      706.5        3.0       ?       ? 
1 1 1   39    1   16 o    156.6    4.1    0.0000   0.0000          ?        ?   245.1923  12.7704          ?        ?      156.6        4.1       ?       ? 
1 1 1   39    1   17 o    912.2    3.5    0.0000   0.0000          ?        ?  8323.1299  63.2136          ?        ?      912.2        3.5       ?       ? 
1 1 1   39    1   18 o    589.7    2.7    0.0000   0.0000          ?        ?  3478.0273  31.2876          ?        ?      589.7        2.7       ?       ? 
1 1 1   39    1   19 o    509.1    2.8    0.0000   0.0000          ?        ?  2591.7593  28.0950          ?        ?      509.1        2.8       ?       ? 
1 1 1   39    1   20 o   1042.0    3.8    0.0000   0.0000          ?        ? 10859.9766  78.5382          ?        ?     1042.0        3.8       ?       ? 
1 1 1   39    1   21 o    454.8    2.4    0.0000   0.0000          ?        ?  2068.1716  21.7097          ?        ?      454.8        2.4       ?       ? 
1 1 1   39    1   22 o    272.6    2.7    0.0000   0.0000          ?        ?   743.2392  14.6860          ?        ?      272.6        2.7       ?       ? 
1 1 1   39    1   23 o    284.0    2.7    0.0000   0.0000          ?        ?   806.4528  15.3245          ?        ?      284.0        2.7       ?       ? 
1 1 1   39    1   24 f    925.5    3.5    0.0000   0.0000          ?        ?  8567.0439  65.1292          ?        ?      925.5        3.5       ?       ? 
1 1 1   39    1   25 o    338.2    2.5    0.0000   0.0000          ?        ?  1144.2307  17.2401          ?        ?      338.2        2.5       ?       ? 
1 1 1   39    1   26 o    706.0    2.9    0.0000   0.0000          ?        ?  4985.5767  40.8654          ?        ?      706.0        2.9       ?       ? 
1 1 1   39    1   27 o    126.3    5.8    0.0000   0.0000          ?        ?   159.6304  14.6860          ?        ?      126.3        5.8       ?       ? 
1 1 1   39    1   28 o    838.5    3.3    0.0000   0.0000          ?        ?  7032.6772  54.9129          ?        ?      838.5        3.3       ?       ? 
1 1 1   39    1   29 o    634.2    2.8    0.0000   0.0000          ?        ?  4023.3247  35.1187          ?        ?      634.2        2.8       ?       ? 
1 1 1   39    1   30 o    612.2    2.7    0.0000   0.0000          ?        ?  3748.1218  32.5646          ?        ?      612.2        2.7       ?       ? 
1 1 1   39    1   31 o    280.9    3.0    0.0000   0.0000          ?        ?   789.2127  16.6016          ?        ?      280.9        3.0       ?       ? 
1 1 1   39    1   32 o    464.2    2.5    0.0000   0.0000          ?        ?  2155.0105  22.9868          ?        ?      464.2        2.5       ?       ? 
1 1 1   39    1   33 o    194.9    3.9    0.0000   0.0000          ?        ?   379.9204  15.3245          ?        ?      194.9        3.9       ?       ? 
1 1 1   39    1   34 o    418.3    2.6    0.0000   0.0000          ?        ?  1750.1879  21.7097          ?        ?      418.3        2.6       ?       ? 
1 1 1   39    1   35 o    800.4    3.2    0.0000   0.0000          ?        ?  6408.8418  51.0817          ?        ?      800.4        3.2       ?       ? 
1 1 1   39    1   36 o    231.4    3.3    0.0000   0.0000          ?        ?   535.7197  15.3245          ?        ?      231.4        3.3       ?       ? 
1 1 1   39    1   37 o    104.1    7.4    0.0000   0.0000          ?        ?   108.5487  15.3245          ?        ?      104.1        7.4       ?       ? 
1 1 1   39    1   38 o    225.1    3.7    0.0000   0.0000          ?        ?   506.9862  16.6016          ?        ?      225.1        3.7       ?       ? 
1 1 1   39    1   39 o    200.8    3.8    0.0000   0.0000          ?        ?   403.5457  15.3245          ?        ?      200.8        3.8       ?       ? 
1 1 1   39    1   40 o    353.4    2.9    0.0000   0.0000          ?        ?  1249.5868  20.4327          ?        ?      353.4        2.9       ?       ? 
1 1 1   39    1   41 o    562.8    2.7    0.0000   0.0000          ?        ?  3168.3445  30.0105          ?        ?      562.8        2.7       ?       ? 
1 1 1   39    1   42 o     23.2   11.2    0.0000   0.0000          ?        ?   -26.1794  15.9630          ?        ?       23.2       11.2       ?       ? 
1 1 1   39    1   43 o    613.5    2.7    0.0000   0.0000          ?        ?  3764.7234  33.2031          ?        ?      613.5        2.7       ?       ? 
1 1 1   39    1   44 o    407.1    2.7    0.0000   0.0000          ?        ?  1658.2407  21.7097          ?        ?      407.1        2.7       ?       ? 
1 1 1   39    1   45 o    193.7    4.5    0.0000   0.0000          ?        ?   375.4507  17.2401          ?        ?      193.7        4.5       ?       ? 
1 1 1   39    1   46 o    133.6    6.0    0.0000   0.0000          ?        ?   178.7861  15.9630          ?        ?      133.6        6.0       ?       ? 
1 1 1   39    1   47 o    189.7    4.5    0.0000   0.0000          ?        ?   360.1262  17.2401          ?        ?      189.7        4.5       ?       ? 
1 1 1   39    1   48 f    164.0    5.3    0.0000   0.0000          ?        ?   269.4561  17.2401          ?        ?      164.0        5.3       ?       ? 
1 1 1   39    1   49 o    201.7    4.4    0.0000   0.0000          ?        ?   407.3768  17.8786          ?        ?      201.7        4.4       ?       ? 
1 1 1   39    1   50 o    117.5    7.6    0.0000   0.0000          ?        ?   138.5592  17.8786          ?        ?      117.5        7.6       ?       ? 
1 1 1   39    1   51 o    359.8    2.9    0.0000   0.0000          ?        ?  1294.9219  21.0712          ?        ?      359.8        2.9       ?       ? 
1 1 1   39    1   52 o    256.2    3.7    0.0000   0.0000          ?        ?   657.0388  19.1556          ?        ?      256.2        3.7       ?       ? 
1 1 1   39    1   53 o    175.4    5.5    0.0000   0.0000          ?        ?   308.4059  19.1556          ?        ?      175.4        5.5       ?       ? 
1 1 1   39    1   54 f    149.5    6.4    0.0000   0.0000          ?        ?   224.1211  19.1556          ?        ?      149.5        6.4       ?       ? 
1 1 1   39    1   55 o    179.0    5.2    0.0000   0.0000          ?        ?   321.1764  18.5171          ?        ?      179.0        5.2       ?       ? 
1 1 1   39    1   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    1   57 o     60.6   16.1    0.0000   0.0000          ?        ?    38.9498  19.7942          ?        ?       60.6       16.1       ?       ? 
1 1 1   39    1   58 o    175.9    5.4    0.0000   0.0000          ?        ?   310.3215  19.1556          ?        ?      175.9        5.4       ?       ? 
1 1 1   39    1   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    1   60 o    276.1    3.9    0.0000   0.0000          ?        ?   763.6719  21.7097          ?        ?      276.1        3.9       ?       ? 
1 1 1   39    1   61 o    167.0    6.1    0.0000   0.0000          ?        ?   280.3110  20.4327          ?        ?      167.0        6.1       ?       ? 
1 1 1   39    1   62 o    152.0    6.5    0.0000   0.0000          ?        ?   232.4219  19.7942          ?        ?      152.0        6.5       ?       ? 
1 1 1   39    1   63 o     47.8   17.0    0.0000   0.0000          ?        ?    21.0712  20.4327          ?        ?       47.8       17.0       ?       ? 
1 1 1   39    1   64 o     62.0   15.9    0.0000   0.0000          ?        ?    41.5039  19.7942          ?        ?       62.0       15.9       ?       ? 
1 1 1   39    1   65 o    185.2    5.5    0.0000   0.0000          ?        ?   344.8017  20.4327          ?        ?      185.2        5.5       ?       ? 
1 1 1   39    1   66 o     30.6   14.0    0.0000   0.0000          ?        ?   -11.4934  19.1556          ?        ?       30.6       14.0       ?       ? 
1 1 1   39    2    0 o     93.5    8.0   89.3930  14.6860    89.3930  14.6860    89.3930  14.6860       93.5      8.0       93.5        8.0     0.0     0.0 
1 1 1   39    2    1 o    794.3    3.1    0.0000   0.0000          ?        ?  6309.8706  49.8047          ?        ?      794.3        3.1       ?       ? 
1 1 1   39    2    2 o    673.2    2.9    0.0000   0.0000          ?        ?  4532.8652  38.9498          ?        ?      673.2        2.9       ?       ? 
1 1 1   39    2    3 o    665.2    2.8    0.0000   0.0000          ?        ?  4424.9551  37.6728          ?        ?      665.2        2.8       ?       ? 
1 1 1   39    2    4 o    229.4    2.8    0.0000   0.0000          ?        ?   526.1418  12.7704          ?        ?      229.4        2.8       ?       ? 
1 1 1   39    2    5 o   1085.2    3.9    0.0000   0.0000          ?        ? 11777.5312  83.6463          ?        ?     1085.2        3.9       ?       ? 
1 1 1   39    2    6 f    404.1    2.4    0.0000   0.0000          ?        ?  1633.3384  19.7942          ?        ?      404.1        2.4       ?       ? 
1 1 1   39    2    7 o    823.0    3.2    0.0000   0.0000          ?        ?  6773.4375  52.9973          ?        ?      823.0        3.2       ?       ? 
1 1 1   39    2    8 o    746.4    3.0    0.0000   0.0000          ?        ?  5571.1011  45.3350          ?        ?      746.4        3.0       ?       ? 
1 1 1   39    2    9 o    790.6    3.1    0.0000   0.0000          ?        ?  6251.7651  49.8047          ?        ?      790.6        3.1       ?       ? 
1 1 1   39    2   10 o    430.2    2.5    0.0000   0.0000          ?        ?  1850.4355  21.7097          ?        ?      430.2        2.5       ?       ? 
1 1 1   39    2   11 o    166.5    3.6    0.0000   0.0000          ?        ?   277.1184  12.1319          ?        ?      166.5        3.6       ?       ? 
1 1 1   39    2   12 o    616.7    2.7    0.0000   0.0000          ?        ?  3803.6733  33.2031          ?        ?      616.7        2.7       ?       ? 
1 1 1   39    2   13 o    825.1    3.3    0.0000   0.0000          ?        ?  6809.1948  53.6358          ?        ?      825.1        3.3       ?       ? 
1 1 1   39    2   14 o    736.8    3.1    0.0000   0.0000          ?        ?  5428.7109  45.3350          ?        ?      736.8        3.1       ?       ? 
1 1 1   39    2   15 o   1032.0    3.9    0.0000   0.0000          ?        ? 10652.4570  80.4537          ?        ?     1032.0        3.9       ?       ? 
1 1 1   39    2   16 o   1232.4    4.5    0.0000   0.0000          ?        ? 15192.3457 111.1028          ?        ?     1232.4        4.5       ?       ? 
1 1 1   39    2   17 o    333.0    2.4    0.0000   0.0000          ?        ?  1109.1121  15.9630          ?        ?      333.0        2.4       ?       ? 
1 1 1   39    2   18 o    732.9    3.0    0.0000   0.0000          ?        ?  5372.5210  43.4195          ?        ?      732.9        3.0       ?       ? 
1 1 1   39    2   19 o    887.6    3.3    0.0000   0.0000          ?        ?  7879.9951  59.3825          ?        ?      887.6        3.3       ?       ? 
1 1 1   39    2   20 o    279.7    2.7    0.0000   0.0000          ?        ?   782.1890  15.3245          ?        ?      279.7        2.7       ?       ? 
1 1 1   39    2   21 o    917.6    3.5    0.0000   0.0000          ?        ?  8422.1006  63.8522          ?        ?      917.6        3.5       ?       ? 
1 1 1   39    2   22 o    683.7    2.8    0.0000   0.0000          ?        ?  4675.2554  37.6728          ?        ?      683.7        2.8       ?       ? 
1 1 1   39    2   23 o    300.1    2.6    0.0000   0.0000          ?        ?   900.9540  15.3245          ?        ?      300.1        2.6       ?       ? 
1 1 1   39    2   24 o    325.3    2.7    0.0000   0.0000          ?        ?  1058.0303  17.2401          ?        ?      325.3        2.7       ?       ? 
1 1 1   39    2   25 o    845.8    3.2    0.0000   0.0000          ?        ?  7155.2729  54.9129          ?        ?      845.8        3.2       ?       ? 
1 1 1   39    2   26 o    459.0    2.4    0.0000   0.0000          ?        ?  2107.1213  22.3483          ?        ?      459.0        2.4       ?       ? 
1 1 1   39    2   27 o     96.2    7.6    0.0000   0.0000          ?        ?    92.5856  14.6860          ?        ?       96.2        7.6       ?       ? 
1 1 1   39    2   28 o    421.9    2.5    0.0000   0.0000          ?        ?  1780.1982  21.0712          ?        ?      421.9        2.5       ?       ? 
1 1 1   39    2   29 o    256.9    3.2    0.0000   0.0000          ?        ?   660.2314  16.6016          ?        ?      256.9        3.2       ?       ? 
1 1 1   39    2   30 o    451.9    2.4    0.0000   0.0000          ?        ?  2041.9921  21.7097          ?        ?      451.9        2.4       ?       ? 
1 1 1   39    2   31 f    533.5    2.6    0.0000   0.0000          ?        ?  2846.5293  27.4564          ?        ?      533.5        2.6       ?       ? 
1 1 1   39    2   32 f    361.8    2.6    0.0000   0.0000          ?        ?  1308.9694  18.5171          ?        ?      361.8        2.6       ?       ? 
1 1 1   39    2   33 o    551.1    2.7    0.0000   0.0000          ?        ?  3038.0859  29.3720          ?        ?      551.1        2.7       ?       ? 
1 1 1   39    2   34 o    460.6    2.6    0.0000   0.0000          ?        ?  2121.8074  24.2638          ?        ?      460.6        2.6       ?       ? 
1 1 1   39    2   35 o    337.1    2.7    0.0000   0.0000          ?        ?  1136.5685  17.8786          ?        ?      337.1        2.7       ?       ? 
1 1 1   39    2   36 o    278.6    3.0    0.0000   0.0000          ?        ?   776.4423  16.6016          ?        ?      278.6        3.0       ?       ? 
1 1 1   39    2   37 o    285.3    2.9    0.0000   0.0000          ?        ?   814.1151  16.6016          ?        ?      285.3        2.9       ?       ? 
1 1 1   39    2   38 o    214.5    3.7    0.0000   0.0000          ?        ?   460.3741  15.9630          ?        ?      214.5        3.7       ?       ? 
1 1 1   39    2   39 o    222.1    3.7    0.0000   0.0000          ?        ?   493.5772  16.6016          ?        ?      222.1        3.7       ?       ? 
1 1 1   39    2   40 o    178.2    4.8    0.0000   0.0000          ?        ?   317.9838  17.2401          ?        ?      178.2        4.8       ?       ? 
1 1 1   39    2   41 o    344.8    2.8    0.0000   0.0000          ?        ?  1189.5658  19.1556          ?        ?      344.8        2.8       ?       ? 
1 1 1   39    2   42 o    198.9    4.0    0.0000   0.0000          ?        ?   395.8834  15.9630          ?        ?      198.9        4.0       ?       ? 
1 1 1   39    2   43 o     82.9   10.0    0.0000   0.0000          ?        ?    68.9603  16.6016          ?        ?       82.9       10.0       ?       ? 
1 1 1   39    2   44 f    268.9    3.3    0.0000   0.0000          ?        ?   723.4450  17.8786          ?        ?      268.9        3.3       ?       ? 
1 1 1   39    2   45 o    388.0    2.6    0.0000   0.0000          ?        ?  1505.6340  20.4327          ?        ?      388.0        2.6       ?       ? 
1 1 1   39    2   46 o    167.1    5.0    0.0000   0.0000          ?        ?   279.6725  16.6016          ?        ?      167.1        5.0       ?       ? 
1 1 1   39    2   47 o    657.5    2.8    0.0000   0.0000          ?        ?  4325.3457  37.0343          ?        ?      657.5        2.8       ?       ? 
1 1 1   39    2   48 f    266.0    3.5    0.0000   0.0000          ?        ?   708.1205  18.5171          ?        ?      266.0        3.5       ?       ? 
1 1 1   39    2   49 o     33.9   14.3    0.0000   0.0000          ?        ?     1.2770  16.6016          ?        ?       33.9       14.3       ?       ? 
1 1 1   39    2   50 o    205.6    4.3    0.0000   0.0000          ?        ?   423.3398  17.8786          ?        ?      205.6        4.3       ?       ? 
1 1 1   39    2   51 o    207.0    4.6    0.0000   0.0000          ?        ?   429.0865  19.1556          ?        ?      207.0        4.6       ?       ? 
1 1 1   39    2   52 o    153.5    5.8    0.0000   0.0000          ?        ?   236.2530  17.8786          ?        ?      153.5        5.8       ?       ? 
1 1 1   39    2   53 o     22.3   11.0    0.0000   0.0000          ?        ?   -39.5883  17.8786          ?        ?       22.3       11.0       ?       ? 
1 1 1   39    2   54 o    303.5    3.5    0.0000   0.0000          ?        ?   922.0252  21.0712          ?        ?      303.5        3.5       ?       ? 
1 1 1   39    2   55 o     19.6    9.9    0.0000   0.0000          ?        ?   -65.7677  19.1556          ?        ?       19.6        9.9       ?       ? 
1 1 1   39    2   56 o    179.5    5.5    0.0000   0.0000          ?        ?   323.0919  19.7942          ?        ?      179.5        5.5       ?       ? 
1 1 1   39    2   57 o    203.0    4.9    0.0000   0.0000          ?        ?   413.1235  19.7942          ?        ?      203.0        4.9       ?       ? 
1 1 1   39    2   58 o    142.4    6.7    0.0000   0.0000          ?        ?   203.6884  19.1556          ?        ?      142.4        6.7       ?       ? 
1 1 1   39    2   59 o    274.5    4.0    0.0000   0.0000          ?        ?   754.7325  21.7097          ?        ?      274.5        4.0       ?       ? 
1 1 1   39    2   60 o     38.5   15.9    0.0000   0.0000          ?        ?     5.1082  19.7942          ?        ?       38.5       15.9       ?       ? 
1 1 1   39    2   61 o    134.0    7.1    0.0000   0.0000          ?        ?   180.7016  19.1556          ?        ?      134.0        7.1       ?       ? 
1 1 1   39    2   62 f    201.8    5.2    0.0000   0.0000          ?        ?   408.6538  21.0712          ?        ?      201.8        5.2       ?       ? 
1 1 1   39    2   63 o     36.8   15.4    0.0000   0.0000          ?        ?     3.1926  19.1556          ?        ?       36.8       15.4       ?       ? 
1 1 1   39    2   64 o    146.1    7.0    0.0000   0.0000          ?        ?   215.1818  20.4327          ?        ?      146.1        7.0       ?       ? 
1 1 1   39    2   65 o    157.2    6.1    0.0000   0.0000          ?        ?   249.0234  19.1556          ?        ?      157.2        6.1       ?       ? 
1 1 1   39    2   66 o     25.1   12.1    0.0000   0.0000          ?        ?   -28.0950  18.5171          ?        ?       25.1       12.1       ?       ? 
1 1 1   39    3    0 o    400.9    4.7 1608.4359  37.6728  1608.4359  37.6728  1608.4359  37.6728      400.9      4.7      400.9        4.7     0.0     0.0 
1 1 1   39    3    1 o   1557.5    5.5    0.0000   0.0000          ?        ? 24263.8223 170.4853          ?        ?     1557.5        5.5       ?       ? 
1 1 1   39    3    2 o    253.4    3.3    0.0000   0.0000          ?        ?   642.3527  16.6016          ?        ?      253.4        3.3       ?       ? 
1 1 1   39    3    3 o    796.0    3.3    0.0000   0.0000          ?        ?  6337.3271  52.3588          ?        ?      796.0        3.3       ?       ? 
1 1 1   39    3    4 o    513.3    2.7    0.0000   0.0000          ?        ?  2634.5403  27.4564          ?        ?      513.3        2.7       ?       ? 
1 1 1   39    3    5 o    397.4    2.6    0.0000   0.0000          ?        ?  1579.7025  20.4327          ?        ?      397.4        2.6       ?       ? 
1 1 1   39    3    6 o    474.3    2.5    0.0000   0.0000          ?        ?  2249.5117  23.6253          ?        ?      474.3        2.5       ?       ? 
1 1 1   39    3    7 f    389.7    2.5    0.0000   0.0000          ?        ?  1518.4044  19.7942          ?        ?      389.7        2.5       ?       ? 
1 1 1   39    3    8 o   1041.5    3.8    0.0000   0.0000          ?        ? 10849.7588  79.8152          ?        ?     1041.5        3.8       ?       ? 
1 1 1   39    3    9 o    833.7    3.2    0.0000   0.0000          ?        ?  6951.5845  52.9973          ?        ?      833.7        3.2       ?       ? 
1 1 1   39    3   10 o    217.8    2.9    0.0000   0.0000          ?        ?   474.4216  12.7704          ?        ?      217.8        2.9       ?       ? 
1 1 1   39    3   11 o     20.8   10.0    0.0000   0.0000          ?        ?   -15.3245  11.4934          ?        ?       20.8       10.0       ?       ? 
1 1 1   39    3   12 o    925.5    3.5    0.0000   0.0000          ?        ?  8567.0439  64.4907          ?        ?      925.5        3.5       ?       ? 
1 1 1   39    3   13 o    432.2    2.4    0.0000   0.0000          ?        ?  1868.3143  21.0712          ?        ?      432.2        2.4       ?       ? 
1 1 1   39    3   14 o    499.6    2.6    0.0000   0.0000          ?        ?  2496.6196  25.5409          ?        ?      499.6        2.6       ?       ? 
1 1 1   39    3   15 o    365.5    2.5    0.0000   0.0000          ?        ?  1335.7872  18.5171          ?        ?      365.5        2.5       ?       ? 
1 1 1   39    3   16 o    457.4    2.6    0.0000   0.0000          ?        ?  2092.4355  23.6253          ?        ?      457.4        2.6       ?       ? 
1 1 1   39    3   17 o    297.9    2.5    0.0000   0.0000          ?        ?   887.5450  14.6860          ?        ?      297.9        2.5       ?       ? 
1 1 1   39    3   18 o    170.2    4.5    0.0000   0.0000          ?        ?   289.8888  15.3245          ?        ?      170.2        4.5       ?       ? 
1 1 1   39    3   19 o    269.0    3.1    0.0000   0.0000          ?        ?   723.4450  16.6016          ?        ?      269.0        3.1       ?       ? 
1 1 1   39    3   20 o     63.4   11.5    0.0000   0.0000          ?        ?    41.5039  14.0475          ?        ?       63.4       11.5       ?       ? 
1 1 1   39    3   21 o    324.8    2.6    0.0000   0.0000          ?        ?  1054.8376  16.6016          ?        ?      324.8        2.6       ?       ? 
1 1 1   39    3   22 o    602.9    2.6    0.0000   0.0000          ?        ?  3635.7422  31.2876          ?        ?      602.9        2.6       ?       ? 
1 1 1   39    3   23 o    414.7    2.5    0.0000   0.0000          ?        ?  1720.1772  20.4327          ?        ?      414.7        2.5       ?       ? 
1 1 1   39    3   24 o    465.9    2.5    0.0000   0.0000          ?        ?  2170.9736  22.9868          ?        ?      465.9        2.5       ?       ? 
1 1 1   39    3   25 o    635.9    2.8    0.0000   0.0000          ?        ?  4044.3962  35.1187          ?        ?      635.9        2.8       ?       ? 
1 1 1   39    3   26 o    214.2    3.3    0.0000   0.0000          ?        ?   459.0970  14.0475          ?        ?      214.2        3.3       ?       ? 
1 1 1   39    3   27 o    162.7    4.5    0.0000   0.0000          ?        ?   264.9865  14.6860          ?        ?      162.7        4.5       ?       ? 
1 1 1   39    3   28 o    426.5    2.4    0.0000   0.0000          ?        ?  1819.1481  20.4327          ?        ?      426.5        2.4       ?       ? 
1 1 1   39    3   29 o    349.2    2.5    0.0000   0.0000          ?        ?  1219.5763  17.2401          ?        ?      349.2        2.5       ?       ? 
1 1 1   39    3   30 o    806.1    3.1    0.0000   0.0000          ?        ?  6500.1504  49.8047          ?        ?      806.1        3.1       ?       ? 
1 1 1   39    3   31 o    132.7    5.3    0.0000   0.0000          ?        ?   176.2320  14.0475          ?        ?      132.7        5.3       ?       ? 
1 1 1   39    3   32 o    548.9    2.7    0.0000   0.0000          ?        ?  3013.8220  29.3720          ?        ?      548.9        2.7       ?       ? 
1 1 1   39    3   33 o    375.9    2.5    0.0000   0.0000          ?        ?  1413.0483  18.5171          ?        ?      375.9        2.5       ?       ? 
1 1 1   39    3   34 o    253.0    3.4    0.0000   0.0000          ?        ?   640.4372  17.2401          ?        ?      253.0        3.4       ?       ? 
1 1 1   39    3   35 o    595.4    2.7    0.0000   0.0000          ?        ?  3546.3494  31.9261          ?        ?      595.4        2.7       ?       ? 
1 1 1   39    3   36 o    579.1    2.6    0.0000   0.0000          ?        ?  3354.1541  30.0105          ?        ?      579.1        2.6       ?       ? 
1 1 1   39    3   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    3   38 o    293.3    2.9    0.0000   0.0000          ?        ?   860.7272  17.2401          ?        ?      293.3        2.9       ?       ? 
1 1 1   39    3   39 o    437.4    2.6    0.0000   0.0000          ?        ?  1913.6494  22.3483          ?        ?      437.4        2.6       ?       ? 
1 1 1   39    3   40 o    212.4    3.8    0.0000   0.0000          ?        ?   451.4348  15.9630          ?        ?      212.4        3.8       ?       ? 
1 1 1   39    3   41 o     55.8   14.7    0.0000   0.0000          ?        ?    32.5646  16.6016          ?        ?       55.8       14.7       ?       ? 
1 1 1   39    3   42 o     41.6   15.2    0.0000   0.0000          ?        ?    14.0475  16.6016          ?        ?       41.6       15.2       ?       ? 
1 1 1   39    3   43 o    193.0    4.3    0.0000   0.0000          ?        ?   372.8966  16.6016          ?        ?      193.0        4.3       ?       ? 
1 1 1   39    3   44 o     16.7    8.5    0.0000   0.0000          ?        ?   -54.2743  14.6860          ?        ?       16.7        8.5       ?       ? 
1 1 1   39    3   45 o    149.4    5.6    0.0000   0.0000          ?        ?   223.4826  16.6016          ?        ?      149.4        5.6       ?       ? 
1 1 1   39    3   46 o    317.9    2.9    0.0000   0.0000          ?        ?  1011.4182  18.5171          ?        ?      317.9        2.9       ?       ? 
1 1 1   39    3   47 o    176.8    4.9    0.0000   0.0000          ?        ?   312.8756  17.2401          ?        ?      176.8        4.9       ?       ? 
1 1 1   39    3   48 o    143.5    6.0    0.0000   0.0000          ?        ?   206.2425  17.2401          ?        ?      143.5        6.0       ?       ? 
1 1 1   39    3   49 o    120.5    7.2    0.0000   0.0000          ?        ?   145.5829  17.2401          ?        ?      120.5        7.2       ?       ? 
1 1 1   39    3   50 o     33.6   14.2    0.0000   0.0000          ?        ?     0.6385  16.6016          ?        ?       33.6       14.2       ?       ? 
1 1 1   39    3   51 o    269.7    3.3    0.0000   0.0000          ?        ?   727.9147  17.8786          ?        ?      269.7        3.3       ?       ? 
1 1 1   39    3   52 o    214.6    4.3    0.0000   0.0000          ?        ?   461.0126  18.5171          ?        ?      214.6        4.3       ?       ? 
1 1 1   39    3   53 o    297.9    3.4    0.0000   0.0000          ?        ?   888.1836  20.4327          ?        ?      297.9        3.4       ?       ? 
1 1 1   39    3   54 o    182.9    5.2    0.0000   0.0000          ?        ?   335.2238  19.1556          ?        ?      182.9        5.2       ?       ? 
1 1 1   39    3   55 o    372.3    3.0    0.0000   0.0000          ?        ?  1387.5076  22.3483          ?        ?      372.3        3.0       ?       ? 
1 1 1   39    3   56 o     25.1   12.2    0.0000   0.0000          ?        ?   -35.1187  19.7942          ?        ?       25.1       12.2       ?       ? 
1 1 1   39    3   57 f    595.8    2.9    0.0000   0.0000          ?        ?  3553.3728  35.1187          ?        ?      595.8        2.9       ?       ? 
1 1 1   39    3   58 o    326.2    3.4    0.0000   0.0000          ?        ?  1065.6925  22.3483          ?        ?      326.2        3.4       ?       ? 
1 1 1   39    3   59 o    161.2    6.3    0.0000   0.0000          ?        ?   261.1554  20.4327          ?        ?      161.2        6.3       ?       ? 
1 1 1   39    3   60 o    319.0    3.4    0.0000   0.0000          ?        ?  1019.0806  21.7097          ?        ?      319.0        3.4       ?       ? 
1 1 1   39    3   61 o     93.8   10.5    0.0000   0.0000          ?        ?    89.3930  19.7942          ?        ?       93.8       10.5       ?       ? 
1 1 1   39    3   62 o    153.8    6.6    0.0000   0.0000          ?        ?   238.1686  20.4327          ?        ?      153.8        6.6       ?       ? 
1 1 1   39    3   63 o    131.6    8.0    0.0000   0.0000          ?        ?   174.9549  21.0712          ?        ?      131.6        8.0       ?       ? 
1 1 1   39    3   64 o    109.7    8.4    0.0000   0.0000          ?        ?   121.9576  18.5171          ?        ?      109.7        8.4       ?       ? 
1 1 1   39    3   65 o     67.5   14.6    0.0000   0.0000          ?        ?    49.1662  19.1556          ?        ?       67.5       14.6       ?       ? 
1 1 1   39    4    0 o    130.3    6.7  171.1238  17.2401   171.1238  17.2401   171.1238  17.2401      130.3      6.7      130.3        6.7     0.0     0.0 
1 1 1   39    4    1 o    945.6    3.6    0.0000   0.0000          ?        ?  8941.8574  67.6833          ?        ?      945.6        3.6       ?       ? 
1 1 1   39    4    2 o    388.6    2.5    0.0000   0.0000          ?        ?  1510.1036  19.7942          ?        ?      388.6        2.5       ?       ? 
1 1 1   39    4    3 o    433.6    2.4    0.0000   0.0000          ?        ?  1880.4462  21.0712          ?        ?      433.6        2.4       ?       ? 
1 1 1   39    4    4 o    600.6    2.9    0.0000   0.0000          ?        ?  3607.0088  34.4802          ?        ?      600.6        2.9       ?       ? 
1 1 1   39    4    5 o   1227.2    4.4    0.0000   0.0000          ?        ? 15064.0020 107.2716          ?        ?     1227.2        4.4       ?       ? 
1 1 1   39    4    6 o     56.0   11.2    0.0000   0.0000          ?        ?    32.5646  12.1319          ?        ?       56.0       11.2       ?       ? 
1 1 1   39    4    7 o    550.6    2.6    0.0000   0.0000          ?        ?  3031.7007  28.0950          ?        ?      550.6        2.6       ?       ? 
1 1 1   39    4    8 o    407.0    2.5    0.0000   0.0000          ?        ?  1656.9636  20.4327          ?        ?      407.0        2.5       ?       ? 
1 1 1   39    4    9 o    518.1    2.6    0.0000   0.0000          ?        ?  2684.3450  26.8179          ?        ?      518.1        2.6       ?       ? 
1 1 1   39    4   10 o    253.2    2.6    0.0000   0.0000          ?        ?   641.0757  13.4090          ?        ?      253.2        2.6       ?       ? 
1 1 1   39    4   11 o    911.3    3.5    0.0000   0.0000          ?        ?  8305.2500  63.2136          ?        ?      911.3        3.5       ?       ? 
1 1 1   39    4   12 o    116.9    6.3    0.0000   0.0000          ?        ?   136.6436  14.6860          ?        ?      116.9        6.3       ?       ? 
1 1 1   39    4   13 o    363.6    2.5    0.0000   0.0000          ?        ?  1322.3783  18.5171          ?        ?      363.6        2.5       ?       ? 
1 1 1   39    4   14 o    316.0    2.5    0.0000   0.0000          ?        ?   998.6478  15.9630          ?        ?      316.0        2.5       ?       ? 
1 1 1   39    4   15 o    854.5    3.4    0.0000   0.0000          ?        ?  7302.7715  57.4669          ?        ?      854.5        3.4       ?       ? 
1 1 1   39    4   16 o    642.0    2.8    0.0000   0.0000          ?        ?  4121.6572  35.7572          ?        ?      642.0        2.8       ?       ? 
1 1 1   39    4   17 o    152.2    4.2    0.0000   0.0000          ?        ?   231.7833  12.7704          ?        ?      152.2        4.2       ?       ? 
1 1 1   39    4   18 o    742.4    3.1    0.0000   0.0000          ?        ?  5511.7188  46.6121          ?        ?      742.4        3.1       ?       ? 
1 1 1   39    4   19 o    731.0    3.0    0.0000   0.0000          ?        ?  5343.7876  43.4195          ?        ?      731.0        3.0       ?       ? 
1 1 1   39    4   20 o    383.4    2.5    0.0000   0.0000          ?        ?  1469.8767  19.1556          ?        ?      383.4        2.5       ?       ? 
1 1 1   39    4   21 o    599.6    2.8    0.0000   0.0000          ?        ?  3595.5151  33.2031          ?        ?      599.6        2.8       ?       ? 
1 1 1   39    4   22 o    436.3    2.4    0.0000   0.0000          ?        ?  1903.4330  21.0712          ?        ?      436.3        2.4       ?       ? 
1 1 1   39    4   23 o    345.6    2.5    0.0000   0.0000          ?        ?  1194.6740  17.2401          ?        ?      345.6        2.5       ?       ? 
1 1 1   39    4   24 o    161.8    4.3    0.0000   0.0000          ?        ?   261.7939  14.0475          ?        ?      161.8        4.3       ?       ? 
1 1 1   39    4   25 o    271.8    2.9    0.0000   0.0000          ?        ?   738.7695  15.9630          ?        ?      271.8        2.9       ?       ? 
1 1 1   39    4   26 f    279.0    2.9    0.0000   0.0000          ?        ?   778.3578  15.9630          ?        ?      279.0        2.9       ?       ? 
1 1 1   39    4   27 o    464.5    2.5    0.0000   0.0000          ?        ?  2158.2031  22.9868          ?        ?      464.5        2.5       ?       ? 
1 1 1   39    4   28 o    186.0    3.9    0.0000   0.0000          ?        ?   346.0787  14.6860          ?        ?      186.0        3.9       ?       ? 
1 1 1   39    4   29 o    368.6    2.5    0.0000   0.0000          ?        ?  1358.7740  18.5171          ?        ?      368.6        2.5       ?       ? 
1 1 1   39    4   30 o    322.8    2.9    0.0000   0.0000          ?        ?  1042.0673  18.5171          ?        ?      322.8        2.9       ?       ? 
1 1 1   39    4   31 o    456.4    2.5    0.0000   0.0000          ?        ?  2083.4961  22.9868          ?        ?      456.4        2.5       ?       ? 
1 1 1   39    4   32 o    201.9    4.0    0.0000   0.0000          ?        ?   408.0153  15.9630          ?        ?      201.9        4.0       ?       ? 
1 1 1   39    4   33 o    339.7    2.7    0.0000   0.0000          ?        ?  1154.4471  18.5171          ?        ?      339.7        2.7       ?       ? 
1 1 1   39    4   34 o    580.2    2.6    0.0000   0.0000          ?        ?  3367.5632  30.0105          ?        ?      580.2        2.6       ?       ? 
1 1 1   39    4   35 o    500.2    2.6    0.0000   0.0000          ?        ?  2503.0049  25.5409          ?        ?      500.2        2.6       ?       ? 
1 1 1   39    4   36 f    398.6    2.6    0.0000   0.0000          ?        ?  1589.2803  20.4327          ?        ?      398.6        2.6       ?       ? 
1 1 1   39    4   37 o    101.9    7.5    0.0000   0.0000          ?        ?   104.0790  15.3245          ?        ?      101.9        7.5       ?       ? 
1 1 1   39    4   38 o    240.2    3.3    0.0000   0.0000          ?        ?   577.2236  15.9630          ?        ?      240.2        3.3       ?       ? 
1 1 1   39    4   39 o    478.3    2.5    0.0000   0.0000          ?        ?  2288.4614  24.2638          ?        ?      478.3        2.5       ?       ? 
1 1 1   39    4   40 o    349.4    2.7    0.0000   0.0000          ?        ?  1220.8533  19.1556          ?        ?      349.4        2.7       ?       ? 
1 1 1   39    4   41 o    274.7    3.3    0.0000   0.0000          ?        ?   754.7325  17.8786          ?        ?      274.7        3.3       ?       ? 
1 1 1   39    4   42 o    163.3    4.9    0.0000   0.0000          ?        ?   266.9020  15.9630          ?        ?      163.3        4.9       ?       ? 
1 1 1   39    4   43 o    312.7    2.9    0.0000   0.0000          ?        ?   978.2151  17.8786          ?        ?      312.7        2.9       ?       ? 
1 1 1   39    4   44 o     28.6   13.0    0.0000   0.0000          ?        ?    -8.9393  15.9630          ?        ?       28.6       13.0       ?       ? 
1 1 1   39    4   45 o    378.8    2.7    0.0000   0.0000          ?        ?  1435.3966  20.4327          ?        ?      378.8        2.7       ?       ? 
1 1 1   39    4   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    4   47 o    129.9    6.9    0.0000   0.0000          ?        ?   169.2082  17.8786          ?        ?      129.9        6.9       ?       ? 
1 1 1   39    4   48 o    265.2    3.5    0.0000   0.0000          ?        ?   703.6508  18.5171          ?        ?      265.2        3.5       ?       ? 
1 1 1   39    4   49 o    245.3    3.6    0.0000   0.0000          ?        ?   602.1259  17.8786          ?        ?      245.3        3.6       ?       ? 
1 1 1   39    4   50 o     22.3   11.0    0.0000   0.0000          ?        ?   -39.5883  17.8786          ?        ?       22.3       11.0       ?       ? 
1 1 1   39    4   51 o    350.4    3.0    0.0000   0.0000          ?        ?  1228.5156  21.0712          ?        ?      350.4        3.0       ?       ? 
1 1 1   39    4   52 o    349.2    3.0    0.0000   0.0000          ?        ?  1220.2148  21.0712          ?        ?      349.2        3.0       ?       ? 
1 1 1   39    4   53 o    108.7    8.2    0.0000   0.0000          ?        ?   118.7650  17.8786          ?        ?      108.7        8.2       ?       ? 
1 1 1   39    4   54 o     99.8    9.3    0.0000   0.0000          ?        ?   100.2479  18.5171          ?        ?       99.8        9.3       ?       ? 
1 1 1   39    4   55 o     31.7   14.2    0.0000   0.0000          ?        ?    -7.6623  18.5171          ?        ?       31.7       14.2       ?       ? 
1 1 1   39    4   56 o    162.1    5.7    0.0000   0.0000          ?        ?   263.7094  18.5171          ?        ?      162.1        5.7       ?       ? 
1 1 1   39    4   57 f     34.7   14.9    0.0000   0.0000          ?        ?    -0.6385  18.5171          ?        ?       34.7       14.9       ?       ? 
1 1 1   39    4   58 o     21.7   10.8    0.0000   0.0000          ?        ?   -46.6121  18.5171          ?        ?       21.7       10.8       ?       ? 
1 1 1   39    4   59 o     57.6   16.7    0.0000   0.0000          ?        ?    35.1187  20.4327          ?        ?       57.6       16.7       ?       ? 
1 1 1   39    4   60 o    266.7    3.8    0.0000   0.0000          ?        ?   712.5901  20.4327          ?        ?      266.7        3.8       ?       ? 
1 1 1   39    4   61 o     21.4   10.7    0.0000   0.0000          ?        ?   -56.1899  19.7942          ?        ?       21.4       10.7       ?       ? 
1 1 1   39    4   62 o     67.2   15.1    0.0000   0.0000          ?        ?    48.5276  19.7942          ?        ?       67.2       15.1       ?       ? 
1 1 1   39    4   63 o    142.2    6.7    0.0000   0.0000          ?        ?   203.6884  19.1556          ?        ?      142.2        6.7       ?       ? 
1 1 1   39    4   64 o     49.3   16.8    0.0000   0.0000          ?        ?    24.2638  19.7942          ?        ?       49.3       16.8       ?       ? 
1 1 1   39    4   65 o     24.0   11.8    0.0000   0.0000          ?        ?   -36.3957  19.1556          ?        ?       24.0       11.8       ?       ? 
1 1 1   39    5    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    5    1 o    459.2    2.6    0.0000   0.0000          ?        ?  2109.0369  23.6253          ?        ?      459.2        2.6       ?       ? 
1 1 1   39    5    2 o    977.6    3.9    0.0000   0.0000          ?        ?  9559.3066  75.3456          ?        ?      977.6        3.9       ?       ? 
1 1 1   39    5    3 o    532.4    2.8    0.0000   0.0000          ?        ?  2834.3975  30.0105          ?        ?      532.4        2.8       ?       ? 
1 1 1   39    5    4 o    501.1    2.6    0.0000   0.0000          ?        ?  2511.3054  26.1794          ?        ?      501.1        2.6       ?       ? 
1 1 1   39    5    5 o    588.8    2.8    0.0000   0.0000          ?        ?  3467.1724  32.5646          ?        ?      588.8        2.8       ?       ? 
1 1 1   39    5    6 o    186.7    3.1    0.0000   0.0000          ?        ?   348.6328  11.4934          ?        ?      186.7        3.1       ?       ? 
1 1 1   39    5    7 o    620.5    2.7    0.0000   0.0000          ?        ?  3850.9238  33.8416          ?        ?      620.5        2.7       ?       ? 
1 1 1   39    5    8 o    680.9    3.0    0.0000   0.0000          ?        ?  4636.3052  40.2269          ?        ?      680.9        3.0       ?       ? 
1 1 1   39    5    9 o     63.9    8.5    0.0000   0.0000          ?        ?    40.8654  10.8549          ?        ?       63.9        8.5       ?       ? 
1 1 1   39    5   10 o    491.7    2.5    0.0000   0.0000          ?        ?  2417.4429  24.2638          ?        ?      491.7        2.5       ?       ? 
1 1 1   39    5   11 f    839.7    3.2    0.0000   0.0000          ?        ?  7051.1948  54.2743          ?        ?      839.7        3.2       ?       ? 
1 1 1   39    5   12 o    245.2    2.7    0.0000   0.0000          ?        ?   601.4874  13.4090          ?        ?      245.2        2.7       ?       ? 
1 1 1   39    5   13 o    633.8    2.7    0.0000   0.0000          ?        ?  4016.9395  34.4802          ?        ?      633.8        2.7       ?       ? 
1 1 1   39    5   14 o    321.2    2.7    0.0000   0.0000          ?        ?  1031.8510  17.2401          ?        ?      321.2        2.7       ?       ? 
1 1 1   39    5   15 o    337.8    2.5    0.0000   0.0000          ?        ?  1141.0381  16.6016          ?        ?      337.8        2.5       ?       ? 
1 1 1   39    5   16 o    535.6    2.6    0.0000   0.0000          ?        ?  2868.8777  27.4564          ?        ?      535.6        2.6       ?       ? 
1 1 1   39    5   17 f    249.2    2.9    0.0000   0.0000          ?        ?   621.2816  14.6860          ?        ?      249.2        2.9       ?       ? 
1 1 1   39    5   18 o    704.1    2.9    0.0000   0.0000          ?        ?  4958.1206  40.2269          ?        ?      704.1        2.9       ?       ? 
1 1 1   39    5   19 o    639.4    2.7    0.0000   0.0000          ?        ?  4089.0928  35.1187          ?        ?      639.4        2.7       ?       ? 
1 1 1   39    5   20 o    141.8    4.5    0.0000   0.0000          ?        ?   201.1343  12.7704          ?        ?      141.8        4.5       ?       ? 
1 1 1   39    5   21 o    127.3    5.3    0.0000   0.0000          ?        ?   162.1845  13.4090          ?        ?      127.3        5.3       ?       ? 
1 1 1   39    5   22 o    443.2    2.4    0.0000   0.0000          ?        ?  1964.0925  21.7097          ?        ?      443.2        2.4       ?       ? 
1 1 1   39    5   23 o    219.1    3.2    0.0000   0.0000          ?        ?   480.1682  14.0475          ?        ?      219.1        3.2       ?       ? 
1 1 1   39    5   24 o    861.3    3.4    0.0000   0.0000          ?        ?  7420.2598  58.1055          ?        ?      861.3        3.4       ?       ? 
1 1 1   39    5   25 o    304.3    2.5    0.0000   0.0000          ?        ?   925.8564  15.3245          ?        ?      304.3        2.5       ?       ? 
1 1 1   39    5   26 o    507.6    2.6    0.0000   0.0000          ?        ?  2577.0732  26.1794          ?        ?      507.6        2.6       ?       ? 
1 1 1   39    5   27 o    220.0    3.3    0.0000   0.0000          ?        ?   483.9994  14.6860          ?        ?      220.0        3.3       ?       ? 
1 1 1   39    5   28 o     67.7    9.9    0.0000   0.0000          ?        ?    45.9736  13.4090          ?        ?       67.7        9.9       ?       ? 
1 1 1   39    5   29 o     20.2   10.0    0.0000   0.0000          ?        ?   -29.3720  14.0475          ?        ?       20.2       10.0       ?       ? 
1 1 1   39    5   30 o    173.7    4.0    0.0000   0.0000          ?        ?   302.0207  14.0475          ?        ?      173.7        4.0       ?       ? 
1 1 1   39    5   31 o    695.6    2.9    0.0000   0.0000          ?        ?  4839.9941  40.2269          ?        ?      695.6        2.9       ?       ? 
1 1 1   39    5   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    5   33 o    232.8    3.6    0.0000   0.0000          ?        ?   542.1049  16.6016          ?        ?      232.8        3.6       ?       ? 
1 1 1   39    5   34 o    295.5    2.9    0.0000   0.0000          ?        ?   873.4976  17.2401          ?        ?      295.5        2.9       ?       ? 
1 1 1   39    5   35 o    434.5    2.5    0.0000   0.0000          ?        ?  1888.1085  21.7097          ?        ?      434.5        2.5       ?       ? 
1 1 1   39    5   36 o    291.2    3.0    0.0000   0.0000          ?        ?   847.9567  17.2401          ?        ?      291.2        3.0       ?       ? 
1 1 1   39    5   37 o    302.8    2.8    0.0000   0.0000          ?        ?   916.9171  17.2401          ?        ?      302.8        2.8       ?       ? 
1 1 1   39    5   38 o    548.4    2.6    0.0000   0.0000          ?        ?  3008.7139  28.0950          ?        ?      548.4        2.6       ?       ? 
1 1 1   39    5   39 o    302.6    2.8    0.0000   0.0000          ?        ?   916.2786  17.2401          ?        ?      302.6        2.8       ?       ? 
1 1 1   39    5   40 o    237.2    3.5    0.0000   0.0000          ?        ?   563.1760  16.6016          ?        ?      237.2        3.5       ?       ? 
1 1 1   39    5   41 o    224.2    3.7    0.0000   0.0000          ?        ?   503.1551  16.6016          ?        ?      224.2        3.7       ?       ? 
1 1 1   39    5   42 o     20.6   10.2    0.0000   0.0000          ?        ?   -34.4802  15.3245          ?        ?       20.6       10.2       ?       ? 
1 1 1   39    5   43 o     22.3   10.8    0.0000   0.0000          ?        ?   -26.8179  15.3245          ?        ?       22.3       10.8       ?       ? 
1 1 1   39    5   44 o    152.1    5.2    0.0000   0.0000          ?        ?   231.7833  15.9630          ?        ?      152.1        5.2       ?       ? 
1 1 1   39    5   45 o     48.5   15.3    0.0000   0.0000          ?        ?    23.6253  16.6016          ?        ?       48.5       15.3       ?       ? 
1 1 1   39    5   46 o    642.6    2.8    0.0000   0.0000          ?        ?  4131.8730  36.3957          ?        ?      642.6        2.8       ?       ? 
1 1 1   39    5   47 o     21.7   10.7    0.0000   0.0000          ?        ?   -39.5883  17.2401          ?        ?       21.7       10.7       ?       ? 
1 1 1   39    5   48 o    322.0    3.1    0.0000   0.0000          ?        ?  1037.5977  19.7942          ?        ?      322.0        3.1       ?       ? 
1 1 1   39    5   49 o    342.6    3.0    0.0000   0.0000          ?        ?  1174.2412  20.4327          ?        ?      342.6        3.0       ?       ? 
1 1 1   39    5   50 o    228.3    4.1    0.0000   0.0000          ?        ?   521.6721  18.5171          ?        ?      228.3        4.1       ?       ? 
1 1 1   39    5   51 o    140.0    6.6    0.0000   0.0000          ?        ?   196.6647  18.5171          ?        ?      140.0        6.6       ?       ? 
1 1 1   39    5   52 o    170.1    5.4    0.0000   0.0000          ?        ?   289.8888  18.5171          ?        ?      170.1        5.4       ?       ? 
1 1 1   39    5   53 o     76.7   11.2    0.0000   0.0000          ?        ?    59.3825  17.2401          ?        ?       76.7       11.2       ?       ? 
1 1 1   39    5   54 o    241.0    4.0    0.0000   0.0000          ?        ?   581.6932  19.1556          ?        ?      241.0        4.0       ?       ? 
1 1 1   39    5   55 o     26.1   12.5    0.0000   0.0000          ?        ?   -28.0950  19.1556          ?        ?       26.1       12.5       ?       ? 
1 1 1   39    5   56 o    102.8    9.3    0.0000   0.0000          ?        ?   106.6331  19.1556          ?        ?      102.8        9.3       ?       ? 
1 1 1   39    5   57 o     31.1   14.2    0.0000   0.0000          ?        ?   -12.7704  19.7942          ?        ?       31.1       14.2       ?       ? 
1 1 1   39    5   58 o    227.0    4.2    0.0000   0.0000          ?        ?   516.5640  19.1556          ?        ?      227.0        4.2       ?       ? 
1 1 1   39    5   59 o    231.5    4.3    0.0000   0.0000          ?        ?   536.9967  19.7942          ?        ?      231.5        4.3       ?       ? 
1 1 1   39    5   60 o    317.4    3.4    0.0000   0.0000          ?        ?  1008.8642  21.7097          ?        ?      317.4        3.4       ?       ? 
1 1 1   39    5   61 o    258.0    4.0    0.0000   0.0000          ?        ?   667.2551  20.4327          ?        ?      258.0        4.0       ?       ? 
1 1 1   39    5   62 o     23.9   11.7    0.0000   0.0000          ?        ?   -40.8654  19.7942          ?        ?       23.9       11.7       ?       ? 
1 1 1   39    5   63 o     90.1   11.0    0.0000   0.0000          ?        ?    83.0078  19.7942          ?        ?       90.1       11.0       ?       ? 
1 1 1   39    5   64 o    112.7    8.5    0.0000   0.0000          ?        ?   128.9814  19.1556          ?        ?      112.7        8.5       ?       ? 
1 1 1   39    6    0 o    382.2    3.3 1460.9375  25.5409  1460.9375  25.5409  1460.9375  25.5409      382.2      3.3      382.2        3.3     0.0     0.0 
1 1 1   39    6    1 o    223.3    2.9    0.0000   0.0000          ?        ?   498.6854  12.7704          ?        ?      223.3        2.9       ?       ? 
1 1 1   39    6    2 o    492.3    2.5    0.0000   0.0000          ?        ?  2423.8281  24.9023          ?        ?      492.3        2.5       ?       ? 
1 1 1   39    6    3 o    192.3    3.3    0.0000   0.0000          ?        ?   369.7040  12.7704          ?        ?      192.3        3.3       ?       ? 
1 1 1   39    6    4 o    149.7    4.3    0.0000   0.0000          ?        ?   224.1211  12.7704          ?        ?      149.7        4.3       ?       ? 
1 1 1   39    6    5 o    817.5    3.3    0.0000   0.0000          ?        ?  6684.0449  53.6358          ?        ?      817.5        3.3       ?       ? 
1 1 1   39    6    6 o     29.5   12.1    0.0000   0.0000          ?        ?     2.5541  11.4934          ?        ?       29.5       12.1       ?       ? 
1 1 1   39    6    7 o    440.0    2.4    0.0000   0.0000          ?        ?  1935.9977  21.0712          ?        ?      440.0        2.4       ?       ? 
1 1 1   39    6    8 o    626.5    2.8    0.0000   0.0000          ?        ?  3925.6309  34.4802          ?        ?      626.5        2.8       ?       ? 
1 1 1   39    6    9 o     81.5    6.7    0.0000   0.0000          ?        ?    66.4062  10.8549          ?        ?       81.5        6.7       ?       ? 
1 1 1   39    6   10 o    202.1    3.0    0.0000   0.0000          ?        ?   408.6538  12.1319          ?        ?      202.1        3.0       ?       ? 
1 1 1   39    6   11 o    182.7    3.3    0.0000   0.0000          ?        ?   333.9468  12.1319          ?        ?      182.7        3.3       ?       ? 
1 1 1   39    6   12 o    481.9    2.4    0.0000   0.0000          ?        ?  2322.3032  22.9868          ?        ?      481.9        2.4       ?       ? 
1 1 1   39    6   13 o    487.1    2.4    0.0000   0.0000          ?        ?  2372.7463  23.6253          ?        ?      487.1        2.4       ?       ? 
1 1 1   39    6   14 o    148.2    4.3    0.0000   0.0000          ?        ?   219.6514  12.7704          ?        ?      148.2        4.3       ?       ? 
1 1 1   39    6   15 o    729.2    3.1    0.0000   0.0000          ?        ?  5318.2466  44.6965          ?        ?      729.2        3.1       ?       ? 
1 1 1   39    6   16 o    473.9    2.4    0.0000   0.0000          ?        ?  2246.3191  22.9868          ?        ?      473.9        2.4       ?       ? 
1 1 1   39    6   17 f    583.1    2.6    0.0000   0.0000          ?        ?  3400.7661  30.0105          ?        ?      583.1        2.6       ?       ? 
1 1 1   39    6   18 o    312.2    2.8    0.0000   0.0000          ?        ?   975.0225  17.2401          ?        ?      312.2        2.8       ?       ? 
1 1 1   39    6   19 o   1000.8    3.8    0.0000   0.0000          ?        ? 10019.0430  75.3456          ?        ?     1000.8        3.8       ?       ? 
1 1 1   39    6   20 f    784.6    3.1    0.0000   0.0000          ?        ?  6156.6255  49.1662          ?        ?      784.6        3.1       ?       ? 
1 1 1   39    6   21 o    141.1    4.5    0.0000   0.0000          ?        ?   199.2188  12.7704          ?        ?      141.1        4.5       ?       ? 
1 1 1   39    6   22 o    221.9    3.3    0.0000   0.0000          ?        ?   492.3002  14.6860          ?        ?      221.9        3.3       ?       ? 
1 1 1   39    6   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    6   24 o    753.5    2.9    0.0000   0.0000          ?        ?  5678.3726  44.0580          ?        ?      753.5        2.9       ?       ? 
1 1 1   39    6   25 f    215.0    3.3    0.0000   0.0000          ?        ?   462.2897  14.0475          ?        ?      215.0        3.3       ?       ? 
1 1 1   39    6   26 o    527.5    2.5    0.0000   0.0000          ?        ?  2782.6772  26.8179          ?        ?      527.5        2.5       ?       ? 
1 1 1   39    6   27 o    303.0    2.6    0.0000   0.0000          ?        ?   918.1941  15.9630          ?        ?      303.0        2.6       ?       ? 
1 1 1   39    6   28 o    535.6    2.6    0.0000   0.0000          ?        ?  2868.8777  28.0950          ?        ?      535.6        2.6       ?       ? 
1 1 1   39    6   29 o    607.4    2.6    0.0000   0.0000          ?        ?  3690.6550  31.9261          ?        ?      607.4        2.6       ?       ? 
1 1 1   39    6   30 o    369.1    2.5    0.0000   0.0000          ?        ?  1362.6051  18.5171          ?        ?      369.1        2.5       ?       ? 
1 1 1   39    6   31 o     72.7    9.7    0.0000   0.0000          ?        ?    52.9973  14.0475          ?        ?       72.7        9.7       ?       ? 
1 1 1   39    6   32 o     53.1   14.2    0.0000   0.0000          ?        ?    29.3720  15.3245          ?        ?       53.1       14.2       ?       ? 
1 1 1   39    6   33 o    514.2    2.6    0.0000   0.0000          ?        ?  2644.7566  26.8179          ?        ?      514.2        2.6       ?       ? 
1 1 1   39    6   34 o    529.0    2.5    0.0000   0.0000          ?        ?  2799.2788  26.8179          ?        ?      529.0        2.5       ?       ? 
1 1 1   39    6   35 o     43.6   14.1    0.0000   0.0000          ?        ?    18.5171  14.0475          ?        ?       43.6       14.1       ?       ? 
1 1 1   39    6   36 o    364.2    2.7    0.0000   0.0000          ?        ?  1326.8479  19.7942          ?        ?      364.2        2.7       ?       ? 
1 1 1   39    6   37 f    436.7    2.5    0.0000   0.0000          ?        ?  1907.2642  21.7097          ?        ?      436.7        2.5       ?       ? 
1 1 1   39    6   38 o    439.5    2.6    0.0000   0.0000          ?        ?  1932.1665  22.9868          ?        ?      439.5        2.6       ?       ? 
1 1 1   39    6   39 o    147.9    5.6    0.0000   0.0000          ?        ?   219.0129  16.6016          ?        ?      147.9        5.6       ?       ? 
1 1 1   39    6   40 o    252.0    3.4    0.0000   0.0000          ?        ?   635.3290  17.2401          ?        ?      252.0        3.4       ?       ? 
1 1 1   39    6   41 o    154.2    5.0    0.0000   0.0000          ?        ?   238.1686  15.3245          ?        ?      154.2        5.0       ?       ? 
1 1 1   39    6   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    6   43 o     89.9    8.5    0.0000   0.0000          ?        ?    81.0922  15.3245          ?        ?       89.9        8.5       ?       ? 
1 1 1   39    6   44 o    205.2    4.0    0.0000   0.0000          ?        ?   421.4243  16.6016          ?        ?      205.2        4.0       ?       ? 
1 1 1   39    6   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    6   46 o    289.9    3.2    0.0000   0.0000          ?        ?   840.9330  18.5171          ?        ?      289.9        3.2       ?       ? 
1 1 1   39    6   47 o    240.9    3.7    0.0000   0.0000          ?        ?   581.0547  17.8786          ?        ?      240.9        3.7       ?       ? 
1 1 1   39    6   48 o    251.3    3.8    0.0000   0.0000          ?        ?   632.1364  19.1556          ?        ?      251.3        3.8       ?       ? 
1 1 1   39    6   49 o     33.3   14.5    0.0000   0.0000          ?        ?    -2.5541  17.8786          ?        ?       33.3       14.5       ?       ? 
1 1 1   39    6   50 o     98.9    9.0    0.0000   0.0000          ?        ?    98.3323  17.8786          ?        ?       98.9        9.0       ?       ? 
1 1 1   39    6   51 o    152.2    6.1    0.0000   0.0000          ?        ?   232.4219  18.5171          ?        ?      152.2        6.1       ?       ? 
1 1 1   39    6   52 o     74.1   12.1    0.0000   0.0000          ?        ?    55.5514  17.8786          ?        ?       74.1       12.1       ?       ? 
1 1 1   39    6   53 o     48.9   15.9    0.0000   0.0000          ?        ?    23.6253  17.8786          ?        ?       48.9       15.9       ?       ? 
1 1 1   39    6   54 o     20.1   10.1    0.0000   0.0000          ?        ?   -52.9973  17.8786          ?        ?       20.1       10.1       ?       ? 
1 1 1   39    6   55 o    148.8    6.4    0.0000   0.0000          ?        ?   222.2055  19.1556          ?        ?      148.8        6.4       ?       ? 
1 1 1   39    6   56 o     60.5   15.3    0.0000   0.0000          ?        ?    38.9498  18.5171          ?        ?       60.5       15.3       ?       ? 
1 1 1   39    6   57 o     32.2   14.3    0.0000   0.0000          ?        ?    -6.3852  18.5171          ?        ?       32.2       14.3       ?       ? 
1 1 1   39    6   58 o    103.3    9.6    0.0000   0.0000          ?        ?   107.9102  19.7942          ?        ?      103.3        9.6       ?       ? 
1 1 1   39    6   59 o    117.5    7.9    0.0000   0.0000          ?        ?   139.1977  18.5171          ?        ?      117.5        7.9       ?       ? 
1 1 1   39    6   60 o    164.9    5.8    0.0000   0.0000          ?        ?   273.2873  19.1556          ?        ?      164.9        5.8       ?       ? 
1 1 1   39    6   61 o    157.1    6.3    0.0000   0.0000          ?        ?   248.3849  19.7942          ?        ?      157.1        6.3       ?       ? 
1 1 1   39    6   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    6   63 o     42.5   16.2    0.0000   0.0000          ?        ?    14.0475  19.1556          ?        ?       42.5       16.2       ?       ? 
1 1 1   39    7    0 f    354.7    3.3 1258.5261  23.6253  1258.5261  23.6253  1258.5261  23.6253      354.7      3.3      354.7        3.3     0.0     0.0 
1 1 1   39    7    1 o    315.1    2.4    0.0000   0.0000          ?        ?   992.9011  15.3245          ?        ?      315.1        2.4       ?       ? 
1 1 1   39    7    2 o    251.9    2.7    0.0000   0.0000          ?        ?   634.6905  13.4090          ?        ?      251.9        2.7       ?       ? 
1 1 1   39    7    3 o    967.4    3.6    0.0000   0.0000          ?        ?  9360.0889  69.5989          ?        ?      967.4        3.6       ?       ? 
1 1 1   39    7    4 o    214.8    3.0    0.0000   0.0000          ?        ?   461.6512  12.7704          ?        ?      214.8        3.0       ?       ? 
1 1 1   39    7    5 o    471.6    2.6    0.0000   0.0000          ?        ?  2224.6094  24.2638          ?        ?      471.6        2.6       ?       ? 
1 1 1   39    7    6 o   1142.4    4.3    0.0000   0.0000          ?        ? 13055.2129  97.6938          ?        ?     1142.4        4.3       ?       ? 
1 1 1   39    7    7 f    362.3    2.6    0.0000   0.0000          ?        ?  1312.8005  18.5171          ?        ?      362.3        2.6       ?       ? 
1 1 1   39    7    8 o    299.4    2.5    0.0000   0.0000          ?        ?   896.4843  14.6860          ?        ?      299.4        2.5       ?       ? 
1 1 1   39    7    9 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    7   10 o    339.0    2.4    0.0000   0.0000          ?        ?  1149.3389  15.9630          ?        ?      339.0        2.4       ?       ? 
1 1 1   39    7   11 o    156.4    3.7    0.0000   0.0000          ?        ?   244.5538  11.4934          ?        ?      156.4        3.7       ?       ? 
1 1 1   39    7   12 o    419.6    2.4    0.0000   0.0000          ?        ?  1761.0426  19.7942          ?        ?      419.6        2.4       ?       ? 
1 1 1   39    7   13 f    339.4    2.4    0.0000   0.0000          ?        ?  1151.8929  16.6016          ?        ?      339.4        2.4       ?       ? 
1 1 1   39    7   14 o    185.0    3.5    0.0000   0.0000          ?        ?   342.2476  12.7704          ?        ?      185.0        3.5       ?       ? 
1 1 1   39    7   15 o    932.5    3.4    0.0000   0.0000          ?        ?  8697.9414  63.8522          ?        ?      932.5        3.4       ?       ? 
1 1 1   39    7   16 o    379.7    2.5    0.0000   0.0000          ?        ?  1441.7819  19.1556          ?        ?      379.7        2.5       ?       ? 
1 1 1   39    7   17 o    393.8    2.5    0.0000   0.0000          ?        ?  1550.9690  19.7942          ?        ?      393.8        2.5       ?       ? 
1 1 1   39    7   18 o    269.5    2.6    0.0000   0.0000          ?        ?   726.6376  14.0475          ?        ?      269.5        2.6       ?       ? 
1 1 1   39    7   19 o    182.0    3.5    0.0000   0.0000          ?        ?   331.3927  12.7704          ?        ?      182.0        3.5       ?       ? 
1 1 1   39    7   20 o    257.3    2.9    0.0000   0.0000          ?        ?   662.1469  14.6860          ?        ?      257.3        2.9       ?       ? 
1 1 1   39    7   21 o    530.8    2.6    0.0000   0.0000          ?        ?  2818.4343  27.4564          ?        ?      530.8        2.6       ?       ? 
1 1 1   39    7   22 o   1030.6    3.8    0.0000   0.0000          ?        ? 10625.0000  77.8996          ?        ?     1030.6        3.8       ?       ? 
1 1 1   39    7   23 o     90.3    7.1    0.0000   0.0000          ?        ?    81.7308  12.7704          ?        ?       90.3        7.1       ?       ? 
1 1 1   39    7   24 o    209.9    3.3    0.0000   0.0000          ?        ?   440.5799  14.0475          ?        ?      209.9        3.3       ?       ? 
1 1 1   39    7   25 o    111.5    5.7    0.0000   0.0000          ?        ?   124.5117  12.7704          ?        ?      111.5        5.7       ?       ? 
1 1 1   39    7   26 o    266.6    2.9    0.0000   0.0000          ?        ?   710.6746  15.3245          ?        ?      266.6        2.9       ?       ? 
1 1 1   39    7   27 o    228.5    3.4    0.0000   0.0000          ?        ?   522.3107  15.3245          ?        ?      228.5        3.4       ?       ? 
1 1 1   39    7   28 o    520.2    2.7    0.0000   0.0000          ?        ?  2706.6931  28.0950          ?        ?      520.2        2.7       ?       ? 
1 1 1   39    7   29 o    418.5    2.6    0.0000   0.0000          ?        ?  1752.1033  21.7097          ?        ?      418.5        2.6       ?       ? 
1 1 1   39    7   30 o     18.3    9.2    0.0000   0.0000          ?        ?   -43.4195  14.6860          ?        ?       18.3        9.2       ?       ? 
1 1 1   39    7   31 o    233.6    3.3    0.0000   0.0000          ?        ?   545.9360  15.3245          ?        ?      233.6        3.3       ?       ? 
1 1 1   39    7   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    7   33 o    262.0    3.0    0.0000   0.0000          ?        ?   686.4108  15.9630          ?        ?      262.0        3.0       ?       ? 
1 1 1   39    7   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    7   35 o    561.8    2.6    0.0000   0.0000          ?        ?  3156.8508  29.3720          ?        ?      561.8        2.6       ?       ? 
1 1 1   39    7   36 o    223.7    3.6    0.0000   0.0000          ?        ?   500.6010  15.9630          ?        ?      223.7        3.6       ?       ? 
1 1 1   39    7   37 o    483.4    2.5    0.0000   0.0000          ?        ?  2336.9893  24.2638          ?        ?      483.4        2.5       ?       ? 
1 1 1   39    7   38 o    454.7    2.6    0.0000   0.0000          ?        ?  2068.1716  23.6253          ?        ?      454.7        2.6       ?       ? 
1 1 1   39    7   39 o    327.0    2.7    0.0000   0.0000          ?        ?  1069.5237  17.8786          ?        ?      327.0        2.7       ?       ? 
1 1 1   39    7   40 o    598.7    2.7    0.0000   0.0000          ?        ?  3585.9373  32.5646          ?        ?      598.7        2.7       ?       ? 
1 1 1   39    7   41 o    443.5    2.7    0.0000   0.0000          ?        ?  1967.9237  23.6253          ?        ?      443.5        2.7       ?       ? 
1 1 1   39    7   42 o     93.7    8.5    0.0000   0.0000          ?        ?    88.1160  15.9630          ?        ?       93.7        8.5       ?       ? 
1 1 1   39    7   43 o    292.6    3.1    0.0000   0.0000          ?        ?   856.8960  17.8786          ?        ?      292.6        3.1       ?       ? 
1 1 1   39    7   44 o    189.7    4.4    0.0000   0.0000          ?        ?   360.1262  16.6016          ?        ?      189.7        4.4       ?       ? 
1 1 1   39    7   45 o    251.6    3.6    0.0000   0.0000          ?        ?   633.4135  17.8786          ?        ?      251.6        3.6       ?       ? 
1 1 1   39    7   46 o    127.4    6.8    0.0000   0.0000          ?        ?   162.8230  17.2401          ?        ?      127.4        6.8       ?       ? 
1 1 1   39    7   47 o    108.2    8.0    0.0000   0.0000          ?        ?   117.4880  17.2401          ?        ?      108.2        8.0       ?       ? 
1 1 1   39    7   48 o    173.3    5.0    0.0000   0.0000          ?        ?   300.7437  17.2401          ?        ?      173.3        5.0       ?       ? 
1 1 1   39    7   49 o    253.6    3.7    0.0000   0.0000          ?        ?   643.6298  18.5171          ?        ?      253.6        3.7       ?       ? 
1 1 1   39    7   50 f    288.9    3.2    0.0000   0.0000          ?        ?   835.1863  18.5171          ?        ?      288.9        3.2       ?       ? 
1 1 1   39    7   51 o     45.7   15.9    0.0000   0.0000          ?        ?    19.1556  17.8786          ?        ?       45.7       15.9       ?       ? 
1 1 1   39    7   52 o    178.3    5.2    0.0000   0.0000          ?        ?   318.6223  18.5171          ?        ?      178.3        5.2       ?       ? 
1 1 1   39    7   53 o    405.1    2.9    0.0000   0.0000          ?        ?  1642.2777  23.6253          ?        ?      405.1        2.9       ?       ? 
1 1 1   39    7   54 o    197.8    4.8    0.0000   0.0000          ?        ?   392.0523  19.1556          ?        ?      197.8        4.8       ?       ? 
1 1 1   39    7   55 o     27.8   13.0    0.0000   0.0000          ?        ?   -19.1556  18.5171          ?        ?       27.8       13.0       ?       ? 
1 1 1   39    7   56 f    343.6    3.2    0.0000   0.0000          ?        ?  1181.9036  21.7097          ?        ?      343.6        3.2       ?       ? 
1 1 1   39    7   57 o     43.3   16.1    0.0000   0.0000          ?        ?    15.3245  18.5171          ?        ?       43.3       16.1       ?       ? 
1 1 1   39    7   58 o    119.4    8.0    0.0000   0.0000          ?        ?   143.6674  19.1556          ?        ?      119.4        8.0       ?       ? 
1 1 1   39    7   59 o     31.7   14.3    0.0000   0.0000          ?        ?    -8.9393  19.1556          ?        ?       31.7       14.3       ?       ? 
1 1 1   39    7   60 o    363.1    3.2    0.0000   0.0000          ?        ?  1320.4628  22.9868          ?        ?      363.1        3.2       ?       ? 
1 1 1   39    7   61 o     73.5   14.0    0.0000   0.0000          ?        ?    57.4669  19.7942          ?        ?       73.5       14.0       ?       ? 
1 1 1   39    7   62 o     47.8   16.5    0.0000   0.0000          ?        ?    22.3483  19.1556          ?        ?       47.8       16.5       ?       ? 
1 1 1   39    7   63 o    102.6    9.3    0.0000   0.0000          ?        ?   107.2716  19.1556          ?        ?      102.6        9.3       ?       ? 
1 1 1   39    8    0 o     24.5   15.3    4.4697  14.6860     4.4697  14.6860     4.4697  14.6860       24.5     15.3       24.5       15.3     0.0     0.0 
1 1 1   39    8    1 o    576.2    2.7    0.0000   0.0000          ?        ?  3320.3125  31.2876          ?        ?      576.2        2.7       ?       ? 
1 1 1   39    8    2 o    710.5    2.9    0.0000   0.0000          ?        ?  5048.1519  41.5039          ?        ?      710.5        2.9       ?       ? 
1 1 1   39    8    3 o    230.5    2.5    0.0000   0.0000          ?        ?   531.2500  11.4934          ?        ?      230.5        2.5       ?       ? 
1 1 1   39    8    4 o    415.2    2.4    0.0000   0.0000          ?        ?  1724.0084  19.7942          ?        ?      415.2        2.4       ?       ? 
1 1 1   39    8    5 o    436.2    2.5    0.0000   0.0000          ?        ?  1902.7944  21.7097          ?        ?      436.2        2.5       ?       ? 
1 1 1   39    8    6 o    429.8    2.5    0.0000   0.0000          ?        ?  1847.2430  21.0712          ?        ?      429.8        2.5       ?       ? 
1 1 1   39    8    7 o    451.1    2.4    0.0000   0.0000          ?        ?  2034.9685  21.7097          ?        ?      451.1        2.4       ?       ? 
1 1 1   39    8    8 o    315.5    2.4    0.0000   0.0000          ?        ?   995.4552  15.3245          ?        ?      315.5        2.4       ?       ? 
1 1 1   39    8    9 o    172.7    3.3    0.0000   0.0000          ?        ?   298.1896  11.4934          ?        ?      172.7        3.3       ?       ? 
1 1 1   39    8   10 o    462.0    2.4    0.0000   0.0000          ?        ?  2134.5776  22.3483          ?        ?      462.0        2.4       ?       ? 
1 1 1   39    8   11 o    646.1    2.7    0.0000   0.0000          ?        ?  4175.2930  35.1187          ?        ?      646.1        2.7       ?       ? 
1 1 1   39    8   12 o    177.2    3.2    0.0000   0.0000          ?        ?   314.1526  11.4934          ?        ?      177.2        3.2       ?       ? 
1 1 1   39    8   13 f    333.8    2.4    0.0000   0.0000          ?        ?  1114.2202  15.9630          ?        ?      333.8        2.4       ?       ? 
1 1 1   39    8   14 o    541.2    2.7    0.0000   0.0000          ?        ?  2928.8987  29.3720          ?        ?      541.2        2.7       ?       ? 
1 1 1   39    8   15 o     54.3   11.0    0.0000   0.0000          ?        ?    30.6490  11.4934          ?        ?       54.3       11.0       ?       ? 
1 1 1   39    8   16 o    269.7    2.6    0.0000   0.0000          ?        ?   727.2761  14.0475          ?        ?      269.7        2.6       ?       ? 
1 1 1   39    8   17 o    127.8    4.7    0.0000   0.0000          ?        ?   163.4615  12.1319          ?        ?      127.8        4.7       ?       ? 
1 1 1   39    8   18 o    199.7    3.2    0.0000   0.0000          ?        ?   399.0760  12.7704          ?        ?      199.7        3.2       ?       ? 
1 1 1   39    8   19 o    493.2    2.5    0.0000   0.0000          ?        ?  2432.7673  24.9023          ?        ?      493.2        2.5       ?       ? 
1 1 1   39    8   20 o    458.8    2.4    0.0000   0.0000          ?        ?  2105.2058  21.7097          ?        ?      458.8        2.4       ?       ? 
1 1 1   39    8   21 o    359.9    2.4    0.0000   0.0000          ?        ?  1295.5603  17.2401          ?        ?      359.9        2.4       ?       ? 
1 1 1   39    8   22 o    249.1    2.8    0.0000   0.0000          ?        ?   620.6430  14.0475          ?        ?      249.1        2.8       ?       ? 
1 1 1   39    8   23 o    609.1    2.7    0.0000   0.0000          ?        ?  3710.4490  32.5646          ?        ?      609.1        2.7       ?       ? 
1 1 1   39    8   24 o    157.6    4.3    0.0000   0.0000          ?        ?   248.3849  13.4090          ?        ?      157.6        4.3       ?       ? 
1 1 1   39    8   25 o    232.3    2.9    0.0000   0.0000          ?        ?   539.5508  13.4090          ?        ?      232.3        2.9       ?       ? 
1 1 1   39    8   26 o    210.2    3.3    0.0000   0.0000          ?        ?   441.8569  14.0475          ?        ?      210.2        3.3       ?       ? 
1 1 1   39    8   27 o    535.9    2.7    0.0000   0.0000          ?        ?  2872.0703  28.7335          ?        ?      535.9        2.7       ?       ? 
1 1 1   39    8   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    8   29 o    182.5    4.0    0.0000   0.0000          ?        ?   333.3083  14.6860          ?        ?      182.5        4.0       ?       ? 
1 1 1   39    8   30 o    481.2    2.5    0.0000   0.0000          ?        ?  2315.9180  23.6253          ?        ?      481.2        2.5       ?       ? 
1 1 1   39    8   31 o    597.0    2.7    0.0000   0.0000          ?        ?  3564.8662  31.9261          ?        ?      597.0        2.7       ?       ? 
1 1 1   39    8   32 o    587.5    2.8    0.0000   0.0000          ?        ?  3452.4866  32.5646          ?        ?      587.5        2.8       ?       ? 
1 1 1   39    8   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    8   34 o    410.3    2.6    0.0000   0.0000          ?        ?  1683.7816  21.7097          ?        ?      410.3        2.6       ?       ? 
1 1 1   39    8   35 o    668.3    2.8    0.0000   0.0000          ?        ?  4467.7358  37.6728          ?        ?      668.3        2.8       ?       ? 
1 1 1   39    8   36 o     40.3   14.9    0.0000   0.0000          ?        ?    12.7704  15.9630          ?        ?       40.3       14.9       ?       ? 
1 1 1   39    8   37 o    121.9    6.3    0.0000   0.0000          ?        ?   148.7755  15.3245          ?        ?      121.9        6.3       ?       ? 
1 1 1   39    8   38 o    531.0    2.6    0.0000   0.0000          ?        ?  2820.9885  27.4564          ?        ?      531.0        2.6       ?       ? 
1 1 1   39    8   39 f    218.2    3.8    0.0000   0.0000          ?        ?   476.3371  16.6016          ?        ?      218.2        3.8       ?       ? 
1 1 1   39    8   40 o    321.0    2.9    0.0000   0.0000          ?        ?  1030.5739  18.5171          ?        ?      321.0        2.9       ?       ? 
1 1 1   39    8   41 o    188.5    4.2    0.0000   0.0000          ?        ?   355.6566  15.9630          ?        ?      188.5        4.2       ?       ? 
1 1 1   39    8   42 o    180.0    4.4    0.0000   0.0000          ?        ?   324.3690  15.9630          ?        ?      180.0        4.4       ?       ? 
1 1 1   39    8   43 o    128.5    6.2    0.0000   0.0000          ?        ?   165.3771  15.9630          ?        ?      128.5        6.2       ?       ? 
1 1 1   39    8   44 o     25.5   12.0    0.0000   0.0000          ?        ?   -17.8786  15.9630          ?        ?       25.5       12.0       ?       ? 
1 1 1   39    8   45 o    305.4    3.1    0.0000   0.0000          ?        ?   933.5186  19.1556          ?        ?      305.4        3.1       ?       ? 
1 1 1   39    8   46 o    199.2    4.5    0.0000   0.0000          ?        ?   397.1605  17.8786          ?        ?      199.2        4.5       ?       ? 
1 1 1   39    8   47 o    173.4    5.3    0.0000   0.0000          ?        ?   301.3822  18.5171          ?        ?      173.4        5.3       ?       ? 
1 1 1   39    8   48 o    199.3    4.6    0.0000   0.0000          ?        ?   397.7990  18.5171          ?        ?      199.3        4.6       ?       ? 
1 1 1   39    8   49 o    164.7    5.4    0.0000   0.0000          ?        ?   272.0102  17.8786          ?        ?      164.7        5.4       ?       ? 
1 1 1   39    8   50 o     90.8    9.8    0.0000   0.0000          ?        ?    83.0078  17.8786          ?        ?       90.8        9.8       ?       ? 
1 1 1   39    8   51 o    115.2    7.8    0.0000   0.0000          ?        ?   133.4510  17.8786          ?        ?      115.2        7.8       ?       ? 
1 1 1   39    8   52 o    202.6    4.7    0.0000   0.0000          ?        ?   411.2079  19.1556          ?        ?      202.6        4.7       ?       ? 
1 1 1   39    8   53 o    231.3    4.3    0.0000   0.0000          ?        ?   535.7197  19.7942          ?        ?      231.3        4.3       ?       ? 
1 1 1   39    8   54 f    210.7    4.5    0.0000   0.0000          ?        ?   445.0496  19.1556          ?        ?      210.7        4.5       ?       ? 
1 1 1   39    8   55 o     71.9   13.4    0.0000   0.0000          ?        ?    54.2743  18.5171          ?        ?       71.9       13.4       ?       ? 
1 1 1   39    8   56 o     34.1   14.9    0.0000   0.0000          ?        ?    -3.1926  19.1556          ?        ?       34.1       14.9       ?       ? 
1 1 1   39    8   57 o    161.2    6.1    0.0000   0.0000          ?        ?   261.1554  19.7942          ?        ?      161.2        6.1       ?       ? 
1 1 1   39    8   58 o    160.2    6.0    0.0000   0.0000          ?        ?   257.9627  19.1556          ?        ?      160.2        6.0       ?       ? 
1 1 1   39    8   59 o    189.1    5.1    0.0000   0.0000          ?        ?   358.8492  19.1556          ?        ?      189.1        5.1       ?       ? 
1 1 1   39    8   60 o     39.7   15.9    0.0000   0.0000          ?        ?     8.9393  19.1556          ?        ?       39.7       15.9       ?       ? 
1 1 1   39    8   61 o    122.5    8.1    0.0000   0.0000          ?        ?   151.9681  19.7942          ?        ?      122.5        8.1       ?       ? 
1 1 1   39    8   62 o     45.2   16.4    0.0000   0.0000          ?        ?    18.5171  19.1556          ?        ?       45.2       16.4       ?       ? 
1 1 1   39    9    0 o   1269.7    6.4 16129.0566 161.5460 16129.0566 161.5460 16129.0566 161.5460     1269.7      6.4     1269.7        6.4     0.0     0.0 
1 1 1   39    9    1 o    901.4    3.5    0.0000   0.0000          ?        ?  8127.1035  63.2136          ?        ?      901.4        3.5       ?       ? 
1 1 1   39    9    2 o    228.2    2.8    0.0000   0.0000          ?        ?   521.0336  12.7704          ?        ?      228.2        2.8       ?       ? 
1 1 1   39    9    3 f     23.5   10.4    0.0000   0.0000          ?        ?    -3.1926   9.5778          ?        ?       23.5       10.4       ?       ? 
1 1 1   39    9    4 o    583.2    2.7    0.0000   0.0000          ?        ?  3401.4048  31.2876          ?        ?      583.2        2.7       ?       ? 
1 1 1   39    9    5 o    256.4    2.6    0.0000   0.0000          ?        ?   657.6772  13.4090          ?        ?      256.4        2.6       ?       ? 
1 1 1   39    9    6 o    425.3    2.5    0.0000   0.0000          ?        ?  1808.9316  21.0712          ?        ?      425.3        2.5       ?       ? 
1 1 1   39    9    7 o     94.5    6.4    0.0000   0.0000          ?        ?    89.3930  12.1319          ?        ?       94.5        6.4       ?       ? 
1 1 1   39    9    8 o    384.6    2.4    0.0000   0.0000          ?        ?  1479.4546  18.5171          ?        ?      384.6        2.4       ?       ? 
1 1 1   39    9    9 o    605.4    2.6    0.0000   0.0000          ?        ?  3665.7524  31.9261          ?        ?      605.4        2.6       ?       ? 
1 1 1   39    9   10 o    185.8    3.1    0.0000   0.0000          ?        ?   345.4402  11.4934          ?        ?      185.8        3.1       ?       ? 
1 1 1   39    9   11 o    293.1    2.6    0.0000   0.0000          ?        ?   859.4501  15.3245          ?        ?      293.1        2.6       ?       ? 
1 1 1   39    9   12 o     97.2    5.9    0.0000   0.0000          ?        ?    94.5012  11.4934          ?        ?       97.2        5.9       ?       ? 
1 1 1   39    9   13 o    941.1    3.7    0.0000   0.0000          ?        ?  8858.8496  68.9603          ?        ?      941.1        3.7       ?       ? 
1 1 1   39    9   14 o    246.3    2.9    0.0000   0.0000          ?        ?   606.5955  14.0475          ?        ?      246.3        2.9       ?       ? 
1 1 1   39    9   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    9   16 o    303.4    2.6    0.0000   0.0000          ?        ?   920.7482  15.9630          ?        ?      303.4        2.6       ?       ? 
1 1 1   39    9   17 o    157.4    3.9    0.0000   0.0000          ?        ?   247.7464  12.1319          ?        ?      157.4        3.9       ?       ? 
1 1 1   39    9   18 o    370.9    2.3    0.0000   0.0000          ?        ?  1376.0142  17.2401          ?        ?      370.9        2.3       ?       ? 
1 1 1   39    9   19 o    276.6    2.5    0.0000   0.0000          ?        ?   764.9489  14.0475          ?        ?      276.6        2.5       ?       ? 
1 1 1   39    9   20 o    396.0    2.4    0.0000   0.0000          ?        ?  1568.2091  19.1556          ?        ?      396.0        2.4       ?       ? 
1 1 1   39    9   21 o     95.2    6.0    0.0000   0.0000          ?        ?    90.6701  11.4934          ?        ?       95.2        6.0       ?       ? 
1 1 1   39    9   22 o    621.7    2.8    0.0000   0.0000          ?        ?  3865.6101  34.4802          ?        ?      621.7        2.8       ?       ? 
1 1 1   39    9   23 o    765.3    3.2    0.0000   0.0000          ?        ?  5858.4360  48.5276          ?        ?      765.3        3.2       ?       ? 
1 1 1   39    9   24 o    364.3    2.5    0.0000   0.0000          ?        ?  1327.4865  18.5171          ?        ?      364.3        2.5       ?       ? 
1 1 1   39    9   25 o    160.8    4.4    0.0000   0.0000          ?        ?   258.6013  14.0475          ?        ?      160.8        4.4       ?       ? 
1 1 1   39    9   26 f     29.7   12.9    0.0000   0.0000          ?        ?    -1.9156  14.0475          ?        ?       29.7       12.9       ?       ? 
1 1 1   39    9   27 o    167.0    4.4    0.0000   0.0000          ?        ?   279.0340  14.6860          ?        ?      167.0        4.4       ?       ? 
1 1 1   39    9   28 o    419.8    2.4    0.0000   0.0000          ?        ?  1762.3197  20.4327          ?        ?      419.8        2.4       ?       ? 
1 1 1   39    9   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    9   30 o     88.2    7.6    0.0000   0.0000          ?        ?    77.8996  13.4090          ?        ?       88.2        7.6       ?       ? 
1 1 1   39    9   31 o     98.1    7.2    0.0000   0.0000          ?        ?    96.4168  14.0475          ?        ?       98.1        7.2       ?       ? 
1 1 1   39    9   32 o    522.8    2.5    0.0000   0.0000          ?        ?  2733.5112  26.1794          ?        ?      522.8        2.5       ?       ? 
1 1 1   39    9   33 o     84.8    8.3    0.0000   0.0000          ?        ?    72.1529  14.0475          ?        ?       84.8        8.3       ?       ? 
1 1 1   39    9   34 o    309.7    2.7    0.0000   0.0000          ?        ?   959.6980  16.6016          ?        ?      309.7        2.7       ?       ? 
1 1 1   39    9   35 o    113.5    6.5    0.0000   0.0000          ?        ?   128.9814  14.6860          ?        ?      113.5        6.5       ?       ? 
1 1 1   39    9   36 o    108.0    6.5    0.0000   0.0000          ?        ?   116.8494  14.0475          ?        ?      108.0        6.5       ?       ? 
1 1 1   39    9   37 o     62.6   12.7    0.0000   0.0000          ?        ?    40.8654  15.3245          ?        ?       62.6       12.7       ?       ? 
1 1 1   39    9   38 o    193.5    4.1    0.0000   0.0000          ?        ?   374.8122  15.9630          ?        ?      193.5        4.1       ?       ? 
1 1 1   39    9   39 o    425.5    2.7    0.0000   0.0000          ?        ?  1811.4860  22.9868          ?        ?      425.5        2.7       ?       ? 
1 1 1   39    9   40 o    385.1    2.7    0.0000   0.0000          ?        ?  1483.2858  20.4327          ?        ?      385.1        2.7       ?       ? 
1 1 1   39    9   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39    9   42 o    237.9    3.6    0.0000   0.0000          ?        ?   566.3687  17.2401          ?        ?      237.9        3.6       ?       ? 
1 1 1   39    9   43 o    248.9    3.5    0.0000   0.0000          ?        ?   620.0045  17.2401          ?        ?      248.9        3.5       ?       ? 
1 1 1   39    9   44 o    182.1    4.4    0.0000   0.0000          ?        ?   332.0312  15.9630          ?        ?      182.1        4.4       ?       ? 
1 1 1   39    9   45 o     27.4   12.6    0.0000   0.0000          ?        ?   -12.1319  15.9630          ?        ?       27.4       12.6       ?       ? 
1 1 1   39    9   46 o     57.7   14.4    0.0000   0.0000          ?        ?    35.1187  16.6016          ?        ?       57.7       14.4       ?       ? 
1 1 1   39    9   47 o    162.6    5.5    0.0000   0.0000          ?        ?   264.9865  17.8786          ?        ?      162.6        5.5       ?       ? 
1 1 1   39    9   48 o    193.3    4.8    0.0000   0.0000          ?        ?   374.1737  18.5171          ?        ?      193.3        4.8       ?       ? 
1 1 1   39    9   49 f    100.8    8.9    0.0000   0.0000          ?        ?   102.1635  17.8786          ?        ?      100.8        8.9       ?       ? 
1 1 1   39    9   50 o     62.6   14.5    0.0000   0.0000          ?        ?    41.5039  17.8786          ?        ?       62.6       14.5       ?       ? 
1 1 1   39    9   51 o    165.9    5.4    0.0000   0.0000          ?        ?   275.8413  17.8786          ?        ?      165.9        5.4       ?       ? 
1 1 1   39    9   52 o    136.5    6.8    0.0000   0.0000          ?        ?   187.0868  18.5171          ?        ?      136.5        6.8       ?       ? 
1 1 1   39    9   53 o    105.6    9.1    0.0000   0.0000          ?        ?   112.3798  19.1556          ?        ?      105.6        9.1       ?       ? 
1 1 1   39    9   54 o     19.5    9.9    0.0000   0.0000          ?        ?   -61.9366  18.5171          ?        ?       19.5        9.9       ?       ? 
1 1 1   39    9   55 o    288.4    3.4    0.0000   0.0000          ?        ?   832.6321  19.7942          ?        ?      288.4        3.4       ?       ? 
1 1 1   39    9   56 o    147.0    6.3    0.0000   0.0000          ?        ?   217.0974  18.5171          ?        ?      147.0        6.3       ?       ? 
1 1 1   39    9   57 o     41.4   16.3    0.0000   0.0000          ?        ?    10.8549  19.7942          ?        ?       41.4       16.3       ?       ? 
1 1 1   39    9   58 o     33.6   14.7    0.0000   0.0000          ?        ?    -2.5541  18.5171          ?        ?       33.6       14.7       ?       ? 
1 1 1   39    9   59 o     78.6   11.8    0.0000   0.0000          ?        ?    63.2136  18.5171          ?        ?       78.6       11.8       ?       ? 
1 1 1   39    9   60 o    279.8    3.5    0.0000   0.0000          ?        ?   784.7431  19.7942          ?        ?      279.8        3.5       ?       ? 
1 1 1   39    9   61 o    113.1    8.5    0.0000   0.0000          ?        ?   129.6199  19.1556          ?        ?      113.1        8.5       ?       ? 
1 1 1   39   10    0 o    554.6    3.7 3076.3972  40.8654  3076.3972  40.8654  3076.3972  40.8654      554.6      3.7      554.6        3.7     0.0     0.0 
1 1 1   39   10    1 o    524.6    2.5    0.0000   0.0000          ?        ?  2752.6667  26.1794          ?        ?      524.6        2.5       ?       ? 
1 1 1   39   10    2 o    568.6    2.6    0.0000   0.0000          ?        ?  3233.4734  30.0105          ?        ?      568.6        2.6       ?       ? 
1 1 1   39   10    3 o    305.1    2.4    0.0000   0.0000          ?        ?   930.9645  14.6860          ?        ?      305.1        2.4       ?       ? 
1 1 1   39   10    4 o    802.1    3.2    0.0000   0.0000          ?        ?  6434.3823  51.0817          ?        ?      802.1        3.2       ?       ? 
1 1 1   39   10    5 o    503.1    2.5    0.0000   0.0000          ?        ?  2531.0996  25.5409          ?        ?      503.1        2.5       ?       ? 
1 1 1   39   10    6 o    258.5    2.5    0.0000   0.0000          ?        ?   668.5321  12.7704          ?        ?      258.5        2.5       ?       ? 
1 1 1   39   10    7 o    529.7    2.5    0.0000   0.0000          ?        ?  2806.3025  26.8179          ?        ?      529.7        2.5       ?       ? 
1 1 1   39   10    8 f    452.8    2.5    0.0000   0.0000          ?        ?  2050.9316  22.3483          ?        ?      452.8        2.5       ?       ? 
1 1 1   39   10    9 o     87.9    5.8    0.0000   0.0000          ?        ?    77.2611  10.2163          ?        ?       87.9        5.8       ?       ? 
1 1 1   39   10   10 o    421.7    2.3    0.0000   0.0000          ?        ?  1778.2827  19.1556          ?        ?      421.7        2.3       ?       ? 
1 1 1   39   10   11 o    525.1    2.6    0.0000   0.0000          ?        ?  2757.7749  26.8179          ?        ?      525.1        2.6       ?       ? 
1 1 1   39   10   12 o    147.5    3.5    0.0000   0.0000          ?        ?   217.7359  10.2163          ?        ?      147.5        3.5       ?       ? 
1 1 1   39   10   13 o    302.2    2.5    0.0000   0.0000          ?        ?   913.0859  15.3245          ?        ?      302.2        2.5       ?       ? 
1 1 1   39   10   14 o    764.6    3.1    0.0000   0.0000          ?        ?  5846.9424  47.8891          ?        ?      764.6        3.1       ?       ? 
1 1 1   39   10   15 o    433.4    2.4    0.0000   0.0000          ?        ?  1878.5308  21.0712          ?        ?      433.4        2.4       ?       ? 
1 1 1   39   10   16 o    344.7    2.3    0.0000   0.0000          ?        ?  1188.2888  15.9630          ?        ?      344.7        2.3       ?       ? 
1 1 1   39   10   17 o    307.3    2.4    0.0000   0.0000          ?        ?   944.3735  14.6860          ?        ?      307.3        2.4       ?       ? 
1 1 1   39   10   18 o    236.1    2.7    0.0000   0.0000          ?        ?   557.4294  12.7704          ?        ?      236.1        2.7       ?       ? 
1 1 1   39   10   19 o    383.6    2.3    0.0000   0.0000          ?        ?  1471.7924  17.8786          ?        ?      383.6        2.3       ?       ? 
1 1 1   39   10   20 o     26.4   11.5    0.0000   0.0000          ?        ?    -2.5541  11.4934          ?        ?       26.4       11.5       ?       ? 
1 1 1   39   10   21 f    371.5    2.4    0.0000   0.0000          ?        ?  1380.4838  17.8786          ?        ?      371.5        2.4       ?       ? 
1 1 1   39   10   22 o    204.2    3.3    0.0000   0.0000          ?        ?   416.9547  13.4090          ?        ?      204.2        3.3       ?       ? 
1 1 1   39   10   23 o    425.8    2.4    0.0000   0.0000          ?        ?  1813.4014  20.4327          ?        ?      425.8        2.4       ?       ? 
1 1 1   39   10   24 o    225.6    3.3    0.0000   0.0000          ?        ?   508.9017  14.6860          ?        ?      225.6        3.3       ?       ? 
1 1 1   39   10   25 o    222.8    3.3    0.0000   0.0000          ?        ?   496.7698  14.6860          ?        ?      222.8        3.3       ?       ? 
1 1 1   39   10   26 o    496.9    2.5    0.0000   0.0000          ?        ?  2469.1631  24.9023          ?        ?      496.9        2.5       ?       ? 
1 1 1   39   10   27 o    450.7    2.4    0.0000   0.0000          ?        ?  2031.7759  21.7097          ?        ?      450.7        2.4       ?       ? 
1 1 1   39   10   28 f     16.1    8.2    0.0000   0.0000          ?        ?   -48.5276  13.4090          ?        ?       16.1        8.2       ?       ? 
1 1 1   39   10   29 o    489.5    2.5    0.0000   0.0000          ?        ?  2396.3716  24.2638          ?        ?      489.5        2.5       ?       ? 
1 1 1   39   10   30 o    330.7    2.6    0.0000   0.0000          ?        ?  1093.7876  17.2401          ?        ?      330.7        2.6       ?       ? 
1 1 1   39   10   31 o    147.7    4.8    0.0000   0.0000          ?        ?   218.3744  14.0475          ?        ?      147.7        4.8       ?       ? 
1 1 1   39   10   32 o    233.5    3.3    0.0000   0.0000          ?        ?   545.2975  15.3245          ?        ?      233.5        3.3       ?       ? 
1 1 1   39   10   33 o    473.3    2.6    0.0000   0.0000          ?        ?  2240.5723  24.2638          ?        ?      473.3        2.6       ?       ? 
1 1 1   39   10   34 o    164.5    4.3    0.0000   0.0000          ?        ?   270.7332  14.0475          ?        ?      164.5        4.3       ?       ? 
1 1 1   39   10   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   10   36 o     82.1    8.9    0.0000   0.0000          ?        ?    67.6833  14.6860          ?        ?       82.1        8.9       ?       ? 
1 1 1   39   10   37 o     58.9   13.3    0.0000   0.0000          ?        ?    36.3957  15.3245          ?        ?       58.9       13.3       ?       ? 
1 1 1   39   10   38 o    236.7    3.5    0.0000   0.0000          ?        ?   560.6220  16.6016          ?        ?      236.7        3.5       ?       ? 
1 1 1   39   10   39 o     18.7    9.4    0.0000   0.0000          ?        ?   -49.1662  15.9630          ?        ?       18.7        9.4       ?       ? 
1 1 1   39   10   40 o    348.8    2.7    0.0000   0.0000          ?        ?  1217.0222  19.1556          ?        ?      348.8        2.7       ?       ? 
1 1 1   39   10   41 o    447.0    2.6    0.0000   0.0000          ?        ?  1999.2113  22.9868          ?        ?      447.0        2.6       ?       ? 
1 1 1   39   10   42 o    230.0    3.7    0.0000   0.0000          ?        ?   529.3344  17.2401          ?        ?      230.0        3.7       ?       ? 
1 1 1   39   10   43 o     56.7   14.1    0.0000   0.0000          ?        ?    33.8416  15.9630          ?        ?       56.7       14.1       ?       ? 
1 1 1   39   10   44 o    316.5    3.0    0.0000   0.0000          ?        ?  1002.4789  19.1556          ?        ?      316.5        3.0       ?       ? 
1 1 1   39   10   45 o     25.4   12.1    0.0000   0.0000          ?        ?   -20.4327  16.6016          ?        ?       25.4       12.1       ?       ? 
1 1 1   39   10   46 o    231.5    4.0    0.0000   0.0000          ?        ?   536.3582  18.5171          ?        ?      231.5        4.0       ?       ? 
1 1 1   39   10   47 o     94.9    9.1    0.0000   0.0000          ?        ?    90.6701  17.2401          ?        ?       94.9        9.1       ?       ? 
1 1 1   39   10   48 o    402.7    2.8    0.0000   0.0000          ?        ?  1622.4835  22.3483          ?        ?      402.7        2.8       ?       ? 
1 1 1   39   10   49 o    298.7    3.4    0.0000   0.0000          ?        ?   893.2917  20.4327          ?        ?      298.7        3.4       ?       ? 
1 1 1   39   10   50 o     59.6   15.0    0.0000   0.0000          ?        ?    37.6728  17.8786          ?        ?       59.6       15.0       ?       ? 
1 1 1   39   10   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   10   52 o    151.1    6.3    0.0000   0.0000          ?        ?   229.2293  19.1556          ?        ?      151.1        6.3       ?       ? 
1 1 1   39   10   53 o     21.5   10.7    0.0000   0.0000          ?        ?   -47.8891  18.5171          ?        ?       21.5       10.7       ?       ? 
1 1 1   39   10   54 o    235.0    4.2    0.0000   0.0000          ?        ?   553.5982  19.7942          ?        ?      235.0        4.2       ?       ? 
1 1 1   39   10   55 o    215.0    4.5    0.0000   0.0000          ?        ?   463.5667  19.1556          ?        ?      215.0        4.5       ?       ? 
1 1 1   39   10   56 o     96.6    9.6    0.0000   0.0000          ?        ?    94.5012  18.5171          ?        ?       96.6        9.6       ?       ? 
1 1 1   39   10   57 o     24.0   11.8    0.0000   0.0000          ?        ?   -37.0343  19.1556          ?        ?       24.0       11.8       ?       ? 
1 1 1   39   10   58 o     57.7   16.0    0.0000   0.0000          ?        ?    35.7572  19.1556          ?        ?       57.7       16.0       ?       ? 
1 1 1   39   10   59 o     45.1   16.1    0.0000   0.0000          ?        ?    18.5171  18.5171          ?        ?       45.1       16.1       ?       ? 
1 1 1   39   10   60 o    147.8    6.5    0.0000   0.0000          ?        ?   220.2900  19.1556          ?        ?      147.8        6.5       ?       ? 
1 1 1   39   10   61 o    144.9    6.6    0.0000   0.0000          ?        ?   211.9892  19.1556          ?        ?      144.9        6.6       ?       ? 
1 1 1   39   11    0 o    146.2    4.8  214.5433  14.0475   214.5433  14.0475   214.5433  14.0475      146.2      4.8      146.2        4.8     0.0     0.0 
1 1 1   39   11    1 o    627.2    2.6    0.0000   0.0000          ?        ?  3933.9316  33.2031          ?        ?      627.2        2.6       ?       ? 
1 1 1   39   11    2 o    556.5    2.6    0.0000   0.0000          ?        ?  3096.8298  29.3720          ?        ?      556.5        2.6       ?       ? 
1 1 1   39   11    3 o    563.8    2.7    0.0000   0.0000          ?        ?  3179.1992  30.6490          ?        ?      563.8        2.7       ?       ? 
1 1 1   39   11    4 o    630.1    2.8    0.0000   0.0000          ?        ?  3970.3274  35.1187          ?        ?      630.1        2.8       ?       ? 
1 1 1   39   11    5 o    381.9    2.3    0.0000   0.0000          ?        ?  1458.3833  17.8786          ?        ?      381.9        2.3       ?       ? 
1 1 1   39   11    6 f    423.2    2.4    0.0000   0.0000          ?        ?  1791.0532  20.4327          ?        ?      423.2        2.4       ?       ? 
1 1 1   39   11    7 o    436.4    2.3    0.0000   0.0000          ?        ?  1904.7100  20.4327          ?        ?      436.4        2.3       ?       ? 
1 1 1   39   11    8 o    240.9    2.7    0.0000   0.0000          ?        ?   580.4161  12.7704          ?        ?      240.9        2.7       ?       ? 
1 1 1   39   11    9 o    720.2    3.0    0.0000   0.0000          ?        ?  5188.6265  43.4195          ?        ?      720.2        3.0       ?       ? 
1 1 1   39   11   10 o    203.5    3.0    0.0000   0.0000          ?        ?   414.4005  12.1319          ?        ?      203.5        3.0       ?       ? 
1 1 1   39   11   11 o    554.1    2.6    0.0000   0.0000          ?        ?  3070.6504  28.7335          ?        ?      554.1        2.6       ?       ? 
1 1 1   39   11   12 o    193.4    3.0    0.0000   0.0000          ?        ?   374.1737  11.4934          ?        ?      193.4        3.0       ?       ? 
1 1 1   39   11   13 o    403.2    2.3    0.0000   0.0000          ?        ?  1625.6761  18.5171          ?        ?      403.2        2.3       ?       ? 
1 1 1   39   11   14 o    331.0    2.2    0.0000   0.0000          ?        ?  1095.7031  14.6860          ?        ?      331.0        2.2       ?       ? 
1 1 1   39   11   15 o    321.1    2.4    0.0000   0.0000          ?        ?  1031.2124  15.3245          ?        ?      321.1        2.4       ?       ? 
1 1 1   39   11   16 o    301.9    2.4    0.0000   0.0000          ?        ?   911.8089  14.6860          ?        ?      301.9        2.4       ?       ? 
1 1 1   39   11   17 o     31.2   12.4    0.0000   0.0000          ?        ?     5.1082  11.4934          ?        ?       31.2       12.4       ?       ? 
1 1 1   39   11   18 o    382.6    2.4    0.0000   0.0000          ?        ?  1464.1301  18.5171          ?        ?      382.6        2.4       ?       ? 
1 1 1   39   11   19 o    206.5    3.1    0.0000   0.0000          ?        ?   426.5325  12.7704          ?        ?      206.5        3.1       ?       ? 
1 1 1   39   11   20 o    266.1    2.8    0.0000   0.0000          ?        ?   708.1205  14.6860          ?        ?      266.1        2.8       ?       ? 
1 1 1   39   11   21 f    168.7    3.8    0.0000   0.0000          ?        ?   284.7806  12.7704          ?        ?      168.7        3.8       ?       ? 
1 1 1   39   11   22 o    262.6    2.7    0.0000   0.0000          ?        ?   689.6033  14.0475          ?        ?      262.6        2.7       ?       ? 
1 1 1   39   11   23 o    181.5    3.5    0.0000   0.0000          ?        ?   329.4771  12.7704          ?        ?      181.5        3.5       ?       ? 
1 1 1   39   11   24 o    247.2    3.0    0.0000   0.0000          ?        ?   611.0652  14.6860          ?        ?      247.2        3.0       ?       ? 
1 1 1   39   11   25 o    265.0    2.8    0.0000   0.0000          ?        ?   702.3738  14.6860          ?        ?      265.0        2.8       ?       ? 
1 1 1   39   11   26 o    322.4    2.6    0.0000   0.0000          ?        ?  1039.5132  16.6016          ?        ?      322.4        2.6       ?       ? 
1 1 1   39   11   27 o    305.4    2.6    0.0000   0.0000          ?        ?   932.8801  15.9630          ?        ?      305.4        2.6       ?       ? 
1 1 1   39   11   28 o    400.7    2.5    0.0000   0.0000          ?        ?  1605.8818  20.4327          ?        ?      400.7        2.5       ?       ? 
1 1 1   39   11   29 o    398.9    2.6    0.0000   0.0000          ?        ?  1591.8345  20.4327          ?        ?      398.9        2.6       ?       ? 
1 1 1   39   11   30 o     88.9    7.5    0.0000   0.0000          ?        ?    79.1767  13.4090          ?        ?       88.9        7.5       ?       ? 
1 1 1   39   11   31 o     20.1    9.8    0.0000   0.0000          ?        ?   -26.8179  13.4090          ?        ?       20.1        9.8       ?       ? 
1 1 1   39   11   32 o    315.9    2.6    0.0000   0.0000          ?        ?   998.0093  16.6016          ?        ?      315.9        2.6       ?       ? 
1 1 1   39   11   33 o     20.2   10.0    0.0000   0.0000          ?        ?   -29.3720  14.0475          ?        ?       20.2       10.0       ?       ? 
1 1 1   39   11   34 o    139.7    5.5    0.0000   0.0000          ?        ?   195.3876  15.3245          ?        ?      139.7        5.5       ?       ? 
1 1 1   39   11   35 o    196.6    4.1    0.0000   0.0000          ?        ?   386.9441  15.9630          ?        ?      196.6        4.1       ?       ? 
1 1 1   39   11   36 o    426.7    2.6    0.0000   0.0000          ?        ?  1821.0637  22.3483          ?        ?      426.7        2.6       ?       ? 
1 1 1   39   11   37 o     46.9   14.3    0.0000   0.0000          ?        ?    22.3483  14.6860          ?        ?       46.9       14.3       ?       ? 
1 1 1   39   11   38 o    685.6    2.9    0.0000   0.0000          ?        ?  4703.3501  39.5883          ?        ?      685.6        2.9       ?       ? 
1 1 1   39   11   39 o     34.1   14.0    0.0000   0.0000          ?        ?     3.8311  15.3245          ?        ?       34.1       14.0       ?       ? 
1 1 1   39   11   40 o    228.6    3.5    0.0000   0.0000          ?        ?   522.9492  15.9630          ?        ?      228.6        3.5       ?       ? 
1 1 1   39   11   41 o    334.8    3.0    0.0000   0.0000          ?        ?  1121.2440  19.7942          ?        ?      334.8        3.0       ?       ? 
1 1 1   39   11   42 o    296.8    3.1    0.0000   0.0000          ?        ?   881.1599  18.5171          ?        ?      296.8        3.1       ?       ? 
1 1 1   39   11   43 o    102.1    8.1    0.0000   0.0000          ?        ?   104.7175  16.6016          ?        ?      102.1        8.1       ?       ? 
1 1 1   39   11   44 o    277.0    3.3    0.0000   0.0000          ?        ?   768.1415  18.5171          ?        ?      277.0        3.3       ?       ? 
1 1 1   39   11   45 o    146.7    5.9    0.0000   0.0000          ?        ?   215.8203  17.2401          ?        ?      146.7        5.9       ?       ? 
1 1 1   39   11   46 o    265.3    3.5    0.0000   0.0000          ?        ?   704.2894  18.5171          ?        ?      265.3        3.5       ?       ? 
1 1 1   39   11   47 o    269.9    3.5    0.0000   0.0000          ?        ?   729.1917  19.1556          ?        ?      269.9        3.5       ?       ? 
1 1 1   39   11   48 o     54.7   15.6    0.0000   0.0000          ?        ?    31.2876  17.8786          ?        ?       54.7       15.6       ?       ? 
1 1 1   39   11   49 o     23.2   11.4    0.0000   0.0000          ?        ?   -35.1187  17.8786          ?        ?       23.2       11.4       ?       ? 
1 1 1   39   11   50 f    367.7    3.0    0.0000   0.0000          ?        ?  1353.0273  22.3483          ?        ?      367.7        3.0       ?       ? 
1 1 1   39   11   51 o    227.5    4.1    0.0000   0.0000          ?        ?   518.4796  18.5171          ?        ?      227.5        4.1       ?       ? 
1 1 1   39   11   52 o    235.5    4.1    0.0000   0.0000          ?        ?   555.5138  19.1556          ?        ?      235.5        4.1       ?       ? 
1 1 1   39   11   53 o    308.1    3.2    0.0000   0.0000          ?        ?   950.1202  19.7942          ?        ?      308.1        3.2       ?       ? 
1 1 1   39   11   54 o     68.5   14.4    0.0000   0.0000          ?        ?    49.8047  19.1556          ?        ?       68.5       14.4       ?       ? 
1 1 1   39   11   55 o    123.3    7.8    0.0000   0.0000          ?        ?   153.2452  19.1556          ?        ?      123.3        7.8       ?       ? 
1 1 1   39   11   56 o     63.7   14.8    0.0000   0.0000          ?        ?    43.4195  18.5171          ?        ?       63.7       14.8       ?       ? 
1 1 1   39   11   57 o    249.2    4.1    0.0000   0.0000          ?        ?   622.5586  20.4327          ?        ?      249.2        4.1       ?       ? 
1 1 1   39   11   58 o    249.1    3.8    0.0000   0.0000          ?        ?   621.9200  19.1556          ?        ?      249.1        3.8       ?       ? 
1 1 1   39   11   59 o    151.3    6.3    0.0000   0.0000          ?        ?   230.5063  19.1556          ?        ?      151.3        6.3       ?       ? 
1 1 1   39   11   60 o    172.5    5.4    0.0000   0.0000          ?        ?   299.4666  18.5171          ?        ?      172.5        5.4       ?       ? 
1 1 1   39   12    0 o    162.4    5.9  264.9865  19.1556   264.9865  19.1556   264.9865  19.1556      162.4      5.9      162.4        5.9     0.0     0.0 
1 1 1   39   12    1 o    423.2    2.4    0.0000   0.0000          ?        ?  1791.0532  20.4327          ?        ?      423.2        2.4       ?       ? 
1 1 1   39   12    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   12    3 o    272.0    2.5    0.0000   0.0000          ?        ?   740.0466  13.4090          ?        ?      272.0        2.5       ?       ? 
1 1 1   39   12    4 o    192.4    2.8    0.0000   0.0000          ?        ?   370.3425  10.8549          ?        ?      192.4        2.8       ?       ? 
1 1 1   39   12    5 o    310.5    2.3    0.0000   0.0000          ?        ?   964.1677  14.0475          ?        ?      310.5        2.3       ?       ? 
1 1 1   39   12    6 o     80.3    5.6    0.0000   0.0000          ?        ?    64.4907   8.9393          ?        ?       80.3        5.6       ?       ? 
1 1 1   39   12    7 o    147.1    3.3    0.0000   0.0000          ?        ?   216.4588   9.5778          ?        ?      147.1        3.3       ?       ? 
1 1 1   39   12    8 o    605.2    2.6    0.0000   0.0000          ?        ?  3663.8369  31.9261          ?        ?      605.2        2.6       ?       ? 
1 1 1   39   12    9 o    529.2    2.5    0.0000   0.0000          ?        ?  2800.5559  26.1794          ?        ?      529.2        2.5       ?       ? 
1 1 1   39   12   10 o    187.9    3.1    0.0000   0.0000          ?        ?   353.1024  11.4934          ?        ?      187.9        3.1       ?       ? 
1 1 1   39   12   11 o    514.6    2.5    0.0000   0.0000          ?        ?  2648.5876  25.5409          ?        ?      514.6        2.5       ?       ? 
1 1 1   39   12   12 o    106.6    4.8    0.0000   0.0000          ?        ?   113.6568  10.2163          ?        ?      106.6        4.8       ?       ? 
1 1 1   39   12   13 f    391.8    2.3    0.0000   0.0000          ?        ?  1535.6445  17.8786          ?        ?      391.8        2.3       ?       ? 
1 1 1   39   12   14 f    127.3    4.5    0.0000   0.0000          ?        ?   162.1845  11.4934          ?        ?      127.3        4.5       ?       ? 
1 1 1   39   12   15 o    498.1    2.6    0.0000   0.0000          ?        ?  2481.9336  25.5409          ?        ?      498.1        2.6       ?       ? 
1 1 1   39   12   16 o    339.9    2.4    0.0000   0.0000          ?        ?  1155.7241  16.6016          ?        ?      339.9        2.4       ?       ? 
1 1 1   39   12   17 o    695.8    2.9    0.0000   0.0000          ?        ?  4843.1865  40.2269          ?        ?      695.8        2.9       ?       ? 
1 1 1   39   12   18 o     91.1    6.3    0.0000   0.0000          ?        ?    83.0078  11.4934          ?        ?       91.1        6.3       ?       ? 
1 1 1   39   12   19 o    344.4    2.3    0.0000   0.0000          ?        ?  1186.3732  15.9630          ?        ?      344.4        2.3       ?       ? 
1 1 1   39   12   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   12   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   12   22 o    125.0    5.4    0.0000   0.0000          ?        ?   156.4378  13.4090          ?        ?      125.0        5.4       ?       ? 
1 1 1   39   12   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   12   24 o    483.4    2.5    0.0000   0.0000          ?        ?  2336.9893  24.2638          ?        ?      483.4        2.5       ?       ? 
1 1 1   39   12   25 f    279.0    2.7    0.0000   0.0000          ?        ?   778.3578  15.3245          ?        ?      279.0        2.7       ?       ? 
1 1 1   39   12   26 f    179.3    3.9    0.0000   0.0000          ?        ?   321.8149  14.0475          ?        ?      179.3        3.9       ?       ? 
1 1 1   39   12   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   12   28 o    272.2    3.0    0.0000   0.0000          ?        ?   741.3236  16.6016          ?        ?      272.2        3.0       ?       ? 
1 1 1   39   12   29 o    222.7    3.3    0.0000   0.0000          ?        ?   496.1313  14.6860          ?        ?      222.7        3.3       ?       ? 
1 1 1   39   12   30 o    234.0    3.4    0.0000   0.0000          ?        ?   547.8516  15.9630          ?        ?      234.0        3.4       ?       ? 
1 1 1   39   12   31 o    251.9    3.0    0.0000   0.0000          ?        ?   634.6905  15.3245          ?        ?      251.9        3.0       ?       ? 
1 1 1   39   12   32 o     24.5   11.5    0.0000   0.0000          ?        ?   -14.0475  14.0475          ?        ?       24.5       11.5       ?       ? 
1 1 1   39   12   33 o    164.1    4.5    0.0000   0.0000          ?        ?   269.4561  14.6860          ?        ?      164.1        4.5       ?       ? 
1 1 1   39   12   34 o    185.4    4.3    0.0000   0.0000          ?        ?   344.1632  15.9630          ?        ?      185.4        4.3       ?       ? 
1 1 1   39   12   35 o    434.1    2.6    0.0000   0.0000          ?        ?  1884.9159  22.3483          ?        ?      434.1        2.6       ?       ? 
1 1 1   39   12   36 o    230.5    3.6    0.0000   0.0000          ?        ?   531.8885  16.6016          ?        ?      230.5        3.6       ?       ? 
1 1 1   39   12   37 o    187.1    4.3    0.0000   0.0000          ?        ?   350.5484  15.9630          ?        ?      187.1        4.3       ?       ? 
1 1 1   39   12   38 o    263.6    3.3    0.0000   0.0000          ?        ?   695.3500  17.2401          ?        ?      263.6        3.3       ?       ? 
1 1 1   39   12   39 o    342.8    2.8    0.0000   0.0000          ?        ?  1175.5183  19.1556          ?        ?      342.8        2.8       ?       ? 
1 1 1   39   12   40 o    267.8    3.2    0.0000   0.0000          ?        ?   717.6983  17.2401          ?        ?      267.8        3.2       ?       ? 
1 1 1   39   12   41 o    261.7    3.3    0.0000   0.0000          ?        ?   685.1337  17.2401          ?        ?      261.7        3.3       ?       ? 
1 1 1   39   12   42 o    121.0    6.9    0.0000   0.0000          ?        ?   146.8600  16.6016          ?        ?      121.0        6.9       ?       ? 
1 1 1   39   12   43 o     58.8   13.8    0.0000   0.0000          ?        ?    36.3957  15.9630          ?        ?       58.8       13.8       ?       ? 
1 1 1   39   12   44 o    106.7    8.1    0.0000   0.0000          ?        ?   114.2954  17.2401          ?        ?      106.7        8.1       ?       ? 
1 1 1   39   12   45 o    194.4    4.4    0.0000   0.0000          ?        ?   378.6433  17.2401          ?        ?      194.4        4.4       ?       ? 
1 1 1   39   12   46 o     77.1   11.2    0.0000   0.0000          ?        ?    60.0210  17.2401          ?        ?       77.1       11.2       ?       ? 
1 1 1   39   12   47 o    416.0    2.8    0.0000   0.0000          ?        ?  1731.6708  22.9868          ?        ?      416.0        2.8       ?       ? 
1 1 1   39   12   48 o    289.7    3.4    0.0000   0.0000          ?        ?   840.2945  19.7942          ?        ?      289.7        3.4       ?       ? 
1 1 1   39   12   49 o     47.9   15.9    0.0000   0.0000          ?        ?    22.3483  17.8786          ?        ?       47.9       15.9       ?       ? 
1 1 1   39   12   50 o     36.4   14.9    0.0000   0.0000          ?        ?     5.1082  17.2401          ?        ?       36.4       14.9       ?       ? 
1 1 1   39   12   51 o    325.4    3.2    0.0000   0.0000          ?        ?  1059.9459  21.0712          ?        ?      325.4        3.2       ?       ? 
1 1 1   39   12   52 o    192.2    5.2    0.0000   0.0000          ?        ?   370.3425  19.7942          ?        ?      192.2        5.2       ?       ? 
1 1 1   39   12   53 o    309.7    3.3    0.0000   0.0000          ?        ?   960.3365  20.4327          ?        ?      309.7        3.3       ?       ? 
1 1 1   39   12   54 o     99.6    9.0    0.0000   0.0000          ?        ?   100.2479  17.8786          ?        ?       99.6        9.0       ?       ? 
1 1 1   39   12   55 o    133.5    6.9    0.0000   0.0000          ?        ?   179.4246  18.5171          ?        ?      133.5        6.9       ?       ? 
1 1 1   39   12   56 o    114.1    8.1    0.0000   0.0000          ?        ?   131.5355  18.5171          ?        ?      114.1        8.1       ?       ? 
1 1 1   39   12   57 o    145.5    6.4    0.0000   0.0000          ?        ?   213.2662  18.5171          ?        ?      145.5        6.4       ?       ? 
1 1 1   39   12   58 o    161.7    5.9    0.0000   0.0000          ?        ?   263.0709  19.1556          ?        ?      161.7        5.9       ?       ? 
1 1 1   39   12   59 o    130.7    6.8    0.0000   0.0000          ?        ?   172.4008  17.8786          ?        ?      130.7        6.8       ?       ? 
1 1 1   39   13    0 o    230.7    4.4  533.1656  20.4327   533.1656  20.4327   533.1656  20.4327      230.7      4.4      230.7        4.4     0.0     0.0 
1 1 1   39   13    1 o    625.4    2.9    0.0000   0.0000          ?        ?  3911.5833  35.7572          ?        ?      625.4        2.9       ?       ? 
1 1 1   39   13    2 o    457.3    2.5    0.0000   0.0000          ?        ?  2091.7969  22.9868          ?        ?      457.3        2.5       ?       ? 
1 1 1   39   13    3 o    263.1    2.7    0.0000   0.0000          ?        ?   692.1575  14.0475          ?        ?      263.1        2.7       ?       ? 
1 1 1   39   13    4 o    361.0    2.4    0.0000   0.0000          ?        ?  1303.2227  17.2401          ?        ?      361.0        2.4       ?       ? 
1 1 1   39   13    5 o    205.4    2.5    0.0000   0.0000          ?        ?   422.0628  10.2163          ?        ?      205.4        2.5       ?       ? 
1 1 1   39   13    6 o    570.9    2.6    0.0000   0.0000          ?        ?  3259.6528  29.3720          ?        ?      570.9        2.6       ?       ? 
1 1 1   39   13    7 o    564.8    2.5    0.0000   0.0000          ?        ?  3190.6926  28.0950          ?        ?      564.8        2.5       ?       ? 
1 1 1   39   13    8 o    522.9    2.4    0.0000   0.0000          ?        ?  2734.7881  25.5409          ?        ?      522.9        2.4       ?       ? 
1 1 1   39   13    9 o    399.4    2.3    0.0000   0.0000          ?        ?  1595.6655  18.5171          ?        ?      399.4        2.3       ?       ? 
1 1 1   39   13   10 o    478.3    2.4    0.0000   0.0000          ?        ?  2288.4614  22.9868          ?        ?      478.3        2.4       ?       ? 
1 1 1   39   13   11 o    720.6    3.0    0.0000   0.0000          ?        ?  5194.3735  42.7809          ?        ?      720.6        3.0       ?       ? 
1 1 1   39   13   12 o    208.0    2.9    0.0000   0.0000          ?        ?   432.9177  12.1319          ?        ?      208.0        2.9       ?       ? 
1 1 1   39   13   13 o    116.0    4.4    0.0000   0.0000          ?        ?   134.7281  10.2163          ?        ?      116.0        4.4       ?       ? 
1 1 1   39   13   14 o    197.7    2.9    0.0000   0.0000          ?        ?   390.7752  11.4934          ?        ?      197.7        2.9       ?       ? 
1 1 1   39   13   15 o    156.8    3.7    0.0000   0.0000          ?        ?   245.8308  11.4934          ?        ?      156.8        3.7       ?       ? 
1 1 1   39   13   16 o    232.7    2.7    0.0000   0.0000          ?        ?   541.4664  12.7704          ?        ?      232.7        2.7       ?       ? 
1 1 1   39   13   17 o    122.7    4.7    0.0000   0.0000          ?        ?   150.6911  11.4934          ?        ?      122.7        4.7       ?       ? 
1 1 1   39   13   18 o    314.4    2.3    0.0000   0.0000          ?        ?   988.4315  14.6860          ?        ?      314.4        2.3       ?       ? 
1 1 1   39   13   19 o     99.4    5.8    0.0000   0.0000          ?        ?    98.9709  11.4934          ?        ?       99.4        5.8       ?       ? 
1 1 1   39   13   20 o    237.8    2.7    0.0000   0.0000          ?        ?   565.7302  12.7704          ?        ?      237.8        2.7       ?       ? 
1 1 1   39   13   21 o    542.4    2.6    0.0000   0.0000          ?        ?  2942.3076  28.0950          ?        ?      542.4        2.6       ?       ? 
1 1 1   39   13   22 o    207.3    3.2    0.0000   0.0000          ?        ?   429.7251  13.4090          ?        ?      207.3        3.2       ?       ? 
1 1 1   39   13   23 o    417.9    2.4    0.0000   0.0000          ?        ?  1746.3567  19.7942          ?        ?      417.9        2.4       ?       ? 
1 1 1   39   13   24 o    146.9    4.3    0.0000   0.0000          ?        ?   215.8203  12.7704          ?        ?      146.9        4.3       ?       ? 
1 1 1   39   13   25 o    237.3    3.0    0.0000   0.0000          ?        ?   563.1760  14.0475          ?        ?      237.3        3.0       ?       ? 
1 1 1   39   13   26 o    445.6    2.4    0.0000   0.0000          ?        ?  1985.8022  21.7097          ?        ?      445.6        2.4       ?       ? 
1 1 1   39   13   27 f    177.9    3.8    0.0000   0.0000          ?        ?   316.7067  13.4090          ?        ?      177.9        3.8       ?       ? 
1 1 1   39   13   28 o    366.6    2.4    0.0000   0.0000          ?        ?  1344.0880  17.8786          ?        ?      366.6        2.4       ?       ? 
1 1 1   39   13   29 o    303.7    2.7    0.0000   0.0000          ?        ?   922.6638  16.6016          ?        ?      303.7        2.7       ?       ? 
1 1 1   39   13   30 o    238.6    3.3    0.0000   0.0000          ?        ?   569.5613  15.9630          ?        ?      238.6        3.3       ?       ? 
1 1 1   39   13   31 o    198.9    3.7    0.0000   0.0000          ?        ?   395.8834  14.6860          ?        ?      198.9        3.7       ?       ? 
1 1 1   39   13   32 o    456.0    2.5    0.0000   0.0000          ?        ?  2079.6650  22.9868          ?        ?      456.0        2.5       ?       ? 
1 1 1   39   13   33 o    310.3    2.8    0.0000   0.0000          ?        ?   963.5291  17.2401          ?        ?      310.3        2.8       ?       ? 
1 1 1   39   13   34 o    352.3    2.7    0.0000   0.0000          ?        ?  1241.9246  19.1556          ?        ?      352.3        2.7       ?       ? 
1 1 1   39   13   35 o    444.2    2.5    0.0000   0.0000          ?        ?  1973.6704  22.3483          ?        ?      444.2        2.5       ?       ? 
1 1 1   39   13   36 o    409.3    2.7    0.0000   0.0000          ?        ?  1676.1193  21.7097          ?        ?      409.3        2.7       ?       ? 
1 1 1   39   13   37 o    246.1    3.4    0.0000   0.0000          ?        ?   605.9570  16.6016          ?        ?      246.1        3.4       ?       ? 
1 1 1   39   13   38 o    156.9    4.9    0.0000   0.0000          ?        ?   246.4693  15.3245          ?        ?      156.9        4.9       ?       ? 
1 1 1   39   13   39 o    259.0    3.3    0.0000   0.0000          ?        ?   671.0862  17.2401          ?        ?      259.0        3.3       ?       ? 
1 1 1   39   13   40 o    194.1    4.3    0.0000   0.0000          ?        ?   377.3663  16.6016          ?        ?      194.1        4.3       ?       ? 
1 1 1   39   13   41 o     36.1   14.5    0.0000   0.0000          ?        ?     6.3852  15.9630          ?        ?       36.1       14.5       ?       ? 
1 1 1   39   13   42 f    363.2    2.8    0.0000   0.0000          ?        ?  1319.8242  20.4327          ?        ?      363.2        2.8       ?       ? 
1 1 1   39   13   43 o    167.6    5.1    0.0000   0.0000          ?        ?   281.5880  17.2401          ?        ?      167.6        5.1       ?       ? 
1 1 1   39   13   44 o    172.3    5.2    0.0000   0.0000          ?        ?   297.5511  17.8786          ?        ?      172.3        5.2       ?       ? 
1 1 1   39   13   45 o    168.6    5.3    0.0000   0.0000          ?        ?   284.7806  17.8786          ?        ?      168.6        5.3       ?       ? 
1 1 1   39   13   46 o     67.1   13.3    0.0000   0.0000          ?        ?    47.2506  17.2401          ?        ?       67.1       13.3       ?       ? 
1 1 1   39   13   47 o     23.7   11.6    0.0000   0.0000          ?        ?   -32.5646  17.8786          ?        ?       23.7       11.6       ?       ? 
1 1 1   39   13   48 o    283.0    3.4    0.0000   0.0000          ?        ?   801.9832  19.1556          ?        ?      283.0        3.4       ?       ? 
1 1 1   39   13   49 o    231.8    4.1    0.0000   0.0000          ?        ?   538.2737  19.1556          ?        ?      231.8        4.1       ?       ? 
1 1 1   39   13   50 o     49.5   15.6    0.0000   0.0000          ?        ?    24.9023  17.2401          ?        ?       49.5       15.6       ?       ? 
1 1 1   39   13   51 o    234.9    4.1    0.0000   0.0000          ?        ?   552.9597  19.1556          ?        ?      234.9        4.1       ?       ? 
1 1 1   39   13   52 o    133.3    6.7    0.0000   0.0000          ?        ?   178.7861  17.8786          ?        ?      133.3        6.7       ?       ? 
1 1 1   39   13   53 o     28.1   13.2    0.0000   0.0000          ?        ?   -17.8786  18.5171          ?        ?       28.1       13.2       ?       ? 
1 1 1   39   13   54 o    181.4    5.1    0.0000   0.0000          ?        ?   330.1157  18.5171          ?        ?      181.4        5.1       ?       ? 
1 1 1   39   13   55 o     19.4    9.8    0.0000   0.0000          ?        ?   -57.4669  17.8786          ?        ?       19.4        9.8       ?       ? 
1 1 1   39   13   56 o    150.7    6.1    0.0000   0.0000          ?        ?   228.5907  18.5171          ?        ?      150.7        6.1       ?       ? 
1 1 1   39   13   57 o    140.4    6.6    0.0000   0.0000          ?        ?   198.5802  18.5171          ?        ?      140.4        6.6       ?       ? 
1 1 1   39   13   58 o     57.4   16.1    0.0000   0.0000          ?        ?    35.7572  19.1556          ?        ?       57.4       16.1       ?       ? 
1 1 1   39   14    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   14    1 o    200.5    3.7    0.0000   0.0000          ?        ?   402.2686  14.6860          ?        ?      200.5        3.7       ?       ? 
1 1 1   39   14    2 o     31.5   13.0    0.0000   0.0000          ?        ?     2.5541  13.4090          ?        ?       31.5       13.0       ?       ? 
1 1 1   39   14    3 o    155.9    3.7    0.0000   0.0000          ?        ?   243.2767  11.4934          ?        ?      155.9        3.7       ?       ? 
1 1 1   39   14    4 o    338.6    2.5    0.0000   0.0000          ?        ?  1146.7849  16.6016          ?        ?      338.6        2.5       ?       ? 
1 1 1   39   14    5 o    445.2    2.5    0.0000   0.0000          ?        ?  1982.6096  22.3483          ?        ?      445.2        2.5       ?       ? 
1 1 1   39   14    6 o    368.8    2.6    0.0000   0.0000          ?        ?  1360.0510  19.1556          ?        ?      368.8        2.6       ?       ? 
1 1 1   39   14    7 o    427.5    2.4    0.0000   0.0000          ?        ?  1827.4490  20.4327          ?        ?      427.5        2.4       ?       ? 
1 1 1   39   14    8 o    461.6    2.5    0.0000   0.0000          ?        ?  2130.7468  22.9868          ?        ?      461.6        2.5       ?       ? 
1 1 1   39   14    9 o    102.3    5.0    0.0000   0.0000          ?        ?   104.7175  10.2163          ?        ?      102.3        5.0       ?       ? 
1 1 1   39   14   10 o    779.5    3.1    0.0000   0.0000          ?        ?  6077.4487  47.8891          ?        ?      779.5        3.1       ?       ? 
1 1 1   39   14   11 o    703.6    2.9    0.0000   0.0000          ?        ?  4951.0967  40.2269          ?        ?      703.6        2.9       ?       ? 
1 1 1   39   14   12 o    422.9    2.5    0.0000   0.0000          ?        ?  1789.1377  21.0712          ?        ?      422.9        2.5       ?       ? 
1 1 1   39   14   13 o    116.8    5.2    0.0000   0.0000          ?        ?   136.6436  12.1319          ?        ?      116.8        5.2       ?       ? 
1 1 1   39   14   14 o    922.4    3.6    0.0000   0.0000          ?        ?  8512.1318  66.4062          ?        ?      922.4        3.6       ?       ? 
1 1 1   39   14   15 f    301.7    2.5    0.0000   0.0000          ?        ?   910.5319  15.3245          ?        ?      301.7        2.5       ?       ? 
1 1 1   39   14   16 o     94.2    5.4    0.0000   0.0000          ?        ?    88.7545  10.2163          ?        ?       94.2        5.4       ?       ? 
1 1 1   39   14   17 o     26.7   11.6    0.0000   0.0000          ?        ?    -1.9156  11.4934          ?        ?       26.7       11.6       ?       ? 
1 1 1   39   14   18 o    257.9    2.8    0.0000   0.0000          ?        ?   665.3395  14.6860          ?        ?      257.9        2.8       ?       ? 
1 1 1   39   14   19 o    638.3    2.8    0.0000   0.0000          ?        ?  4075.6833  35.1187          ?        ?      638.3        2.8       ?       ? 
1 1 1   39   14   20 o    360.9    2.6    0.0000   0.0000          ?        ?  1302.5841  18.5171          ?        ?      360.9        2.6       ?       ? 
1 1 1   39   14   21 o    511.1    2.4    0.0000   0.0000          ?        ?  2612.8306  24.9023          ?        ?      511.1        2.4       ?       ? 
1 1 1   39   14   22 o    432.9    2.4    0.0000   0.0000          ?        ?  1874.6996  20.4327          ?        ?      432.9        2.4       ?       ? 
1 1 1   39   14   23 o    326.2    2.4    0.0000   0.0000          ?        ?  1064.4155  15.9630          ?        ?      326.2        2.4       ?       ? 
1 1 1   39   14   24 o    356.2    2.4    0.0000   0.0000          ?        ?  1268.7424  17.2401          ?        ?      356.2        2.4       ?       ? 
1 1 1   39   14   25 o    579.2    2.6    0.0000   0.0000          ?        ?  3356.0696  30.6490          ?        ?      579.2        2.6       ?       ? 
1 1 1   39   14   26 o    202.6    3.3    0.0000   0.0000          ?        ?   410.5694  13.4090          ?        ?      202.6        3.3       ?       ? 
1 1 1   39   14   27 o    172.6    3.9    0.0000   0.0000          ?        ?   298.1896  13.4090          ?        ?      172.6        3.9       ?       ? 
1 1 1   39   14   28 o    139.9    5.0    0.0000   0.0000          ?        ?   196.0261  14.0475          ?        ?      139.9        5.0       ?       ? 
1 1 1   39   14   29 o    151.5    4.6    0.0000   0.0000          ?        ?   229.8678  14.0475          ?        ?      151.5        4.6       ?       ? 
1 1 1   39   14   30 o    676.0    2.8    0.0000   0.0000          ?        ?  4571.1763  37.6728          ?        ?      676.0        2.8       ?       ? 
1 1 1   39   14   31 o    254.3    3.3    0.0000   0.0000          ?        ?   646.8224  16.6016          ?        ?      254.3        3.3       ?       ? 
1 1 1   39   14   32 o    197.4    3.7    0.0000   0.0000          ?        ?   390.1367  14.6860          ?        ?      197.4        3.7       ?       ? 
1 1 1   39   14   33 o    316.7    2.7    0.0000   0.0000          ?        ?  1003.1175  17.2401          ?        ?      316.7        2.7       ?       ? 
1 1 1   39   14   34 o    167.9    4.6    0.0000   0.0000          ?        ?   282.2266  15.3245          ?        ?      167.9        4.6       ?       ? 
1 1 1   39   14   35 o    270.1    3.2    0.0000   0.0000          ?        ?   729.8303  17.2401          ?        ?      270.1        3.2       ?       ? 
1 1 1   39   14   36 o    414.0    2.6    0.0000   0.0000          ?        ?  1715.0691  21.7097          ?        ?      414.0        2.6       ?       ? 
1 1 1   39   14   37 o    407.2    2.6    0.0000   0.0000          ?        ?  1658.8792  21.0712          ?        ?      407.2        2.6       ?       ? 
1 1 1   39   14   38 o    464.7    2.6    0.0000   0.0000          ?        ?  2160.7571  24.2638          ?        ?      464.7        2.6       ?       ? 
1 1 1   39   14   39 o     69.4   11.0    0.0000   0.0000          ?        ?    48.5276  15.3245          ?        ?       69.4       11.0       ?       ? 
1 1 1   39   14   40 o    208.7    3.8    0.0000   0.0000          ?        ?   436.1103  15.9630          ?        ?      208.7        3.8       ?       ? 
1 1 1   39   14   41 o    252.6    3.5    0.0000   0.0000          ?        ?   638.5216  17.8786          ?        ?      252.6        3.5       ?       ? 
1 1 1   39   14   42 o    167.5    4.8    0.0000   0.0000          ?        ?   280.9495  15.9630          ?        ?      167.5        4.8       ?       ? 
1 1 1   39   14   43 o    252.4    3.5    0.0000   0.0000          ?        ?   637.8831  17.8786          ?        ?      252.4        3.5       ?       ? 
1 1 1   39   14   44 o    224.0    4.0    0.0000   0.0000          ?        ?   502.5165  17.8786          ?        ?      224.0        4.0       ?       ? 
1 1 1   39   14   45 f     22.6   11.1    0.0000   0.0000          ?        ?   -38.3113  17.8786          ?        ?       22.6       11.1       ?       ? 
1 1 1   39   14   46 o    273.5    3.5    0.0000   0.0000          ?        ?   748.9859  19.1556          ?        ?      273.5        3.5       ?       ? 
1 1 1   39   14   47 o    250.3    4.0    0.0000   0.0000          ?        ?   627.6667  19.7942          ?        ?      250.3        4.0       ?       ? 
1 1 1   39   14   48 o     31.8   14.1    0.0000   0.0000          ?        ?    -5.7467  17.8786          ?        ?       31.8       14.1       ?       ? 
1 1 1   39   14   49 o    280.0    3.6    0.0000   0.0000          ?        ?   785.3816  20.4327          ?        ?      280.0        3.6       ?       ? 
1 1 1   39   14   50 o    229.8    4.3    0.0000   0.0000          ?        ?   529.3344  19.7942          ?        ?      229.8        4.3       ?       ? 
1 1 1   39   14   51 o     21.8   10.9    0.0000   0.0000          ?        ?   -49.8047  19.1556          ?        ?       21.8       10.9       ?       ? 
1 1 1   39   14   52 o     25.8   12.3    0.0000   0.0000          ?        ?   -23.6253  17.8786          ?        ?       25.8       12.3       ?       ? 
1 1 1   39   14   53 o    143.2    6.7    0.0000   0.0000          ?        ?   206.2425  19.1556          ?        ?      143.2        6.7       ?       ? 
1 1 1   39   14   54 o     86.8   10.7    0.0000   0.0000          ?        ?    76.6226  18.5171          ?        ?       86.8       10.7       ?       ? 
1 1 1   39   14   55 o    153.1    5.8    0.0000   0.0000          ?        ?   235.6145  17.8786          ?        ?      153.1        5.8       ?       ? 
1 1 1   39   14   56 o     65.3   14.5    0.0000   0.0000          ?        ?    45.9736  18.5171          ?        ?       65.3       14.5       ?       ? 
1 1 1   39   14   57 o    123.1    7.3    0.0000   0.0000          ?        ?   153.2452  17.8786          ?        ?      123.1        7.3       ?       ? 
1 1 1   39   15    0 o    264.3    4.6  699.1812  24.2638   699.1812  24.2638   699.1812  24.2638      264.3      4.6      264.3        4.6     0.0     0.0 
1 1 1   39   15    1 o    574.2    2.9    0.0000   0.0000          ?        ?  3297.3259  33.2031          ?        ?      574.2        2.9       ?       ? 
1 1 1   39   15    2 o    452.7    2.8    0.0000   0.0000          ?        ?  2050.2930  25.5409          ?        ?      452.7        2.8       ?       ? 
1 1 1   39   15    3 o    261.3    3.1    0.0000   0.0000          ?        ?   683.2181  15.9630          ?        ?      261.3        3.1       ?       ? 
1 1 1   39   15    4 o    382.3    2.8    0.0000   0.0000          ?        ?  1461.5759  21.0712          ?        ?      382.3        2.8       ?       ? 
1 1 1   39   15    5 o    397.1    2.6    0.0000   0.0000          ?        ?  1577.1484  20.4327          ?        ?      397.1        2.6       ?       ? 
1 1 1   39   15    6 f    325.5    2.5    0.0000   0.0000          ?        ?  1059.9459  15.9630          ?        ?      325.5        2.5       ?       ? 
1 1 1   39   15    7 o    159.4    3.6    0.0000   0.0000          ?        ?   254.1316  11.4934          ?        ?      159.4        3.6       ?       ? 
1 1 1   39   15    8 o    164.1    3.5    0.0000   0.0000          ?        ?   269.4561  11.4934          ?        ?      164.1        3.5       ?       ? 
1 1 1   39   15    9 o    567.4    2.6    0.0000   0.0000          ?        ?  3220.0645  30.0105          ?        ?      567.4        2.6       ?       ? 
1 1 1   39   15   10 o    204.0    2.8    0.0000   0.0000          ?        ?   416.3161  11.4934          ?        ?      204.0        2.8       ?       ? 
1 1 1   39   15   11 o    120.4    4.5    0.0000   0.0000          ?        ?   144.9444  10.8549          ?        ?      120.4        4.5       ?       ? 
1 1 1   39   15   12 o    345.4    2.4    0.0000   0.0000          ?        ?  1193.3969  16.6016          ?        ?      345.4        2.4       ?       ? 
1 1 1   39   15   13 o    256.2    2.6    0.0000   0.0000          ?        ?   656.4003  13.4090          ?        ?      256.2        2.6       ?       ? 
1 1 1   39   15   14 o    114.4    4.7    0.0000   0.0000          ?        ?   130.8969  10.8549          ?        ?      114.4        4.7       ?       ? 
1 1 1   39   15   15 o     83.4    6.1    0.0000   0.0000          ?        ?    69.5989  10.2163          ?        ?       83.4        6.1       ?       ? 
1 1 1   39   15   16 o     79.0    6.9    0.0000   0.0000          ?        ?    62.5751  10.8549          ?        ?       79.0        6.9       ?       ? 
1 1 1   39   15   17 o    138.1    4.2    0.0000   0.0000          ?        ?   190.9180  11.4934          ?        ?      138.1        4.2       ?       ? 
1 1 1   39   15   18 o    462.7    2.5    0.0000   0.0000          ?        ?  2141.6016  22.9868          ?        ?      462.7        2.5       ?       ? 
1 1 1   39   15   19 o     19.6    9.5    0.0000   0.0000          ?        ?   -19.1556  11.4934          ?        ?       19.6        9.5       ?       ? 
1 1 1   39   15   20 o    512.6    2.6    0.0000   0.0000          ?        ?  2628.1550  26.1794          ?        ?      512.6        2.6       ?       ? 
1 1 1   39   15   21 o    389.5    2.4    0.0000   0.0000          ?        ?  1517.7659  18.5171          ?        ?      389.5        2.4       ?       ? 
1 1 1   39   15   22 o    181.1    3.5    0.0000   0.0000          ?        ?   328.2001  12.7704          ?        ?      181.1        3.5       ?       ? 
1 1 1   39   15   23 o    277.1    2.8    0.0000   0.0000          ?        ?   768.1415  15.3245          ?        ?      277.1        2.8       ?       ? 
1 1 1   39   15   24 o    380.5    2.5    0.0000   0.0000          ?        ?  1448.1671  19.1556          ?        ?      380.5        2.5       ?       ? 
1 1 1   39   15   25 o    219.4    3.3    0.0000   0.0000          ?        ?   481.4453  14.6860          ?        ?      219.4        3.3       ?       ? 
1 1 1   39   15   26 o    169.8    3.9    0.0000   0.0000          ?        ?   288.6118  13.4090          ?        ?      169.8        3.9       ?       ? 
1 1 1   39   15   27 o    237.7    3.0    0.0000   0.0000          ?        ?   565.0916  14.0475          ?        ?      237.7        3.0       ?       ? 
1 1 1   39   15   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   15   29 o    195.0    3.9    0.0000   0.0000          ?        ?   380.5589  15.3245          ?        ?      195.0        3.9       ?       ? 
1 1 1   39   15   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   15   31 o     95.1    7.7    0.0000   0.0000          ?        ?    90.6701  14.6860          ?        ?       95.1        7.7       ?       ? 
1 1 1   39   15   32 o    272.1    2.9    0.0000   0.0000          ?        ?   740.6851  15.9630          ?        ?      272.1        2.9       ?       ? 
1 1 1   39   15   33 o    318.0    2.6    0.0000   0.0000          ?        ?  1011.4182  16.6016          ?        ?      318.0        2.6       ?       ? 
1 1 1   39   15   34 o    179.5    4.1    0.0000   0.0000          ?        ?   322.4534  14.6860          ?        ?      179.5        4.1       ?       ? 
1 1 1   39   15   35 o    325.3    2.8    0.0000   0.0000          ?        ?  1058.6688  18.5171          ?        ?      325.3        2.8       ?       ? 
1 1 1   39   15   36 o    122.1    6.3    0.0000   0.0000          ?        ?   149.4141  15.3245          ?        ?      122.1        6.3       ?       ? 
1 1 1   39   15   37 o    506.2    2.6    0.0000   0.0000          ?        ?  2563.6643  26.8179          ?        ?      506.2        2.6       ?       ? 
1 1 1   39   15   38 o    108.5    7.4    0.0000   0.0000          ?        ?   118.1265  15.9630          ?        ?      108.5        7.4       ?       ? 
1 1 1   39   15   39 o     26.1   12.2    0.0000   0.0000          ?        ?   -15.9630  15.9630          ?        ?       26.1       12.2       ?       ? 
1 1 1   39   15   40 o    143.4    5.8    0.0000   0.0000          ?        ?   206.2425  16.6016          ?        ?      143.4        5.8       ?       ? 
1 1 1   39   15   41 o     60.8   13.5    0.0000   0.0000          ?        ?    38.9498  15.9630          ?        ?       60.8       13.5       ?       ? 
1 1 1   39   15   42 o    225.0    4.0    0.0000   0.0000          ?        ?   506.9862  17.8786          ?        ?      225.0        4.0       ?       ? 
1 1 1   39   15   43 o    228.5    3.9    0.0000   0.0000          ?        ?   522.9492  17.8786          ?        ?      228.5        3.9       ?       ? 
1 1 1   39   15   44 o    238.1    3.6    0.0000   0.0000          ?        ?   567.6458  17.2401          ?        ?      238.1        3.6       ?       ? 
1 1 1   39   15   45 o    448.9    2.7    0.0000   0.0000          ?        ?  2016.4512  24.2638          ?        ?      448.9        2.7       ?       ? 
1 1 1   39   15   46 o    340.3    3.0    0.0000   0.0000          ?        ?  1158.9167  20.4327          ?        ?      340.3        3.0       ?       ? 
1 1 1   39   15   47 o    278.8    3.5    0.0000   0.0000          ?        ?   778.3578  19.7942          ?        ?      278.8        3.5       ?       ? 
1 1 1   39   15   48 f    351.2    3.1    0.0000   0.0000          ?        ?  1234.9008  21.7097          ?        ?      351.2        3.1       ?       ? 
1 1 1   39   15   49 o     47.6   16.2    0.0000   0.0000          ?        ?    21.7097  18.5171          ?        ?       47.6       16.2       ?       ? 
1 1 1   39   15   50 o     93.0   10.0    0.0000   0.0000          ?        ?    87.4775  18.5171          ?        ?       93.0       10.0       ?       ? 
1 1 1   39   15   51 o     88.4   10.1    0.0000   0.0000          ?        ?    79.1767  17.8786          ?        ?       88.4       10.1       ?       ? 
1 1 1   39   15   52 o    170.4    5.6    0.0000   0.0000          ?        ?   291.8044  19.1556          ?        ?      170.4        5.6       ?       ? 
1 1 1   39   15   53 o    163.4    5.7    0.0000   0.0000          ?        ?   268.1791  18.5171          ?        ?      163.4        5.7       ?       ? 
1 1 1   39   15   54 o     68.0   13.6    0.0000   0.0000          ?        ?    49.1662  17.8786          ?        ?       68.0       13.6       ?       ? 
1 1 1   39   15   55 f     28.6   13.4    0.0000   0.0000          ?        ?   -17.8786  19.1556          ?        ?       28.6       13.4       ?       ? 
1 1 1   39   15   56 o     80.4   11.5    0.0000   0.0000          ?        ?    66.4062  18.5171          ?        ?       80.4       11.5       ?       ? 
1 1 1   39   16    0 o     13.9   10.2  -37.6728  16.6016   -37.6728  16.6016   -37.6728  16.6016       13.9     10.2       13.9       10.2     0.0     0.0 
1 1 1   39   16    1 o    177.0    3.8    0.0000   0.0000          ?        ?   313.5141  13.4090          ?        ?      177.0        3.8       ?       ? 
1 1 1   39   16    2 o    371.7    2.7    0.0000   0.0000          ?        ?  1381.7607  19.7942          ?        ?      371.7        2.7       ?       ? 
1 1 1   39   16    3 o    671.1    3.2    0.0000   0.0000          ?        ?  4505.4082  43.4195          ?        ?      671.1        3.2       ?       ? 
1 1 1   39   16    4 o    184.4    3.8    0.0000   0.0000          ?        ?   340.3320  14.0475          ?        ?      184.4        3.8       ?       ? 
1 1 1   39   16    5 o    133.9    4.8    0.0000   0.0000          ?        ?   179.4246  12.7704          ?        ?      133.9        4.8       ?       ? 
1 1 1   39   16    6 o    336.4    2.5    0.0000   0.0000          ?        ?  1132.0989  16.6016          ?        ?      336.4        2.5       ?       ? 
1 1 1   39   16    7 o    354.9    2.4    0.0000   0.0000          ?        ?  1259.8032  17.2401          ?        ?      354.9        2.4       ?       ? 
1 1 1   39   16    8 o    493.4    2.6    0.0000   0.0000          ?        ?  2435.3215  25.5409          ?        ?      493.4        2.6       ?       ? 
1 1 1   39   16    9 o    518.1    2.6    0.0000   0.0000          ?        ?  2684.3450  26.8179          ?        ?      518.1        2.6       ?       ? 
1 1 1   39   16   10 o     17.0    8.5    0.0000   0.0000          ?        ?   -33.8416  12.1319          ?        ?       17.0        8.5       ?       ? 
1 1 1   39   16   11 o    143.6    3.3    0.0000   0.0000          ?        ?   206.2425   9.5778          ?        ?      143.6        3.3       ?       ? 
1 1 1   39   16   12 o    120.9    4.8    0.0000   0.0000          ?        ?   146.2215  11.4934          ?        ?      120.9        4.8       ?       ? 
1 1 1   39   16   13 o    178.1    3.2    0.0000   0.0000          ?        ?   317.3452  11.4934          ?        ?      178.1        3.2       ?       ? 
1 1 1   39   16   14 o    331.4    2.3    0.0000   0.0000          ?        ?  1098.2572  15.3245          ?        ?      331.4        2.3       ?       ? 
1 1 1   39   16   15 o    358.2    2.3    0.0000   0.0000          ?        ?  1283.4285  16.6016          ?        ?      358.2        2.3       ?       ? 
1 1 1   39   16   16 o    103.2    5.6    0.0000   0.0000          ?        ?   106.6331  11.4934          ?        ?      103.2        5.6       ?       ? 
1 1 1   39   16   17 o    229.9    2.9    0.0000   0.0000          ?        ?   528.6959  13.4090          ?        ?      229.9        2.9       ?       ? 
1 1 1   39   16   18 o    207.0    3.1    0.0000   0.0000          ?        ?   428.4480  12.7704          ?        ?      207.0        3.1       ?       ? 
1 1 1   39   16   19 o    361.0    2.5    0.0000   0.0000          ?        ?  1303.8611  17.8786          ?        ?      361.0        2.5       ?       ? 
1 1 1   39   16   20 o    508.7    2.5    0.0000   0.0000          ?        ?  2588.5667  25.5409          ?        ?      508.7        2.5       ?       ? 
1 1 1   39   16   21 o    349.1    2.6    0.0000   0.0000          ?        ?  1218.9377  17.8786          ?        ?      349.1        2.6       ?       ? 
1 1 1   39   16   22 o    470.4    2.6    0.0000   0.0000          ?        ?  2213.7546  24.2638          ?        ?      470.4        2.6       ?       ? 
1 1 1   39   16   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   16   24 o    206.6    3.4    0.0000   0.0000          ?        ?   427.1710  14.0475          ?        ?      206.6        3.4       ?       ? 
1 1 1   39   16   25 o    107.7    5.9    0.0000   0.0000          ?        ?   116.2109  12.7704          ?        ?      107.7        5.9       ?       ? 
1 1 1   39   16   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   16   27 o    237.5    3.1    0.0000   0.0000          ?        ?   564.4531  14.6860          ?        ?      237.5        3.1       ?       ? 
1 1 1   39   16   28 o    350.5    2.6    0.0000   0.0000          ?        ?  1229.1542  17.8786          ?        ?      350.5        2.6       ?       ? 
1 1 1   39   16   29 o    164.3    4.5    0.0000   0.0000          ?        ?   270.0946  14.6860          ?        ?      164.3        4.5       ?       ? 
1 1 1   39   16   30 o    157.3    4.5    0.0000   0.0000          ?        ?   247.7464  14.0475          ?        ?      157.3        4.5       ?       ? 
1 1 1   39   16   31 o    639.6    2.8    0.0000   0.0000          ?        ?  4092.2852  36.3957          ?        ?      639.6        2.8       ?       ? 
1 1 1   39   16   32 o    140.8    5.2    0.0000   0.0000          ?        ?   198.5802  14.6860          ?        ?      140.8        5.2       ?       ? 
1 1 1   39   16   33 o    246.9    3.2    0.0000   0.0000          ?        ?   609.7881  15.9630          ?        ?      246.9        3.2       ?       ? 
1 1 1   39   16   34 o    326.6    2.7    0.0000   0.0000          ?        ?  1066.9697  17.8786          ?        ?      326.6        2.7       ?       ? 
1 1 1   39   16   35 o    225.2    3.5    0.0000   0.0000          ?        ?   507.6247  15.9630          ?        ?      225.2        3.5       ?       ? 
1 1 1   39   16   36 o    168.1    4.7    0.0000   0.0000          ?        ?   282.8651  15.9630          ?        ?      168.1        4.7       ?       ? 
1 1 1   39   16   37 o    216.8    4.0    0.0000   0.0000          ?        ?   470.5904  17.2401          ?        ?      216.8        4.0       ?       ? 
1 1 1   39   16   38 o    239.2    3.5    0.0000   0.0000          ?        ?   572.7539  16.6016          ?        ?      239.2        3.5       ?       ? 
1 1 1   39   16   39 o    155.2    5.3    0.0000   0.0000          ?        ?   241.3612  16.6016          ?        ?      155.2        5.3       ?       ? 
1 1 1   39   16   40 o    365.0    2.8    0.0000   0.0000          ?        ?  1333.2332  20.4327          ?        ?      365.0        2.8       ?       ? 
1 1 1   39   16   41 o    108.5    7.4    0.0000   0.0000          ?        ?   118.1265  15.9630          ?        ?      108.5        7.4       ?       ? 
1 1 1   39   16   42 o     50.4   15.2    0.0000   0.0000          ?        ?    26.1794  16.6016          ?        ?       50.4       15.2       ?       ? 
1 1 1   39   16   43 o     34.1   14.5    0.0000   0.0000          ?        ?     0.6385  17.2401          ?        ?       34.1       14.5       ?       ? 
1 1 1   39   16   44 o    299.0    3.2    0.0000   0.0000          ?        ?   894.5688  19.1556          ?        ?      299.0        3.2       ?       ? 
1 1 1   39   16   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   16   46 o     22.3   11.0    0.0000   0.0000          ?        ?   -39.5883  17.8786          ?        ?       22.3       11.0       ?       ? 
1 1 1   39   16   47 o    352.8    3.0    0.0000   0.0000          ?        ?  1245.7557  21.0712          ?        ?      352.8        3.0       ?       ? 
1 1 1   39   16   48 o    143.3    6.5    0.0000   0.0000          ?        ?   206.2425  18.5171          ?        ?      143.3        6.5       ?       ? 
1 1 1   39   16   49 o    378.7    2.9    0.0000   0.0000          ?        ?  1435.3966  21.7097          ?        ?      378.7        2.9       ?       ? 
1 1 1   39   16   50 o     20.5   10.3    0.0000   0.0000          ?        ?   -49.8047  17.8786          ?        ?       20.5       10.3       ?       ? 
1 1 1   39   16   51 o    187.1    4.9    0.0000   0.0000          ?        ?   351.1869  18.5171          ?        ?      187.1        4.9       ?       ? 
1 1 1   39   16   52 o    245.5    3.9    0.0000   0.0000          ?        ?   604.0414  19.1556          ?        ?      245.5        3.9       ?       ? 
1 1 1   39   16   53 o    180.9    5.1    0.0000   0.0000          ?        ?   328.8386  18.5171          ?        ?      180.9        5.1       ?       ? 
1 1 1   39   16   54 f     21.0   10.5    0.0000   0.0000          ?        ?   -46.6121  17.8786          ?        ?       21.0       10.5       ?       ? 
1 1 1   39   16   55 o     83.9   11.0    0.0000   0.0000          ?        ?    72.1529  18.5171          ?        ?       83.9       11.0       ?       ? 
1 1 1   39   16   56 o    181.5    5.1    0.0000   0.0000          ?        ?   331.3927  18.5171          ?        ?      181.5        5.1       ?       ? 
1 1 1   39   17    0 o    453.0    4.0 2052.8469  36.3957  2052.8469  36.3957  2052.8469  36.3957      453.0      4.0      453.0        4.0     0.0     0.0 
1 1 1   39   17    1 o    257.2    3.0    0.0000   0.0000          ?        ?   661.5084  15.3245          ?        ?      257.2        3.0       ?       ? 
1 1 1   39   17    2 o    288.6    3.0    0.0000   0.0000          ?        ?   833.2708  17.2401          ?        ?      288.6        3.0       ?       ? 
1 1 1   39   17    3 o    412.3    2.9    0.0000   0.0000          ?        ?  1700.3831  24.2638          ?        ?      412.3        2.9       ?       ? 
1 1 1   39   17    4 o    393.9    2.9    0.0000   0.0000          ?        ?  1552.2461  22.9868          ?        ?      393.9        2.9       ?       ? 
1 1 1   39   17    5 o    198.1    4.2    0.0000   0.0000          ?        ?   392.6908  16.6016          ?        ?      198.1        4.2       ?       ? 
1 1 1   39   17    6 o    752.1    3.7    0.0000   0.0000          ?        ?  5659.8560  55.5514          ?        ?      752.1        3.7       ?       ? 
1 1 1   39   17    7 o    511.6    2.7    0.0000   0.0000          ?        ?  2617.9387  28.0950          ?        ?      511.6        2.7       ?       ? 
1 1 1   39   17    8 o    213.9    2.7    0.0000   0.0000          ?        ?   457.8200  11.4934          ?        ?      213.9        2.7       ?       ? 
1 1 1   39   17    9 o    305.9    2.5    0.0000   0.0000          ?        ?   936.0728  15.3245          ?        ?      305.9        2.5       ?       ? 
1 1 1   39   17   10 o    356.8    2.4    0.0000   0.0000          ?        ?  1273.2120  17.2401          ?        ?      356.8        2.4       ?       ? 
1 1 1   39   17   11 o    235.2    3.0    0.0000   0.0000          ?        ?   553.5982  14.0475          ?        ?      235.2        3.0       ?       ? 
1 1 1   39   17   12 o    480.1    2.7    0.0000   0.0000          ?        ?  2305.7017  26.1794          ?        ?      480.1        2.7       ?       ? 
1 1 1   39   17   13 o    360.6    2.3    0.0000   0.0000          ?        ?  1300.6686  16.6016          ?        ?      360.6        2.3       ?       ? 
1 1 1   39   17   14 o    168.1    3.4    0.0000   0.0000          ?        ?   282.8651  11.4934          ?        ?      168.1        3.4       ?       ? 
1 1 1   39   17   15 o    129.3    4.4    0.0000   0.0000          ?        ?   167.2927  11.4934          ?        ?      129.3        4.4       ?       ? 
1 1 1   39   17   16 o    502.7    2.9    0.0000   0.0000          ?        ?  2527.9070  29.3720          ?        ?      502.7        2.9       ?       ? 
1 1 1   39   17   17 o    256.5    2.7    0.0000   0.0000          ?        ?   658.3158  14.0475          ?        ?      256.5        2.7       ?       ? 
1 1 1   39   17   18 o    264.7    2.7    0.0000   0.0000          ?        ?   701.0967  14.0475          ?        ?      264.7        2.7       ?       ? 
1 1 1   39   17   19 o    589.4    2.7    0.0000   0.0000          ?        ?  3474.8347  31.9261          ?        ?      589.4        2.7       ?       ? 
1 1 1   39   17   20 o    305.7    2.6    0.0000   0.0000          ?        ?   934.7956  15.9630          ?        ?      305.7        2.6       ?       ? 
1 1 1   39   17   21 f    246.3    2.7    0.0000   0.0000          ?        ?   606.5955  13.4090          ?        ?      246.3        2.7       ?       ? 
1 1 1   39   17   22 o     57.1   11.0    0.0000   0.0000          ?        ?    33.8416  12.1319          ?        ?       57.1       11.0       ?       ? 
1 1 1   39   17   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   17   24 o    332.1    2.6    0.0000   0.0000          ?        ?  1103.3654  17.2401          ?        ?      332.1        2.6       ?       ? 
1 1 1   39   17   25 o    160.5    4.0    0.0000   0.0000          ?        ?   257.9627  12.7704          ?        ?      160.5        4.0       ?       ? 
1 1 1   39   17   26 o    332.5    2.5    0.0000   0.0000          ?        ?  1105.9194  16.6016          ?        ?      332.5        2.5       ?       ? 
1 1 1   39   17   27 o    391.6    2.5    0.0000   0.0000          ?        ?  1533.7289  19.7942          ?        ?      391.6        2.5       ?       ? 
1 1 1   39   17   28 o    183.9    3.8    0.0000   0.0000          ?        ?   338.4165  14.0475          ?        ?      183.9        3.8       ?       ? 
1 1 1   39   17   29 o     33.5   13.7    0.0000   0.0000          ?        ?     3.8311  14.6860          ?        ?       33.5       13.7       ?       ? 
1 1 1   39   17   30 o    124.7    5.9    0.0000   0.0000          ?        ?   155.7993  14.6860          ?        ?      124.7        5.9       ?       ? 
1 1 1   39   17   31 o    270.5    3.1    0.0000   0.0000          ?        ?   732.3843  16.6016          ?        ?      270.5        3.1       ?       ? 
1 1 1   39   17   32 o    287.7    2.9    0.0000   0.0000          ?        ?   828.1625  16.6016          ?        ?      287.7        2.9       ?       ? 
1 1 1   39   17   33 o    271.5    2.9    0.0000   0.0000          ?        ?   737.4925  15.9630          ?        ?      271.5        2.9       ?       ? 
1 1 1   39   17   34 o     95.4    7.7    0.0000   0.0000          ?        ?    91.3086  14.6860          ?        ?       95.4        7.7       ?       ? 
1 1 1   39   17   35 o     23.6   11.3    0.0000   0.0000          ?        ?   -21.7097  15.3245          ?        ?       23.6       11.3       ?       ? 
1 1 1   39   17   36 o    368.5    2.8    0.0000   0.0000          ?        ?  1358.7740  20.4327          ?        ?      368.5        2.8       ?       ? 
1 1 1   39   17   37 o    188.5    4.4    0.0000   0.0000          ?        ?   355.6566  16.6016          ?        ?      188.5        4.4       ?       ? 
1 1 1   39   17   38 o     20.5   10.2    0.0000   0.0000          ?        ?   -38.3113  15.9630          ?        ?       20.5       10.2       ?       ? 
1 1 1   39   17   39 o     36.1   14.5    0.0000   0.0000          ?        ?     6.3852  15.9630          ?        ?       36.1       14.5       ?       ? 
1 1 1   39   17   40 o    175.7    4.5    0.0000   0.0000          ?        ?   309.0445  15.9630          ?        ?      175.7        4.5       ?       ? 
1 1 1   39   17   41 o    160.6    5.0    0.0000   0.0000          ?        ?   258.6013  15.9630          ?        ?      160.6        5.0       ?       ? 
1 1 1   39   17   42 o    189.9    4.4    0.0000   0.0000          ?        ?   361.4032  16.6016          ?        ?      189.9        4.4       ?       ? 
1 1 1   39   17   43 o    144.0    6.0    0.0000   0.0000          ?        ?   208.1580  17.2401          ?        ?      144.0        6.0       ?       ? 
1 1 1   39   17   44 o     30.8   13.6    0.0000   0.0000          ?        ?    -5.1082  16.6016          ?        ?       30.8       13.6       ?       ? 
1 1 1   39   17   45 o     61.5   14.7    0.0000   0.0000          ?        ?    40.2269  17.8786          ?        ?       61.5       14.7       ?       ? 
1 1 1   39   17   46 o     38.2   15.2    0.0000   0.0000          ?        ?     8.3008  17.2401          ?        ?       38.2       15.2       ?       ? 
1 1 1   39   17   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   17   48 o     25.6   12.2    0.0000   0.0000          ?        ?   -21.7097  17.2401          ?        ?       25.6       12.2       ?       ? 
1 1 1   39   17   49 o    161.6    5.9    0.0000   0.0000          ?        ?   262.4324  19.1556          ?        ?      161.6        5.9       ?       ? 
1 1 1   39   17   50 o    231.6    4.1    0.0000   0.0000          ?        ?   537.6352  19.1556          ?        ?      231.6        4.1       ?       ? 
1 1 1   39   17   51 o    234.8    4.1    0.0000   0.0000          ?        ?   552.9597  19.1556          ?        ?      234.8        4.1       ?       ? 
1 1 1   39   17   52 o    213.8    4.5    0.0000   0.0000          ?        ?   458.4586  19.1556          ?        ?      213.8        4.5       ?       ? 
1 1 1   39   17   53 o    155.9    5.7    0.0000   0.0000          ?        ?   244.5538  17.8786          ?        ?      155.9        5.7       ?       ? 
1 1 1   39   17   54 f    166.2    5.6    0.0000   0.0000          ?        ?   277.7569  18.5171          ?        ?      166.2        5.6       ?       ? 
1 1 1   39   17   55 o     53.8   15.3    0.0000   0.0000          ?        ?    31.2876  17.2401          ?        ?       53.8       15.3       ?       ? 
1 1 1   39   18    0 o    355.7    4.0 1266.1884  28.7335  1266.1884  28.7335  1266.1884  28.7335      355.7      4.0      355.7        4.0     0.0     0.0 
1 1 1   39   18    1 o    150.3    4.2    0.0000   0.0000          ?        ?   226.0367  12.7704          ?        ?      150.3        4.2       ?       ? 
1 1 1   39   18    2 o    331.5    2.7    0.0000   0.0000          ?        ?  1098.8958  17.8786          ?        ?      331.5        2.7       ?       ? 
1 1 1   39   18    3 f    471.2    2.8    0.0000   0.0000          ?        ?  2220.7781  26.1794          ?        ?      471.2        2.8       ?       ? 
1 1 1   39   18    4 o    233.6    3.0    0.0000   0.0000          ?        ?   545.9360  14.0475          ?        ?      233.6        3.0       ?       ? 
1 1 1   39   18    5 o    437.9    2.8    0.0000   0.0000          ?        ?  1918.1189  24.2638          ?        ?      437.9        2.8       ?       ? 
1 1 1   39   18    6 o    487.9    2.9    0.0000   0.0000          ?        ?  2381.0471  28.0950          ?        ?      487.9        2.9       ?       ? 
1 1 1   39   18    7 o    513.8    2.9    0.0000   0.0000          ?        ?  2640.9255  30.0105          ?        ?      513.8        2.9       ?       ? 
1 1 1   39   18    8 o    656.2    3.3    0.0000   0.0000          ?        ?  4308.1055  42.7809          ?        ?      656.2        3.3       ?       ? 
1 1 1   39   18    9 o    510.3    2.6    0.0000   0.0000          ?        ?  2604.5298  26.8179          ?        ?      510.3        2.6       ?       ? 
1 1 1   39   18   10 o    144.2    4.0    0.0000   0.0000          ?        ?   208.1580  11.4934          ?        ?      144.2        4.0       ?       ? 
1 1 1   39   18   11 o    214.4    3.1    0.0000   0.0000          ?        ?   459.7356  13.4090          ?        ?      214.4        3.1       ?       ? 
1 1 1   39   18   12 o    503.8    2.7    0.0000   0.0000          ?        ?  2538.7620  26.8179          ?        ?      503.8        2.7       ?       ? 
1 1 1   39   18   13 o    315.5    2.7    0.0000   0.0000          ?        ?   995.4552  17.2401          ?        ?      315.5        2.7       ?       ? 
1 1 1   39   18   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   18   15 o    210.2    2.7    0.0000   0.0000          ?        ?   441.8569  11.4934          ?        ?      210.2        2.7       ?       ? 
1 1 1   39   18   16 o    257.0    2.6    0.0000   0.0000          ?        ?   660.8699  13.4090          ?        ?      257.0        2.6       ?       ? 
1 1 1   39   18   17 o    185.3    3.4    0.0000   0.0000          ?        ?   343.5246  12.7704          ?        ?      185.3        3.4       ?       ? 
1 1 1   39   18   18 o    194.2    3.3    0.0000   0.0000          ?        ?   377.3663  12.7704          ?        ?      194.2        3.3       ?       ? 
1 1 1   39   18   19 o     32.0   12.9    0.0000   0.0000          ?        ?     4.4697  12.7704          ?        ?       32.0       12.9       ?       ? 
1 1 1   39   18   20 o    280.2    2.8    0.0000   0.0000          ?        ?   785.3816  15.9630          ?        ?      280.2        2.8       ?       ? 
1 1 1   39   18   21 o    233.1    3.2    0.0000   0.0000          ?        ?   543.3819  14.6860          ?        ?      233.1        3.2       ?       ? 
1 1 1   39   18   22 o    375.2    2.4    0.0000   0.0000          ?        ?  1407.9402  17.8786          ?        ?      375.2        2.4       ?       ? 
1 1 1   39   18   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   18   24 o    110.0    5.8    0.0000   0.0000          ?        ?   121.3191  12.7704          ?        ?      110.0        5.8       ?       ? 
1 1 1   39   18   25 o    238.7    2.9    0.0000   0.0000          ?        ?   570.1998  14.0475          ?        ?      238.7        2.9       ?       ? 
1 1 1   39   18   26 o    248.0    3.0    0.0000   0.0000          ?        ?   615.5349  14.6860          ?        ?      248.0        3.0       ?       ? 
1 1 1   39   18   27 o    329.4    2.6    0.0000   0.0000          ?        ?  1085.4868  17.2401          ?        ?      329.4        2.6       ?       ? 
1 1 1   39   18   28 o    250.7    2.9    0.0000   0.0000          ?        ?   628.9438  14.6860          ?        ?      250.7        2.9       ?       ? 
1 1 1   39   18   29 o    270.1    3.0    0.0000   0.0000          ?        ?   729.8303  15.9630          ?        ?      270.1        3.0       ?       ? 
1 1 1   39   18   30 o     50.7   14.0    0.0000   0.0000          ?        ?    26.8179  14.6860          ?        ?       50.7       14.0       ?       ? 
1 1 1   39   18   31 o    274.4    2.9    0.0000   0.0000          ?        ?   753.4555  15.9630          ?        ?      274.4        2.9       ?       ? 
1 1 1   39   18   32 o    143.1    4.9    0.0000   0.0000          ?        ?   204.9654  14.0475          ?        ?      143.1        4.9       ?       ? 
1 1 1   39   18   33 o    217.6    3.7    0.0000   0.0000          ?        ?   473.7830  15.9630          ?        ?      217.6        3.7       ?       ? 
1 1 1   39   18   34 o    159.7    4.8    0.0000   0.0000          ?        ?   255.4086  15.3245          ?        ?      159.7        4.8       ?       ? 
1 1 1   39   18   35 o     61.0   12.5    0.0000   0.0000          ?        ?    38.9498  14.6860          ?        ?       61.0       12.5       ?       ? 
1 1 1   39   18   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   18   37 o    235.7    3.8    0.0000   0.0000          ?        ?   556.1523  17.8786          ?        ?      235.7        3.8       ?       ? 
1 1 1   39   18   38 o    352.3    2.8    0.0000   0.0000          ?        ?  1241.9246  19.7942          ?        ?      352.3        2.8       ?       ? 
1 1 1   39   18   39 o    180.0    4.4    0.0000   0.0000          ?        ?   324.3690  15.9630          ?        ?      180.0        4.4       ?       ? 
1 1 1   39   18   40 o     96.3    8.0    0.0000   0.0000          ?        ?    93.2242  15.3245          ?        ?       96.3        8.0       ?       ? 
1 1 1   39   18   41 o    215.3    3.7    0.0000   0.0000          ?        ?   464.2052  15.9630          ?        ?      215.3        3.7       ?       ? 
1 1 1   39   18   42 f     18.0    9.1    0.0000   0.0000          ?        ?   -59.3825  16.6016          ?        ?       18.0        9.1       ?       ? 
1 1 1   39   18   43 o    109.5    7.6    0.0000   0.0000          ?        ?   120.6806  16.6016          ?        ?      109.5        7.6       ?       ? 
1 1 1   39   18   44 o    223.8    4.0    0.0000   0.0000          ?        ?   501.8780  17.8786          ?        ?      223.8        4.0       ?       ? 
1 1 1   39   18   45 o    131.2    6.8    0.0000   0.0000          ?        ?   173.0394  17.8786          ?        ?      131.2        6.8       ?       ? 
1 1 1   39   18   46 o     24.4   11.8    0.0000   0.0000          ?        ?   -29.3720  17.8786          ?        ?       24.4       11.8       ?       ? 
1 1 1   39   18   47 o     81.3   10.6    0.0000   0.0000          ?        ?    67.0448  17.2401          ?        ?       81.3       10.6       ?       ? 
1 1 1   39   18   48 o    263.1    3.6    0.0000   0.0000          ?        ?   693.4344  19.1556          ?        ?      263.1        3.6       ?       ? 
1 1 1   39   18   49 o    224.2    4.1    0.0000   0.0000          ?        ?   503.7936  18.5171          ?        ?      224.2        4.1       ?       ? 
1 1 1   39   18   50 o    112.7    7.9    0.0000   0.0000          ?        ?   128.3428  17.8786          ?        ?      112.7        7.9       ?       ? 
1 1 1   39   18   51 o     82.6   11.2    0.0000   0.0000          ?        ?    69.5989  18.5171          ?        ?       82.6       11.2       ?       ? 
1 1 1   39   18   52 o    111.8    7.7    0.0000   0.0000          ?        ?   126.4273  17.2401          ?        ?      111.8        7.7       ?       ? 
1 1 1   39   18   53 o     24.2   11.8    0.0000   0.0000          ?        ?   -29.3720  17.8786          ?        ?       24.2       11.8       ?       ? 
1 1 1   39   19    0 o    325.4    4.2 1059.9459  27.4564  1059.9459  27.4564  1059.9459  27.4564      325.4      4.2      325.4        4.2     0.0     0.0 
1 1 1   39   19    1 o    393.1    2.9    0.0000   0.0000          ?        ?  1545.8608  22.9868          ?        ?      393.1        2.9       ?       ? 
1 1 1   39   19    2 o    186.3    3.9    0.0000   0.0000          ?        ?   347.3558  14.6860          ?        ?      186.3        3.9       ?       ? 
1 1 1   39   19    3 o    474.5    3.0    0.0000   0.0000          ?        ?  2252.7041  28.0950          ?        ?      474.5        3.0       ?       ? 
1 1 1   39   19    4 o    136.5    4.9    0.0000   0.0000          ?        ?   186.4483  13.4090          ?        ?      136.5        4.9       ?       ? 
1 1 1   39   19    5 o    328.6    3.0    0.0000   0.0000          ?        ?  1080.3785  19.7942          ?        ?      328.6        3.0       ?       ? 
1 1 1   39   19    6 o    140.2    4.3    0.0000   0.0000          ?        ?   196.6647  12.1319          ?        ?      140.2        4.3       ?       ? 
1 1 1   39   19    7 o    320.6    2.8    0.0000   0.0000          ?        ?  1028.0198  17.8786          ?        ?      320.6        2.8       ?       ? 
1 1 1   39   19    8 o    227.8    3.4    0.0000   0.0000          ?        ?   519.1181  15.3245          ?        ?      227.8        3.4       ?       ? 
1 1 1   39   19    9 o     33.0   12.0    0.0000   0.0000          ?        ?     8.9393  10.2163          ?        ?       33.0       12.0       ?       ? 
1 1 1   39   19   10 o    230.7    2.8    0.0000   0.0000          ?        ?   532.5270  12.7704          ?        ?      230.7        2.8       ?       ? 
1 1 1   39   19   11 o    248.4    3.0    0.0000   0.0000          ?        ?   617.4504  14.6860          ?        ?      248.4        3.0       ?       ? 
1 1 1   39   19   12 o    163.7    3.9    0.0000   0.0000          ?        ?   268.1791  12.7704          ?        ?      163.7        3.9       ?       ? 
1 1 1   39   19   13 o    248.1    2.8    0.0000   0.0000          ?        ?   615.5349  14.0475          ?        ?      248.1        2.8       ?       ? 
1 1 1   39   19   14 o    244.9    2.9    0.0000   0.0000          ?        ?   600.2103  14.0475          ?        ?      244.9        2.9       ?       ? 
1 1 1   39   19   15 o    218.7    2.6    0.0000   0.0000          ?        ?   478.2527  11.4934          ?        ?      218.7        2.6       ?       ? 
1 1 1   39   19   16 o     24.2   10.5    0.0000   0.0000          ?        ?    -1.9156   9.5778          ?        ?       24.2       10.5       ?       ? 
1 1 1   39   19   17 o    132.9    4.1    0.0000   0.0000          ?        ?   176.8705  10.8549          ?        ?      132.9        4.1       ?       ? 
1 1 1   39   19   18 o     93.5    5.5    0.0000   0.0000          ?        ?    87.4775  10.2163          ?        ?       93.5        5.5       ?       ? 
1 1 1   39   19   19 o    146.2    3.9    0.0000   0.0000          ?        ?   213.9047  11.4934          ?        ?      146.2        3.9       ?       ? 
1 1 1   39   19   20 o     77.4    7.8    0.0000   0.0000          ?        ?    60.0210  12.1319          ?        ?       77.4        7.8       ?       ? 
1 1 1   39   19   21 o    164.1    4.1    0.0000   0.0000          ?        ?   269.4561  13.4090          ?        ?      164.1        4.1       ?       ? 
1 1 1   39   19   22 o    259.4    3.0    0.0000   0.0000          ?        ?   673.0018  15.3245          ?        ?      259.4        3.0       ?       ? 
1 1 1   39   19   23 o    285.2    2.7    0.0000   0.0000          ?        ?   813.4766  15.3245          ?        ?      285.2        2.7       ?       ? 
1 1 1   39   19   24 o    215.8    3.1    0.0000   0.0000          ?        ?   466.1208  13.4090          ?        ?      215.8        3.1       ?       ? 
1 1 1   39   19   25 o    336.0    2.6    0.0000   0.0000          ?        ?  1129.5447  17.2401          ?        ?      336.0        2.6       ?       ? 
1 1 1   39   19   26 o     85.9    7.1    0.0000   0.0000          ?        ?    74.0685  12.1319          ?        ?       85.9        7.1       ?       ? 
1 1 1   39   19   27 o    334.8    2.6    0.0000   0.0000          ?        ?  1121.2440  17.2401          ?        ?      334.8        2.6       ?       ? 
1 1 1   39   19   28 o    161.1    4.4    0.0000   0.0000          ?        ?   259.8783  14.0475          ?        ?      161.1        4.4       ?       ? 
1 1 1   39   19   29 o    159.1    4.4    0.0000   0.0000          ?        ?   253.4931  14.0475          ?        ?      159.1        4.4       ?       ? 
1 1 1   39   19   30 o    234.0    3.4    0.0000   0.0000          ?        ?   547.8516  15.9630          ?        ?      234.0        3.4       ?       ? 
1 1 1   39   19   31 o    337.6    2.6    0.0000   0.0000          ?        ?  1140.3997  17.8786          ?        ?      337.6        2.6       ?       ? 
1 1 1   39   19   32 o    211.8    3.8    0.0000   0.0000          ?        ?   448.8807  15.9630          ?        ?      211.8        3.8       ?       ? 
1 1 1   39   19   33 o    201.1    3.8    0.0000   0.0000          ?        ?   404.8227  15.3245          ?        ?      201.1        3.8       ?       ? 
1 1 1   39   19   34 o    206.6    3.7    0.0000   0.0000          ?        ?   427.1710  15.3245          ?        ?      206.6        3.7       ?       ? 
1 1 1   39   19   35 o    131.6    5.8    0.0000   0.0000          ?        ?   173.6779  15.3245          ?        ?      131.6        5.8       ?       ? 
1 1 1   39   19   36 o     24.0   11.4    0.0000   0.0000          ?        ?   -20.4327  15.3245          ?        ?       24.0       11.4       ?       ? 
1 1 1   39   19   37 o     70.2   10.9    0.0000   0.0000          ?        ?    49.8047  15.3245          ?        ?       70.2       10.9       ?       ? 
1 1 1   39   19   38 o    239.3    3.7    0.0000   0.0000          ?        ?   573.3925  17.8786          ?        ?      239.3        3.7       ?       ? 
1 1 1   39   19   39 o    130.3    6.6    0.0000   0.0000          ?        ?   170.4853  17.2401          ?        ?      130.3        6.6       ?       ? 
1 1 1   39   19   40 o     20.6   10.2    0.0000   0.0000          ?        ?   -34.4802  15.3245          ?        ?       20.6       10.2       ?       ? 
1 1 1   39   19   41 o    227.0    3.8    0.0000   0.0000          ?        ?   515.9255  17.2401          ?        ?      227.0        3.8       ?       ? 
1 1 1   39   19   42 o    114.4    7.3    0.0000   0.0000          ?        ?   131.5355  16.6016          ?        ?      114.4        7.3       ?       ? 
1 1 1   39   19   43 o    272.0    3.3    0.0000   0.0000          ?        ?   740.6851  17.8786          ?        ?      272.0        3.3       ?       ? 
1 1 1   39   19   44 o     43.9   15.6    0.0000   0.0000          ?        ?    17.2401  17.2401          ?        ?       43.9       15.6       ?       ? 
1 1 1   39   19   45 f     88.1    9.8    0.0000   0.0000          ?        ?    78.5382  17.2401          ?        ?       88.1        9.8       ?       ? 
1 1 1   39   19   46 o     82.4   10.8    0.0000   0.0000          ?        ?    68.9603  17.8786          ?        ?       82.4       10.8       ?       ? 
1 1 1   39   19   47 o     24.4   11.8    0.0000   0.0000          ?        ?   -26.1794  17.2401          ?        ?       24.4       11.8       ?       ? 
1 1 1   39   19   48 o    162.4    5.7    0.0000   0.0000          ?        ?   264.9865  18.5171          ?        ?      162.4        5.7       ?       ? 
1 1 1   39   19   49 o     25.2   12.1    0.0000   0.0000          ?        ?   -25.5409  17.8786          ?        ?       25.2       12.1       ?       ? 
1 1 1   39   19   50 o    204.9    4.7    0.0000   0.0000          ?        ?   421.4243  19.1556          ?        ?      204.9        4.7       ?       ? 
1 1 1   39   19   51 o    206.3    4.5    0.0000   0.0000          ?        ?   427.1710  18.5171          ?        ?      206.3        4.5       ?       ? 
1 1 1   39   19   52 o     31.1   14.0    0.0000   0.0000          ?        ?    -8.3008  18.5171          ?        ?       31.1       14.0       ?       ? 
1 1 1   39   20    0 o    176.2    5.4  311.5985  19.1556   311.5985  19.1556   311.5985  19.1556      176.2      5.4      176.2        5.4     0.0     0.0 
1 1 1   39   20    1 o    229.9    3.2    0.0000   0.0000          ?        ?   528.6959  14.6860          ?        ?      229.9        3.2       ?       ? 
1 1 1   39   20    2 o    308.6    2.8    0.0000   0.0000          ?        ?   952.6743  17.2401          ?        ?      308.6        2.8       ?       ? 
1 1 1   39   20    3 o     47.5   12.1    0.0000   0.0000          ?        ?    23.6253  11.4934          ?        ?       47.5       12.1       ?       ? 
1 1 1   39   20    4 o    263.5    3.1    0.0000   0.0000          ?        ?   694.7115  16.6016          ?        ?      263.5        3.1       ?       ? 
1 1 1   39   20    5 o    530.9    3.1    0.0000   0.0000          ?        ?  2819.7114  33.2031          ?        ?      530.9        3.1       ?       ? 
1 1 1   39   20    6 o    140.6    5.4    0.0000   0.0000          ?        ?   197.9417  15.3245          ?        ?      140.6        5.4       ?       ? 
1 1 1   39   20    7 o    399.1    3.1    0.0000   0.0000          ?        ?  1593.1115  24.9023          ?        ?      399.1        3.1       ?       ? 
1 1 1   39   20    8 o    380.6    3.1    0.0000   0.0000          ?        ?  1449.4441  23.6253          ?        ?      380.6        3.1       ?       ? 
1 1 1   39   20    9 o    257.9    3.6    0.0000   0.0000          ?        ?   665.3395  18.5171          ?        ?      257.9        3.6       ?       ? 
1 1 1   39   20   10 o     42.4   12.2    0.0000   0.0000          ?        ?    18.5171  10.8549          ?        ?       42.4       12.2       ?       ? 
1 1 1   39   20   11 o    421.4    2.7    0.0000   0.0000          ?        ?  1776.3672  22.3483          ?        ?      421.4        2.7       ?       ? 
1 1 1   39   20   12 o    260.5    2.7    0.0000   0.0000          ?        ?   678.7485  14.0475          ?        ?      260.5        2.7       ?       ? 
1 1 1   39   20   13 f     99.4    5.5    0.0000   0.0000          ?        ?    98.9709  10.8549          ?        ?       99.4        5.5       ?       ? 
1 1 1   39   20   14 o    215.5    3.3    0.0000   0.0000          ?        ?   464.8438  14.0475          ?        ?      215.5        3.3       ?       ? 
1 1 1   39   20   15 o     86.7    7.0    0.0000   0.0000          ?        ?    75.3456  12.1319          ?        ?       86.7        7.0       ?       ? 
1 1 1   39   20   16 o    286.9    2.3    0.0000   0.0000          ?        ?   823.0543  13.4090          ?        ?      286.9        2.3       ?       ? 
1 1 1   39   20   17 o    410.4    2.4    0.0000   0.0000          ?        ?  1684.4199  19.7942          ?        ?      410.4        2.4       ?       ? 
1 1 1   39   20   18 o    217.6    2.8    0.0000   0.0000          ?        ?   473.7830  12.1319          ?        ?      217.6        2.8       ?       ? 
1 1 1   39   20   19 o    320.6    2.4    0.0000   0.0000          ?        ?  1028.0198  15.3245          ?        ?      320.6        2.4       ?       ? 
1 1 1   39   20   20 o    566.7    2.7    0.0000   0.0000          ?        ?  3213.0410  30.6490          ?        ?      566.7        2.7       ?       ? 
1 1 1   39   20   21 o    233.0    3.0    0.0000   0.0000          ?        ?   543.3819  14.0475          ?        ?      233.0        3.0       ?       ? 
1 1 1   39   20   22 o    411.6    2.5    0.0000   0.0000          ?        ?  1694.6364  20.4327          ?        ?      411.6        2.5       ?       ? 
1 1 1   39   20   23 o     67.7    8.5    0.0000   0.0000          ?        ?    45.9736  11.4934          ?        ?       67.7        8.5       ?       ? 
1 1 1   39   20   24 o    353.2    2.5    0.0000   0.0000          ?        ?  1247.6713  17.8786          ?        ?      353.2        2.5       ?       ? 
1 1 1   39   20   25 o     84.8    7.9    0.0000   0.0000          ?        ?    72.1529  13.4090          ?        ?       84.8        7.9       ?       ? 
1 1 1   39   20   26 o    387.6    2.5    0.0000   0.0000          ?        ?  1503.0798  19.1556          ?        ?      387.6        2.5       ?       ? 
1 1 1   39   20   27 o    214.9    3.6    0.0000   0.0000          ?        ?   462.2897  15.3245          ?        ?      214.9        3.6       ?       ? 
1 1 1   39   20   28 o    155.4    4.9    0.0000   0.0000          ?        ?   241.9997  15.3245          ?        ?      155.4        4.9       ?       ? 
1 1 1   39   20   29 o    399.6    2.6    0.0000   0.0000          ?        ?  1597.5811  21.0712          ?        ?      399.6        2.6       ?       ? 
1 1 1   39   20   30 o     81.3    8.6    0.0000   0.0000          ?        ?    66.4062  14.0475          ?        ?       81.3        8.6       ?       ? 
1 1 1   39   20   31 o    358.0    2.7    0.0000   0.0000          ?        ?  1282.1515  19.1556          ?        ?      358.0        2.7       ?       ? 
1 1 1   39   20   32 o    109.4    6.4    0.0000   0.0000          ?        ?   120.0421  14.0475          ?        ?      109.4        6.4       ?       ? 
1 1 1   39   20   33 o    282.3    2.9    0.0000   0.0000          ?        ?   797.5135  16.6016          ?        ?      282.3        2.9       ?       ? 
1 1 1   39   20   34 o    112.2    7.1    0.0000   0.0000          ?        ?   126.4273  15.9630          ?        ?      112.2        7.1       ?       ? 
1 1 1   39   20   35 o    116.7    6.0    0.0000   0.0000          ?        ?   136.6436  14.0475          ?        ?      116.7        6.0       ?       ? 
1 1 1   39   20   36 o     97.6    7.8    0.0000   0.0000          ?        ?    95.7782  15.3245          ?        ?       97.6        7.8       ?       ? 
1 1 1   39   20   37 o    251.6    3.4    0.0000   0.0000          ?        ?   633.4135  17.2401          ?        ?      251.6        3.4       ?       ? 
1 1 1   39   20   38 o     85.4    9.4    0.0000   0.0000          ?        ?    73.4300  15.9630          ?        ?       85.4        9.4       ?       ? 
1 1 1   39   20   39 o    216.2    3.8    0.0000   0.0000          ?        ?   468.0364  16.6016          ?        ?      216.2        3.8       ?       ? 
1 1 1   39   20   40 o    206.0    4.3    0.0000   0.0000          ?        ?   425.2554  17.8786          ?        ?      206.0        4.3       ?       ? 
1 1 1   39   20   41 o     79.9   10.4    0.0000   0.0000          ?        ?    64.4907  16.6016          ?        ?       79.9       10.4       ?       ? 
1 1 1   39   20   42 o    150.5    5.5    0.0000   0.0000          ?        ?   227.3137  16.6016          ?        ?      150.5        5.5       ?       ? 
1 1 1   39   20   43 o    203.7    4.4    0.0000   0.0000          ?        ?   415.6776  17.8786          ?        ?      203.7        4.4       ?       ? 
1 1 1   39   20   44 o    268.5    3.6    0.0000   0.0000          ?        ?   722.1680  19.1556          ?        ?      268.5        3.6       ?       ? 
1 1 1   39   20   45 o     76.4   11.3    0.0000   0.0000          ?        ?    59.3825  17.2401          ?        ?       76.4       11.3       ?       ? 
1 1 1   39   20   46 o    283.2    3.4    0.0000   0.0000          ?        ?   803.2603  19.1556          ?        ?      283.2        3.4       ?       ? 
1 1 1   39   20   47 f     92.2    9.7    0.0000   0.0000          ?        ?    86.2004  17.8786          ?        ?       92.2        9.7       ?       ? 
1 1 1   39   20   48 o    277.0    3.5    0.0000   0.0000          ?        ?   768.7800  19.1556          ?        ?      277.0        3.5       ?       ? 
1 1 1   39   20   49 o    138.4    6.2    0.0000   0.0000          ?        ?   192.8335  17.2401          ?        ?      138.4        6.2       ?       ? 
1 1 1   39   20   50 o     54.5   14.8    0.0000   0.0000          ?        ?    31.9261  16.6016          ?        ?       54.5       14.8       ?       ? 
1 1 1   39   20   51 o     19.6    9.9    0.0000   0.0000          ?        ?   -60.6596  18.5171          ?        ?       19.6        9.9       ?       ? 
1 1 1   39   21    0 o    195.3    5.1  382.4745  19.7942   382.4745  19.7942   382.4745  19.7942      195.3      5.1      195.3        5.1     0.0     0.0 
1 1 1   39   21    1 o    337.9    2.8    0.0000   0.0000          ?        ?  1142.3152  19.1556          ?        ?      337.9        2.8       ?       ? 
1 1 1   39   21    2 o    168.9    3.8    0.0000   0.0000          ?        ?   285.4192  12.7704          ?        ?      168.9        3.8       ?       ? 
1 1 1   39   21    3 o    146.2    4.1    0.0000   0.0000          ?        ?   213.9047  12.1319          ?        ?      146.2        4.1       ?       ? 
1 1 1   39   21    4 o    163.7    3.9    0.0000   0.0000          ?        ?   268.1791  12.7704          ?        ?      163.7        3.9       ?       ? 
1 1 1   39   21    5 o    133.2    5.0    0.0000   0.0000          ?        ?   177.5090  13.4090          ?        ?      133.2        5.0       ?       ? 
1 1 1   39   21    6 o     45.2   12.8    0.0000   0.0000          ?        ?    21.0712  12.1319          ?        ?       45.2       12.8       ?       ? 
1 1 1   39   21    7 o     21.0   10.2    0.0000   0.0000          ?        ?   -22.9868  13.4090          ?        ?       21.0       10.2       ?       ? 
1 1 1   39   21    8 o    259.8    3.3    0.0000   0.0000          ?        ?   675.5559  17.2401          ?        ?      259.8        3.3       ?       ? 
1 1 1   39   21    9 o    218.6    3.7    0.0000   0.0000          ?        ?   478.2527  15.9630          ?        ?      218.6        3.7       ?       ? 
1 1 1   39   21   10 o    422.9    3.0    0.0000   0.0000          ?        ?  1789.1377  25.5409          ?        ?      422.9        3.0       ?       ? 
1 1 1   39   21   11 o    255.8    2.6    0.0000   0.0000          ?        ?   654.4847  13.4090          ?        ?      255.8        2.6       ?       ? 
1 1 1   39   21   12 o    259.3    2.7    0.0000   0.0000          ?        ?   672.3633  14.0475          ?        ?      259.3        2.7       ?       ? 
1 1 1   39   21   13 o    101.6    5.7    0.0000   0.0000          ?        ?   103.4405  11.4934          ?        ?      101.6        5.7       ?       ? 
1 1 1   39   21   14 o    167.2    4.2    0.0000   0.0000          ?        ?   279.6725  14.0475          ?        ?      167.2        4.2       ?       ? 
1 1 1   39   21   15 f    467.9    3.0    0.0000   0.0000          ?        ?  2190.1292  28.0950          ?        ?      467.9        3.0       ?       ? 
1 1 1   39   21   16 o    574.8    3.0    0.0000   0.0000          ?        ?  3305.6265  34.4802          ?        ?      574.8        3.0       ?       ? 
1 1 1   39   21   17 o     88.9    5.4    0.0000   0.0000          ?        ?    79.1767   9.5778          ?        ?       88.9        5.4       ?       ? 
1 1 1   39   21   18 o    203.8    3.0    0.0000   0.0000          ?        ?   415.6776  12.1319          ?        ?      203.8        3.0       ?       ? 
1 1 1   39   21   19 o     92.8    5.9    0.0000   0.0000          ?        ?    86.2004  10.8549          ?        ?       92.8        5.9       ?       ? 
1 1 1   39   21   20 o    378.6    2.4    0.0000   0.0000          ?        ?  1434.1196  18.5171          ?        ?      378.6        2.4       ?       ? 
1 1 1   39   21   21 o    103.8    5.5    0.0000   0.0000          ?        ?   107.9102  11.4934          ?        ?      103.8        5.5       ?       ? 
1 1 1   39   21   22 o    357.8    2.6    0.0000   0.0000          ?        ?  1280.8744  18.5171          ?        ?      357.8        2.6       ?       ? 
1 1 1   39   21   23 o    380.1    2.4    0.0000   0.0000          ?        ?  1444.9745  18.5171          ?        ?      380.1        2.4       ?       ? 
1 1 1   39   21   24 o     85.2    7.1    0.0000   0.0000          ?        ?    72.7915  12.1319          ?        ?       85.2        7.1       ?       ? 
1 1 1   39   21   25 o    136.7    4.9    0.0000   0.0000          ?        ?   187.0868  13.4090          ?        ?      136.7        4.9       ?       ? 
1 1 1   39   21   26 o    196.8    3.6    0.0000   0.0000          ?        ?   387.5826  14.0475          ?        ?      196.8        3.6       ?       ? 
1 1 1   39   21   27 o    150.5    4.7    0.0000   0.0000          ?        ?   226.6752  14.0475          ?        ?      150.5        4.7       ?       ? 
1 1 1   39   21   28 o    463.2    2.6    0.0000   0.0000          ?        ?  2146.0713  24.2638          ?        ?      463.2        2.6       ?       ? 
1 1 1   39   21   29 o    160.1    4.6    0.0000   0.0000          ?        ?   256.6857  14.6860          ?        ?      160.1        4.6       ?       ? 
1 1 1   39   21   30 o     37.9   14.0    0.0000   0.0000          ?        ?    11.4934  14.0475          ?        ?       37.9       14.0       ?       ? 
1 1 1   39   21   31 o    145.0    5.1    0.0000   0.0000          ?        ?   210.7121  14.6860          ?        ?      145.0        5.1       ?       ? 
1 1 1   39   21   32 o    273.7    3.4    0.0000   0.0000          ?        ?   749.6244  18.5171          ?        ?      273.7        3.4       ?       ? 
1 1 1   39   21   33 o    179.6    4.3    0.0000   0.0000          ?        ?   323.0919  15.3245          ?        ?      179.6        4.3       ?       ? 
1 1 1   39   21   34 o    216.1    3.8    0.0000   0.0000          ?        ?   467.3978  16.6016          ?        ?      216.1        3.8       ?       ? 
1 1 1   39   21   35 o     71.2   10.3    0.0000   0.0000          ?        ?    51.0817  14.6860          ?        ?       71.2       10.3       ?       ? 
1 1 1   39   21   36 o    289.5    3.0    0.0000   0.0000          ?        ?   839.0174  17.2401          ?        ?      289.5        3.0       ?       ? 
1 1 1   39   21   37 o     28.3   12.9    0.0000   0.0000          ?        ?   -11.4934  16.6016          ?        ?       28.3       12.9       ?       ? 
1 1 1   39   21   38 o    262.2    3.4    0.0000   0.0000          ?        ?   688.3264  17.8786          ?        ?      262.2        3.4       ?       ? 
1 1 1   39   21   39 o    313.5    3.1    0.0000   0.0000          ?        ?   983.9619  19.1556          ?        ?      313.5        3.1       ?       ? 
1 1 1   39   21   40 o     56.5   14.6    0.0000   0.0000          ?        ?    33.8416  16.6016          ?        ?       56.5       14.6       ?       ? 
1 1 1   39   21   41 o    259.2    3.6    0.0000   0.0000          ?        ?   673.0018  18.5171          ?        ?      259.2        3.6       ?       ? 
1 1 1   39   21   42 o    357.9    3.0    0.0000   0.0000          ?        ?  1282.1515  21.7097          ?        ?      357.9        3.0       ?       ? 
1 1 1   39   21   43 o    135.7    6.4    0.0000   0.0000          ?        ?   185.1713  17.2401          ?        ?      135.7        6.4       ?       ? 
1 1 1   39   21   44 o    265.0    3.5    0.0000   0.0000          ?        ?   703.6508  18.5171          ?        ?      265.0        3.5       ?       ? 
1 1 1   39   21   45 o     85.8   10.0    0.0000   0.0000          ?        ?    74.7070  17.2401          ?        ?       85.8       10.0       ?       ? 
1 1 1   39   21   46 o     20.7   10.3    0.0000   0.0000          ?        ?   -40.8654  16.6016          ?        ?       20.7       10.3       ?       ? 
1 1 1   39   21   47 o    476.8    2.8    0.0000   0.0000          ?        ?  2276.3296  26.8179          ?        ?      476.8        2.8       ?       ? 
1 1 1   39   21   48 o    156.9    5.7    0.0000   0.0000          ?        ?   247.7464  17.8786          ?        ?      156.9        5.7       ?       ? 
1 1 1   39   21   49 o     28.5   13.2    0.0000   0.0000          ?        ?   -14.0475  17.8786          ?        ?       28.5       13.2       ?       ? 
1 1 1   39   21   50 o    173.5    5.2    0.0000   0.0000          ?        ?   302.6593  17.8786          ?        ?      173.5        5.2       ?       ? 
1 1 1   39   22    0 o     52.8   16.6   35.1187  15.3245    35.1187  15.3245    35.1187  15.3245       52.8     16.6       52.8       16.6     0.0     0.0 
1 1 1   39   22    1 o    323.5    2.9    0.0000   0.0000          ?        ?  1047.1754  18.5171          ?        ?      323.5        2.9       ?       ? 
1 1 1   39   22    2 o    621.7    3.2    0.0000   0.0000          ?        ?  3867.5256  40.2269          ?        ?      621.7        3.2       ?       ? 
1 1 1   39   22    3 o    298.5    3.0    0.0000   0.0000          ?        ?   891.3762  17.8786          ?        ?      298.5        3.0       ?       ? 
1 1 1   39   22    4 o    225.1    3.1    0.0000   0.0000          ?        ?   506.9862  14.0475          ?        ?      225.1        3.1       ?       ? 
1 1 1   39   22    5 o    199.9    3.8    0.0000   0.0000          ?        ?   399.7145  15.3245          ?        ?      199.9        3.8       ?       ? 
1 1 1   39   22    6 o    383.5    3.3    0.0000   0.0000          ?        ?  1471.7924  25.5409          ?        ?      383.5        3.3       ?       ? 
1 1 1   39   22    7 o    136.2    5.4    0.0000   0.0000          ?        ?   185.8098  14.6860          ?        ?      136.2        5.4       ?       ? 
1 1 1   39   22    8 o    282.9    3.3    0.0000   0.0000          ?        ?   800.7061  18.5171          ?        ?      282.9        3.3       ?       ? 
1 1 1   39   22    9 o    263.6    3.3    0.0000   0.0000          ?        ?   695.3500  17.2401          ?        ?      263.6        3.3       ?       ? 
1 1 1   39   22   10 o    448.9    3.4    0.0000   0.0000          ?        ?  2016.4512  30.6490          ?        ?      448.9        3.4       ?       ? 
1 1 1   39   22   11 o    151.3    3.8    0.0000   0.0000          ?        ?   229.2293  11.4934          ?        ?      151.3        3.8       ?       ? 
1 1 1   39   22   12 o    433.0    2.7    0.0000   0.0000          ?        ?  1875.3381  22.9868          ?        ?      433.0        2.7       ?       ? 
1 1 1   39   22   13 o    229.7    3.1    0.0000   0.0000          ?        ?   528.0574  14.0475          ?        ?      229.7        3.1       ?       ? 
1 1 1   39   22   14 o    119.8    5.1    0.0000   0.0000          ?        ?   143.6674  12.1319          ?        ?      119.8        5.1       ?       ? 
1 1 1   39   22   15 o    400.7    2.9    0.0000   0.0000          ?        ?  1606.5205  22.9868          ?        ?      400.7        2.9       ?       ? 
1 1 1   39   22   16 o    308.9    2.9    0.0000   0.0000          ?        ?   954.5898  17.8786          ?        ?      308.9        2.9       ?       ? 
1 1 1   39   22   17 o    231.9    3.2    0.0000   0.0000          ?        ?   538.2737  14.6860          ?        ?      231.9        3.2       ?       ? 
1 1 1   39   22   18 o    436.0    2.5    0.0000   0.0000          ?        ?  1901.5173  21.7097          ?        ?      436.0        2.5       ?       ? 
1 1 1   39   22   19 o    119.8    4.5    0.0000   0.0000          ?        ?   143.6674  10.8549          ?        ?      119.8        4.5       ?       ? 
1 1 1   39   22   20 o    302.8    2.4    0.0000   0.0000          ?        ?   916.9171  14.6860          ?        ?      302.8        2.4       ?       ? 
1 1 1   39   22   21 o    347.9    2.5    0.0000   0.0000          ?        ?  1210.6371  17.2401          ?        ?      347.9        2.5       ?       ? 
1 1 1   39   22   22 o    151.8    4.0    0.0000   0.0000          ?        ?   230.5063  12.1319          ?        ?      151.8        4.0       ?       ? 
1 1 1   39   22   23 o     53.5   11.7    0.0000   0.0000          ?        ?    30.0105  12.1319          ?        ?       53.5       11.7       ?       ? 
1 1 1   39   22   24 o    214.9    3.1    0.0000   0.0000          ?        ?   462.2897  13.4090          ?        ?      214.9        3.1       ?       ? 
1 1 1   39   22   25 o    209.5    3.2    0.0000   0.0000          ?        ?   439.3029  13.4090          ?        ?      209.5        3.2       ?       ? 
1 1 1   39   22   26 o    122.4    5.5    0.0000   0.0000          ?        ?   150.0526  13.4090          ?        ?      122.4        5.5       ?       ? 
1 1 1   39   22   27 o    266.9    2.9    0.0000   0.0000          ?        ?   712.5901  15.3245          ?        ?      266.9        2.9       ?       ? 
1 1 1   39   22   28 o    369.6    2.6    0.0000   0.0000          ?        ?  1366.4363  19.1556          ?        ?      369.6        2.6       ?       ? 
1 1 1   39   22   29 o    407.7    2.7    0.0000   0.0000          ?        ?  1662.7103  21.7097          ?        ?      407.7        2.7       ?       ? 
1 1 1   39   22   30 o     90.6    7.8    0.0000   0.0000          ?        ?    82.3693  14.0475          ?        ?       90.6        7.8       ?       ? 
1 1 1   39   22   31 o    109.4    6.4    0.0000   0.0000          ?        ?   120.0421  14.0475          ?        ?      109.4        6.4       ?       ? 
1 1 1   39   22   32 o    244.9    3.3    0.0000   0.0000          ?        ?   600.2103  15.9630          ?        ?      244.9        3.3       ?       ? 
1 1 1   39   22   33 o    141.9    5.2    0.0000   0.0000          ?        ?   201.7728  14.6860          ?        ?      141.9        5.2       ?       ? 
1 1 1   39   22   34 o    318.0    2.9    0.0000   0.0000          ?        ?  1012.0568  18.5171          ?        ?      318.0        2.9       ?       ? 
1 1 1   39   22   35 o    255.1    3.4    0.0000   0.0000          ?        ?   651.2921  17.2401          ?        ?      255.1        3.4       ?       ? 
1 1 1   39   22   36 f    224.9    3.8    0.0000   0.0000          ?        ?   506.3477  17.2401          ?        ?      224.9        3.8       ?       ? 
1 1 1   39   22   37 o    145.4    5.7    0.0000   0.0000          ?        ?   211.9892  16.6016          ?        ?      145.4        5.7       ?       ? 
1 1 1   39   22   38 o    265.3    3.5    0.0000   0.0000          ?        ?   704.9279  18.5171          ?        ?      265.3        3.5       ?       ? 
1 1 1   39   22   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   22   40 o    331.8    3.0    0.0000   0.0000          ?        ?  1102.0884  19.7942          ?        ?      331.8        3.0       ?       ? 
1 1 1   39   22   41 o    108.3    8.0    0.0000   0.0000          ?        ?   118.1265  17.2401          ?        ?      108.3        8.0       ?       ? 
1 1 1   39   22   42 o    149.6    5.8    0.0000   0.0000          ?        ?   224.7596  17.2401          ?        ?      149.6        5.8       ?       ? 
1 1 1   39   22   43 o    190.3    4.5    0.0000   0.0000          ?        ?   363.3188  17.2401          ?        ?      190.3        4.5       ?       ? 
1 1 1   39   22   44 o    273.3    3.5    0.0000   0.0000          ?        ?   748.3474  19.1556          ?        ?      273.3        3.5       ?       ? 
1 1 1   39   22   45 o    162.8    5.5    0.0000   0.0000          ?        ?   266.2635  17.8786          ?        ?      162.8        5.5       ?       ? 
1 1 1   39   22   46 o     78.3   11.0    0.0000   0.0000          ?        ?    62.5751  17.2401          ?        ?       78.3       11.0       ?       ? 
1 1 1   39   22   47 o    323.1    3.1    0.0000   0.0000          ?        ?  1045.8984  19.7942          ?        ?      323.1        3.1       ?       ? 
1 1 1   39   22   48 o    269.7    3.4    0.0000   0.0000          ?        ?   729.1917  18.5171          ?        ?      269.7        3.4       ?       ? 
1 1 1   39   22   49 o    122.9    7.0    0.0000   0.0000          ?        ?   152.6067  17.2401          ?        ?      122.9        7.0       ?       ? 
1 1 1   39   23    0 o    389.3    3.8 1516.4889  29.3720  1516.4889  29.3720  1516.4889  29.3720      389.3      3.8      389.3        3.8     0.0     0.0 
1 1 1   39   23    1 f    244.3    2.9    0.0000   0.0000          ?        ?   597.0177  14.0475          ?        ?      244.3        2.9       ?       ? 
1 1 1   39   23    2 o    349.5    2.8    0.0000   0.0000          ?        ?  1222.1304  19.7942          ?        ?      349.5        2.8       ?       ? 
1 1 1   39   23    3 o     77.7    8.6    0.0000   0.0000          ?        ?    60.6596  13.4090          ?        ?       77.7        8.6       ?       ? 
1 1 1   39   23    4 o    426.8    3.3    0.0000   0.0000          ?        ?  1822.3407  28.0950          ?        ?      426.8        3.3       ?       ? 
1 1 1   39   23    5 o    111.8    5.7    0.0000   0.0000          ?        ?   125.1502  12.7704          ?        ?      111.8        5.7       ?       ? 
1 1 1   39   23    6 o    372.6    3.3    0.0000   0.0000          ?        ?  1389.4231  24.2638          ?        ?      372.6        3.3       ?       ? 
1 1 1   39   23    7 o    153.2    4.2    0.0000   0.0000          ?        ?   234.9760  12.7704          ?        ?      153.2        4.2       ?       ? 
1 1 1   39   23    8 f    281.4    2.9    0.0000   0.0000          ?        ?   792.4053  16.6016          ?        ?      281.4        2.9       ?       ? 
1 1 1   39   23    9 f    180.7    3.9    0.0000   0.0000          ?        ?   326.9231  14.0475          ?        ?      180.7        3.9       ?       ? 
1 1 1   39   23   10 o    234.3    3.3    0.0000   0.0000          ?        ?   549.1286  15.3245          ?        ?      234.3        3.3       ?       ? 
1 1 1   39   23   11 f    454.1    3.2    0.0000   0.0000          ?        ?  2063.0635  29.3720          ?        ?      454.1        3.2       ?       ? 
1 1 1   39   23   12 o     58.6    9.3    0.0000   0.0000          ?        ?    34.4802  10.8549          ?        ?       58.6        9.3       ?       ? 
1 1 1   39   23   13 o    347.5    2.6    0.0000   0.0000          ?        ?  1208.0829  17.8786          ?        ?      347.5        2.6       ?       ? 
1 1 1   39   23   14 o    479.5    3.0    0.0000   0.0000          ?        ?  2299.9551  28.7335          ?        ?      479.5        3.0       ?       ? 
1 1 1   39   23   15 o    534.6    3.3    0.0000   0.0000          ?        ?  2859.2998  35.1187          ?        ?      534.6        3.3       ?       ? 
1 1 1   39   23   16 o    121.6    5.5    0.0000   0.0000          ?        ?   148.1370  13.4090          ?        ?      121.6        5.5       ?       ? 
1 1 1   39   23   17 o    171.3    4.3    0.0000   0.0000          ?        ?   293.7199  14.6860          ?        ?      171.3        4.3       ?       ? 
1 1 1   39   23   18 o    351.2    2.5    0.0000   0.0000          ?        ?  1233.6238  17.2401          ?        ?      351.2        2.5       ?       ? 
1 1 1   39   23   19 o    429.2    2.6    0.0000   0.0000          ?        ?  1842.7734  22.3483          ?        ?      429.2        2.6       ?       ? 
1 1 1   39   23   20 o    204.9    3.3    0.0000   0.0000          ?        ?   420.1472  13.4090          ?        ?      204.9        3.3       ?       ? 
1 1 1   39   23   21 o    411.6    2.7    0.0000   0.0000          ?        ?  1695.2749  22.3483          ?        ?      411.6        2.7       ?       ? 
1 1 1   39   23   22 o    193.0    3.3    0.0000   0.0000          ?        ?   372.8966  12.7704          ?        ?      193.0        3.3       ?       ? 
1 1 1   39   23   23 o    374.3    2.6    0.0000   0.0000          ?        ?  1401.5549  19.7942          ?        ?      374.3        2.6       ?       ? 
1 1 1   39   23   24 o    233.9    3.0    0.0000   0.0000          ?        ?   547.2130  14.0475          ?        ?      233.9        3.0       ?       ? 
1 1 1   39   23   25 o    152.1    4.4    0.0000   0.0000          ?        ?   231.7833  13.4090          ?        ?      152.1        4.4       ?       ? 
1 1 1   39   23   26 o     38.9   13.8    0.0000   0.0000          ?        ?    13.4090  13.4090          ?        ?       38.9       13.8       ?       ? 
1 1 1   39   23   27 o     37.0   13.7    0.0000   0.0000          ?        ?    10.8549  13.4090          ?        ?       37.0       13.7       ?       ? 
1 1 1   39   23   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   23   29 o     97.3    7.5    0.0000   0.0000          ?        ?    95.1397  14.6860          ?        ?       97.3        7.5       ?       ? 
1 1 1   39   23   30 o     56.7   12.7    0.0000   0.0000          ?        ?    33.8416  14.0475          ?        ?       56.7       12.7       ?       ? 
1 1 1   39   23   31 o    267.4    3.1    0.0000   0.0000          ?        ?   715.7827  16.6016          ?        ?      267.4        3.1       ?       ? 
1 1 1   39   23   32 o    255.3    3.3    0.0000   0.0000          ?        ?   652.5691  16.6016          ?        ?      255.3        3.3       ?       ? 
1 1 1   39   23   33 o    160.6    5.0    0.0000   0.0000          ?        ?   258.6013  15.9630          ?        ?      160.6        5.0       ?       ? 
1 1 1   39   23   34 o    284.1    3.1    0.0000   0.0000          ?        ?   807.7299  17.8786          ?        ?      284.1        3.1       ?       ? 
1 1 1   39   23   35 o    155.4    5.1    0.0000   0.0000          ?        ?   241.9997  15.9630          ?        ?      155.4        5.1       ?       ? 
1 1 1   39   23   36 o     49.5   14.5    0.0000   0.0000          ?        ?    25.5409  15.3245          ?        ?       49.5       14.5       ?       ? 
1 1 1   39   23   37 o     41.8   15.0    0.0000   0.0000          ?        ?    15.3245  15.9630          ?        ?       41.8       15.0       ?       ? 
1 1 1   39   23   38 o    229.6    3.8    0.0000   0.0000          ?        ?   528.0574  17.2401          ?        ?      229.6        3.8       ?       ? 
1 1 1   39   23   39 o    131.2    6.3    0.0000   0.0000          ?        ?   173.0394  16.6016          ?        ?      131.2        6.3       ?       ? 
1 1 1   39   23   40 o    306.0    3.1    0.0000   0.0000          ?        ?   937.3498  19.1556          ?        ?      306.0        3.1       ?       ? 
1 1 1   39   23   41 o    145.7    5.9    0.0000   0.0000          ?        ?   213.2662  17.2401          ?        ?      145.7        5.9       ?       ? 
1 1 1   39   23   42 o     74.7   11.1    0.0000   0.0000          ?        ?    56.8284  16.6016          ?        ?       74.7       11.1       ?       ? 
1 1 1   39   23   43 o    373.1    3.0    0.0000   0.0000          ?        ?  1393.8927  22.3483          ?        ?      373.1        3.0       ?       ? 
1 1 1   39   23   44 o    147.9    6.3    0.0000   0.0000          ?        ?   220.2900  18.5171          ?        ?      147.9        6.3       ?       ? 
1 1 1   39   23   45 o    162.2    5.5    0.0000   0.0000          ?        ?   264.3480  17.8786          ?        ?      162.2        5.5       ?       ? 
1 1 1   39   23   46 o    233.6    4.0    0.0000   0.0000          ?        ?   547.2130  18.5171          ?        ?      233.6        4.0       ?       ? 
1 1 1   39   23   47 o    193.6    4.8    0.0000   0.0000          ?        ?   376.7278  18.5171          ?        ?      193.6        4.8       ?       ? 
1 1 1   39   24    0 o     13.8   10.3  -73.4300  22.3483   -73.4300  22.3483   -73.4300  22.3483       13.8     10.3       13.8       10.3     0.0     0.0 
1 1 1   39   24    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   24    2 o    127.0    4.8    0.0000   0.0000          ?        ?   161.5460  12.1319          ?        ?      127.0        4.8       ?       ? 
1 1 1   39   24    3 f    151.3    4.0    0.0000   0.0000          ?        ?   229.2293  12.1319          ?        ?      151.3        4.0       ?       ? 
1 1 1   39   24    4 o    259.5    3.1    0.0000   0.0000          ?        ?   673.6403  15.9630          ?        ?      259.5        3.1       ?       ? 
1 1 1   39   24    5 o    275.8    2.9    0.0000   0.0000          ?        ?   761.1177  15.9630          ?        ?      275.8        2.9       ?       ? 
1 1 1   39   24    6 o    223.2    3.1    0.0000   0.0000          ?        ?   498.6854  14.0475          ?        ?      223.2        3.1       ?       ? 
1 1 1   39   24    7 o    215.9    4.0    0.0000   0.0000          ?        ?   466.7593  17.2401          ?        ?      215.9        4.0       ?       ? 
1 1 1   39   24    8 o     34.9   13.7    0.0000   0.0000          ?        ?     7.0237  14.0475          ?        ?       34.9       13.7       ?       ? 
1 1 1   39   24    9 o    353.0    3.4    0.0000   0.0000          ?        ?  1247.0327  24.2638          ?        ?      353.0        3.4       ?       ? 
1 1 1   39   24   10 o    408.2    3.3    0.0000   0.0000          ?        ?  1667.1801  26.8179          ?        ?      408.2        3.3       ?       ? 
1 1 1   39   24   11 o    177.7    4.3    0.0000   0.0000          ?        ?   316.0682  15.3245          ?        ?      177.7        4.3       ?       ? 
1 1 1   39   24   12 o    328.1    3.3    0.0000   0.0000          ?        ?  1077.1859  21.7097          ?        ?      328.1        3.3       ?       ? 
1 1 1   39   24   13 f    214.8    3.0    0.0000   0.0000          ?        ?   461.6512  12.7704          ?        ?      214.8        3.0       ?       ? 
1 1 1   39   24   14 o     63.3    8.6    0.0000   0.0000          ?        ?    40.2269  10.8549          ?        ?       63.3        8.6       ?       ? 
1 1 1   39   24   15 o    165.4    4.1    0.0000   0.0000          ?        ?   273.9258  13.4090          ?        ?      165.4        4.1       ?       ? 
1 1 1   39   24   16 o    151.9    4.6    0.0000   0.0000          ?        ?   231.1448  14.0475          ?        ?      151.9        4.6       ?       ? 
1 1 1   39   24   17 o    322.7    3.1    0.0000   0.0000          ?        ?  1042.0673  19.7942          ?        ?      322.7        3.1       ?       ? 
1 1 1   39   24   18 o     94.7    7.4    0.0000   0.0000          ?        ?    90.0316  14.0475          ?        ?       94.7        7.4       ?       ? 
1 1 1   39   24   19 o    105.0    4.6    0.0000   0.0000          ?        ?   110.4642   9.5778          ?        ?      105.0        4.6       ?       ? 
1 1 1   39   24   20 o    397.9    2.6    0.0000   0.0000          ?        ?  1584.1722  21.0712          ?        ?      397.9        2.6       ?       ? 
1 1 1   39   24   21 o    171.3    3.5    0.0000   0.0000          ?        ?   293.7199  12.1319          ?        ?      171.3        3.5       ?       ? 
1 1 1   39   24   22 o    324.5    2.6    0.0000   0.0000          ?        ?  1053.5607  16.6016          ?        ?      324.5        2.6       ?       ? 
1 1 1   39   24   23 o    134.3    4.8    0.0000   0.0000          ?        ?   180.7016  12.7704          ?        ?      134.3        4.8       ?       ? 
1 1 1   39   24   24 o    239.9    3.1    0.0000   0.0000          ?        ?   575.9465  14.6860          ?        ?      239.9        3.1       ?       ? 
1 1 1   39   24   25 f    164.3    3.9    0.0000   0.0000          ?        ?   270.0946  12.7704          ?        ?      164.3        3.9       ?       ? 
1 1 1   39   24   26 o    102.8    6.5    0.0000   0.0000          ?        ?   105.9946  13.4090          ?        ?      102.8        6.5       ?       ? 
1 1 1   39   24   27 f     35.5   13.6    0.0000   0.0000          ?        ?     8.9393  13.4090          ?        ?       35.5       13.6       ?       ? 
1 1 1   39   24   28 o    196.9    3.6    0.0000   0.0000          ?        ?   388.2211  14.0475          ?        ?      196.9        3.6       ?       ? 
1 1 1   39   24   29 f    175.3    4.2    0.0000   0.0000          ?        ?   307.7674  14.6860          ?        ?      175.3        4.2       ?       ? 
1 1 1   39   24   30 o    120.5    5.8    0.0000   0.0000          ?        ?   145.5829  14.0475          ?        ?      120.5        5.8       ?       ? 
1 1 1   39   24   31 o    201.1    3.8    0.0000   0.0000          ?        ?   404.8227  15.3245          ?        ?      201.1        3.8       ?       ? 
1 1 1   39   24   32 f    154.8    4.7    0.0000   0.0000          ?        ?   240.0841  14.6860          ?        ?      154.8        4.7       ?       ? 
1 1 1   39   24   33 o    164.5    4.9    0.0000   0.0000          ?        ?   271.3717  15.9630          ?        ?      164.5        4.9       ?       ? 
1 1 1   39   24   34 o    174.7    4.6    0.0000   0.0000          ?        ?   305.8519  15.9630          ?        ?      174.7        4.6       ?       ? 
1 1 1   39   24   35 o     81.1    9.1    0.0000   0.0000          ?        ?    66.4062  14.6860          ?        ?       81.1        9.1       ?       ? 
1 1 1   39   24   36 o    466.7    2.7    0.0000   0.0000          ?        ?  2179.9128  25.5409          ?        ?      466.7        2.7       ?       ? 
1 1 1   39   24   37 o     79.4   10.0    0.0000   0.0000          ?        ?    63.8522  15.9630          ?        ?       79.4       10.0       ?       ? 
1 1 1   39   24   38 o    249.5    3.5    0.0000   0.0000          ?        ?   623.1971  17.2401          ?        ?      249.5        3.5       ?       ? 
1 1 1   39   24   39 o    112.1    6.8    0.0000   0.0000          ?        ?   126.4273  15.3245          ?        ?      112.1        6.8       ?       ? 
1 1 1   39   24   40 o     22.8   11.1    0.0000   0.0000          ?        ?   -30.0105  16.6016          ?        ?       22.8       11.1       ?       ? 
1 1 1   39   24   41 o     19.6    9.8    0.0000   0.0000          ?        ?   -43.4195  15.9630          ?        ?       19.6        9.8       ?       ? 
1 1 1   39   24   42 o    193.6    4.5    0.0000   0.0000          ?        ?   376.0892  17.2401          ?        ?      193.6        4.5       ?       ? 
1 1 1   39   24   43 o     56.1   14.6    0.0000   0.0000          ?        ?    33.8416  16.6016          ?        ?       56.1       14.6       ?       ? 
1 1 1   39   24   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   24   45 o     24.3   11.7    0.0000   0.0000          ?        ?   -23.6253  16.6016          ?        ?       24.3       11.7       ?       ? 
1 1 1   39   24   46 o    110.6    7.8    0.0000   0.0000          ?        ?   123.8732  17.2401          ?        ?      110.6        7.8       ?       ? 
1 1 1   39   25    0 o     56.7   17.4   40.2269  17.2401    40.2269  17.2401    40.2269  17.2401       56.7     17.4       56.7       17.4     0.0     0.0 
1 1 1   39   25    1 o    325.7    3.2    0.0000   0.0000          ?        ?  1061.2229  21.0712          ?        ?      325.7        3.2       ?       ? 
1 1 1   39   25    2 o    135.3    3.8    0.0000   0.0000          ?        ?   183.2557  10.2163          ?        ?      135.3        3.8       ?       ? 
1 1 1   39   25    3 o    272.0    2.7    0.0000   0.0000          ?        ?   740.0466  14.6860          ?        ?      272.0        2.7       ?       ? 
1 1 1   39   25    4 o    222.0    2.6    0.0000   0.0000          ?        ?   492.9387  11.4934          ?        ?      222.0        2.6       ?       ? 
1 1 1   39   25    5 o    543.7    3.6    0.0000   0.0000          ?        ?  2958.9092  38.9498          ?        ?      543.7        3.6       ?       ? 
1 1 1   39   25    6 o    226.1    3.1    0.0000   0.0000          ?        ?   511.4558  14.0475          ?        ?      226.1        3.1       ?       ? 
1 1 1   39   25    7 o    263.4    3.3    0.0000   0.0000          ?        ?   694.0730  17.2401          ?        ?      263.4        3.3       ?       ? 
1 1 1   39   25    8 o    203.5    3.1    0.0000   0.0000          ?        ?   414.4005  12.7704          ?        ?      203.5        3.1       ?       ? 
1 1 1   39   25    9 o    294.5    3.0    0.0000   0.0000          ?        ?   867.7509  17.8786          ?        ?      294.5        3.0       ?       ? 
1 1 1   39   25   10 o    379.7    2.9    0.0000   0.0000          ?        ?  1442.4203  22.3483          ?        ?      379.7        2.9       ?       ? 
1 1 1   39   25   11 o    598.2    3.9    0.0000   0.0000          ?        ?  3582.1064  47.2506          ?        ?      598.2        3.9       ?       ? 
1 1 1   39   25   12 o     61.2   11.4    0.0000   0.0000          ?        ?    38.9498  13.4090          ?        ?       61.2       11.4       ?       ? 
1 1 1   39   25   13 o    348.1    3.0    0.0000   0.0000          ?        ?  1212.5525  21.0712          ?        ?      348.1        3.0       ?       ? 
1 1 1   39   25   14 o     47.5   12.1    0.0000   0.0000          ?        ?    23.6253  11.4934          ?        ?       47.5       12.1       ?       ? 
1 1 1   39   25   15 o    418.4    3.2    0.0000   0.0000          ?        ?  1752.1033  26.8179          ?        ?      418.4        3.2       ?       ? 
1 1 1   39   25   16 o    176.6    4.0    0.0000   0.0000          ?        ?   312.2371  14.0475          ?        ?      176.6        4.0       ?       ? 
1 1 1   39   25   17 o    450.6    3.0    0.0000   0.0000          ?        ?  2031.7759  26.8179          ?        ?      450.6        3.0       ?       ? 
1 1 1   39   25   18 o    301.9    3.1    0.0000   0.0000          ?        ?   911.8089  18.5171          ?        ?      301.9        3.1       ?       ? 
1 1 1   39   25   19 o    313.9    2.8    0.0000   0.0000          ?        ?   985.8774  17.8786          ?        ?      313.9        2.8       ?       ? 
1 1 1   39   25   20 o    519.7    2.8    0.0000   0.0000          ?        ?  2702.2236  28.7335          ?        ?      519.7        2.8       ?       ? 
1 1 1   39   25   21 o     27.3   11.7    0.0000   0.0000          ?        ?    -0.6385  11.4934          ?        ?       27.3       11.7       ?       ? 
1 1 1   39   25   22 o    173.0    3.7    0.0000   0.0000          ?        ?   299.4666  12.7704          ?        ?      173.0        3.7       ?       ? 
1 1 1   39   25   23 o    672.2    2.9    0.0000   0.0000          ?        ?  4521.3716  38.9498          ?        ?      672.2        2.9       ?       ? 
1 1 1   39   25   24 o    147.4    4.5    0.0000   0.0000          ?        ?   217.7359  13.4090          ?        ?      147.4        4.5       ?       ? 
1 1 1   39   25   25 o    524.1    2.6    0.0000   0.0000          ?        ?  2748.8357  27.4564          ?        ?      524.1        2.6       ?       ? 
1 1 1   39   25   26 o    216.8    3.2    0.0000   0.0000          ?        ?   470.5904  14.0475          ?        ?      216.8        3.2       ?       ? 
1 1 1   39   25   27 o    259.4    3.1    0.0000   0.0000          ?        ?   673.6403  15.9630          ?        ?      259.4        3.1       ?       ? 
1 1 1   39   25   28 o     47.0   13.5    0.0000   0.0000          ?        ?    22.9868  13.4090          ?        ?       47.0       13.5       ?       ? 
1 1 1   39   25   29 o    100.8    7.3    0.0000   0.0000          ?        ?   102.1635  14.6860          ?        ?      100.8        7.3       ?       ? 
1 1 1   39   25   30 o    383.5    2.7    0.0000   0.0000          ?        ?  1471.7924  20.4327          ?        ?      383.5        2.7       ?       ? 
1 1 1   39   25   31 o    416.5    2.7    0.0000   0.0000          ?        ?  1736.1403  22.3483          ?        ?      416.5        2.7       ?       ? 
1 1 1   39   25   32 o    107.5    6.8    0.0000   0.0000          ?        ?   116.2109  14.6860          ?        ?      107.5        6.8       ?       ? 
1 1 1   39   25   33 o     60.7   13.0    0.0000   0.0000          ?        ?    38.9498  15.3245          ?        ?       60.7       13.0       ?       ? 
1 1 1   39   25   34 o    110.7    7.5    0.0000   0.0000          ?        ?   123.2347  16.6016          ?        ?      110.7        7.5       ?       ? 
1 1 1   39   25   35 o    258.0    3.2    0.0000   0.0000          ?        ?   666.6166  16.6016          ?        ?      258.0        3.2       ?       ? 
1 1 1   39   25   36 o    119.0    6.4    0.0000   0.0000          ?        ?   142.3903  15.3245          ?        ?      119.0        6.4       ?       ? 
1 1 1   39   25   37 o    149.7    5.1    0.0000   0.0000          ?        ?   224.7596  15.3245          ?        ?      149.7        5.1       ?       ? 
1 1 1   39   25   38 o     76.4   10.9    0.0000   0.0000          ?        ?    59.3825  16.6016          ?        ?       76.4       10.9       ?       ? 
1 1 1   39   25   39 o    214.8    4.0    0.0000   0.0000          ?        ?   462.2897  17.2401          ?        ?      214.8        4.0       ?       ? 
1 1 1   39   25   40 o    115.3    7.2    0.0000   0.0000          ?        ?   134.0895  16.6016          ?        ?      115.3        7.2       ?       ? 
1 1 1   39   25   41 o    212.1    3.9    0.0000   0.0000          ?        ?   450.7963  16.6016          ?        ?      212.1        3.9       ?       ? 
1 1 1   39   25   42 o     77.6   10.3    0.0000   0.0000          ?        ?    61.2981  15.9630          ?        ?       77.6       10.3       ?       ? 
1 1 1   39   25   43 o    238.9    3.6    0.0000   0.0000          ?        ?   572.1154  17.2401          ?        ?      238.9        3.6       ?       ? 
1 1 1   39   25   44 o    135.3    6.1    0.0000   0.0000          ?        ?   184.5327  16.6016          ?        ?      135.3        6.1       ?       ? 
1 1 1   39   26    0 f    397.2    5.4 1579.7025  42.7809  1579.7025  42.7809  1579.7025  42.7809      397.2      5.4      397.2        5.4     0.0     0.0 
1 1 1   39   26    1 o    122.3   10.4    0.0000   0.0000          ?        ?   150.6911  25.5409          ?        ?      122.3       10.4       ?       ? 
1 1 1   39   26    2 o     58.4   12.9    0.0000   0.0000          ?        ?    35.7572  14.6860          ?        ?       58.4       12.9       ?       ? 
1 1 1   39   26    3 o    245.6    4.3    0.0000   0.0000          ?        ?   604.0414  21.0712          ?        ?      245.6        4.3       ?       ? 
1 1 1   39   26    4 o    519.4    4.2    0.0000   0.0000          ?        ?  2700.9465  43.4195          ?        ?      519.4        4.2       ?       ? 
1 1 1   39   26    5 o    147.6    6.5    0.0000   0.0000          ?        ?   218.3744  19.1556          ?        ?      147.6        6.5       ?       ? 
1 1 1   39   26    6 o    230.9    4.1    0.0000   0.0000          ?        ?   533.8041  19.1556          ?        ?      230.9        4.1       ?       ? 
1 1 1   39   26    7 o    101.5    7.2    0.0000   0.0000          ?        ?   103.4405  14.6860          ?        ?      101.5        7.2       ?       ? 
1 1 1   39   26    8 o    255.3    4.5    0.0000   0.0000          ?        ?   652.5691  22.9868          ?        ?      255.3        4.5       ?       ? 
1 1 1   39   26    9 o     27.0   12.6    0.0000   0.0000          ?        ?   -15.3245  16.6016          ?        ?       27.0       12.6       ?       ? 
1 1 1   39   26   10 f    231.9    3.2    0.0000   0.0000          ?        ?   538.2737  14.6860          ?        ?      231.9        3.2       ?       ? 
1 1 1   39   26   11 o    417.9    3.1    0.0000   0.0000          ?        ?  1747.6338  26.1794          ?        ?      417.9        3.1       ?       ? 
1 1 1   39   26   12 o    303.9    3.3    0.0000   0.0000          ?        ?   923.9408  19.7942          ?        ?      303.9        3.3       ?       ? 
1 1 1   39   26   13 o    317.0    3.2    0.0000   0.0000          ?        ?  1005.6716  20.4327          ?        ?      317.0        3.2       ?       ? 
1 1 1   39   26   14 o    136.5    4.2    0.0000   0.0000          ?        ?   186.4483  11.4934          ?        ?      136.5        4.2       ?       ? 
1 1 1   39   26   15 o    189.4    3.4    0.0000   0.0000          ?        ?   358.8492  12.7704          ?        ?      189.4        3.4       ?       ? 
1 1 1   39   26   16 o    192.7    3.5    0.0000   0.0000          ?        ?   371.6196  13.4090          ?        ?      192.7        3.5       ?       ? 
1 1 1   39   26   17 o    138.7    5.1    0.0000   0.0000          ?        ?   192.8335  14.0475          ?        ?      138.7        5.1       ?       ? 
1 1 1   39   26   18 o     44.0   13.3    0.0000   0.0000          ?        ?    19.7942  12.7704          ?        ?       44.0       13.3       ?       ? 
1 1 1   39   26   19 o    421.6    2.9    0.0000   0.0000          ?        ?  1778.2827  24.2638          ?        ?      421.6        2.9       ?       ? 
1 1 1   39   26   20 o    170.2    2.8    0.0000   0.0000          ?        ?   289.8888   9.5778          ?        ?      170.2        2.8       ?       ? 
1 1 1   39   26   21 o    249.9    2.8    0.0000   0.0000          ?        ?   625.1127  14.0475          ?        ?      249.9        2.8       ?       ? 
1 1 1   39   26   22 o    317.5    2.6    0.0000   0.0000          ?        ?  1008.8642  16.6016          ?        ?      317.5        2.6       ?       ? 
1 1 1   39   26   23 o    100.9    6.0    0.0000   0.0000          ?        ?   102.1635  12.1319          ?        ?      100.9        6.0       ?       ? 
1 1 1   39   26   24 o    173.9    3.9    0.0000   0.0000          ?        ?   302.6593  13.4090          ?        ?      173.9        3.9       ?       ? 
1 1 1   39   26   25 f    284.2    2.7    0.0000   0.0000          ?        ?   808.3683  15.3245          ?        ?      284.2        2.7       ?       ? 
1 1 1   39   26   26 o     32.3   13.0    0.0000   0.0000          ?        ?     5.1082  12.7704          ?        ?       32.3       13.0       ?       ? 
1 1 1   39   26   27 o     75.9    9.3    0.0000   0.0000          ?        ?    58.1055  14.0475          ?        ?       75.9        9.3       ?       ? 
1 1 1   39   26   28 o    464.2    2.5    0.0000   0.0000          ?        ?  2156.2876  23.6253          ?        ?      464.2        2.5       ?       ? 
1 1 1   39   26   29 o    172.0    4.1    0.0000   0.0000          ?        ?   296.2740  14.0475          ?        ?      172.0        4.1       ?       ? 
1 1 1   39   26   30 o    210.4    3.6    0.0000   0.0000          ?        ?   443.1340  15.3245          ?        ?      210.4        3.6       ?       ? 
1 1 1   39   26   31 o     26.6   12.2    0.0000   0.0000          ?        ?   -10.2163  14.6860          ?        ?       26.6       12.2       ?       ? 
1 1 1   39   26   32 o    237.8    3.4    0.0000   0.0000          ?        ?   566.3687  15.9630          ?        ?      237.8        3.4       ?       ? 
1 1 1   39   26   33 f     20.2   10.0    0.0000   0.0000          ?        ?   -32.5646  14.6860          ?        ?       20.2       10.0       ?       ? 
1 1 1   39   26   34 o     51.0   14.0    0.0000   0.0000          ?        ?    27.4564  14.6860          ?        ?       51.0       14.0       ?       ? 
1 1 1   39   26   35 o     95.1    8.4    0.0000   0.0000          ?        ?    91.3086  15.9630          ?        ?       95.1        8.4       ?       ? 
1 1 1   39   26   36 o     96.5    7.9    0.0000   0.0000          ?        ?    93.8627  15.3245          ?        ?       96.5        7.9       ?       ? 
1 1 1   39   26   37 o     18.7    9.4    0.0000   0.0000          ?        ?   -48.5276  15.9630          ?        ?       18.7        9.4       ?       ? 
1 1 1   39   26   38 o     77.3   10.3    0.0000   0.0000          ?        ?    60.6596  15.9630          ?        ?       77.3       10.3       ?       ? 
1 1 1   39   26   39 f    239.7    3.6    0.0000   0.0000          ?        ?   575.9465  17.2401          ?        ?      239.7        3.6       ?       ? 
1 1 1   39   26   40 o     81.5   10.6    0.0000   0.0000          ?        ?    67.6833  17.2401          ?        ?       81.5       10.6       ?       ? 
1 1 1   39   26   41 o    192.6    4.1    0.0000   0.0000          ?        ?   372.2581  15.9630          ?        ?      192.6        4.1       ?       ? 
1 1 1   39   26   42 o     17.7    9.0    0.0000   0.0000          ?        ?   -55.5514  15.9630          ?        ?       17.7        9.0       ?       ? 
1 1 1   39   26   43 o    161.5    5.1    0.0000   0.0000          ?        ?   262.4324  16.6016          ?        ?      161.5        5.1       ?       ? 
1 1 1   39   27    0 o     86.4   31.1  100.8864  49.1662   100.8864  49.1662   100.8864  49.1662       86.4     31.1       86.4       31.1     0.0     0.0 
1 1 1   39   27    1 f    267.9    6.2    0.0000   0.0000          ?        ?   719.6138  33.2031          ?        ?      267.9        6.2       ?       ? 
1 1 1   39   27    2 o    171.6    7.3    0.0000   0.0000          ?        ?   295.6355  24.9023          ?        ?      171.6        7.3       ?       ? 
1 1 1   39   27    3 o    254.8    4.9    0.0000   0.0000          ?        ?   650.0150  24.9023          ?        ?      254.8        4.9       ?       ? 
1 1 1   39   27    4 o    409.1    4.1    0.0000   0.0000          ?        ?  1675.4807  33.2031          ?        ?      409.1        4.1       ?       ? 
1 1 1   39   27    5 o    103.1    7.7    0.0000   0.0000          ?        ?   106.6331  15.9630          ?        ?      103.1        7.7       ?       ? 
1 1 1   39   27    6 o    144.2    7.3    0.0000   0.0000          ?        ?   208.7966  21.0712          ?        ?      144.2        7.3       ?       ? 
1 1 1   39   27    7 o    201.2    4.4    0.0000   0.0000          ?        ?   405.4612  17.8786          ?        ?      201.2        4.4       ?       ? 
1 1 1   39   27    8 o    217.8    4.5    0.0000   0.0000          ?        ?   475.0601  19.7942          ?        ?      217.8        4.5       ?       ? 
1 1 1   39   27    9 o    125.7    6.1    0.0000   0.0000          ?        ?   158.3534  15.3245          ?        ?      125.7        6.1       ?       ? 
1 1 1   39   27   10 o    251.0    4.3    0.0000   0.0000          ?        ?   630.8594  21.7097          ?        ?      251.0        4.3       ?       ? 
1 1 1   39   27   11 o    228.1    4.8    0.0000   0.0000          ?        ?   521.0336  21.7097          ?        ?      228.1        4.8       ?       ? 
1 1 1   39   27   12 o     86.3    6.3    0.0000   0.0000          ?        ?    74.7070  10.8549          ?        ?       86.3        6.3       ?       ? 
1 1 1   39   27   13 o    192.2    3.7    0.0000   0.0000          ?        ?   369.7040  14.0475          ?        ?      192.2        3.7       ?       ? 
1 1 1   39   27   14 f    169.1    3.6    0.0000   0.0000          ?        ?   286.0577  12.1319          ?        ?      169.1        3.6       ?       ? 
1 1 1   39   27   15 o    273.0    2.9    0.0000   0.0000          ?        ?   745.7933  15.9630          ?        ?      273.0        2.9       ?       ? 
1 1 1   39   27   16 o    163.9    3.9    0.0000   0.0000          ?        ?   268.8176  12.7704          ?        ?      163.9        3.9       ?       ? 
1 1 1   39   27   17 o    285.3    2.9    0.0000   0.0000          ?        ?   814.7536  16.6016          ?        ?      285.3        2.9       ?       ? 
1 1 1   39   27   18 o    191.5    3.7    0.0000   0.0000          ?        ?   367.1499  14.0475          ?        ?      191.5        3.7       ?       ? 
1 1 1   39   27   19 o     64.1   10.5    0.0000   0.0000          ?        ?    41.5039  13.4090          ?        ?       64.1       10.5       ?       ? 
1 1 1   39   27   20 o    202.2    3.6    0.0000   0.0000          ?        ?   409.2924  14.6860          ?        ?      202.2        3.6       ?       ? 
1 1 1   39   27   21 o    205.4    3.0    0.0000   0.0000          ?        ?   422.0628  12.1319          ?        ?      205.4        3.0       ?       ? 
1 1 1   39   27   22 o     53.6   10.5    0.0000   0.0000          ?        ?    30.0105  10.8549          ?        ?       53.6       10.5       ?       ? 
1 1 1   39   27   23 o    181.4    3.5    0.0000   0.0000          ?        ?   329.4771  12.7704          ?        ?      181.4        3.5       ?       ? 
1 1 1   39   27   24 o    285.5    2.7    0.0000   0.0000          ?        ?   815.3921  15.3245          ?        ?      285.5        2.7       ?       ? 
1 1 1   39   27   25 o    158.3    4.0    0.0000   0.0000          ?        ?   250.9390  12.7704          ?        ?      158.3        4.0       ?       ? 
1 1 1   39   27   26 o     27.4   11.9    0.0000   0.0000          ?        ?    -1.9156  12.1319          ?        ?       27.4       11.9       ?       ? 
1 1 1   39   27   27 o    201.4    3.5    0.0000   0.0000          ?        ?   406.0997  14.0475          ?        ?      201.4        3.5       ?       ? 
1 1 1   39   27   28 o    386.8    2.6    0.0000   0.0000          ?        ?  1497.3333  19.7942          ?        ?      386.8        2.6       ?       ? 
1 1 1   39   27   29 o    145.8    5.3    0.0000   0.0000          ?        ?   213.2662  15.3245          ?        ?      145.8        5.3       ?       ? 
1 1 1   39   27   30 o    103.6    7.1    0.0000   0.0000          ?        ?   107.9102  14.6860          ?        ?      103.6        7.1       ?       ? 
1 1 1   39   27   31 o     29.5   12.8    0.0000   0.0000          ?        ?    -1.9156  14.0475          ?        ?       29.5       12.8       ?       ? 
1 1 1   39   27   32 o    265.2    3.0    0.0000   0.0000          ?        ?   704.2894  15.9630          ?        ?      265.2        3.0       ?       ? 
1 1 1   39   27   33 o    399.1    2.7    0.0000   0.0000          ?        ?  1594.3884  21.7097          ?        ?      399.1        2.7       ?       ? 
1 1 1   39   27   34 o    280.7    3.1    0.0000   0.0000          ?        ?   789.2127  17.2401          ?        ?      280.7        3.1       ?       ? 
1 1 1   39   27   35 o     38.1   14.3    0.0000   0.0000          ?        ?    11.4934  14.6860          ?        ?       38.1       14.3       ?       ? 
1 1 1   39   27   36 o     99.1    7.4    0.0000   0.0000          ?        ?    98.9709  14.6860          ?        ?       99.1        7.4       ?       ? 
1 1 1   39   27   37 o    259.3    3.3    0.0000   0.0000          ?        ?   673.6403  17.2401          ?        ?      259.3        3.3       ?       ? 
1 1 1   39   27   38 o    139.2    5.7    0.0000   0.0000          ?        ?   194.7491  15.9630          ?        ?      139.2        5.7       ?       ? 
1 1 1   39   27   39 o    149.3    5.3    0.0000   0.0000          ?        ?   224.1211  15.9630          ?        ?      149.3        5.3       ?       ? 
1 1 1   39   27   40 f    135.7    5.6    0.0000   0.0000          ?        ?   185.1713  15.3245          ?        ?      135.7        5.6       ?       ? 
1 1 1   39   27   41 o    223.5    3.9    0.0000   0.0000          ?        ?   501.2395  17.2401          ?        ?      223.5        3.9       ?       ? 
1 1 1   39   28    0 o    242.6    9.5  593.1866  45.9736   593.1866  45.9736   593.1866  45.9736      242.6      9.5      242.6        9.5     0.0     0.0 
1 1 1   39   28    1 o    101.9   13.8    0.0000   0.0000          ?        ?   105.3561  28.0950          ?        ?      101.9       13.8       ?       ? 
1 1 1   39   28    2 o     35.5   16.3    0.0000   0.0000          ?        ?   -19.7942  26.8179          ?        ?       35.5       16.3       ?       ? 
1 1 1   39   28    3 o     63.0   22.1    0.0000   0.0000          ?        ?    37.0343  34.4802          ?        ?       63.0       22.1       ?       ? 
1 1 1   39   28    4 o    262.4    5.8    0.0000   0.0000          ?        ?   690.2419  30.6490          ?        ?      262.4        5.8       ?       ? 
1 1 1   39   28    5 o    271.2    5.3    0.0000   0.0000          ?        ?   736.8539  28.7335          ?        ?      271.2        5.3       ?       ? 
1 1 1   39   28    6 o    167.4    7.6    0.0000   0.0000          ?        ?   281.5880  25.5409          ?        ?      167.4        7.6       ?       ? 
1 1 1   39   28    7 o    218.1    4.5    0.0000   0.0000          ?        ?   476.3371  19.7942          ?        ?      218.1        4.5       ?       ? 
1 1 1   39   28    8 o    302.5    5.1    0.0000   0.0000          ?        ?   916.9171  30.6490          ?        ?      302.5        5.1       ?       ? 
1 1 1   39   28    9 o     63.4   13.0    0.0000   0.0000          ?        ?    42.1424  15.9630          ?        ?       63.4       13.0       ?       ? 
1 1 1   39   28   10 o    282.9    3.8    0.0000   0.0000          ?        ?   801.3447  21.7097          ?        ?      282.9        3.8       ?       ? 
1 1 1   39   28   11 o    115.3    6.9    0.0000   0.0000          ?        ?   133.4510  15.9630          ?        ?      115.3        6.9       ?       ? 
1 1 1   39   28   12 o    434.9    3.9    0.0000   0.0000          ?        ?  1893.2167  33.8416          ?        ?      434.9        3.9       ?       ? 
1 1 1   39   28   13 o    280.6    5.0    0.0000   0.0000          ?        ?   789.2127  28.0950          ?        ?      280.6        5.0       ?       ? 
1 1 1   39   28   14 o    257.3    3.2    0.0000   0.0000          ?        ?   662.7855  16.6016          ?        ?      257.3        3.2       ?       ? 
1 1 1   39   28   15 o    176.8    3.1    0.0000   0.0000          ?        ?   312.8756  10.8549          ?        ?      176.8        3.1       ?       ? 
1 1 1   39   28   16 o    291.3    3.0    0.0000   0.0000          ?        ?   849.2338  17.2401          ?        ?      291.3        3.0       ?       ? 
1 1 1   39   28   17 o    131.7    4.6    0.0000   0.0000          ?        ?   173.6779  12.1319          ?        ?      131.7        4.6       ?       ? 
1 1 1   39   28   18 o    153.6    4.6    0.0000   0.0000          ?        ?   236.2530  14.0475          ?        ?      153.6        4.6       ?       ? 
1 1 1   39   28   19 o    337.2    3.2    0.0000   0.0000          ?        ?  1137.8455  21.7097          ?        ?      337.2        3.2       ?       ? 
1 1 1   39   28   20 o    197.4    3.7    0.0000   0.0000          ?        ?   390.1367  14.6860          ?        ?      197.4        3.7       ?       ? 
1 1 1   39   28   21 o    364.0    2.8    0.0000   0.0000          ?        ?  1326.2094  20.4327          ?        ?      364.0        2.8       ?       ? 
1 1 1   39   28   22 o    132.2    4.1    0.0000   0.0000          ?        ?   174.9549  10.8549          ?        ?      132.2        4.1       ?       ? 
1 1 1   39   28   23 o    203.3    3.3    0.0000   0.0000          ?        ?   413.7620  13.4090          ?        ?      203.3        3.3       ?       ? 
1 1 1   39   28   24 o    156.2    4.1    0.0000   0.0000          ?        ?   244.5538  12.7704          ?        ?      156.2        4.1       ?       ? 
1 1 1   39   28   25 o    207.3    3.2    0.0000   0.0000          ?        ?   430.3636  13.4090          ?        ?      207.3        3.2       ?       ? 
1 1 1   39   28   26 o    316.0    2.6    0.0000   0.0000          ?        ?   999.2863  16.6016          ?        ?      316.0        2.6       ?       ? 
1 1 1   39   28   27 o     16.0    8.1    0.0000   0.0000          ?        ?   -49.1662  13.4090          ?        ?       16.0        8.1       ?       ? 
1 1 1   39   28   28 o    130.4    5.1    0.0000   0.0000          ?        ?   170.4853  13.4090          ?        ?      130.4        5.1       ?       ? 
1 1 1   39   28   29 o    145.6    4.6    0.0000   0.0000          ?        ?   212.6277  13.4090          ?        ?      145.6        4.6       ?       ? 
1 1 1   39   28   30 o    202.0    3.6    0.0000   0.0000          ?        ?   408.6538  14.6860          ?        ?      202.0        3.6       ?       ? 
1 1 1   39   28   31 o    159.0    4.6    0.0000   0.0000          ?        ?   253.4931  14.6860          ?        ?      159.0        4.6       ?       ? 
1 1 1   39   28   32 o    306.9    2.9    0.0000   0.0000          ?        ?   943.0964  17.8786          ?        ?      306.9        2.9       ?       ? 
1 1 1   39   28   33 o     16.7    8.5    0.0000   0.0000          ?        ?   -54.2743  14.6860          ?        ?       16.7        8.5       ?       ? 
1 1 1   39   28   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   28   35 o     77.7    9.4    0.0000   0.0000          ?        ?    61.2981  14.6860          ?        ?       77.7        9.4       ?       ? 
1 1 1   39   28   36 o    173.3    4.4    0.0000   0.0000          ?        ?   301.3822  15.3245          ?        ?      173.3        4.4       ?       ? 
1 1 1   39   28   37 o    152.7    5.0    0.0000   0.0000          ?        ?   234.3374  15.3245          ?        ?      152.7        5.0       ?       ? 
1 1 1   39   28   38 o    195.1    4.3    0.0000   0.0000          ?        ?   381.8359  16.6016          ?        ?      195.1        4.3       ?       ? 
1 1 1   39   28   39 o    150.8    5.3    0.0000   0.0000          ?        ?   228.5907  15.9630          ?        ?      150.8        5.3       ?       ? 
1 1 1   39   29    0 f    164.6   11.0  275.8413  35.7572   275.8413  35.7572   275.8413  35.7572      164.6     11.0      164.6       11.0     0.0     0.0 
1 1 1   39   29    1 o    401.9    4.3    0.0000   0.0000          ?        ?  1617.3752  34.4802          ?        ?      401.9        4.3       ?       ? 
1 1 1   39   29    2 o    220.1    7.5    0.0000   0.0000          ?        ?   486.5535  33.2031          ?        ?      220.1        7.5       ?       ? 
1 1 1   39   29    3 o    238.6    6.6    0.0000   0.0000          ?        ?   571.4769  31.2876          ?        ?      238.6        6.6       ?       ? 
1 1 1   39   29    4 f    325.1    4.6    0.0000   0.0000          ?        ?  1058.6688  30.0105          ?        ?      325.1        4.6       ?       ? 
1 1 1   39   29    5 o    162.6    7.9    0.0000   0.0000          ?        ?   265.6250  25.5409          ?        ?      162.6        7.9       ?       ? 
1 1 1   39   29    6 o    282.1    6.6    0.0000   0.0000          ?        ?   798.7905  37.0343          ?        ?      282.1        6.6       ?       ? 
1 1 1   39   29    7 o    203.7    7.4    0.0000   0.0000          ?        ?   416.9547  30.0105          ?        ?      203.7        7.4       ?       ? 
1 1 1   39   29    8 o    341.2    5.1    0.0000   0.0000          ?        ?  1166.5790  34.4802          ?        ?      341.2        5.1       ?       ? 
1 1 1   39   29    9 f    177.1    4.1    0.0000   0.0000          ?        ?   314.1526  14.6860          ?        ?      177.1        4.1       ?       ? 
1 1 1   39   29   10 o    353.9    3.3    0.0000   0.0000          ?        ?  1253.4180  23.6253          ?        ?      353.9        3.3       ?       ? 
1 1 1   39   29   11 o    301.8    4.2    0.0000   0.0000          ?        ?   912.4474  25.5409          ?        ?      301.8        4.2       ?       ? 
1 1 1   39   29   12 o    171.9    5.6    0.0000   0.0000          ?        ?   296.2740  19.1556          ?        ?      171.9        5.6       ?       ? 
1 1 1   39   29   13 o     48.2   17.0    0.0000   0.0000          ?        ?    21.0712  20.4327          ?        ?       48.2       17.0       ?       ? 
1 1 1   39   29   14 o    124.7    8.2    0.0000   0.0000          ?        ?   156.4378  20.4327          ?        ?      124.7        8.2       ?       ? 
1 1 1   39   29   15 o     59.3   12.7    0.0000   0.0000          ?        ?    37.0343  14.6860          ?        ?       59.3       12.7       ?       ? 
1 1 1   39   29   16 o    322.0    2.8    0.0000   0.0000          ?        ?  1037.5977  17.8786          ?        ?      322.0        2.8       ?       ? 
1 1 1   39   29   17 o    117.3    4.9    0.0000   0.0000          ?        ?   137.9207  11.4934          ?        ?      117.3        4.9       ?       ? 
1 1 1   39   29   18 o    209.2    3.4    0.0000   0.0000          ?        ?   438.0258  14.0475          ?        ?      209.2        3.4       ?       ? 
1 1 1   39   29   19 o    192.1    4.0    0.0000   0.0000          ?        ?   369.7040  15.3245          ?        ?      192.1        4.0       ?       ? 
1 1 1   39   29   20 o    292.5    3.2    0.0000   0.0000          ?        ?   856.2576  18.5171          ?        ?      292.5        3.2       ?       ? 
1 1 1   39   29   21 o    294.3    3.1    0.0000   0.0000          ?        ?   867.1124  18.5171          ?        ?      294.3        3.1       ?       ? 
1 1 1   39   29   22 o    297.6    2.4    0.0000   0.0000          ?        ?   886.2681  14.0475          ?        ?      297.6        2.4       ?       ? 
1 1 1   39   29   23 o    224.6    2.8    0.0000   0.0000          ?        ?   505.0706  12.7704          ?        ?      224.6        2.8       ?       ? 
1 1 1   39   29   24 o    334.4    2.6    0.0000   0.0000          ?        ?  1119.3285  17.2401          ?        ?      334.4        2.6       ?       ? 
1 1 1   39   29   25 o     20.8   10.0    0.0000   0.0000          ?        ?   -17.8786  12.1319          ?        ?       20.8       10.0       ?       ? 
1 1 1   39   29   26 o     29.8   12.6    0.0000   0.0000          ?        ?     1.2770  12.7704          ?        ?       29.8       12.6       ?       ? 
1 1 1   39   29   27 o    176.5    3.8    0.0000   0.0000          ?        ?   312.2371  13.4090          ?        ?      176.5        3.8       ?       ? 
1 1 1   39   29   28 o     85.4    7.5    0.0000   0.0000          ?        ?    73.4300  12.7704          ?        ?       85.4        7.5       ?       ? 
1 1 1   39   29   29 o     80.3    8.3    0.0000   0.0000          ?        ?    65.1292  13.4090          ?        ?       80.3        8.3       ?       ? 
1 1 1   39   29   30 o     16.6    8.4    0.0000   0.0000          ?        ?   -44.6965  13.4090          ?        ?       16.6        8.4       ?       ? 
1 1 1   39   29   31 o     94.8    7.7    0.0000   0.0000          ?        ?    90.6701  14.6860          ?        ?       94.8        7.7       ?       ? 
1 1 1   39   29   32 o    120.8    6.1    0.0000   0.0000          ?        ?   146.8600  14.6860          ?        ?      120.8        6.1       ?       ? 
1 1 1   39   29   33 o     66.8   10.0    0.0000   0.0000          ?        ?    45.3350  13.4090          ?        ?       66.8       10.0       ?       ? 
1 1 1   39   29   34 o     58.5   12.4    0.0000   0.0000          ?        ?    36.3957  14.0475          ?        ?       58.5       12.4       ?       ? 
1 1 1   39   29   35 o     40.3   14.4    0.0000   0.0000          ?        ?    14.6860  14.6860          ?        ?       40.3       14.4       ?       ? 
1 1 1   39   29   36 o    173.5    4.4    0.0000   0.0000          ?        ?   302.0207  15.3245          ?        ?      173.5        4.4       ?       ? 
1 1 1   39   29   37 o     21.7   10.5    0.0000   0.0000          ?        ?   -22.3483  14.0475          ?        ?       21.7       10.5       ?       ? 
1 1 1   39   29   38 o    130.6    5.9    0.0000   0.0000          ?        ?   171.7623  15.3245          ?        ?      130.6        5.9       ?       ? 
1 1 1   39   30    0 o    278.9    8.0  782.1890  44.6965   782.1890  44.6965   782.1890  44.6965      278.9      8.0      278.9        8.0     0.0     0.0 
1 1 1   39   30    1 o     81.2   23.0    0.0000   0.0000          ?        ?    70.8759  38.9498          ?        ?       81.2       23.0       ?       ? 
1 1 1   39   30    2 o    296.6    7.4    0.0000   0.0000          ?        ?   883.7139  44.0580          ?        ?      296.6        7.4       ?       ? 
1 1 1   39   30    3 o    454.9    6.2    0.0000   0.0000          ?        ?  2075.8337  56.1899          ?        ?      454.9        6.2       ?       ? 
1 1 1   39   30    4 o    194.2   10.4    0.0000   0.0000          ?        ?   380.5589  40.2269          ?        ?      194.2       10.4       ?       ? 
1 1 1   39   30    5 o    256.4    8.2    0.0000   0.0000          ?        ?   661.5084  42.1424          ?        ?      256.4        8.2       ?       ? 
1 1 1   39   30    6 o    172.7    9.8    0.0000   0.0000          ?        ?   300.7437  33.8416          ?        ?      172.7        9.8       ?       ? 
1 1 1   39   30    7 o    236.7    9.0    0.0000   0.0000          ?        ?   564.4531  42.7809          ?        ?      236.7        9.0       ?       ? 
1 1 1   39   30    8 o     83.7   24.7    0.0000   0.0000          ?        ?    75.3456  44.0580          ?        ?       83.7       24.7       ?       ? 
1 1 1   39   30    9 o    359.6    7.2    0.0000   0.0000          ?        ?  1299.3915  51.7203          ?        ?      359.6        7.2       ?       ? 
1 1 1   39   30   10 o     96.3   25.0    0.0000   0.0000          ?        ?   101.5249  48.5276          ?        ?       96.3       25.0       ?       ? 
1 1 1   39   30   11 o    253.5    3.9    0.0000   0.0000          ?        ?   643.6298  19.7942          ?        ?      253.5        3.9       ?       ? 
1 1 1   39   30   12 o    184.3    4.3    0.0000   0.0000          ?        ?   340.3320  15.9630          ?        ?      184.3        4.3       ?       ? 
1 1 1   39   30   13 o    291.7    4.4    0.0000   0.0000          ?        ?   852.4264  25.5409          ?        ?      291.7        4.4       ?       ? 
1 1 1   39   30   14 o    155.6    7.0    0.0000   0.0000          ?        ?   243.2767  21.7097          ?        ?      155.6        7.0       ?       ? 
1 1 1   39   30   15 o    222.3    4.9    0.0000   0.0000          ?        ?   495.4928  21.7097          ?        ?      222.3        4.9       ?       ? 
1 1 1   39   30   16 o    303.8    3.6    0.0000   0.0000          ?        ?   923.9408  21.7097          ?        ?      303.8        3.6       ?       ? 
1 1 1   39   30   17 o    278.0    2.9    0.0000   0.0000          ?        ?   773.2497  15.9630          ?        ?      278.0        2.9       ?       ? 
1 1 1   39   30   18 o     48.6   11.4    0.0000   0.0000          ?        ?    24.9023  10.8549          ?        ?       48.6       11.4       ?       ? 
1 1 1   39   30   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   30   20 o    124.1    5.4    0.0000   0.0000          ?        ?   154.5222  13.4090          ?        ?      124.1        5.4       ?       ? 
1 1 1   39   30   21 o    374.5    3.0    0.0000   0.0000          ?        ?  1404.1090  22.3483          ?        ?      374.5        3.0       ?       ? 
1 1 1   39   30   22 o    247.8    3.2    0.0000   0.0000          ?        ?   614.8964  15.9630          ?        ?      247.8        3.2       ?       ? 
1 1 1   39   30   23 o    158.9    3.4    0.0000   0.0000          ?        ?   252.8546  10.8549          ?        ?      158.9        3.4       ?       ? 
1 1 1   39   30   24 o     23.6   11.1    0.0000   0.0000          ?        ?   -14.0475  13.4090          ?        ?       23.6       11.1       ?       ? 
1 1 1   39   30   25 o    105.8    5.7    0.0000   0.0000          ?        ?   112.3798  12.1319          ?        ?      105.8        5.7       ?       ? 
1 1 1   39   30   26 o     53.3   11.7    0.0000   0.0000          ?        ?    30.0105  12.1319          ?        ?       53.3       11.7       ?       ? 
1 1 1   39   30   27 o    166.5    3.8    0.0000   0.0000          ?        ?   277.7569  12.7704          ?        ?      166.5        3.8       ?       ? 
1 1 1   39   30   28 o    120.1    5.3    0.0000   0.0000          ?        ?   144.9444  12.7704          ?        ?      120.1        5.3       ?       ? 
1 1 1   39   30   29 o    138.1    5.1    0.0000   0.0000          ?        ?   191.5565  14.0475          ?        ?      138.1        5.1       ?       ? 
1 1 1   39   30   30 o    236.3    3.1    0.0000   0.0000          ?        ?   559.3449  14.6860          ?        ?      236.3        3.1       ?       ? 
1 1 1   39   30   31 o    324.1    2.8    0.0000   0.0000          ?        ?  1051.6451  17.8786          ?        ?      324.1        2.8       ?       ? 
1 1 1   39   30   32 o    234.7    3.3    0.0000   0.0000          ?        ?   551.6827  15.3245          ?        ?      234.7        3.3       ?       ? 
1 1 1   39   30   33 o    140.8    5.0    0.0000   0.0000          ?        ?   199.2188  14.0475          ?        ?      140.8        5.0       ?       ? 
1 1 1   39   30   34 o     60.0   12.1    0.0000   0.0000          ?        ?    38.3113  14.0475          ?        ?       60.0       12.1       ?       ? 
1 1 1   39   30   35 o    249.5    3.2    0.0000   0.0000          ?        ?   623.8356  15.9630          ?        ?      249.5        3.2       ?       ? 
1 1 1   39   30   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   31    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   31    1 o    351.8    8.6    0.0000   0.0000          ?        ?  1246.3942  60.6596          ?        ?      351.8        8.6       ?       ? 
1 1 1   39   31    2 o    308.7   10.9    0.0000   0.0000          ?        ?   963.5291  67.0448          ?        ?      308.7       10.9       ?       ? 
1 1 1   39   31    3 o    238.4    7.1    0.0000   0.0000          ?        ?   570.8383  33.8416          ?        ?      238.4        7.1       ?       ? 
1 1 1   39   31    4 o    138.2   14.6    0.0000   0.0000          ?        ?   194.7491  40.2269          ?        ?      138.2       14.6       ?       ? 
1 1 1   39   31    5 o    265.1    8.2    0.0000   0.0000          ?        ?   707.4820  43.4195          ?        ?      265.1        8.2       ?       ? 
1 1 1   39   31    6 o    212.5    8.3    0.0000   0.0000          ?        ?   454.6274  35.1187          ?        ?      212.5        8.3       ?       ? 
1 1 1   39   31    7 o     34.7   16.1    0.0000   0.0000          ?        ?   -22.3483  26.8179          ?        ?       34.7       16.1       ?       ? 
1 1 1   39   31    8 o    180.3   10.8    0.0000   0.0000          ?        ?   328.8386  38.9498          ?        ?      180.3       10.8       ?       ? 
1 1 1   39   31    9 f     75.3   25.6    0.0000   0.0000          ?        ?    57.4669  45.9736          ?        ?       75.3       25.6       ?       ? 
1 1 1   39   31   10 o    311.9    8.6    0.0000   0.0000          ?        ?   980.1307  53.6358          ?        ?      311.9        8.6       ?       ? 
1 1 1   39   31   11 o    101.5   20.9    0.0000   0.0000          ?        ?   111.1028  40.8654          ?        ?      101.5       20.9       ?       ? 
1 1 1   39   31   12 o    231.7    4.1    0.0000   0.0000          ?        ?   537.6352  19.1556          ?        ?      231.7        4.1       ?       ? 
1 1 1   39   31   13 o    135.3    6.8    0.0000   0.0000          ?        ?   183.8942  18.5171          ?        ?      135.3        6.8       ?       ? 
1 1 1   39   31   14 o    444.9    4.0    0.0000   0.0000          ?        ?  1983.2482  35.7572          ?        ?      444.9        4.0       ?       ? 
1 1 1   39   31   15 o    105.8    9.0    0.0000   0.0000          ?        ?   113.0183  19.1556          ?        ?      105.8        9.0       ?       ? 
1 1 1   39   31   16 o    236.6    3.4    0.0000   0.0000          ?        ?   560.6220  15.9630          ?        ?      236.6        3.4       ?       ? 
1 1 1   39   31   17 o     28.3   12.5    0.0000   0.0000          ?        ?    -4.4697  14.0475          ?        ?       28.3       12.5       ?       ? 
1 1 1   39   31   18 o    211.8    3.9    0.0000   0.0000          ?        ?   449.5192  16.6016          ?        ?      211.8        3.9       ?       ? 
1 1 1   39   31   19 o    136.9    4.2    0.0000   0.0000          ?        ?   187.7254  11.4934          ?        ?      136.9        4.2       ?       ? 
1 1 1   39   31   20 f    220.6    3.3    0.0000   0.0000          ?        ?   487.1920  14.6860          ?        ?      220.6        3.3       ?       ? 
1 1 1   39   31   21 f    289.9    3.1    0.0000   0.0000          ?        ?   841.5715  17.8786          ?        ?      289.9        3.1       ?       ? 
1 1 1   39   31   22 o    201.6    3.8    0.0000   0.0000          ?        ?   407.3768  15.3245          ?        ?      201.6        3.8       ?       ? 
1 1 1   39   31   23 o     76.4    6.3    0.0000   0.0000          ?        ?    58.7440   9.5778          ?        ?       76.4        6.3       ?       ? 
1 1 1   39   31   24 o    273.3    2.6    0.0000   0.0000          ?        ?   747.7088  14.0475          ?        ?      273.3        2.6       ?       ? 
1 1 1   39   31   25 o    326.6    2.5    0.0000   0.0000          ?        ?  1067.6082  16.6016          ?        ?      326.6        2.5       ?       ? 
1 1 1   39   31   26 o    116.1    5.5    0.0000   0.0000          ?        ?   135.3666  12.7704          ?        ?      116.1        5.5       ?       ? 
1 1 1   39   31   27 o    184.5    3.5    0.0000   0.0000          ?        ?   340.9706  12.7704          ?        ?      184.5        3.5       ?       ? 
1 1 1   39   31   28 o    284.7    2.7    0.0000   0.0000          ?        ?   811.5610  15.3245          ?        ?      284.7        2.7       ?       ? 
1 1 1   39   31   29 o     94.4    7.4    0.0000   0.0000          ?        ?    90.0316  14.0475          ?        ?       94.4        7.4       ?       ? 
1 1 1   39   31   30 o    198.9    3.5    0.0000   0.0000          ?        ?   396.5219  14.0475          ?        ?      198.9        3.5       ?       ? 
1 1 1   39   31   31 o    226.1    3.2    0.0000   0.0000          ?        ?   512.0943  14.6860          ?        ?      226.1        3.2       ?       ? 
1 1 1   39   31   32 o    153.1    5.0    0.0000   0.0000          ?        ?   235.6145  15.3245          ?        ?      153.1        5.0       ?       ? 
1 1 1   39   31   33 o     32.0   13.3    0.0000   0.0000          ?        ?     3.1926  14.0475          ?        ?       32.0       13.3       ?       ? 
1 1 1   39   32    0 o     48.4   28.3   31.2876  44.6965    31.2876  44.6965    31.2876  44.6965       48.4     28.3       48.4       28.3     0.0     0.0 
1 1 1   39   32    1 o    159.1   14.2    0.0000   0.0000          ?        ?   258.6013  45.3350          ?        ?      159.1       14.2       ?       ? 
1 1 1   39   32    2 o    155.9   14.5    0.0000   0.0000          ?        ?   248.3849  45.3350          ?        ?      155.9       14.5       ?       ? 
1 1 1   39   32    3 o    248.4    8.0    0.0000   0.0000          ?        ?   621.2816  39.5883          ?        ?      248.4        8.0       ?       ? 
1 1 1   39   32    4 f    196.3    7.6    0.0000   0.0000          ?        ?   387.5826  30.0105          ?        ?      196.3        7.6       ?       ? 
1 1 1   39   32    5 o    141.3   14.9    0.0000   0.0000          ?        ?   204.3269  42.1424          ?        ?      141.3       14.9       ?       ? 
1 1 1   39   32    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   32    7 o    218.1   14.2    0.0000   0.0000          ?        ?   485.9149  61.9366          ?        ?      218.1       14.2       ?       ? 
1 1 1   39   32    8 f    230.5   20.6    0.0000   0.0000          ?        ?   556.1523  95.1397          ?        ?      230.5       20.6       ?       ? 
1 1 1   39   32    9 o    448.1    7.3    0.0000   0.0000          ?        ?  2019.6438  65.1292          ?        ?      448.1        7.3       ?       ? 
1 1 1   39   32   10 o    174.1    9.9    0.0000   0.0000          ?        ?   306.4904  34.4802          ?        ?      174.1        9.9       ?       ? 
1 1 1   39   32   11 o    213.5    6.9    0.0000   0.0000          ?        ?   458.4586  29.3720          ?        ?      213.5        6.9       ?       ? 
1 1 1   39   32   12 o    149.6   29.0    0.0000   0.0000          ?        ?   251.5775  83.6463          ?        ?      149.6       29.0       ?       ? 
1 1 1   39   32   13 o    235.7    4.5    0.0000   0.0000          ?        ?   556.7908  21.0712          ?        ?      235.7        4.5       ?       ? 
1 1 1   39   32   14 o    172.6    5.2    0.0000   0.0000          ?        ?   298.8281  17.8786          ?        ?      172.6        5.2       ?       ? 
1 1 1   39   32   15 o    309.2    4.9    0.0000   0.0000          ?        ?   959.0594  30.0105          ?        ?      309.2        4.9       ?       ? 
1 1 1   39   32   16 o     49.8   13.7    0.0000   0.0000          ?        ?    26.1794  14.0475          ?        ?       49.8       13.7       ?       ? 
1 1 1   39   32   17 o    208.6    3.8    0.0000   0.0000          ?        ?   436.1103  15.9630          ?        ?      208.6        3.8       ?       ? 
1 1 1   39   32   18 o    161.6    4.5    0.0000   0.0000          ?        ?   261.7939  14.6860          ?        ?      161.6        4.5       ?       ? 
1 1 1   39   32   19 o    238.3    3.9    0.0000   0.0000          ?        ?   568.9227  18.5171          ?        ?      238.3        3.9       ?       ? 
1 1 1   39   32   20 o     72.9    7.9    0.0000   0.0000          ?        ?    53.6358  11.4934          ?        ?       72.9        7.9       ?       ? 
1 1 1   39   32   21 f    318.6    2.8    0.0000   0.0000          ?        ?  1015.8879  17.8786          ?        ?      318.6        2.8       ?       ? 
1 1 1   39   32   22 o    218.2    3.4    0.0000   0.0000          ?        ?   476.9756  14.6860          ?        ?      218.2        3.4       ?       ? 
1 1 1   39   32   23 o     87.2    7.3    0.0000   0.0000          ?        ?    76.6226  12.7704          ?        ?       87.2        7.3       ?       ? 
1 1 1   39   32   24 o    147.6    3.7    0.0000   0.0000          ?        ?   218.3744  10.8549          ?        ?      147.6        3.7       ?       ? 
1 1 1   39   32   25 o    299.3    2.6    0.0000   0.0000          ?        ?   896.4843  15.3245          ?        ?      299.3        2.6       ?       ? 
1 1 1   39   32   26 o    205.1    3.3    0.0000   0.0000          ?        ?   421.4243  13.4090          ?        ?      205.1        3.3       ?       ? 
1 1 1   39   32   27 o    192.1    3.5    0.0000   0.0000          ?        ?   369.7040  13.4090          ?        ?      192.1        3.5       ?       ? 
1 1 1   39   32   28 o     18.9    9.3    0.0000   0.0000          ?        ?   -24.2638  12.1319          ?        ?       18.9        9.3       ?       ? 
1 1 1   39   32   29 o     83.3    7.7    0.0000   0.0000          ?        ?    70.2374  12.7704          ?        ?       83.3        7.7       ?       ? 
1 1 1   39   32   30 o     50.7   12.1    0.0000   0.0000          ?        ?    27.4564  12.1319          ?        ?       50.7       12.1       ?       ? 
1 1 1   39   32   31 o    139.2    4.8    0.0000   0.0000          ?        ?   194.7491  13.4090          ?        ?      139.2        4.8       ?       ? 
1 1 1   39   33    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   33    1 o    151.0   16.1    0.0000   0.0000          ?        ?   234.9760  48.5276          ?        ?      151.0       16.1       ?       ? 
1 1 1   39   33    2 o    226.0    7.6    0.0000   0.0000          ?        ?   514.0099  34.4802          ?        ?      226.0        7.6       ?       ? 
1 1 1   39   33    3 o    266.7   10.7    0.0000   0.0000          ?        ?   720.8909  56.8284          ?        ?      266.7       10.7       ?       ? 
1 1 1   39   33    4 o     95.6   22.4    0.0000   0.0000          ?        ?   100.2479  42.1424          ?        ?       95.6       22.4       ?       ? 
1 1 1   39   33    5 o     76.9   25.6    0.0000   0.0000          ?        ?    61.9366  45.9736          ?        ?       76.9       25.6       ?       ? 
1 1 1   39   33    6 o    174.0   12.5    0.0000   0.0000          ?        ?   308.4059  43.4195          ?        ?      174.0       12.5       ?       ? 
1 1 1   39   33    7 o     76.7   25.4    0.0000   0.0000          ?        ?    61.9366  45.3350          ?        ?       76.7       25.4       ?       ? 
1 1 1   39   33    8 o     68.0   28.8    0.0000   0.0000          ?        ?    15.3245  67.6833          ?        ?       68.0       28.8       ?       ? 
1 1 1   39   33    9 o     74.6   25.7    0.0000   0.0000          ?        ?    56.8284  46.6121          ?        ?       74.6       25.7       ?       ? 
1 1 1   39   33   10 f     76.6   27.9    0.0000   0.0000          ?        ?    56.8284  55.5514          ?        ?       76.6       27.9       ?       ? 
1 1 1   39   33   11 o     37.5   18.2    0.0000   0.0000          ?        ?   -68.3218  42.7809          ?        ?       37.5       18.2       ?       ? 
1 1 1   39   33   12 o    143.2   28.7    0.0000   0.0000          ?        ?   232.4219  79.1767          ?        ?      143.2       28.7       ?       ? 
1 1 1   39   33   13 o    262.8   10.2    0.0000   0.0000          ?        ?   699.8197  53.6358          ?        ?      262.8       10.2       ?       ? 
1 1 1   39   33   14 o    307.3    4.4    0.0000   0.0000          ?        ?   946.9276  26.8179          ?        ?      307.3        4.4       ?       ? 
1 1 1   39   33   15 o    103.6    9.6    0.0000   0.0000          ?        ?   108.5487  19.7942          ?        ?      103.6        9.6       ?       ? 
1 1 1   39   33   16 o    127.5    8.5    0.0000   0.0000          ?        ?   164.1001  21.7097          ?        ?      127.5        8.5       ?       ? 
1 1 1   39   33   17 o     20.0    9.7    0.0000   0.0000          ?        ?   -20.4327  12.1319          ?        ?       20.0        9.7       ?       ? 
1 1 1   39   33   18 o    178.1    4.5    0.0000   0.0000          ?        ?   317.9838  15.9630          ?        ?      178.1        4.5       ?       ? 
1 1 1   39   33   19 o    136.0    5.9    0.0000   0.0000          ?        ?   185.8098  15.9630          ?        ?      136.0        5.9       ?       ? 
1 1 1   39   33   20 o    301.2    3.7    0.0000   0.0000          ?        ?   909.2548  22.3483          ?        ?      301.2        3.7       ?       ? 
1 1 1   39   33   21 o    136.8    4.2    0.0000   0.0000          ?        ?   187.7254  11.4934          ?        ?      136.8        4.2       ?       ? 
1 1 1   39   33   22 o    166.8    3.8    0.0000   0.0000          ?        ?   279.0340  12.7704          ?        ?      166.8        3.8       ?       ? 
1 1 1   39   33   23 o     19.7    9.7    0.0000   0.0000          ?        ?   -24.2638  12.7704          ?        ?       19.7        9.7       ?       ? 
1 1 1   39   33   24 o     64.1    7.0    0.0000   0.0000          ?        ?    41.5039   8.9393          ?        ?       64.1        7.0       ?       ? 
1 1 1   39   33   25 o     77.6    6.6    0.0000   0.0000          ?        ?    60.6596  10.2163          ?        ?       77.6        6.6       ?       ? 
1 1 1   39   33   26 o     65.5    8.3    0.0000   0.0000          ?        ?    43.4195  10.8549          ?        ?       65.5        8.3       ?       ? 
1 1 1   39   33   27 o    140.7    4.3    0.0000   0.0000          ?        ?   198.5802  12.1319          ?        ?      140.7        4.3       ?       ? 
1 1 1   39   33   28 o     25.4   11.3    0.0000   0.0000          ?        ?    -3.8311  11.4934          ?        ?       25.4       11.3       ?       ? 
1 1 1   39   34    0 o    268.3   15.8  738.7695  84.2849   738.7695  84.2849   738.7695  84.2849      268.3     15.8      268.3       15.8     0.0     0.0 
1 1 1   39   34    1 o    182.6   12.6    0.0000   0.0000          ?        ?   340.3320  45.9736          ?        ?      182.6       12.6       ?       ? 
1 1 1   39   34    2 o    376.4    9.2    0.0000   0.0000          ?        ?  1432.2040  68.9603          ?        ?      376.4        9.2       ?       ? 
1 1 1   39   34    3 o    172.6   11.1    0.0000   0.0000          ?        ?   302.6593  38.3113          ?        ?      172.6       11.1       ?       ? 
1 1 1   39   34    4 o    172.9   17.0    0.0000   0.0000          ?        ?   310.3215  58.7440          ?        ?      172.9       17.0       ?       ? 
1 1 1   39   34    5 o     87.7   19.4    0.0000   0.0000          ?        ?    83.6463  33.2031          ?        ?       87.7       19.4       ?       ? 
1 1 1   39   34    6 o     91.7   32.5    0.0000   0.0000          ?        ?    90.6701  74.7070          ?        ?       91.7       32.5       ?       ? 
1 1 1   39   34    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   34    8 o    215.9   11.1    0.0000   0.0000          ?        ?   473.7830  47.8891          ?        ?      215.9       11.1       ?       ? 
1 1 1   39   34    9 o    155.3   19.7    0.0000   0.0000          ?        ?   254.1316  61.2981          ?        ?      155.3       19.7       ?       ? 
1 1 1   39   34   10 o    142.9   15.2    0.0000   0.0000          ?        ?   210.7121  43.4195          ?        ?      142.9       15.2       ?       ? 
1 1 1   39   34   11 o    130.1   17.9    0.0000   0.0000          ?        ?   176.8705  46.6121          ?        ?      130.1       17.9       ?       ? 
1 1 1   39   34   12 o    350.2   10.0    0.0000   0.0000          ?        ?  1244.4786  70.2374          ?        ?      350.2       10.0       ?       ? 
1 1 1   39   34   13 o    214.3   14.8    0.0000   0.0000          ?        ?   473.7830  63.2136          ?        ?      214.3       14.8       ?       ? 
1 1 1   39   34   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   34   15 o    216.8    5.0    0.0000   0.0000          ?        ?   471.8675  21.7097          ?        ?      216.8        5.0       ?       ? 
1 1 1   39   34   16 o     43.9   16.7    0.0000   0.0000          ?        ?    14.6860  20.4327          ?        ?       43.9       16.7       ?       ? 
1 1 1   39   34   17 o    228.3    3.9    0.0000   0.0000          ?        ?   522.3107  17.8786          ?        ?      228.3        3.9       ?       ? 
1 1 1   39   34   18 o    117.9    6.2    0.0000   0.0000          ?        ?   139.8362  14.6860          ?        ?      117.9        6.2       ?       ? 
1 1 1   39   34   19 o    190.0    4.4    0.0000   0.0000          ?        ?   362.0418  16.6016          ?        ?      190.0        4.4       ?       ? 
1 1 1   39   34   20 o    132.6    5.8    0.0000   0.0000          ?        ?   176.8705  15.3245          ?        ?      132.6        5.8       ?       ? 
1 1 1   39   34   21 o    272.7    3.5    0.0000   0.0000          ?        ?   745.1547  19.1556          ?        ?      272.7        3.5       ?       ? 
1 1 1   39   34   22 o    278.9    2.7    0.0000   0.0000          ?        ?   778.9964  15.3245          ?        ?      278.9        2.7       ?       ? 
1 1 1   39   34   23 o    118.8    5.1    0.0000   0.0000          ?        ?   141.7518  12.1319          ?        ?      118.8        5.1       ?       ? 
1 1 1   39   34   24 o    127.0    5.0    0.0000   0.0000          ?        ?   162.1845  12.7704          ?        ?      127.0        5.0       ?       ? 
1 1 1   39   34   25 o     95.3    5.0    0.0000   0.0000          ?        ?    91.3086   9.5778          ?        ?       95.3        5.0       ?       ? 
1 1 1   39   35    0 o     21.5   15.9 -110.4642  44.0580  -110.4642  44.0580  -110.4642  44.0580       21.5     15.9       21.5       15.9     0.0     0.0 
1 1 1   39   35    1 o     85.0   27.2    0.0000   0.0000          ?        ?    80.4537  52.3588          ?        ?       85.0       27.2       ?       ? 
1 1 1   39   35    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   35    3 o     82.9   28.1    0.0000   0.0000          ?        ?    74.7070  55.5514          ?        ?       82.9       28.1       ?       ? 
1 1 1   39   35    4 o     56.4   23.1    0.0000   0.0000          ?        ?    16.6016  41.5039          ?        ?       56.4       23.1       ?       ? 
1 1 1   39   35    5 o    181.2   11.3    0.0000   0.0000          ?        ?   334.5853  40.8654          ?        ?      181.2       11.3       ?       ? 
1 1 1   39   35    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   35    7 o    207.2   21.7    0.0000   0.0000          ?        ?   460.3741  90.0316          ?        ?      207.2       21.7       ?       ? 
1 1 1   39   35    8 f    147.1   24.3    0.0000   0.0000          ?        ?   236.2530  71.5144          ?        ?      147.1       24.3       ?       ? 
1 1 1   39   35    9 o     79.1   32.8    0.0000   0.0000          ?        ?    42.7809  84.9234          ?        ?       79.1       32.8       ?       ? 
1 1 1   39   35   10 o    293.4   11.0    0.0000   0.0000          ?        ?   877.3287  64.4907          ?        ?      293.4       11.0       ?       ? 
1 1 1   39   35   11 o    214.8   10.7    0.0000   0.0000          ?        ?   469.9519  45.9736          ?        ?      214.8       10.7       ?       ? 
1 1 1   39   35   12 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   35   13 o    296.4   10.8    0.0000   0.0000          ?        ?   895.8459  63.8522          ?        ?      296.4       10.8       ?       ? 
1 1 1   39   35   14 o     64.1   29.5    0.0000   0.0000          ?        ?   -36.3957  87.4775          ?        ?       64.1       29.5       ?       ? 
1 1 1   39   35   15 o    137.8   17.4    0.0000   0.0000          ?        ?   199.8573  47.8891          ?        ?      137.8       17.4       ?       ? 
1 1 1   39   35   16 o    274.3    4.2    0.0000   0.0000          ?        ?   754.7325  22.9868          ?        ?      274.3        4.2       ?       ? 
1 1 1   39   35   17 o    119.1    8.3    0.0000   0.0000          ?        ?   143.6674  19.7942          ?        ?      119.1        8.3       ?       ? 
1 1 1   39   35   18 o     79.8    8.0    0.0000   0.0000          ?        ?    64.4907  12.7704          ?        ?       79.8        8.0       ?       ? 
1 1 1   39   35   19 o     40.2   14.4    0.0000   0.0000          ?        ?    14.6860  14.6860          ?        ?       40.2       14.4       ?       ? 
1 1 1   39   35   20 o     56.7   13.2    0.0000   0.0000          ?        ?    34.4802  14.6860          ?        ?       56.7       13.2       ?       ? 
1 1 1   39   35   21 o    231.3    3.7    0.0000   0.0000          ?        ?   536.3582  17.2401          ?        ?      231.3        3.7       ?       ? 
1 1 1   39   35   22 o    101.0    7.9    0.0000   0.0000          ?        ?   103.4405  15.9630          ?        ?      101.0        7.9       ?       ? 
1 1 1   39   36    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   36    1 o     99.5   25.3    0.0000   0.0000          ?        ?   113.6568  50.4432          ?        ?       99.5       25.3       ?       ? 
1 1 1   39   36    2 o     74.8   31.0    0.0000   0.0000          ?        ?    37.0343  75.9841          ?        ?       74.8       31.0       ?       ? 
1 1 1   39   36    3 o    108.3   20.5    0.0000   0.0000          ?        ?   128.9814  42.7809          ?        ?      108.3       20.5       ?       ? 
1 1 1   39   36    4 o    184.8   20.7    0.0000   0.0000          ?        ?   366.5114  76.6226          ?        ?      184.8       20.7       ?       ? 
1 1 1   39   36    5 o    213.9   11.2    0.0000   0.0000          ?        ?   467.3978  47.8891          ?        ?      213.9       11.2       ?       ? 
1 1 1   39   36    6 o    137.4   21.8    0.0000   0.0000          ?        ?   204.3269  60.0210          ?        ?      137.4       21.8       ?       ? 
1 1 1   39   36    7 o    275.3   17.7    0.0000   0.0000          ?        ?   799.4291  97.6938          ?        ?      275.3       17.7       ?       ? 
1 1 1   39   36    8 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   36    9 o    127.9   35.6    0.0000   0.0000          ?        ?   208.1580  94.5012          ?        ?      127.9       35.6       ?       ? 
1 1 1   39   36   10 o    323.5   14.0    0.0000   0.0000          ?        ?  1083.5712  90.6701          ?        ?      323.5       14.0       ?       ? 
1 1 1   39   36   11 o    129.5   21.4    0.0000   0.0000          ?        ?   181.9787  55.5514          ?        ?      129.5       21.4       ?       ? 
1 1 1   39   36   12 o    218.8   17.9    0.0000   0.0000          ?        ?   507.6247  78.5382          ?        ?      218.8       17.9       ?       ? 
1 1 1   39   36   13 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   36   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   36   15 o     72.0   28.3    0.0000   0.0000          ?        ?    47.2506  59.3825          ?        ?       72.0       28.3       ?       ? 
1 1 1   39   36   16 o    133.3   26.6    0.0000   0.0000          ?        ?   208.1580  68.3218          ?        ?      133.3       26.6       ?       ? 
1 1 1   39   36   17 o    157.3    5.7    0.0000   0.0000          ?        ?   249.0234  17.8786          ?        ?      157.3        5.7       ?       ? 
1 1 1   39   37    0 o     73.2   39.8   91.9471  81.0922    91.9471  81.0922    91.9471  81.0922       73.2     39.8       73.2       39.8     0.0     0.0 
1 1 1   39   37    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   37    2 o     81.1   28.4    0.0000   0.0000          ?        ?    73.4300  56.8284          ?        ?       81.1       28.4       ?       ? 
1 1 1   39   37    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   37    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   37    5 o     94.4   27.2    0.0000   0.0000          ?        ?   105.3561  54.2743          ?        ?       94.4       27.2       ?       ? 
1 1 1   39   37    6 o     62.9   28.3    0.0000   0.0000          ?        ?   -10.8549  74.7070          ?        ?       62.9       28.3       ?       ? 
1 1 1   39   37    7 o     76.9   32.7    0.0000   0.0000          ?        ?    37.6728  88.1160          ?        ?       76.9       32.7       ?       ? 
1 1 1   39   37    8 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   37    9 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   39   37   10 o    116.2   26.7    0.0000   0.0000          ?        ?   159.6304  60.6596          ?        ?      116.2       26.7       ?       ? 
1 1 1   39   37   11 o    148.8   19.5    0.0000   0.0000          ?        ?   239.4456  58.1055          ?        ?      148.8       19.5       ?       ? 
1 1 1   39   37   12 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    0    0 o   1857.8   12.3 34528.6953 457.8200 34528.6953 457.8200 34528.6953 457.8200     1857.8     12.3     1857.8       12.3     0.0     0.0 
1 1 1   40    0    1 o    268.4    4.2  720.8909  22.3483   720.8909  22.3483   720.8909  22.3483      268.4      4.2      268.4        4.2     0.0     0.0 
1 1 1   40    0    2 f    627.7    3.9 3940.3169  48.5276  3940.3169  48.5276  3940.3169  48.5276      627.7      3.9      627.7        3.9     0.0     0.0 
1 1 1   40    0    3 o    230.0    3.9  529.3344  17.8786   529.3344  17.8786   529.3344  17.8786      230.0      3.9      230.0        3.9     0.0     0.0 
1 1 1   40    0    4 o    695.5    4.0 4838.0786  56.1899  4838.0786  56.1899  4838.0786  56.1899      695.5      4.0      695.5        4.0     0.0     0.0 
1 1 1   40    0    5 o    701.0    4.2 4914.7012  59.3825  4914.7012  59.3825  4914.7012  59.3825      701.0      4.2      701.0        4.2     0.0     0.0 
1 1 1   40    0    6 o    305.1    3.7  931.6030  22.3483   931.6030  22.3483   931.6030  22.3483      305.1      3.7      305.1        3.7     0.0     0.0 
1 1 1   40    0    7 o   1228.7    6.2 15100.3975 151.9681 15100.3975 151.9681 15100.3975 151.9681     1228.7      6.2     1228.7        6.2     0.0     0.0 
1 1 1   40    0    8 o    792.9    4.4 6288.7998  69.5989  6288.7998  69.5989  6288.7998  69.5989      792.9      4.4      792.9        4.4     0.0     0.0 
1 1 1   40    0    9 o    720.7    4.2 5195.6504  60.0210  5195.6504  60.0210  5195.6504  60.0210      720.7      4.2      720.7        4.2     0.0     0.0 
1 1 1   40    0   10 o     70.5   13.0   54.2743  16.6016    54.2743  16.6016    54.2743  16.6016       70.5     13.0       70.5       13.0     0.0     0.0 
1 1 1   40    0   11 f    180.4    4.8  326.2845  17.2401   326.2845  17.2401   326.2845  17.2401      180.4      4.8      180.4        4.8     0.0     0.0 
1 1 1   40    0   12 o    238.5    4.2  569.5613  19.7942   569.5613  19.7942   569.5613  19.7942      238.5      4.2      238.5        4.2     0.0     0.0 
1 1 1   40    0   13 o    123.6    8.6  155.1608  21.0712   155.1608  21.0712   155.1608  21.0712      123.6      8.6      123.6        8.6     0.0     0.0 
1 1 1   40    0   14 o     13.9   10.3  -40.8654  17.2401   -40.8654  17.2401   -40.8654  17.2401       13.9     10.3       13.9       10.3     0.0     0.0 
1 1 1   40    0   15 o    658.0    3.9 4330.4536  51.0817  4330.4536  51.0817  4330.4536  51.0817      658.0      3.9      658.0        3.9     0.0     0.0 
1 1 1   40    0   16 o    263.4    3.8  694.0730  19.7942   694.0730  19.7942   694.0730  19.7942      263.4      3.8      263.4        3.8     0.0     0.0 
1 1 1   40    0   17 o     98.4   10.6  100.2479  20.4327   100.2479  20.4327   100.2479  20.4327       98.4     10.6       98.4       10.6     0.0     0.0 
1 1 1   40    0   18 o    886.9    4.7 7868.5024  83.0078  7868.5024  83.0078  7868.5024  83.0078      886.9      4.7      886.9        4.7     0.0     0.0 
1 1 1   40    0   19 o    397.6    3.4 1580.9796  26.8179  1580.9796  26.8179  1580.9796  26.8179      397.6      3.4      397.6        3.4     0.0     0.0 
1 1 1   40    0   20 o    657.3    4.1 4321.5142  53.6358  4321.5142  53.6358  4321.5142  53.6358      657.3      4.1      657.3        4.1     0.0     0.0 
1 1 1   40    0   21 o    211.5    4.8  448.2422  20.4327   448.2422  20.4327   448.2422  20.4327      211.5      4.8      211.5        4.8     0.0     0.0 
1 1 1   40    0   22 o    320.4    3.5 1026.7428  22.3483  1026.7428  22.3483  1026.7428  22.3483      320.4      3.5      320.4        3.5     0.0     0.0 
1 1 1   40    0   23 o     14.3   10.6  -47.8891  19.1556   -47.8891  19.1556   -47.8891  19.1556       14.3     10.6       14.3       10.6     0.0     0.0 
1 1 1   40    0   24 f    541.7    3.5 2934.6455  37.6728  2934.6455  37.6728  2934.6455  37.6728      541.7      3.5      541.7        3.5     0.0     0.0 
1 1 1   40    0   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    0   26 o     15.1   11.1  -45.3350  19.7942   -45.3350  19.7942   -45.3350  19.7942       15.1     11.1       15.1       11.1     0.0     0.0 
1 1 1   40    0   27 o    302.7    4.3  916.9171  26.1794   916.9171  26.1794   916.9171  26.1794      302.7      4.3      302.7        4.3     0.0     0.0 
1 1 1   40    0   28 o    699.9    4.1 4900.6533  57.4669  4900.6533  57.4669  4900.6533  57.4669      699.9      4.1      699.9        4.1     0.0     0.0 
1 1 1   40    0   29 o    222.1    4.9  494.2158  21.7097   494.2158  21.7097   494.2158  21.7097      222.1      4.9      222.1        4.9     0.0     0.0 
1 1 1   40    0   30 o    569.7    3.6 3246.2439  41.5039  3246.2439  41.5039  3246.2439  41.5039      569.7      3.6      569.7        3.6     0.0     0.0 
1 1 1   40    0   31 o    536.8    3.6 2882.9250  38.9498  2882.9250  38.9498  2882.9250  38.9498      536.8      3.6      536.8        3.6     0.0     0.0 
1 1 1   40    0   32 o    367.0    3.7 1347.2806  26.8179  1347.2806  26.8179  1347.2806  26.8179      367.0      3.7      367.0        3.7     0.0     0.0 
1 1 1   40    0   33 f    724.3    4.1 5248.0093  59.3825  5248.0093  59.3825  5248.0093  59.3825      724.3      4.1      724.3        4.1     0.0     0.0 
1 1 1   40    0   34 o    269.7    4.3  727.9147  22.9868   727.9147  22.9868   727.9147  22.9868      269.7      4.3      269.7        4.3     0.0     0.0 
1 1 1   40    0   35 o     20.0   14.1  -19.1556  20.4327   -19.1556  20.4327   -19.1556  20.4327       20.0     14.1       20.0       14.1     0.0     0.0 
1 1 1   40    0   36 o    134.7    7.6  183.2557  20.4327   183.2557  20.4327   183.2557  20.4327      134.7      7.6      134.7        7.6     0.0     0.0 
1 1 1   40    0   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    0   38 o    497.8    3.6 2478.7410  35.7572  2478.7410  35.7572  2478.7410  35.7572      497.8      3.6      497.8        3.6     0.0     0.0 
1 1 1   40    0   39 o    446.4    3.8 1993.4646  33.8416  1993.4646  33.8416  1993.4646  33.8416      446.4      3.8      446.4        3.8     0.0     0.0 
1 1 1   40    0   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    0   41 o    452.6    3.8 2049.6545  34.4802  2049.6545  34.4802  2049.6545  34.4802      452.6      3.8      452.6        3.8     0.0     0.0 
1 1 1   40    0   42 o    340.8    4.1 1162.1094  28.0950  1162.1094  28.0950  1162.1094  28.0950      340.8      4.1      340.8        4.1     0.0     0.0 
1 1 1   40    0   43 o     16.9   12.4  -44.0580  22.3483   -44.0580  22.3483   -44.0580  22.3483       16.9     12.4       16.9       12.4     0.0     0.0 
1 1 1   40    0   44 o    272.1    4.6  741.3236  24.9023   741.3236  24.9023   741.3236  24.9023      272.1      4.6      272.1        4.6     0.0     0.0 
1 1 1   40    0   45 o     14.4   10.7  -71.5144  22.9868   -71.5144  22.9868   -71.5144  22.9868       14.4     10.7       14.4       10.7     0.0     0.0 
1 1 1   40    0   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    0   47 o    338.8    4.0 1148.7003  26.8179  1148.7003  26.8179  1148.7003  26.8179      338.8      4.0      338.8        4.0     0.0     0.0 
1 1 1   40    0   48 o     16.7   12.3  -54.9129  24.2638   -54.9129  24.2638   -54.9129  24.2638       16.7     12.3       16.7       12.3     0.0     0.0 
1 1 1   40    0   49 o     28.1   18.3   -0.6385  24.2638    -0.6385  24.2638    -0.6385  24.2638       28.1     18.3       28.1       18.3     0.0     0.0 
1 1 1   40    0   50 o    223.0    5.9  498.6854  26.1794   498.6854  26.1794   498.6854  26.1794      223.0      5.9      223.0        5.9     0.0     0.0 
1 1 1   40    0   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    0   52 o    325.7    4.3 1061.8615  28.0950  1061.8615  28.0950  1061.8615  28.0950      325.7      4.3      325.7        4.3     0.0     0.0 
1 1 1   40    0   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    0   54 o     22.1   15.7  -26.8179  26.1794   -26.8179  26.1794   -26.8179  26.1794       22.1     15.7       22.1       15.7     0.0     0.0 
1 1 1   40    0   55 o     94.4   15.2   95.1397  26.8179    95.1397  26.8179    95.1397  26.8179       94.4     15.2       94.4       15.2     0.0     0.0 
1 1 1   40    0   56 o    359.6    4.4 1294.9219  31.2876  1294.9219  31.2876  1294.9219  31.2876      359.6      4.4      359.6        4.4     0.0     0.0 
1 1 1   40    0   57 o    479.7    4.1 2303.1477  38.9498  2303.1477  38.9498  2303.1477  38.9498      479.7      4.1      479.7        4.1     0.0     0.0 
1 1 1   40    0   58 o    281.4    5.3  793.6824  30.0105   793.6824  30.0105   793.6824  30.0105      281.4      5.3      281.4        5.3     0.0     0.0 
1 1 1   40    0   59 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    0   60 o     15.7   11.7  -81.0922  26.8179   -81.0922  26.8179   -81.0922  26.8179       15.7     11.7       15.7       11.7     0.0     0.0 
1 1 1   40    0   61 o    235.4    6.2  556.7908  29.3720   556.7908  29.3720   556.7908  29.3720      235.4      6.2      235.4        6.2     0.0     0.0 
1 1 1   40    0   62 o    296.2    5.4  879.8828  31.9261   879.8828  31.9261   879.8828  31.9261      296.2      5.4      296.2        5.4     0.0     0.0 
1 1 1   40    0   63 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    0   64 o     57.7   24.0   48.5276  27.4564    48.5276  27.4564    48.5276  27.4564       57.7     24.0       57.7       24.0     0.0     0.0 
1 1 1   40    0   65 o    140.8    9.8  203.0499  27.4564   203.0499  27.4564   203.0499  27.4564      140.8      9.8      140.8        9.8     0.0     0.0 
1 1 1   40    0   66 o     51.8   23.5   40.8654  26.1794    40.8654  26.1794    40.8654  26.1794       51.8     23.5       51.8       23.5     0.0     0.0 
1 1 1   40    1    0 o    548.8    3.7 3012.5449  40.8654  3012.5449  40.8654  3012.5449  40.8654      548.8      3.7      548.8        3.7     0.0     0.0 
1 1 1   40    1    1 o    380.2    2.4    0.0000   0.0000          ?        ?  1445.6129  18.5171          ?        ?      380.2        2.4       ?       ? 
1 1 1   40    1    2 o    302.8    2.4    0.0000   0.0000          ?        ?   916.9171  14.6860          ?        ?      302.8        2.4       ?       ? 
1 1 1   40    1    3 o    365.0    2.4    0.0000   0.0000          ?        ?  1331.9562  17.2401          ?        ?      365.0        2.4       ?       ? 
1 1 1   40    1    4 o    490.6    2.5    0.0000   0.0000          ?        ?  2407.2266  24.9023          ?        ?      490.6        2.5       ?       ? 
1 1 1   40    1    5 o    272.8    2.7    0.0000   0.0000          ?        ?   744.5162  14.6860          ?        ?      272.8        2.7       ?       ? 
1 1 1   40    1    6 o    391.6    2.5    0.0000   0.0000          ?        ?  1533.7289  19.7942          ?        ?      391.6        2.5       ?       ? 
1 1 1   40    1    7 f    293.3    2.8    0.0000   0.0000          ?        ?   860.0886  16.6016          ?        ?      293.3        2.8       ?       ? 
1 1 1   40    1    8 o   1006.5    3.8    0.0000   0.0000          ?        ? 10132.0615  75.9841          ?        ?     1006.5        3.8       ?       ? 
1 1 1   40    1    9 f    372.3    2.4    0.0000   0.0000          ?        ?  1386.2305  17.8786          ?        ?      372.3        2.4       ?       ? 
1 1 1   40    1   10 o    516.9    2.5    0.0000   0.0000          ?        ?  2671.5745  26.1794          ?        ?      516.9        2.5       ?       ? 
1 1 1   40    1   11 o    700.5    2.9    0.0000   0.0000          ?        ?  4907.0386  40.8654          ?        ?      700.5        2.9       ?       ? 
1 1 1   40    1   12 o    458.3    2.4    0.0000   0.0000          ?        ?  2100.7361  22.3483          ?        ?      458.3        2.4       ?       ? 
1 1 1   40    1   13 f    375.4    2.5    0.0000   0.0000          ?        ?  1409.2172  18.5171          ?        ?      375.4        2.5       ?       ? 
1 1 1   40    1   14 o    653.6    2.8    0.0000   0.0000          ?        ?  4271.7095  37.0343          ?        ?      653.6        2.8       ?       ? 
1 1 1   40    1   15 o    600.3    2.7    0.0000   0.0000          ?        ?  3604.4546  32.5646          ?        ?      600.3        2.7       ?       ? 
1 1 1   40    1   16 o    318.3    2.5    0.0000   0.0000          ?        ?  1013.3338  15.9630          ?        ?      318.3        2.5       ?       ? 
1 1 1   40    1   17 o    655.2    2.7    0.0000   0.0000          ?        ?  4293.4194  35.7572          ?        ?      655.2        2.7       ?       ? 
1 1 1   40    1   18 o    477.1    2.6    0.0000   0.0000          ?        ?  2276.3296  24.9023          ?        ?      477.1        2.6       ?       ? 
1 1 1   40    1   19 o    784.3    3.1    0.0000   0.0000          ?        ?  6151.5176  48.5276          ?        ?      784.3        3.1       ?       ? 
1 1 1   40    1   20 o    821.4    3.1    0.0000   0.0000          ?        ?  6747.8970  51.0817          ?        ?      821.4        3.1       ?       ? 
1 1 1   40    1   21 f    440.8    2.5    0.0000   0.0000          ?        ?  1943.0212  21.7097          ?        ?      440.8        2.5       ?       ? 
1 1 1   40    1   22 o    655.1    2.8    0.0000   0.0000          ?        ?  4292.1426  37.0343          ?        ?      655.1        2.8       ?       ? 
1 1 1   40    1   23 o    654.2    2.8    0.0000   0.0000          ?        ?  4280.6489  37.0343          ?        ?      654.2        2.8       ?       ? 
1 1 1   40    1   24 o    967.9    3.7    0.0000   0.0000          ?        ?  9371.5820  71.5144          ?        ?      967.9        3.7       ?       ? 
1 1 1   40    1   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    1   26 o    514.0    2.7    0.0000   0.0000          ?        ?  2642.8411  28.0950          ?        ?      514.0        2.7       ?       ? 
1 1 1   40    1   27 o   1175.1    4.1    0.0000   0.0000          ?        ? 13814.4150  97.0553          ?        ?     1175.1        4.1       ?       ? 
1 1 1   40    1   28 o    864.5    3.4    0.0000   0.0000          ?        ?  7475.8115  58.7440          ?        ?      864.5        3.4       ?       ? 
1 1 1   40    1   29 o    662.1    2.8    0.0000   0.0000          ?        ?  4384.7280  37.6728          ?        ?      662.1        2.8       ?       ? 
1 1 1   40    1   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    1   31 o    449.7    2.5    0.0000   0.0000          ?        ?  2022.8364  22.3483          ?        ?      449.7        2.5       ?       ? 
1 1 1   40    1   32 o    121.9    5.8    0.0000   0.0000          ?        ?   148.7755  14.0475          ?        ?      121.9        5.8       ?       ? 
1 1 1   40    1   33 o    276.9    3.0    0.0000   0.0000          ?        ?   766.8644  16.6016          ?        ?      276.9        3.0       ?       ? 
1 1 1   40    1   34 o    395.2    2.5    0.0000   0.0000          ?        ?  1561.8240  19.7942          ?        ?      395.2        2.5       ?       ? 
1 1 1   40    1   35 o    312.9    2.9    0.0000   0.0000          ?        ?   979.4921  17.8786          ?        ?      312.9        2.9       ?       ? 
1 1 1   40    1   36 o    141.8    5.2    0.0000   0.0000          ?        ?   201.1343  14.6860          ?        ?      141.8        5.2       ?       ? 
1 1 1   40    1   37 o    365.4    2.7    0.0000   0.0000          ?        ?  1335.7872  19.7942          ?        ?      365.4        2.7       ?       ? 
1 1 1   40    1   38 o    497.5    2.6    0.0000   0.0000          ?        ?  2475.5483  25.5409          ?        ?      497.5        2.6       ?       ? 
1 1 1   40    1   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    1   40 o    391.4    2.6    0.0000   0.0000          ?        ?  1532.4519  20.4327          ?        ?      391.4        2.6       ?       ? 
1 1 1   40    1   41 o    178.2    4.7    0.0000   0.0000          ?        ?   317.9838  16.6016          ?        ?      178.2        4.7       ?       ? 
1 1 1   40    1   42 o    182.1    4.6    0.0000   0.0000          ?        ?   332.0312  16.6016          ?        ?      182.1        4.6       ?       ? 
1 1 1   40    1   43 o    143.5    5.6    0.0000   0.0000          ?        ?   206.2425  15.9630          ?        ?      143.5        5.6       ?       ? 
1 1 1   40    1   44 o    118.7    6.7    0.0000   0.0000          ?        ?   141.1133  15.9630          ?        ?      118.7        6.7       ?       ? 
1 1 1   40    1   45 o    194.0    4.3    0.0000   0.0000          ?        ?   376.7278  16.6016          ?        ?      194.0        4.3       ?       ? 
1 1 1   40    1   46 o    301.6    3.1    0.0000   0.0000          ?        ?   909.8933  18.5171          ?        ?      301.6        3.1       ?       ? 
1 1 1   40    1   47 o     17.8    9.0    0.0000   0.0000          ?        ?   -61.2981  16.6016          ?        ?       17.8        9.0       ?       ? 
1 1 1   40    1   48 o     67.2   13.3    0.0000   0.0000          ?        ?    47.2506  17.2401          ?        ?       67.2       13.3       ?       ? 
1 1 1   40    1   49 o     87.6    9.8    0.0000   0.0000          ?        ?    77.2611  17.2401          ?        ?       87.6        9.8       ?       ? 
1 1 1   40    1   50 o     43.7   15.6    0.0000   0.0000          ?        ?    16.6016  17.2401          ?        ?       43.7       15.6       ?       ? 
1 1 1   40    1   51 o    168.2    5.3    0.0000   0.0000          ?        ?   283.5036  17.8786          ?        ?      168.2        5.3       ?       ? 
1 1 1   40    1   52 o    152.7    6.1    0.0000   0.0000          ?        ?   233.6989  18.5171          ?        ?      152.7        6.1       ?       ? 
1 1 1   40    1   53 o     35.7   15.2    0.0000   0.0000          ?        ?     0.0000  19.1556          ?        ?       35.7       15.2       ?       ? 
1 1 1   40    1   54 o     29.5   13.5    0.0000   0.0000          ?        ?   -12.1319  17.8786          ?        ?       29.5       13.5       ?       ? 
1 1 1   40    1   55 o    447.9    2.9    0.0000   0.0000          ?        ?  2007.5120  25.5409          ?        ?      447.9        2.9       ?       ? 
1 1 1   40    1   56 o    633.0    2.8    0.0000   0.0000          ?        ?  4009.2773  35.7572          ?        ?      633.0        2.8       ?       ? 
1 1 1   40    1   57 o    145.5    6.8    0.0000   0.0000          ?        ?   212.6277  19.7942          ?        ?      145.5        6.8       ?       ? 
1 1 1   40    1   58 o    170.9    6.0    0.0000   0.0000          ?        ?   293.0815  20.4327          ?        ?      170.9        6.0       ?       ? 
1 1 1   40    1   59 o    283.4    3.6    0.0000   0.0000          ?        ?   804.5372  20.4327          ?        ?      283.4        3.6       ?       ? 
1 1 1   40    1   60 o    163.2    5.9    0.0000   0.0000          ?        ?   267.5406  19.1556          ?        ?      163.2        5.9       ?       ? 
1 1 1   40    1   61 o    177.8    5.4    0.0000   0.0000          ?        ?   317.3452  19.1556          ?        ?      177.8        5.4       ?       ? 
1 1 1   40    1   62 o     45.5   16.4    0.0000   0.0000          ?        ?    18.5171  19.1556          ?        ?       45.5       16.4       ?       ? 
1 1 1   40    1   63 o    154.5    6.2    0.0000   0.0000          ?        ?   240.0841  19.1556          ?        ?      154.5        6.2       ?       ? 
1 1 1   40    1   64 o     94.4    9.8    0.0000   0.0000          ?        ?    90.6701  18.5171          ?        ?       94.4        9.8       ?       ? 
1 1 1   40    1   65 o     31.7   14.3    0.0000   0.0000          ?        ?    -8.3008  19.1556          ?        ?       31.7       14.3       ?       ? 
1 1 1   40    2    0 o    375.7    4.1 1412.4098  30.6490  1412.4098  30.6490  1412.4098  30.6490      375.7      4.1      375.7        4.1     0.0     0.0 
1 1 1   40    2    1 o   1099.5    4.0    0.0000   0.0000          ?        ? 12091.6836  87.4775          ?        ?     1099.5        4.0       ?       ? 
1 1 1   40    2    2 o    501.1    2.5    0.0000   0.0000          ?        ?  2511.3054  25.5409          ?        ?      501.1        2.5       ?       ? 
1 1 1   40    2    3 o    473.1    2.4    0.0000   0.0000          ?        ?  2238.6570  22.9868          ?        ?      473.1        2.4       ?       ? 
1 1 1   40    2    4 o    365.2    2.4    0.0000   0.0000          ?        ?  1333.8716  17.8786          ?        ?      365.2        2.4       ?       ? 
1 1 1   40    2    5 o    433.6    2.4    0.0000   0.0000          ?        ?  1879.8076  21.0712          ?        ?      433.6        2.4       ?       ? 
1 1 1   40    2    6 o    489.3    2.5    0.0000   0.0000          ?        ?  2394.4561  24.9023          ?        ?      489.3        2.5       ?       ? 
1 1 1   40    2    7 f    255.1    2.8    0.0000   0.0000          ?        ?   650.6536  14.0475          ?        ?      255.1        2.8       ?       ? 
1 1 1   40    2    8 f    569.1    2.6    0.0000   0.0000          ?        ?  3238.5818  30.0105          ?        ?      569.1        2.6       ?       ? 
1 1 1   40    2    9 o    364.9    2.4    0.0000   0.0000          ?        ?  1331.9562  17.8786          ?        ?      364.9        2.4       ?       ? 
1 1 1   40    2   10 o    866.3    3.4    0.0000   0.0000          ?        ?  7506.4600  58.1055          ?        ?      866.3        3.4       ?       ? 
1 1 1   40    2   11 o    435.4    2.3    0.0000   0.0000          ?        ?  1895.7706  20.4327          ?        ?      435.4        2.3       ?       ? 
1 1 1   40    2   12 o    647.5    2.8    0.0000   0.0000          ?        ?  4192.5327  36.3957          ?        ?      647.5        2.8       ?       ? 
1 1 1   40    2   13 o    601.9    2.7    0.0000   0.0000          ?        ?  3622.9719  32.5646          ?        ?      601.9        2.7       ?       ? 
1 1 1   40    2   14 o    576.4    2.7    0.0000   0.0000          ?        ?  3322.2280  31.2876          ?        ?      576.4        2.7       ?       ? 
1 1 1   40    2   15 o    379.1    2.4    0.0000   0.0000          ?        ?  1437.3123  18.5171          ?        ?      379.1        2.4       ?       ? 
1 1 1   40    2   16 o    320.8    2.4    0.0000   0.0000          ?        ?  1029.2969  15.3245          ?        ?      320.8        2.4       ?       ? 
1 1 1   40    2   17 o    452.9    2.4    0.0000   0.0000          ?        ?  2051.5698  21.7097          ?        ?      452.9        2.4       ?       ? 
1 1 1   40    2   18 o    334.2    2.6    0.0000   0.0000          ?        ?  1116.7743  17.2401          ?        ?      334.2        2.6       ?       ? 
1 1 1   40    2   19 o    863.9    3.4    0.0000   0.0000          ?        ?  7464.9561  58.1055          ?        ?      863.9        3.4       ?       ? 
1 1 1   40    2   20 o    438.5    2.5    0.0000   0.0000          ?        ?  1922.5886  21.7097          ?        ?      438.5        2.5       ?       ? 
1 1 1   40    2   21 o    268.8    2.6    0.0000   0.0000          ?        ?   722.8065  14.0475          ?        ?      268.8        2.6       ?       ? 
1 1 1   40    2   22 o    444.1    2.4    0.0000   0.0000          ?        ?  1972.3933  21.0712          ?        ?      444.1        2.4       ?       ? 
1 1 1   40    2   23 o    323.0    2.7    0.0000   0.0000          ?        ?  1043.3442  17.2401          ?        ?      323.0        2.7       ?       ? 
1 1 1   40    2   24 o    149.7    5.1    0.0000   0.0000          ?        ?   224.1211  15.3245          ?        ?      149.7        5.1       ?       ? 
1 1 1   40    2   25 o    623.8    2.8    0.0000   0.0000          ?        ?  3891.7893  35.1187          ?        ?      623.8        2.8       ?       ? 
1 1 1   40    2   26 o    610.2    2.8    0.0000   0.0000          ?        ?  3723.8582  33.8416          ?        ?      610.2        2.8       ?       ? 
1 1 1   40    2   27 f    420.1    2.4    0.0000   0.0000          ?        ?  1764.8738  20.4327          ?        ?      420.1        2.4       ?       ? 
1 1 1   40    2   28 o    270.4    3.0    0.0000   0.0000          ?        ?   731.1072  15.9630          ?        ?      270.4        3.0       ?       ? 
1 1 1   40    2   29 o    342.1    2.5    0.0000   0.0000          ?        ?  1170.4102  17.2401          ?        ?      342.1        2.5       ?       ? 
1 1 1   40    2   30 o    240.9    3.0    0.0000   0.0000          ?        ?   580.4161  14.6860          ?        ?      240.9        3.0       ?       ? 
1 1 1   40    2   31 o    425.5    2.5    0.0000   0.0000          ?        ?  1810.8474  21.0712          ?        ?      425.5        2.5       ?       ? 
1 1 1   40    2   32 o    208.6    3.5    0.0000   0.0000          ?        ?   435.4717  14.6860          ?        ?      208.6        3.5       ?       ? 
1 1 1   40    2   33 o    304.3    2.8    0.0000   0.0000          ?        ?   926.4949  17.2401          ?        ?      304.3        2.8       ?       ? 
1 1 1   40    2   34 o    234.2    3.4    0.0000   0.0000          ?        ?   548.4901  15.9630          ?        ?      234.2        3.4       ?       ? 
1 1 1   40    2   35 o    158.6    4.6    0.0000   0.0000          ?        ?   251.5775  14.6860          ?        ?      158.6        4.6       ?       ? 
1 1 1   40    2   36 o    311.0    2.8    0.0000   0.0000          ?        ?   967.3603  17.2401          ?        ?      311.0        2.8       ?       ? 
1 1 1   40    2   37 o    299.2    2.9    0.0000   0.0000          ?        ?   895.2073  17.2401          ?        ?      299.2        2.9       ?       ? 
1 1 1   40    2   38 o    410.8    2.6    0.0000   0.0000          ?        ?  1687.6125  21.0712          ?        ?      410.8        2.6       ?       ? 
1 1 1   40    2   39 o    418.7    2.6    0.0000   0.0000          ?        ?  1753.3804  21.7097          ?        ?      418.7        2.6       ?       ? 
1 1 1   40    2   40 f    378.1    2.7    0.0000   0.0000          ?        ?  1429.6499  20.4327          ?        ?      378.1        2.7       ?       ? 
1 1 1   40    2   41 o    231.1    3.7    0.0000   0.0000          ?        ?   534.4426  17.2401          ?        ?      231.1        3.7       ?       ? 
1 1 1   40    2   42 o    328.8    2.9    0.0000   0.0000          ?        ?  1081.6556  19.1556          ?        ?      328.8        2.9       ?       ? 
1 1 1   40    2   43 o     82.4   10.1    0.0000   0.0000          ?        ?    68.3218  16.6016          ?        ?       82.4       10.1       ?       ? 
1 1 1   40    2   44 o     44.7   15.4    0.0000   0.0000          ?        ?    18.5171  16.6016          ?        ?       44.7       15.4       ?       ? 
1 1 1   40    2   45 f    209.2    4.0    0.0000   0.0000          ?        ?   438.0258  16.6016          ?        ?      209.2        4.0       ?       ? 
1 1 1   40    2   46 o     97.0    8.6    0.0000   0.0000          ?        ?    94.5012  16.6016          ?        ?       97.0        8.6       ?       ? 
1 1 1   40    2   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    2   48 o    299.1    3.1    0.0000   0.0000          ?        ?   895.2073  18.5171          ?        ?      299.1        3.1       ?       ? 
1 1 1   40    2   49 o    116.2    7.1    0.0000   0.0000          ?        ?   135.3666  16.6016          ?        ?      116.2        7.1       ?       ? 
1 1 1   40    2   50 o    138.0    6.0    0.0000   0.0000          ?        ?   190.9180  16.6016          ?        ?      138.0        6.0       ?       ? 
1 1 1   40    2   51 o    198.0    4.7    0.0000   0.0000          ?        ?   392.6908  18.5171          ?        ?      198.0        4.7       ?       ? 
1 1 1   40    2   52 o     81.1   11.4    0.0000   0.0000          ?        ?    66.4062  18.5171          ?        ?       81.1       11.4       ?       ? 
1 1 1   40    2   53 o    246.8    3.6    0.0000   0.0000          ?        ?   609.7881  17.8786          ?        ?      246.8        3.6       ?       ? 
1 1 1   40    2   54 o     22.6   11.2    0.0000   0.0000          ?        ?   -41.5039  18.5171          ?        ?       22.6       11.2       ?       ? 
1 1 1   40    2   55 o    363.8    3.1    0.0000   0.0000          ?        ?  1324.2938  22.3483          ?        ?      363.8        3.1       ?       ? 
1 1 1   40    2   56 o    147.9    6.5    0.0000   0.0000          ?        ?   219.6514  19.1556          ?        ?      147.9        6.5       ?       ? 
1 1 1   40    2   57 o    236.0    4.5    0.0000   0.0000          ?        ?   558.0679  21.0712          ?        ?      236.0        4.5       ?       ? 
1 1 1   40    2   58 o    163.2    6.1    0.0000   0.0000          ?        ?   267.5406  19.7942          ?        ?      163.2        6.1       ?       ? 
1 1 1   40    2   59 o     43.3   16.5    0.0000   0.0000          ?        ?    14.0475  19.7942          ?        ?       43.3       16.5       ?       ? 
1 1 1   40    2   60 o     22.5   11.2    0.0000   0.0000          ?        ?   -45.3350  19.1556          ?        ?       22.5       11.2       ?       ? 
1 1 1   40    2   61 o    291.9    3.7    0.0000   0.0000          ?        ?   853.7034  21.7097          ?        ?      291.9        3.7       ?       ? 
1 1 1   40    2   62 o     22.3   11.1    0.0000   0.0000          ?        ?   -46.6121  19.1556          ?        ?       22.3       11.1       ?       ? 
1 1 1   40    2   63 o     32.2   14.5    0.0000   0.0000          ?        ?    -8.9393  19.7942          ?        ?       32.2       14.5       ?       ? 
1 1 1   40    2   64 f    284.3    3.7    0.0000   0.0000          ?        ?   810.2839  21.0712          ?        ?      284.3        3.7       ?       ? 
1 1 1   40    2   65 o    106.5    9.3    0.0000   0.0000          ?        ?   115.5724  19.7942          ?        ?      106.5        9.3       ?       ? 
1 1 1   40    3    0 o    732.0    4.3 5359.1118  62.5751  5359.1118  62.5751  5359.1118  62.5751      732.0      4.3      732.0        4.3     0.0     0.0 
1 1 1   40    3    1 o    432.9    2.6    0.0000   0.0000          ?        ?  1874.0609  22.3483          ?        ?      432.9        2.6       ?       ? 
1 1 1   40    3    2 o   1106.1    4.1    0.0000   0.0000          ?        ? 12235.9902  90.0316          ?        ?     1106.1        4.1       ?       ? 
1 1 1   40    3    3 o    182.7    3.8    0.0000   0.0000          ?        ?   333.9468  14.0475          ?        ?      182.7        3.8       ?       ? 
1 1 1   40    3    4 o   1194.4    4.3    0.0000   0.0000          ?        ? 14268.4053 101.5249          ?        ?     1194.4        4.3       ?       ? 
1 1 1   40    3    5 o    870.8    3.4    0.0000   0.0000          ?        ?  7583.0825  58.7440          ?        ?      870.8        3.4       ?       ? 
1 1 1   40    3    6 o    733.2    3.0    0.0000   0.0000          ?        ?  5375.7139  43.4195          ?        ?      733.2        3.0       ?       ? 
1 1 1   40    3    7 o   1313.2    4.6    0.0000   0.0000          ?        ? 17249.6621 120.0421          ?        ?     1313.2        4.6       ?       ? 
1 1 1   40    3    8 o    291.8    2.8    0.0000   0.0000          ?        ?   851.7878  16.6016          ?        ?      291.8        2.8       ?       ? 
1 1 1   40    3    9 o    205.4    3.1    0.0000   0.0000          ?        ?   422.0628  12.7704          ?        ?      205.4        3.1       ?       ? 
1 1 1   40    3   10 o    653.5    2.8    0.0000   0.0000          ?        ?  4271.0713  36.3957          ?        ?      653.5        2.8       ?       ? 
1 1 1   40    3   11 f    440.2    2.4    0.0000   0.0000          ?        ?  1937.9131  21.0712          ?        ?      440.2        2.4       ?       ? 
1 1 1   40    3   12 o    658.5    2.8    0.0000   0.0000          ?        ?  4336.2002  36.3957          ?        ?      658.5        2.8       ?       ? 
1 1 1   40    3   13 o    762.2    3.1    0.0000   0.0000          ?        ?  5810.5469  46.6121          ?        ?      762.2        3.1       ?       ? 
1 1 1   40    3   14 o    526.0    2.6    0.0000   0.0000          ?        ?  2766.7141  27.4564          ?        ?      526.0        2.6       ?       ? 
1 1 1   40    3   15 o    653.4    2.8    0.0000   0.0000          ?        ?  4269.7944  37.0343          ?        ?      653.4        2.8       ?       ? 
1 1 1   40    3   16 o    650.0    2.8    0.0000   0.0000          ?        ?  4225.0977  35.7572          ?        ?      650.0        2.8       ?       ? 
1 1 1   40    3   17 o     36.2   12.7    0.0000   0.0000          ?        ?    11.4934  11.4934          ?        ?       36.2       12.7       ?       ? 
1 1 1   40    3   18 o    428.8    2.3    0.0000   0.0000          ?        ?  1838.9423  19.7942          ?        ?      428.8        2.3       ?       ? 
1 1 1   40    3   19 o    917.2    3.6    0.0000   0.0000          ?        ?  8414.4385  66.4062          ?        ?      917.2        3.6       ?       ? 
1 1 1   40    3   20 o    684.1    2.9    0.0000   0.0000          ?        ?  4680.3633  39.5883          ?        ?      684.1        2.9       ?       ? 
1 1 1   40    3   21 o    377.6    2.4    0.0000   0.0000          ?        ?  1425.8188  17.8786          ?        ?      377.6        2.4       ?       ? 
1 1 1   40    3   22 o    536.4    2.6    0.0000   0.0000          ?        ?  2877.1785  27.4564          ?        ?      536.4        2.6       ?       ? 
1 1 1   40    3   23 o    487.3    2.6    0.0000   0.0000          ?        ?  2374.6619  24.9023          ?        ?      487.3        2.6       ?       ? 
1 1 1   40    3   24 o    877.9    3.4    0.0000   0.0000          ?        ?  7708.2329  60.0210          ?        ?      877.9        3.4       ?       ? 
1 1 1   40    3   25 o     67.7    9.4    0.0000   0.0000          ?        ?    45.9736  12.7704          ?        ?       67.7        9.4       ?       ? 
1 1 1   40    3   26 o    326.1    2.4    0.0000   0.0000          ?        ?  1063.7771  15.9630          ?        ?      326.1        2.4       ?       ? 
1 1 1   40    3   27 o    552.4    2.5    0.0000   0.0000          ?        ?  3051.4949  28.0950          ?        ?      552.4        2.5       ?       ? 
1 1 1   40    3   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    3   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    3   30 o     16.6    8.4    0.0000   0.0000          ?        ?   -50.4432  14.0475          ?        ?       16.6        8.4       ?       ? 
1 1 1   40    3   31 o    360.3    2.5    0.0000   0.0000          ?        ?  1298.1145  17.8786          ?        ?      360.3        2.5       ?       ? 
1 1 1   40    3   32 o    229.1    3.3    0.0000   0.0000          ?        ?   524.8647  15.3245          ?        ?      229.1        3.3       ?       ? 
1 1 1   40    3   33 o    871.7    3.3    0.0000   0.0000          ?        ?  7600.9614  57.4669          ?        ?      871.7        3.3       ?       ? 
1 1 1   40    3   34 o    337.8    2.8    0.0000   0.0000          ?        ?  1141.6766  19.1556          ?        ?      337.8        2.8       ?       ? 
1 1 1   40    3   35 o    440.0    2.5    0.0000   0.0000          ?        ?  1936.6360  22.3483          ?        ?      440.0        2.5       ?       ? 
1 1 1   40    3   36 o    272.5    3.0    0.0000   0.0000          ?        ?   742.6006  16.6016          ?        ?      272.5        3.0       ?       ? 
1 1 1   40    3   37 o    359.2    2.5    0.0000   0.0000          ?        ?  1290.4523  17.8786          ?        ?      359.2        2.5       ?       ? 
1 1 1   40    3   38 o    288.2    2.9    0.0000   0.0000          ?        ?   830.7167  16.6016          ?        ?      288.2        2.9       ?       ? 
1 1 1   40    3   39 o    251.2    3.3    0.0000   0.0000          ?        ?   631.4979  16.6016          ?        ?      251.2        3.3       ?       ? 
1 1 1   40    3   40 o     60.5   13.5    0.0000   0.0000          ?        ?    38.3113  15.9630          ?        ?       60.5       13.5       ?       ? 
1 1 1   40    3   41 o    493.8    2.7    0.0000   0.0000          ?        ?  2439.1526  26.1794          ?        ?      493.8        2.7       ?       ? 
1 1 1   40    3   42 o    177.7    4.5    0.0000   0.0000          ?        ?   316.0682  15.9630          ?        ?      177.7        4.5       ?       ? 
1 1 1   40    3   43 o     66.9   12.4    0.0000   0.0000          ?        ?    46.6121  15.9630          ?        ?       66.9       12.4       ?       ? 
1 1 1   40    3   44 o    254.1    3.4    0.0000   0.0000          ?        ?   646.1838  17.2401          ?        ?      254.1        3.4       ?       ? 
1 1 1   40    3   45 o    206.3    4.2    0.0000   0.0000          ?        ?   425.8939  17.2401          ?        ?      206.3        4.2       ?       ? 
1 1 1   40    3   46 o    344.5    3.0    0.0000   0.0000          ?        ?  1187.6503  20.4327          ?        ?      344.5        3.0       ?       ? 
1 1 1   40    3   47 o    413.0    2.7    0.0000   0.0000          ?        ?  1706.1299  22.3483          ?        ?      413.0        2.7       ?       ? 
1 1 1   40    3   48 o    447.6    2.7    0.0000   0.0000          ?        ?  2004.3193  24.2638          ?        ?      447.6        2.7       ?       ? 
1 1 1   40    3   49 o    101.2    8.2    0.0000   0.0000          ?        ?   102.8020  16.6016          ?        ?      101.2        8.2       ?       ? 
1 1 1   40    3   50 o    115.3    7.5    0.0000   0.0000          ?        ?   133.4510  17.2401          ?        ?      115.3        7.5       ?       ? 
1 1 1   40    3   51 o     65.2   13.7    0.0000   0.0000          ?        ?    44.6965  17.2401          ?        ?       65.2       13.7       ?       ? 
1 1 1   40    3   52 o    123.0    7.3    0.0000   0.0000          ?        ?   151.9681  17.8786          ?        ?      123.0        7.3       ?       ? 
1 1 1   40    3   53 o     22.7   11.2    0.0000   0.0000          ?        ?   -40.8654  18.5171          ?        ?       22.7       11.2       ?       ? 
1 1 1   40    3   54 o     25.1   12.1    0.0000   0.0000          ?        ?   -26.8179  17.8786          ?        ?       25.1       12.1       ?       ? 
1 1 1   40    3   55 o    154.9    6.2    0.0000   0.0000          ?        ?   240.7227  19.1556          ?        ?      154.9        6.2       ?       ? 
1 1 1   40    3   56 o     40.7   15.8    0.0000   0.0000          ?        ?    10.8549  18.5171          ?        ?       40.7       15.8       ?       ? 
1 1 1   40    3   57 o    116.2    8.0    0.0000   0.0000          ?        ?   136.0051  18.5171          ?        ?      116.2        8.0       ?       ? 
1 1 1   40    3   58 o    206.0    4.7    0.0000   0.0000          ?        ?   425.2554  19.1556          ?        ?      206.0        4.7       ?       ? 
1 1 1   40    3   59 o    131.3    7.3    0.0000   0.0000          ?        ?   173.6779  19.1556          ?        ?      131.3        7.3       ?       ? 
1 1 1   40    3   60 o     66.5   14.8    0.0000   0.0000          ?        ?    47.2506  19.1556          ?        ?       66.5       14.8       ?       ? 
1 1 1   40    3   61 o    323.0    3.5    0.0000   0.0000          ?        ?  1045.2599  22.3483          ?        ?      323.0        3.5       ?       ? 
1 1 1   40    3   62 o    212.5    5.0    0.0000   0.0000          ?        ?   453.3503  21.0712          ?        ?      212.5        5.0       ?       ? 
1 1 1   40    3   63 o    176.7    5.8    0.0000   0.0000          ?        ?   314.1526  20.4327          ?        ?      176.7        5.8       ?       ? 
1 1 1   40    3   64 o     50.4   17.0    0.0000   0.0000          ?        ?    25.5409  20.4327          ?        ?       50.4       17.0       ?       ? 
1 1 1   40    4    0 o    292.8    3.5  857.5345  20.4327   857.5345  20.4327   857.5345  20.4327      292.8      3.5      292.8        3.5     0.0     0.0 
1 1 1   40    4    1 o    270.1    2.7    0.0000   0.0000          ?        ?   729.8303  14.6860          ?        ?      270.1        2.7       ?       ? 
1 1 1   40    4    2 o    982.1    3.6    0.0000   0.0000          ?        ?  9646.7852  71.5144          ?        ?      982.1        3.6       ?       ? 
1 1 1   40    4    3 o    745.4    3.0    0.0000   0.0000          ?        ?  5557.0537  44.6965          ?        ?      745.4        3.0       ?       ? 
1 1 1   40    4    4 o    284.3    2.6    0.0000   0.0000          ?        ?   808.3683  14.6860          ?        ?      284.3        2.6       ?       ? 
1 1 1   40    4    5 o    301.1    2.8    0.0000   0.0000          ?        ?   906.7007  16.6016          ?        ?      301.1        2.8       ?       ? 
1 1 1   40    4    6 o    634.2    2.8    0.0000   0.0000          ?        ?  4022.6863  35.1187          ?        ?      634.2        2.8       ?       ? 
1 1 1   40    4    7 o    394.0    2.4    0.0000   0.0000          ?        ?  1552.2461  19.1556          ?        ?      394.0        2.4       ?       ? 
1 1 1   40    4    8 o     22.4   10.5    0.0000   0.0000          ?        ?   -13.4090  12.1319          ?        ?       22.4       10.5       ?       ? 
1 1 1   40    4    9 o    709.5    2.9    0.0000   0.0000          ?        ?  5034.1045  41.5039          ?        ?      709.5        2.9       ?       ? 
1 1 1   40    4   10 o     53.1   11.2    0.0000   0.0000          ?        ?    29.3720  11.4934          ?        ?       53.1       11.2       ?       ? 
1 1 1   40    4   11 o    303.1    2.8    0.0000   0.0000          ?        ?   918.8326  17.2401          ?        ?      303.1        2.8       ?       ? 
1 1 1   40    4   12 o   1168.4    4.2    0.0000   0.0000          ?        ? 13655.4238  98.3323          ?        ?     1168.4        4.2       ?       ? 
1 1 1   40    4   13 o   1106.1    4.1    0.0000   0.0000          ?        ? 12236.6289  91.3086          ?        ?     1106.1        4.1       ?       ? 
1 1 1   40    4   14 o    887.8    3.3    0.0000   0.0000          ?        ?  7883.1880  59.3825          ?        ?      887.8        3.3       ?       ? 
1 1 1   40    4   15 o    338.2    2.5    0.0000   0.0000          ?        ?  1144.2307  16.6016          ?        ?      338.2        2.5       ?       ? 
1 1 1   40    4   16 o    543.8    2.6    0.0000   0.0000          ?        ?  2956.9937  28.7335          ?        ?      543.8        2.6       ?       ? 
1 1 1   40    4   17 o    530.6    2.6    0.0000   0.0000          ?        ?  2815.8804  27.4564          ?        ?      530.6        2.6       ?       ? 
1 1 1   40    4   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    4   19 o    392.7    2.4    0.0000   0.0000          ?        ?  1542.6683  19.1556          ?        ?      392.7        2.4       ?       ? 
1 1 1   40    4   20 f    509.9    2.5    0.0000   0.0000          ?        ?  2600.6985  25.5409          ?        ?      509.9        2.5       ?       ? 
1 1 1   40    4   21 o    196.7    3.6    0.0000   0.0000          ?        ?   386.9441  14.0475          ?        ?      196.7        3.6       ?       ? 
1 1 1   40    4   22 o    238.1    2.9    0.0000   0.0000          ?        ?   567.0072  14.0475          ?        ?      238.1        2.9       ?       ? 
1 1 1   40    4   23 o    354.3    2.4    0.0000   0.0000          ?        ?  1255.3335  17.2401          ?        ?      354.3        2.4       ?       ? 
1 1 1   40    4   24 o    262.9    2.9    0.0000   0.0000          ?        ?   691.5189  15.3245          ?        ?      262.9        2.9       ?       ? 
1 1 1   40    4   25 o    182.7    3.8    0.0000   0.0000          ?        ?   333.9468  14.0475          ?        ?      182.7        3.8       ?       ? 
1 1 1   40    4   26 o     25.0   11.5    0.0000   0.0000          ?        ?   -10.8549  13.4090          ?        ?       25.0       11.5       ?       ? 
1 1 1   40    4   27 o    667.0    2.8    0.0000   0.0000          ?        ?  4449.2188  37.0343          ?        ?      667.0        2.8       ?       ? 
1 1 1   40    4   28 o    540.3    2.5    0.0000   0.0000          ?        ?  2919.9592  27.4564          ?        ?      540.3        2.5       ?       ? 
1 1 1   40    4   29 o    241.1    3.2    0.0000   0.0000          ?        ?   581.6932  15.3245          ?        ?      241.1        3.2       ?       ? 
1 1 1   40    4   30 o    462.9    2.6    0.0000   0.0000          ?        ?  2143.5171  23.6253          ?        ?      462.9        2.6       ?       ? 
1 1 1   40    4   31 o    276.1    2.8    0.0000   0.0000          ?        ?   762.3948  15.3245          ?        ?      276.1        2.8       ?       ? 
1 1 1   40    4   32 o    442.8    2.5    0.0000   0.0000          ?        ?  1960.8999  22.3483          ?        ?      442.8        2.5       ?       ? 
1 1 1   40    4   33 o    318.2    2.8    0.0000   0.0000          ?        ?  1012.6953  17.8786          ?        ?      318.2        2.8       ?       ? 
1 1 1   40    4   34 o    546.5    2.7    0.0000   0.0000          ?        ?  2987.0042  29.3720          ?        ?      546.5        2.7       ?       ? 
1 1 1   40    4   35 o    383.6    2.6    0.0000   0.0000          ?        ?  1471.7924  19.7942          ?        ?      383.6        2.6       ?       ? 
1 1 1   40    4   36 o    211.1    3.6    0.0000   0.0000          ?        ?   445.6881  15.3245          ?        ?      211.1        3.6       ?       ? 
1 1 1   40    4   37 o    343.1    2.8    0.0000   0.0000          ?        ?  1177.4338  19.1556          ?        ?      343.1        2.8       ?       ? 
1 1 1   40    4   38 o    155.3    4.9    0.0000   0.0000          ?        ?   241.3612  15.3245          ?        ?      155.3        4.9       ?       ? 
1 1 1   40    4   39 o    100.3    7.6    0.0000   0.0000          ?        ?   100.8864  15.3245          ?        ?      100.3        7.6       ?       ? 
1 1 1   40    4   40 o    596.8    2.7    0.0000   0.0000          ?        ?  3562.3123  31.9261          ?        ?      596.8        2.7       ?       ? 
1 1 1   40    4   41 o    217.6    3.8    0.0000   0.0000          ?        ?   473.7830  16.6016          ?        ?      217.6        3.8       ?       ? 
1 1 1   40    4   42 o    523.8    2.8    0.0000   0.0000          ?        ?  2744.3660  29.3720          ?        ?      523.8        2.8       ?       ? 
1 1 1   40    4   43 o    234.1    3.7    0.0000   0.0000          ?        ?   548.4901  17.2401          ?        ?      234.1        3.7       ?       ? 
1 1 1   40    4   44 f    327.8    2.9    0.0000   0.0000          ?        ?  1075.2704  19.1556          ?        ?      327.8        2.9       ?       ? 
1 1 1   40    4   45 o    153.0    5.2    0.0000   0.0000          ?        ?   234.3374  15.9630          ?        ?      153.0        5.2       ?       ? 
1 1 1   40    4   46 o     95.7    8.7    0.0000   0.0000          ?        ?    91.9471  16.6016          ?        ?       95.7        8.7       ?       ? 
1 1 1   40    4   47 o     96.0    9.0    0.0000   0.0000          ?        ?    92.5856  17.2401          ?        ?       96.0        9.0       ?       ? 
1 1 1   40    4   48 o    299.7    3.3    0.0000   0.0000          ?        ?   899.0385  19.7942          ?        ?      299.7        3.3       ?       ? 
1 1 1   40    4   49 o    352.5    2.9    0.0000   0.0000          ?        ?  1243.2015  20.4327          ?        ?      352.5        2.9       ?       ? 
1 1 1   40    4   50 o     19.6    9.8    0.0000   0.0000          ?        ?   -52.3588  17.2401          ?        ?       19.6        9.8       ?       ? 
1 1 1   40    4   51 o    103.0    8.7    0.0000   0.0000          ?        ?   106.6331  17.8786          ?        ?      103.0        8.7       ?       ? 
1 1 1   40    4   52 o     68.0   13.6    0.0000   0.0000          ?        ?    48.5276  17.8786          ?        ?       68.0       13.6       ?       ? 
1 1 1   40    4   53 f    207.9    4.6    0.0000   0.0000          ?        ?   432.9177  19.1556          ?        ?      207.9        4.6       ?       ? 
1 1 1   40    4   54 o    225.4    4.2    0.0000   0.0000          ?        ?   508.9017  19.1556          ?        ?      225.4        4.2       ?       ? 
1 1 1   40    4   55 o     73.6   12.2    0.0000   0.0000          ?        ?    54.9129  17.8786          ?        ?       73.6       12.2       ?       ? 
1 1 1   40    4   56 o     31.7   14.2    0.0000   0.0000          ?        ?    -7.6623  18.5171          ?        ?       31.7       14.2       ?       ? 
1 1 1   40    4   57 o    198.7    5.0    0.0000   0.0000          ?        ?   395.8834  19.7942          ?        ?      198.7        5.0       ?       ? 
1 1 1   40    4   58 o    105.4    9.7    0.0000   0.0000          ?        ?   112.3798  20.4327          ?        ?      105.4        9.7       ?       ? 
1 1 1   40    4   59 o    127.9    7.5    0.0000   0.0000          ?        ?   164.7386  19.1556          ?        ?      127.9        7.5       ?       ? 
1 1 1   40    4   60 o    299.3    3.5    0.0000   0.0000          ?        ?   897.1229  21.0712          ?        ?      299.3        3.5       ?       ? 
1 1 1   40    4   61 o    345.2    3.2    0.0000   0.0000          ?        ?  1193.3969  22.3483          ?        ?      345.2        3.2       ?       ? 
1 1 1   40    4   62 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    4   63 o    123.8    7.7    0.0000   0.0000          ?        ?   155.1608  19.1556          ?        ?      123.8        7.7       ?       ? 
1 1 1   40    4   64 o    176.1    5.4    0.0000   0.0000          ?        ?   312.2371  19.1556          ?        ?      176.1        5.4       ?       ? 
1 1 1   40    5    0 o    205.6    4.2  423.3398  17.2401   423.3398  17.2401   423.3398  17.2401      205.6      4.2      205.6        4.2     0.0     0.0 
1 1 1   40    5    1 o    617.8    2.7    0.0000   0.0000          ?        ?  3817.7209  33.2031          ?        ?      617.8        2.7       ?       ? 
1 1 1   40    5    2 o    184.3    3.5    0.0000   0.0000          ?        ?   339.6935  12.7704          ?        ?      184.3        3.5       ?       ? 
1 1 1   40    5    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    5    4 o    472.4    2.6    0.0000   0.0000          ?        ?  2231.6331  24.2638          ?        ?      472.4        2.6       ?       ? 
1 1 1   40    5    5 o   1031.3    3.9    0.0000   0.0000          ?        ? 10637.7705  79.8152          ?        ?     1031.3        3.9       ?       ? 
1 1 1   40    5    6 o    323.0    2.5    0.0000   0.0000          ?        ?  1043.3442  15.9630          ?        ?      323.0        2.5       ?       ? 
1 1 1   40    5    7 o    352.6    2.4    0.0000   0.0000          ?        ?  1243.2015  17.2401          ?        ?      352.6        2.4       ?       ? 
1 1 1   40    5    8 o    444.4    2.4    0.0000   0.0000          ?        ?  1974.9473  21.0712          ?        ?      444.4        2.4       ?       ? 
1 1 1   40    5    9 o    188.2    3.1    0.0000   0.0000          ?        ?   354.3795  11.4934          ?        ?      188.2        3.1       ?       ? 
1 1 1   40    5   10 o    634.1    2.7    0.0000   0.0000          ?        ?  4021.4092  33.8416          ?        ?      634.1        2.7       ?       ? 
1 1 1   40    5   11 o    742.1    2.9    0.0000   0.0000          ?        ?  5507.8872  43.4195          ?        ?      742.1        2.9       ?       ? 
1 1 1   40    5   12 o    321.5    2.5    0.0000   0.0000          ?        ?  1033.7665  15.9630          ?        ?      321.5        2.5       ?       ? 
1 1 1   40    5   13 o    226.0    3.1    0.0000   0.0000          ?        ?   510.8173  14.0475          ?        ?      226.0        3.1       ?       ? 
1 1 1   40    5   14 o    517.5    2.4    0.0000   0.0000          ?        ?  2678.5981  24.9023          ?        ?      517.5        2.4       ?       ? 
1 1 1   40    5   15 o    343.2    2.4    0.0000   0.0000          ?        ?  1178.0724  16.6016          ?        ?      343.2        2.4       ?       ? 
1 1 1   40    5   16 o    511.7    2.6    0.0000   0.0000          ?        ?  2618.5771  26.1794          ?        ?      511.7        2.6       ?       ? 
1 1 1   40    5   17 o    696.8    2.9    0.0000   0.0000          ?        ?  4855.9570  40.8654          ?        ?      696.8        2.9       ?       ? 
1 1 1   40    5   18 o    546.1    2.5    0.0000   0.0000          ?        ?  2982.5347  27.4564          ?        ?      546.1        2.5       ?       ? 
1 1 1   40    5   19 o    319.1    2.5    0.0000   0.0000          ?        ?  1018.4420  15.9630          ?        ?      319.1        2.5       ?       ? 
1 1 1   40    5   20 o    385.8    2.4    0.0000   0.0000          ?        ?  1488.3939  18.5171          ?        ?      385.8        2.4       ?       ? 
1 1 1   40    5   21 o    281.2    2.7    0.0000   0.0000          ?        ?   791.1283  15.3245          ?        ?      281.2        2.7       ?       ? 
1 1 1   40    5   22 o    449.9    2.3    0.0000   0.0000          ?        ?  2024.7521  21.0712          ?        ?      449.9        2.3       ?       ? 
1 1 1   40    5   23 o    294.8    2.6    0.0000   0.0000          ?        ?   869.0280  15.3245          ?        ?      294.8        2.6       ?       ? 
1 1 1   40    5   24 f     79.0    7.7    0.0000   0.0000          ?        ?    62.5751  12.1319          ?        ?       79.0        7.7       ?       ? 
1 1 1   40    5   25 o     93.1    7.9    0.0000   0.0000          ?        ?    86.8389  14.6860          ?        ?       93.1        7.9       ?       ? 
1 1 1   40    5   26 o    214.4    3.3    0.0000   0.0000          ?        ?   459.7356  14.0475          ?        ?      214.4        3.3       ?       ? 
1 1 1   40    5   27 f     61.8   11.3    0.0000   0.0000          ?        ?    39.5883  13.4090          ?        ?       61.8       11.3       ?       ? 
1 1 1   40    5   28 o    381.9    2.5    0.0000   0.0000          ?        ?  1458.3833  19.1556          ?        ?      381.9        2.5       ?       ? 
1 1 1   40    5   29 o     41.7   13.8    0.0000   0.0000          ?        ?    16.6016  13.4090          ?        ?       41.7       13.8       ?       ? 
1 1 1   40    5   30 o    437.2    2.5    0.0000   0.0000          ?        ?  1911.7338  21.7097          ?        ?      437.2        2.5       ?       ? 
1 1 1   40    5   31 o     59.6   12.7    0.0000   0.0000          ?        ?    37.0343  14.6860          ?        ?       59.6       12.7       ?       ? 
1 1 1   40    5   32 o    498.6    2.6    0.0000   0.0000          ?        ?  2487.0417  26.1794          ?        ?      498.6        2.6       ?       ? 
1 1 1   40    5   33 o    143.3    5.1    0.0000   0.0000          ?        ?   205.6040  14.6860          ?        ?      143.3        5.1       ?       ? 
1 1 1   40    5   34 o    294.9    2.8    0.0000   0.0000          ?        ?   869.6664  16.6016          ?        ?      294.9        2.8       ?       ? 
1 1 1   40    5   35 o    396.8    2.6    0.0000   0.0000          ?        ?  1575.2328  20.4327          ?        ?      396.8        2.6       ?       ? 
1 1 1   40    5   36 o    369.3    2.6    0.0000   0.0000          ?        ?  1363.8822  19.1556          ?        ?      369.3        2.6       ?       ? 
1 1 1   40    5   37 o    411.4    2.6    0.0000   0.0000          ?        ?  1693.3594  21.0712          ?        ?      411.4        2.6       ?       ? 
1 1 1   40    5   38 o    331.1    2.8    0.0000   0.0000          ?        ?  1096.3416  18.5171          ?        ?      331.1        2.8       ?       ? 
1 1 1   40    5   39 o     88.4    9.4    0.0000   0.0000          ?        ?    78.5382  16.6016          ?        ?       88.4        9.4       ?       ? 
1 1 1   40    5   40 o     20.9   10.3    0.0000   0.0000          ?        ?   -36.3957  15.9630          ?        ?       20.9       10.3       ?       ? 
1 1 1   40    5   41 o    358.2    2.7    0.0000   0.0000          ?        ?  1283.4285  19.1556          ?        ?      358.2        2.7       ?       ? 
1 1 1   40    5   42 o    183.2    4.4    0.0000   0.0000          ?        ?   335.8624  15.9630          ?        ?      183.2        4.4       ?       ? 
1 1 1   40    5   43 o    118.4    6.7    0.0000   0.0000          ?        ?   140.4748  15.9630          ?        ?      118.4        6.7       ?       ? 
1 1 1   40    5   44 o     20.7   10.2    0.0000   0.0000          ?        ?   -33.8416  15.3245          ?        ?       20.7       10.2       ?       ? 
1 1 1   40    5   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    5   46 o    308.5    3.1    0.0000   0.0000          ?        ?   952.0358  19.1556          ?        ?      308.5        3.1       ?       ? 
1 1 1   40    5   47 f    454.0    2.7    0.0000   0.0000          ?        ?  2062.4248  24.2638          ?        ?      454.0        2.7       ?       ? 
1 1 1   40    5   48 o     59.8   15.0    0.0000   0.0000          ?        ?    37.6728  17.8786          ?        ?       59.8       15.0       ?       ? 
1 1 1   40    5   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    5   50 o    188.4    4.9    0.0000   0.0000          ?        ?   355.6566  18.5171          ?        ?      188.4        4.9       ?       ? 
1 1 1   40    5   51 o    111.3    7.7    0.0000   0.0000          ?        ?   124.5117  17.2401          ?        ?      111.3        7.7       ?       ? 
1 1 1   40    5   52 o     94.2    9.8    0.0000   0.0000          ?        ?    89.3930  18.5171          ?        ?       94.2        9.8       ?       ? 
1 1 1   40    5   53 o    264.9    3.6    0.0000   0.0000          ?        ?   702.3738  19.1556          ?        ?      264.9        3.6       ?       ? 
1 1 1   40    5   54 o    108.3    8.5    0.0000   0.0000          ?        ?   118.1265  18.5171          ?        ?      108.3        8.5       ?       ? 
1 1 1   40    5   55 f    151.9    6.3    0.0000   0.0000          ?        ?   231.7833  19.1556          ?        ?      151.9        6.3       ?       ? 
1 1 1   40    5   56 o    166.0    5.8    0.0000   0.0000          ?        ?   276.4799  19.1556          ?        ?      166.0        5.8       ?       ? 
1 1 1   40    5   57 o    270.2    3.8    0.0000   0.0000          ?        ?   731.1072  20.4327          ?        ?      270.2        3.8       ?       ? 
1 1 1   40    5   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    5   59 o    174.7    5.5    0.0000   0.0000          ?        ?   306.4904  19.1556          ?        ?      174.7        5.5       ?       ? 
1 1 1   40    5   60 o    136.2    7.3    0.0000   0.0000          ?        ?   187.0868  19.7942          ?        ?      136.2        7.3       ?       ? 
1 1 1   40    5   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    5   62 o     19.5    9.9    0.0000   0.0000          ?        ?   -65.7677  19.1556          ?        ?       19.5        9.9       ?       ? 
1 1 1   40    5   63 o    218.1    4.5    0.0000   0.0000          ?        ?   477.6142  19.7942          ?        ?      218.1        4.5       ?       ? 
1 1 1   40    6    0 o     75.7   10.3   58.7440  15.3245    58.7440  15.3245    58.7440  15.3245       75.7     10.3       75.7       10.3     0.0     0.0 
1 1 1   40    6    1 o    766.7    3.2    0.0000   0.0000          ?        ?  5879.5068  49.1662          ?        ?      766.7        3.2       ?       ? 
1 1 1   40    6    2 o    494.4    2.6    0.0000   0.0000          ?        ?  2444.8992  25.5409          ?        ?      494.4        2.6       ?       ? 
1 1 1   40    6    3 o    588.0    2.7    0.0000   0.0000          ?        ?  3458.2329  31.2876          ?        ?      588.0        2.7       ?       ? 
1 1 1   40    6    4 o    109.8    4.9    0.0000   0.0000          ?        ?   120.6806  10.8549          ?        ?      109.8        4.9       ?       ? 
1 1 1   40    6    5 o    659.9    2.9    0.0000   0.0000          ?        ?  4355.3560  38.3113          ?        ?      659.9        2.9       ?       ? 
1 1 1   40    6    6 o    332.3    2.3    0.0000   0.0000          ?        ?  1104.6425  15.3245          ?        ?      332.3        2.3       ?       ? 
1 1 1   40    6    7 o    445.0    2.4    0.0000   0.0000          ?        ?  1980.6942  21.0712          ?        ?      445.0        2.4       ?       ? 
1 1 1   40    6    8 o    158.2    3.4    0.0000   0.0000          ?        ?   250.3005  10.8549          ?        ?      158.2        3.4       ?       ? 
1 1 1   40    6    9 o    655.6    2.8    0.0000   0.0000          ?        ?  4298.5278  36.3957          ?        ?      655.6        2.8       ?       ? 
1 1 1   40    6   10 o    308.7    2.4    0.0000   0.0000          ?        ?   953.3128  14.6860          ?        ?      308.7        2.4       ?       ? 
1 1 1   40    6   11 o    603.3    2.6    0.0000   0.0000          ?        ?  3639.5732  31.2876          ?        ?      603.3        2.6       ?       ? 
1 1 1   40    6   12 o    524.4    2.5    0.0000   0.0000          ?        ?  2750.7510  26.1794          ?        ?      524.4        2.5       ?       ? 
1 1 1   40    6   13 o    668.0    2.9    0.0000   0.0000          ?        ?  4462.6279  38.3113          ?        ?      668.0        2.9       ?       ? 
1 1 1   40    6   14 o    428.1    2.4    0.0000   0.0000          ?        ?  1832.5571  20.4327          ?        ?      428.1        2.4       ?       ? 
1 1 1   40    6   15 o    541.7    2.5    0.0000   0.0000          ?        ?  2934.6455  27.4564          ?        ?      541.7        2.5       ?       ? 
1 1 1   40    6   16 o    187.9    3.2    0.0000   0.0000          ?        ?   353.1024  12.1319          ?        ?      187.9        3.2       ?       ? 
1 1 1   40    6   17 o    400.0    2.5    0.0000   0.0000          ?        ?  1600.1353  19.7942          ?        ?      400.0        2.5       ?       ? 
1 1 1   40    6   18 o    308.6    2.6    0.0000   0.0000          ?        ?   952.6743  15.9630          ?        ?      308.6        2.6       ?       ? 
1 1 1   40    6   19 o    123.0    5.5    0.0000   0.0000          ?        ?   151.3296  13.4090          ?        ?      123.0        5.5       ?       ? 
1 1 1   40    6   20 o    150.1    4.5    0.0000   0.0000          ?        ?   225.3981  13.4090          ?        ?      150.1        4.5       ?       ? 
1 1 1   40    6   21 o    819.6    3.2    0.0000   0.0000          ?        ?  6718.5244  51.7203          ?        ?      819.6        3.2       ?       ? 
1 1 1   40    6   22 o    274.3    2.8    0.0000   0.0000          ?        ?   752.8170  15.3245          ?        ?      274.3        2.8       ?       ? 
1 1 1   40    6   23 o    498.3    2.4    0.0000   0.0000          ?        ?  2483.8491  24.2638          ?        ?      498.3        2.4       ?       ? 
1 1 1   40    6   24 o    144.2    4.4    0.0000   0.0000          ?        ?   208.1580  12.7704          ?        ?      144.2        4.4       ?       ? 
1 1 1   40    6   25 o    326.2    2.5    0.0000   0.0000          ?        ?  1064.4155  16.6016          ?        ?      326.2        2.5       ?       ? 
1 1 1   40    6   26 o    514.0    2.7    0.0000   0.0000          ?        ?  2642.8411  27.4564          ?        ?      514.0        2.7       ?       ? 
1 1 1   40    6   27 o    404.0    2.4    0.0000   0.0000          ?        ?  1632.6998  19.7942          ?        ?      404.0        2.4       ?       ? 
1 1 1   40    6   28 o    354.4    2.6    0.0000   0.0000          ?        ?  1255.9720  18.5171          ?        ?      354.4        2.6       ?       ? 
1 1 1   40    6   29 o    564.3    2.5    0.0000   0.0000          ?        ?  3184.9458  28.7335          ?        ?      564.3        2.5       ?       ? 
1 1 1   40    6   30 o    203.7    3.6    0.0000   0.0000          ?        ?   415.0391  14.6860          ?        ?      203.7        3.6       ?       ? 
1 1 1   40    6   31 o     43.1   14.1    0.0000   0.0000          ?        ?    17.8786  14.0475          ?        ?       43.1       14.1       ?       ? 
1 1 1   40    6   32 f    366.6    2.5    0.0000   0.0000          ?        ?  1344.0880  18.5171          ?        ?      366.6        2.5       ?       ? 
1 1 1   40    6   33 o     94.8    7.7    0.0000   0.0000          ?        ?    90.0316  14.6860          ?        ?       94.8        7.7       ?       ? 
1 1 1   40    6   34 o    614.2    2.7    0.0000   0.0000          ?        ?  3773.6628  33.2031          ?        ?      614.2        2.7       ?       ? 
1 1 1   40    6   35 o    160.0    4.4    0.0000   0.0000          ?        ?   256.0471  14.0475          ?        ?      160.0        4.4       ?       ? 
1 1 1   40    6   36 o    277.6    3.0    0.0000   0.0000          ?        ?   770.6956  16.6016          ?        ?      277.6        3.0       ?       ? 
1 1 1   40    6   37 o    400.8    2.6    0.0000   0.0000          ?        ?  1607.1589  21.0712          ?        ?      400.8        2.6       ?       ? 
1 1 1   40    6   38 o    158.7    5.0    0.0000   0.0000          ?        ?   252.2160  15.9630          ?        ?      158.7        5.0       ?       ? 
1 1 1   40    6   39 o    231.1    3.6    0.0000   0.0000          ?        ?   534.4426  16.6016          ?        ?      231.1        3.6       ?       ? 
1 1 1   40    6   40 o    843.8    3.2    0.0000   0.0000          ?        ?  7124.6245  54.2743          ?        ?      843.8        3.2       ?       ? 
1 1 1   40    6   41 o    105.2    8.2    0.0000   0.0000          ?        ?   111.1028  17.2401          ?        ?      105.2        8.2       ?       ? 
1 1 1   40    6   42 o    203.2    3.9    0.0000   0.0000          ?        ?   413.1235  15.9630          ?        ?      203.2        3.9       ?       ? 
1 1 1   40    6   43 o    177.3    4.5    0.0000   0.0000          ?        ?   314.7912  15.9630          ?        ?      177.3        4.5       ?       ? 
1 1 1   40    6   44 o    139.4    6.0    0.0000   0.0000          ?        ?   194.7491  16.6016          ?        ?      139.4        6.0       ?       ? 
1 1 1   40    6   45 o    416.9    2.7    0.0000   0.0000          ?        ?  1738.6943  22.3483          ?        ?      416.9        2.7       ?       ? 
1 1 1   40    6   46 o    234.9    3.9    0.0000   0.0000          ?        ?   552.3212  18.5171          ?        ?      234.9        3.9       ?       ? 
1 1 1   40    6   47 o    159.1    5.4    0.0000   0.0000          ?        ?   253.4931  17.2401          ?        ?      159.1        5.4       ?       ? 
1 1 1   40    6   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    6   49 o    172.3    5.2    0.0000   0.0000          ?        ?   297.5511  17.8786          ?        ?      172.3        5.2       ?       ? 
1 1 1   40    6   50 o    234.6    3.9    0.0000   0.0000          ?        ?   551.0442  18.5171          ?        ?      234.6        3.9       ?       ? 
1 1 1   40    6   51 o    144.9    6.6    0.0000   0.0000          ?        ?   210.7121  19.1556          ?        ?      144.9        6.6       ?       ? 
1 1 1   40    6   52 f     21.4   10.7    0.0000   0.0000          ?        ?   -52.3588  19.1556          ?        ?       21.4       10.7       ?       ? 
1 1 1   40    6   53 o    181.8    5.1    0.0000   0.0000          ?        ?   331.3927  18.5171          ?        ?      181.8        5.1       ?       ? 
1 1 1   40    6   54 o     25.7   12.3    0.0000   0.0000          ?        ?   -24.2638  17.8786          ?        ?       25.7       12.3       ?       ? 
1 1 1   40    6   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    6   56 o     89.8   10.7    0.0000   0.0000          ?        ?    81.7308  19.1556          ?        ?       89.8       10.7       ?       ? 
1 1 1   40    6   57 o     34.6   14.9    0.0000   0.0000          ?        ?    -0.6385  18.5171          ?        ?       34.6       14.9       ?       ? 
1 1 1   40    6   58 o     43.6   16.1    0.0000   0.0000          ?        ?    15.9630  18.5171          ?        ?       43.6       16.1       ?       ? 
1 1 1   40    6   59 o    140.2    6.6    0.0000   0.0000          ?        ?   197.9417  18.5171          ?        ?      140.2        6.6       ?       ? 
1 1 1   40    6   60 o    141.7    7.0    0.0000   0.0000          ?        ?   202.4114  19.7942          ?        ?      141.7        7.0       ?       ? 
1 1 1   40    6   61 o     20.1   10.1    0.0000   0.0000          ?        ?   -61.2981  19.1556          ?        ?       20.1       10.1       ?       ? 
1 1 1   40    6   62 o    105.1    9.1    0.0000   0.0000          ?        ?   112.3798  19.1556          ?        ?      105.1        9.1       ?       ? 
1 1 1   40    7    0 o    203.3    4.1  413.7620  16.6016   413.7620  16.6016   413.7620  16.6016      203.3      4.1      203.3        4.1     0.0     0.0 
1 1 1   40    7    1 o    477.3    2.4    0.0000   0.0000          ?        ?  2278.2451  22.9868          ?        ?      477.3        2.4       ?       ? 
1 1 1   40    7    2 o     98.8    5.2    0.0000   0.0000          ?        ?    97.6938  10.2163          ?        ?       98.8        5.2       ?       ? 
1 1 1   40    7    3 o    533.9    2.6    0.0000   0.0000          ?        ?  2850.3606  27.4564          ?        ?      533.9        2.6       ?       ? 
1 1 1   40    7    4 o    211.8    3.3    0.0000   0.0000          ?        ?   448.8807  14.0475          ?        ?      211.8        3.3       ?       ? 
1 1 1   40    7    5 o   1107.6    4.0    0.0000   0.0000          ?        ? 12270.4697  88.7545          ?        ?     1107.6        4.0       ?       ? 
1 1 1   40    7    6 o    607.3    2.7    0.0000   0.0000          ?        ?  3688.1008  33.2031          ?        ?      607.3        2.7       ?       ? 
1 1 1   40    7    7 o    296.6    2.5    0.0000   0.0000          ?        ?   879.8828  14.6860          ?        ?      296.6        2.5       ?       ? 
1 1 1   40    7    8 o    798.0    3.1    0.0000   0.0000          ?        ?  6369.8916  49.8047          ?        ?      798.0        3.1       ?       ? 
1 1 1   40    7    9 o    764.1    3.1    0.0000   0.0000          ?        ?  5839.9185  46.6121          ?        ?      764.1        3.1       ?       ? 
1 1 1   40    7   10 o    371.6    2.3    0.0000   0.0000          ?        ?  1381.1223  17.2401          ?        ?      371.6        2.3       ?       ? 
1 1 1   40    7   11 o    400.6    2.4    0.0000   0.0000          ?        ?  1605.2433  19.1556          ?        ?      400.6        2.4       ?       ? 
1 1 1   40    7   12 o    519.1    2.5    0.0000   0.0000          ?        ?  2695.1997  26.1794          ?        ?      519.1        2.5       ?       ? 
1 1 1   40    7   13 o    326.8    2.3    0.0000   0.0000          ?        ?  1068.2467  15.3245          ?        ?      326.8        2.3       ?       ? 
1 1 1   40    7   14 o    206.4    2.9    0.0000   0.0000          ?        ?   425.8939  12.1319          ?        ?      206.4        2.9       ?       ? 
1 1 1   40    7   15 o    622.0    2.8    0.0000   0.0000          ?        ?  3869.4412  35.1187          ?        ?      622.0        2.8       ?       ? 
1 1 1   40    7   16 o    268.7    2.7    0.0000   0.0000          ?        ?   722.1680  14.6860          ?        ?      268.7        2.7       ?       ? 
1 1 1   40    7   17 o     29.8   12.4    0.0000   0.0000          ?        ?     1.9156  12.1319          ?        ?       29.8       12.4       ?       ? 
1 1 1   40    7   18 o    161.0    4.0    0.0000   0.0000          ?        ?   259.2398  12.7704          ?        ?      161.0        4.0       ?       ? 
1 1 1   40    7   19 o    138.6    4.1    0.0000   0.0000          ?        ?   192.1950  11.4934          ?        ?      138.6        4.1       ?       ? 
1 1 1   40    7   20 o    302.7    2.5    0.0000   0.0000          ?        ?   916.2786  15.3245          ?        ?      302.7        2.5       ?       ? 
1 1 1   40    7   21 o    219.5    3.5    0.0000   0.0000          ?        ?   482.0838  15.3245          ?        ?      219.5        3.5       ?       ? 
1 1 1   40    7   22 f    514.4    2.6    0.0000   0.0000          ?        ?  2646.6721  26.8179          ?        ?      514.4        2.6       ?       ? 
1 1 1   40    7   23 o    600.5    2.7    0.0000   0.0000          ?        ?  3607.0088  32.5646          ?        ?      600.5        2.7       ?       ? 
1 1 1   40    7   24 o    340.7    2.5    0.0000   0.0000          ?        ?  1160.8323  17.2401          ?        ?      340.7        2.5       ?       ? 
1 1 1   40    7   25 o    249.0    2.9    0.0000   0.0000          ?        ?   620.0045  14.6860          ?        ?      249.0        2.9       ?       ? 
1 1 1   40    7   26 f    538.1    2.6    0.0000   0.0000          ?        ?  2896.3342  27.4564          ?        ?      538.1        2.6       ?       ? 
1 1 1   40    7   27 o    520.0    2.5    0.0000   0.0000          ?        ?  2704.7776  26.1794          ?        ?      520.0        2.5       ?       ? 
1 1 1   40    7   28 o    304.9    2.6    0.0000   0.0000          ?        ?   929.6875  15.9630          ?        ?      304.9        2.6       ?       ? 
1 1 1   40    7   29 o    427.1    2.5    0.0000   0.0000          ?        ?  1824.8948  21.7097          ?        ?      427.1        2.5       ?       ? 
1 1 1   40    7   30 o    246.8    3.2    0.0000   0.0000          ?        ?   609.1497  15.9630          ?        ?      246.8        3.2       ?       ? 
1 1 1   40    7   31 o    380.5    2.5    0.0000   0.0000          ?        ?  1448.1671  19.1556          ?        ?      380.5        2.5       ?       ? 
1 1 1   40    7   32 o     30.4   13.0    0.0000   0.0000          ?        ?    -0.6385  14.0475          ?        ?       30.4       13.0       ?       ? 
1 1 1   40    7   33 o    120.0    5.9    0.0000   0.0000          ?        ?   144.3059  14.0475          ?        ?      120.0        5.9       ?       ? 
1 1 1   40    7   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    7   35 o    172.6    4.6    0.0000   0.0000          ?        ?   298.1896  15.9630          ?        ?      172.6        4.6       ?       ? 
1 1 1   40    7   36 o    228.3    3.6    0.0000   0.0000          ?        ?   521.6721  16.6016          ?        ?      228.3        3.6       ?       ? 
1 1 1   40    7   37 o    369.8    2.7    0.0000   0.0000          ?        ?  1367.7133  19.7942          ?        ?      369.8        2.7       ?       ? 
1 1 1   40    7   38 o     30.6   13.5    0.0000   0.0000          ?        ?    -4.4697  15.9630          ?        ?       30.6       13.5       ?       ? 
1 1 1   40    7   39 o    197.3    4.0    0.0000   0.0000          ?        ?   389.4982  15.9630          ?        ?      197.3        4.0       ?       ? 
1 1 1   40    7   40 o    320.7    3.0    0.0000   0.0000          ?        ?  1029.2969  19.1556          ?        ?      320.7        3.0       ?       ? 
1 1 1   40    7   41 o    421.6    2.7    0.0000   0.0000          ?        ?  1778.2827  22.3483          ?        ?      421.6        2.7       ?       ? 
1 1 1   40    7   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    7   43 o     26.7   12.3    0.0000   0.0000          ?        ?   -12.1319  15.3245          ?        ?       26.7       12.3       ?       ? 
1 1 1   40    7   44 o    199.2    4.2    0.0000   0.0000          ?        ?   397.1605  16.6016          ?        ?      199.2        4.2       ?       ? 
1 1 1   40    7   45 o    230.1    3.9    0.0000   0.0000          ?        ?   529.9730  17.8786          ?        ?      230.1        3.9       ?       ? 
1 1 1   40    7   46 o    171.8    5.2    0.0000   0.0000          ?        ?   295.6355  17.8786          ?        ?      171.8        5.2       ?       ? 
1 1 1   40    7   47 o    208.4    4.3    0.0000   0.0000          ?        ?   434.8332  17.8786          ?        ?      208.4        4.3       ?       ? 
1 1 1   40    7   48 o    269.1    3.4    0.0000   0.0000          ?        ?   724.7220  18.5171          ?        ?      269.1        3.4       ?       ? 
1 1 1   40    7   49 o    294.6    3.3    0.0000   0.0000          ?        ?   868.3894  19.1556          ?        ?      294.6        3.3       ?       ? 
1 1 1   40    7   50 o    101.1    8.8    0.0000   0.0000          ?        ?   102.8020  17.8786          ?        ?      101.1        8.8       ?       ? 
1 1 1   40    7   51 o     62.1   15.0    0.0000   0.0000          ?        ?    40.8654  18.5171          ?        ?       62.1       15.0       ?       ? 
1 1 1   40    7   52 o    404.2    2.9    0.0000   0.0000          ?        ?  1635.2539  23.6253          ?        ?      404.2        2.9       ?       ? 
1 1 1   40    7   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    7   54 o    171.7    5.4    0.0000   0.0000          ?        ?   295.6355  18.5171          ?        ?      171.7        5.4       ?       ? 
1 1 1   40    7   55 o     20.6   10.4    0.0000   0.0000          ?        ?   -57.4669  19.1556          ?        ?       20.6       10.4       ?       ? 
1 1 1   40    7   56 o    182.2    5.4    0.0000   0.0000          ?        ?   333.3083  19.7942          ?        ?      182.2        5.4       ?       ? 
1 1 1   40    7   57 o     40.9   15.8    0.0000   0.0000          ?        ?    11.4934  18.5171          ?        ?       40.9       15.8       ?       ? 
1 1 1   40    7   58 o    179.4    5.5    0.0000   0.0000          ?        ?   323.0919  19.7942          ?        ?      179.4        5.5       ?       ? 
1 1 1   40    7   59 o    114.6    8.4    0.0000   0.0000          ?        ?   132.8125  19.1556          ?        ?      114.6        8.4       ?       ? 
1 1 1   40    7   60 o    329.3    3.3    0.0000   0.0000          ?        ?  1086.7638  21.7097          ?        ?      329.3        3.3       ?       ? 
1 1 1   40    7   61 o     50.9   16.5    0.0000   0.0000          ?        ?    26.8179  19.1556          ?        ?       50.9       16.5       ?       ? 
1 1 1   40    7   62 o    214.0    4.5    0.0000   0.0000          ?        ?   459.7356  19.1556          ?        ?      214.0        4.5       ?       ? 
1 1 1   40    8    0 o     75.1   10.1   59.3825  14.6860    59.3825  14.6860    59.3825  14.6860       75.1     10.1       75.1       10.1     0.0     0.0 
1 1 1   40    8    1 o    734.7    3.0    0.0000   0.0000          ?        ?  5399.3389  44.0580          ?        ?      734.7        3.0       ?       ? 
1 1 1   40    8    2 o    716.4    3.0    0.0000   0.0000          ?        ?  5132.4365  42.7809          ?        ?      716.4        3.0       ?       ? 
1 1 1   40    8    3 o    239.7    2.8    0.0000   0.0000          ?        ?   574.6694  13.4090          ?        ?      239.7        2.8       ?       ? 
1 1 1   40    8    4 o    411.1    2.4    0.0000   0.0000          ?        ?  1690.1669  19.7942          ?        ?      411.1        2.4       ?       ? 
1 1 1   40    8    5 f    570.7    2.7    0.0000   0.0000          ?        ?  3257.0989  30.6490          ?        ?      570.7        2.7       ?       ? 
1 1 1   40    8    6 o    539.4    2.6    0.0000   0.0000          ?        ?  2909.7432  28.0950          ?        ?      539.4        2.6       ?       ? 
1 1 1   40    8    7 o    309.2    2.5    0.0000   0.0000          ?        ?   955.8669  15.3245          ?        ?      309.2        2.5       ?       ? 
1 1 1   40    8    8 o    756.3    3.1    0.0000   0.0000          ?        ?  5721.1538  47.2506          ?        ?      756.3        3.1       ?       ? 
1 1 1   40    8    9 o    280.3    2.6    0.0000   0.0000          ?        ?   786.0201  14.6860          ?        ?      280.3        2.6       ?       ? 
1 1 1   40    8   10 o    331.3    2.4    0.0000   0.0000          ?        ?  1097.6187  15.9630          ?        ?      331.3        2.4       ?       ? 
1 1 1   40    8   11 o    325.9    2.4    0.0000   0.0000          ?        ?  1062.5000  15.3245          ?        ?      325.9        2.4       ?       ? 
1 1 1   40    8   12 o    160.8    3.8    0.0000   0.0000          ?        ?   258.6013  12.1319          ?        ?      160.8        3.8       ?       ? 
1 1 1   40    8   13 o    747.9    3.2    0.0000   0.0000          ?        ?  5595.3647  47.2506          ?        ?      747.9        3.2       ?       ? 
1 1 1   40    8   14 f    530.1    2.6    0.0000   0.0000          ?        ?  2810.1338  27.4564          ?        ?      530.1        2.6       ?       ? 
1 1 1   40    8   15 o    174.5    3.7    0.0000   0.0000          ?        ?   304.5748  12.7704          ?        ?      174.5        3.7       ?       ? 
1 1 1   40    8   16 o    510.5    2.6    0.0000   0.0000          ?        ?  2606.4453  26.1794          ?        ?      510.5        2.6       ?       ? 
1 1 1   40    8   17 o    357.1    2.4    0.0000   0.0000          ?        ?  1275.1277  17.2401          ?        ?      357.1        2.4       ?       ? 
1 1 1   40    8   18 o    214.1    3.1    0.0000   0.0000          ?        ?   458.4586  13.4090          ?        ?      214.1        3.1       ?       ? 
1 1 1   40    8   19 o    454.7    2.5    0.0000   0.0000          ?        ?  2067.5330  22.3483          ?        ?      454.7        2.5       ?       ? 
1 1 1   40    8   20 f    291.1    2.6    0.0000   0.0000          ?        ?   847.3182  15.3245          ?        ?      291.1        2.6       ?       ? 
1 1 1   40    8   21 o    369.2    2.4    0.0000   0.0000          ?        ?  1363.2437  17.8786          ?        ?      369.2        2.4       ?       ? 
1 1 1   40    8   22 o    200.2    3.3    0.0000   0.0000          ?        ?   400.9916  13.4090          ?        ?      200.2        3.3       ?       ? 
1 1 1   40    8   23 f    337.1    2.6    0.0000   0.0000          ?        ?  1136.5685  17.2401          ?        ?      337.1        2.6       ?       ? 
1 1 1   40    8   24 o    198.4    3.5    0.0000   0.0000          ?        ?   393.9678  14.0475          ?        ?      198.4        3.5       ?       ? 
1 1 1   40    8   25 o    342.7    2.4    0.0000   0.0000          ?        ?  1174.8798  16.6016          ?        ?      342.7        2.4       ?       ? 
1 1 1   40    8   26 o     64.3    9.9    0.0000   0.0000          ?        ?    41.5039  12.7704          ?        ?       64.3        9.9       ?       ? 
1 1 1   40    8   27 o    309.9    2.7    0.0000   0.0000          ?        ?   960.3365  16.6016          ?        ?      309.9        2.7       ?       ? 
1 1 1   40    8   28 o    150.5    4.7    0.0000   0.0000          ?        ?   226.6752  14.0475          ?        ?      150.5        4.7       ?       ? 
1 1 1   40    8   29 o    353.8    2.6    0.0000   0.0000          ?        ?  1252.1410  18.5171          ?        ?      353.8        2.6       ?       ? 
1 1 1   40    8   30 o    134.6    5.2    0.0000   0.0000          ?        ?   181.3401  14.0475          ?        ?      134.6        5.2       ?       ? 
1 1 1   40    8   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    8   32 o    167.2    4.4    0.0000   0.0000          ?        ?   279.6725  14.6860          ?        ?      167.2        4.4       ?       ? 
1 1 1   40    8   33 o    116.3    6.3    0.0000   0.0000          ?        ?   135.3666  14.6860          ?        ?      116.3        6.3       ?       ? 
1 1 1   40    8   34 o    104.7    7.3    0.0000   0.0000          ?        ?   109.8257  15.3245          ?        ?      104.7        7.3       ?       ? 
1 1 1   40    8   35 o    788.7    3.0    0.0000   0.0000          ?        ?  6223.0317  47.2506          ?        ?      788.7        3.0       ?       ? 
1 1 1   40    8   36 o    179.5    4.3    0.0000   0.0000          ?        ?   322.4534  15.3245          ?        ?      179.5        4.3       ?       ? 
1 1 1   40    8   37 o    173.1    4.8    0.0000   0.0000          ?        ?   300.1052  16.6016          ?        ?      173.1        4.8       ?       ? 
1 1 1   40    8   38 o     20.1    9.9    0.0000   0.0000          ?        ?   -33.2031  14.6860          ?        ?       20.1        9.9       ?       ? 
1 1 1   40    8   39 o    344.5    2.7    0.0000   0.0000          ?        ?  1187.0117  18.5171          ?        ?      344.5        2.7       ?       ? 
1 1 1   40    8   40 o    375.6    2.7    0.0000   0.0000          ?        ?  1411.1328  20.4327          ?        ?      375.6        2.7       ?       ? 
1 1 1   40    8   41 o    342.0    2.9    0.0000   0.0000          ?        ?  1170.4102  19.7942          ?        ?      342.0        2.9       ?       ? 
1 1 1   40    8   42 o    491.8    2.7    0.0000   0.0000          ?        ?  2419.3584  26.1794          ?        ?      491.8        2.7       ?       ? 
1 1 1   40    8   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    8   44 o    253.5    3.4    0.0000   0.0000          ?        ?   642.9913  17.2401          ?        ?      253.5        3.4       ?       ? 
1 1 1   40    8   45 o    266.7    3.5    0.0000   0.0000          ?        ?   711.9516  18.5171          ?        ?      266.7        3.5       ?       ? 
1 1 1   40    8   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    8   47 o    270.9    3.4    0.0000   0.0000          ?        ?   734.2999  18.5171          ?        ?      270.9        3.4       ?       ? 
1 1 1   40    8   48 o    444.3    2.9    0.0000   0.0000          ?        ?  1974.9473  25.5409          ?        ?      444.3        2.9       ?       ? 
1 1 1   40    8   49 f     25.1   12.0    0.0000   0.0000          ?        ?   -24.2638  17.2401          ?        ?       25.1       12.0       ?       ? 
1 1 1   40    8   50 o    377.5    3.0    0.0000   0.0000          ?        ?  1426.4573  22.3483          ?        ?      377.5        3.0       ?       ? 
1 1 1   40    8   51 o    215.1    4.2    0.0000   0.0000          ?        ?   463.5667  17.8786          ?        ?      215.1        4.2       ?       ? 
1 1 1   40    8   52 o    160.7    6.0    0.0000   0.0000          ?        ?   259.2398  19.1556          ?        ?      160.7        6.0       ?       ? 
1 1 1   40    8   53 o    260.6    3.7    0.0000   0.0000          ?        ?   680.0255  19.1556          ?        ?      260.6        3.7       ?       ? 
1 1 1   40    8   54 o     29.2   13.5    0.0000   0.0000          ?        ?   -14.6860  18.5171          ?        ?       29.2       13.5       ?       ? 
1 1 1   40    8   55 o    296.6    3.6    0.0000   0.0000          ?        ?   881.1599  21.0712          ?        ?      296.6        3.6       ?       ? 
1 1 1   40    8   56 o     82.3   11.6    0.0000   0.0000          ?        ?    68.9603  19.1556          ?        ?       82.3       11.6       ?       ? 
1 1 1   40    8   57 o    102.3    9.4    0.0000   0.0000          ?        ?   105.9946  19.1556          ?        ?      102.3        9.4       ?       ? 
1 1 1   40    8   58 o     21.5   10.7    0.0000   0.0000          ?        ?   -47.2506  18.5171          ?        ?       21.5       10.7       ?       ? 
1 1 1   40    8   59 o    135.5    7.1    0.0000   0.0000          ?        ?   185.1713  19.1556          ?        ?      135.5        7.1       ?       ? 
1 1 1   40    8   60 o     88.7   10.8    0.0000   0.0000          ?        ?    80.4537  19.1556          ?        ?       88.7       10.8       ?       ? 
1 1 1   40    8   61 o    175.1    5.3    0.0000   0.0000          ?        ?   308.4059  18.5171          ?        ?      175.1        5.3       ?       ? 
1 1 1   40    9    0 o    849.2    5.0 7214.6562  85.5619  7214.6562  85.5619  7214.6562  85.5619      849.2      5.0      849.2        5.0     0.0     0.0 
1 1 1   40    9    1 o    212.6    2.9    0.0000   0.0000          ?        ?   452.0733  12.1319          ?        ?      212.6        2.9       ?       ? 
1 1 1   40    9    2 o     87.9    6.2    0.0000   0.0000          ?        ?    77.2611  10.8549          ?        ?       87.9        6.2       ?       ? 
1 1 1   40    9    3 o    932.0    3.6    0.0000   0.0000          ?        ?  8688.3633  67.0448          ?        ?      932.0        3.6       ?       ? 
1 1 1   40    9    4 o    597.2    2.8    0.0000   0.0000          ?        ?  3567.4204  33.2031          ?        ?      597.2        2.8       ?       ? 
1 1 1   40    9    5 o    668.4    2.8    0.0000   0.0000          ?        ?  4467.7358  37.6728          ?        ?      668.4        2.8       ?       ? 
1 1 1   40    9    6 o    326.6    2.4    0.0000   0.0000          ?        ?  1066.9697  15.9630          ?        ?      326.6        2.4       ?       ? 
1 1 1   40    9    7 o    501.2    2.5    0.0000   0.0000          ?        ?  2512.5825  25.5409          ?        ?      501.2        2.5       ?       ? 
1 1 1   40    9    8 o    406.7    2.4    0.0000   0.0000          ?        ?  1654.4095  19.7942          ?        ?      406.7        2.4       ?       ? 
1 1 1   40    9    9 o    127.6    4.3    0.0000   0.0000          ?        ?   162.8230  10.8549          ?        ?      127.6        4.3       ?       ? 
1 1 1   40    9   10 o    353.1    2.4    0.0000   0.0000          ?        ?  1247.0327  17.2401          ?        ?      353.1        2.4       ?       ? 
1 1 1   40    9   11 o    474.3    2.5    0.0000   0.0000          ?        ?  2250.1501  23.6253          ?        ?      474.3        2.5       ?       ? 
1 1 1   40    9   12 o    491.1    2.5    0.0000   0.0000          ?        ?  2411.6963  24.2638          ?        ?      491.1        2.5       ?       ? 
1 1 1   40    9   13 o    367.4    2.4    0.0000   0.0000          ?        ?  1349.8347  17.8786          ?        ?      367.4        2.4       ?       ? 
1 1 1   40    9   14 o    747.0    2.9    0.0000   0.0000          ?        ?  5581.9561  44.0580          ?        ?      747.0        2.9       ?       ? 
1 1 1   40    9   15 f    804.7    3.3    0.0000   0.0000          ?        ?  6477.8018  52.3588          ?        ?      804.7        3.3       ?       ? 
1 1 1   40    9   16 o    328.7    2.5    0.0000   0.0000          ?        ?  1080.3785  16.6016          ?        ?      328.7        2.5       ?       ? 
1 1 1   40    9   17 o    274.2    2.6    0.0000   0.0000          ?        ?   752.1785  14.0475          ?        ?      274.2        2.6       ?       ? 
1 1 1   40    9   18 o    171.2    3.5    0.0000   0.0000          ?        ?   293.0815  12.1319          ?        ?      171.2        3.5       ?       ? 
1 1 1   40    9   19 o    284.2    2.8    0.0000   0.0000          ?        ?   807.7299  15.9630          ?        ?      284.2        2.8       ?       ? 
1 1 1   40    9   20 o    186.9    3.4    0.0000   0.0000          ?        ?   349.2713  12.7704          ?        ?      186.9        3.4       ?       ? 
1 1 1   40    9   21 f    239.8    2.8    0.0000   0.0000          ?        ?   575.3080  13.4090          ?        ?      239.8        2.8       ?       ? 
1 1 1   40    9   22 o    247.3    2.7    0.0000   0.0000          ?        ?   611.7037  13.4090          ?        ?      247.3        2.7       ?       ? 
1 1 1   40    9   23 o    223.0    3.1    0.0000   0.0000          ?        ?   497.4084  14.0475          ?        ?      223.0        3.1       ?       ? 
1 1 1   40    9   24 o    427.6    2.4    0.0000   0.0000          ?        ?  1828.7260  20.4327          ?        ?      427.6        2.4       ?       ? 
1 1 1   40    9   25 o    394.0    2.4    0.0000   0.0000          ?        ?  1552.2461  18.5171          ?        ?      394.0        2.4       ?       ? 
1 1 1   40    9   26 o    253.9    3.0    0.0000   0.0000          ?        ?   644.9069  15.3245          ?        ?      253.9        3.0       ?       ? 
1 1 1   40    9   27 o    115.4    6.1    0.0000   0.0000          ?        ?   133.4510  14.0475          ?        ?      115.4        6.1       ?       ? 
1 1 1   40    9   28 o    120.6    5.6    0.0000   0.0000          ?        ?   145.5829  13.4090          ?        ?      120.6        5.6       ?       ? 
1 1 1   40    9   29 f     84.8    8.3    0.0000   0.0000          ?        ?    72.1529  14.0475          ?        ?       84.8        8.3       ?       ? 
1 1 1   40    9   30 o    197.5    3.6    0.0000   0.0000          ?        ?   390.1367  14.0475          ?        ?      197.5        3.6       ?       ? 
1 1 1   40    9   31 o    597.3    2.6    0.0000   0.0000          ?        ?  3568.6975  31.2876          ?        ?      597.3        2.6       ?       ? 
1 1 1   40    9   32 o    192.9    4.0    0.0000   0.0000          ?        ?   372.2581  15.3245          ?        ?      192.9        4.0       ?       ? 
1 1 1   40    9   33 o    414.8    2.6    0.0000   0.0000          ?        ?  1720.8158  21.7097          ?        ?      414.8        2.6       ?       ? 
1 1 1   40    9   34 o    644.6    2.8    0.0000   0.0000          ?        ?  4156.7759  35.7572          ?        ?      644.6        2.8       ?       ? 
1 1 1   40    9   35 o    357.7    2.6    0.0000   0.0000          ?        ?  1279.5973  18.5171          ?        ?      357.7        2.6       ?       ? 
1 1 1   40    9   36 o    499.0    2.7    0.0000   0.0000          ?        ?  2490.8728  26.8179          ?        ?      499.0        2.7       ?       ? 
1 1 1   40    9   37 o    226.8    3.7    0.0000   0.0000          ?        ?   514.6484  16.6016          ?        ?      226.8        3.7       ?       ? 
1 1 1   40    9   38 o    156.3    5.1    0.0000   0.0000          ?        ?   244.5538  15.9630          ?        ?      156.3        5.1       ?       ? 
1 1 1   40    9   39 o    168.8    4.7    0.0000   0.0000          ?        ?   285.4192  15.9630          ?        ?      168.8        4.7       ?       ? 
1 1 1   40    9   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    9   41 o    220.0    3.9    0.0000   0.0000          ?        ?   484.6379  17.2401          ?        ?      220.0        3.9       ?       ? 
1 1 1   40    9   42 o    181.6    4.6    0.0000   0.0000          ?        ?   330.1157  16.6016          ?        ?      181.6        4.6       ?       ? 
1 1 1   40    9   43 o    275.2    3.2    0.0000   0.0000          ?        ?   757.9252  17.8786          ?        ?      275.2        3.2       ?       ? 
1 1 1   40    9   44 o    144.8    6.0    0.0000   0.0000          ?        ?   210.0736  17.2401          ?        ?      144.8        6.0       ?       ? 
1 1 1   40    9   45 o    287.9    3.2    0.0000   0.0000          ?        ?   829.4396  18.5171          ?        ?      287.9        3.2       ?       ? 
1 1 1   40    9   46 o     24.5   11.8    0.0000   0.0000          ?        ?   -29.3720  17.8786          ?        ?       24.5       11.8       ?       ? 
1 1 1   40    9   47 o    419.3    2.8    0.0000   0.0000          ?        ?  1759.1271  23.6253          ?        ?      419.3        2.8       ?       ? 
1 1 1   40    9   48 o    310.0    3.1    0.0000   0.0000          ?        ?   961.6136  19.1556          ?        ?      310.0        3.1       ?       ? 
1 1 1   40    9   49 o    137.5    6.5    0.0000   0.0000          ?        ?   189.6409  17.8786          ?        ?      137.5        6.5       ?       ? 
1 1 1   40    9   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    9   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40    9   52 o    177.7    5.2    0.0000   0.0000          ?        ?   316.7067  18.5171          ?        ?      177.7        5.2       ?       ? 
1 1 1   40    9   53 o     23.6   11.6    0.0000   0.0000          ?        ?   -36.3957  18.5171          ?        ?       23.6       11.6       ?       ? 
1 1 1   40    9   54 o    171.4    5.6    0.0000   0.0000          ?        ?   294.9970  19.1556          ?        ?      171.4        5.6       ?       ? 
1 1 1   40    9   55 o     23.8   11.6    0.0000   0.0000          ?        ?   -31.9261  17.8786          ?        ?       23.8       11.6       ?       ? 
1 1 1   40    9   56 o     82.3   11.2    0.0000   0.0000          ?        ?    68.9603  18.5171          ?        ?       82.3       11.2       ?       ? 
1 1 1   40    9   57 o     22.2   11.0    0.0000   0.0000          ?        ?   -43.4195  18.5171          ?        ?       22.2       11.0       ?       ? 
1 1 1   40    9   58 o     70.5   14.1    0.0000   0.0000          ?        ?    52.9973  19.1556          ?        ?       70.5       14.1       ?       ? 
1 1 1   40    9   59 o    157.3    6.1    0.0000   0.0000          ?        ?   249.0234  19.1556          ?        ?      157.3        6.1       ?       ? 
1 1 1   40    9   60 o    312.4    3.4    0.0000   0.0000          ?        ?   978.2151  21.0712          ?        ?      312.4        3.4       ?       ? 
1 1 1   40   10    0 o    206.2    3.9  425.8939  15.9630   425.8939  15.9630   425.8939  15.9630      206.2      3.9      206.2        3.9     0.0     0.0 
1 1 1   40   10    1 o    514.6    2.5    0.0000   0.0000          ?        ?  2648.5876  26.1794          ?        ?      514.6        2.5       ?       ? 
1 1 1   40   10    2 o    124.8    4.1    0.0000   0.0000          ?        ?   155.7993  10.2163          ?        ?      124.8        4.1       ?       ? 
1 1 1   40   10    3 o    892.2    3.4    0.0000   0.0000          ?        ?  7961.7261  61.2981          ?        ?      892.2        3.4       ?       ? 
1 1 1   40   10    4 o    636.6    2.9    0.0000   0.0000          ?        ?  4053.9739  37.0343          ?        ?      636.6        2.9       ?       ? 
1 1 1   40   10    5 o    327.4    2.4    0.0000   0.0000          ?        ?  1072.0778  15.9630          ?        ?      327.4        2.4       ?       ? 
1 1 1   40   10    6 o    297.6    2.4    0.0000   0.0000          ?        ?   885.6295  14.0475          ?        ?      297.6        2.4       ?       ? 
1 1 1   40   10    7 o    195.6    2.9    0.0000   0.0000          ?        ?   382.4745  11.4934          ?        ?      195.6        2.9       ?       ? 
1 1 1   40   10    8 o    303.5    2.5    0.0000   0.0000          ?        ?   921.3867  15.3245          ?        ?      303.5        2.5       ?       ? 
1 1 1   40   10    9 o    292.5    2.4    0.0000   0.0000          ?        ?   855.6190  14.0475          ?        ?      292.5        2.4       ?       ? 
1 1 1   40   10   10 o    363.4    2.3    0.0000   0.0000          ?        ?  1320.4628  16.6016          ?        ?      363.4        2.3       ?       ? 
1 1 1   40   10   11 o     24.5   10.9    0.0000   0.0000          ?        ?    -4.4697  10.8549          ?        ?       24.5       10.9       ?       ? 
1 1 1   40   10   12 f    428.6    2.3    0.0000   0.0000          ?        ?  1837.0269  19.7942          ?        ?      428.6        2.3       ?       ? 
1 1 1   40   10   13 o    385.9    2.3    0.0000   0.0000          ?        ?  1489.0325  17.8786          ?        ?      385.9        2.3       ?       ? 
1 1 1   40   10   14 f    215.6    3.0    0.0000   0.0000          ?        ?   464.8438  12.7704          ?        ?      215.6        3.0       ?       ? 
1 1 1   40   10   15 o    153.9    3.9    0.0000   0.0000          ?        ?   236.8915  12.1319          ?        ?      153.9        3.9       ?       ? 
1 1 1   40   10   16 f    417.0    2.4    0.0000   0.0000          ?        ?  1739.3329  19.7942          ?        ?      417.0        2.4       ?       ? 
1 1 1   40   10   17 o    171.5    3.5    0.0000   0.0000          ?        ?   294.3585  12.1319          ?        ?      171.5        3.5       ?       ? 
1 1 1   40   10   18 o    160.2    4.0    0.0000   0.0000          ?        ?   256.6857  12.7704          ?        ?      160.2        4.0       ?       ? 
1 1 1   40   10   19 o     62.3    9.7    0.0000   0.0000          ?        ?    38.9498  12.1319          ?        ?       62.3        9.7       ?       ? 
1 1 1   40   10   20 o     23.8   11.0    0.0000   0.0000          ?        ?    -9.5778  12.1319          ?        ?       23.8       11.0       ?       ? 
1 1 1   40   10   21 o    477.9    2.4    0.0000   0.0000          ?        ?  2284.6304  22.9868          ?        ?      477.9        2.4       ?       ? 
1 1 1   40   10   22 o    421.5    2.3    0.0000   0.0000          ?        ?  1777.0056  19.7942          ?        ?      421.5        2.3       ?       ? 
1 1 1   40   10   23 o    103.8    5.8    0.0000   0.0000          ?        ?   107.9102  12.1319          ?        ?      103.8        5.8       ?       ? 
1 1 1   40   10   24 o     93.8    6.8    0.0000   0.0000          ?        ?    88.1160  12.7704          ?        ?       93.8        6.8       ?       ? 
1 1 1   40   10   25 o    115.7    5.8    0.0000   0.0000          ?        ?   134.0895  13.4090          ?        ?      115.7        5.8       ?       ? 
1 1 1   40   10   26 o    411.5    2.4    0.0000   0.0000          ?        ?  1693.9978  19.7942          ?        ?      411.5        2.4       ?       ? 
1 1 1   40   10   27 o    556.0    2.6    0.0000   0.0000          ?        ?  3092.3601  28.7335          ?        ?      556.0        2.6       ?       ? 
1 1 1   40   10   28 o    157.1    4.3    0.0000   0.0000          ?        ?   247.1079  13.4090          ?        ?      157.1        4.3       ?       ? 
1 1 1   40   10   29 o    281.7    2.8    0.0000   0.0000          ?        ?   793.6824  15.9630          ?        ?      281.7        2.8       ?       ? 
1 1 1   40   10   30 o    355.0    2.6    0.0000   0.0000          ?        ?  1260.4417  18.5171          ?        ?      355.0        2.6       ?       ? 
1 1 1   40   10   31 o    198.6    3.7    0.0000   0.0000          ?        ?   394.6064  14.6860          ?        ?      198.6        3.7       ?       ? 
1 1 1   40   10   32 o    485.2    2.5    0.0000   0.0000          ?        ?  2354.8677  24.2638          ?        ?      485.2        2.5       ?       ? 
1 1 1   40   10   33 f    199.5    3.7    0.0000   0.0000          ?        ?   398.4375  14.6860          ?        ?      199.5        3.7       ?       ? 
1 1 1   40   10   34 o    189.5    4.2    0.0000   0.0000          ?        ?   359.4877  15.9630          ?        ?      189.5        4.2       ?       ? 
1 1 1   40   10   35 o    302.6    3.0    0.0000   0.0000          ?        ?   916.2786  17.8786          ?        ?      302.6        3.0       ?       ? 
1 1 1   40   10   36 o    296.1    3.0    0.0000   0.0000          ?        ?   877.3287  17.8786          ?        ?      296.1        3.0       ?       ? 
1 1 1   40   10   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   10   38 o    165.4    4.8    0.0000   0.0000          ?        ?   273.9258  15.9630          ?        ?      165.4        4.8       ?       ? 
1 1 1   40   10   39 o    149.6    5.3    0.0000   0.0000          ?        ?   224.1211  15.9630          ?        ?      149.6        5.3       ?       ? 
1 1 1   40   10   40 o    213.6    3.9    0.0000   0.0000          ?        ?   456.5430  16.6016          ?        ?      213.6        3.9       ?       ? 
1 1 1   40   10   41 o    200.0    4.2    0.0000   0.0000          ?        ?   400.3531  16.6016          ?        ?      200.0        4.2       ?       ? 
1 1 1   40   10   42 o    103.4    7.7    0.0000   0.0000          ?        ?   107.2716  15.9630          ?        ?      103.4        7.7       ?       ? 
1 1 1   40   10   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   10   44 o    320.5    3.0    0.0000   0.0000          ?        ?  1028.0198  19.1556          ?        ?      320.5        3.0       ?       ? 
1 1 1   40   10   45 o     18.2    9.2    0.0000   0.0000          ?        ?   -57.4669  16.6016          ?        ?       18.2        9.2       ?       ? 
1 1 1   40   10   46 o    387.8    2.8    0.0000   0.0000          ?        ?  1504.9955  21.7097          ?        ?      387.8        2.8       ?       ? 
1 1 1   40   10   47 o    175.6    5.1    0.0000   0.0000          ?        ?   309.0445  17.8786          ?        ?      175.6        5.1       ?       ? 
1 1 1   40   10   48 o    290.9    3.5    0.0000   0.0000          ?        ?   847.3182  20.4327          ?        ?      290.9        3.5       ?       ? 
1 1 1   40   10   49 o    364.7    2.9    0.0000   0.0000          ?        ?  1331.3176  21.0712          ?        ?      364.7        2.9       ?       ? 
1 1 1   40   10   50 o    233.2    4.1    0.0000   0.0000          ?        ?   544.6590  19.1556          ?        ?      233.2        4.1       ?       ? 
1 1 1   40   10   51 o    166.4    5.6    0.0000   0.0000          ?        ?   277.7569  18.5171          ?        ?      166.4        5.6       ?       ? 
1 1 1   40   10   52 o    176.1    5.3    0.0000   0.0000          ?        ?   310.9600  18.5171          ?        ?      176.1        5.3       ?       ? 
1 1 1   40   10   53 f    230.5    4.3    0.0000   0.0000          ?        ?   532.5270  19.7942          ?        ?      230.5        4.3       ?       ? 
1 1 1   40   10   54 o    181.2    4.9    0.0000   0.0000          ?        ?   329.4771  17.8786          ?        ?      181.2        4.9       ?       ? 
1 1 1   40   10   55 o     65.6   14.5    0.0000   0.0000          ?        ?    45.9736  18.5171          ?        ?       65.6       14.5       ?       ? 
1 1 1   40   10   56 o    123.8    7.5    0.0000   0.0000          ?        ?   154.5222  18.5171          ?        ?      123.8        7.5       ?       ? 
1 1 1   40   10   57 o    177.4    5.4    0.0000   0.0000          ?        ?   316.0682  19.1556          ?        ?      177.4        5.4       ?       ? 
1 1 1   40   10   58 o     82.1   11.3    0.0000   0.0000          ?        ?    68.9603  18.5171          ?        ?       82.1       11.3       ?       ? 
1 1 1   40   10   59 o     98.0    9.4    0.0000   0.0000          ?        ?    97.6938  18.5171          ?        ?       98.0        9.4       ?       ? 
1 1 1   40   10   60 o     87.9   10.9    0.0000   0.0000          ?        ?    79.1767  19.1556          ?        ?       87.9       10.9       ?       ? 
1 1 1   40   11    0 o    307.8    3.6  948.2046  22.3483   948.2046  22.3483   948.2046  22.3483      307.8      3.6      307.8        3.6     0.0     0.0 
1 1 1   40   11    1 o    409.2    2.4    0.0000   0.0000          ?        ?  1674.8422  19.7942          ?        ?      409.2        2.4       ?       ? 
1 1 1   40   11    2 o    720.1    3.0    0.0000   0.0000          ?        ?  5186.7109  43.4195          ?        ?      720.1        3.0       ?       ? 
1 1 1   40   11    3 o    387.3    2.4    0.0000   0.0000          ?        ?  1499.8872  18.5171          ?        ?      387.3        2.4       ?       ? 
1 1 1   40   11    4 o    739.5    3.0    0.0000   0.0000          ?        ?  5470.2148  44.6965          ?        ?      739.5        3.0       ?       ? 
1 1 1   40   11    5 o    138.8    3.7    0.0000   0.0000          ?        ?   192.8335  10.2163          ?        ?      138.8        3.7       ?       ? 
1 1 1   40   11    6 o    227.0    2.7    0.0000   0.0000          ?        ?   515.2869  12.1319          ?        ?      227.0        2.7       ?       ? 
1 1 1   40   11    7 o    504.1    2.5    0.0000   0.0000          ?        ?  2541.9546  24.9023          ?        ?      504.1        2.5       ?       ? 
1 1 1   40   11    8 o    259.8    2.6    0.0000   0.0000          ?        ?   674.9174  13.4090          ?        ?      259.8        2.6       ?       ? 
1 1 1   40   11    9 o    445.4    2.4    0.0000   0.0000          ?        ?  1984.5251  21.7097          ?        ?      445.4        2.4       ?       ? 
1 1 1   40   11   10 o    262.5    2.4    0.0000   0.0000          ?        ?   688.9648  12.7704          ?        ?      262.5        2.4       ?       ? 
1 1 1   40   11   11 o    410.9    2.5    0.0000   0.0000          ?        ?  1688.8896  20.4327          ?        ?      410.9        2.5       ?       ? 
1 1 1   40   11   12 o    180.1    3.2    0.0000   0.0000          ?        ?   324.3690  11.4934          ?        ?      180.1        3.2       ?       ? 
1 1 1   40   11   13 o    204.3    3.0    0.0000   0.0000          ?        ?   417.5931  12.1319          ?        ?      204.3        3.0       ?       ? 
1 1 1   40   11   14 o    127.3    4.3    0.0000   0.0000          ?        ?   162.1845  10.8549          ?        ?      127.3        4.3       ?       ? 
1 1 1   40   11   15 o    224.1    2.8    0.0000   0.0000          ?        ?   502.5165  12.7704          ?        ?      224.1        2.8       ?       ? 
1 1 1   40   11   16 o    185.1    3.3    0.0000   0.0000          ?        ?   342.8861  12.1319          ?        ?      185.1        3.3       ?       ? 
1 1 1   40   11   17 o    265.1    2.6    0.0000   0.0000          ?        ?   703.0123  14.0475          ?        ?      265.1        2.6       ?       ? 
1 1 1   40   11   18 o    668.5    2.8    0.0000   0.0000          ?        ?  4469.6514  37.6728          ?        ?      668.5        2.8       ?       ? 
1 1 1   40   11   19 o    270.6    2.7    0.0000   0.0000          ?        ?   732.3843  14.6860          ?        ?      270.6        2.7       ?       ? 
1 1 1   40   11   20 o    554.7    2.6    0.0000   0.0000          ?        ?  3077.6743  28.7335          ?        ?      554.7        2.6       ?       ? 
1 1 1   40   11   21 o    464.8    2.4    0.0000   0.0000          ?        ?  2160.7571  22.3483          ?        ?      464.8        2.4       ?       ? 
1 1 1   40   11   22 o    341.8    2.4    0.0000   0.0000          ?        ?  1168.4946  16.6016          ?        ?      341.8        2.4       ?       ? 
1 1 1   40   11   23 o    325.6    2.5    0.0000   0.0000          ?        ?  1060.5845  15.9630          ?        ?      325.6        2.5       ?       ? 
1 1 1   40   11   24 o    153.2    4.6    0.0000   0.0000          ?        ?   234.9760  14.0475          ?        ?      153.2        4.6       ?       ? 
1 1 1   40   11   25 o    197.0    3.6    0.0000   0.0000          ?        ?   388.2211  14.0475          ?        ?      197.0        3.6       ?       ? 
1 1 1   40   11   26 o    297.4    2.7    0.0000   0.0000          ?        ?   884.9910  15.9630          ?        ?      297.4        2.7       ?       ? 
1 1 1   40   11   27 o    428.3    2.5    0.0000   0.0000          ?        ?  1835.1111  21.7097          ?        ?      428.3        2.5       ?       ? 
1 1 1   40   11   28 o    376.7    2.5    0.0000   0.0000          ?        ?  1419.4336  18.5171          ?        ?      376.7        2.5       ?       ? 
1 1 1   40   11   29 o    382.9    2.6    0.0000   0.0000          ?        ?  1466.6842  19.7942          ?        ?      382.9        2.6       ?       ? 
1 1 1   40   11   30 o    321.0    2.6    0.0000   0.0000          ?        ?  1030.5739  16.6016          ?        ?      321.0        2.6       ?       ? 
1 1 1   40   11   31 o     35.7   13.6    0.0000   0.0000          ?        ?     8.9393  13.4090          ?        ?       35.7       13.6       ?       ? 
1 1 1   40   11   32 o     17.1    8.7    0.0000   0.0000          ?        ?   -56.1899  15.3245          ?        ?       17.1        8.7       ?       ? 
1 1 1   40   11   33 o    180.0    4.1    0.0000   0.0000          ?        ?   324.3690  14.6860          ?        ?      180.0        4.1       ?       ? 
1 1 1   40   11   34 o    124.5    5.9    0.0000   0.0000          ?        ?   155.1608  14.6860          ?        ?      124.5        5.9       ?       ? 
1 1 1   40   11   35 o    393.4    2.5    0.0000   0.0000          ?        ?  1548.4149  19.7942          ?        ?      393.4        2.5       ?       ? 
1 1 1   40   11   36 o    198.1    4.0    0.0000   0.0000          ?        ?   392.6908  15.9630          ?        ?      198.1        4.0       ?       ? 
1 1 1   40   11   37 o    265.9    3.2    0.0000   0.0000          ?        ?   707.4820  17.2401          ?        ?      265.9        3.2       ?       ? 
1 1 1   40   11   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   11   39 o    462.1    2.6    0.0000   0.0000          ?        ?  2136.4934  24.2638          ?        ?      462.1        2.6       ?       ? 
1 1 1   40   11   40 o    142.4    5.6    0.0000   0.0000          ?        ?   203.0499  15.9630          ?        ?      142.4        5.6       ?       ? 
1 1 1   40   11   41 o    351.1    2.8    0.0000   0.0000          ?        ?  1233.6238  19.7942          ?        ?      351.1        2.8       ?       ? 
1 1 1   40   11   42 f    244.4    3.5    0.0000   0.0000          ?        ?   597.6562  17.2401          ?        ?      244.4        3.5       ?       ? 
1 1 1   40   11   43 o    156.4    5.5    0.0000   0.0000          ?        ?   245.1923  17.2401          ?        ?      156.4        5.5       ?       ? 
1 1 1   40   11   44 o    492.6    2.6    0.0000   0.0000          ?        ?  2427.6594  25.5409          ?        ?      492.6        2.6       ?       ? 
1 1 1   40   11   45 o    107.5    8.0    0.0000   0.0000          ?        ?   116.2109  17.2401          ?        ?      107.5        8.0       ?       ? 
1 1 1   40   11   46 o    397.2    2.8    0.0000   0.0000          ?        ?  1579.0640  22.3483          ?        ?      397.2        2.8       ?       ? 
1 1 1   40   11   47 o     25.0   12.0    0.0000   0.0000          ?        ?   -24.2638  17.2401          ?        ?       25.0       12.0       ?       ? 
1 1 1   40   11   48 o    249.2    3.8    0.0000   0.0000          ?        ?   621.9200  19.1556          ?        ?      249.2        3.8       ?       ? 
1 1 1   40   11   49 o    219.8    4.4    0.0000   0.0000          ?        ?   483.9994  19.1556          ?        ?      219.8        4.4       ?       ? 
1 1 1   40   11   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   11   51 o    245.3    4.0    0.0000   0.0000          ?        ?   602.7644  19.7942          ?        ?      245.3        4.0       ?       ? 
1 1 1   40   11   52 o    202.8    4.6    0.0000   0.0000          ?        ?   412.4850  18.5171          ?        ?      202.8        4.6       ?       ? 
1 1 1   40   11   53 o    135.0    6.9    0.0000   0.0000          ?        ?   183.2557  18.5171          ?        ?      135.0        6.9       ?       ? 
1 1 1   40   11   54 o     24.9   12.0    0.0000   0.0000          ?        ?   -30.0105  18.5171          ?        ?       24.9       12.0       ?       ? 
1 1 1   40   11   55 o    132.2    7.2    0.0000   0.0000          ?        ?   176.2320  19.1556          ?        ?      132.2        7.2       ?       ? 
1 1 1   40   11   56 o     43.1   15.8    0.0000   0.0000          ?        ?    15.9630  17.8786          ?        ?       43.1       15.8       ?       ? 
1 1 1   40   11   57 o     50.1   16.5    0.0000   0.0000          ?        ?    25.5409  19.1556          ?        ?       50.1       16.5       ?       ? 
1 1 1   40   11   58 o     54.6   16.0    0.0000   0.0000          ?        ?    31.9261  18.5171          ?        ?       54.6       16.0       ?       ? 
1 1 1   40   11   59 o    115.9    7.7    0.0000   0.0000          ?        ?   136.0051  17.8786          ?        ?      115.9        7.7       ?       ? 
1 1 1   40   12    0 o     98.2    6.2   97.6938  12.1319    97.6938  12.1319    97.6938  12.1319       98.2      6.2       98.2        6.2     0.0     0.0 
1 1 1   40   12    1 o    388.8    2.3    0.0000   0.0000          ?        ?  1512.0193  17.8786          ?        ?      388.8        2.3       ?       ? 
1 1 1   40   12    2 o    578.2    2.5    0.0000   0.0000          ?        ?  3343.2991  29.3720          ?        ?      578.2        2.5       ?       ? 
1 1 1   40   12    3 o    254.8    2.4    0.0000   0.0000          ?        ?   649.3765  12.1319          ?        ?      254.8        2.4       ?       ? 
1 1 1   40   12    4 o    626.7    2.7    0.0000   0.0000          ?        ?  3928.1851  33.8416          ?        ?      626.7        2.7       ?       ? 
1 1 1   40   12    5 o     46.3    9.9    0.0000   0.0000          ?        ?    22.3483   8.9393          ?        ?       46.3        9.9       ?       ? 
1 1 1   40   12    6 o    257.8    2.5    0.0000   0.0000          ?        ?   664.7010  12.7704          ?        ?      257.8        2.5       ?       ? 
1 1 1   40   12    7 o    119.0    4.0    0.0000   0.0000          ?        ?   141.7518   9.5778          ?        ?      119.0        4.0       ?       ? 
1 1 1   40   12    8 o    147.5    3.2    0.0000   0.0000          ?        ?   217.7359   9.5778          ?        ?      147.5        3.2       ?       ? 
1 1 1   40   12    9 o    127.3    4.0    0.0000   0.0000          ?        ?   162.1845  10.2163          ?        ?      127.3        4.0       ?       ? 
1 1 1   40   12   10 o    140.0    3.6    0.0000   0.0000          ?        ?   196.0261  10.2163          ?        ?      140.0        3.6       ?       ? 
1 1 1   40   12   11 o    224.1    2.7    0.0000   0.0000          ?        ?   502.5165  12.1319          ?        ?      224.1        2.7       ?       ? 
1 1 1   40   12   12 o    265.2    2.6    0.0000   0.0000          ?        ?   703.6508  14.0475          ?        ?      265.2        2.6       ?       ? 
1 1 1   40   12   13 o    275.5    2.7    0.0000   0.0000          ?        ?   759.2022  14.6860          ?        ?      275.5        2.7       ?       ? 
1 1 1   40   12   14 o    272.0    2.6    0.0000   0.0000          ?        ?   740.0466  14.0475          ?        ?      272.0        2.6       ?       ? 
1 1 1   40   12   15 o    163.1    3.5    0.0000   0.0000          ?        ?   266.2635  11.4934          ?        ?      163.1        3.5       ?       ? 
1 1 1   40   12   16 o    381.9    2.3    0.0000   0.0000          ?        ?  1459.0220  17.8786          ?        ?      381.9        2.3       ?       ? 
1 1 1   40   12   17 o    101.0    5.7    0.0000   0.0000          ?        ?   102.1635  11.4934          ?        ?      101.0        5.7       ?       ? 
1 1 1   40   12   18 o    407.6    2.4    0.0000   0.0000          ?        ?  1662.0717  19.7942          ?        ?      407.6        2.4       ?       ? 
1 1 1   40   12   19 o    209.3    3.2    0.0000   0.0000          ?        ?   438.0258  13.4090          ?        ?      209.3        3.2       ?       ? 
1 1 1   40   12   20 o    190.7    3.3    0.0000   0.0000          ?        ?   363.9573  12.7704          ?        ?      190.7        3.3       ?       ? 
1 1 1   40   12   21 o    585.4    2.7    0.0000   0.0000          ?        ?  3427.5840  31.2876          ?        ?      585.4        2.7       ?       ? 
1 1 1   40   12   22 o    719.1    2.9    0.0000   0.0000          ?        ?  5172.0254  42.1424          ?        ?      719.1        2.9       ?       ? 
1 1 1   40   12   23 o    567.4    2.6    0.0000   0.0000          ?        ?  3220.0645  30.0105          ?        ?      567.4        2.6       ?       ? 
1 1 1   40   12   24 o    144.0    4.4    0.0000   0.0000          ?        ?   207.5195  12.7704          ?        ?      144.0        4.4       ?       ? 
1 1 1   40   12   25 o    329.2    2.5    0.0000   0.0000          ?        ?  1084.2097  16.6016          ?        ?      329.2        2.5       ?       ? 
1 1 1   40   12   26 o    194.5    3.6    0.0000   0.0000          ?        ?   378.6433  14.0475          ?        ?      194.5        3.6       ?       ? 
1 1 1   40   12   27 o    573.1    2.6    0.0000   0.0000          ?        ?  3285.8320  29.3720          ?        ?      573.1        2.6       ?       ? 
1 1 1   40   12   28 o    301.3    2.8    0.0000   0.0000          ?        ?   907.9777  16.6016          ?        ?      301.3        2.8       ?       ? 
1 1 1   40   12   29 o    181.5    3.9    0.0000   0.0000          ?        ?   329.4771  14.0475          ?        ?      181.5        3.9       ?       ? 
1 1 1   40   12   30 o    172.2    4.4    0.0000   0.0000          ?        ?   296.9126  15.3245          ?        ?      172.2        4.4       ?       ? 
1 1 1   40   12   31 o    266.2    3.0    0.0000   0.0000          ?        ?   708.7590  15.9630          ?        ?      266.2        3.0       ?       ? 
1 1 1   40   12   32 o    678.1    2.8    0.0000   0.0000          ?        ?  4599.9102  38.3113          ?        ?      678.1        2.8       ?       ? 
1 1 1   40   12   33 o     24.2   11.3    0.0000   0.0000          ?        ?   -12.7704  13.4090          ?        ?       24.2       11.3       ?       ? 
1 1 1   40   12   34 o    162.9    4.7    0.0000   0.0000          ?        ?   265.6250  15.3245          ?        ?      162.9        4.7       ?       ? 
1 1 1   40   12   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   12   36 o    247.9    3.3    0.0000   0.0000          ?        ?   614.8964  16.6016          ?        ?      247.9        3.3       ?       ? 
1 1 1   40   12   37 o    336.8    2.8    0.0000   0.0000          ?        ?  1134.6530  19.1556          ?        ?      336.8        2.8       ?       ? 
1 1 1   40   12   38 o    166.7    4.6    0.0000   0.0000          ?        ?   278.3954  15.3245          ?        ?      166.7        4.6       ?       ? 
1 1 1   40   12   39 o    285.7    3.0    0.0000   0.0000          ?        ?   816.6692  17.2401          ?        ?      285.7        3.0       ?       ? 
1 1 1   40   12   40 o     77.2   10.3    0.0000   0.0000          ?        ?    60.0210  15.9630          ?        ?       77.2       10.3       ?       ? 
1 1 1   40   12   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   12   42 o    178.7    4.6    0.0000   0.0000          ?        ?   319.8993  16.6016          ?        ?      178.7        4.6       ?       ? 
1 1 1   40   12   43 o    131.8    6.3    0.0000   0.0000          ?        ?   174.3164  16.6016          ?        ?      131.8        6.3       ?       ? 
1 1 1   40   12   44 o     28.3   13.0    0.0000   0.0000          ?        ?   -11.4934  16.6016          ?        ?       28.3       13.0       ?       ? 
1 1 1   40   12   45 o    101.7    8.5    0.0000   0.0000          ?        ?   104.0790  17.2401          ?        ?      101.7        8.5       ?       ? 
1 1 1   40   12   46 o    156.0    5.3    0.0000   0.0000          ?        ?   243.9153  16.6016          ?        ?      156.0        5.3       ?       ? 
1 1 1   40   12   47 f     80.7   10.7    0.0000   0.0000          ?        ?    65.7677  17.2401          ?        ?       80.7       10.7       ?       ? 
1 1 1   40   12   48 o    162.9    5.9    0.0000   0.0000          ?        ?   266.2635  19.1556          ?        ?      162.9        5.9       ?       ? 
1 1 1   40   12   49 o     96.8    9.6    0.0000   0.0000          ?        ?    94.5012  18.5171          ?        ?       96.8        9.6       ?       ? 
1 1 1   40   12   50 o    201.1    4.8    0.0000   0.0000          ?        ?   405.4612  19.1556          ?        ?      201.1        4.8       ?       ? 
1 1 1   40   12   51 o    152.5    6.1    0.0000   0.0000          ?        ?   233.6989  18.5171          ?        ?      152.5        6.1       ?       ? 
1 1 1   40   12   52 o     24.8   12.1    0.0000   0.0000          ?        ?   -33.2031  19.1556          ?        ?       24.8       12.1       ?       ? 
1 1 1   40   12   53 o    116.6    8.2    0.0000   0.0000          ?        ?   137.2822  19.1556          ?        ?      116.6        8.2       ?       ? 
1 1 1   40   12   54 o     55.8   15.5    0.0000   0.0000          ?        ?    33.2031  17.8786          ?        ?       55.8       15.5       ?       ? 
1 1 1   40   12   55 o     87.8   10.5    0.0000   0.0000          ?        ?    78.5382  18.5171          ?        ?       87.8       10.5       ?       ? 
1 1 1   40   12   56 o    112.0    8.6    0.0000   0.0000          ?        ?   127.0658  19.1556          ?        ?      112.0        8.6       ?       ? 
1 1 1   40   12   57 o    152.6    5.9    0.0000   0.0000          ?        ?   234.3374  17.8786          ?        ?      152.6        5.9       ?       ? 
1 1 1   40   12   58 o     31.1   14.0    0.0000   0.0000          ?        ?    -8.3008  18.5171          ?        ?       31.1       14.0       ?       ? 
1 1 1   40   13    0 o    336.9    6.4 1137.2070  43.4195  1137.2070  43.4195  1137.2070  43.4195      336.9      6.4      336.9        6.4     0.0     0.0 
1 1 1   40   13    1 o    937.2    3.6    0.0000   0.0000          ?        ?  8786.0576  68.3218          ?        ?      937.2        3.6       ?       ? 
1 1 1   40   13    2 o    653.5    2.9    0.0000   0.0000          ?        ?  4271.7095  38.3113          ?        ?      653.5        2.9       ?       ? 
1 1 1   40   13    3 o    246.5    2.7    0.0000   0.0000          ?        ?   607.8726  13.4090          ?        ?      246.5        2.7       ?       ? 
1 1 1   40   13    4 o    372.0    2.5    0.0000   0.0000          ?        ?  1384.3149  18.5171          ?        ?      372.0        2.5       ?       ? 
1 1 1   40   13    5 o    702.7    3.0    0.0000   0.0000          ?        ?  4938.9648  42.1424          ?        ?      702.7        3.0       ?       ? 
1 1 1   40   13    6 o    272.0    2.5    0.0000   0.0000          ?        ?   740.0466  13.4090          ?        ?      272.0        2.5       ?       ? 
1 1 1   40   13    7 o    239.6    2.5    0.0000   0.0000          ?        ?   574.0309  12.1319          ?        ?      239.6        2.5       ?       ? 
1 1 1   40   13    8 o    128.1    3.7    0.0000   0.0000          ?        ?   164.1001   9.5778          ?        ?      128.1        3.7       ?       ? 
1 1 1   40   13    9 o    387.8    2.3    0.0000   0.0000          ?        ?  1504.3569  17.8786          ?        ?      387.8        2.3       ?       ? 
1 1 1   40   13   10 o    419.9    2.4    0.0000   0.0000          ?        ?  1763.5968  19.7942          ?        ?      419.9        2.4       ?       ? 
1 1 1   40   13   11 o    504.4    2.5    0.0000   0.0000          ?        ?  2545.1472  25.5409          ?        ?      504.4        2.5       ?       ? 
1 1 1   40   13   12 o    496.5    2.4    0.0000   0.0000          ?        ?  2465.9707  24.2638          ?        ?      496.5        2.4       ?       ? 
1 1 1   40   13   13 o    238.5    2.5    0.0000   0.0000          ?        ?   568.9227  12.1319          ?        ?      238.5        2.5       ?       ? 
1 1 1   40   13   14 o    157.0    3.5    0.0000   0.0000          ?        ?   246.4693  10.8549          ?        ?      157.0        3.5       ?       ? 
1 1 1   40   13   15 o    467.4    2.6    0.0000   0.0000          ?        ?  2185.0210  24.2638          ?        ?      467.4        2.6       ?       ? 
1 1 1   40   13   16 o     26.3   11.3    0.0000   0.0000          ?        ?    -1.2770  10.8549          ?        ?       26.3       11.3       ?       ? 
1 1 1   40   13   17 o    209.3    3.1    0.0000   0.0000          ?        ?   438.0258  12.7704          ?        ?      209.3        3.1       ?       ? 
1 1 1   40   13   18 f    222.4    2.9    0.0000   0.0000          ?        ?   494.8542  12.7704          ?        ?      222.4        2.9       ?       ? 
1 1 1   40   13   19 o    361.5    2.6    0.0000   0.0000          ?        ?  1307.0537  19.1556          ?        ?      361.5        2.6       ?       ? 
1 1 1   40   13   20 o    413.5    2.5    0.0000   0.0000          ?        ?  1710.5994  20.4327          ?        ?      413.5        2.5       ?       ? 
1 1 1   40   13   21 o    320.0    2.7    0.0000   0.0000          ?        ?  1024.1886  17.2401          ?        ?      320.0        2.7       ?       ? 
1 1 1   40   13   22 o    353.2    2.5    0.0000   0.0000          ?        ?  1247.6713  17.8786          ?        ?      353.2        2.5       ?       ? 
1 1 1   40   13   23 o    303.4    2.5    0.0000   0.0000          ?        ?   920.7482  15.3245          ?        ?      303.4        2.5       ?       ? 
1 1 1   40   13   24 o    263.3    2.8    0.0000   0.0000          ?        ?   693.4344  14.6860          ?        ?      263.3        2.8       ?       ? 
1 1 1   40   13   25 f    464.4    2.5    0.0000   0.0000          ?        ?  2157.5645  23.6253          ?        ?      464.4        2.5       ?       ? 
1 1 1   40   13   26 o     64.3    9.9    0.0000   0.0000          ?        ?    41.5039  12.7704          ?        ?       64.3        9.9       ?       ? 
1 1 1   40   13   27 o    227.1    3.2    0.0000   0.0000          ?        ?   515.9255  14.6860          ?        ?      227.1        3.2       ?       ? 
1 1 1   40   13   28 o    613.2    2.8    0.0000   0.0000          ?        ?  3761.5308  33.8416          ?        ?      613.2        2.8       ?       ? 
1 1 1   40   13   29 o     93.4    7.2    0.0000   0.0000          ?        ?    87.4775  13.4090          ?        ?       93.4        7.2       ?       ? 
1 1 1   40   13   30 o    315.8    2.7    0.0000   0.0000          ?        ?   997.3708  17.2401          ?        ?      315.8        2.7       ?       ? 
1 1 1   40   13   31 o    466.1    2.6    0.0000   0.0000          ?        ?  2172.8889  24.2638          ?        ?      466.1        2.6       ?       ? 
1 1 1   40   13   32 o    230.1    3.3    0.0000   0.0000          ?        ?   529.9730  15.3245          ?        ?      230.1        3.3       ?       ? 
1 1 1   40   13   33 o     82.1    9.3    0.0000   0.0000          ?        ?    67.6833  15.3245          ?        ?       82.1        9.3       ?       ? 
1 1 1   40   13   34 o    427.4    2.6    0.0000   0.0000          ?        ?  1827.4490  22.3483          ?        ?      427.4        2.6       ?       ? 
1 1 1   40   13   35 o    143.9    5.3    0.0000   0.0000          ?        ?   207.5195  15.3245          ?        ?      143.9        5.3       ?       ? 
1 1 1   40   13   36 o    173.9    4.8    0.0000   0.0000          ?        ?   302.6593  16.6016          ?        ?      173.9        4.8       ?       ? 
1 1 1   40   13   37 o     18.2    9.2    0.0000   0.0000          ?        ?   -52.9973  15.9630          ?        ?       18.2        9.2       ?       ? 
1 1 1   40   13   38 o    311.0    3.0    0.0000   0.0000          ?        ?   967.9988  18.5171          ?        ?      311.0        3.0       ?       ? 
1 1 1   40   13   39 f    264.2    3.3    0.0000   0.0000          ?        ?   698.5427  17.2401          ?        ?      264.2        3.3       ?       ? 
1 1 1   40   13   40 f     17.8    9.0    0.0000   0.0000          ?        ?   -56.1899  15.9630          ?        ?       17.8        9.0       ?       ? 
1 1 1   40   13   41 o    227.2    3.7    0.0000   0.0000          ?        ?   516.5640  16.6016          ?        ?      227.2        3.7       ?       ? 
1 1 1   40   13   42 o    269.0    3.4    0.0000   0.0000          ?        ?   724.0836  18.5171          ?        ?      269.0        3.4       ?       ? 
1 1 1   40   13   43 o    471.4    2.6    0.0000   0.0000          ?        ?  2223.3323  24.2638          ?        ?      471.4        2.6       ?       ? 
1 1 1   40   13   44 o    166.9    5.0    0.0000   0.0000          ?        ?   279.0340  16.6016          ?        ?      166.9        5.0       ?       ? 
1 1 1   40   13   45 o    274.6    3.3    0.0000   0.0000          ?        ?   754.7325  17.8786          ?        ?      274.6        3.3       ?       ? 
1 1 1   40   13   46 o     38.9   15.0    0.0000   0.0000          ?        ?    10.2163  16.6016          ?        ?       38.9       15.0       ?       ? 
1 1 1   40   13   47 f    196.3    4.6    0.0000   0.0000          ?        ?   386.3056  17.8786          ?        ?      196.3        4.6       ?       ? 
1 1 1   40   13   48 o     26.6   12.5    0.0000   0.0000          ?        ?   -18.5171  17.2401          ?        ?       26.6       12.5       ?       ? 
1 1 1   40   13   49 o     95.1    9.7    0.0000   0.0000          ?        ?    91.3086  18.5171          ?        ?       95.1        9.7       ?       ? 
1 1 1   40   13   50 o    284.8    3.5    0.0000   0.0000          ?        ?   812.1995  19.7942          ?        ?      284.8        3.5       ?       ? 
1 1 1   40   13   51 f     18.9    9.5    0.0000   0.0000          ?        ?   -61.9366  17.8786          ?        ?       18.9        9.5       ?       ? 
1 1 1   40   13   52 o    233.8    4.1    0.0000   0.0000          ?        ?   547.8516  19.1556          ?        ?      233.8        4.1       ?       ? 
1 1 1   40   13   53 o    347.0    3.2    0.0000   0.0000          ?        ?  1206.1674  22.3483          ?        ?      347.0        3.2       ?       ? 
1 1 1   40   13   54 o     72.5   13.3    0.0000   0.0000          ?        ?    55.5514  18.5171          ?        ?       72.5       13.3       ?       ? 
1 1 1   40   13   55 o     56.7   16.1    0.0000   0.0000          ?        ?    34.4802  19.1556          ?        ?       56.7       16.1       ?       ? 
1 1 1   40   13   56 o    112.9    7.9    0.0000   0.0000          ?        ?   128.9814  17.8786          ?        ?      112.9        7.9       ?       ? 
1 1 1   40   13   57 o     75.1   12.3    0.0000   0.0000          ?        ?    58.1055  18.5171          ?        ?       75.1       12.3       ?       ? 
1 1 1   40   14    0 o    422.1    4.0 1782.7524  33.8416  1782.7524  33.8416  1782.7524  33.8416      422.1      4.0      422.1        4.0     0.0     0.0 
1 1 1   40   14    1 o    159.8    4.4    0.0000   0.0000          ?        ?   255.4086  14.0475          ?        ?      159.8        4.4       ?       ? 
1 1 1   40   14    2 o    242.7    3.2    0.0000   0.0000          ?        ?   589.3555  15.3245          ?        ?      242.7        3.2       ?       ? 
1 1 1   40   14    3 o     93.1    5.5    0.0000   0.0000          ?        ?    86.8389  10.2163          ?        ?       93.1        5.5       ?       ? 
1 1 1   40   14    4 f    464.9    2.5    0.0000   0.0000          ?        ?  2161.3958  23.6253          ?        ?      464.9        2.5       ?       ? 
1 1 1   40   14    5 o    142.5    3.6    0.0000   0.0000          ?        ?   203.0499  10.2163          ?        ?      142.5        3.6       ?       ? 
1 1 1   40   14    6 o    495.8    2.5    0.0000   0.0000          ?        ?  2458.9468  24.9023          ?        ?      495.8        2.5       ?       ? 
1 1 1   40   14    7 o    275.4    2.3    0.0000   0.0000          ?        ?   758.5637  12.7704          ?        ?      275.4        2.3       ?       ? 
1 1 1   40   14    8 o    251.4    2.7    0.0000   0.0000          ?        ?   632.1364  13.4090          ?        ?      251.4        2.7       ?       ? 
1 1 1   40   14    9 o     15.0    7.5    0.0000   0.0000          ?        ?   -27.4564   9.5778          ?        ?       15.0        7.5       ?       ? 
1 1 1   40   14   10 o     41.2   12.3    0.0000   0.0000          ?        ?    17.2401  10.8549          ?        ?       41.2       12.3       ?       ? 
1 1 1   40   14   11 o    134.6    4.3    0.0000   0.0000          ?        ?   181.3401  11.4934          ?        ?      134.6        4.3       ?       ? 
1 1 1   40   14   12 o    176.9    3.2    0.0000   0.0000          ?        ?   312.8756  11.4934          ?        ?      176.9        3.2       ?       ? 
1 1 1   40   14   13 o    446.2    2.4    0.0000   0.0000          ?        ?  1991.5490  21.0712          ?        ?      446.2        2.4       ?       ? 
1 1 1   40   14   14 o    252.5    2.8    0.0000   0.0000          ?        ?   637.8831  14.0475          ?        ?      252.5        2.8       ?       ? 
1 1 1   40   14   15 o    420.3    2.4    0.0000   0.0000          ?        ?  1766.7894  19.7942          ?        ?      420.3        2.4       ?       ? 
1 1 1   40   14   16 o    210.9    3.0    0.0000   0.0000          ?        ?   445.0496  12.7704          ?        ?      210.9        3.0       ?       ? 
1 1 1   40   14   17 o    476.4    2.5    0.0000   0.0000          ?        ?  2269.9443  24.2638          ?        ?      476.4        2.5       ?       ? 
1 1 1   40   14   18 f    323.5    2.4    0.0000   0.0000          ?        ?  1046.5369  15.3245          ?        ?      323.5        2.4       ?       ? 
1 1 1   40   14   19 o    328.3    2.6    0.0000   0.0000          ?        ?  1077.8246  17.2401          ?        ?      328.3        2.6       ?       ? 
1 1 1   40   14   20 o    146.2    4.1    0.0000   0.0000          ?        ?   213.9047  12.1319          ?        ?      146.2        4.1       ?       ? 
1 1 1   40   14   21 o    675.0    2.8    0.0000   0.0000          ?        ?  4557.1289  38.3113          ?        ?      675.0        2.8       ?       ? 
1 1 1   40   14   22 o    449.0    2.5    0.0000   0.0000          ?        ?  2016.4512  22.3483          ?        ?      449.0        2.5       ?       ? 
1 1 1   40   14   23 o     92.1    6.9    0.0000   0.0000          ?        ?    84.9234  12.7704          ?        ?       92.1        6.9       ?       ? 
1 1 1   40   14   24 o    659.5    2.8    0.0000   0.0000          ?        ?  4350.2476  36.3957          ?        ?      659.5        2.8       ?       ? 
1 1 1   40   14   25 o     94.5    6.8    0.0000   0.0000          ?        ?    89.3930  12.7704          ?        ?       94.5        6.8       ?       ? 
1 1 1   40   14   26 o    185.6    3.8    0.0000   0.0000          ?        ?   344.8017  14.0475          ?        ?      185.6        3.8       ?       ? 
1 1 1   40   14   27 o    168.9    4.0    0.0000   0.0000          ?        ?   285.4192  13.4090          ?        ?      168.9        4.0       ?       ? 
1 1 1   40   14   28 o    233.6    3.1    0.0000   0.0000          ?        ?   545.9360  14.6860          ?        ?      233.6        3.1       ?       ? 
1 1 1   40   14   29 o    627.7    2.7    0.0000   0.0000          ?        ?  3940.9556  33.8416          ?        ?      627.7        2.7       ?       ? 
1 1 1   40   14   30 o     85.9    8.2    0.0000   0.0000          ?        ?    74.0685  14.0475          ?        ?       85.9        8.2       ?       ? 
1 1 1   40   14   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   14   32 o    172.4    4.3    0.0000   0.0000          ?        ?   297.5511  14.6860          ?        ?      172.4        4.3       ?       ? 
1 1 1   40   14   33 o    143.5    5.1    0.0000   0.0000          ?        ?   206.2425  14.6860          ?        ?      143.5        5.1       ?       ? 
1 1 1   40   14   34 o    425.3    2.6    0.0000   0.0000          ?        ?  1809.5702  22.3483          ?        ?      425.3        2.6       ?       ? 
1 1 1   40   14   35 o    264.5    3.3    0.0000   0.0000          ?        ?   699.8197  17.2401          ?        ?      264.5        3.3       ?       ? 
1 1 1   40   14   36 o    178.4    4.5    0.0000   0.0000          ?        ?   318.6223  15.9630          ?        ?      178.4        4.5       ?       ? 
1 1 1   40   14   37 o    292.6    3.2    0.0000   0.0000          ?        ?   856.8960  18.5171          ?        ?      292.6        3.2       ?       ? 
1 1 1   40   14   38 o    172.2    4.8    0.0000   0.0000          ?        ?   296.9126  16.6016          ?        ?      172.2        4.8       ?       ? 
1 1 1   40   14   39 o    405.4    2.7    0.0000   0.0000          ?        ?  1644.1932  21.7097          ?        ?      405.4        2.7       ?       ? 
1 1 1   40   14   40 o    151.2    5.5    0.0000   0.0000          ?        ?   229.2293  16.6016          ?        ?      151.2        5.5       ?       ? 
1 1 1   40   14   41 o    170.1    5.1    0.0000   0.0000          ?        ?   289.8888  17.2401          ?        ?      170.1        5.1       ?       ? 
1 1 1   40   14   42 o    127.9    6.5    0.0000   0.0000          ?        ?   164.1001  16.6016          ?        ?      127.9        6.5       ?       ? 
1 1 1   40   14   43 o    306.4    3.1    0.0000   0.0000          ?        ?   939.2654  19.1556          ?        ?      306.4        3.1       ?       ? 
1 1 1   40   14   44 o    161.6    5.5    0.0000   0.0000          ?        ?   261.7939  17.8786          ?        ?      161.6        5.5       ?       ? 
1 1 1   40   14   45 o    234.4    3.9    0.0000   0.0000          ?        ?   550.4056  18.5171          ?        ?      234.4        3.9       ?       ? 
1 1 1   40   14   46 o    240.2    3.9    0.0000   0.0000          ?        ?   577.8621  18.5171          ?        ?      240.2        3.9       ?       ? 
1 1 1   40   14   47 o     19.1    9.6    0.0000   0.0000          ?        ?   -60.6596  17.8786          ?        ?       19.1        9.6       ?       ? 
1 1 1   40   14   48 o    418.5    2.8    0.0000   0.0000          ?        ?  1752.7418  23.6253          ?        ?      418.5        2.8       ?       ? 
1 1 1   40   14   49 o    333.9    3.1    0.0000   0.0000          ?        ?  1116.1359  20.4327          ?        ?      333.9        3.1       ?       ? 
1 1 1   40   14   50 o    134.3    6.4    0.0000   0.0000          ?        ?   181.3401  17.2401          ?        ?      134.3        6.4       ?       ? 
1 1 1   40   14   51 o    104.2    8.9    0.0000   0.0000          ?        ?   109.8257  18.5171          ?        ?      104.2        8.9       ?       ? 
1 1 1   40   14   52 o    206.7    4.5    0.0000   0.0000          ?        ?   428.4480  18.5171          ?        ?      206.7        4.5       ?       ? 
1 1 1   40   14   53 o     66.1   14.0    0.0000   0.0000          ?        ?    46.6121  17.8786          ?        ?       66.1       14.0       ?       ? 
1 1 1   40   14   54 o    143.1    6.5    0.0000   0.0000          ?        ?   206.2425  18.5171          ?        ?      143.1        6.5       ?       ? 
1 1 1   40   14   55 o     60.9   15.2    0.0000   0.0000          ?        ?    40.2269  18.5171          ?        ?       60.9       15.2       ?       ? 
1 1 1   40   14   56 o    161.5    5.5    0.0000   0.0000          ?        ?   262.4324  17.8786          ?        ?      161.5        5.5       ?       ? 
1 1 1   40   15    0 o    355.6    3.9 1264.9114  27.4564  1264.9114  27.4564  1264.9114  27.4564      355.6      3.9      355.6        3.9     0.0     0.0 
1 1 1   40   15    1 o    261.2    2.9    0.0000   0.0000          ?        ?   682.5797  15.3245          ?        ?      261.2        2.9       ?       ? 
1 1 1   40   15    2 o    190.6    3.5    0.0000   0.0000          ?        ?   363.3188  13.4090          ?        ?      190.6        3.5       ?       ? 
1 1 1   40   15    3 o    359.0    2.8    0.0000   0.0000          ?        ?  1289.1752  19.7942          ?        ?      359.0        2.8       ?       ? 
1 1 1   40   15    4 o    440.2    2.8    0.0000   0.0000          ?        ?  1938.5518  24.2638          ?        ?      440.2        2.8       ?       ? 
1 1 1   40   15    5 o    264.8    2.8    0.0000   0.0000          ?        ?   701.0967  14.6860          ?        ?      264.8        2.8       ?       ? 
1 1 1   40   15    6 o    280.7    2.6    0.0000   0.0000          ?        ?   787.9357  14.6860          ?        ?      280.7        2.6       ?       ? 
1 1 1   40   15    7 o     23.5   10.7    0.0000   0.0000          ?        ?    -6.3852  10.8549          ?        ?       23.5       10.7       ?       ? 
1 1 1   40   15    8 o    128.1    4.5    0.0000   0.0000          ?        ?   164.1001  11.4934          ?        ?      128.1        4.5       ?       ? 
1 1 1   40   15    9 o     16.8    8.4    0.0000   0.0000          ?        ?   -30.6490  11.4934          ?        ?       16.8        8.4       ?       ? 
1 1 1   40   15   10 o     23.8   11.0    0.0000   0.0000          ?        ?    -9.5778  12.1319          ?        ?       23.8       11.0       ?       ? 
1 1 1   40   15   11 o    361.1    2.5    0.0000   0.0000          ?        ?  1304.4998  17.8786          ?        ?      361.1        2.5       ?       ? 
1 1 1   40   15   12 o    687.5    3.1    0.0000   0.0000          ?        ?  4728.2524  42.1424          ?        ?      687.5        3.1       ?       ? 
1 1 1   40   15   13 o    444.3    2.5    0.0000   0.0000          ?        ?  1974.3090  22.3483          ?        ?      444.3        2.5       ?       ? 
1 1 1   40   15   14 o    185.8    2.9    0.0000   0.0000          ?        ?   345.4402  10.8549          ?        ?      185.8        2.9       ?       ? 
1 1 1   40   15   15 o    359.9    2.4    0.0000   0.0000          ?        ?  1295.5603  17.2401          ?        ?      359.9        2.4       ?       ? 
1 1 1   40   15   16 o    295.5    2.4    0.0000   0.0000          ?        ?   873.4976  14.0475          ?        ?      295.5        2.4       ?       ? 
1 1 1   40   15   17 o    399.7    2.3    0.0000   0.0000          ?        ?  1598.2196  18.5171          ?        ?      399.7        2.3       ?       ? 
1 1 1   40   15   18 o    190.1    3.2    0.0000   0.0000          ?        ?   361.4032  12.1319          ?        ?      190.1        3.2       ?       ? 
1 1 1   40   15   19 o    518.5    2.6    0.0000   0.0000          ?        ?  2688.8147  26.8179          ?        ?      518.5        2.6       ?       ? 
1 1 1   40   15   20 o    118.7    5.1    0.0000   0.0000          ?        ?   141.1133  12.1319          ?        ?      118.7        5.1       ?       ? 
1 1 1   40   15   21 o    288.6    2.7    0.0000   0.0000          ?        ?   833.2708  15.3245          ?        ?      288.6        2.7       ?       ? 
1 1 1   40   15   22 o    189.2    3.4    0.0000   0.0000          ?        ?   358.2106  12.7704          ?        ?      189.2        3.4       ?       ? 
1 1 1   40   15   23 o    340.2    2.5    0.0000   0.0000          ?        ?  1157.6398  17.2401          ?        ?      340.2        2.5       ?       ? 
1 1 1   40   15   24 o     86.3    7.8    0.0000   0.0000          ?        ?    74.7070  13.4090          ?        ?       86.3        7.8       ?       ? 
1 1 1   40   15   25 o    229.5    3.1    0.0000   0.0000          ?        ?   526.7803  14.0475          ?        ?      229.5        3.1       ?       ? 
1 1 1   40   15   26 o     72.2    8.8    0.0000   0.0000          ?        ?    52.3588  12.7704          ?        ?       72.2        8.8       ?       ? 
1 1 1   40   15   27 o    200.8    3.3    0.0000   0.0000          ?        ?   403.5457  13.4090          ?        ?      200.8        3.3       ?       ? 
1 1 1   40   15   28 f    337.4    2.6    0.0000   0.0000          ?        ?  1138.4841  17.8786          ?        ?      337.4        2.6       ?       ? 
1 1 1   40   15   29 o    348.0    2.6    0.0000   0.0000          ?        ?  1211.2755  17.8786          ?        ?      348.0        2.6       ?       ? 
1 1 1   40   15   30 o     18.4    9.2    0.0000   0.0000          ?        ?   -34.4802  13.4090          ?        ?       18.4        9.2       ?       ? 
1 1 1   40   15   31 o    425.6    2.7    0.0000   0.0000          ?        ?  1812.1243  22.9868          ?        ?      425.6        2.7       ?       ? 
1 1 1   40   15   32 o    396.2    2.6    0.0000   0.0000          ?        ?  1570.7632  20.4327          ?        ?      396.2        2.6       ?       ? 
1 1 1   40   15   33 f    181.2    4.1    0.0000   0.0000          ?        ?   328.8386  14.6860          ?        ?      181.2        4.1       ?       ? 
1 1 1   40   15   34 o    185.1    4.1    0.0000   0.0000          ?        ?   342.8861  15.3245          ?        ?      185.1        4.1       ?       ? 
1 1 1   40   15   35 o     84.3    9.5    0.0000   0.0000          ?        ?    71.5144  15.9630          ?        ?       84.3        9.5       ?       ? 
1 1 1   40   15   36 o    158.5    5.0    0.0000   0.0000          ?        ?   251.5775  15.9630          ?        ?      158.5        5.0       ?       ? 
1 1 1   40   15   37 o     19.2    9.6    0.0000   0.0000          ?        ?   -45.9736  15.9630          ?        ?       19.2        9.6       ?       ? 
1 1 1   40   15   38 o     31.6   13.6    0.0000   0.0000          ?        ?    -0.6385  15.3245          ?        ?       31.6       13.6       ?       ? 
1 1 1   40   15   39 o    115.9    7.2    0.0000   0.0000          ?        ?   134.7281  16.6016          ?        ?      115.9        7.2       ?       ? 
1 1 1   40   15   40 o    184.9    4.3    0.0000   0.0000          ?        ?   342.2476  15.9630          ?        ?      184.9        4.3       ?       ? 
1 1 1   40   15   41 o    175.8    4.7    0.0000   0.0000          ?        ?   309.6830  16.6016          ?        ?      175.8        4.7       ?       ? 
1 1 1   40   15   42 o    239.0    3.7    0.0000   0.0000          ?        ?   572.1154  17.8786          ?        ?      239.0        3.7       ?       ? 
1 1 1   40   15   43 o    349.2    2.9    0.0000   0.0000          ?        ?  1220.2148  20.4327          ?        ?      349.2        2.9       ?       ? 
1 1 1   40   15   44 o    347.1    2.9    0.0000   0.0000          ?        ?  1205.5288  20.4327          ?        ?      347.1        2.9       ?       ? 
1 1 1   40   15   45 o    317.3    3.2    0.0000   0.0000          ?        ?  1007.5872  20.4327          ?        ?      317.3        3.2       ?       ? 
1 1 1   40   15   46 o    270.1    3.7    0.0000   0.0000          ?        ?   730.4688  19.7942          ?        ?      270.1        3.7       ?       ? 
1 1 1   40   15   47 o    134.1    6.7    0.0000   0.0000          ?        ?   180.7016  17.8786          ?        ?      134.1        6.7       ?       ? 
1 1 1   40   15   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   15   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   15   50 o    265.9    3.6    0.0000   0.0000          ?        ?   708.1205  19.1556          ?        ?      265.9        3.6       ?       ? 
1 1 1   40   15   51 o    136.5    7.0    0.0000   0.0000          ?        ?   187.7254  19.1556          ?        ?      136.5        7.0       ?       ? 
1 1 1   40   15   52 o    128.6    7.0    0.0000   0.0000          ?        ?   166.6541  17.8786          ?        ?      128.6        7.0       ?       ? 
1 1 1   40   15   53 o    110.1    7.8    0.0000   0.0000          ?        ?   122.5962  17.2401          ?        ?      110.1        7.8       ?       ? 
1 1 1   40   15   54 o     29.4   13.4    0.0000   0.0000          ?        ?    -9.5778  17.2401          ?        ?       29.4       13.4       ?       ? 
1 1 1   40   15   55 o    116.4    8.0    0.0000   0.0000          ?        ?   137.2822  18.5171          ?        ?      116.4        8.0       ?       ? 
1 1 1   40   16    0 o    146.7    6.1  216.4588  17.8786   216.4588  17.8786   216.4588  17.8786      146.7      6.1      146.7        6.1     0.0     0.0 
1 1 1   40   16    1 o    407.9    2.7    0.0000   0.0000          ?        ?  1663.9874  22.3483          ?        ?      407.9        2.7       ?       ? 
1 1 1   40   16    2 o     59.2   11.2    0.0000   0.0000          ?        ?    36.3957  12.7704          ?        ?       59.2       11.2       ?       ? 
1 1 1   40   16    3 o    334.6    3.1    0.0000   0.0000          ?        ?  1119.9669  20.4327          ?        ?      334.6        3.1       ?       ? 
1 1 1   40   16    4 o    340.8    3.0    0.0000   0.0000          ?        ?  1162.1094  20.4327          ?        ?      340.8        3.0       ?       ? 
1 1 1   40   16    5 o    293.6    3.0    0.0000   0.0000          ?        ?   862.0042  17.8786          ?        ?      293.6        3.0       ?       ? 
1 1 1   40   16    6 o    192.6    3.1    0.0000   0.0000          ?        ?   370.9810  12.1319          ?        ?      192.6        3.1       ?       ? 
1 1 1   40   16    7 o    414.0    2.5    0.0000   0.0000          ?        ?  1714.4305  20.4327          ?        ?      414.0        2.5       ?       ? 
1 1 1   40   16    8 o    477.9    2.7    0.0000   0.0000          ?        ?  2284.6304  26.1794          ?        ?      477.9        2.7       ?       ? 
1 1 1   40   16    9 o    366.5    2.5    0.0000   0.0000          ?        ?  1343.4495  18.5171          ?        ?      366.5        2.5       ?       ? 
1 1 1   40   16   10 o    235.8    2.8    0.0000   0.0000          ?        ?   556.1523  13.4090          ?        ?      235.8        2.8       ?       ? 
1 1 1   40   16   11 o    702.8    3.0    0.0000   0.0000          ?        ?  4940.8804  41.5039          ?        ?      702.8        3.0       ?       ? 
1 1 1   40   16   12 o    329.1    2.6    0.0000   0.0000          ?        ?  1083.5712  17.2401          ?        ?      329.1        2.6       ?       ? 
1 1 1   40   16   13 o    130.8    4.2    0.0000   0.0000          ?        ?   171.1238  10.8549          ?        ?      130.8        4.2       ?       ? 
1 1 1   40   16   14 o    163.7    3.5    0.0000   0.0000          ?        ?   268.1791  11.4934          ?        ?      163.7        3.5       ?       ? 
1 1 1   40   16   15 o     52.6   10.1    0.0000   0.0000          ?        ?    28.7335  10.2163          ?        ?       52.6       10.1       ?       ? 
1 1 1   40   16   16 o    284.7    2.5    0.0000   0.0000          ?        ?   810.9225  14.0475          ?        ?      284.7        2.5       ?       ? 
1 1 1   40   16   17 f    180.9    3.7    0.0000   0.0000          ?        ?   327.5616  13.4090          ?        ?      180.9        3.7       ?       ? 
1 1 1   40   16   18 o    316.4    2.4    0.0000   0.0000          ?        ?  1001.2019  15.3245          ?        ?      316.4        2.4       ?       ? 
1 1 1   40   16   19 f    413.9    2.5    0.0000   0.0000          ?        ?  1713.7920  20.4327          ?        ?      413.9        2.5       ?       ? 
1 1 1   40   16   20 o    184.3    3.5    0.0000   0.0000          ?        ?   339.6935  12.7704          ?        ?      184.3        3.5       ?       ? 
1 1 1   40   16   21 o     15.9    8.0    0.0000   0.0000          ?        ?   -35.7572  11.4934          ?        ?       15.9        8.0       ?       ? 
1 1 1   40   16   22 o    231.8    2.9    0.0000   0.0000          ?        ?   537.6352  13.4090          ?        ?      231.8        2.9       ?       ? 
1 1 1   40   16   23 o     48.2   13.0    0.0000   0.0000          ?        ?    24.2638  12.7704          ?        ?       48.2       13.0       ?       ? 
1 1 1   40   16   24 o    157.1    4.3    0.0000   0.0000          ?        ?   247.1079  13.4090          ?        ?      157.1        4.3       ?       ? 
1 1 1   40   16   25 o    321.4    2.5    0.0000   0.0000          ?        ?  1033.1281  15.9630          ?        ?      321.4        2.5       ?       ? 
1 1 1   40   16   26 o    219.5    3.3    0.0000   0.0000          ?        ?   482.0838  14.6860          ?        ?      219.5        3.3       ?       ? 
1 1 1   40   16   27 o    158.9    4.2    0.0000   0.0000          ?        ?   252.8546  13.4090          ?        ?      158.9        4.2       ?       ? 
1 1 1   40   16   28 o    147.5    4.5    0.0000   0.0000          ?        ?   217.7359  13.4090          ?        ?      147.5        4.5       ?       ? 
1 1 1   40   16   29 o    366.0    2.7    0.0000   0.0000          ?        ?  1340.2568  19.7942          ?        ?      366.0        2.7       ?       ? 
1 1 1   40   16   30 o    439.6    2.5    0.0000   0.0000          ?        ?  1933.4434  22.3483          ?        ?      439.6        2.5       ?       ? 
1 1 1   40   16   31 o    327.9    2.7    0.0000   0.0000          ?        ?  1075.9089  17.8786          ?        ?      327.9        2.7       ?       ? 
1 1 1   40   16   32 o    174.4    4.0    0.0000   0.0000          ?        ?   304.5748  14.0475          ?        ?      174.4        4.0       ?       ? 
1 1 1   40   16   33 o    217.3    3.5    0.0000   0.0000          ?        ?   472.5060  15.3245          ?        ?      217.3        3.5       ?       ? 
1 1 1   40   16   34 o    372.1    2.6    0.0000   0.0000          ?        ?  1384.9534  19.1556          ?        ?      372.1        2.6       ?       ? 
1 1 1   40   16   35 o    161.5    4.7    0.0000   0.0000          ?        ?   261.1554  15.3245          ?        ?      161.5        4.7       ?       ? 
1 1 1   40   16   36 o    192.2    4.3    0.0000   0.0000          ?        ?   369.7040  16.6016          ?        ?      192.2        4.3       ?       ? 
1 1 1   40   16   37 o    107.3    7.7    0.0000   0.0000          ?        ?   115.5724  16.6016          ?        ?      107.3        7.7       ?       ? 
1 1 1   40   16   38 o    249.8    3.5    0.0000   0.0000          ?        ?   624.4742  17.2401          ?        ?      249.8        3.5       ?       ? 
1 1 1   40   16   39 o    318.4    2.9    0.0000   0.0000          ?        ?  1014.6108  18.5171          ?        ?      318.4        2.9       ?       ? 
1 1 1   40   16   40 o    358.6    2.8    0.0000   0.0000          ?        ?  1286.6211  19.7942          ?        ?      358.6        2.8       ?       ? 
1 1 1   40   16   41 o    169.5    4.9    0.0000   0.0000          ?        ?   287.9732  16.6016          ?        ?      169.5        4.9       ?       ? 
1 1 1   40   16   42 o    133.5    6.0    0.0000   0.0000          ?        ?   178.7861  15.9630          ?        ?      133.5        6.0       ?       ? 
1 1 1   40   16   43 o     71.0   11.7    0.0000   0.0000          ?        ?    51.0817  16.6016          ?        ?       71.0       11.7       ?       ? 
1 1 1   40   16   44 o    193.6    4.6    0.0000   0.0000          ?        ?   375.4507  17.8786          ?        ?      193.6        4.6       ?       ? 
1 1 1   40   16   45 o    118.2    7.6    0.0000   0.0000          ?        ?   140.4748  17.8786          ?        ?      118.2        7.6       ?       ? 
1 1 1   40   16   46 o    189.5    4.5    0.0000   0.0000          ?        ?   360.1262  17.2401          ?        ?      189.5        4.5       ?       ? 
1 1 1   40   16   47 o    100.3    8.9    0.0000   0.0000          ?        ?   101.5249  17.8786          ?        ?      100.3        8.9       ?       ? 
1 1 1   40   16   48 o    194.9    4.9    0.0000   0.0000          ?        ?   381.1974  19.1556          ?        ?      194.9        4.9       ?       ? 
1 1 1   40   16   49 o     40.9   15.8    0.0000   0.0000          ?        ?    11.4934  18.5171          ?        ?       40.9       15.8       ?       ? 
1 1 1   40   16   50 o    391.8    2.9    0.0000   0.0000          ?        ?  1536.9215  22.3483          ?        ?      391.8        2.9       ?       ? 
1 1 1   40   16   51 o    134.4    6.6    0.0000   0.0000          ?        ?   181.9787  17.8786          ?        ?      134.4        6.6       ?       ? 
1 1 1   40   16   52 f     25.6   12.3    0.0000   0.0000          ?        ?   -26.8179  18.5171          ?        ?       25.6       12.3       ?       ? 
1 1 1   40   16   53 o     28.1   13.0    0.0000   0.0000          ?        ?   -13.4090  17.2401          ?        ?       28.1       13.0       ?       ? 
1 1 1   40   16   54 o    103.5    8.3    0.0000   0.0000          ?        ?   108.5487  17.2401          ?        ?      103.5        8.3       ?       ? 
1 1 1   40   17    0 o    559.6    4.5 3133.2256  50.4432  3133.2256  50.4432  3133.2256  50.4432      559.6      4.5      559.6        4.5     0.0     0.0 
1 1 1   40   17    1 o    279.9    3.0    0.0000   0.0000          ?        ?   783.4660  16.6016          ?        ?      279.9        3.0       ?       ? 
1 1 1   40   17    2 o    105.6    5.7    0.0000   0.0000          ?        ?   111.7413  12.1319          ?        ?      105.6        5.7       ?       ? 
1 1 1   40   17    3 o    222.1    3.2    0.0000   0.0000          ?        ?   493.5772  14.0475          ?        ?      222.1        3.2       ?       ? 
1 1 1   40   17    4 o    566.6    3.0    0.0000   0.0000          ?        ?  3211.7637  33.8416          ?        ?      566.6        3.0       ?       ? 
1 1 1   40   17    5 o    122.2    5.2    0.0000   0.0000          ?        ?   149.4141  12.7704          ?        ?      122.2        5.2       ?       ? 
1 1 1   40   17    6 o     25.5   11.6    0.0000   0.0000          ?        ?    -9.5778  13.4090          ?        ?       25.5       11.6       ?       ? 
1 1 1   40   17    7 f    382.6    2.8    0.0000   0.0000          ?        ?  1464.1301  21.7097          ?        ?      382.6        2.8       ?       ? 
1 1 1   40   17    8 o    178.8    3.0    0.0000   0.0000          ?        ?   319.8993  10.8549          ?        ?      178.8        3.0       ?       ? 
1 1 1   40   17    9 o    243.0    2.8    0.0000   0.0000          ?        ?   590.6325  13.4090          ?        ?      243.0        2.8       ?       ? 
1 1 1   40   17   10 f    197.3    3.2    0.0000   0.0000          ?        ?   389.4982  12.7704          ?        ?      197.3        3.2       ?       ? 
1 1 1   40   17   11 o    528.3    2.8    0.0000   0.0000          ?        ?  2792.2549  30.0105          ?        ?      528.3        2.8       ?       ? 
1 1 1   40   17   12 o    292.1    2.5    0.0000   0.0000          ?        ?   853.7034  14.6860          ?        ?      292.1        2.5       ?       ? 
1 1 1   40   17   13 o    127.8    3.5    0.0000   0.0000          ?        ?   163.4615   8.9393          ?        ?      127.8        3.5       ?       ? 
1 1 1   40   17   14 o    141.1    4.1    0.0000   0.0000          ?        ?   199.2188  11.4934          ?        ?      141.1        4.1       ?       ? 
1 1 1   40   17   15 o    404.2    2.7    0.0000   0.0000          ?        ?  1633.9768  21.7097          ?        ?      404.2        2.7       ?       ? 
1 1 1   40   17   16 o    379.8    2.6    0.0000   0.0000          ?        ?  1443.0588  19.7942          ?        ?      379.8        2.6       ?       ? 
1 1 1   40   17   17 o    244.0    2.9    0.0000   0.0000          ?        ?   595.7407  14.0475          ?        ?      244.0        2.9       ?       ? 
1 1 1   40   17   18 o    170.6    3.6    0.0000   0.0000          ?        ?   291.1659  12.1319          ?        ?      170.6        3.6       ?       ? 
1 1 1   40   17   19 o    230.3    2.9    0.0000   0.0000          ?        ?   530.6115  13.4090          ?        ?      230.3        2.9       ?       ? 
1 1 1   40   17   20 o    392.6    2.4    0.0000   0.0000          ?        ?  1541.3911  19.1556          ?        ?      392.6        2.4       ?       ? 
1 1 1   40   17   21 o    202.3    3.5    0.0000   0.0000          ?        ?   409.2924  14.0475          ?        ?      202.3        3.5       ?       ? 
1 1 1   40   17   22 o    308.9    2.5    0.0000   0.0000          ?        ?   954.5898  15.3245          ?        ?      308.9        2.5       ?       ? 
1 1 1   40   17   23 o    329.2    2.6    0.0000   0.0000          ?        ?  1084.2097  17.2401          ?        ?      329.2        2.6       ?       ? 
1 1 1   40   17   24 o    548.4    2.6    0.0000   0.0000          ?        ?  3008.0754  28.7335          ?        ?      548.4        2.6       ?       ? 
1 1 1   40   17   25 o    236.7    3.1    0.0000   0.0000          ?        ?   560.6220  14.6860          ?        ?      236.7        3.1       ?       ? 
1 1 1   40   17   26 o    193.4    3.6    0.0000   0.0000          ?        ?   374.1737  14.0475          ?        ?      193.4        3.6       ?       ? 
1 1 1   40   17   27 o    504.2    2.5    0.0000   0.0000          ?        ?  2542.5933  24.9023          ?        ?      504.2        2.5       ?       ? 
1 1 1   40   17   28 o    220.9    3.3    0.0000   0.0000          ?        ?   488.4691  14.6860          ?        ?      220.9        3.3       ?       ? 
1 1 1   40   17   29 o     51.2   13.5    0.0000   0.0000          ?        ?    27.4564  14.0475          ?        ?       51.2       13.5       ?       ? 
1 1 1   40   17   30 o    230.3    3.3    0.0000   0.0000          ?        ?   530.6115  15.3245          ?        ?      230.3        3.3       ?       ? 
1 1 1   40   17   31 o    169.0    4.2    0.0000   0.0000          ?        ?   286.0577  14.0475          ?        ?      169.0        4.2       ?       ? 
1 1 1   40   17   32 o    170.7    4.5    0.0000   0.0000          ?        ?   291.8044  15.3245          ?        ?      170.7        4.5       ?       ? 
1 1 1   40   17   33 o     23.6   11.2    0.0000   0.0000          ?        ?   -16.6016  14.0475          ?        ?       23.6       11.2       ?       ? 
1 1 1   40   17   34 o    136.6    5.4    0.0000   0.0000          ?        ?   187.0868  14.6860          ?        ?      136.6        5.4       ?       ? 
1 1 1   40   17   35 o    123.6    6.2    0.0000   0.0000          ?        ?   153.2452  15.3245          ?        ?      123.6        6.2       ?       ? 
1 1 1   40   17   36 o    397.7    2.7    0.0000   0.0000          ?        ?  1582.8950  21.7097          ?        ?      397.7        2.7       ?       ? 
1 1 1   40   17   37 o    460.9    2.6    0.0000   0.0000          ?        ?  2125.0000  23.6253          ?        ?      460.9        2.6       ?       ? 
1 1 1   40   17   38 o     25.3   11.9    0.0000   0.0000          ?        ?   -18.5171  15.9630          ?        ?       25.3       11.9       ?       ? 
1 1 1   40   17   39 o    165.7    5.0    0.0000   0.0000          ?        ?   275.2028  16.6016          ?        ?      165.7        5.0       ?       ? 
1 1 1   40   17   40 o    321.2    3.0    0.0000   0.0000          ?        ?  1032.4895  19.1556          ?        ?      321.2        3.0       ?       ? 
1 1 1   40   17   41 o    204.4    4.1    0.0000   0.0000          ?        ?   418.2317  16.6016          ?        ?      204.4        4.1       ?       ? 
1 1 1   40   17   42 o     65.8   12.6    0.0000   0.0000          ?        ?    45.3350  15.9630          ?        ?       65.8       12.6       ?       ? 
1 1 1   40   17   43 o    106.3    8.1    0.0000   0.0000          ?        ?   113.6568  17.2401          ?        ?      106.3        8.1       ?       ? 
1 1 1   40   17   44 o    276.5    3.3    0.0000   0.0000          ?        ?   765.5875  18.5171          ?        ?      276.5        3.3       ?       ? 
1 1 1   40   17   45 o    117.3    7.3    0.0000   0.0000          ?        ?   138.5592  17.2401          ?        ?      117.3        7.3       ?       ? 
1 1 1   40   17   46 o    307.6    3.2    0.0000   0.0000          ?        ?   947.5660  19.7942          ?        ?      307.6        3.2       ?       ? 
1 1 1   40   17   47 o     62.4   14.6    0.0000   0.0000          ?        ?    41.5039  17.8786          ?        ?       62.4       14.6       ?       ? 
1 1 1   40   17   48 f    346.5    3.0    0.0000   0.0000          ?        ?  1202.3362  21.0712          ?        ?      346.5        3.0       ?       ? 
1 1 1   40   17   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   17   50 o    160.9    6.0    0.0000   0.0000          ?        ?   260.5168  19.1556          ?        ?      160.9        6.0       ?       ? 
1 1 1   40   17   51 o     47.7   15.7    0.0000   0.0000          ?        ?    22.9868  17.2401          ?        ?       47.7       15.7       ?       ? 
1 1 1   40   17   52 o     66.5   13.4    0.0000   0.0000          ?        ?    47.2506  17.2401          ?        ?       66.5       13.4       ?       ? 
1 1 1   40   17   53 o    127.5    7.0    0.0000   0.0000          ?        ?   164.1001  17.8786          ?        ?      127.5        7.0       ?       ? 
1 1 1   40   18    0 o    664.0    4.4 4410.9072  58.1055  4410.9072  58.1055  4410.9072  58.1055      664.0      4.4      664.0        4.4     0.0     0.0 
1 1 1   40   18    1 f     25.2   11.5    0.0000   0.0000          ?        ?    -8.3008  12.7704          ?        ?       25.2       11.5       ?       ? 
1 1 1   40   18    2 f    107.1    6.3    0.0000   0.0000          ?        ?   114.9339  13.4090          ?        ?      107.1        6.3       ?       ? 
1 1 1   40   18    3 o     99.7    6.7    0.0000   0.0000          ?        ?    99.6094  13.4090          ?        ?       99.7        6.7       ?       ? 
1 1 1   40   18    4 o    543.5    3.3    0.0000   0.0000          ?        ?  2955.0781  36.3957          ?        ?      543.5        3.3       ?       ? 
1 1 1   40   18    5 o    357.9    2.8    0.0000   0.0000          ?        ?  1281.5129  19.7942          ?        ?      357.9        2.8       ?       ? 
1 1 1   40   18    6 o    173.9    3.9    0.0000   0.0000          ?        ?   302.6593  13.4090          ?        ?      173.9        3.9       ?       ? 
1 1 1   40   18    7 o    367.1    3.0    0.0000   0.0000          ?        ?  1347.9192  21.7097          ?        ?      367.1        3.0       ?       ? 
1 1 1   40   18    8 o    235.7    2.8    0.0000   0.0000          ?        ?   555.5138  13.4090          ?        ?      235.7        2.8       ?       ? 
1 1 1   40   18    9 o    320.1    2.5    0.0000   0.0000          ?        ?  1024.8273  15.9630          ?        ?      320.1        2.5       ?       ? 
1 1 1   40   18   10 o    214.4    3.0    0.0000   0.0000          ?        ?   459.7356  12.7704          ?        ?      214.4        3.0       ?       ? 
1 1 1   40   18   11 o    231.0    2.9    0.0000   0.0000          ?        ?   533.8041  13.4090          ?        ?      231.0        2.9       ?       ? 
1 1 1   40   18   12 o    453.9    2.7    0.0000   0.0000          ?        ?  2061.1477  24.9023          ?        ?      453.9        2.7       ?       ? 
1 1 1   40   18   13 o    203.7    3.6    0.0000   0.0000          ?        ?   415.0391  14.6860          ?        ?      203.7        3.6       ?       ? 
1 1 1   40   18   14 o    515.0    2.5    0.0000   0.0000          ?        ?  2653.0574  25.5409          ?        ?      515.0        2.5       ?       ? 
1 1 1   40   18   15 o    376.5    2.5    0.0000   0.0000          ?        ?  1418.1566  18.5171          ?        ?      376.5        2.5       ?       ? 
1 1 1   40   18   16 o    108.6    4.7    0.0000   0.0000          ?        ?   118.1265  10.2163          ?        ?      108.6        4.7       ?       ? 
1 1 1   40   18   17 o    338.1    2.5    0.0000   0.0000          ?        ?  1143.5923  17.2401          ?        ?      338.1        2.5       ?       ? 
1 1 1   40   18   18 o    183.9    3.6    0.0000   0.0000          ?        ?   338.4165  13.4090          ?        ?      183.9        3.6       ?       ? 
1 1 1   40   18   19 o    334.8    2.7    0.0000   0.0000          ?        ?  1121.2440  17.8786          ?        ?      334.8        2.7       ?       ? 
1 1 1   40   18   20 o    269.5    2.8    0.0000   0.0000          ?        ?   726.6376  15.3245          ?        ?      269.5        2.8       ?       ? 
1 1 1   40   18   21 o    643.0    2.8    0.0000   0.0000          ?        ?  4136.3433  35.7572          ?        ?      643.0        2.8       ?       ? 
1 1 1   40   18   22 o    111.2    5.5    0.0000   0.0000          ?        ?   123.8732  12.1319          ?        ?      111.2        5.5       ?       ? 
1 1 1   40   18   23 o    349.9    2.5    0.0000   0.0000          ?        ?  1224.6844  17.2401          ?        ?      349.9        2.5       ?       ? 
1 1 1   40   18   24 o    233.6    3.3    0.0000   0.0000          ?        ?   545.9360  15.3245          ?        ?      233.6        3.3       ?       ? 
1 1 1   40   18   25 o    457.9    2.4    0.0000   0.0000          ?        ?  2097.5435  22.3483          ?        ?      457.9        2.4       ?       ? 
1 1 1   40   18   26 o    130.5    5.1    0.0000   0.0000          ?        ?   170.4853  13.4090          ?        ?      130.5        5.1       ?       ? 
1 1 1   40   18   27 o    290.4    2.9    0.0000   0.0000          ?        ?   843.4871  16.6016          ?        ?      290.4        2.9       ?       ? 
1 1 1   40   18   28 o     44.3   13.7    0.0000   0.0000          ?        ?    19.7942  13.4090          ?        ?       44.3       13.7       ?       ? 
1 1 1   40   18   29 o    355.2    2.5    0.0000   0.0000          ?        ?  1262.3572  17.8786          ?        ?      355.2        2.5       ?       ? 
1 1 1   40   18   30 o    135.2    5.7    0.0000   0.0000          ?        ?   183.2557  15.3245          ?        ?      135.2        5.7       ?       ? 
1 1 1   40   18   31 o    328.8    2.7    0.0000   0.0000          ?        ?  1081.6556  17.8786          ?        ?      328.8        2.7       ?       ? 
1 1 1   40   18   32 o    228.7    3.3    0.0000   0.0000          ?        ?   523.5877  15.3245          ?        ?      228.7        3.3       ?       ? 
1 1 1   40   18   33 o    101.8    7.5    0.0000   0.0000          ?        ?   104.0790  15.3245          ?        ?      101.8        7.5       ?       ? 
1 1 1   40   18   34 o    217.9    3.7    0.0000   0.0000          ?        ?   475.0601  15.9630          ?        ?      217.9        3.7       ?       ? 
1 1 1   40   18   35 o    140.5    5.5    0.0000   0.0000          ?        ?   197.9417  15.3245          ?        ?      140.5        5.5       ?       ? 
1 1 1   40   18   36 o    186.2    4.5    0.0000   0.0000          ?        ?   347.3558  16.6016          ?        ?      186.2        4.5       ?       ? 
1 1 1   40   18   37 o    177.8    4.5    0.0000   0.0000          ?        ?   316.7067  15.9630          ?        ?      177.8        4.5       ?       ? 
1 1 1   40   18   38 o    216.9    4.0    0.0000   0.0000          ?        ?   471.2290  17.2401          ?        ?      216.9        4.0       ?       ? 
1 1 1   40   18   39 o    154.1    5.2    0.0000   0.0000          ?        ?   238.1686  15.9630          ?        ?      154.1        5.2       ?       ? 
1 1 1   40   18   40 o     55.0   14.4    0.0000   0.0000          ?        ?    31.9261  15.9630          ?        ?       55.0       14.4       ?       ? 
1 1 1   40   18   41 o    115.2    7.2    0.0000   0.0000          ?        ?   133.4510  16.6016          ?        ?      115.2        7.2       ?       ? 
1 1 1   40   18   42 o    391.6    2.7    0.0000   0.0000          ?        ?  1534.3674  21.0712          ?        ?      391.6        2.7       ?       ? 
1 1 1   40   18   43 o    198.3    4.5    0.0000   0.0000          ?        ?   393.9678  17.8786          ?        ?      198.3        4.5       ?       ? 
1 1 1   40   18   44 o     23.8   11.5    0.0000   0.0000          ?        ?   -26.1794  16.6016          ?        ?       23.8       11.5       ?       ? 
1 1 1   40   18   45 o     27.0   12.6    0.0000   0.0000          ?        ?   -17.2401  17.2401          ?        ?       27.0       12.6       ?       ? 
1 1 1   40   18   46 o     23.0   11.2    0.0000   0.0000          ?        ?   -32.5646  17.2401          ?        ?       23.0       11.2       ?       ? 
1 1 1   40   18   47 o    228.7    3.9    0.0000   0.0000          ?        ?   524.2263  17.8786          ?        ?      228.7        3.9       ?       ? 
1 1 1   40   18   48 o     64.2   14.3    0.0000   0.0000          ?        ?    44.0580  17.8786          ?        ?       64.2       14.3       ?       ? 
1 1 1   40   18   49 o    186.5    5.1    0.0000   0.0000          ?        ?   349.2713  19.1556          ?        ?      186.5        5.1       ?       ? 
1 1 1   40   18   50 o     87.5   10.2    0.0000   0.0000          ?        ?    77.8996  17.8786          ?        ?       87.5       10.2       ?       ? 
1 1 1   40   18   51 o     56.5   15.0    0.0000   0.0000          ?        ?    34.4802  17.2401          ?        ?       56.5       15.0       ?       ? 
1 1 1   40   18   52 o    106.7    8.4    0.0000   0.0000          ?        ?   115.5724  17.8786          ?        ?      106.7        8.4       ?       ? 
1 1 1   40   19    0 o    705.6    4.8 4982.3843  67.0448  4982.3843  67.0448  4982.3843  67.0448      705.6      4.8      705.6        4.8     0.0     0.0 
1 1 1   40   19    1 o    183.6    3.8    0.0000   0.0000          ?        ?   337.1394  14.0475          ?        ?      183.6        3.8       ?       ? 
1 1 1   40   19    2 o    223.1    3.4    0.0000   0.0000          ?        ?   498.0469  15.3245          ?        ?      223.1        3.4       ?       ? 
1 1 1   40   19    3 o    485.0    3.4    0.0000   0.0000          ?        ?  2353.5908  33.2031          ?        ?      485.0        3.4       ?       ? 
1 1 1   40   19    4 o    169.1    4.3    0.0000   0.0000          ?        ?   286.0577  14.6860          ?        ?      169.1        4.3       ?       ? 
1 1 1   40   19    5 o    375.8    3.1    0.0000   0.0000          ?        ?  1413.0483  22.9868          ?        ?      375.8        3.1       ?       ? 
1 1 1   40   19    6 o    240.9    3.4    0.0000   0.0000          ?        ?   580.4161  16.6016          ?        ?      240.9        3.4       ?       ? 
1 1 1   40   19    7 o    252.5    3.2    0.0000   0.0000          ?        ?   637.8831  15.9630          ?        ?      252.5        3.2       ?       ? 
1 1 1   40   19    8 o    413.6    2.8    0.0000   0.0000          ?        ?  1711.2379  22.9868          ?        ?      413.6        2.8       ?       ? 
1 1 1   40   19    9 o    291.5    2.6    0.0000   0.0000          ?        ?   849.8723  15.3245          ?        ?      291.5        2.6       ?       ? 
1 1 1   40   19   10 o    261.1    2.6    0.0000   0.0000          ?        ?   681.9411  13.4090          ?        ?      261.1        2.6       ?       ? 
1 1 1   40   19   11 f    129.0    4.2    0.0000   0.0000          ?        ?   166.6541  10.8549          ?        ?      129.0        4.2       ?       ? 
1 1 1   40   19   12 f    195.2    3.4    0.0000   0.0000          ?        ?   381.1974  13.4090          ?        ?      195.2        3.4       ?       ? 
1 1 1   40   19   13 o     72.3    8.0    0.0000   0.0000          ?        ?    52.3588  11.4934          ?        ?       72.3        8.0       ?       ? 
1 1 1   40   19   14 o    378.1    3.0    0.0000   0.0000          ?        ?  1430.2885  22.3483          ?        ?      378.1        3.0       ?       ? 
1 1 1   40   19   15 o    783.3    3.5    0.0000   0.0000          ?        ?  6139.3853  54.2743          ?        ?      783.3        3.5       ?       ? 
1 1 1   40   19   16 o    289.5    2.4    0.0000   0.0000          ?        ?   838.3789  14.0475          ?        ?      289.5        2.4       ?       ? 
1 1 1   40   19   17 o    201.5    2.9    0.0000   0.0000          ?        ?   406.0997  11.4934          ?        ?      201.5        2.9       ?       ? 
1 1 1   40   19   18 o    315.0    2.4    0.0000   0.0000          ?        ?   992.2626  15.3245          ?        ?      315.0        2.4       ?       ? 
1 1 1   40   19   19 o     24.6   11.2    0.0000   0.0000          ?        ?    -7.6623  12.1319          ?        ?       24.6       11.2       ?       ? 
1 1 1   40   19   20 o    228.5    2.9    0.0000   0.0000          ?        ?   522.3107  13.4090          ?        ?      228.5        2.9       ?       ? 
1 1 1   40   19   21 o    281.2    2.7    0.0000   0.0000          ?        ?   791.1283  15.3245          ?        ?      281.2        2.7       ?       ? 
1 1 1   40   19   22 o    409.3    2.5    0.0000   0.0000          ?        ?  1676.1193  20.4327          ?        ?      409.3        2.5       ?       ? 
1 1 1   40   19   23 o     24.4   11.4    0.0000   0.0000          ?        ?   -12.1319  13.4090          ?        ?       24.4       11.4       ?       ? 
1 1 1   40   19   24 o    193.2    3.8    0.0000   0.0000          ?        ?   373.5352  14.6860          ?        ?      193.2        3.8       ?       ? 
1 1 1   40   19   25 o    126.5    5.3    0.0000   0.0000          ?        ?   160.2689  13.4090          ?        ?      126.5        5.3       ?       ? 
1 1 1   40   19   26 o     19.1    9.4    0.0000   0.0000          ?        ?   -27.4564  12.7704          ?        ?       19.1        9.4       ?       ? 
1 1 1   40   19   27 o    175.9    4.0    0.0000   0.0000          ?        ?   309.6830  14.0475          ?        ?      175.9        4.0       ?       ? 
1 1 1   40   19   28 o    293.0    2.8    0.0000   0.0000          ?        ?   858.8116  16.6016          ?        ?      293.0        2.8       ?       ? 
1 1 1   40   19   29 o    355.4    2.5    0.0000   0.0000          ?        ?  1263.6343  17.8786          ?        ?      355.4        2.5       ?       ? 
1 1 1   40   19   30 o    375.6    2.6    0.0000   0.0000          ?        ?  1411.7714  19.7942          ?        ?      375.6        2.6       ?       ? 
1 1 1   40   19   31 o    252.7    3.3    0.0000   0.0000          ?        ?   639.1602  16.6016          ?        ?      252.7        3.3       ?       ? 
1 1 1   40   19   32 o    341.0    2.8    0.0000   0.0000          ?        ?  1163.3864  19.1556          ?        ?      341.0        2.8       ?       ? 
1 1 1   40   19   33 f    132.8    5.8    0.0000   0.0000          ?        ?   176.8705  15.3245          ?        ?      132.8        5.8       ?       ? 
1 1 1   40   19   34 o    229.3    3.5    0.0000   0.0000          ?        ?   526.1418  15.9630          ?        ?      229.3        3.5       ?       ? 
1 1 1   40   19   35 o    107.0    6.9    0.0000   0.0000          ?        ?   114.9339  14.6860          ?        ?      107.0        6.9       ?       ? 
1 1 1   40   19   36 o    184.0    4.5    0.0000   0.0000          ?        ?   339.0550  16.6016          ?        ?      184.0        4.5       ?       ? 
1 1 1   40   19   37 o     25.2   11.9    0.0000   0.0000          ?        ?   -18.5171  15.9630          ?        ?       25.2       11.9       ?       ? 
1 1 1   40   19   38 f    201.9    3.8    0.0000   0.0000          ?        ?   408.0153  15.3245          ?        ?      201.9        3.8       ?       ? 
1 1 1   40   19   39 o     21.9   10.7    0.0000   0.0000          ?        ?   -31.2876  15.9630          ?        ?       21.9       10.7       ?       ? 
1 1 1   40   19   40 o    263.3    3.4    0.0000   0.0000          ?        ?   694.0730  17.8786          ?        ?      263.3        3.4       ?       ? 
1 1 1   40   19   41 o    248.7    3.6    0.0000   0.0000          ?        ?   619.3660  17.8786          ?        ?      248.7        3.6       ?       ? 
1 1 1   40   19   42 o     83.0   10.0    0.0000   0.0000          ?        ?    69.5989  16.6016          ?        ?       83.0       10.0       ?       ? 
1 1 1   40   19   43 o    274.4    3.4    0.0000   0.0000          ?        ?   754.0941  18.5171          ?        ?      274.4        3.4       ?       ? 
1 1 1   40   19   44 o    195.5    4.6    0.0000   0.0000          ?        ?   383.1130  17.8786          ?        ?      195.5        4.6       ?       ? 
1 1 1   40   19   45 o    188.9    4.4    0.0000   0.0000          ?        ?   357.5721  16.6016          ?        ?      188.9        4.4       ?       ? 
1 1 1   40   19   46 o    229.8    3.9    0.0000   0.0000          ?        ?   529.3344  17.8786          ?        ?      229.8        3.9       ?       ? 
1 1 1   40   19   47 o     18.2    9.2    0.0000   0.0000          ?        ?   -62.5751  17.2401          ?        ?       18.2        9.2       ?       ? 
1 1 1   40   19   48 o    157.2    5.5    0.0000   0.0000          ?        ?   248.3849  17.2401          ?        ?      157.2        5.5       ?       ? 
1 1 1   40   19   49 o    167.0    5.4    0.0000   0.0000          ?        ?   280.3110  17.8786          ?        ?      167.0        5.4       ?       ? 
1 1 1   40   19   50 o     65.0   13.7    0.0000   0.0000          ?        ?    45.3350  17.2401          ?        ?       65.0       13.7       ?       ? 
1 1 1   40   19   51 o     47.5   15.7    0.0000   0.0000          ?        ?    22.9868  17.2401          ?        ?       47.5       15.7       ?       ? 
1 1 1   40   20    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   20    1 o    142.2    4.5    0.0000   0.0000          ?        ?   202.4114  12.7704          ?        ?      142.2        4.5       ?       ? 
1 1 1   40   20    2 o    339.9    2.8    0.0000   0.0000          ?        ?  1155.7241  19.1556          ?        ?      339.9        2.8       ?       ? 
1 1 1   40   20    3 o    249.6    3.2    0.0000   0.0000          ?        ?   623.1971  15.9630          ?        ?      249.6        3.2       ?       ? 
1 1 1   40   20    4 f    193.7    3.6    0.0000   0.0000          ?        ?   375.4507  14.0475          ?        ?      193.7        3.6       ?       ? 
1 1 1   40   20    5 o    571.6    3.2    0.0000   0.0000          ?        ?  3268.5923  36.3957          ?        ?      571.6        3.2       ?       ? 
1 1 1   40   20    6 o    322.8    3.2    0.0000   0.0000          ?        ?  1042.7058  20.4327          ?        ?      322.8        3.2       ?       ? 
1 1 1   40   20    7 o    539.1    3.1    0.0000   0.0000          ?        ?  2907.1890  33.8416          ?        ?      539.1        3.1       ?       ? 
1 1 1   40   20    8 o    231.1    3.5    0.0000   0.0000          ?        ?   534.4426  15.9630          ?        ?      231.1        3.5       ?       ? 
1 1 1   40   20    9 f    577.0    3.8    0.0000   0.0000          ?        ?  3331.1675  43.4195          ?        ?      577.0        3.8       ?       ? 
1 1 1   40   20   10 o    197.1    3.4    0.0000   0.0000          ?        ?   388.8597  13.4090          ?        ?      197.1        3.4       ?       ? 
1 1 1   40   20   11 f    177.7    3.4    0.0000   0.0000          ?        ?   316.0682  12.1319          ?        ?      177.7        3.4       ?       ? 
1 1 1   40   20   12 o    409.2    2.6    0.0000   0.0000          ?        ?  1674.8422  21.0712          ?        ?      409.2        2.6       ?       ? 
1 1 1   40   20   13 o    310.3    2.7    0.0000   0.0000          ?        ?   963.5291  16.6016          ?        ?      310.3        2.7       ?       ? 
1 1 1   40   20   14 o    413.8    2.9    0.0000   0.0000          ?        ?  1713.1534  24.2638          ?        ?      413.8        2.9       ?       ? 
1 1 1   40   20   15 o    269.3    3.0    0.0000   0.0000          ?        ?   725.3605  15.9630          ?        ?      269.3        3.0       ?       ? 
1 1 1   40   20   16 o    169.3    2.8    0.0000   0.0000          ?        ?   286.6962   9.5778          ?        ?      169.3        2.8       ?       ? 
1 1 1   40   20   17 o    248.2    2.6    0.0000   0.0000          ?        ?   616.1733  12.7704          ?        ?      248.2        2.6       ?       ? 
1 1 1   40   20   18 o    222.5    2.9    0.0000   0.0000          ?        ?   495.4928  12.7704          ?        ?      222.5        2.9       ?       ? 
1 1 1   40   20   19 o    391.4    2.7    0.0000   0.0000          ?        ?  1532.4519  21.0712          ?        ?      391.4        2.7       ?       ? 
1 1 1   40   20   20 o    407.7    2.5    0.0000   0.0000          ?        ?  1662.7103  20.4327          ?        ?      407.7        2.5       ?       ? 
1 1 1   40   20   21 o     17.3    8.6    0.0000   0.0000          ?        ?   -28.0950  11.4934          ?        ?       17.3        8.6       ?       ? 
1 1 1   40   20   22 o    243.1    2.8    0.0000   0.0000          ?        ?   591.2710  13.4090          ?        ?      243.1        2.8       ?       ? 
1 1 1   40   20   23 o    106.5    5.7    0.0000   0.0000          ?        ?   113.6568  12.1319          ?        ?      106.5        5.7       ?       ? 
1 1 1   40   20   24 o    107.1    5.7    0.0000   0.0000          ?        ?   114.9339  12.1319          ?        ?      107.1        5.7       ?       ? 
1 1 1   40   20   25 o    310.6    2.9    0.0000   0.0000          ?        ?   965.4447  17.8786          ?        ?      310.6        2.9       ?       ? 
1 1 1   40   20   26 o     18.5    9.3    0.0000   0.0000          ?        ?   -37.6728  14.0475          ?        ?       18.5        9.3       ?       ? 
1 1 1   40   20   27 o    281.1    3.0    0.0000   0.0000          ?        ?   790.4898  16.6016          ?        ?      281.1        3.0       ?       ? 
1 1 1   40   20   28 o    315.8    2.7    0.0000   0.0000          ?        ?   998.0093  17.2401          ?        ?      315.8        2.7       ?       ? 
1 1 1   40   20   29 o    170.5    4.5    0.0000   0.0000          ?        ?   291.1659  15.3245          ?        ?      170.5        4.5       ?       ? 
1 1 1   40   20   30 o    212.8    3.8    0.0000   0.0000          ?        ?   453.3503  15.9630          ?        ?      212.8        3.8       ?       ? 
1 1 1   40   20   31 o    396.6    2.7    0.0000   0.0000          ?        ?  1573.9558  21.0712          ?        ?      396.6        2.7       ?       ? 
1 1 1   40   20   32 o    244.4    3.4    0.0000   0.0000          ?        ?   597.6562  16.6016          ?        ?      244.4        3.4       ?       ? 
1 1 1   40   20   33 o    204.2    3.9    0.0000   0.0000          ?        ?   417.5931  15.9630          ?        ?      204.2        3.9       ?       ? 
1 1 1   40   20   34 o    269.7    3.3    0.0000   0.0000          ?        ?   727.9147  17.8786          ?        ?      269.7        3.3       ?       ? 
1 1 1   40   20   35 o     27.4   12.5    0.0000   0.0000          ?        ?   -10.2163  15.3245          ?        ?       27.4       12.5       ?       ? 
1 1 1   40   20   36 o     41.9   15.0    0.0000   0.0000          ?        ?    15.3245  15.9630          ?        ?       41.9       15.0       ?       ? 
1 1 1   40   20   37 o    244.8    3.7    0.0000   0.0000          ?        ?   600.2103  17.8786          ?        ?      244.8        3.7       ?       ? 
1 1 1   40   20   38 o    301.5    3.2    0.0000   0.0000          ?        ?   909.8933  19.1556          ?        ?      301.5        3.2       ?       ? 
1 1 1   40   20   39 o    121.7    6.6    0.0000   0.0000          ?        ?   148.7755  15.9630          ?        ?      121.7        6.6       ?       ? 
1 1 1   40   20   40 o    125.1    6.4    0.0000   0.0000          ?        ?   157.0763  15.9630          ?        ?      125.1        6.4       ?       ? 
1 1 1   40   20   41 o    139.5    5.7    0.0000   0.0000          ?        ?   195.3876  15.9630          ?        ?      139.5        5.7       ?       ? 
1 1 1   40   20   42 o     23.9   11.5    0.0000   0.0000          ?        ?   -25.5409  16.6016          ?        ?       23.9       11.5       ?       ? 
1 1 1   40   20   43 o    210.9    4.2    0.0000   0.0000          ?        ?   445.6881  17.8786          ?        ?      210.9        4.2       ?       ? 
1 1 1   40   20   44 o     19.2    9.7    0.0000   0.0000          ?        ?   -54.2743  17.2401          ?        ?       19.2        9.7       ?       ? 
1 1 1   40   20   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   20   46 o     58.3   14.3    0.0000   0.0000          ?        ?    36.3957  16.6016          ?        ?       58.3       14.3       ?       ? 
1 1 1   40   20   47 o    146.7    5.9    0.0000   0.0000          ?        ?   216.4588  17.2401          ?        ?      146.7        5.9       ?       ? 
1 1 1   40   20   48 o    190.2    4.7    0.0000   0.0000          ?        ?   363.3188  17.8786          ?        ?      190.2        4.7       ?       ? 
1 1 1   40   20   49 o    233.8    4.0    0.0000   0.0000          ?        ?   548.4901  18.5171          ?        ?      233.8        4.0       ?       ? 
1 1 1   40   20   50 o     51.8   15.5    0.0000   0.0000          ?        ?    28.7335  17.2401          ?        ?       51.8       15.5       ?       ? 
1 1 1   40   21    0 o    324.0    4.0 1050.3680  26.1794  1050.3680  26.1794  1050.3680  26.1794      324.0      4.0      324.0        4.0     0.0     0.0 
1 1 1   40   21    1 o    297.6    2.9    0.0000   0.0000          ?        ?   886.2681  17.2401          ?        ?      297.6        2.9       ?       ? 
1 1 1   40   21    2 o    230.6    3.3    0.0000   0.0000          ?        ?   531.8885  15.3245          ?        ?      230.6        3.3       ?       ? 
1 1 1   40   21    3 o    288.5    3.2    0.0000   0.0000          ?        ?   832.6321  18.5171          ?        ?      288.5        3.2       ?       ? 
1 1 1   40   21    4 o     31.6   12.4    0.0000   0.0000          ?        ?     5.7467  11.4934          ?        ?       31.6       12.4       ?       ? 
1 1 1   40   21    5 o    403.8    3.1    0.0000   0.0000          ?        ?  1631.4227  24.9023          ?        ?      403.8        3.1       ?       ? 
1 1 1   40   21    6 o    329.8    2.9    0.0000   0.0000          ?        ?  1088.0408  19.1556          ?        ?      329.8        2.9       ?       ? 
1 1 1   40   21    7 o    165.6    4.4    0.0000   0.0000          ?        ?   274.5643  14.6860          ?        ?      165.6        4.4       ?       ? 
1 1 1   40   21    8 o    269.1    3.4    0.0000   0.0000          ?        ?   724.7220  18.5171          ?        ?      269.1        3.4       ?       ? 
1 1 1   40   21    9 o    525.8    3.2    0.0000   0.0000          ?        ?  2766.0757  33.8416          ?        ?      525.8        3.2       ?       ? 
1 1 1   40   21   10 o    579.1    3.4    0.0000   0.0000          ?        ?  3355.4312  38.9498          ?        ?      579.1        3.4       ?       ? 
1 1 1   40   21   11 o    389.2    3.0    0.0000   0.0000          ?        ?  1515.2118  22.9868          ?        ?      389.2        3.0       ?       ? 
1 1 1   40   21   12 o    210.1    3.0    0.0000   0.0000          ?        ?   441.8569  12.7704          ?        ?      210.1        3.0       ?       ? 
1 1 1   40   21   13 o    495.8    2.8    0.0000   0.0000          ?        ?  2459.5854  28.0950          ?        ?      495.8        2.8       ?       ? 
1 1 1   40   21   14 o    455.1    2.7    0.0000   0.0000          ?        ?  2072.0027  24.2638          ?        ?      455.1        2.7       ?       ? 
1 1 1   40   21   15 o     89.2    6.8    0.0000   0.0000          ?        ?    79.8152  12.1319          ?        ?       89.2        6.8       ?       ? 
1 1 1   40   21   16 o    162.7    4.1    0.0000   0.0000          ?        ?   264.9865  13.4090          ?        ?      162.7        4.1       ?       ? 
1 1 1   40   21   17 o     70.0    6.4    0.0000   0.0000          ?        ?    49.1662   8.9393          ?        ?       70.0        6.4       ?       ? 
1 1 1   40   21   18 o    101.0    5.4    0.0000   0.0000          ?        ?   102.1635  10.8549          ?        ?      101.0        5.4       ?       ? 
1 1 1   40   21   19 o    191.7    3.2    0.0000   0.0000          ?        ?   367.7885  12.1319          ?        ?      191.7        3.2       ?       ? 
1 1 1   40   21   20 o    392.0    2.5    0.0000   0.0000          ?        ?  1536.9215  19.7942          ?        ?      392.0        2.5       ?       ? 
1 1 1   40   21   21 o    164.7    3.7    0.0000   0.0000          ?        ?   271.3717  12.1319          ?        ?      164.7        3.7       ?       ? 
1 1 1   40   21   22 o    189.5    3.4    0.0000   0.0000          ?        ?   359.4877  12.7704          ?        ?      189.5        3.4       ?       ? 
1 1 1   40   21   23 o    263.9    2.9    0.0000   0.0000          ?        ?   696.6271  15.3245          ?        ?      263.9        2.9       ?       ? 
1 1 1   40   21   24 o    180.2    3.7    0.0000   0.0000          ?        ?   325.0075  13.4090          ?        ?      180.2        3.7       ?       ? 
1 1 1   40   21   25 o    286.3    2.9    0.0000   0.0000          ?        ?   819.8618  16.6016          ?        ?      286.3        2.9       ?       ? 
1 1 1   40   21   26 o    360.7    2.6    0.0000   0.0000          ?        ?  1301.3071  18.5171          ?        ?      360.7        2.6       ?       ? 
1 1 1   40   21   27 o    222.4    3.3    0.0000   0.0000          ?        ?   494.8542  14.6860          ?        ?      222.4        3.3       ?       ? 
1 1 1   40   21   28 o    338.1    2.7    0.0000   0.0000          ?        ?  1143.5923  18.5171          ?        ?      338.1        2.7       ?       ? 
1 1 1   40   21   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   21   30 o    116.4    6.3    0.0000   0.0000          ?        ?   136.0051  14.6860          ?        ?      116.4        6.3       ?       ? 
1 1 1   40   21   31 o     37.9   14.3    0.0000   0.0000          ?        ?    10.8549  14.6860          ?        ?       37.9       14.3       ?       ? 
1 1 1   40   21   32 o    221.4    4.0    0.0000   0.0000          ?        ?   491.0231  17.8786          ?        ?      221.4        4.0       ?       ? 
1 1 1   40   21   33 o    213.4    3.9    0.0000   0.0000          ?        ?   455.9044  16.6016          ?        ?      213.4        3.9       ?       ? 
1 1 1   40   21   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   21   35 o    250.3    3.4    0.0000   0.0000          ?        ?   627.0282  17.2401          ?        ?      250.3        3.4       ?       ? 
1 1 1   40   21   36 o    102.7    7.8    0.0000   0.0000          ?        ?   105.9946  15.9630          ?        ?      102.7        7.8       ?       ? 
1 1 1   40   21   37 o    148.6    5.4    0.0000   0.0000          ?        ?   221.5670  15.9630          ?        ?      148.6        5.4       ?       ? 
1 1 1   40   21   38 f    192.2    4.5    0.0000   0.0000          ?        ?   370.3425  17.2401          ?        ?      192.2        4.5       ?       ? 
1 1 1   40   21   39 o     50.3   15.2    0.0000   0.0000          ?        ?    26.1794  16.6016          ?        ?       50.3       15.2       ?       ? 
1 1 1   40   21   40 o    165.5    4.8    0.0000   0.0000          ?        ?   274.5643  15.9630          ?        ?      165.5        4.8       ?       ? 
1 1 1   40   21   41 o    390.4    2.7    0.0000   0.0000          ?        ?  1525.4281  21.0712          ?        ?      390.4        2.7       ?       ? 
1 1 1   40   21   42 o     80.1   10.4    0.0000   0.0000          ?        ?    65.1292  16.6016          ?        ?       80.1       10.4       ?       ? 
1 1 1   40   21   43 o    159.7    5.2    0.0000   0.0000          ?        ?   256.0471  16.6016          ?        ?      159.7        5.2       ?       ? 
1 1 1   40   21   44 o    163.8    5.1    0.0000   0.0000          ?        ?   269.4561  16.6016          ?        ?      163.8        5.1       ?       ? 
1 1 1   40   21   45 o     85.4   10.1    0.0000   0.0000          ?        ?    74.0685  17.2401          ?        ?       85.4       10.1       ?       ? 
1 1 1   40   21   46 o    132.3    6.3    0.0000   0.0000          ?        ?   176.2320  16.6016          ?        ?      132.3        6.3       ?       ? 
1 1 1   40   21   47 o     87.1    9.9    0.0000   0.0000          ?        ?    77.2611  17.2401          ?        ?       87.1        9.9       ?       ? 
1 1 1   40   21   48 o     75.7   11.4    0.0000   0.0000          ?        ?    58.7440  17.2401          ?        ?       75.7       11.4       ?       ? 
1 1 1   40   22    0 o    188.1    5.1  355.0180  19.1556   355.0180  19.1556   355.0180  19.1556      188.1      5.1      188.1        5.1     0.0     0.0 
1 1 1   40   22    1 o    433.9    3.2    0.0000   0.0000          ?        ?  1883.6388  27.4564          ?        ?      433.9        3.2       ?       ? 
1 1 1   40   22    2 o     69.1    8.8    0.0000   0.0000          ?        ?    47.8891  12.1319          ?        ?       69.1        8.8       ?       ? 
1 1 1   40   22    3 o    157.1    4.1    0.0000   0.0000          ?        ?   247.1079  12.7704          ?        ?      157.1        4.1       ?       ? 
1 1 1   40   22    4 o    390.8    2.8    0.0000   0.0000          ?        ?  1527.9823  21.7097          ?        ?      390.8        2.8       ?       ? 
1 1 1   40   22    5 o    213.5    3.3    0.0000   0.0000          ?        ?   455.9044  14.0475          ?        ?      213.5        3.3       ?       ? 
1 1 1   40   22    6 o     44.3   14.4    0.0000   0.0000          ?        ?    19.1556  14.6860          ?        ?       44.3       14.4       ?       ? 
1 1 1   40   22    7 o     92.7    7.9    0.0000   0.0000          ?        ?    86.2004  14.6860          ?        ?       92.7        7.9       ?       ? 
1 1 1   40   22    8 o    254.1    3.1    0.0000   0.0000          ?        ?   646.1838  15.9630          ?        ?      254.1        3.1       ?       ? 
1 1 1   40   22    9 o    462.6    3.3    0.0000   0.0000          ?        ?  2140.9629  30.6490          ?        ?      462.6        3.3       ?       ? 
1 1 1   40   22   10 o    405.7    3.2    0.0000   0.0000          ?        ?  1646.7472  26.1794          ?        ?      405.7        3.2       ?       ? 
1 1 1   40   22   11 o    317.4    3.4    0.0000   0.0000          ?        ?  1008.2256  21.7097          ?        ?      317.4        3.4       ?       ? 
1 1 1   40   22   12 o    338.2    2.6    0.0000   0.0000          ?        ?  1144.2307  17.8786          ?        ?      338.2        2.6       ?       ? 
1 1 1   40   22   13 o     17.7    8.7    0.0000   0.0000          ?        ?   -22.9868  10.8549          ?        ?       17.7        8.7       ?       ? 
1 1 1   40   22   14 o    267.4    3.0    0.0000   0.0000          ?        ?   715.1442  15.9630          ?        ?      267.4        3.0       ?       ? 
1 1 1   40   22   15 o    329.2    2.8    0.0000   0.0000          ?        ?  1084.2097  18.5171          ?        ?      329.2        2.8       ?       ? 
1 1 1   40   22   16 o    179.1    3.7    0.0000   0.0000          ?        ?   321.1764  13.4090          ?        ?      179.1        3.7       ?       ? 
1 1 1   40   22   17 o    146.0    4.4    0.0000   0.0000          ?        ?   213.2662  12.7704          ?        ?      146.0        4.4       ?       ? 
1 1 1   40   22   18 o    153.9    3.3    0.0000   0.0000          ?        ?   236.8915  10.2163          ?        ?      153.9        3.3       ?       ? 
1 1 1   40   22   19 o     24.3   10.7    0.0000   0.0000          ?        ?    -3.1926  10.2163          ?        ?       24.3       10.7       ?       ? 
1 1 1   40   22   20 o    353.9    2.6    0.0000   0.0000          ?        ?  1252.7794  18.5171          ?        ?      353.9        2.6       ?       ? 
1 1 1   40   22   21 o    325.6    2.6    0.0000   0.0000          ?        ?  1060.5845  17.2401          ?        ?      325.6        2.6       ?       ? 
1 1 1   40   22   22 o    354.8    2.5    0.0000   0.0000          ?        ?  1259.1647  17.8786          ?        ?      354.8        2.5       ?       ? 
1 1 1   40   22   23 o    313.1    2.5    0.0000   0.0000          ?        ?   980.7693  15.9630          ?        ?      313.1        2.5       ?       ? 
1 1 1   40   22   24 o    349.8    2.5    0.0000   0.0000          ?        ?  1224.0459  17.2401          ?        ?      349.8        2.5       ?       ? 
1 1 1   40   22   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   22   26 o     98.0    6.8    0.0000   0.0000          ?        ?    96.4168  13.4090          ?        ?       98.0        6.8       ?       ? 
1 1 1   40   22   27 o     69.4    9.7    0.0000   0.0000          ?        ?    48.5276  13.4090          ?        ?       69.4        9.7       ?       ? 
1 1 1   40   22   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   22   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   22   30 o     47.7   13.9    0.0000   0.0000          ?        ?    23.6253  14.0475          ?        ?       47.7       13.9       ?       ? 
1 1 1   40   22   31 o     33.4   13.3    0.0000   0.0000          ?        ?     5.7467  13.4090          ?        ?       33.4       13.3       ?       ? 
1 1 1   40   22   32 o     88.3    8.7    0.0000   0.0000          ?        ?    78.5382  15.3245          ?        ?       88.3        8.7       ?       ? 
1 1 1   40   22   33 o    272.2    3.1    0.0000   0.0000          ?        ?   741.3236  16.6016          ?        ?      272.2        3.1       ?       ? 
1 1 1   40   22   34 o    155.1    5.4    0.0000   0.0000          ?        ?   241.3612  16.6016          ?        ?      155.1        5.4       ?       ? 
1 1 1   40   22   35 o    131.5    6.6    0.0000   0.0000          ?        ?   173.6779  17.2401          ?        ?      131.5        6.6       ?       ? 
1 1 1   40   22   36 o    195.4    4.2    0.0000   0.0000          ?        ?   382.4745  16.6016          ?        ?      195.4        4.2       ?       ? 
1 1 1   40   22   37 o    234.6    3.8    0.0000   0.0000          ?        ?   551.0442  17.8786          ?        ?      234.6        3.8       ?       ? 
1 1 1   40   22   38 o     61.6   13.8    0.0000   0.0000          ?        ?    40.2269  16.6016          ?        ?       61.6       13.8       ?       ? 
1 1 1   40   22   39 o    196.0    4.4    0.0000   0.0000          ?        ?   385.0285  17.2401          ?        ?      196.0        4.4       ?       ? 
1 1 1   40   22   40 o    295.0    3.4    0.0000   0.0000          ?        ?   871.5820  19.7942          ?        ?      295.0        3.4       ?       ? 
1 1 1   40   22   41 o     84.0    9.9    0.0000   0.0000          ?        ?    71.5144  16.6016          ?        ?       84.0        9.9       ?       ? 
1 1 1   40   22   42 o    350.8    2.8    0.0000   0.0000          ?        ?  1232.3467  19.7942          ?        ?      350.8        2.8       ?       ? 
1 1 1   40   22   43 o    162.8    5.5    0.0000   0.0000          ?        ?   266.2635  17.8786          ?        ?      162.8        5.5       ?       ? 
1 1 1   40   22   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   22   45 o    114.1    7.6    0.0000   0.0000          ?        ?   131.5355  17.2401          ?        ?      114.1        7.6       ?       ? 
1 1 1   40   22   46 o    155.3    5.6    0.0000   0.0000          ?        ?   242.6382  17.2401          ?        ?      155.3        5.6       ?       ? 
1 1 1   40   22   47 o     69.7   12.8    0.0000   0.0000          ?        ?    51.7203  17.2401          ?        ?       69.7       12.8       ?       ? 
1 1 1   40   23    0 o    317.0    4.7 1006.3101  30.0105  1006.3101  30.0105  1006.3101  30.0105      317.0      4.7      317.0        4.7     0.0     0.0 
1 1 1   40   23    1 o    214.8    3.6    0.0000   0.0000          ?        ?   461.6512  15.3245          ?        ?      214.8        3.6       ?       ? 
1 1 1   40   23    2 o    278.2    3.0    0.0000   0.0000          ?        ?   774.5267  16.6016          ?        ?      278.2        3.0       ?       ? 
1 1 1   40   23    3 o     49.4   11.2    0.0000   0.0000          ?        ?    25.5409  10.8549          ?        ?       49.4       11.2       ?       ? 
1 1 1   40   23    4 o    407.9    3.4    0.0000   0.0000          ?        ?  1665.2643  28.0950          ?        ?      407.9        3.4       ?       ? 
1 1 1   40   23    5 o    310.0    3.3    0.0000   0.0000          ?        ?   961.6136  20.4327          ?        ?      310.0        3.3       ?       ? 
1 1 1   40   23    6 o     70.4   10.0    0.0000   0.0000          ?        ?    49.8047  14.0475          ?        ?       70.4       10.0       ?       ? 
1 1 1   40   23    7 o     38.0   13.4    0.0000   0.0000          ?        ?    12.7704  12.7704          ?        ?       38.0       13.4       ?       ? 
1 1 1   40   23    8 o    338.9    3.0    0.0000   0.0000          ?        ?  1149.3389  20.4327          ?        ?      338.9        3.0       ?       ? 
1 1 1   40   23    9 o    149.6    4.5    0.0000   0.0000          ?        ?   224.1211  13.4090          ?        ?      149.6        4.5       ?       ? 
1 1 1   40   23   10 o    564.1    3.5    0.0000   0.0000          ?        ?  3184.9458  39.5883          ?        ?      564.1        3.5       ?       ? 
1 1 1   40   23   11 o    365.4    3.1    0.0000   0.0000          ?        ?  1335.7872  22.3483          ?        ?      365.4        3.1       ?       ? 
1 1 1   40   23   12 o    170.6    3.6    0.0000   0.0000          ?        ?   291.1659  12.1319          ?        ?      170.6        3.6       ?       ? 
1 1 1   40   23   13 o    192.1    3.2    0.0000   0.0000          ?        ?   369.0655  12.1319          ?        ?      192.1        3.2       ?       ? 
1 1 1   40   23   14 o    316.7    2.7    0.0000   0.0000          ?        ?  1003.7560  17.2401          ?        ?      316.7        2.7       ?       ? 
1 1 1   40   23   15 o    347.2    2.7    0.0000   0.0000          ?        ?  1206.1674  18.5171          ?        ?      347.2        2.7       ?       ? 
1 1 1   40   23   16 o    390.0    3.2    0.0000   0.0000          ?        ?  1521.5970  24.9023          ?        ?      390.0        3.2       ?       ? 
1 1 1   40   23   17 o     95.1    7.4    0.0000   0.0000          ?        ?    90.6701  14.0475          ?        ?       95.1        7.4       ?       ? 
1 1 1   40   23   18 o    262.1    3.3    0.0000   0.0000          ?        ?   687.6877  17.2401          ?        ?      262.1        3.3       ?       ? 
1 1 1   40   23   19 o    169.5    3.2    0.0000   0.0000          ?        ?   287.3347  10.8549          ?        ?      169.5        3.2       ?       ? 
1 1 1   40   23   20 o    267.4    2.7    0.0000   0.0000          ?        ?   715.1442  14.6860          ?        ?      267.4        2.7       ?       ? 
1 1 1   40   23   21 o     28.9   12.0    0.0000   0.0000          ?        ?     1.9156  11.4934          ?        ?       28.9       12.0       ?       ? 
1 1 1   40   23   22 o     18.7    9.2    0.0000   0.0000          ?        ?   -25.5409  12.1319          ?        ?       18.7        9.2       ?       ? 
1 1 1   40   23   23 o    356.2    2.6    0.0000   0.0000          ?        ?  1269.3810  18.5171          ?        ?      356.2        2.6       ?       ? 
1 1 1   40   23   24 o    478.3    2.6    0.0000   0.0000          ?        ?  2288.4614  24.9023          ?        ?      478.3        2.6       ?       ? 
1 1 1   40   23   25 o    162.5    4.1    0.0000   0.0000          ?        ?   264.3480  13.4090          ?        ?      162.5        4.1       ?       ? 
1 1 1   40   23   26 o    429.0    2.8    0.0000   0.0000          ?        ?  1841.4963  23.6253          ?        ?      429.0        2.8       ?       ? 
1 1 1   40   23   27 o    372.5    2.7    0.0000   0.0000          ?        ?  1388.1460  19.7942          ?        ?      372.5        2.7       ?       ? 
1 1 1   40   23   28 o    351.9    2.7    0.0000   0.0000          ?        ?  1239.3705  19.1556          ?        ?      351.9        2.7       ?       ? 
1 1 1   40   23   29 f    271.3    3.1    0.0000   0.0000          ?        ?   736.8539  16.6016          ?        ?      271.3        3.1       ?       ? 
1 1 1   40   23   30 o    224.6    3.6    0.0000   0.0000          ?        ?   505.0706  15.9630          ?        ?      224.6        3.6       ?       ? 
1 1 1   40   23   31 o    258.2    3.3    0.0000   0.0000          ?        ?   667.2551  17.2401          ?        ?      258.2        3.3       ?       ? 
1 1 1   40   23   32 o    186.4    4.1    0.0000   0.0000          ?        ?   347.9943  15.3245          ?        ?      186.4        4.1       ?       ? 
1 1 1   40   23   33 o    119.6    6.9    0.0000   0.0000          ?        ?   143.6674  16.6016          ?        ?      119.6        6.9       ?       ? 
1 1 1   40   23   34 o    235.7    3.5    0.0000   0.0000          ?        ?   556.1523  16.6016          ?        ?      235.7        3.5       ?       ? 
1 1 1   40   23   35 o    273.4    3.3    0.0000   0.0000          ?        ?   748.3474  17.8786          ?        ?      273.4        3.3       ?       ? 
1 1 1   40   23   36 o    261.3    3.3    0.0000   0.0000          ?        ?   683.8566  17.2401          ?        ?      261.3        3.3       ?       ? 
1 1 1   40   23   37 o    194.5    4.3    0.0000   0.0000          ?        ?   379.2819  16.6016          ?        ?      194.5        4.3       ?       ? 
1 1 1   40   23   38 f    154.7    5.2    0.0000   0.0000          ?        ?   240.0841  15.9630          ?        ?      154.7        5.2       ?       ? 
1 1 1   40   23   39 f     20.5   10.2    0.0000   0.0000          ?        ?   -38.3113  15.9630          ?        ?       20.5       10.2       ?       ? 
1 1 1   40   23   40 o    146.8    5.9    0.0000   0.0000          ?        ?   216.4588  17.2401          ?        ?      146.8        5.9       ?       ? 
1 1 1   40   23   41 o    385.8    2.8    0.0000   0.0000          ?        ?  1490.3094  21.7097          ?        ?      385.8        2.8       ?       ? 
1 1 1   40   23   42 o     41.9   15.5    0.0000   0.0000          ?        ?    14.6860  17.2401          ?        ?       41.9       15.5       ?       ? 
1 1 1   40   23   43 o     53.6   15.3    0.0000   0.0000          ?        ?    30.6490  17.2401          ?        ?       53.6       15.3       ?       ? 
1 1 1   40   23   44 o    111.5    8.0    0.0000   0.0000          ?        ?   125.7888  17.8786          ?        ?      111.5        8.0       ?       ? 
1 1 1   40   23   45 o    162.5    5.5    0.0000   0.0000          ?        ?   265.6250  17.8786          ?        ?      162.5        5.5       ?       ? 
1 1 1   40   23   46 o    185.7    4.8    0.0000   0.0000          ?        ?   346.7172  17.8786          ?        ?      185.7        4.8       ?       ? 
1 1 1   40   24    0 o    340.4    3.8 1159.5553  26.1794  1159.5553  26.1794  1159.5553  26.1794      340.4      3.8      340.4        3.8     0.0     0.0 
1 1 1   40   24    1 o    312.7    3.2    0.0000   0.0000          ?        ?   978.2151  19.7942          ?        ?      312.7        3.2       ?       ? 
1 1 1   40   24    2 o    519.2    3.7    0.0000   0.0000          ?        ?  2697.7539  38.3113          ?        ?      519.2        3.7       ?       ? 
1 1 1   40   24    3 o    456.8    3.6    0.0000   0.0000          ?        ?  2087.9658  33.2031          ?        ?      456.8        3.6       ?       ? 
1 1 1   40   24    4 o    263.6    3.4    0.0000   0.0000          ?        ?   695.3500  17.8786          ?        ?      263.6        3.4       ?       ? 
1 1 1   40   24    5 o     38.4   12.8    0.0000   0.0000          ?        ?    14.0475  11.4934          ?        ?       38.4       12.8       ?       ? 
1 1 1   40   24    6 o    114.3    4.7    0.0000   0.0000          ?        ?   130.8969  10.8549          ?        ?      114.3        4.7       ?       ? 
1 1 1   40   24    7 o    232.6    3.2    0.0000   0.0000          ?        ?   541.4664  14.6860          ?        ?      232.6        3.2       ?       ? 
1 1 1   40   24    8 o    208.4    3.5    0.0000   0.0000          ?        ?   434.8332  14.6860          ?        ?      208.4        3.5       ?       ? 
1 1 1   40   24    9 o    342.6    3.5    0.0000   0.0000          ?        ?  1174.8798  24.2638          ?        ?      342.6        3.5       ?       ? 
1 1 1   40   24   10 o    517.4    3.4    0.0000   0.0000          ?        ?  2679.2368  35.1187          ?        ?      517.4        3.4       ?       ? 
1 1 1   40   24   11 o    104.1    6.4    0.0000   0.0000          ?        ?   108.5487  13.4090          ?        ?      104.1        6.4       ?       ? 
1 1 1   40   24   12 o    279.4    3.2    0.0000   0.0000          ?        ?   780.9120  17.8786          ?        ?      279.4        3.2       ?       ? 
1 1 1   40   24   13 o     74.8    6.8    0.0000   0.0000          ?        ?    56.1899  10.2163          ?        ?       74.8        6.8       ?       ? 
1 1 1   40   24   14 o    188.9    3.4    0.0000   0.0000          ?        ?   356.9336  12.7704          ?        ?      188.9        3.4       ?       ? 
1 1 1   40   24   15 o     20.2    9.8    0.0000   0.0000          ?        ?   -19.7942  12.1319          ?        ?       20.2        9.8       ?       ? 
1 1 1   40   24   16 o    251.3    3.4    0.0000   0.0000          ?        ?   632.1364  17.2401          ?        ?      251.3        3.4       ?       ? 
1 1 1   40   24   17 o    296.0    3.1    0.0000   0.0000          ?        ?   876.6902  18.5171          ?        ?      296.0        3.1       ?       ? 
1 1 1   40   24   18 o    253.5    3.4    0.0000   0.0000          ?        ?   642.9913  17.2401          ?        ?      253.5        3.4       ?       ? 
1 1 1   40   24   19 o    167.9    4.2    0.0000   0.0000          ?        ?   282.2266  14.0475          ?        ?      167.9        4.2       ?       ? 
1 1 1   40   24   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   24   21 o    166.8    3.8    0.0000   0.0000          ?        ?   278.3954  12.7704          ?        ?      166.8        3.8       ?       ? 
1 1 1   40   24   22 o    157.5    4.1    0.0000   0.0000          ?        ?   248.3849  12.7704          ?        ?      157.5        4.1       ?       ? 
1 1 1   40   24   23 o    481.8    2.5    0.0000   0.0000          ?        ?  2322.3032  24.2638          ?        ?      481.8        2.5       ?       ? 
1 1 1   40   24   24 o     25.1   11.4    0.0000   0.0000          ?        ?    -6.3852  12.1319          ?        ?       25.1       11.4       ?       ? 
1 1 1   40   24   25 o    135.7    4.9    0.0000   0.0000          ?        ?   184.5327  13.4090          ?        ?      135.7        4.9       ?       ? 
1 1 1   40   24   26 o    344.4    2.7    0.0000   0.0000          ?        ?  1187.0117  18.5171          ?        ?      344.4        2.7       ?       ? 
1 1 1   40   24   27 o    155.8    4.3    0.0000   0.0000          ?        ?   243.2767  13.4090          ?        ?      155.8        4.3       ?       ? 
1 1 1   40   24   28 o    215.6    3.4    0.0000   0.0000          ?        ?   465.4823  14.6860          ?        ?      215.6        3.4       ?       ? 
1 1 1   40   24   29 o    374.9    2.7    0.0000   0.0000          ?        ?  1406.6632  20.4327          ?        ?      374.9        2.7       ?       ? 
1 1 1   40   24   30 o    249.3    3.2    0.0000   0.0000          ?        ?   621.9200  15.9630          ?        ?      249.3        3.2       ?       ? 
1 1 1   40   24   31 o    120.7    6.1    0.0000   0.0000          ?        ?   146.2215  14.6860          ?        ?      120.7        6.1       ?       ? 
1 1 1   40   24   32 o    223.9    3.4    0.0000   0.0000          ?        ?   501.8780  15.3245          ?        ?      223.9        3.4       ?       ? 
1 1 1   40   24   33 o    152.7    5.0    0.0000   0.0000          ?        ?   233.6989  15.3245          ?        ?      152.7        5.0       ?       ? 
1 1 1   40   24   34 o    329.0    2.9    0.0000   0.0000          ?        ?  1083.5712  19.1556          ?        ?      329.0        2.9       ?       ? 
1 1 1   40   24   35 o    181.3    4.4    0.0000   0.0000          ?        ?   329.4771  15.9630          ?        ?      181.3        4.4       ?       ? 
1 1 1   40   24   36 o    121.1    6.3    0.0000   0.0000          ?        ?   147.4985  15.3245          ?        ?      121.1        6.3       ?       ? 
1 1 1   40   24   37 o     63.1   13.1    0.0000   0.0000          ?        ?    42.1424  15.9630          ?        ?       63.1       13.1       ?       ? 
1 1 1   40   24   38 o    100.6    7.9    0.0000   0.0000          ?        ?   102.1635  15.9630          ?        ?      100.6        7.9       ?       ? 
1 1 1   40   24   39 o    162.7    4.7    0.0000   0.0000          ?        ?   265.6250  15.3245          ?        ?      162.7        4.7       ?       ? 
1 1 1   40   24   40 f    118.6    7.0    0.0000   0.0000          ?        ?   141.7518  16.6016          ?        ?      118.6        7.0       ?       ? 
1 1 1   40   24   41 o    166.3    5.0    0.0000   0.0000          ?        ?   277.7569  16.6016          ?        ?      166.3        5.0       ?       ? 
1 1 1   40   24   42 o    270.3    3.2    0.0000   0.0000          ?        ?   731.7458  17.2401          ?        ?      270.3        3.2       ?       ? 
1 1 1   40   24   43 o     27.3   12.6    0.0000   0.0000          ?        ?   -11.4934  15.9630          ?        ?       27.3       12.6       ?       ? 
1 1 1   40   24   44 o    409.3    2.7    0.0000   0.0000          ?        ?  1678.0348  22.3483          ?        ?      409.3        2.7       ?       ? 
1 1 1   40   25    0 f    165.5    7.0  275.8413  22.9868   275.8413  22.9868   275.8413  22.9868      165.5      7.0      165.5        7.0     0.0     0.0 
1 1 1   40   25    1 o    284.9    3.9    0.0000   0.0000          ?        ?   812.1995  22.3483          ?        ?      284.9        3.9       ?       ? 
1 1 1   40   25    2 o    164.4    4.3    0.0000   0.0000          ?        ?   270.7332  14.0475          ?        ?      164.4        4.3       ?       ? 
1 1 1   40   25    3 o    209.4    2.9    0.0000   0.0000          ?        ?   438.6643  12.1319          ?        ?      209.4        2.9       ?       ? 
1 1 1   40   25    4 o     67.2    7.1    0.0000   0.0000          ?        ?    45.3350   9.5778          ?        ?       67.2        7.1       ?       ? 
1 1 1   40   25    5 o    135.8    3.8    0.0000   0.0000          ?        ?   184.5327  10.2163          ?        ?      135.8        3.8       ?       ? 
1 1 1   40   25    6 f    267.5    3.2    0.0000   0.0000          ?        ?   715.7827  17.2401          ?        ?      267.5        3.2       ?       ? 
1 1 1   40   25    7 o    457.2    3.6    0.0000   0.0000          ?        ?  2092.4355  32.5646          ?        ?      457.2        3.6       ?       ? 
1 1 1   40   25    8 o    329.0    2.9    0.0000   0.0000          ?        ?  1082.9327  19.1556          ?        ?      329.0        2.9       ?       ? 
1 1 1   40   25    9 o    205.8    3.6    0.0000   0.0000          ?        ?   423.9784  14.6860          ?        ?      205.8        3.6       ?       ? 
1 1 1   40   25   10 o    495.3    3.4    0.0000   0.0000          ?        ?  2455.1157  33.2031          ?        ?      495.3        3.4       ?       ? 
1 1 1   40   25   11 o    242.5    3.4    0.0000   0.0000          ?        ?   588.7169  16.6016          ?        ?      242.5        3.4       ?       ? 
1 1 1   40   25   12 o    242.8    3.7    0.0000   0.0000          ?        ?   589.9940  17.8786          ?        ?      242.8        3.7       ?       ? 
1 1 1   40   25   13 o    143.2    5.3    0.0000   0.0000          ?        ?   205.6040  15.3245          ?        ?      143.2        5.3       ?       ? 
1 1 1   40   25   14 o    371.8    3.0    0.0000   0.0000          ?        ?  1383.0378  22.3483          ?        ?      371.8        3.0       ?       ? 
1 1 1   40   25   15 o    119.2    5.4    0.0000   0.0000          ?        ?   142.3903  12.7704          ?        ?      119.2        5.4       ?       ? 
1 1 1   40   25   16 o    242.8    3.3    0.0000   0.0000          ?        ?   589.9940  15.9630          ?        ?      242.8        3.3       ?       ? 
1 1 1   40   25   17 o    112.3    6.0    0.0000   0.0000          ?        ?   126.4273  13.4090          ?        ?      112.3        6.0       ?       ? 
1 1 1   40   25   18 o    359.0    3.1    0.0000   0.0000          ?        ?  1289.8137  22.3483          ?        ?      359.0        3.1       ?       ? 
1 1 1   40   25   19 o     92.3    7.3    0.0000   0.0000          ?        ?    85.5619  13.4090          ?        ?       92.3        7.3       ?       ? 
1 1 1   40   25   20 o    175.0    3.1    0.0000   0.0000          ?        ?   306.4904  10.8549          ?        ?      175.0        3.1       ?       ? 
1 1 1   40   25   21 o    264.3    2.7    0.0000   0.0000          ?        ?   699.1812  14.0475          ?        ?      264.3        2.7       ?       ? 
1 1 1   40   25   22 o    313.4    2.5    0.0000   0.0000          ?        ?   982.6848  15.9630          ?        ?      313.4        2.5       ?       ? 
1 1 1   40   25   23 o     50.5   12.1    0.0000   0.0000          ?        ?    26.8179  12.1319          ?        ?       50.5       12.1       ?       ? 
1 1 1   40   25   24 o    368.6    2.6    0.0000   0.0000          ?        ?  1359.4125  19.1556          ?        ?      368.6        2.6       ?       ? 
1 1 1   40   25   25 o    317.7    2.6    0.0000   0.0000          ?        ?  1010.1412  16.6016          ?        ?      317.7        2.6       ?       ? 
1 1 1   40   25   26 o    251.2    2.9    0.0000   0.0000          ?        ?   631.4979  14.6860          ?        ?      251.2        2.9       ?       ? 
1 1 1   40   25   27 o    117.5    5.7    0.0000   0.0000          ?        ?   138.5592  13.4090          ?        ?      117.5        5.7       ?       ? 
1 1 1   40   25   28 o    234.6    3.1    0.0000   0.0000          ?        ?   551.0442  14.6860          ?        ?      234.6        3.1       ?       ? 
1 1 1   40   25   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   25   30 o     58.2   12.4    0.0000   0.0000          ?        ?    35.7572  14.0475          ?        ?       58.2       12.4       ?       ? 
1 1 1   40   25   31 o    142.0    5.4    0.0000   0.0000          ?        ?   202.4114  15.3245          ?        ?      142.0        5.4       ?       ? 
1 1 1   40   25   32 o     20.2   10.0    0.0000   0.0000          ?        ?   -32.5646  14.6860          ?        ?       20.2       10.0       ?       ? 
1 1 1   40   25   33 o    284.6    3.0    0.0000   0.0000          ?        ?   810.9225  17.2401          ?        ?      284.6        3.0       ?       ? 
1 1 1   40   25   34 o    195.4    4.1    0.0000   0.0000          ?        ?   382.4745  15.9630          ?        ?      195.4        4.1       ?       ? 
1 1 1   40   25   35 o    166.8    4.6    0.0000   0.0000          ?        ?   279.0340  15.3245          ?        ?      166.8        4.6       ?       ? 
1 1 1   40   25   36 o    134.6    5.7    0.0000   0.0000          ?        ?   181.9787  15.3245          ?        ?      134.6        5.7       ?       ? 
1 1 1   40   25   37 o    171.7    4.5    0.0000   0.0000          ?        ?   295.6355  15.3245          ?        ?      171.7        4.5       ?       ? 
1 1 1   40   25   38 o    155.8    5.3    0.0000   0.0000          ?        ?   243.9153  16.6016          ?        ?      155.8        5.3       ?       ? 
1 1 1   40   25   39 o    196.1    4.4    0.0000   0.0000          ?        ?   385.6671  17.2401          ?        ?      196.1        4.4       ?       ? 
1 1 1   40   25   40 o     37.7   14.7    0.0000   0.0000          ?        ?     9.5778  15.9630          ?        ?       37.7       14.7       ?       ? 
1 1 1   40   25   41 o    170.1    4.7    0.0000   0.0000          ?        ?   290.5273  15.9630          ?        ?      170.1        4.7       ?       ? 
1 1 1   40   25   42 o    136.0    6.1    0.0000   0.0000          ?        ?   186.4483  16.6016          ?        ?      136.0        6.1       ?       ? 
1 1 1   40   25   43 o     26.1   12.3    0.0000   0.0000          ?        ?   -17.2401  16.6016          ?        ?       26.1       12.3       ?       ? 
1 1 1   40   26    0 o    271.8    6.9  741.3236  37.6728   741.3236  37.6728   741.3236  37.6728      271.8      6.9      271.8        6.9     0.0     0.0 
1 1 1   40   26    1 o    204.6    7.2    0.0000   0.0000          ?        ?   420.1472  29.3720          ?        ?      204.6        7.2       ?       ? 
1 1 1   40   26    2 o     91.2    9.5    0.0000   0.0000          ?        ?    83.6463  17.2401          ?        ?       91.2        9.5       ?       ? 
1 1 1   40   26    3 o    228.2    5.3    0.0000   0.0000          ?        ?   521.6721  24.2638          ?        ?      228.2        5.3       ?       ? 
1 1 1   40   26    4 o    270.5    4.1    0.0000   0.0000          ?        ?   732.3843  22.3483          ?        ?      270.5        4.1       ?       ? 
1 1 1   40   26    5 o     92.3    7.3    0.0000   0.0000          ?        ?    85.5619  13.4090          ?        ?       92.3        7.3       ?       ? 
1 1 1   40   26    6 o    214.1    4.0    0.0000   0.0000          ?        ?   459.0970  17.2401          ?        ?      214.1        4.0       ?       ? 
1 1 1   40   26    7 o    309.6    3.6    0.0000   0.0000          ?        ?   959.6980  22.3483          ?        ?      309.6        3.6       ?       ? 
1 1 1   40   26    8 o    178.7    5.4    0.0000   0.0000          ?        ?   319.8993  19.1556          ?        ?      178.7        5.4       ?       ? 
1 1 1   40   26    9 o    661.2    3.9    0.0000   0.0000          ?        ?  4377.0659  51.7203          ?        ?      661.2        3.9       ?       ? 
1 1 1   40   26   10 o    290.8    3.3    0.0000   0.0000          ?        ?   846.0411  19.1556          ?        ?      290.8        3.3       ?       ? 
1 1 1   40   26   11 o    119.2    5.6    0.0000   0.0000          ?        ?   142.3903  13.4090          ?        ?      119.2        5.6       ?       ? 
1 1 1   40   26   12 o    161.3    4.8    0.0000   0.0000          ?        ?   260.5168  15.3245          ?        ?      161.3        4.8       ?       ? 
1 1 1   40   26   13 o    666.8    4.3    0.0000   0.0000          ?        ?  4451.7729  56.8284          ?        ?      666.8        4.3       ?       ? 
1 1 1   40   26   14 o    315.8    3.2    0.0000   0.0000          ?        ?   998.0093  20.4327          ?        ?      315.8        3.2       ?       ? 
1 1 1   40   26   15 o    166.0    3.8    0.0000   0.0000          ?        ?   275.8413  12.7704          ?        ?      166.0        3.8       ?       ? 
1 1 1   40   26   16 o     28.5   12.1    0.0000   0.0000          ?        ?     0.0000  12.1319          ?        ?       28.5       12.1       ?       ? 
1 1 1   40   26   17 o    284.3    3.1    0.0000   0.0000          ?        ?   809.0069  17.8786          ?        ?      284.3        3.1       ?       ? 
1 1 1   40   26   18 o    107.9    6.2    0.0000   0.0000          ?        ?   116.8494  13.4090          ?        ?      107.9        6.2       ?       ? 
1 1 1   40   26   19 o    361.2    3.1    0.0000   0.0000          ?        ?  1305.7767  22.3483          ?        ?      361.2        3.1       ?       ? 
1 1 1   40   26   20 o    402.6    3.2    0.0000   0.0000          ?        ?  1622.4835  25.5409          ?        ?      402.6        3.2       ?       ? 
1 1 1   40   26   21 o    307.4    2.5    0.0000   0.0000          ?        ?   945.6506  15.3245          ?        ?      307.4        2.5       ?       ? 
1 1 1   40   26   22 o    409.4    2.5    0.0000   0.0000          ?        ?  1676.7578  20.4327          ?        ?      409.4        2.5       ?       ? 
1 1 1   40   26   23 o    163.2    4.1    0.0000   0.0000          ?        ?   266.9020  13.4090          ?        ?      163.2        4.1       ?       ? 
1 1 1   40   26   24 o    230.5    3.0    0.0000   0.0000          ?        ?   531.8885  14.0475          ?        ?      230.5        3.0       ?       ? 
1 1 1   40   26   25 o     99.6    6.4    0.0000   0.0000          ?        ?    99.6094  12.7704          ?        ?       99.6        6.4       ?       ? 
1 1 1   40   26   26 o    270.2    2.8    0.0000   0.0000          ?        ?   730.4688  15.3245          ?        ?      270.2        2.8       ?       ? 
1 1 1   40   26   27 o    187.3    3.8    0.0000   0.0000          ?        ?   351.1869  14.0475          ?        ?      187.3        3.8       ?       ? 
1 1 1   40   26   28 o    178.5    3.8    0.0000   0.0000          ?        ?   319.2608  13.4090          ?        ?      178.5        3.8       ?       ? 
1 1 1   40   26   29 o    188.8    3.7    0.0000   0.0000          ?        ?   356.9336  14.0475          ?        ?      188.8        3.7       ?       ? 
1 1 1   40   26   30 o    194.9    4.1    0.0000   0.0000          ?        ?   380.5589  15.9630          ?        ?      194.9        4.1       ?       ? 
1 1 1   40   26   31 o    340.8    2.7    0.0000   0.0000          ?        ?  1162.7479  18.5171          ?        ?      340.8        2.7       ?       ? 
1 1 1   40   26   32 o    229.5    3.3    0.0000   0.0000          ?        ?   527.4188  15.3245          ?        ?      229.5        3.3       ?       ? 
1 1 1   40   26   33 o    224.7    3.7    0.0000   0.0000          ?        ?   505.7091  16.6016          ?        ?      224.7        3.7       ?       ? 
1 1 1   40   26   34 o    111.5    6.6    0.0000   0.0000          ?        ?   125.1502  14.6860          ?        ?      111.5        6.6       ?       ? 
1 1 1   40   26   35 o     72.6   11.0    0.0000   0.0000          ?        ?    53.6358  15.9630          ?        ?       72.6       11.0       ?       ? 
1 1 1   40   26   36 o     20.9   10.3    0.0000   0.0000          ?        ?   -32.5646  15.3245          ?        ?       20.9       10.3       ?       ? 
1 1 1   40   26   37 o    205.5    4.0    0.0000   0.0000          ?        ?   423.3398  16.6016          ?        ?      205.5        4.0       ?       ? 
1 1 1   40   26   38 f     51.3   14.4    0.0000   0.0000          ?        ?    28.0950  15.3245          ?        ?       51.3       14.4       ?       ? 
1 1 1   40   26   39 o    148.2    5.4    0.0000   0.0000          ?        ?   220.9285  15.9630          ?        ?      148.2        5.4       ?       ? 
1 1 1   40   26   40 o     26.2   12.2    0.0000   0.0000          ?        ?   -12.7704  15.3245          ?        ?       26.2       12.2       ?       ? 
1 1 1   40   26   41 o    142.4    5.8    0.0000   0.0000          ?        ?   204.3269  16.6016          ?        ?      142.4        5.8       ?       ? 
1 1 1   40   27    0 o    213.5    9.2  459.7356  38.9498   459.7356  38.9498   459.7356  38.9498      213.5      9.2      213.5        9.2     0.0     0.0 
1 1 1   40   27    1 o    136.2    8.2    0.0000   0.0000          ?        ?   186.4483  22.3483          ?        ?      136.2        8.2       ?       ? 
1 1 1   40   27    2 o    243.2    7.2    0.0000   0.0000          ?        ?   593.8251  35.1187          ?        ?      243.2        7.2       ?       ? 
1 1 1   40   27    3 o    243.0    9.3    0.0000   0.0000          ?        ?   594.4636  45.3350          ?        ?      243.0        9.3       ?       ? 
1 1 1   40   27    4 o    381.2    4.0    0.0000   0.0000          ?        ?  1455.1908  30.6490          ?        ?      381.2        4.0       ?       ? 
1 1 1   40   27    5 o    437.7    4.2    0.0000   0.0000          ?        ?  1918.1189  37.0343          ?        ?      437.7        4.2       ?       ? 
1 1 1   40   27    6 o    183.2    7.3    0.0000   0.0000          ?        ?   337.1394  26.8179          ?        ?      183.2        7.3       ?       ? 
1 1 1   40   27    7 o    353.3    3.7    0.0000   0.0000          ?        ?  1249.5868  26.1794          ?        ?      353.3        3.7       ?       ? 
1 1 1   40   27    8 o    368.1    3.9    0.0000   0.0000          ?        ?  1356.8584  28.7335          ?        ?      368.1        3.9       ?       ? 
1 1 1   40   27    9 o    323.6    3.9    0.0000   0.0000          ?        ?  1048.4525  25.5409          ?        ?      323.6        3.9       ?       ? 
1 1 1   40   27   10 o    160.2    6.0    0.0000   0.0000          ?        ?   257.3242  19.1556          ?        ?      160.2        6.0       ?       ? 
1 1 1   40   27   11 o    218.2    4.8    0.0000   0.0000          ?        ?   476.9756  21.0712          ?        ?      218.2        4.8       ?       ? 
1 1 1   40   27   12 o    126.0    4.6    0.0000   0.0000          ?        ?   158.9919  11.4934          ?        ?      126.0        4.6       ?       ? 
1 1 1   40   27   13 o    171.5    4.1    0.0000   0.0000          ?        ?   294.3585  14.0475          ?        ?      171.5        4.1       ?       ? 
1 1 1   40   27   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   27   15 o    151.1    3.8    0.0000   0.0000          ?        ?   228.5907  11.4934          ?        ?      151.1        3.8       ?       ? 
1 1 1   40   27   16 o    329.0    2.9    0.0000   0.0000          ?        ?  1082.9327  19.1556          ?        ?      329.0        2.9       ?       ? 
1 1 1   40   27   17 o    292.0    3.3    0.0000   0.0000          ?        ?   853.7034  19.1556          ?        ?      292.0        3.3       ?       ? 
1 1 1   40   27   18 o     45.2   13.3    0.0000   0.0000          ?        ?    21.0712  12.7704          ?        ?       45.2       13.3       ?       ? 
1 1 1   40   27   19 o    195.4    3.8    0.0000   0.0000          ?        ?   382.4745  14.6860          ?        ?      195.4        3.8       ?       ? 
1 1 1   40   27   20 o    305.3    3.0    0.0000   0.0000          ?        ?   932.8801  18.5171          ?        ?      305.3        3.0       ?       ? 
1 1 1   40   27   21 o    171.4    4.5    0.0000   0.0000          ?        ?   294.3585  15.3245          ?        ?      171.4        4.5       ?       ? 
1 1 1   40   27   22 o    208.0    2.9    0.0000   0.0000          ?        ?   432.9177  12.1319          ?        ?      208.0        2.9       ?       ? 
1 1 1   40   27   23 o    465.0    2.6    0.0000   0.0000          ?        ?  2163.9497  24.2638          ?        ?      465.0        2.6       ?       ? 
1 1 1   40   27   24 o    102.1    6.3    0.0000   0.0000          ?        ?   104.7175  12.7704          ?        ?      102.1        6.3       ?       ? 
1 1 1   40   27   25 o    180.9    3.7    0.0000   0.0000          ?        ?   327.5616  13.4090          ?        ?      180.9        3.7       ?       ? 
1 1 1   40   27   26 o     31.4   12.8    0.0000   0.0000          ?        ?     3.8311  12.7704          ?        ?       31.4       12.8       ?       ? 
1 1 1   40   27   27 o    277.3    2.9    0.0000   0.0000          ?        ?   769.4186  15.9630          ?        ?      277.3        2.9       ?       ? 
1 1 1   40   27   28 f    172.0    3.9    0.0000   0.0000          ?        ?   296.2740  13.4090          ?        ?      172.0        3.9       ?       ? 
1 1 1   40   27   29 o    152.0    4.6    0.0000   0.0000          ?        ?   231.7833  14.0475          ?        ?      152.0        4.6       ?       ? 
1 1 1   40   27   30 o    184.6    4.2    0.0000   0.0000          ?        ?   341.6091  15.3245          ?        ?      184.6        4.2       ?       ? 
1 1 1   40   27   31 o    366.5    2.7    0.0000   0.0000          ?        ?  1344.7266  19.7942          ?        ?      366.5        2.7       ?       ? 
1 1 1   40   27   32 o    233.3    3.3    0.0000   0.0000          ?        ?   545.2975  15.3245          ?        ?      233.3        3.3       ?       ? 
1 1 1   40   27   33 o     29.8   12.9    0.0000   0.0000          ?        ?    -1.2770  14.0475          ?        ?       29.8       12.9       ?       ? 
1 1 1   40   27   34 o     34.7   13.9    0.0000   0.0000          ?        ?     6.3852  14.6860          ?        ?       34.7       13.9       ?       ? 
1 1 1   40   27   35 o     26.2   12.2    0.0000   0.0000          ?        ?   -12.7704  15.3245          ?        ?       26.2       12.2       ?       ? 
1 1 1   40   27   36 o     76.9    9.6    0.0000   0.0000          ?        ?    60.0210  14.6860          ?        ?       76.9        9.6       ?       ? 
1 1 1   40   27   37 o     23.4   11.2    0.0000   0.0000          ?        ?   -19.1556  14.6860          ?        ?       23.4       11.2       ?       ? 
1 1 1   40   27   38 o    133.8    5.5    0.0000   0.0000          ?        ?   180.0631  14.6860          ?        ?      133.8        5.5       ?       ? 
1 1 1   40   27   39 o    168.9    4.7    0.0000   0.0000          ?        ?   286.6962  15.9630          ?        ?      168.9        4.7       ?       ? 
1 1 1   40   28    0 o    343.2    9.7 1185.0962  66.4062  1185.0962  66.4062  1185.0962  66.4062      343.2      9.7      343.2        9.7     0.0     0.0 
1 1 1   40   28    1 o    151.2    9.9    0.0000   0.0000          ?        ?   230.5063  30.0105          ?        ?      151.2        9.9       ?       ? 
1 1 1   40   28    2 o    516.0    4.8    0.0000   0.0000          ?        ?  2667.1050  49.1662          ?        ?      516.0        4.8       ?       ? 
1 1 1   40   28    3 o    497.4    4.9    0.0000   0.0000          ?        ?  2479.3794  49.1662          ?        ?      497.4        4.9       ?       ? 
1 1 1   40   28    4 o    251.1    6.5    0.0000   0.0000          ?        ?   632.7749  32.5646          ?        ?      251.1        6.5       ?       ? 
1 1 1   40   28    5 o    125.0   10.7    0.0000   0.0000          ?        ?   157.7148  26.8179          ?        ?      125.0       10.7       ?       ? 
1 1 1   40   28    6 o    278.6    4.1    0.0000   0.0000          ?        ?   777.0808  22.9868          ?        ?      278.6        4.1       ?       ? 
1 1 1   40   28    7 o     83.0   11.2    0.0000   0.0000          ?        ?    69.5989  18.5171          ?        ?       83.0       11.2       ?       ? 
1 1 1   40   28    8 o    150.7    6.4    0.0000   0.0000          ?        ?   227.9522  19.1556          ?        ?      150.7        6.4       ?       ? 
1 1 1   40   28    9 o    376.3    4.2    0.0000   0.0000          ?        ?  1418.1566  31.9261          ?        ?      376.3        4.2       ?       ? 
1 1 1   40   28   10 o    132.8    6.5    0.0000   0.0000          ?        ?   176.8705  17.2401          ?        ?      132.8        6.5       ?       ? 
1 1 1   40   28   11 f    153.1    5.8    0.0000   0.0000          ?        ?   234.9760  17.8786          ?        ?      153.1        5.8       ?       ? 
1 1 1   40   28   12 f     77.7   14.1    0.0000   0.0000          ?        ?    63.2136  21.0712          ?        ?       77.7       14.1       ?       ? 
1 1 1   40   28   13 o    111.7    9.1    0.0000   0.0000          ?        ?   125.7888  20.4327          ?        ?      111.7        9.1       ?       ? 
1 1 1   40   28   14 o    326.6    3.2    0.0000   0.0000          ?        ?  1067.6082  21.0712          ?        ?      326.6        3.2       ?       ? 
1 1 1   40   28   15 o    339.8    3.2    0.0000   0.0000          ?        ?  1155.7241  21.7097          ?        ?      339.8        3.2       ?       ? 
1 1 1   40   28   16 o    253.8    3.1    0.0000   0.0000          ?        ?   644.9069  15.9630          ?        ?      253.8        3.1       ?       ? 
1 1 1   40   28   17 o     20.0    9.7    0.0000   0.0000          ?        ?   -23.6253  12.7704          ?        ?       20.0        9.7       ?       ? 
1 1 1   40   28   18 o     49.3   13.3    0.0000   0.0000          ?        ?    25.5409  13.4090          ?        ?       49.3       13.3       ?       ? 
1 1 1   40   28   19 o    290.1    3.2    0.0000   0.0000          ?        ?   842.2100  18.5171          ?        ?      290.1        3.2       ?       ? 
1 1 1   40   28   20 o    111.6    6.6    0.0000   0.0000          ?        ?   125.1502  14.6860          ?        ?      111.6        6.6       ?       ? 
1 1 1   40   28   21 f    188.1    4.1    0.0000   0.0000          ?        ?   354.3795  15.3245          ?        ?      188.1        4.1       ?       ? 
1 1 1   40   28   22 o     22.3   10.1    0.0000   0.0000          ?        ?    -5.1082   9.5778          ?        ?       22.3       10.1       ?       ? 
1 1 1   40   28   23 o    225.6    3.0    0.0000   0.0000          ?        ?   509.5403  13.4090          ?        ?      225.6        3.0       ?       ? 
1 1 1   40   28   24 o    203.1    3.1    0.0000   0.0000          ?        ?   413.1235  12.7704          ?        ?      203.1        3.1       ?       ? 
1 1 1   40   28   25 o     50.4   11.6    0.0000   0.0000          ?        ?    26.8179  11.4934          ?        ?       50.4       11.6       ?       ? 
1 1 1   40   28   26 o    185.7    3.6    0.0000   0.0000          ?        ?   345.4402  13.4090          ?        ?      185.7        3.6       ?       ? 
1 1 1   40   28   27 o    339.6    2.6    0.0000   0.0000          ?        ?  1154.4471  17.8786          ?        ?      339.6        2.6       ?       ? 
1 1 1   40   28   28 o    151.6    4.6    0.0000   0.0000          ?        ?   230.5063  14.0475          ?        ?      151.6        4.6       ?       ? 
1 1 1   40   28   29 o    101.1    6.3    0.0000   0.0000          ?        ?   102.8020  12.7704          ?        ?      101.1        6.3       ?       ? 
1 1 1   40   28   30 o    124.3    5.7    0.0000   0.0000          ?        ?   155.1608  14.0475          ?        ?      124.3        5.7       ?       ? 
1 1 1   40   28   31 o    210.8    3.6    0.0000   0.0000          ?        ?   445.0496  15.3245          ?        ?      210.8        3.6       ?       ? 
1 1 1   40   28   32 o     16.8    8.5    0.0000   0.0000          ?        ?   -52.9973  14.6860          ?        ?       16.8        8.5       ?       ? 
1 1 1   40   28   33 o    106.5    6.6    0.0000   0.0000          ?        ?   114.2954  14.0475          ?        ?      106.5        6.6       ?       ? 
1 1 1   40   28   34 o     30.0   13.1    0.0000   0.0000          ?        ?    -1.9156  14.6860          ?        ?       30.0       13.1       ?       ? 
1 1 1   40   28   35 o    108.2    7.1    0.0000   0.0000          ?        ?   118.1265  15.3245          ?        ?      108.2        7.1       ?       ? 
1 1 1   40   28   36 o    223.0    3.6    0.0000   0.0000          ?        ?   498.6854  15.9630          ?        ?      223.0        3.6       ?       ? 
1 1 1   40   28   37 o     89.8    8.2    0.0000   0.0000          ?        ?    81.7308  14.6860          ?        ?       89.8        8.2       ?       ? 
1 1 1   40   29    0 o    243.8   10.9  600.8488  52.9973   600.8488  52.9973   600.8488  52.9973      243.8     10.9      243.8       10.9     0.0     0.0 
1 1 1   40   29    1 o    473.6    4.9    0.0000   0.0000          ?        ?  2247.5962  46.6121          ?        ?      473.6        4.9       ?       ? 
1 1 1   40   29    2 o    506.0    4.2    0.0000   0.0000          ?        ?  2564.3030  42.7809          ?        ?      506.0        4.2       ?       ? 
1 1 1   40   29    3 f    334.7    4.9    0.0000   0.0000          ?        ?  1122.5210  32.5646          ?        ?      334.7        4.9       ?       ? 
1 1 1   40   29    4 o    237.0    8.2    0.0000   0.0000          ?        ?   565.0916  38.9498          ?        ?      237.0        8.2       ?       ? 
1 1 1   40   29    5 o    144.8    9.7    0.0000   0.0000          ?        ?   211.3506  28.0950          ?        ?      144.8        9.7       ?       ? 
1 1 1   40   29    6 o    352.9    5.5    0.0000   0.0000          ?        ?  1248.9484  38.9498          ?        ?      352.9        5.5       ?       ? 
1 1 1   40   29    7 o    112.6   13.6    0.0000   0.0000          ?        ?   128.9814  30.6490          ?        ?      112.6       13.6       ?       ? 
1 1 1   40   29    8 o     55.6   21.3    0.0000   0.0000          ?        ?    22.9868  33.2031          ?        ?       55.6       21.3       ?       ? 
1 1 1   40   29    9 o    282.9    4.5    0.0000   0.0000          ?        ?   801.9832  25.5409          ?        ?      282.9        4.5       ?       ? 
1 1 1   40   29   10 f    380.0    3.9    0.0000   0.0000          ?        ?  1446.2515  29.3720          ?        ?      380.0        3.9       ?       ? 
1 1 1   40   29   11 o    131.0    7.3    0.0000   0.0000          ?        ?   172.4008  19.1556          ?        ?      131.0        7.3       ?       ? 
1 1 1   40   29   12 o     49.8   15.9    0.0000   0.0000          ?        ?    24.9023  17.8786          ?        ?       49.8       15.9       ?       ? 
1 1 1   40   29   13 o    189.8    5.4    0.0000   0.0000          ?        ?   361.4032  20.4327          ?        ?      189.8        5.4       ?       ? 
1 1 1   40   29   14 o    253.6    5.5    0.0000   0.0000          ?        ?   644.9069  28.0950          ?        ?      253.6        5.5       ?       ? 
1 1 1   40   29   15 o    138.3    9.2    0.0000   0.0000          ?        ?   192.8335  25.5409          ?        ?      138.3        9.2       ?       ? 
1 1 1   40   29   16 o    100.3    5.1    0.0000   0.0000          ?        ?   100.8864  10.2163          ?        ?      100.3        5.1       ?       ? 
1 1 1   40   29   17 o    245.0    3.0    0.0000   0.0000          ?        ?   600.8488  14.6860          ?        ?      245.0        3.0       ?       ? 
1 1 1   40   29   18 o    558.0    3.4    0.0000   0.0000          ?        ?  3117.9011  37.6728          ?        ?      558.0        3.4       ?       ? 
1 1 1   40   29   19 f    424.4    2.9    0.0000   0.0000          ?        ?  1803.1851  24.9023          ?        ?      424.4        2.9       ?       ? 
1 1 1   40   29   20 o    108.5    6.2    0.0000   0.0000          ?        ?   118.1265  13.4090          ?        ?      108.5        6.2       ?       ? 
1 1 1   40   29   21 o    154.6    4.5    0.0000   0.0000          ?        ?   239.4456  14.0475          ?        ?      154.6        4.5       ?       ? 
1 1 1   40   29   22 o    395.6    3.0    0.0000   0.0000          ?        ?  1566.9320  23.6253          ?        ?      395.6        3.0       ?       ? 
1 1 1   40   29   23 o    295.6    2.6    0.0000   0.0000          ?        ?   874.7747  15.3245          ?        ?      295.6        2.6       ?       ? 
1 1 1   40   29   24 o    155.0    3.9    0.0000   0.0000          ?        ?   240.7227  12.1319          ?        ?      155.0        3.9       ?       ? 
1 1 1   40   29   25 o    115.3    5.3    0.0000   0.0000          ?        ?   133.4510  12.1319          ?        ?      115.3        5.3       ?       ? 
1 1 1   40   29   26 o    340.6    2.6    0.0000   0.0000          ?        ?  1160.8323  17.8786          ?        ?      340.6        2.6       ?       ? 
1 1 1   40   29   27 o    150.3    4.5    0.0000   0.0000          ?        ?   226.6752  13.4090          ?        ?      150.3        4.5       ?       ? 
1 1 1   40   29   28 o    121.4    5.5    0.0000   0.0000          ?        ?   148.1370  13.4090          ?        ?      121.4        5.5       ?       ? 
1 1 1   40   29   29 o    183.9    3.8    0.0000   0.0000          ?        ?   339.0550  14.0475          ?        ?      183.9        3.8       ?       ? 
1 1 1   40   29   30 o    257.8    3.0    0.0000   0.0000          ?        ?   665.3395  15.3245          ?        ?      257.8        3.0       ?       ? 
1 1 1   40   29   31 o     40.0   14.1    0.0000   0.0000          ?        ?    14.6860  14.0475          ?        ?       40.0       14.1       ?       ? 
1 1 1   40   29   32 o     57.4   12.6    0.0000   0.0000          ?        ?    35.1187  14.0475          ?        ?       57.4       12.6       ?       ? 
1 1 1   40   29   33 o     69.1    9.7    0.0000   0.0000          ?        ?    48.5276  13.4090          ?        ?       69.1        9.7       ?       ? 
1 1 1   40   29   34 f    216.7    3.5    0.0000   0.0000          ?        ?   470.5904  15.3245          ?        ?      216.7        3.5       ?       ? 
1 1 1   40   29   35 o    344.4    2.8    0.0000   0.0000          ?        ?  1188.2888  19.1556          ?        ?      344.4        2.8       ?       ? 
1 1 1   40   30    0 o    253.1    9.0  645.5453  45.3350   645.5453  45.3350   645.5453  45.3350      253.1      9.0      253.1        9.0     0.0     0.0 
1 1 1   40   30    1 o     63.5   20.2    0.0000   0.0000          ?        ?    41.5039  28.7335          ?        ?       63.5       20.2       ?       ? 
1 1 1   40   30    2 o    227.4    7.6    0.0000   0.0000          ?        ?   519.7566  34.4802          ?        ?      227.4        7.6       ?       ? 
1 1 1   40   30    3 o    229.1    7.1    0.0000   0.0000          ?        ?   527.4188  32.5646          ?        ?      229.1        7.1       ?       ? 
1 1 1   40   30    4 o    361.0    4.9    0.0000   0.0000          ?        ?  1306.4153  35.1187          ?        ?      361.0        4.9       ?       ? 
1 1 1   40   30    5 o    101.4   18.3    0.0000   0.0000          ?        ?   109.1872  35.7572          ?        ?      101.4       18.3       ?       ? 
1 1 1   40   30    6 o    101.8   18.9    0.0000   0.0000          ?        ?   110.4642  37.0343          ?        ?      101.8       18.9       ?       ? 
1 1 1   40   30    7 o    284.3    6.2    0.0000   0.0000          ?        ?   811.5610  35.1187          ?        ?      284.3        6.2       ?       ? 
1 1 1   40   30    8 f    177.2   11.4    0.0000   0.0000          ?        ?   317.9838  40.2269          ?        ?      177.2       11.4       ?       ? 
1 1 1   40   30    9 o    239.0   12.2    0.0000   0.0000          ?        ?   579.7776  58.1055          ?        ?      239.0       12.2       ?       ? 
1 1 1   40   30   10 o    188.1   10.4    0.0000   0.0000          ?        ?   357.5721  38.9498          ?        ?      188.1       10.4       ?       ? 
1 1 1   40   30   11 o    280.6    4.0    0.0000   0.0000          ?        ?   788.5742  22.3483          ?        ?      280.6        4.0       ?       ? 
1 1 1   40   30   12 o    103.9    7.4    0.0000   0.0000          ?        ?   108.5487  15.3245          ?        ?      103.9        7.4       ?       ? 
1 1 1   40   30   13 o    365.7    4.3    0.0000   0.0000          ?        ?  1340.2568  31.2876          ?        ?      365.7        4.3       ?       ? 
1 1 1   40   30   14 o    160.8    7.1    0.0000   0.0000          ?        ?   259.8783  22.9868          ?        ?      160.8        7.1       ?       ? 
1 1 1   40   30   15 o    329.4    4.7    0.0000   0.0000          ?        ?  1088.0408  31.2876          ?        ?      329.4        4.7       ?       ? 
1 1 1   40   30   16 o    365.4    3.8    0.0000   0.0000          ?        ?  1337.0642  27.4564          ?        ?      365.4        3.8       ?       ? 
1 1 1   40   30   17 o    313.1    2.9    0.0000   0.0000          ?        ?   981.4077  17.8786          ?        ?      313.1        2.9       ?       ? 
1 1 1   40   30   18 o    316.9    2.9    0.0000   0.0000          ?        ?  1005.0330  18.5171          ?        ?      316.9        2.9       ?       ? 
1 1 1   40   30   19 o    228.3    3.2    0.0000   0.0000          ?        ?   521.6721  14.6860          ?        ?      228.3        3.2       ?       ? 
1 1 1   40   30   20 o    172.5    3.9    0.0000   0.0000          ?        ?   298.1896  13.4090          ?        ?      172.5        3.9       ?       ? 
1 1 1   40   30   21 o    353.8    2.9    0.0000   0.0000          ?        ?  1252.7794  20.4327          ?        ?      353.8        2.9       ?       ? 
1 1 1   40   30   22 o     25.3   11.8    0.0000   0.0000          ?        ?   -13.4090  14.6860          ?        ?       25.3       11.8       ?       ? 
1 1 1   40   30   23 o    178.8    4.3    0.0000   0.0000          ?        ?   320.5379  15.3245          ?        ?      178.8        4.3       ?       ? 
1 1 1   40   30   24 o    158.7    3.6    0.0000   0.0000          ?        ?   252.2160  11.4934          ?        ?      158.7        3.6       ?       ? 
1 1 1   40   30   25 o    104.9    5.2    0.0000   0.0000          ?        ?   110.4642  10.8549          ?        ?      104.9        5.2       ?       ? 
1 1 1   40   30   26 f    145.6    4.2    0.0000   0.0000          ?        ?   212.6277  12.1319          ?        ?      145.6        4.2       ?       ? 
1 1 1   40   30   27 o     27.9   12.0    0.0000   0.0000          ?        ?    -0.6385  12.1319          ?        ?       27.9       12.0       ?       ? 
1 1 1   40   30   28 o    125.8    5.1    0.0000   0.0000          ?        ?   158.9919  12.7704          ?        ?      125.8        5.1       ?       ? 
1 1 1   40   30   29 o    253.6    3.0    0.0000   0.0000          ?        ?   644.2683  15.3245          ?        ?      253.6        3.0       ?       ? 
1 1 1   40   30   30 o     27.9   12.2    0.0000   0.0000          ?        ?    -1.9156  12.7704          ?        ?       27.9       12.2       ?       ? 
1 1 1   40   30   31 o    184.4    4.0    0.0000   0.0000          ?        ?   340.9706  14.6860          ?        ?      184.4        4.0       ?       ? 
1 1 1   40   30   32 o     17.5    8.8    0.0000   0.0000          ?        ?   -42.7809  14.0475          ?        ?       17.5        8.8       ?       ? 
1 1 1   40   30   33 o     52.8   13.3    0.0000   0.0000          ?        ?    30.0105  14.0475          ?        ?       52.8       13.3       ?       ? 
1 1 1   40   31    0 o    161.9   17.9  275.8413  56.8284   275.8413  56.8284   275.8413  56.8284      161.9     17.9      161.9       17.9     0.0     0.0 
1 1 1   40   31    1 o     74.6   25.9    0.0000   0.0000          ?        ?    55.5514  47.2506          ?        ?       74.6       25.9       ?       ? 
1 1 1   40   31    2 o    269.4    7.3    0.0000   0.0000          ?        ?   729.8303  39.5883          ?        ?      269.4        7.3       ?       ? 
1 1 1   40   31    3 o    373.3    8.1    0.0000   0.0000          ?        ?  1403.4706  60.6596          ?        ?      373.3        8.1       ?       ? 
1 1 1   40   31    4 o    107.9   22.9    0.0000   0.0000          ?        ?   127.0658  47.8891          ?        ?      107.9       22.9       ?       ? 
1 1 1   40   31    5 o    177.3   11.3    0.0000   0.0000          ?        ?   318.6223  40.2269          ?        ?      177.3       11.3       ?       ? 
1 1 1   40   31    6 o     79.0   25.4    0.0000   0.0000          ?        ?    66.4062  45.3350          ?        ?       79.0       25.4       ?       ? 
1 1 1   40   31    7 o    193.3    9.6    0.0000   0.0000          ?        ?   377.3663  37.0343          ?        ?      193.3        9.6       ?       ? 
1 1 1   40   31    8 o    196.6    8.6    0.0000   0.0000          ?        ?   389.4982  33.8416          ?        ?      196.6        8.6       ?       ? 
1 1 1   40   31    9 o    526.4    6.4    0.0000   0.0000          ?        ?  2783.9543  67.6833          ?        ?      526.4        6.4       ?       ? 
1 1 1   40   31   10 o    399.5   10.7    0.0000   0.0000          ?        ?  1616.7367  85.5619          ?        ?      399.5       10.7       ?       ? 
1 1 1   40   31   11 o    163.7   13.1    0.0000   0.0000          ?        ?   273.2873  42.7809          ?        ?      163.7       13.1       ?       ? 
1 1 1   40   31   12 o     92.2    7.6    0.0000   0.0000          ?        ?    85.5619  14.0475          ?        ?       92.2        7.6       ?       ? 
1 1 1   40   31   13 o    170.5    5.6    0.0000   0.0000          ?        ?   291.8044  19.1556          ?        ?      170.5        5.6       ?       ? 
1 1 1   40   31   14 o    371.2    4.1    0.0000   0.0000          ?        ?  1380.4838  30.6490          ?        ?      371.2        4.1       ?       ? 
1 1 1   40   31   15 o    121.0    7.4    0.0000   0.0000          ?        ?   147.4985  17.8786          ?        ?      121.0        7.4       ?       ? 
1 1 1   40   31   16 o    229.0    5.9    0.0000   0.0000          ?        ?   526.7803  26.8179          ?        ?      229.0        5.9       ?       ? 
1 1 1   40   31   17 o    278.1    3.6    0.0000   0.0000          ?        ?   774.5267  19.7942          ?        ?      278.1        3.6       ?       ? 
1 1 1   40   31   18 o    115.8    6.3    0.0000   0.0000          ?        ?   134.7281  14.6860          ?        ?      115.8        6.3       ?       ? 
1 1 1   40   31   19 o     69.4    7.8    0.0000   0.0000          ?        ?    48.5276  10.8549          ?        ?       69.4        7.8       ?       ? 
1 1 1   40   31   20 o     41.3   13.1    0.0000   0.0000          ?        ?    17.2401  12.1319          ?        ?       41.3       13.1       ?       ? 
1 1 1   40   31   21 o    126.3    5.3    0.0000   0.0000          ?        ?   160.2689  13.4090          ?        ?      126.3        5.3       ?       ? 
1 1 1   40   31   22 o     25.5   11.6    0.0000   0.0000          ?        ?    -7.0237  12.7704          ?        ?       25.5       11.6       ?       ? 
1 1 1   40   31   23 o    143.3    4.9    0.0000   0.0000          ?        ?   206.2425  14.0475          ?        ?      143.3        4.9       ?       ? 
1 1 1   40   31   24 o     78.0    7.0    0.0000   0.0000          ?        ?    61.2981  10.8549          ?        ?       78.0        7.0       ?       ? 
1 1 1   40   31   25 o    163.2    3.5    0.0000   0.0000          ?        ?   266.9020  11.4934          ?        ?      163.2        3.5       ?       ? 
1 1 1   40   31   26 o     22.4   10.5    0.0000   0.0000          ?        ?   -12.7704  12.1319          ?        ?       22.4       10.5       ?       ? 
1 1 1   40   31   27 o    111.8    5.7    0.0000   0.0000          ?        ?   125.7888  12.7704          ?        ?      111.8        5.7       ?       ? 
1 1 1   40   31   28 o     92.4    6.9    0.0000   0.0000          ?        ?    86.2004  12.7704          ?        ?       92.4        6.9       ?       ? 
1 1 1   40   31   29 o     19.3    9.5    0.0000   0.0000          ?        ?   -26.1794  12.7704          ?        ?       19.3        9.5       ?       ? 
1 1 1   40   31   30 o    112.4    5.7    0.0000   0.0000          ?        ?   127.0658  12.7704          ?        ?      112.4        5.7       ?       ? 
1 1 1   40   31   31 o    108.3    5.9    0.0000   0.0000          ?        ?   118.1265  12.7704          ?        ?      108.3        5.9       ?       ? 
1 1 1   40   32    0 o     64.2   37.7   58.7440  80.4537    58.7440  80.4537    58.7440  80.4537       64.2     37.7       64.2       37.7     0.0     0.0 
1 1 1   40   32    1 o    124.4   24.8    0.0000   0.0000          ?        ?   170.4853  59.3825          ?        ?      124.4       24.8       ?       ? 
1 1 1   40   32    2 o    148.3   15.5    0.0000   0.0000          ?        ?   226.0367  45.9736          ?        ?      148.3       15.5       ?       ? 
1 1 1   40   32    3 o    446.5    6.6    0.0000   0.0000          ?        ?  2003.6808  58.7440          ?        ?      446.5        6.6       ?       ? 
1 1 1   40   32    4 o    239.9   10.4    0.0000   0.0000          ?        ?   582.9703  49.8047          ?        ?      239.9       10.4       ?       ? 
1 1 1   40   32    5 o    140.4   12.1    0.0000   0.0000          ?        ?   200.4958  33.8416          ?        ?      140.4       12.1       ?       ? 
1 1 1   40   32    6 o    200.9    8.9    0.0000   0.0000          ?        ?   407.3768  35.7572          ?        ?      200.9        8.9       ?       ? 
1 1 1   40   32    7 f    201.7   18.4    0.0000   0.0000          ?        ?   423.3398  74.0685          ?        ?      201.7       18.4       ?       ? 
1 1 1   40   32    8 o    166.7   13.0    0.0000   0.0000          ?        ?   283.5036  43.4195          ?        ?      166.7       13.0       ?       ? 
1 1 1   40   32    9 o    331.7    5.8    0.0000   0.0000          ?        ?  1104.6425  38.3113          ?        ?      331.7        5.8       ?       ? 
1 1 1   40   32   10 o    188.9   13.4    0.0000   0.0000          ?        ?   364.5958  50.4432          ?        ?      188.9       13.4       ?       ? 
1 1 1   40   32   11 o    247.3    9.9    0.0000   0.0000          ?        ?   619.3660  49.1662          ?        ?      247.3        9.9       ?       ? 
1 1 1   40   32   12 o    116.1   26.0    0.0000   0.0000          ?        ?   151.3296  58.7440          ?        ?      116.1       26.0       ?       ? 
1 1 1   40   32   13 o    181.2    4.8    0.0000   0.0000          ?        ?   329.4771  17.2401          ?        ?      181.2        4.8       ?       ? 
1 1 1   40   32   14 o     96.3    9.6    0.0000   0.0000          ?        ?    93.8627  18.5171          ?        ?       96.3        9.6       ?       ? 
1 1 1   40   32   15 o    194.7    5.2    0.0000   0.0000          ?        ?   380.5589  20.4327          ?        ?      194.7        5.2       ?       ? 
1 1 1   40   32   16 o    386.1    5.0    0.0000   0.0000          ?        ?  1496.0562  38.9498          ?        ?      386.1        5.0       ?       ? 
1 1 1   40   32   17 o    171.8    3.9    0.0000   0.0000          ?        ?   295.6355  13.4090          ?        ?      171.8        3.9       ?       ? 
1 1 1   40   32   18 o     75.8    8.8    0.0000   0.0000          ?        ?    58.1055  13.4090          ?        ?       75.8        8.8       ?       ? 
1 1 1   40   32   19 o    201.9    4.4    0.0000   0.0000          ?        ?   408.6538  17.8786          ?        ?      201.9        4.4       ?       ? 
1 1 1   40   32   20 f     82.8    6.6    0.0000   0.0000          ?        ?    68.9603  10.8549          ?        ?       82.8        6.6       ?       ? 
1 1 1   40   32   21 o     17.3    8.6    0.0000   0.0000          ?        ?   -28.0950  11.4934          ?        ?       17.3        8.6       ?       ? 
1 1 1   40   32   22 o     70.6    8.6    0.0000   0.0000          ?        ?    50.4432  12.1319          ?        ?       70.6        8.6       ?       ? 
1 1 1   40   32   23 o    110.1    6.1    0.0000   0.0000          ?        ?   121.9576  13.4090          ?        ?      110.1        6.1       ?       ? 
1 1 1   40   32   24 o     16.4    8.3    0.0000   0.0000          ?        ?   -45.9736  13.4090          ?        ?       16.4        8.3       ?       ? 
1 1 1   40   32   25 o    125.4    4.3    0.0000   0.0000          ?        ?   157.7148  10.8549          ?        ?      125.4        4.3       ?       ? 
1 1 1   40   32   26 o    274.1    2.6    0.0000   0.0000          ?        ?   752.1785  14.0475          ?        ?      274.1        2.6       ?       ? 
1 1 1   40   32   27 o    111.5    5.4    0.0000   0.0000          ?        ?   125.1502  12.1319          ?        ?      111.5        5.4       ?       ? 
1 1 1   40   32   28 o     27.8   12.0    0.0000   0.0000          ?        ?    -0.6385  12.1319          ?        ?       27.8       12.0       ?       ? 
1 1 1   40   33    0 f    114.6   27.3  156.4378  54.2743   156.4378  54.2743   156.4378  54.2743      114.6     27.3      114.6       27.3     0.0     0.0 
1 1 1   40   33    1 o    289.8   11.8    0.0000   0.0000          ?        ?   854.9804  68.3218          ?        ?      289.8       11.8       ?       ? 
1 1 1   40   33    2 o    168.2   18.6    0.0000   0.0000          ?        ?   295.6355  62.5751          ?        ?      168.2       18.6       ?       ? 
1 1 1   40   33    3 o     77.8   24.2    0.0000   0.0000          ?        ?    65.7677  41.5039          ?        ?       77.8       24.2       ?       ? 
1 1 1   40   33    4 o     78.1   30.7    0.0000   0.0000          ?        ?    50.4432  70.2374          ?        ?       78.1       30.7       ?       ? 
1 1 1   40   33    5 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   33    6 o     44.9   20.9    0.0000   0.0000          ?        ?   -35.1187  45.3350          ?        ?       44.9       20.9       ?       ? 
1 1 1   40   33    7 o    118.8   16.4    0.0000   0.0000          ?        ?   146.2215  38.9498          ?        ?      118.8       16.4       ?       ? 
1 1 1   40   33    8 o    203.0   11.5    0.0000   0.0000          ?        ?   419.5087  46.6121          ?        ?      203.0       11.5       ?       ? 
1 1 1   40   33    9 o    375.5    8.2    0.0000   0.0000          ?        ?  1423.2646  61.2981          ?        ?      375.5        8.2       ?       ? 
1 1 1   40   33   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   33   11 o    243.2   20.2    0.0000   0.0000          ?        ?   625.7512  98.3323          ?        ?      243.2       20.2       ?       ? 
1 1 1   40   33   12 o    529.2    9.7    0.0000   0.0000          ?        ?  2838.8672 102.1635          ?        ?      529.2        9.7       ?       ? 
1 1 1   40   33   13 o    222.2   22.4    0.0000   0.0000          ?        ?   530.6115  99.6094          ?        ?      222.2       22.4       ?       ? 
1 1 1   40   33   14 o    334.2    4.4    0.0000   0.0000          ?        ?  1119.9669  29.3720          ?        ?      334.2        4.4       ?       ? 
1 1 1   40   33   15 o    171.7    5.8    0.0000   0.0000          ?        ?   296.2740  19.7942          ?        ?      171.7        5.8       ?       ? 
1 1 1   40   33   16 o     39.2   16.4    0.0000   0.0000          ?        ?     3.8311  21.7097          ?        ?       39.2       16.4       ?       ? 
1 1 1   40   33   17 o    129.8    8.4    0.0000   0.0000          ?        ?   170.4853  21.7097          ?        ?      129.8        8.4       ?       ? 
1 1 1   40   33   18 o    219.2    3.8    0.0000   0.0000          ?        ?   481.4453  16.6016          ?        ?      219.2        3.8       ?       ? 
1 1 1   40   33   19 o     84.0    9.1    0.0000   0.0000          ?        ?    71.5144  15.3245          ?        ?       84.0        9.1       ?       ? 
1 1 1   40   33   20 o     18.6    9.4    0.0000   0.0000          ?        ?   -44.6965  15.3245          ?        ?       18.6        9.4       ?       ? 
1 1 1   40   33   21 o     57.3    8.4    0.0000   0.0000          ?        ?    33.2031   9.5778          ?        ?       57.3        8.4       ?       ? 
1 1 1   40   33   22 o    190.1    3.4    0.0000   0.0000          ?        ?   362.0418  12.7704          ?        ?      190.1        3.4       ?       ? 
1 1 1   40   33   23 o    162.9    3.9    0.0000   0.0000          ?        ?   266.2635  12.7704          ?        ?      162.9        3.9       ?       ? 
1 1 1   40   33   24 f    239.7    3.2    0.0000   0.0000          ?        ?   575.9465  15.3245          ?        ?      239.7        3.2       ?       ? 
1 1 1   40   33   25 o     72.5    6.2    0.0000   0.0000          ?        ?    52.9973   8.9393          ?        ?       72.5        6.2       ?       ? 
1 1 1   40   34    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   34    1 o    116.3   33.4    0.0000   0.0000          ?        ?   162.8230  81.7308          ?        ?      116.3       33.4       ?       ? 
1 1 1   40   34    2 o    174.8   10.4    0.0000   0.0000          ?        ?   310.3215  36.3957          ?        ?      174.8       10.4       ?       ? 
1 1 1   40   34    3 o    192.5   20.9    0.0000   0.0000          ?        ?   394.6064  80.4537          ?        ?      192.5       20.9       ?       ? 
1 1 1   40   34    4 o    232.6   19.8    0.0000   0.0000          ?        ?   572.7539  91.9471          ?        ?      232.6       19.8       ?       ? 
1 1 1   40   34    5 o    179.5   17.3    0.0000   0.0000          ?        ?   336.5009  61.9366          ?        ?      179.5       17.3       ?       ? 
1 1 1   40   34    6 o    194.4   18.9    0.0000   0.0000          ?        ?   398.4375  73.4300          ?        ?      194.4       18.9       ?       ? 
1 1 1   40   34    7 o    292.6   14.5    0.0000   0.0000          ?        ?   883.7139  84.9234          ?        ?      292.6       14.5       ?       ? 
1 1 1   40   34    8 o    126.2   17.2    0.0000   0.0000          ?        ?   166.6541  43.4195          ?        ?      126.2       17.2       ?       ? 
1 1 1   40   34    9 o    181.5   11.3    0.0000   0.0000          ?        ?   335.8624  40.8654          ?        ?      181.5       11.3       ?       ? 
1 1 1   40   34   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   34   11 o    258.0   10.6    0.0000   0.0000          ?        ?   678.1099  54.9129          ?        ?      258.0       10.6       ?       ? 
1 1 1   40   34   12 o    122.5   31.4    0.0000   0.0000          ?        ?   180.7016  77.2611          ?        ?      122.5       31.4       ?       ? 
1 1 1   40   34   13 o    289.9   11.0    0.0000   0.0000          ?        ?   857.5345  63.8522          ?        ?      289.9       11.0       ?       ? 
1 1 1   40   34   14 o    215.6   13.2    0.0000   0.0000          ?        ?   478.8912  56.8284          ?        ?      215.6       13.2       ?       ? 
1 1 1   40   34   15 o     78.4    9.8    0.0000   0.0000          ?        ?    62.5751  15.3245          ?        ?       78.4        9.8       ?       ? 
1 1 1   40   34   16 o    205.4    5.4    0.0000   0.0000          ?        ?   423.9784  22.3483          ?        ?      205.4        5.4       ?       ? 
1 1 1   40   34   17 o     57.2   17.1    0.0000   0.0000          ?        ?    35.1187  21.0712          ?        ?       57.2       17.1       ?       ? 
1 1 1   40   34   18 o    229.4    3.5    0.0000   0.0000          ?        ?   527.4188  15.9630          ?        ?      229.4        3.5       ?       ? 
1 1 1   40   34   19 o     19.3    9.5    0.0000   0.0000          ?        ?   -29.3720  13.4090          ?        ?       19.3        9.5       ?       ? 
1 1 1   40   34   20 o     92.1    8.7    0.0000   0.0000          ?        ?    86.2004  15.9630          ?        ?       92.1        8.7       ?       ? 
1 1 1   40   34   21 o     62.3   12.7    0.0000   0.0000          ?        ?    41.5039  15.3245          ?        ?       62.3       12.7       ?       ? 
1 1 1   40   35    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   35    1 o    128.5   31.5    0.0000   0.0000          ?        ?   199.2188  80.4537          ?        ?      128.5       31.5       ?       ? 
1 1 1   40   35    2 o    140.0   18.7    0.0000   0.0000          ?        ?   207.5195  52.3588          ?        ?      140.0       18.7       ?       ? 
1 1 1   40   35    3 o     60.9   25.0    0.0000   0.0000          ?        ?    21.7097  48.5276          ?        ?       60.9       25.0       ?       ? 
1 1 1   40   35    4 o     80.0   25.5    0.0000   0.0000          ?        ?    71.5144  45.9736          ?        ?       80.0       25.5       ?       ? 
1 1 1   40   35    5 o     84.7   31.8    0.0000   0.0000          ?        ?    75.3456  72.7915          ?        ?       84.7       31.8       ?       ? 
1 1 1   40   35    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   35    7 o    113.2   26.6    0.0000   0.0000          ?        ?   148.7755  59.3825          ?        ?      113.2       26.6       ?       ? 
1 1 1   40   35    8 o    166.2   21.1    0.0000   0.0000          ?        ?   298.1896  70.2374          ?        ?      166.2       21.1       ?       ? 
1 1 1   40   35    9 o     48.7   23.7    0.0000   0.0000          ?        ?  -109.8257  74.0685          ?        ?       48.7       23.7       ?       ? 
1 1 1   40   35   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   35   11 o    159.3   15.0    0.0000   0.0000          ?        ?   264.3480  47.8891          ?        ?      159.3       15.0       ?       ? 
1 1 1   40   35   12 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   35   13 o    238.0   18.2    0.0000   0.0000          ?        ?   602.7644  86.8389          ?        ?      238.0       18.2       ?       ? 
1 1 1   40   35   14 o     81.8   26.8    0.0000   0.0000          ?        ?    76.6226  50.4432          ?        ?       81.8       26.8       ?       ? 
1 1 1   40   35   15 o    158.6   29.3    0.0000   0.0000          ?        ?   300.1052  89.3930          ?        ?      158.6       29.3       ?       ? 
1 1 1   40   35   16 o    158.1    5.5    0.0000   0.0000          ?        ?   251.5775  17.2401          ?        ?      158.1        5.5       ?       ? 
1 1 1   40   35   17 o    105.9    8.1    0.0000   0.0000          ?        ?   113.6568  17.2401          ?        ?      105.9        8.1       ?       ? 
1 1 1   40   36    0 o     89.9   30.6  110.4642  49.1662   110.4642  49.1662   110.4642  49.1662       89.9     30.6       89.9       30.6     0.0     0.0 
1 1 1   40   36    1 o    157.0   30.8    0.0000   0.0000          ?        ?   296.9126  93.2242          ?        ?      157.0       30.8       ?       ? 
1 1 1   40   36    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   36    3 o    259.2   16.5    0.0000   0.0000          ?        ?   707.4820  85.5619          ?        ?      259.2       16.5       ?       ? 
1 1 1   40   36    4 o    331.4    8.4    0.0000   0.0000          ?        ?  1113.5817  55.5514          ?        ?      331.4        8.4       ?       ? 
1 1 1   40   36    5 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   36    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   36    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   40   36    8 o    157.7   17.6    0.0000   0.0000          ?        ?   264.3480  55.5514          ?        ?      157.7       17.6       ?       ? 
1 1 1   40   36    9 o    239.6   13.1    0.0000   0.0000          ?        ?   594.4636  62.5751          ?        ?      239.6       13.1       ?       ? 
1 1 1   40   36   10 o    158.2   22.8    0.0000   0.0000          ?        ?   277.7569  72.1529          ?        ?      158.2       22.8       ?       ? 
1 1 1   40   36   11 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    0    0 o    152.5    8.6  234.9760  26.1794   234.9760  26.1794   234.9760  26.1794      152.5      8.6      152.5        8.6     0.0     0.0 
1 1 1   41    0    1 o     60.3   15.3   42.7809  15.9630    42.7809  15.9630    42.7809  15.9630       60.3     15.3       60.3       15.3     0.0     0.0 
1 1 1   41    0    2 o    925.3    5.0 8563.8516  91.9471  8563.8516  91.9471  8563.8516  91.9471      925.3      5.0      925.3        5.0     0.0     0.0 
1 1 1   41    0    3 o    396.0    3.4 1568.8477  26.8179  1568.8477  26.8179  1568.8477  26.8179      396.0      3.4      396.0        3.4     0.0     0.0 
1 1 1   41    0    4 o    405.0    3.5 1640.3621  28.7335  1640.3621  28.7335  1640.3621  28.7335      405.0      3.5      405.0        3.5     0.0     0.0 
1 1 1   41    0    5 f    626.8    3.9 3930.1006  49.1662  3930.1006  49.1662  3930.1006  49.1662      626.8      3.9      626.8        3.9     0.0     0.0 
1 1 1   41    0    6 o    381.5    3.4 1455.8293  26.1794  1455.8293  26.1794  1455.8293  26.1794      381.5      3.4      381.5        3.4     0.0     0.0 
1 1 1   41    0    7 o    617.4    4.0 3813.2512  49.8047  3813.2512  49.8047  3813.2512  49.8047      617.4      4.0      617.4        4.0     0.0     0.0 
1 1 1   41    0    8 o    350.4    3.9 1228.5156  27.4564  1228.5156  27.4564  1228.5156  27.4564      350.4      3.9      350.4        3.9     0.0     0.0 
1 1 1   41    0    9 o    716.2    4.3 5130.5215  61.9366  5130.5215  61.9366  5130.5215  61.9366      716.2      4.3      716.2        4.3     0.0     0.0 
1 1 1   41    0   10 f     41.7   18.0   24.9023  15.3245    24.9023  15.3245    24.9023  15.3245       41.7     18.0       41.7       18.0     0.0     0.0 
1 1 1   41    0   11 o    564.0    3.7 3181.7532  41.5039  3181.7532  41.5039  3181.7532  41.5039      564.0      3.7      564.0        3.7     0.0     0.0 
1 1 1   41    0   12 o    321.8    3.3 1035.6820  21.0712  1035.6820  21.0712  1035.6820  21.0712      321.8      3.3      321.8        3.3     0.0     0.0 
1 1 1   41    0   13 o    279.0    3.4  778.9964  19.1556   778.9964  19.1556   778.9964  19.1556      279.0      3.4      279.0        3.4     0.0     0.0 
1 1 1   41    0   14 o    585.8    3.8 3432.6921  44.6965  3432.6921  44.6965  3432.6921  44.6965      585.8      3.8      585.8        3.8     0.0     0.0 
1 1 1   41    0   15 o    420.7    3.3 1770.6204  28.0950  1770.6204  28.0950  1770.6204  28.0950      420.7      3.3      420.7        3.3     0.0     0.0 
1 1 1   41    0   16 o    308.1    3.5  949.4816  21.7097   949.4816  21.7097   949.4816  21.7097      308.1      3.5      308.1        3.5     0.0     0.0 
1 1 1   41    0   17 o    140.2    6.6  197.9417  18.5171   197.9417  18.5171   197.9417  18.5171      140.2      6.6      140.2        6.6     0.0     0.0 
1 1 1   41    0   18 o   1258.7    6.5 15850.6602 162.8230 15850.6602 162.8230 15850.6602 162.8230     1258.7      6.5     1258.7        6.5     0.0     0.0 
1 1 1   41    0   19 o   1240.2    6.1 15387.0947 150.6911 15387.0947 150.6911 15387.0947 150.6911     1240.2      6.1     1240.2        6.1     0.0     0.0 
1 1 1   41    0   20 o    958.9    5.2 9198.5420  98.9709  9198.5420  98.9709  9198.5420  98.9709      958.9      5.2      958.9        5.2     0.0     0.0 
1 1 1   41    0   21 f    260.6    3.8  679.3870  19.7942   679.3870  19.7942   679.3870  19.7942      260.6      3.8      260.6        3.8     0.0     0.0 
1 1 1   41    0   22 f    667.2    3.9 4452.4111  52.3588  4452.4111  52.3588  4452.4111  52.3588      667.2      3.9      667.2        3.9     0.0     0.0 
1 1 1   41    0   23 f    394.8    3.3 1559.2698  26.1794  1559.2698  26.1794  1559.2698  26.1794      394.8      3.3      394.8        3.3     0.0     0.0 
1 1 1   41    0   24 o    365.1    3.7 1333.2332  26.8179  1333.2332  26.8179  1333.2332  26.8179      365.1      3.7      365.1        3.7     0.0     0.0 
1 1 1   41    0   25 o    605.0    4.1 3661.9216  49.1662  3661.9216  49.1662  3661.9216  49.1662      605.0      4.1      605.0        4.1     0.0     0.0 
1 1 1   41    0   26 o    791.5    4.4 6266.4512  68.9603  6266.4512  68.9603  6266.4512  68.9603      791.5      4.4      791.5        4.4     0.0     0.0 
1 1 1   41    0   27 o    950.7    5.4 9042.7432 102.1635  9042.7432 102.1635  9042.7432 102.1635      950.7      5.4      950.7        5.4     0.0     0.0 
1 1 1   41    0   28 o    539.0    3.7 2905.9119  40.2269  2905.9119  40.2269  2905.9119  40.2269      539.0      3.7      539.0        3.7     0.0     0.0 
1 1 1   41    0   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    0   30 o     13.5   10.1  -55.5514  19.1556   -55.5514  19.1556   -55.5514  19.1556       13.5     10.1       13.5       10.1     0.0     0.0 
1 1 1   41    0   31 o    261.5    4.2  684.4952  21.7097   684.4952  21.7097   684.4952  21.7097      261.5      4.2      261.5        4.2     0.0     0.0 
1 1 1   41    0   32 o    336.9    3.7 1135.9299  24.9023  1135.9299  24.9023  1135.9299  24.9023      336.9      3.7      336.9        3.7     0.0     0.0 
1 1 1   41    0   33 o     12.7    9.5  -64.4907  19.1556   -64.4907  19.1556   -64.4907  19.1556       12.7      9.5       12.7        9.5     0.0     0.0 
1 1 1   41    0   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    0   35 o    121.7    9.0  150.6911  21.7097   150.6911  21.7097   150.6911  21.7097      121.7      9.0      121.7        9.0     0.0     0.0 
1 1 1   41    0   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    0   37 o     18.8   13.5  -29.3720  21.7097   -29.3720  21.7097   -29.3720  21.7097       18.8     13.5       18.8       13.5     0.0     0.0 
1 1 1   41    0   38 o    386.8    4.0 1497.3333  30.6490  1497.3333  30.6490  1497.3333  30.6490      386.8      4.0      386.8        4.0     0.0     0.0 
1 1 1   41    0   39 o    396.5    4.0 1573.3173  31.9261  1573.3173  31.9261  1573.3173  31.9261      396.5      4.0      396.5        4.0     0.0     0.0 
1 1 1   41    0   40 o    837.8    4.6 7023.0996  77.8996  7023.0996  77.8996  7023.0996  77.8996      837.8      4.6      837.8        4.6     0.0     0.0 
1 1 1   41    0   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    0   42 o    355.7    3.9 1266.1884  27.4564  1266.1884  27.4564  1266.1884  27.4564      355.7      3.9      355.7        3.9     0.0     0.0 
1 1 1   41    0   43 f    369.2    3.7 1363.8822  27.4564  1363.8822  27.4564  1363.8822  27.4564      369.2      3.7      369.2        3.7     0.0     0.0 
1 1 1   41    0   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    0   45 o    335.1    3.8 1123.7981  25.5409  1123.7981  25.5409  1123.7981  25.5409      335.1      3.8      335.1        3.8     0.0     0.0 
1 1 1   41    0   46 o     16.8   12.3  -44.6965  22.3483   -44.6965  22.3483   -44.6965  22.3483       16.8     12.3       16.8       12.3     0.0     0.0 
1 1 1   41    0   47 o     15.7   11.6  -68.9603  24.9023   -68.9603  24.9023   -68.9603  24.9023       15.7     11.6       15.7       11.6     0.0     0.0 
1 1 1   41    0   48 o    270.4    4.6  732.3843  24.9023   732.3843  24.9023   732.3843  24.9023      270.4      4.6      270.4        4.6     0.0     0.0 
1 1 1   41    0   49 o    198.2    6.1  394.6064  24.2638   394.6064  24.2638   394.6064  24.2638      198.2      6.1      198.2        6.1     0.0     0.0 
1 1 1   41    0   50 o     17.0   12.5  -56.1899  24.9023   -56.1899  24.9023   -56.1899  24.9023       17.0     12.5       17.0       12.5     0.0     0.0 
1 1 1   41    0   51 o     19.1   13.8  -39.5883  24.9023   -39.5883  24.9023   -39.5883  24.9023       19.1     13.8       19.1       13.8     0.0     0.0 
1 1 1   41    0   52 o     96.3   13.1   95.7782  24.9023    95.7782  24.9023    95.7782  24.9023       96.3     13.1       96.3       13.1     0.0     0.0 
1 1 1   41    0   53 o     22.4   15.7  -21.7097  24.9023   -21.7097  24.9023   -21.7097  24.9023       22.4     15.7       22.4       15.7     0.0     0.0 
1 1 1   41    0   54 o     18.6   13.6  -54.9129  27.4564   -54.9129  27.4564   -54.9129  27.4564       18.6     13.6       18.6       13.6     0.0     0.0 
1 1 1   41    0   55 o    501.0    4.0 2512.5825  39.5883  2512.5825  39.5883  2512.5825  39.5883      501.0      4.0      501.0        4.0     0.0     0.0 
1 1 1   41    0   56 o    449.5    4.0 2022.8364  35.7572  2022.8364  35.7572  2022.8364  35.7572      449.5      4.0      449.5        4.0     0.0     0.0 
1 1 1   41    0   57 o    207.9    6.9  434.8332  28.7335   434.8332  28.7335   434.8332  28.7335      207.9      6.9      207.9        6.9     0.0     0.0 
1 1 1   41    0   58 o     33.6   20.6   10.8549  26.1794    10.8549  26.1794    10.8549  26.1794       33.6     20.6       33.6       20.6     0.0     0.0 
1 1 1   41    0   59 f    114.6   11.9  136.6436  26.8179   136.6436  26.8179   136.6436  26.8179      114.6     11.9      114.6       11.9     0.0     0.0 
1 1 1   41    0   60 o    353.2    4.4 1249.5868  31.2876  1249.5868  31.2876  1249.5868  31.2876      353.2      4.4      353.2        4.4     0.0     0.0 
1 1 1   41    0   61 o    143.8    9.4  210.7121  26.8179   210.7121  26.8179   210.7121  26.8179      143.8      9.4      143.8        9.4     0.0     0.0 
1 1 1   41    0   62 o     16.9   12.5  -63.2136  26.1794   -63.2136  26.1794   -63.2136  26.1794       16.9     12.5       16.9       12.5     0.0     0.0 
1 1 1   41    0   63 o     18.0   13.3  -62.5751  28.0950   -62.5751  28.0950   -62.5751  28.0950       18.0     13.3       18.0       13.3     0.0     0.0 
1 1 1   41    0   64 o     67.3   22.0   59.3825  26.1794    59.3825  26.1794    59.3825  26.1794       67.3     22.0       67.3       22.0     0.0     0.0 
1 1 1   41    0   65 o    223.7    6.3  503.7936  28.0950   503.7936  28.0950   503.7936  28.0950      223.7      6.3      223.7        6.3     0.0     0.0 
1 1 1   41    1    0 o     12.4    9.2  -45.9736  15.9630   -45.9736  15.9630   -45.9736  15.9630       12.4      9.2       12.4        9.2     0.0     0.0 
1 1 1   41    1    1 o    322.4    2.5    0.0000   0.0000          ?        ?  1039.5132  15.9630          ?        ?      322.4        2.5       ?       ? 
1 1 1   41    1    2 o    907.1    3.5    0.0000   0.0000          ?        ?  8229.2666  63.2136          ?        ?      907.1        3.5       ?       ? 
1 1 1   41    1    3 o    419.9    2.4    0.0000   0.0000          ?        ?  1762.9583  20.4327          ?        ?      419.9        2.4       ?       ? 
1 1 1   41    1    4 o    503.5    2.6    0.0000   0.0000          ?        ?  2534.9309  26.1794          ?        ?      503.5        2.6       ?       ? 
1 1 1   41    1    5 o    835.9    3.3    0.0000   0.0000          ?        ?  6988.6191  54.9129          ?        ?      835.9        3.3       ?       ? 
1 1 1   41    1    6 o    244.1    3.0    0.0000   0.0000          ?        ?   595.7407  14.6860          ?        ?      244.1        3.0       ?       ? 
1 1 1   41    1    7 f   1122.5    4.1    0.0000   0.0000          ?        ? 12603.1406  92.5856          ?        ?     1122.5        4.1       ?       ? 
1 1 1   41    1    8 o    884.2    3.5    0.0000   0.0000          ?        ?  7819.9741  61.2981          ?        ?      884.2        3.5       ?       ? 
1 1 1   41    1    9 o    175.6    3.5    0.0000   0.0000          ?        ?   308.4059  12.1319          ?        ?      175.6        3.5       ?       ? 
1 1 1   41    1   10 o    425.7    2.5    0.0000   0.0000          ?        ?  1812.7628  21.0712          ?        ?      425.7        2.5       ?       ? 
1 1 1   41    1   11 o    133.9    4.3    0.0000   0.0000          ?        ?   179.4246  11.4934          ?        ?      133.9        4.3       ?       ? 
1 1 1   41    1   12 o    191.4    3.3    0.0000   0.0000          ?        ?   366.5114  12.7704          ?        ?      191.4        3.3       ?       ? 
1 1 1   41    1   13 o    329.4    2.4    0.0000   0.0000          ?        ?  1084.8481  15.9630          ?        ?      329.4        2.4       ?       ? 
1 1 1   41    1   14 o    805.5    3.2    0.0000   0.0000          ?        ?  6489.9341  52.3588          ?        ?      805.5        3.2       ?       ? 
1 1 1   41    1   15 o    259.5    2.7    0.0000   0.0000          ?        ?   673.6403  14.0475          ?        ?      259.5        2.7       ?       ? 
1 1 1   41    1   16 o    364.2    2.4    0.0000   0.0000          ?        ?  1326.8479  17.2401          ?        ?      364.2        2.4       ?       ? 
1 1 1   41    1   17 o    262.3    2.9    0.0000   0.0000          ?        ?   688.3264  15.3245          ?        ?      262.3        2.9       ?       ? 
1 1 1   41    1   18 o    826.5    3.3    0.0000   0.0000          ?        ?  6831.5430  54.2743          ?        ?      826.5        3.3       ?       ? 
1 1 1   41    1   19 o    549.6    2.7    0.0000   0.0000          ?        ?  3021.4844  29.3720          ?        ?      549.6        2.7       ?       ? 
1 1 1   41    1   20 o    223.4    3.3    0.0000   0.0000          ?        ?   499.3239  14.6860          ?        ?      223.4        3.3       ?       ? 
1 1 1   41    1   21 o    240.4    3.1    0.0000   0.0000          ?        ?   577.8621  14.6860          ?        ?      240.4        3.1       ?       ? 
1 1 1   41    1   22 o    380.4    2.5    0.0000   0.0000          ?        ?  1446.8900  19.1556          ?        ?      380.4        2.5       ?       ? 
1 1 1   41    1   23 f    372.0    2.5    0.0000   0.0000          ?        ?  1383.6764  18.5171          ?        ?      372.0        2.5       ?       ? 
1 1 1   41    1   24 o     65.8   10.2    0.0000   0.0000          ?        ?    43.4195  13.4090          ?        ?       65.8       10.2       ?       ? 
1 1 1   41    1   25 o    533.7    2.5    0.0000   0.0000          ?        ?  2848.4451  26.1794          ?        ?      533.7        2.5       ?       ? 
1 1 1   41    1   26 o    209.7    3.8    0.0000   0.0000          ?        ?   439.9414  15.9630          ?        ?      209.7        3.8       ?       ? 
1 1 1   41    1   27 o    117.9    6.8    0.0000   0.0000          ?        ?   139.1977  15.9630          ?        ?      117.9        6.8       ?       ? 
1 1 1   41    1   28 o     60.2   12.1    0.0000   0.0000          ?        ?    37.6728  14.0475          ?        ?       60.2       12.1       ?       ? 
1 1 1   41    1   29 o    190.4    3.9    0.0000   0.0000          ?        ?   362.6803  14.6860          ?        ?      190.4        3.9       ?       ? 
1 1 1   41    1   30 o    524.5    2.6    0.0000   0.0000          ?        ?  2751.3896  26.8179          ?        ?      524.5        2.6       ?       ? 
1 1 1   41    1   31 o     43.3   13.8    0.0000   0.0000          ?        ?    18.5171  13.4090          ?        ?       43.3       13.8       ?       ? 
1 1 1   41    1   32 o    428.9    2.5    0.0000   0.0000          ?        ?  1840.2194  21.7097          ?        ?      428.9        2.5       ?       ? 
1 1 1   41    1   33 o    201.3    3.6    0.0000   0.0000          ?        ?   405.4612  14.6860          ?        ?      201.3        3.6       ?       ? 
1 1 1   41    1   34 o    323.1    2.7    0.0000   0.0000          ?        ?  1043.9829  17.2401          ?        ?      323.1        2.7       ?       ? 
1 1 1   41    1   35 o    319.5    2.8    0.0000   0.0000          ?        ?  1020.9960  17.8786          ?        ?      319.5        2.8       ?       ? 
1 1 1   41    1   36 o    388.1    2.6    0.0000   0.0000          ?        ?  1506.9110  20.4327          ?        ?      388.1        2.6       ?       ? 
1 1 1   41    1   37 o    694.9    2.9    0.0000   0.0000          ?        ?  4831.0547  40.8654          ?        ?      694.9        2.9       ?       ? 
1 1 1   41    1   38 o    355.1    2.7    0.0000   0.0000          ?        ?  1261.0802  19.1556          ?        ?      355.1        2.7       ?       ? 
1 1 1   41    1   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    1   40 o    471.6    2.7    0.0000   0.0000          ?        ?  2224.6094  25.5409          ?        ?      471.6        2.7       ?       ? 
1 1 1   41    1   41 o    456.1    2.7    0.0000   0.0000          ?        ?  2080.9419  24.2638          ?        ?      456.1        2.7       ?       ? 
1 1 1   41    1   42 o    512.0    2.6    0.0000   0.0000          ?        ?  2622.4084  26.1794          ?        ?      512.0        2.6       ?       ? 
1 1 1   41    1   43 o    170.5    4.9    0.0000   0.0000          ?        ?   291.1659  16.6016          ?        ?      170.5        4.9       ?       ? 
1 1 1   41    1   44 o     26.7   12.3    0.0000   0.0000          ?        ?   -12.1319  15.3245          ?        ?       26.7       12.3       ?       ? 
1 1 1   41    1   45 o    223.5    3.9    0.0000   0.0000          ?        ?   499.9625  17.2401          ?        ?      223.5        3.9       ?       ? 
1 1 1   41    1   46 o     21.1   10.4    0.0000   0.0000          ?        ?   -35.7572  15.9630          ?        ?       21.1       10.4       ?       ? 
1 1 1   41    1   47 o    179.3    4.6    0.0000   0.0000          ?        ?   321.8149  16.6016          ?        ?      179.3        4.6       ?       ? 
1 1 1   41    1   48 o    249.7    3.7    0.0000   0.0000          ?        ?   623.8356  18.5171          ?        ?      249.7        3.7       ?       ? 
1 1 1   41    1   49 o     35.2   14.7    0.0000   0.0000          ?        ?     2.5541  17.2401          ?        ?       35.2       14.7       ?       ? 
1 1 1   41    1   50 o    247.0    3.6    0.0000   0.0000          ?        ?   610.4266  17.8786          ?        ?      247.0        3.6       ?       ? 
1 1 1   41    1   51 o     77.9   11.5    0.0000   0.0000          ?        ?    61.2981  17.8786          ?        ?       77.9       11.5       ?       ? 
1 1 1   41    1   52 o     74.6   11.6    0.0000   0.0000          ?        ?    56.1899  17.2401          ?        ?       74.6       11.6       ?       ? 
1 1 1   41    1   53 o    194.7    4.9    0.0000   0.0000          ?        ?   379.9204  19.1556          ?        ?      194.7        4.9       ?       ? 
1 1 1   41    1   54 o     19.8   10.0    0.0000   0.0000          ?        ?   -60.0210  18.5171          ?        ?       19.8       10.0       ?       ? 
1 1 1   41    1   55 o    215.5    4.6    0.0000   0.0000          ?        ?   465.4823  19.7942          ?        ?      215.5        4.6       ?       ? 
1 1 1   41    1   56 o    510.8    2.9    0.0000   0.0000          ?        ?  2611.5535  29.3720          ?        ?      510.8        2.9       ?       ? 
1 1 1   41    1   57 o    104.9    9.4    0.0000   0.0000          ?        ?   111.1028  19.7942          ?        ?      104.9        9.4       ?       ? 
1 1 1   41    1   58 o    139.2    6.9    0.0000   0.0000          ?        ?   194.7491  19.1556          ?        ?      139.2        6.9       ?       ? 
1 1 1   41    1   59 o     27.2   12.8    0.0000   0.0000          ?        ?   -21.0712  18.5171          ?        ?       27.2       12.8       ?       ? 
1 1 1   41    1   60 o    241.3    4.1    0.0000   0.0000          ?        ?   583.6088  19.7942          ?        ?      241.3        4.1       ?       ? 
1 1 1   41    1   61 o     24.5   12.1    0.0000   0.0000          ?        ?   -40.8654  20.4327          ?        ?       24.5       12.1       ?       ? 
1 1 1   41    1   62 o    123.4    8.0    0.0000   0.0000          ?        ?   153.8837  19.7942          ?        ?      123.4        8.0       ?       ? 
1 1 1   41    1   63 o    174.7    5.8    0.0000   0.0000          ?        ?   307.1289  20.4327          ?        ?      174.7        5.8       ?       ? 
1 1 1   41    1   64 o    196.1    5.4    0.0000   0.0000          ?        ?   386.9441  21.0712          ?        ?      196.1        5.4       ?       ? 
1 1 1   41    2    0 o    105.4    8.0  113.0183  16.6016   113.0183  16.6016   113.0183  16.6016      105.4      8.0      105.4        8.0     0.0     0.0 
1 1 1   41    2    1 f    250.6    2.9    0.0000   0.0000          ?        ?   628.3053  14.6860          ?        ?      250.6        2.9       ?       ? 
1 1 1   41    2    2 o    840.0    3.4    0.0000   0.0000          ?        ?  7056.9409  57.4669          ?        ?      840.0        3.4       ?       ? 
1 1 1   41    2    3 o     35.7   13.0    0.0000   0.0000          ?        ?    10.2163  12.1319          ?        ?       35.7       13.0       ?       ? 
1 1 1   41    2    4 o    791.8    3.2    0.0000   0.0000          ?        ?  6270.2822  51.0817          ?        ?      791.8        3.2       ?       ? 
1 1 1   41    2    5 o    574.0    2.7    0.0000   0.0000          ?        ?  3294.7715  30.6490          ?        ?      574.0        2.7       ?       ? 
1 1 1   41    2    6 o    739.4    3.1    0.0000   0.0000          ?        ?  5468.2993  45.3350          ?        ?      739.4        3.1       ?       ? 
1 1 1   41    2    7 o    327.5    2.5    0.0000   0.0000          ?        ?  1072.7163  16.6016          ?        ?      327.5        2.5       ?       ? 
1 1 1   41    2    8 f    369.7    2.5    0.0000   0.0000          ?        ?  1367.0748  18.5171          ?        ?      369.7        2.5       ?       ? 
1 1 1   41    2    9 o    785.7    3.2    0.0000   0.0000          ?        ?  6174.5039  49.8047          ?        ?      785.7        3.2       ?       ? 
1 1 1   41    2   10 o    286.4    2.6    0.0000   0.0000          ?        ?   820.5003  14.6860          ?        ?      286.4        2.6       ?       ? 
1 1 1   41    2   11 o   1001.7    3.7    0.0000   0.0000          ?        ? 10036.2832  74.7070          ?        ?     1001.7        3.7       ?       ? 
1 1 1   41    2   12 o    247.1    2.7    0.0000   0.0000          ?        ?   610.4266  13.4090          ?        ?      247.1        2.7       ?       ? 
1 1 1   41    2   13 o    601.5    2.7    0.0000   0.0000          ?        ?  3618.5022  32.5646          ?        ?      601.5        2.7       ?       ? 
1 1 1   41    2   14 o    656.1    2.7    0.0000   0.0000          ?        ?  4305.5513  35.7572          ?        ?      656.1        2.7       ?       ? 
1 1 1   41    2   15 o    371.5    2.4    0.0000   0.0000          ?        ?  1380.4838  17.8786          ?        ?      371.5        2.4       ?       ? 
1 1 1   41    2   16 o    532.3    2.6    0.0000   0.0000          ?        ?  2833.7588  28.0950          ?        ?      532.3        2.6       ?       ? 
1 1 1   41    2   17 o     79.1    7.7    0.0000   0.0000          ?        ?    62.5751  12.1319          ?        ?       79.1        7.7       ?       ? 
1 1 1   41    2   18 o    215.9    3.3    0.0000   0.0000          ?        ?   466.1208  14.0475          ?        ?      215.9        3.3       ?       ? 
1 1 1   41    2   19 f    289.6    2.9    0.0000   0.0000          ?        ?   839.0174  16.6016          ?        ?      289.6        2.9       ?       ? 
1 1 1   41    2   20 o     21.5   10.3    0.0000   0.0000          ?        ?   -18.5171  12.7704          ?        ?       21.5       10.3       ?       ? 
1 1 1   41    2   21 o    666.7    2.8    0.0000   0.0000          ?        ?  4446.0259  37.0343          ?        ?      666.7        2.8       ?       ? 
1 1 1   41    2   22 o    429.5    2.5    0.0000   0.0000          ?        ?  1845.3275  21.7097          ?        ?      429.5        2.5       ?       ? 
1 1 1   41    2   23 o    582.8    2.7    0.0000   0.0000          ?        ?  3397.5735  31.2876          ?        ?      582.8        2.7       ?       ? 
1 1 1   41    2   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    2   25 o    239.6    2.9    0.0000   0.0000          ?        ?   574.0309  14.0475          ?        ?      239.6        2.9       ?       ? 
1 1 1   41    2   26 o    295.6    2.7    0.0000   0.0000          ?        ?   874.1360  15.9630          ?        ?      295.6        2.7       ?       ? 
1 1 1   41    2   27 o    434.4    2.5    0.0000   0.0000          ?        ?  1887.4700  21.7097          ?        ?      434.4        2.5       ?       ? 
1 1 1   41    2   28 o    152.8    4.4    0.0000   0.0000          ?        ?   233.6989  13.4090          ?        ?      152.8        4.4       ?       ? 
1 1 1   41    2   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    2   30 o    454.5    2.5    0.0000   0.0000          ?        ?  2066.2561  22.9868          ?        ?      454.5        2.5       ?       ? 
1 1 1   41    2   31 o    447.0    2.5    0.0000   0.0000          ?        ?  1998.5726  22.3483          ?        ?      447.0        2.5       ?       ? 
1 1 1   41    2   32 o     18.6    9.3    0.0000   0.0000          ?        ?   -37.6728  14.0475          ?        ?       18.6        9.3       ?       ? 
1 1 1   41    2   33 o    298.2    2.7    0.0000   0.0000          ?        ?   889.4606  15.9630          ?        ?      298.2        2.7       ?       ? 
1 1 1   41    2   34 o    417.7    2.5    0.0000   0.0000          ?        ?  1745.0795  21.0712          ?        ?      417.7        2.5       ?       ? 
1 1 1   41    2   35 o    217.9    3.5    0.0000   0.0000          ?        ?   475.0601  15.3245          ?        ?      217.9        3.5       ?       ? 
1 1 1   41    2   36 o    366.5    2.7    0.0000   0.0000          ?        ?  1343.4495  19.7942          ?        ?      366.5        2.7       ?       ? 
1 1 1   41    2   37 o    205.2    3.9    0.0000   0.0000          ?        ?   421.4243  15.9630          ?        ?      205.2        3.9       ?       ? 
1 1 1   41    2   38 o    221.1    3.6    0.0000   0.0000          ?        ?   489.1075  15.9630          ?        ?      221.1        3.6       ?       ? 
1 1 1   41    2   39 o    560.3    2.6    0.0000   0.0000          ?        ?  3140.2493  29.3720          ?        ?      560.3        2.6       ?       ? 
1 1 1   41    2   40 o    468.3    2.7    0.0000   0.0000          ?        ?  2193.9604  24.9023          ?        ?      468.3        2.7       ?       ? 
1 1 1   41    2   41 o    210.1    3.8    0.0000   0.0000          ?        ?   441.8569  15.9630          ?        ?      210.1        3.8       ?       ? 
1 1 1   41    2   42 o    117.0    6.5    0.0000   0.0000          ?        ?   137.2822  15.3245          ?        ?      117.0        6.5       ?       ? 
1 1 1   41    2   43 o    110.3    7.2    0.0000   0.0000          ?        ?   121.9576  15.9630          ?        ?      110.3        7.2       ?       ? 
1 1 1   41    2   44 o    192.7    4.3    0.0000   0.0000          ?        ?   371.6196  16.6016          ?        ?      192.7        4.3       ?       ? 
1 1 1   41    2   45 o    348.4    2.8    0.0000   0.0000          ?        ?  1214.4681  19.7942          ?        ?      348.4        2.8       ?       ? 
1 1 1   41    2   46 o    407.4    2.7    0.0000   0.0000          ?        ?  1660.7948  21.7097          ?        ?      407.4        2.7       ?       ? 
1 1 1   41    2   47 f    213.3    4.2    0.0000   0.0000          ?        ?   455.2659  17.8786          ?        ?      213.3        4.2       ?       ? 
1 1 1   41    2   48 o    190.3    4.7    0.0000   0.0000          ?        ?   362.6803  17.8786          ?        ?      190.3        4.7       ?       ? 
1 1 1   41    2   49 o    364.8    3.0    0.0000   0.0000          ?        ?  1331.3176  21.7097          ?        ?      364.8        3.0       ?       ? 
1 1 1   41    2   50 o    154.6    5.8    0.0000   0.0000          ?        ?   239.4456  17.8786          ?        ?      154.6        5.8       ?       ? 
1 1 1   41    2   51 o    209.4    4.7    0.0000   0.0000          ?        ?   439.3029  19.7942          ?        ?      209.4        4.7       ?       ? 
1 1 1   41    2   52 o     23.6   11.5    0.0000   0.0000          ?        ?   -33.2031  17.8786          ?        ?       23.6       11.5       ?       ? 
1 1 1   41    2   53 o     58.2   15.2    0.0000   0.0000          ?        ?    35.7572  17.8786          ?        ?       58.2       15.2       ?       ? 
1 1 1   41    2   54 o    146.2    6.3    0.0000   0.0000          ?        ?   214.5433  18.5171          ?        ?      146.2        6.3       ?       ? 
1 1 1   41    2   55 o     23.6   11.6    0.0000   0.0000          ?        ?   -36.3957  18.5171          ?        ?       23.6       11.6       ?       ? 
1 1 1   41    2   56 o    303.8    3.6    0.0000   0.0000          ?        ?   923.9408  21.7097          ?        ?      303.8        3.6       ?       ? 
1 1 1   41    2   57 o    150.4    6.4    0.0000   0.0000          ?        ?   227.3137  19.1556          ?        ?      150.4        6.4       ?       ? 
1 1 1   41    2   58 o     63.2   15.7    0.0000   0.0000          ?        ?    42.7809  19.7942          ?        ?       63.2       15.7       ?       ? 
1 1 1   41    2   59 o     53.8   16.7    0.0000   0.0000          ?        ?    30.0105  19.7942          ?        ?       53.8       16.7       ?       ? 
1 1 1   41    2   60 o    176.7    5.4    0.0000   0.0000          ?        ?   313.5141  19.1556          ?        ?      176.7        5.4       ?       ? 
1 1 1   41    2   61 o    180.4    5.7    0.0000   0.0000          ?        ?   326.9231  20.4327          ?        ?      180.4        5.7       ?       ? 
1 1 1   41    2   62 o    137.8    7.2    0.0000   0.0000          ?        ?   191.5565  19.7942          ?        ?      137.8        7.2       ?       ? 
1 1 1   41    2   63 o    163.2    5.9    0.0000   0.0000          ?        ?   268.1791  19.1556          ?        ?      163.2        5.9       ?       ? 
1 1 1   41    2   64 o     30.4   13.9    0.0000   0.0000          ?        ?   -12.1319  19.1556          ?        ?       30.4       13.9       ?       ? 
1 1 1   41    3    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    3    1 o    305.2    2.5    0.0000   0.0000          ?        ?   931.6030  15.3245          ?        ?      305.2        2.5       ?       ? 
1 1 1   41    3    2 o     25.4   11.3    0.0000   0.0000          ?        ?    -4.4697  11.4934          ?        ?       25.4       11.3       ?       ? 
1 1 1   41    3    3 o    778.3    3.1    0.0000   0.0000          ?        ?  6057.6548  47.8891          ?        ?      778.3        3.1       ?       ? 
1 1 1   41    3    4 o    446.5    2.4    0.0000   0.0000          ?        ?  1993.4646  21.7097          ?        ?      446.5        2.4       ?       ? 
1 1 1   41    3    5 o    799.1    3.3    0.0000   0.0000          ?        ?  6385.8545  52.3588          ?        ?      799.1        3.3       ?       ? 
1 1 1   41    3    6 o   1130.4    4.2    0.0000   0.0000          ?        ? 12780.0107  93.8627          ?        ?     1130.4        4.2       ?       ? 
1 1 1   41    3    7 o    686.9    3.0    0.0000   0.0000          ?        ?  4718.6748  40.8654          ?        ?      686.9        3.0       ?       ? 
1 1 1   41    3    8 o     24.5   10.9    0.0000   0.0000          ?        ?    -4.4697  10.8549          ?        ?       24.5       10.9       ?       ? 
1 1 1   41    3    9 o    635.8    2.8    0.0000   0.0000          ?        ?  4043.1189  35.1187          ?        ?      635.8        2.8       ?       ? 
1 1 1   41    3   10 o    210.2    2.9    0.0000   0.0000          ?        ?   441.8569  12.1319          ?        ?      210.2        2.9       ?       ? 
1 1 1   41    3   11 o    342.5    2.4    0.0000   0.0000          ?        ?  1172.9642  16.6016          ?        ?      342.5        2.4       ?       ? 
1 1 1   41    3   12 o    247.7    2.8    0.0000   0.0000          ?        ?   613.6193  14.0475          ?        ?      247.7        2.8       ?       ? 
1 1 1   41    3   13 o    124.3    4.6    0.0000   0.0000          ?        ?   154.5222  11.4934          ?        ?      124.3        4.6       ?       ? 
1 1 1   41    3   14 o    230.1    2.9    0.0000   0.0000          ?        ?   529.3344  13.4090          ?        ?      230.1        2.9       ?       ? 
1 1 1   41    3   15 o    881.1    3.4    0.0000   0.0000          ?        ?  7765.6997  59.3825          ?        ?      881.1        3.4       ?       ? 
1 1 1   41    3   16 f    241.7    2.9    0.0000   0.0000          ?        ?   584.2473  14.0475          ?        ?      241.7        2.9       ?       ? 
1 1 1   41    3   17 o    185.7    3.4    0.0000   0.0000          ?        ?   344.8017  12.7704          ?        ?      185.7        3.4       ?       ? 
1 1 1   41    3   18 o    320.0    2.6    0.0000   0.0000          ?        ?  1024.1886  16.6016          ?        ?      320.0        2.6       ?       ? 
1 1 1   41    3   19 o    555.6    2.6    0.0000   0.0000          ?        ?  3087.2520  29.3720          ?        ?      555.6        2.6       ?       ? 
1 1 1   41    3   20 o    309.6    2.6    0.0000   0.0000          ?        ?   958.4210  15.9630          ?        ?      309.6        2.6       ?       ? 
1 1 1   41    3   21 o    368.4    2.5    0.0000   0.0000          ?        ?  1357.4971  18.5171          ?        ?      368.4        2.5       ?       ? 
1 1 1   41    3   22 o    415.0    2.4    0.0000   0.0000          ?        ?  1722.7313  19.7942          ?        ?      415.0        2.4       ?       ? 
1 1 1   41    3   23 o    395.8    2.6    0.0000   0.0000          ?        ?  1566.9320  20.4327          ?        ?      395.8        2.6       ?       ? 
1 1 1   41    3   24 o    359.1    2.6    0.0000   0.0000          ?        ?  1289.8137  18.5171          ?        ?      359.1        2.6       ?       ? 
1 1 1   41    3   25 o    608.5    2.6    0.0000   0.0000          ?        ?  3702.7871  31.9261          ?        ?      608.5        2.6       ?       ? 
1 1 1   41    3   26 o    508.5    2.5    0.0000   0.0000          ?        ?  2586.6511  25.5409          ?        ?      508.5        2.5       ?       ? 
1 1 1   41    3   27 o     17.9    8.9    0.0000   0.0000          ?        ?   -33.2031  12.7704          ?        ?       17.9        8.9       ?       ? 
1 1 1   41    3   28 o    538.3    2.4    0.0000   0.0000          ?        ?  2898.2495  26.1794          ?        ?      538.3        2.4       ?       ? 
1 1 1   41    3   29 o    207.6    3.4    0.0000   0.0000          ?        ?   431.0021  14.0475          ?        ?      207.6        3.4       ?       ? 
1 1 1   41    3   30 o    617.8    2.6    0.0000   0.0000          ?        ?  3817.0823  32.5646          ?        ?      617.8        2.6       ?       ? 
1 1 1   41    3   31 o    523.9    2.6    0.0000   0.0000          ?        ?  2745.0044  26.8179          ?        ?      523.9        2.6       ?       ? 
1 1 1   41    3   32 o     75.3    9.8    0.0000   0.0000          ?        ?    56.8284  14.6860          ?        ?       75.3        9.8       ?       ? 
1 1 1   41    3   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    3   34 o    669.3    3.0    0.0000   0.0000          ?        ?  4481.1445  39.5883          ?        ?      669.3        3.0       ?       ? 
1 1 1   41    3   35 o    409.7    2.6    0.0000   0.0000          ?        ?  1679.3119  21.7097          ?        ?      409.7        2.6       ?       ? 
1 1 1   41    3   36 o    781.7    3.1    0.0000   0.0000          ?        ?  6112.5674  48.5276          ?        ?      781.7        3.1       ?       ? 
1 1 1   41    3   37 o     26.5   12.0    0.0000   0.0000          ?        ?    -8.9393  14.0475          ?        ?       26.5       12.0       ?       ? 
1 1 1   41    3   38 o     21.5   10.6    0.0000   0.0000          ?        ?   -33.8416  15.9630          ?        ?       21.5       10.6       ?       ? 
1 1 1   41    3   39 o    133.9    5.7    0.0000   0.0000          ?        ?   179.4246  15.3245          ?        ?      133.9        5.7       ?       ? 
1 1 1   41    3   40 o    259.4    3.3    0.0000   0.0000          ?        ?   673.0018  17.2401          ?        ?      259.4        3.3       ?       ? 
1 1 1   41    3   41 o     20.3   10.1    0.0000   0.0000          ?        ?   -39.5883  15.9630          ?        ?       20.3       10.1       ?       ? 
1 1 1   41    3   42 o    309.5    3.0    0.0000   0.0000          ?        ?   958.4210  18.5171          ?        ?      309.5        3.0       ?       ? 
1 1 1   41    3   43 o    116.2    6.9    0.0000   0.0000          ?        ?   135.3666  15.9630          ?        ?      116.2        6.9       ?       ? 
1 1 1   41    3   44 o    116.7    7.1    0.0000   0.0000          ?        ?   136.6436  16.6016          ?        ?      116.7        7.1       ?       ? 
1 1 1   41    3   45 o    253.2    3.7    0.0000   0.0000          ?        ?   641.7142  18.5171          ?        ?      253.2        3.7       ?       ? 
1 1 1   41    3   46 o     45.8   15.1    0.0000   0.0000          ?        ?    20.4327  15.9630          ?        ?       45.8       15.1       ?       ? 
1 1 1   41    3   47 o    184.9    4.5    0.0000   0.0000          ?        ?   342.2476  16.6016          ?        ?      184.9        4.5       ?       ? 
1 1 1   41    3   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    3   49 o     19.6    9.8    0.0000   0.0000          ?        ?   -52.3588  17.2401          ?        ?       19.6        9.8       ?       ? 
1 1 1   41    3   50 o    103.9    8.3    0.0000   0.0000          ?        ?   108.5487  17.2401          ?        ?      103.9        8.3       ?       ? 
1 1 1   41    3   51 f    106.9    8.1    0.0000   0.0000          ?        ?   114.9339  17.2401          ?        ?      106.9        8.1       ?       ? 
1 1 1   41    3   52 o    120.6    7.7    0.0000   0.0000          ?        ?   146.2215  18.5171          ?        ?      120.6        7.7       ?       ? 
1 1 1   41    3   53 o    101.0    9.5    0.0000   0.0000          ?        ?   102.8020  19.1556          ?        ?      101.0        9.5       ?       ? 
1 1 1   41    3   54 o    244.4    4.0    0.0000   0.0000          ?        ?   598.2947  19.7942          ?        ?      244.4        4.0       ?       ? 
1 1 1   41    3   55 o    211.8    4.5    0.0000   0.0000          ?        ?   449.5192  19.1556          ?        ?      211.8        4.5       ?       ? 
1 1 1   41    3   56 o     23.0   11.4    0.0000   0.0000          ?        ?   -42.7809  19.1556          ?        ?       23.0       11.4       ?       ? 
1 1 1   41    3   57 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    3   58 o    304.2    3.5    0.0000   0.0000          ?        ?   926.4949  21.0712          ?        ?      304.2        3.5       ?       ? 
1 1 1   41    3   59 o    136.5    7.2    0.0000   0.0000          ?        ?   187.7254  19.7942          ?        ?      136.5        7.2       ?       ? 
1 1 1   41    3   60 o     77.0   12.4    0.0000   0.0000          ?        ?    60.6596  19.1556          ?        ?       77.0       12.4       ?       ? 
1 1 1   41    3   61 o     83.6   11.8    0.0000   0.0000          ?        ?    71.5144  19.7942          ?        ?       83.6       11.8       ?       ? 
1 1 1   41    3   62 o    176.8    5.4    0.0000   0.0000          ?        ?   314.1526  19.1556          ?        ?      176.8        5.4       ?       ? 
1 1 1   41    3   63 o    141.2    6.8    0.0000   0.0000          ?        ?   201.1343  19.1556          ?        ?      141.2        6.8       ?       ? 
1 1 1   41    4    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    4    1 o    368.3    2.5    0.0000   0.0000          ?        ?  1356.2198  18.5171          ?        ?      368.3        2.5       ?       ? 
1 1 1   41    4    2 o     23.6   10.7    0.0000   0.0000          ?        ?    -6.3852  10.8549          ?        ?       23.6       10.7       ?       ? 
1 1 1   41    4    3 f    526.0    2.6    0.0000   0.0000          ?        ?  2766.7141  27.4564          ?        ?      526.0        2.6       ?       ? 
1 1 1   41    4    4 o    558.0    2.7    0.0000   0.0000          ?        ?  3114.0701  30.0105          ?        ?      558.0        2.7       ?       ? 
1 1 1   41    4    5 f    659.8    3.0    0.0000   0.0000          ?        ?  4353.4404  38.9498          ?        ?      659.8        3.0       ?       ? 
1 1 1   41    4    6 o    459.2    2.5    0.0000   0.0000          ?        ?  2109.0369  22.9868          ?        ?      459.2        2.5       ?       ? 
1 1 1   41    4    7 o    121.2    4.5    0.0000   0.0000          ?        ?   146.8600  10.8549          ?        ?      121.2        4.5       ?       ? 
1 1 1   41    4    8 o    552.5    2.6    0.0000   0.0000          ?        ?  3053.4104  28.7335          ?        ?      552.5        2.6       ?       ? 
1 1 1   41    4    9 o    705.2    2.9    0.0000   0.0000          ?        ?  4974.0835  40.8654          ?        ?      705.2        2.9       ?       ? 
1 1 1   41    4   10 o    428.3    2.5    0.0000   0.0000          ?        ?  1834.4725  21.0712          ?        ?      428.3        2.5       ?       ? 
1 1 1   41    4   11 o    507.7    2.5    0.0000   0.0000          ?        ?  2577.7119  25.5409          ?        ?      507.7        2.5       ?       ? 
1 1 1   41    4   12 o    374.1    2.4    0.0000   0.0000          ?        ?  1399.6394  17.8786          ?        ?      374.1        2.4       ?       ? 
1 1 1   41    4   13 o    298.0    2.7    0.0000   0.0000          ?        ?   888.1836  15.9630          ?        ?      298.0        2.7       ?       ? 
1 1 1   41    4   14 o    102.0    5.9    0.0000   0.0000          ?        ?   104.0790  12.1319          ?        ?      102.0        5.9       ?       ? 
1 1 1   41    4   15 o     36.7   13.7    0.0000   0.0000          ?        ?    10.2163  13.4090          ?        ?       36.7       13.7       ?       ? 
1 1 1   41    4   16 o   1148.8    4.1    0.0000   0.0000          ?        ? 13202.0742  94.5012          ?        ?     1148.8        4.1       ?       ? 
1 1 1   41    4   17 o    351.8    2.5    0.0000   0.0000          ?        ?  1238.0934  17.8786          ?        ?      351.8        2.5       ?       ? 
1 1 1   41    4   18 f    323.4    2.5    0.0000   0.0000          ?        ?  1045.8984  15.9630          ?        ?      323.4        2.5       ?       ? 
1 1 1   41    4   19 o    111.0    5.8    0.0000   0.0000          ?        ?   123.2347  12.7704          ?        ?      111.0        5.8       ?       ? 
1 1 1   41    4   20 o    624.3    2.7    0.0000   0.0000          ?        ?  3897.5361  33.8416          ?        ?      624.3        2.7       ?       ? 
1 1 1   41    4   21 o    734.6    3.0    0.0000   0.0000          ?        ?  5398.0620  43.4195          ?        ?      734.6        3.0       ?       ? 
1 1 1   41    4   22 f    325.5    2.5    0.0000   0.0000          ?        ?  1059.9459  15.9630          ?        ?      325.5        2.5       ?       ? 
1 1 1   41    4   23 o    629.3    2.7    0.0000   0.0000          ?        ?  3960.7495  33.8416          ?        ?      629.3        2.7       ?       ? 
1 1 1   41    4   24 o    383.4    2.5    0.0000   0.0000          ?        ?  1470.5154  19.1556          ?        ?      383.4        2.5       ?       ? 
1 1 1   41    4   25 o    869.0    3.3    0.0000   0.0000          ?        ?  7553.7109  58.1055          ?        ?      869.0        3.3       ?       ? 
1 1 1   41    4   26 o    308.0    2.6    0.0000   0.0000          ?        ?   948.8432  15.9630          ?        ?      308.0        2.6       ?       ? 
1 1 1   41    4   27 o    439.7    2.5    0.0000   0.0000          ?        ?  1933.4434  21.7097          ?        ?      439.7        2.5       ?       ? 
1 1 1   41    4   28 o     36.1   13.4    0.0000   0.0000          ?        ?    10.2163  12.7704          ?        ?       36.1       13.4       ?       ? 
1 1 1   41    4   29 f    560.9    2.6    0.0000   0.0000          ?        ?  3146.6345  28.7335          ?        ?      560.9        2.6       ?       ? 
1 1 1   41    4   30 o    307.2    2.7    0.0000   0.0000          ?        ?   943.7350  16.6016          ?        ?      307.2        2.7       ?       ? 
1 1 1   41    4   31 o    255.7    2.9    0.0000   0.0000          ?        ?   653.8461  14.6860          ?        ?      255.7        2.9       ?       ? 
1 1 1   41    4   32 o    412.8    2.6    0.0000   0.0000          ?        ?  1704.8528  21.7097          ?        ?      412.8        2.6       ?       ? 
1 1 1   41    4   33 o    475.2    2.6    0.0000   0.0000          ?        ?  2259.0894  24.9023          ?        ?      475.2        2.6       ?       ? 
1 1 1   41    4   34 o    542.4    2.5    0.0000   0.0000          ?        ?  2942.3076  27.4564          ?        ?      542.4        2.5       ?       ? 
1 1 1   41    4   35 o    313.1    2.9    0.0000   0.0000          ?        ?   980.7693  17.8786          ?        ?      313.1        2.9       ?       ? 
1 1 1   41    4   36 o    329.3    2.8    0.0000   0.0000          ?        ?  1084.8481  18.5171          ?        ?      329.3        2.8       ?       ? 
1 1 1   41    4   37 o    166.0    4.8    0.0000   0.0000          ?        ?   275.8413  15.9630          ?        ?      166.0        4.8       ?       ? 
1 1 1   41    4   38 o    220.7    3.6    0.0000   0.0000          ?        ?   487.1920  15.9630          ?        ?      220.7        3.6       ?       ? 
1 1 1   41    4   39 o    471.3    2.6    0.0000   0.0000          ?        ?  2222.0552  24.2638          ?        ?      471.3        2.6       ?       ? 
1 1 1   41    4   40 o     21.6   10.6    0.0000   0.0000          ?        ?   -30.0105  15.3245          ?        ?       21.6       10.6       ?       ? 
1 1 1   41    4   41 o    144.8    5.7    0.0000   0.0000          ?        ?   210.0736  16.6016          ?        ?      144.8        5.7       ?       ? 
1 1 1   41    4   42 o    143.0    5.8    0.0000   0.0000          ?        ?   204.9654  16.6016          ?        ?      143.0        5.8       ?       ? 
1 1 1   41    4   43 o    219.5    3.9    0.0000   0.0000          ?        ?   482.0838  17.2401          ?        ?      219.5        3.9       ?       ? 
1 1 1   41    4   44 o    125.7    6.6    0.0000   0.0000          ?        ?   158.3534  16.6016          ?        ?      125.7        6.6       ?       ? 
1 1 1   41    4   45 o    373.1    2.8    0.0000   0.0000          ?        ?  1392.6157  21.0712          ?        ?      373.1        2.8       ?       ? 
1 1 1   41    4   46 o    179.4    5.0    0.0000   0.0000          ?        ?   322.4534  17.8786          ?        ?      179.4        5.0       ?       ? 
1 1 1   41    4   47 o    271.2    3.4    0.0000   0.0000          ?        ?   736.2155  18.5171          ?        ?      271.2        3.4       ?       ? 
1 1 1   41    4   48 o    191.8    4.5    0.0000   0.0000          ?        ?   368.4270  17.2401          ?        ?      191.8        4.5       ?       ? 
1 1 1   41    4   49 o    205.5    4.2    0.0000   0.0000          ?        ?   422.7013  17.2401          ?        ?      205.5        4.2       ?       ? 
1 1 1   41    4   50 o     65.3   13.2    0.0000   0.0000          ?        ?    44.6965  16.6016          ?        ?       65.3       13.2       ?       ? 
1 1 1   41    4   51 o     79.1   10.9    0.0000   0.0000          ?        ?    63.2136  17.2401          ?        ?       79.1       10.9       ?       ? 
1 1 1   41    4   52 o    155.9    5.9    0.0000   0.0000          ?        ?   243.9153  18.5171          ?        ?      155.9        5.9       ?       ? 
1 1 1   41    4   53 o     61.6   14.7    0.0000   0.0000          ?        ?    40.2269  17.8786          ?        ?       61.6       14.7       ?       ? 
1 1 1   41    4   54 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    4   55 o     29.2   13.4    0.0000   0.0000          ?        ?   -12.7704  17.8786          ?        ?       29.2       13.4       ?       ? 
1 1 1   41    4   56 o    108.8    8.5    0.0000   0.0000          ?        ?   119.4035  18.5171          ?        ?      108.8        8.5       ?       ? 
1 1 1   41    4   57 o    176.0    5.4    0.0000   0.0000          ?        ?   310.9600  19.1556          ?        ?      176.0        5.4       ?       ? 
1 1 1   41    4   58 o    198.8    4.8    0.0000   0.0000          ?        ?   396.5219  19.1556          ?        ?      198.8        4.8       ?       ? 
1 1 1   41    4   59 o    166.4    5.8    0.0000   0.0000          ?        ?   278.3954  19.1556          ?        ?      166.4        5.8       ?       ? 
1 1 1   41    4   60 o    122.1    8.1    0.0000   0.0000          ?        ?   150.6911  19.7942          ?        ?      122.1        8.1       ?       ? 
1 1 1   41    4   61 o    251.4    4.1    0.0000   0.0000          ?        ?   634.0520  20.4327          ?        ?      251.4        4.1       ?       ? 
1 1 1   41    4   62 o     61.3   15.6    0.0000   0.0000          ?        ?    40.8654  19.1556          ?        ?       61.3       15.6       ?       ? 
1 1 1   41    4   63 o     58.8   15.9    0.0000   0.0000          ?        ?    37.6728  19.1556          ?        ?       58.8       15.9       ?       ? 
1 1 1   41    5    0 o    934.9    5.0 8741.9990  93.2242  8741.9990  93.2242  8741.9990  93.2242      934.9      5.0      934.9        5.0     0.0     0.0 
1 1 1   41    5    1 o    780.6    3.2    0.0000   0.0000          ?        ?  6094.0508  49.8047          ?        ?      780.6        3.2       ?       ? 
1 1 1   41    5    2 o    225.0    2.8    0.0000   0.0000          ?        ?   506.3477  12.7704          ?        ?      225.0        2.8       ?       ? 
1 1 1   41    5    3 o    471.8    2.6    0.0000   0.0000          ?        ?  2225.8865  24.9023          ?        ?      471.8        2.6       ?       ? 
1 1 1   41    5    4 o   1221.0    4.3    0.0000   0.0000          ?        ? 14913.3115 105.9946          ?        ?     1221.0        4.3       ?       ? 
1 1 1   41    5    5 o    346.1    2.9    0.0000   0.0000          ?        ?  1197.8666  19.7942          ?        ?      346.1        2.9       ?       ? 
1 1 1   41    5    6 o    371.1    2.4    0.0000   0.0000          ?        ?  1377.2911  17.8786          ?        ?      371.1        2.4       ?       ? 
1 1 1   41    5    7 o    260.1    2.6    0.0000   0.0000          ?        ?   676.8329  13.4090          ?        ?      260.1        2.6       ?       ? 
1 1 1   41    5    8 o    394.7    2.4    0.0000   0.0000          ?        ?  1557.9928  19.1556          ?        ?      394.7        2.4       ?       ? 
1 1 1   41    5    9 o    312.9    2.3    0.0000   0.0000          ?        ?   978.8537  14.6860          ?        ?      312.9        2.3       ?       ? 
1 1 1   41    5   10 o     93.2    6.2    0.0000   0.0000          ?        ?    86.8389  11.4934          ?        ?       93.2        6.2       ?       ? 
1 1 1   41    5   11 o    251.5    2.7    0.0000   0.0000          ?        ?   632.7749  13.4090          ?        ?      251.5        2.7       ?       ? 
1 1 1   41    5   12 o    747.4    3.1    0.0000   0.0000          ?        ?  5587.0645  45.9736          ?        ?      747.4        3.1       ?       ? 
1 1 1   41    5   13 o   1078.1    3.9    0.0000   0.0000          ?        ? 11625.5625  84.9234          ?        ?     1078.1        3.9       ?       ? 
1 1 1   41    5   14 o    792.8    3.3    0.0000   0.0000          ?        ?  6286.8838  51.7203          ?        ?      792.8        3.3       ?       ? 
1 1 1   41    5   15 o    726.4    3.1    0.0000   0.0000          ?        ?  5278.0195  44.6965          ?        ?      726.4        3.1       ?       ? 
1 1 1   41    5   16 o    283.1    2.7    0.0000   0.0000          ?        ?   801.3447  15.3245          ?        ?      283.1        2.7       ?       ? 
1 1 1   41    5   17 o    399.7    2.3    0.0000   0.0000          ?        ?  1597.5811  18.5171          ?        ?      399.7        2.3       ?       ? 
1 1 1   41    5   18 o    122.5    5.0    0.0000   0.0000          ?        ?   150.0526  12.1319          ?        ?      122.5        5.0       ?       ? 
1 1 1   41    5   19 o    397.2    2.5    0.0000   0.0000          ?        ?  1577.7870  19.7942          ?        ?      397.2        2.5       ?       ? 
1 1 1   41    5   20 f     92.8    7.2    0.0000   0.0000          ?        ?    86.2004  13.4090          ?        ?       92.8        7.2       ?       ? 
1 1 1   41    5   21 o    241.2    2.8    0.0000   0.0000          ?        ?   581.6932  13.4090          ?        ?      241.2        2.8       ?       ? 
1 1 1   41    5   22 o    178.3    3.8    0.0000   0.0000          ?        ?   317.9838  13.4090          ?        ?      178.3        3.8       ?       ? 
1 1 1   41    5   23 o    310.6    2.6    0.0000   0.0000          ?        ?   964.8062  15.9630          ?        ?      310.6        2.6       ?       ? 
1 1 1   41    5   24 f    211.8    3.3    0.0000   0.0000          ?        ?   448.8807  14.0475          ?        ?      211.8        3.3       ?       ? 
1 1 1   41    5   25 o    349.9    2.6    0.0000   0.0000          ?        ?  1224.6844  17.8786          ?        ?      349.9        2.6       ?       ? 
1 1 1   41    5   26 o    351.1    2.5    0.0000   0.0000          ?        ?  1232.9854  17.2401          ?        ?      351.1        2.5       ?       ? 
1 1 1   41    5   27 o    266.2    2.9    0.0000   0.0000          ?        ?   708.7590  15.3245          ?        ?      266.2        2.9       ?       ? 
1 1 1   41    5   28 o     29.7   12.9    0.0000   0.0000          ?        ?    -1.9156  14.0475          ?        ?       29.7       12.9       ?       ? 
1 1 1   41    5   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    5   30 o    268.5    2.9    0.0000   0.0000          ?        ?   720.8909  15.3245          ?        ?      268.5        2.9       ?       ? 
1 1 1   41    5   31 o    211.1    3.5    0.0000   0.0000          ?        ?   445.6881  14.6860          ?        ?      211.1        3.5       ?       ? 
1 1 1   41    5   32 o    272.1    3.1    0.0000   0.0000          ?        ?   740.6851  16.6016          ?        ?      272.1        3.1       ?       ? 
1 1 1   41    5   33 o    289.7    2.9    0.0000   0.0000          ?        ?   839.6559  16.6016          ?        ?      289.7        2.9       ?       ? 
1 1 1   41    5   34 o    261.2    2.9    0.0000   0.0000          ?        ?   682.5797  15.3245          ?        ?      261.2        2.9       ?       ? 
1 1 1   41    5   35 o    268.2    3.1    0.0000   0.0000          ?        ?   719.6138  16.6016          ?        ?      268.2        3.1       ?       ? 
1 1 1   41    5   36 o    255.4    3.4    0.0000   0.0000          ?        ?   652.5691  17.2401          ?        ?      255.4        3.4       ?       ? 
1 1 1   41    5   37 o    212.3    3.8    0.0000   0.0000          ?        ?   450.7963  15.9630          ?        ?      212.3        3.8       ?       ? 
1 1 1   41    5   38 o     99.3    7.7    0.0000   0.0000          ?        ?    98.9709  15.3245          ?        ?       99.3        7.7       ?       ? 
1 1 1   41    5   39 o    408.1    2.6    0.0000   0.0000          ?        ?  1665.9028  21.0712          ?        ?      408.1        2.6       ?       ? 
1 1 1   41    5   40 o    486.6    2.6    0.0000   0.0000          ?        ?  2368.9153  25.5409          ?        ?      486.6        2.6       ?       ? 
1 1 1   41    5   41 o    671.1    2.9    0.0000   0.0000          ?        ?  4506.0474  39.5883          ?        ?      671.1        2.9       ?       ? 
1 1 1   41    5   42 o     18.9    9.6    0.0000   0.0000          ?        ?   -52.3588  16.6016          ?        ?       18.9        9.6       ?       ? 
1 1 1   41    5   43 o    184.7    4.5    0.0000   0.0000          ?        ?   341.6091  16.6016          ?        ?      184.7        4.5       ?       ? 
1 1 1   41    5   44 o    372.3    2.8    0.0000   0.0000          ?        ?  1386.8689  21.0712          ?        ?      372.3        2.8       ?       ? 
1 1 1   41    5   45 o    335.2    3.0    0.0000   0.0000          ?        ?  1124.4366  19.7942          ?        ?      335.2        3.0       ?       ? 
1 1 1   41    5   46 o    108.5    7.7    0.0000   0.0000          ?        ?   118.1265  16.6016          ?        ?      108.5        7.7       ?       ? 
1 1 1   41    5   47 o    310.5    3.1    0.0000   0.0000          ?        ?   964.8062  19.1556          ?        ?      310.5        3.1       ?       ? 
1 1 1   41    5   48 o    172.7    5.4    0.0000   0.0000          ?        ?   298.8281  18.5171          ?        ?      172.7        5.4       ?       ? 
1 1 1   41    5   49 o    249.1    3.7    0.0000   0.0000          ?        ?   621.2816  18.5171          ?        ?      249.1        3.7       ?       ? 
1 1 1   41    5   50 o     33.5   14.4    0.0000   0.0000          ?        ?    -0.6385  17.2401          ?        ?       33.5       14.4       ?       ? 
1 1 1   41    5   51 o    155.8    5.7    0.0000   0.0000          ?        ?   243.2767  17.8786          ?        ?      155.8        5.7       ?       ? 
1 1 1   41    5   52 o    186.0    4.8    0.0000   0.0000          ?        ?   346.7172  17.8786          ?        ?      186.0        4.8       ?       ? 
1 1 1   41    5   53 o    253.9    3.9    0.0000   0.0000          ?        ?   645.5453  19.7942          ?        ?      253.9        3.9       ?       ? 
1 1 1   41    5   54 f     61.1   14.3    0.0000   0.0000          ?        ?    39.5883  17.2401          ?        ?       61.1       14.3       ?       ? 
1 1 1   41    5   55 o    243.5    4.1    0.0000   0.0000          ?        ?   593.8251  19.7942          ?        ?      243.5        4.1       ?       ? 
1 1 1   41    5   56 o    108.5    8.5    0.0000   0.0000          ?        ?   118.7650  18.5171          ?        ?      108.5        8.5       ?       ? 
1 1 1   41    5   57 o    102.2    8.4    0.0000   0.0000          ?        ?   105.3561  17.2401          ?        ?      102.2        8.4       ?       ? 
1 1 1   41    5   58 o    219.7    4.5    0.0000   0.0000          ?        ?   483.9994  19.7942          ?        ?      219.7        4.5       ?       ? 
1 1 1   41    5   59 o    173.0    5.5    0.0000   0.0000          ?        ?   300.7437  19.1556          ?        ?      173.0        5.5       ?       ? 
1 1 1   41    5   60 o     32.0   14.2    0.0000   0.0000          ?        ?    -6.3852  18.5171          ?        ?       32.0       14.2       ?       ? 
1 1 1   41    5   61 o     64.8   14.6    0.0000   0.0000          ?        ?    45.3350  18.5171          ?        ?       64.8       14.6       ?       ? 
1 1 1   41    5   62 o    140.7    6.6    0.0000   0.0000          ?        ?   199.8573  18.5171          ?        ?      140.7        6.6       ?       ? 
1 1 1   41    6    0 o    858.4    4.7 7370.4556  81.0922  7370.4556  81.0922  7370.4556  81.0922      858.4      4.7      858.4        4.7     0.0     0.0 
1 1 1   41    6    1 o    470.7    2.8    0.0000   0.0000          ?        ?  2215.6699  26.1794          ?        ?      470.7        2.8       ?       ? 
1 1 1   41    6    2 o    898.3    3.4    0.0000   0.0000          ?        ?  8071.5518  61.9366          ?        ?      898.3        3.4       ?       ? 
1 1 1   41    6    3 f    573.1    2.7    0.0000   0.0000          ?        ?  3285.1938  31.2876          ?        ?      573.1        2.7       ?       ? 
1 1 1   41    6    4 o    538.0    2.6    0.0000   0.0000          ?        ?  2894.4185  28.0950          ?        ?      538.0        2.6       ?       ? 
1 1 1   41    6    5 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    6    6 o    107.2    5.1    0.0000   0.0000          ?        ?   114.9339  10.8549          ?        ?      107.2        5.1       ?       ? 
1 1 1   41    6    7 o    270.3    2.5    0.0000   0.0000          ?        ?   730.4688  13.4090          ?        ?      270.3        2.5       ?       ? 
1 1 1   41    6    8 o    310.2    2.4    0.0000   0.0000          ?        ?   962.2521  14.6860          ?        ?      310.2        2.4       ?       ? 
1 1 1   41    6    9 o    342.9    2.3    0.0000   0.0000          ?        ?  1176.1569  15.9630          ?        ?      342.9        2.3       ?       ? 
1 1 1   41    6   10 o    327.6    2.3    0.0000   0.0000          ?        ?  1073.3549  15.3245          ?        ?      327.6        2.3       ?       ? 
1 1 1   41    6   11 o    219.8    2.8    0.0000   0.0000          ?        ?   483.3608  12.1319          ?        ?      219.8        2.8       ?       ? 
1 1 1   41    6   12 o    333.5    2.6    0.0000   0.0000          ?        ?  1112.3047  17.2401          ?        ?      333.5        2.6       ?       ? 
1 1 1   41    6   13 o     72.7    8.3    0.0000   0.0000          ?        ?    52.9973  12.1319          ?        ?       72.7        8.3       ?       ? 
1 1 1   41    6   14 o    428.1    2.5    0.0000   0.0000          ?        ?  1833.1957  21.0712          ?        ?      428.1        2.5       ?       ? 
1 1 1   41    6   15 o    270.7    2.7    0.0000   0.0000          ?        ?   733.0228  14.6860          ?        ?      270.7        2.7       ?       ? 
1 1 1   41    6   16 o    209.9    3.2    0.0000   0.0000          ?        ?   440.5799  13.4090          ?        ?      209.9        3.2       ?       ? 
1 1 1   41    6   17 o    432.7    2.5    0.0000   0.0000          ?        ?  1872.7838  21.7097          ?        ?      432.7        2.5       ?       ? 
1 1 1   41    6   18 o    324.7    2.5    0.0000   0.0000          ?        ?  1054.1992  15.9630          ?        ?      324.7        2.5       ?       ? 
1 1 1   41    6   19 o     16.3    8.2    0.0000   0.0000          ?        ?   -37.6728  12.1319          ?        ?       16.3        8.2       ?       ? 
1 1 1   41    6   20 o    216.3    3.1    0.0000   0.0000          ?        ?   468.0364  13.4090          ?        ?      216.3        3.1       ?       ? 
1 1 1   41    6   21 o     18.6    9.2    0.0000   0.0000          ?        ?   -30.0105  12.7704          ?        ?       18.6        9.2       ?       ? 
1 1 1   41    6   22 o    159.4    4.2    0.0000   0.0000          ?        ?   254.1316  13.4090          ?        ?      159.4        4.2       ?       ? 
1 1 1   41    6   23 o    434.9    2.5    0.0000   0.0000          ?        ?  1891.9395  21.7097          ?        ?      434.9        2.5       ?       ? 
1 1 1   41    6   24 o    220.4    3.2    0.0000   0.0000          ?        ?   485.9149  14.0475          ?        ?      220.4        3.2       ?       ? 
1 1 1   41    6   25 o    170.2    4.1    0.0000   0.0000          ?        ?   289.8888  14.0475          ?        ?      170.2        4.1       ?       ? 
1 1 1   41    6   26 o    469.4    2.4    0.0000   0.0000          ?        ?  2203.5381  22.9868          ?        ?      469.4        2.4       ?       ? 
1 1 1   41    6   27 o    257.8    3.0    0.0000   0.0000          ?        ?   664.7010  15.3245          ?        ?      257.8        3.0       ?       ? 
1 1 1   41    6   28 o    616.8    2.7    0.0000   0.0000          ?        ?  3805.5889  33.2031          ?        ?      616.8        2.7       ?       ? 
1 1 1   41    6   29 o    287.0    2.8    0.0000   0.0000          ?        ?   823.6929  15.9630          ?        ?      287.0        2.8       ?       ? 
1 1 1   41    6   30 o    111.2    6.0    0.0000   0.0000          ?        ?   123.8732  13.4090          ?        ?      111.2        6.0       ?       ? 
1 1 1   41    6   31 o    265.2    3.1    0.0000   0.0000          ?        ?   703.6508  16.6016          ?        ?      265.2        3.1       ?       ? 
1 1 1   41    6   32 o    290.4    2.9    0.0000   0.0000          ?        ?   843.4871  16.6016          ?        ?      290.4        2.9       ?       ? 
1 1 1   41    6   33 f    169.6    4.3    0.0000   0.0000          ?        ?   287.9732  14.6860          ?        ?      169.6        4.3       ?       ? 
1 1 1   41    6   34 o     26.7   12.2    0.0000   0.0000          ?        ?   -10.2163  14.6860          ?        ?       26.7       12.2       ?       ? 
1 1 1   41    6   35 o    462.6    2.6    0.0000   0.0000          ?        ?  2140.9629  23.6253          ?        ?      462.6        2.6       ?       ? 
1 1 1   41    6   36 o    185.3    4.0    0.0000   0.0000          ?        ?   343.5246  14.6860          ?        ?      185.3        4.0       ?       ? 
1 1 1   41    6   37 o    220.1    3.6    0.0000   0.0000          ?        ?   484.6379  15.9630          ?        ?      220.1        3.6       ?       ? 
1 1 1   41    6   38 o     19.9    9.9    0.0000   0.0000          ?        ?   -38.3113  15.3245          ?        ?       19.9        9.9       ?       ? 
1 1 1   41    6   39 o    479.2    2.6    0.0000   0.0000          ?        ?  2297.4006  24.9023          ?        ?      479.2        2.6       ?       ? 
1 1 1   41    6   40 f    283.1    3.3    0.0000   0.0000          ?        ?   801.9832  18.5171          ?        ?      283.1        3.3       ?       ? 
1 1 1   41    6   41 o    518.3    2.6    0.0000   0.0000          ?        ?  2687.5376  27.4564          ?        ?      518.3        2.6       ?       ? 
1 1 1   41    6   42 o    217.3    3.8    0.0000   0.0000          ?        ?   472.5060  16.6016          ?        ?      217.3        3.8       ?       ? 
1 1 1   41    6   43 o    344.1    2.9    0.0000   0.0000          ?        ?  1184.4576  19.7942          ?        ?      344.1        2.9       ?       ? 
1 1 1   41    6   44 o    139.2    6.2    0.0000   0.0000          ?        ?   194.1106  17.2401          ?        ?      139.2        6.2       ?       ? 
1 1 1   41    6   45 f    287.2    3.3    0.0000   0.0000          ?        ?   825.6085  19.1556          ?        ?      287.2        3.3       ?       ? 
1 1 1   41    6   46 o    204.4    4.4    0.0000   0.0000          ?        ?   418.2317  17.8786          ?        ?      204.4        4.4       ?       ? 
1 1 1   41    6   47 o    155.4    5.8    0.0000   0.0000          ?        ?   241.9997  17.8786          ?        ?      155.4        5.8       ?       ? 
1 1 1   41    6   48 o    193.6    4.6    0.0000   0.0000          ?        ?   375.4507  17.8786          ?        ?      193.6        4.6       ?       ? 
1 1 1   41    6   49 o     23.0   11.3    0.0000   0.0000          ?        ?   -32.5646  17.2401          ?        ?       23.0       11.3       ?       ? 
1 1 1   41    6   50 o     94.8    9.8    0.0000   0.0000          ?        ?    90.6701  18.5171          ?        ?       94.8        9.8       ?       ? 
1 1 1   41    6   51 o     76.2   11.7    0.0000   0.0000          ?        ?    58.7440  17.8786          ?        ?       76.2       11.7       ?       ? 
1 1 1   41    6   52 o     87.1    9.9    0.0000   0.0000          ?        ?    76.6226  17.2401          ?        ?       87.1        9.9       ?       ? 
1 1 1   41    6   53 o    274.6    3.5    0.0000   0.0000          ?        ?   754.7325  19.1556          ?        ?      274.6        3.5       ?       ? 
1 1 1   41    6   54 o     29.2   13.6    0.0000   0.0000          ?        ?   -16.6016  19.1556          ?        ?       29.2       13.6       ?       ? 
1 1 1   41    6   55 o    323.7    3.3    0.0000   0.0000          ?        ?  1049.0911  21.0712          ?        ?      323.7        3.3       ?       ? 
1 1 1   41    6   56 o    221.2    4.3    0.0000   0.0000          ?        ?   490.3846  19.1556          ?        ?      221.2        4.3       ?       ? 
1 1 1   41    6   57 o     22.4   11.1    0.0000   0.0000          ?        ?   -45.9736  19.1556          ?        ?       22.4       11.1       ?       ? 
1 1 1   41    6   58 o    208.9    4.7    0.0000   0.0000          ?        ?   438.0258  19.7942          ?        ?      208.9        4.7       ?       ? 
1 1 1   41    6   59 o     21.6   10.8    0.0000   0.0000          ?        ?   -46.6121  18.5171          ?        ?       21.6       10.8       ?       ? 
1 1 1   41    6   60 o     81.7   11.3    0.0000   0.0000          ?        ?    68.3218  18.5171          ?        ?       81.7       11.3       ?       ? 
1 1 1   41    6   61 o     20.8   10.5    0.0000   0.0000          ?        ?   -55.5514  19.1556          ?        ?       20.8       10.5       ?       ? 
1 1 1   41    7    0 o    415.1    3.3 1723.3699  27.4564  1723.3699  27.4564  1723.3699  27.4564      415.1      3.3      415.1        3.3     0.0     0.0 
1 1 1   41    7    1 o    367.1    2.4    0.0000   0.0000          ?        ?  1347.9192  17.8786          ?        ?      367.1        2.4       ?       ? 
1 1 1   41    7    2 o    884.6    3.5    0.0000   0.0000          ?        ?  7827.6367  61.2981          ?        ?      884.6        3.5       ?       ? 
1 1 1   41    7    3 o    445.6    2.4    0.0000   0.0000          ?        ?  1985.8022  21.7097          ?        ?      445.6        2.4       ?       ? 
1 1 1   41    7    4 o    496.4    2.5    0.0000   0.0000          ?        ?  2464.6934  24.9023          ?        ?      496.4        2.5       ?       ? 
1 1 1   41    7    5 o    793.9    3.2    0.0000   0.0000          ?        ?  6304.7627  50.4432          ?        ?      793.9        3.2       ?       ? 
1 1 1   41    7    6 o    187.2    3.1    0.0000   0.0000          ?        ?   350.5484  11.4934          ?        ?      187.2        3.1       ?       ? 
1 1 1   41    7    7 f    195.1    2.9    0.0000   0.0000          ?        ?   380.5589  11.4934          ?        ?      195.1        2.9       ?       ? 
1 1 1   41    7    8 o    325.9    2.4    0.0000   0.0000          ?        ?  1062.5000  15.9630          ?        ?      325.9        2.4       ?       ? 
1 1 1   41    7    9 o    499.3    2.5    0.0000   0.0000          ?        ?  2493.4270  24.9023          ?        ?      499.3        2.5       ?       ? 
1 1 1   41    7   10 o    567.5    2.8    0.0000   0.0000          ?        ?  3220.7031  31.9261          ?        ?      567.5        2.8       ?       ? 
1 1 1   41    7   11 o     88.6    6.1    0.0000   0.0000          ?        ?    78.5382  10.8549          ?        ?       88.6        6.1       ?       ? 
1 1 1   41    7   12 o     52.5   11.3    0.0000   0.0000          ?        ?    28.7335  11.4934          ?        ?       52.5       11.3       ?       ? 
1 1 1   41    7   13 o    192.1    3.2    0.0000   0.0000          ?        ?   369.0655  12.1319          ?        ?      192.1        3.2       ?       ? 
1 1 1   41    7   14 o    320.5    2.6    0.0000   0.0000          ?        ?  1027.3812  16.6016          ?        ?      320.5        2.6       ?       ? 
1 1 1   41    7   15 o    587.6    2.8    0.0000   0.0000          ?        ?  3453.7637  33.2031          ?        ?      587.6        2.8       ?       ? 
1 1 1   41    7   16 o    245.5    2.9    0.0000   0.0000          ?        ?   602.7644  14.0475          ?        ?      245.5        2.9       ?       ? 
1 1 1   41    7   17 o    674.0    2.9    0.0000   0.0000          ?        ?  4543.0815  39.5883          ?        ?      674.0        2.9       ?       ? 
1 1 1   41    7   18 o    355.3    2.4    0.0000   0.0000          ?        ?  1262.3572  17.2401          ?        ?      355.3        2.4       ?       ? 
1 1 1   41    7   19 o    307.9    2.6    0.0000   0.0000          ?        ?   948.2046  15.9630          ?        ?      307.9        2.6       ?       ? 
1 1 1   41    7   20 o    291.5    2.6    0.0000   0.0000          ?        ?   849.8723  15.3245          ?        ?      291.5        2.6       ?       ? 
1 1 1   41    7   21 o    717.8    2.9    0.0000   0.0000          ?        ?  5154.1465  42.1424          ?        ?      717.8        2.9       ?       ? 
1 1 1   41    7   22 o    176.5    4.0    0.0000   0.0000          ?        ?   311.5985  14.0475          ?        ?      176.5        4.0       ?       ? 
1 1 1   41    7   23 o    496.3    2.5    0.0000   0.0000          ?        ?  2464.0549  24.9023          ?        ?      496.3        2.5       ?       ? 
1 1 1   41    7   24 o    384.0    2.3    0.0000   0.0000          ?        ?  1474.9850  17.8786          ?        ?      384.0        2.3       ?       ? 
1 1 1   41    7   25 o    236.1    3.1    0.0000   0.0000          ?        ?   557.4294  14.6860          ?        ?      236.1        3.1       ?       ? 
1 1 1   41    7   26 o    350.7    2.6    0.0000   0.0000          ?        ?  1230.4312  18.5171          ?        ?      350.7        2.6       ?       ? 
1 1 1   41    7   27 o    338.6    2.5    0.0000   0.0000          ?        ?  1146.7849  17.2401          ?        ?      338.6        2.5       ?       ? 
1 1 1   41    7   28 o    570.2    2.7    0.0000   0.0000          ?        ?  3252.6292  30.6490          ?        ?      570.2        2.7       ?       ? 
1 1 1   41    7   29 o    246.1    3.1    0.0000   0.0000          ?        ?   605.9570  15.3245          ?        ?      246.1        3.1       ?       ? 
1 1 1   41    7   30 o    178.6    3.8    0.0000   0.0000          ?        ?   319.2608  13.4090          ?        ?      178.6        3.8       ?       ? 
1 1 1   41    7   31 o    297.0    2.8    0.0000   0.0000          ?        ?   882.4369  16.6016          ?        ?      297.0        2.8       ?       ? 
1 1 1   41    7   32 o    254.5    3.0    0.0000   0.0000          ?        ?   648.0994  15.3245          ?        ?      254.5        3.0       ?       ? 
1 1 1   41    7   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    7   34 o    340.0    2.6    0.0000   0.0000          ?        ?  1156.3627  17.8786          ?        ?      340.0        2.6       ?       ? 
1 1 1   41    7   35 o    315.4    2.7    0.0000   0.0000          ?        ?   994.8167  17.2401          ?        ?      315.4        2.7       ?       ? 
1 1 1   41    7   36 o    141.7    5.6    0.0000   0.0000          ?        ?   201.1343  15.9630          ?        ?      141.7        5.6       ?       ? 
1 1 1   41    7   37 o    156.9    4.9    0.0000   0.0000          ?        ?   246.4693  15.3245          ?        ?      156.9        4.9       ?       ? 
1 1 1   41    7   38 o    480.8    2.6    0.0000   0.0000          ?        ?  2312.0869  24.9023          ?        ?      480.8        2.6       ?       ? 
1 1 1   41    7   39 o    248.3    3.5    0.0000   0.0000          ?        ?   616.8119  17.2401          ?        ?      248.3        3.5       ?       ? 
1 1 1   41    7   40 o    434.5    2.6    0.0000   0.0000          ?        ?  1888.7469  22.3483          ?        ?      434.5        2.6       ?       ? 
1 1 1   41    7   41 o     84.0    9.1    0.0000   0.0000          ?        ?    70.8759  15.3245          ?        ?       84.0        9.1       ?       ? 
1 1 1   41    7   42 o    231.6    3.9    0.0000   0.0000          ?        ?   536.9967  17.8786          ?        ?      231.6        3.9       ?       ? 
1 1 1   41    7   43 o     97.0    8.2    0.0000   0.0000          ?        ?    94.5012  15.9630          ?        ?       97.0        8.2       ?       ? 
1 1 1   41    7   44 o    299.6    3.0    0.0000   0.0000          ?        ?   898.3999  17.8786          ?        ?      299.6        3.0       ?       ? 
1 1 1   41    7   45 o    166.9    5.2    0.0000   0.0000          ?        ?   279.0340  17.2401          ?        ?      166.9        5.2       ?       ? 
1 1 1   41    7   46 o    126.4    6.6    0.0000   0.0000          ?        ?   160.2689  16.6016          ?        ?      126.4        6.6       ?       ? 
1 1 1   41    7   47 o    430.6    2.7    0.0000   0.0000          ?        ?  1855.5439  23.6253          ?        ?      430.6        2.7       ?       ? 
1 1 1   41    7   48 o     78.3   11.0    0.0000   0.0000          ?        ?    61.9366  17.2401          ?        ?       78.3       11.0       ?       ? 
1 1 1   41    7   49 o    133.7    6.9    0.0000   0.0000          ?        ?   179.4246  18.5171          ?        ?      133.7        6.9       ?       ? 
1 1 1   41    7   50 o    156.8    5.7    0.0000   0.0000          ?        ?   246.4693  17.8786          ?        ?      156.8        5.7       ?       ? 
1 1 1   41    7   51 o    316.2    3.2    0.0000   0.0000          ?        ?  1000.5634  20.4327          ?        ?      316.2        3.2       ?       ? 
1 1 1   41    7   52 o    151.3    6.1    0.0000   0.0000          ?        ?   229.8678  18.5171          ?        ?      151.3        6.1       ?       ? 
1 1 1   41    7   53 o    322.9    3.2    0.0000   0.0000          ?        ?  1043.9829  20.4327          ?        ?      322.9        3.2       ?       ? 
1 1 1   41    7   54 o     22.9   11.3    0.0000   0.0000          ?        ?   -43.4195  19.1556          ?        ?       22.9       11.3       ?       ? 
1 1 1   41    7   55 o     79.6   11.6    0.0000   0.0000          ?        ?    64.4907  18.5171          ?        ?       79.6       11.6       ?       ? 
1 1 1   41    7   56 o    128.1    7.5    0.0000   0.0000          ?        ?   165.3771  19.1556          ?        ?      128.1        7.5       ?       ? 
1 1 1   41    7   57 o    203.4    4.9    0.0000   0.0000          ?        ?   415.0391  19.7942          ?        ?      203.4        4.9       ?       ? 
1 1 1   41    7   58 o    218.3    4.7    0.0000   0.0000          ?        ?   478.2527  20.4327          ?        ?      218.3        4.7       ?       ? 
1 1 1   41    7   59 o    107.3    9.2    0.0000   0.0000          ?        ?   116.8494  19.7942          ?        ?      107.3        9.2       ?       ? 
1 1 1   41    7   60 o     23.7   11.7    0.0000   0.0000          ?        ?   -38.3113  19.1556          ?        ?       23.7       11.7       ?       ? 
1 1 1   41    7   61 o     97.9    9.5    0.0000   0.0000          ?        ?    97.6938  18.5171          ?        ?       97.9        9.5       ?       ? 
1 1 1   41    8    0 o    427.9    3.4 1831.9185  28.7335  1831.9185  28.7335  1831.9185  28.7335      427.9      3.4      427.9        3.4     0.0     0.0 
1 1 1   41    8    1 o    268.0    2.7    0.0000   0.0000          ?        ?   718.3369  14.6860          ?        ?      268.0        2.7       ?       ? 
1 1 1   41    8    2 o    826.6    3.3    0.0000   0.0000          ?        ?  6833.4580  54.2743          ?        ?      826.6        3.3       ?       ? 
1 1 1   41    8    3 o    369.5    2.6    0.0000   0.0000          ?        ?  1365.1593  19.1556          ?        ?      369.5        2.6       ?       ? 
1 1 1   41    8    4 o    568.7    2.6    0.0000   0.0000          ?        ?  3234.1121  30.0105          ?        ?      568.7        2.6       ?       ? 
1 1 1   41    8    5 o    660.4    2.9    0.0000   0.0000          ?        ?  4361.7412  37.6728          ?        ?      660.4        2.9       ?       ? 
1 1 1   41    8    6 o    142.0    4.0    0.0000   0.0000          ?        ?   201.7728  11.4934          ?        ?      142.0        4.0       ?       ? 
1 1 1   41    8    7 o    679.7    2.9    0.0000   0.0000          ?        ?  4620.9810  39.5883          ?        ?      679.7        2.9       ?       ? 
1 1 1   41    8    8 o    395.9    2.4    0.0000   0.0000          ?        ?  1567.5706  19.1556          ?        ?      395.9        2.4       ?       ? 
1 1 1   41    8    9 o    330.3    2.4    0.0000   0.0000          ?        ?  1091.2334  15.9630          ?        ?      330.3        2.4       ?       ? 
1 1 1   41    8   10 f    152.0    4.0    0.0000   0.0000          ?        ?   231.1448  12.1319          ?        ?      152.0        4.0       ?       ? 
1 1 1   41    8   11 o    449.4    2.5    0.0000   0.0000          ?        ?  2020.2823  22.3483          ?        ?      449.4        2.5       ?       ? 
1 1 1   41    8   12 o    384.7    2.5    0.0000   0.0000          ?        ?  1480.0931  19.1556          ?        ?      384.7        2.5       ?       ? 
1 1 1   41    8   13 o    219.4    2.9    0.0000   0.0000          ?        ?   481.4453  12.7704          ?        ?      219.4        2.9       ?       ? 
1 1 1   41    8   14 o    437.4    2.3    0.0000   0.0000          ?        ?  1913.6494  20.4327          ?        ?      437.4        2.3       ?       ? 
1 1 1   41    8   15 o    278.5    2.6    0.0000   0.0000          ?        ?   775.8038  14.6860          ?        ?      278.5        2.6       ?       ? 
1 1 1   41    8   16 o    161.4    3.8    0.0000   0.0000          ?        ?   260.5168  12.1319          ?        ?      161.4        3.8       ?       ? 
1 1 1   41    8   17 o    205.7    3.3    0.0000   0.0000          ?        ?   423.3398  13.4090          ?        ?      205.7        3.3       ?       ? 
1 1 1   41    8   18 o    323.6    2.6    0.0000   0.0000          ?        ?  1047.1754  16.6016          ?        ?      323.6        2.6       ?       ? 
1 1 1   41    8   19 o    688.8    2.9    0.0000   0.0000          ?        ?  4745.4927  40.2269          ?        ?      688.8        2.9       ?       ? 
1 1 1   41    8   20 o    811.4    3.2    0.0000   0.0000          ?        ?  6585.7124  52.3588          ?        ?      811.4        3.2       ?       ? 
1 1 1   41    8   21 o    366.8    2.4    0.0000   0.0000          ?        ?  1345.3650  17.8786          ?        ?      366.8        2.4       ?       ? 
1 1 1   41    8   22 o    506.7    2.5    0.0000   0.0000          ?        ?  2567.4956  24.9023          ?        ?      506.7        2.5       ?       ? 
1 1 1   41    8   23 o    230.7    3.0    0.0000   0.0000          ?        ?   532.5270  14.0475          ?        ?      230.7        3.0       ?       ? 
1 1 1   41    8   24 o    171.7    3.9    0.0000   0.0000          ?        ?   294.9970  13.4090          ?        ?      171.7        3.9       ?       ? 
1 1 1   41    8   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    8   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    8   27 o     34.1   13.6    0.0000   0.0000          ?        ?     5.7467  14.0475          ?        ?       34.1       13.6       ?       ? 
1 1 1   41    8   28 o    290.9    2.9    0.0000   0.0000          ?        ?   846.6797  16.6016          ?        ?      290.9        2.9       ?       ? 
1 1 1   41    8   29 o    280.0    3.0    0.0000   0.0000          ?        ?   784.1046  16.6016          ?        ?      280.0        3.0       ?       ? 
1 1 1   41    8   30 o    421.0    2.5    0.0000   0.0000          ?        ?  1773.1747  21.0712          ?        ?      421.0        2.5       ?       ? 
1 1 1   41    8   31 o    240.3    3.3    0.0000   0.0000          ?        ?   577.8621  15.9630          ?        ?      240.3        3.3       ?       ? 
1 1 1   41    8   32 o    165.8    4.6    0.0000   0.0000          ?        ?   275.2028  15.3245          ?        ?      165.8        4.6       ?       ? 
1 1 1   41    8   33 f    210.3    3.6    0.0000   0.0000          ?        ?   442.4955  15.3245          ?        ?      210.3        3.6       ?       ? 
1 1 1   41    8   34 o    284.4    3.0    0.0000   0.0000          ?        ?   809.0069  17.2401          ?        ?      284.4        3.0       ?       ? 
1 1 1   41    8   35 o    251.5    3.2    0.0000   0.0000          ?        ?   632.7749  15.9630          ?        ?      251.5        3.2       ?       ? 
1 1 1   41    8   36 o    131.2    5.6    0.0000   0.0000          ?        ?   172.4008  14.6860          ?        ?      131.2        5.6       ?       ? 
1 1 1   41    8   37 o    225.4    3.7    0.0000   0.0000          ?        ?   508.2632  16.6016          ?        ?      225.4        3.7       ?       ? 
1 1 1   41    8   38 o     95.7    8.0    0.0000   0.0000          ?        ?    91.9471  15.3245          ?        ?       95.7        8.0       ?       ? 
1 1 1   41    8   39 o    484.0    2.5    0.0000   0.0000          ?        ?  2343.3743  24.2638          ?        ?      484.0        2.5       ?       ? 
1 1 1   41    8   40 o    112.8    7.4    0.0000   0.0000          ?        ?   127.7043  16.6016          ?        ?      112.8        7.4       ?       ? 
1 1 1   41    8   41 o    180.7    4.4    0.0000   0.0000          ?        ?   326.9231  15.9630          ?        ?      180.7        4.4       ?       ? 
1 1 1   41    8   42 o    381.4    2.8    0.0000   0.0000          ?        ?  1455.1908  21.0712          ?        ?      381.4        2.8       ?       ? 
1 1 1   41    8   43 o    213.7    4.0    0.0000   0.0000          ?        ?   457.1815  17.2401          ?        ?      213.7        4.0       ?       ? 
1 1 1   41    8   44 o    168.6    5.1    0.0000   0.0000          ?        ?   284.7806  17.2401          ?        ?      168.6        5.1       ?       ? 
1 1 1   41    8   45 o     22.5   11.1    0.0000   0.0000          ?        ?   -35.1187  17.2401          ?        ?       22.5       11.1       ?       ? 
1 1 1   41    8   46 o    338.8    2.9    0.0000   0.0000          ?        ?  1148.7003  19.7942          ?        ?      338.8        2.9       ?       ? 
1 1 1   41    8   47 o    268.0    3.6    0.0000   0.0000          ?        ?   718.9753  19.1556          ?        ?      268.0        3.6       ?       ? 
1 1 1   41    8   48 o    197.5    4.8    0.0000   0.0000          ?        ?   390.7752  19.1556          ?        ?      197.5        4.8       ?       ? 
1 1 1   41    8   49 o     32.7   14.3    0.0000   0.0000          ?        ?    -3.8311  17.8786          ?        ?       32.7       14.3       ?       ? 
1 1 1   41    8   50 o    181.1    4.9    0.0000   0.0000          ?        ?   328.8386  17.8786          ?        ?      181.1        4.9       ?       ? 
1 1 1   41    8   51 f     96.1    9.3    0.0000   0.0000          ?        ?    93.2242  17.8786          ?        ?       96.1        9.3       ?       ? 
1 1 1   41    8   52 o     30.8   13.8    0.0000   0.0000          ?        ?    -8.3008  17.8786          ?        ?       30.8       13.8       ?       ? 
1 1 1   41    8   53 o    267.4    3.7    0.0000   0.0000          ?        ?   716.4213  19.7942          ?        ?      267.4        3.7       ?       ? 
1 1 1   41    8   54 o    154.6    5.8    0.0000   0.0000          ?        ?   240.0841  17.8786          ?        ?      154.6        5.8       ?       ? 
1 1 1   41    8   55 o    122.0    7.9    0.0000   0.0000          ?        ?   150.0526  19.1556          ?        ?      122.0        7.9       ?       ? 
1 1 1   41    8   56 o    202.9    4.9    0.0000   0.0000          ?        ?   413.1235  19.7942          ?        ?      202.9        4.9       ?       ? 
1 1 1   41    8   57 o    142.7    6.7    0.0000   0.0000          ?        ?   204.9654  19.1556          ?        ?      142.7        6.7       ?       ? 
1 1 1   41    8   58 f    124.4    7.7    0.0000   0.0000          ?        ?   156.4378  19.1556          ?        ?      124.4        7.7       ?       ? 
1 1 1   41    8   59 o    246.8    4.0    0.0000   0.0000          ?        ?   611.0652  19.7942          ?        ?      246.8        4.0       ?       ? 
1 1 1   41    8   60 o    119.3    8.3    0.0000   0.0000          ?        ?   144.3059  19.7942          ?        ?      119.3        8.3       ?       ? 
1 1 1   41    9    0 o     28.8   17.0    9.5778  16.6016     9.5778  16.6016     9.5778  16.6016       28.8     17.0       28.8       17.0     0.0     0.0 
1 1 1   41    9    1 o     18.1    8.8    0.0000   0.0000          ?        ?   -15.3245   9.5778          ?        ?       18.1        8.8       ?       ? 
1 1 1   41    9    2 o    476.2    2.5    0.0000   0.0000          ?        ?  2268.0288  24.2638          ?        ?      476.2        2.5       ?       ? 
1 1 1   41    9    3 o    286.5    2.7    0.0000   0.0000          ?        ?   821.1389  15.3245          ?        ?      286.5        2.7       ?       ? 
1 1 1   41    9    4 o    332.2    2.5    0.0000   0.0000          ?        ?  1104.0039  16.6016          ?        ?      332.2        2.5       ?       ? 
1 1 1   41    9    5 o    207.7    2.9    0.0000   0.0000          ?        ?   431.6406  12.1319          ?        ?      207.7        2.9       ?       ? 
1 1 1   41    9    6 o    340.6    2.4    0.0000   0.0000          ?        ?  1160.1937  16.6016          ?        ?      340.6        2.4       ?       ? 
1 1 1   41    9    7 o    333.3    2.3    0.0000   0.0000          ?        ?  1111.0276  15.3245          ?        ?      333.3        2.3       ?       ? 
1 1 1   41    9    8 o    212.6    3.0    0.0000   0.0000          ?        ?   452.0733  12.7704          ?        ?      212.6        3.0       ?       ? 
1 1 1   41    9    9 o    442.6    2.5    0.0000   0.0000          ?        ?  1959.6228  22.3483          ?        ?      442.6        2.5       ?       ? 
1 1 1   41    9   10 o    210.9    2.9    0.0000   0.0000          ?        ?   445.0496  12.1319          ?        ?      210.9        2.9       ?       ? 
1 1 1   41    9   11 o    497.1    2.5    0.0000   0.0000          ?        ?  2471.7173  24.9023          ?        ?      497.1        2.5       ?       ? 
1 1 1   41    9   12 o    180.8    3.2    0.0000   0.0000          ?        ?   326.9231  11.4934          ?        ?      180.8        3.2       ?       ? 
1 1 1   41    9   13 o     88.6    6.1    0.0000   0.0000          ?        ?    78.5382  10.8549          ?        ?       88.6        6.1       ?       ? 
1 1 1   41    9   14 o    359.4    2.4    0.0000   0.0000          ?        ?  1291.7292  17.2401          ?        ?      359.4        2.4       ?       ? 
1 1 1   41    9   15 o    195.4    3.1    0.0000   0.0000          ?        ?   381.8359  12.1319          ?        ?      195.4        3.1       ?       ? 
1 1 1   41    9   16 o    171.7    3.5    0.0000   0.0000          ?        ?   294.9970  12.1319          ?        ?      171.7        3.5       ?       ? 
1 1 1   41    9   17 o     83.0    7.3    0.0000   0.0000          ?        ?    68.9603  12.1319          ?        ?       83.0        7.3       ?       ? 
1 1 1   41    9   18 o    231.0    3.2    0.0000   0.0000          ?        ?   533.8041  14.6860          ?        ?      231.0        3.2       ?       ? 
1 1 1   41    9   19 o    659.6    2.9    0.0000   0.0000          ?        ?  4352.1631  37.6728          ?        ?      659.6        2.9       ?       ? 
1 1 1   41    9   20 o    839.7    3.2    0.0000   0.0000          ?        ?  7053.1099  53.6358          ?        ?      839.7        3.2       ?       ? 
1 1 1   41    9   21 o    434.3    2.4    0.0000   0.0000          ?        ?  1886.8314  21.0712          ?        ?      434.3        2.4       ?       ? 
1 1 1   41    9   22 o    154.1    4.4    0.0000   0.0000          ?        ?   237.5300  13.4090          ?        ?      154.1        4.4       ?       ? 
1 1 1   41    9   23 o    215.1    3.1    0.0000   0.0000          ?        ?   462.9282  13.4090          ?        ?      215.1        3.1       ?       ? 
1 1 1   41    9   24 o    466.6    2.5    0.0000   0.0000          ?        ?  2177.9973  23.6253          ?        ?      466.6        2.5       ?       ? 
1 1 1   41    9   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41    9   26 o    560.9    2.6    0.0000   0.0000          ?        ?  3147.2729  28.7335          ?        ?      560.9        2.6       ?       ? 
1 1 1   41    9   27 o     31.5   13.0    0.0000   0.0000          ?        ?     2.5541  13.4090          ?        ?       31.5       13.0       ?       ? 
1 1 1   41    9   28 o    298.4    2.7    0.0000   0.0000          ?        ?   890.7377  15.9630          ?        ?      298.4        2.7       ?       ? 
1 1 1   41    9   29 o     76.9    9.1    0.0000   0.0000          ?        ?    59.3825  14.0475          ?        ?       76.9        9.1       ?       ? 
1 1 1   41    9   30 o     16.8    8.5    0.0000   0.0000          ?        ?   -44.0580  13.4090          ?        ?       16.8        8.5       ?       ? 
1 1 1   41    9   31 o    151.8    4.6    0.0000   0.0000          ?        ?   230.5063  14.0475          ?        ?      151.8        4.6       ?       ? 
1 1 1   41    9   32 f    255.4    3.3    0.0000   0.0000          ?        ?   652.5691  16.6016          ?        ?      255.4        3.3       ?       ? 
1 1 1   41    9   33 o    262.1    3.2    0.0000   0.0000          ?        ?   687.0493  16.6016          ?        ?      262.1        3.2       ?       ? 
1 1 1   41    9   34 o    383.7    2.6    0.0000   0.0000          ?        ?  1473.0693  19.7942          ?        ?      383.7        2.6       ?       ? 
1 1 1   41    9   35 o    342.2    2.7    0.0000   0.0000          ?        ?  1171.6871  18.5171          ?        ?      342.2        2.7       ?       ? 
1 1 1   41    9   36 o    344.6    2.7    0.0000   0.0000          ?        ?  1187.6503  18.5171          ?        ?      344.6        2.7       ?       ? 
1 1 1   41    9   37 o    411.4    2.6    0.0000   0.0000          ?        ?  1693.3594  21.0712          ?        ?      411.4        2.6       ?       ? 
1 1 1   41    9   38 o    367.0    2.7    0.0000   0.0000          ?        ?  1347.2806  19.7942          ?        ?      367.0        2.7       ?       ? 
1 1 1   41    9   39 o    305.7    3.0    0.0000   0.0000          ?        ?   934.7956  18.5171          ?        ?      305.7        3.0       ?       ? 
1 1 1   41    9   40 o    350.8    2.8    0.0000   0.0000          ?        ?  1231.0697  19.7942          ?        ?      350.8        2.8       ?       ? 
1 1 1   41    9   41 o    191.8    4.3    0.0000   0.0000          ?        ?   368.4270  16.6016          ?        ?      191.8        4.3       ?       ? 
1 1 1   41    9   42 o    290.1    3.0    0.0000   0.0000          ?        ?   842.2100  17.2401          ?        ?      290.1        3.0       ?       ? 
1 1 1   41    9   43 o    375.1    2.8    0.0000   0.0000          ?        ?  1407.9402  21.0712          ?        ?      375.1        2.8       ?       ? 
1 1 1   41    9   44 o    232.9    3.7    0.0000   0.0000          ?        ?   542.7434  17.2401          ?        ?      232.9        3.7       ?       ? 
1 1 1   41    9   45 o     55.6   14.3    0.0000   0.0000          ?        ?    32.5646  15.9630          ?        ?       55.6       14.3       ?       ? 
1 1 1   41    9   46 o     40.2   15.2    0.0000   0.0000          ?        ?    12.1319  16.6016          ?        ?       40.2       15.2       ?       ? 
1 1 1   41    9   47 o    277.4    3.3    0.0000   0.0000          ?        ?   770.0571  18.5171          ?        ?      277.4        3.3       ?       ? 
1 1 1   41    9   48 o    284.4    3.4    0.0000   0.0000          ?        ?   809.6454  19.1556          ?        ?      284.4        3.4       ?       ? 
1 1 1   41    9   49 o    398.4    2.9    0.0000   0.0000          ?        ?  1588.6418  22.9868          ?        ?      398.4        2.9       ?       ? 
1 1 1   41    9   50 o    100.3    9.2    0.0000   0.0000          ?        ?   101.5249  18.5171          ?        ?      100.3        9.2       ?       ? 
1 1 1   41    9   51 o    255.1    3.8    0.0000   0.0000          ?        ?   651.9305  19.1556          ?        ?      255.1        3.8       ?       ? 
1 1 1   41    9   52 o    254.4    3.8    0.0000   0.0000          ?        ?   648.0994  19.1556          ?        ?      254.4        3.8       ?       ? 
1 1 1   41    9   53 o    230.1    4.2    0.0000   0.0000          ?        ?   530.6115  19.1556          ?        ?      230.1        4.2       ?       ? 
1 1 1   41    9   54 o    205.5    4.7    0.0000   0.0000          ?        ?   423.3398  19.1556          ?        ?      205.5        4.7       ?       ? 
1 1 1   41    9   55 o    148.9    6.2    0.0000   0.0000          ?        ?   222.8441  18.5171          ?        ?      148.9        6.2       ?       ? 
1 1 1   41    9   56 o    177.5    5.8    0.0000   0.0000          ?        ?   316.7067  20.4327          ?        ?      177.5        5.8       ?       ? 
1 1 1   41    9   57 o    220.5    4.5    0.0000   0.0000          ?        ?   487.8305  19.7942          ?        ?      220.5        4.5       ?       ? 
1 1 1   41    9   58 o    198.0    5.0    0.0000   0.0000          ?        ?   393.9678  19.7942          ?        ?      198.0        5.0       ?       ? 
1 1 1   41    9   59 f     28.7   13.2    0.0000   0.0000          ?        ?   -13.4090  17.8786          ?        ?       28.7       13.2       ?       ? 
1 1 1   41   10    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   10    1 o    393.8    2.4    0.0000   0.0000          ?        ?  1550.9690  19.1556          ?        ?      393.8        2.4       ?       ? 
1 1 1   41   10    2 f    328.2    2.4    0.0000   0.0000          ?        ?  1077.1859  15.9630          ?        ?      328.2        2.4       ?       ? 
1 1 1   41   10    3 o    890.8    3.3    0.0000   0.0000          ?        ?  7936.8237  59.3825          ?        ?      890.8        3.3       ?       ? 
1 1 1   41   10    4 o    380.7    2.4    0.0000   0.0000          ?        ?  1449.4441  18.5171          ?        ?      380.7        2.4       ?       ? 
1 1 1   41   10    5 o    273.5    2.5    0.0000   0.0000          ?        ?   748.3474  13.4090          ?        ?      273.5        2.5       ?       ? 
1 1 1   41   10    6 o    100.4    5.1    0.0000   0.0000          ?        ?   100.8864  10.2163          ?        ?      100.4        5.1       ?       ? 
1 1 1   41   10    7 o    319.6    2.4    0.0000   0.0000          ?        ?  1021.6346  15.3245          ?        ?      319.6        2.4       ?       ? 
1 1 1   41   10    8 o    639.0    2.8    0.0000   0.0000          ?        ?  4083.9841  35.7572          ?        ?      639.0        2.8       ?       ? 
1 1 1   41   10    9 o    426.2    2.5    0.0000   0.0000          ?        ?  1816.5940  21.7097          ?        ?      426.2        2.5       ?       ? 
1 1 1   41   10   10 o    299.0    2.6    0.0000   0.0000          ?        ?   893.9303  15.3245          ?        ?      299.0        2.6       ?       ? 
1 1 1   41   10   11 o    580.6    2.6    0.0000   0.0000          ?        ?  3371.3943  30.6490          ?        ?      580.6        2.6       ?       ? 
1 1 1   41   10   12 o    358.1    2.3    0.0000   0.0000          ?        ?  1282.7899  16.6016          ?        ?      358.1        2.3       ?       ? 
1 1 1   41   10   13 o    218.2    2.8    0.0000   0.0000          ?        ?   476.3371  12.1319          ?        ?      218.2        2.8       ?       ? 
1 1 1   41   10   14 o    537.3    2.7    0.0000   0.0000          ?        ?  2887.3948  28.7335          ?        ?      537.3        2.7       ?       ? 
1 1 1   41   10   15 o    399.2    2.5    0.0000   0.0000          ?        ?  1593.7500  19.7942          ?        ?      399.2        2.5       ?       ? 
1 1 1   41   10   16 o    166.1    3.7    0.0000   0.0000          ?        ?   275.8413  12.1319          ?        ?      166.1        3.7       ?       ? 
1 1 1   41   10   17 o    230.7    2.8    0.0000   0.0000          ?        ?   532.5270  12.7704          ?        ?      230.7        2.8       ?       ? 
1 1 1   41   10   18 o    390.4    2.4    0.0000   0.0000          ?        ?  1524.1511  18.5171          ?        ?      390.4        2.4       ?       ? 
1 1 1   41   10   19 o    246.0    2.9    0.0000   0.0000          ?        ?   605.3185  14.0475          ?        ?      246.0        2.9       ?       ? 
1 1 1   41   10   20 o    375.0    2.4    0.0000   0.0000          ?        ?  1406.6632  17.8786          ?        ?      375.0        2.4       ?       ? 
1 1 1   41   10   21 o    173.4    3.7    0.0000   0.0000          ?        ?   300.7437  12.7704          ?        ?      173.4        3.7       ?       ? 
1 1 1   41   10   22 o     21.9   10.4    0.0000   0.0000          ?        ?   -14.6860  12.1319          ?        ?       21.9       10.4       ?       ? 
1 1 1   41   10   23 o    320.1    2.5    0.0000   0.0000          ?        ?  1024.8273  15.9630          ?        ?      320.1        2.5       ?       ? 
1 1 1   41   10   24 o     66.3   10.1    0.0000   0.0000          ?        ?    44.0580  13.4090          ?        ?       66.3       10.1       ?       ? 
1 1 1   41   10   25 o    215.7    3.3    0.0000   0.0000          ?        ?   465.4823  14.0475          ?        ?      215.7        3.3       ?       ? 
1 1 1   41   10   26 f    561.8    2.6    0.0000   0.0000          ?        ?  3157.4895  29.3720          ?        ?      561.8        2.6       ?       ? 
1 1 1   41   10   27 o    326.9    2.6    0.0000   0.0000          ?        ?  1068.8851  17.2401          ?        ?      326.9        2.6       ?       ? 
1 1 1   41   10   28 o    291.8    2.7    0.0000   0.0000          ?        ?   851.7878  15.9630          ?        ?      291.8        2.7       ?       ? 
1 1 1   41   10   29 o    257.0    3.0    0.0000   0.0000          ?        ?   660.8699  15.3245          ?        ?      257.0        3.0       ?       ? 
1 1 1   41   10   30 o    112.1    6.3    0.0000   0.0000          ?        ?   125.7888  14.0475          ?        ?      112.1        6.3       ?       ? 
1 1 1   41   10   31 o    271.6    2.9    0.0000   0.0000          ?        ?   738.1310  15.9630          ?        ?      271.6        2.9       ?       ? 
1 1 1   41   10   32 o    271.9    2.9    0.0000   0.0000          ?        ?   739.4081  15.9630          ?        ?      271.9        2.9       ?       ? 
1 1 1   41   10   33 o    174.8    4.4    0.0000   0.0000          ?        ?   305.8519  15.3245          ?        ?      174.8        4.4       ?       ? 
1 1 1   41   10   34 o    542.4    2.6    0.0000   0.0000          ?        ?  2942.9460  28.0950          ?        ?      542.4        2.6       ?       ? 
1 1 1   41   10   35 o     98.7    7.8    0.0000   0.0000          ?        ?    97.6938  15.3245          ?        ?       98.7        7.8       ?       ? 
1 1 1   41   10   36 o    313.3    2.9    0.0000   0.0000          ?        ?   982.0463  17.8786          ?        ?      313.3        2.9       ?       ? 
1 1 1   41   10   37 o    188.2    3.9    0.0000   0.0000          ?        ?   354.3795  14.6860          ?        ?      188.2        3.9       ?       ? 
1 1 1   41   10   38 o    104.3    7.7    0.0000   0.0000          ?        ?   109.1872  15.9630          ?        ?      104.3        7.7       ?       ? 
1 1 1   41   10   39 o     47.3   15.0    0.0000   0.0000          ?        ?    22.3483  15.9630          ?        ?       47.3       15.0       ?       ? 
1 1 1   41   10   40 f    557.7    2.7    0.0000   0.0000          ?        ?  3112.1543  30.0105          ?        ?      557.7        2.7       ?       ? 
1 1 1   41   10   41 o    204.1    4.1    0.0000   0.0000          ?        ?   416.9547  16.6016          ?        ?      204.1        4.1       ?       ? 
1 1 1   41   10   42 o     87.3    9.5    0.0000   0.0000          ?        ?    76.6226  16.6016          ?        ?       87.3        9.5       ?       ? 
1 1 1   41   10   43 o     20.0   10.0    0.0000   0.0000          ?        ?   -41.5039  15.9630          ?        ?       20.0       10.0       ?       ? 
1 1 1   41   10   44 o    121.0    6.9    0.0000   0.0000          ?        ?   146.8600  16.6016          ?        ?      121.0        6.9       ?       ? 
1 1 1   41   10   45 o     85.0   10.1    0.0000   0.0000          ?        ?    72.7915  17.2401          ?        ?       85.0       10.1       ?       ? 
1 1 1   41   10   46 o    211.9    4.4    0.0000   0.0000          ?        ?   449.5192  18.5171          ?        ?      211.9        4.4       ?       ? 
1 1 1   41   10   47 o    287.5    3.2    0.0000   0.0000          ?        ?   827.5240  18.5171          ?        ?      287.5        3.2       ?       ? 
1 1 1   41   10   48 o     26.4   12.5    0.0000   0.0000          ?        ?   -21.7097  17.8786          ?        ?       26.4       12.5       ?       ? 
1 1 1   41   10   49 o    126.8    7.1    0.0000   0.0000          ?        ?   161.5460  17.8786          ?        ?      126.8        7.1       ?       ? 
1 1 1   41   10   50 o    134.6    6.6    0.0000   0.0000          ?        ?   181.9787  17.8786          ?        ?      134.6        6.6       ?       ? 
1 1 1   41   10   51 f    197.3    4.9    0.0000   0.0000          ?        ?   390.1367  19.1556          ?        ?      197.3        4.9       ?       ? 
1 1 1   41   10   52 o     99.6    9.6    0.0000   0.0000          ?        ?   100.2479  19.1556          ?        ?       99.6        9.6       ?       ? 
1 1 1   41   10   53 f    191.8    4.8    0.0000   0.0000          ?        ?   369.0655  18.5171          ?        ?      191.8        4.8       ?       ? 
1 1 1   41   10   54 o    171.8    5.6    0.0000   0.0000          ?        ?   296.2740  19.1556          ?        ?      171.8        5.6       ?       ? 
1 1 1   41   10   55 o    116.9    7.9    0.0000   0.0000          ?        ?   137.9207  18.5171          ?        ?      116.9        7.9       ?       ? 
1 1 1   41   10   56 o    181.6    5.3    0.0000   0.0000          ?        ?   331.3927  19.1556          ?        ?      181.6        5.3       ?       ? 
1 1 1   41   10   57 o     87.0   10.6    0.0000   0.0000          ?        ?    77.2611  18.5171          ?        ?       87.0       10.6       ?       ? 
1 1 1   41   10   58 o     48.4   16.2    0.0000   0.0000          ?        ?    23.6253  18.5171          ?        ?       48.4       16.2       ?       ? 
1 1 1   41   11    0 o    575.6    3.6 3313.9272  41.5039  3313.9272  41.5039  3313.9272  41.5039      575.6      3.6      575.6        3.6     0.0     0.0 
1 1 1   41   11    1 o    263.9    2.4    0.0000   0.0000          ?        ?   696.6271  12.7704          ?        ?      263.9        2.4       ?       ? 
1 1 1   41   11    2 o    400.1    2.4    0.0000   0.0000          ?        ?  1600.7737  19.1556          ?        ?      400.1        2.4       ?       ? 
1 1 1   41   11    3 o    489.4    2.4    0.0000   0.0000          ?        ?  2395.0947  23.6253          ?        ?      489.4        2.4       ?       ? 
1 1 1   41   11    4 o    294.6    2.4    0.0000   0.0000          ?        ?   867.7509  14.0475          ?        ?      294.6        2.4       ?       ? 
1 1 1   41   11    5 f    132.5    3.6    0.0000   0.0000          ?        ?   175.5934   9.5778          ?        ?      132.5        3.6       ?       ? 
1 1 1   41   11    6 o    489.9    2.4    0.0000   0.0000          ?        ?  2400.8413  23.6253          ?        ?      489.9        2.4       ?       ? 
1 1 1   41   11    7 o    288.9    2.4    0.0000   0.0000          ?        ?   834.5477  14.0475          ?        ?      288.9        2.4       ?       ? 
1 1 1   41   11    8 o     67.8    7.1    0.0000   0.0000          ?        ?    45.9736   9.5778          ?        ?       67.8        7.1       ?       ? 
1 1 1   41   11    9 o    281.2    2.4    0.0000   0.0000          ?        ?   791.1283  13.4090          ?        ?      281.2        2.4       ?       ? 
1 1 1   41   11   10 o    423.6    2.5    0.0000   0.0000          ?        ?  1794.8843  21.0712          ?        ?      423.6        2.5       ?       ? 
1 1 1   41   11   11 o    201.8    2.8    0.0000   0.0000          ?        ?   407.3768  11.4934          ?        ?      201.8        2.8       ?       ? 
1 1 1   41   11   12 o    360.2    2.5    0.0000   0.0000          ?        ?  1297.4760  17.8786          ?        ?      360.2        2.5       ?       ? 
1 1 1   41   11   13 o     74.5    7.3    0.0000   0.0000          ?        ?    55.5514  10.8549          ?        ?       74.5        7.3       ?       ? 
1 1 1   41   11   14 o    398.7    2.4    0.0000   0.0000          ?        ?  1589.9188  19.1556          ?        ?      398.7        2.4       ?       ? 
1 1 1   41   11   15 o    534.7    2.7    0.0000   0.0000          ?        ?  2859.2998  28.7335          ?        ?      534.7        2.7       ?       ? 
1 1 1   41   11   16 o    442.1    2.5    0.0000   0.0000          ?        ?  1955.1533  21.7097          ?        ?      442.1        2.5       ?       ? 
1 1 1   41   11   17 o    269.1    2.7    0.0000   0.0000          ?        ?   724.0836  14.6860          ?        ?      269.1        2.7       ?       ? 
1 1 1   41   11   18 o    209.4    3.2    0.0000   0.0000          ?        ?   438.6643  13.4090          ?        ?      209.4        3.2       ?       ? 
1 1 1   41   11   19 o    283.8    2.6    0.0000   0.0000          ?        ?   805.8143  14.6860          ?        ?      283.8        2.6       ?       ? 
1 1 1   41   11   20 f    117.7    5.4    0.0000   0.0000          ?        ?   138.5592  12.7704          ?        ?      117.7        5.4       ?       ? 
1 1 1   41   11   21 o    385.3    2.3    0.0000   0.0000          ?        ?  1485.2013  17.8786          ?        ?      385.3        2.3       ?       ? 
1 1 1   41   11   22 o    165.3    4.1    0.0000   0.0000          ?        ?   273.2873  13.4090          ?        ?      165.3        4.1       ?       ? 
1 1 1   41   11   23 o    303.7    2.5    0.0000   0.0000          ?        ?   922.6638  15.3245          ?        ?      303.7        2.5       ?       ? 
1 1 1   41   11   24 o    441.8    2.5    0.0000   0.0000          ?        ?  1952.5990  22.3483          ?        ?      441.8        2.5       ?       ? 
1 1 1   41   11   25 o    227.7    3.2    0.0000   0.0000          ?        ?   518.4796  14.6860          ?        ?      227.7        3.2       ?       ? 
1 1 1   41   11   26 o     76.5    8.3    0.0000   0.0000          ?        ?    58.7440  12.7704          ?        ?       76.5        8.3       ?       ? 
1 1 1   41   11   27 o    313.6    2.6    0.0000   0.0000          ?        ?   983.9619  16.6016          ?        ?      313.6        2.6       ?       ? 
1 1 1   41   11   28 o     60.7   12.0    0.0000   0.0000          ?        ?    38.3113  14.0475          ?        ?       60.7       12.0       ?       ? 
1 1 1   41   11   29 o    220.8    3.3    0.0000   0.0000          ?        ?   487.8305  14.6860          ?        ?      220.8        3.3       ?       ? 
1 1 1   41   11   30 o    346.3    2.6    0.0000   0.0000          ?        ?  1199.7821  17.8786          ?        ?      346.3        2.6       ?       ? 
1 1 1   41   11   31 o    119.5    6.1    0.0000   0.0000          ?        ?   143.0288  14.6860          ?        ?      119.5        6.1       ?       ? 
1 1 1   41   11   32 o    324.2    2.7    0.0000   0.0000          ?        ?  1051.6451  17.2401          ?        ?      324.2        2.7       ?       ? 
1 1 1   41   11   33 f    256.8    3.1    0.0000   0.0000          ?        ?   659.5928  15.9630          ?        ?      256.8        3.1       ?       ? 
1 1 1   41   11   34 o    384.6    2.6    0.0000   0.0000          ?        ?  1480.0931  19.7942          ?        ?      384.6        2.6       ?       ? 
1 1 1   41   11   35 o     99.6    7.7    0.0000   0.0000          ?        ?    99.6094  15.3245          ?        ?       99.6        7.7       ?       ? 
1 1 1   41   11   36 o    412.0    2.6    0.0000   0.0000          ?        ?  1698.4675  21.7097          ?        ?      412.0        2.6       ?       ? 
1 1 1   41   11   37 o    269.4    3.2    0.0000   0.0000          ?        ?   725.9991  17.2401          ?        ?      269.4        3.2       ?       ? 
1 1 1   41   11   38 o    325.8    2.8    0.0000   0.0000          ?        ?  1061.8615  18.5171          ?        ?      325.8        2.8       ?       ? 
1 1 1   41   11   39 o    532.2    2.6    0.0000   0.0000          ?        ?  2833.7588  28.0950          ?        ?      532.2        2.6       ?       ? 
1 1 1   41   11   40 o     82.8   10.0    0.0000   0.0000          ?        ?    68.9603  16.6016          ?        ?       82.8       10.0       ?       ? 
1 1 1   41   11   41 o    235.7    3.7    0.0000   0.0000          ?        ?   556.1523  17.2401          ?        ?      235.7        3.7       ?       ? 
1 1 1   41   11   42 o    100.2    8.3    0.0000   0.0000          ?        ?   100.8864  16.6016          ?        ?      100.2        8.3       ?       ? 
1 1 1   41   11   43 o    515.7    2.7    0.0000   0.0000          ?        ?  2661.3582  28.0950          ?        ?      515.7        2.7       ?       ? 
1 1 1   41   11   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   11   45 f    368.5    2.9    0.0000   0.0000          ?        ?  1358.7740  21.7097          ?        ?      368.5        2.9       ?       ? 
1 1 1   41   11   46 o     44.4   15.9    0.0000   0.0000          ?        ?    17.2401  17.8786          ?        ?       44.4       15.9       ?       ? 
1 1 1   41   11   47 o    214.5    4.3    0.0000   0.0000          ?        ?   461.0126  18.5171          ?        ?      214.5        4.3       ?       ? 
1 1 1   41   11   48 f     29.7   13.5    0.0000   0.0000          ?        ?    -9.5778  17.2401          ?        ?       29.7       13.5       ?       ? 
1 1 1   41   11   49 o    147.5    6.3    0.0000   0.0000          ?        ?   218.3744  18.5171          ?        ?      147.5        6.3       ?       ? 
1 1 1   41   11   50 o    304.0    3.3    0.0000   0.0000          ?        ?   925.2178  19.7942          ?        ?      304.0        3.3       ?       ? 
1 1 1   41   11   51 o    147.6    6.5    0.0000   0.0000          ?        ?   219.0129  19.1556          ?        ?      147.6        6.5       ?       ? 
1 1 1   41   11   52 o    204.8    4.8    0.0000   0.0000          ?        ?   420.7858  19.7942          ?        ?      204.8        4.8       ?       ? 
1 1 1   41   11   53 o     31.3   14.1    0.0000   0.0000          ?        ?    -8.3008  18.5171          ?        ?       31.3       14.1       ?       ? 
1 1 1   41   11   54 o    162.2    5.5    0.0000   0.0000          ?        ?   264.3480  17.8786          ?        ?      162.2        5.5       ?       ? 
1 1 1   41   11   55 o     55.3   16.3    0.0000   0.0000          ?        ?    32.5646  19.1556          ?        ?       55.3       16.3       ?       ? 
1 1 1   41   11   56 o    222.8    4.2    0.0000   0.0000          ?        ?   498.0469  18.5171          ?        ?      222.8        4.2       ?       ? 
1 1 1   41   11   57 o    177.3    5.2    0.0000   0.0000          ?        ?   316.0682  18.5171          ?        ?      177.3        5.2       ?       ? 
1 1 1   41   11   58 o    156.2    5.7    0.0000   0.0000          ?        ?   245.8308  17.8786          ?        ?      156.2        5.7       ?       ? 
1 1 1   41   12    0 o     32.8   15.9   15.9630  12.1319    15.9630  12.1319    15.9630  12.1319       32.8     15.9       32.8       15.9     0.0     0.0 
1 1 1   41   12    1 o    153.9    3.1    0.0000   0.0000          ?        ?   236.8915   9.5778          ?        ?      153.9        3.1       ?       ? 
1 1 1   41   12    2 o    457.3    2.5    0.0000   0.0000          ?        ?  2091.1584  22.9868          ?        ?      457.3        2.5       ?       ? 
1 1 1   41   12    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   12    4 o     83.4    5.4    0.0000   0.0000          ?        ?    69.5989   8.9393          ?        ?       83.4        5.4       ?       ? 
1 1 1   41   12    5 o     54.7    8.2    0.0000   0.0000          ?        ?    30.0105   8.9393          ?        ?       54.7        8.2       ?       ? 
1 1 1   41   12    6 o    246.0    2.6    0.0000   0.0000          ?        ?   605.3185  12.7704          ?        ?      246.0        2.6       ?       ? 
1 1 1   41   12    7 o    129.8    3.7    0.0000   0.0000          ?        ?   168.5697   9.5778          ?        ?      129.8        3.7       ?       ? 
1 1 1   41   12    8 o     74.9    6.4    0.0000   0.0000          ?        ?    56.1899   9.5778          ?        ?       74.9        6.4       ?       ? 
1 1 1   41   12    9 o    339.7    2.3    0.0000   0.0000          ?        ?  1154.4471  15.9630          ?        ?      339.7        2.3       ?       ? 
1 1 1   41   12   10 o    101.7    5.0    0.0000   0.0000          ?        ?   103.4405  10.2163          ?        ?      101.7        5.0       ?       ? 
1 1 1   41   12   11 o    300.9    2.3    0.0000   0.0000          ?        ?   905.4237  14.0475          ?        ?      300.9        2.3       ?       ? 
1 1 1   41   12   12 o    109.5    4.7    0.0000   0.0000          ?        ?   120.0421  10.2163          ?        ?      109.5        4.7       ?       ? 
1 1 1   41   12   13 o    300.9    2.5    0.0000   0.0000          ?        ?   905.4237  15.3245          ?        ?      300.9        2.5       ?       ? 
1 1 1   41   12   14 o    435.9    2.5    0.0000   0.0000          ?        ?  1900.2404  21.7097          ?        ?      435.9        2.5       ?       ? 
1 1 1   41   12   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   12   16 o     66.3    8.2    0.0000   0.0000          ?        ?    44.0580  10.8549          ?        ?       66.3        8.2       ?       ? 
1 1 1   41   12   17 o    101.3    6.0    0.0000   0.0000          ?        ?   102.8020  12.1319          ?        ?      101.3        6.0       ?       ? 
1 1 1   41   12   18 o    458.8    2.4    0.0000   0.0000          ?        ?  2105.2058  22.3483          ?        ?      458.8        2.4       ?       ? 
1 1 1   41   12   19 o    510.0    2.5    0.0000   0.0000          ?        ?  2601.3372  25.5409          ?        ?      510.0        2.5       ?       ? 
1 1 1   41   12   20 o    593.2    2.8    0.0000   0.0000          ?        ?  3520.1697  33.2031          ?        ?      593.2        2.8       ?       ? 
1 1 1   41   12   21 o    442.8    2.4    0.0000   0.0000          ?        ?  1961.5386  21.0712          ?        ?      442.8        2.4       ?       ? 
1 1 1   41   12   22 o    295.9    2.7    0.0000   0.0000          ?        ?   876.0516  15.9630          ?        ?      295.9        2.7       ?       ? 
1 1 1   41   12   23 o     90.3    7.1    0.0000   0.0000          ?        ?    81.7308  12.7704          ?        ?       90.3        7.1       ?       ? 
1 1 1   41   12   24 o    196.5    3.6    0.0000   0.0000          ?        ?   386.3056  14.0475          ?        ?      196.5        3.6       ?       ? 
1 1 1   41   12   25 o    261.7    2.8    0.0000   0.0000          ?        ?   685.1337  14.6860          ?        ?      261.7        2.8       ?       ? 
1 1 1   41   12   26 o    354.3    2.6    0.0000   0.0000          ?        ?  1255.9720  18.5171          ?        ?      354.3        2.6       ?       ? 
1 1 1   41   12   27 o    157.9    4.2    0.0000   0.0000          ?        ?   249.6619  13.4090          ?        ?      157.9        4.2       ?       ? 
1 1 1   41   12   28 o    137.9    5.1    0.0000   0.0000          ?        ?   190.2794  14.0475          ?        ?      137.9        5.1       ?       ? 
1 1 1   41   12   29 o    109.4    6.7    0.0000   0.0000          ?        ?   120.0421  14.6860          ?        ?      109.4        6.7       ?       ? 
1 1 1   41   12   30 o    242.7    3.3    0.0000   0.0000          ?        ?   589.3555  15.9630          ?        ?      242.7        3.3       ?       ? 
1 1 1   41   12   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   12   32 o    470.8    2.6    0.0000   0.0000          ?        ?  2217.5854  24.2638          ?        ?      470.8        2.6       ?       ? 
1 1 1   41   12   33 o    550.0    2.7    0.0000   0.0000          ?        ?  3026.5925  29.3720          ?        ?      550.0        2.7       ?       ? 
1 1 1   41   12   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   12   35 o     23.8   11.3    0.0000   0.0000          ?        ?   -18.5171  14.6860          ?        ?       23.8       11.3       ?       ? 
1 1 1   41   12   36 o    267.4    3.5    0.0000   0.0000          ?        ?   715.7827  18.5171          ?        ?      267.4        3.5       ?       ? 
1 1 1   41   12   37 o    520.0    2.7    0.0000   0.0000          ?        ?  2705.4163  28.0950          ?        ?      520.0        2.7       ?       ? 
1 1 1   41   12   38 o    213.3    3.9    0.0000   0.0000          ?        ?   455.2659  16.6016          ?        ?      213.3        3.9       ?       ? 
1 1 1   41   12   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   12   40 o    335.6    2.9    0.0000   0.0000          ?        ?  1126.9907  19.1556          ?        ?      335.6        2.9       ?       ? 
1 1 1   41   12   41 o    150.4    5.5    0.0000   0.0000          ?        ?   226.6752  16.6016          ?        ?      150.4        5.5       ?       ? 
1 1 1   41   12   42 f    168.8    4.7    0.0000   0.0000          ?        ?   285.4192  15.9630          ?        ?      168.8        4.7       ?       ? 
1 1 1   41   12   43 o    131.6    6.3    0.0000   0.0000          ?        ?   173.6779  16.6016          ?        ?      131.6        6.3       ?       ? 
1 1 1   41   12   44 o    271.3    3.4    0.0000   0.0000          ?        ?   736.8539  18.5171          ?        ?      271.3        3.4       ?       ? 
1 1 1   41   12   45 o    123.3    7.0    0.0000   0.0000          ?        ?   152.6067  17.2401          ?        ?      123.3        7.0       ?       ? 
1 1 1   41   12   46 o    175.0    5.1    0.0000   0.0000          ?        ?   307.1289  17.8786          ?        ?      175.0        5.1       ?       ? 
1 1 1   41   12   47 o    119.0    7.2    0.0000   0.0000          ?        ?   142.3903  17.2401          ?        ?      119.0        7.2       ?       ? 
1 1 1   41   12   48 o     76.1   11.3    0.0000   0.0000          ?        ?    58.7440  17.2401          ?        ?       76.1       11.3       ?       ? 
1 1 1   41   12   49 o     20.0   10.1    0.0000   0.0000          ?        ?   -52.9973  17.8786          ?        ?       20.0       10.1       ?       ? 
1 1 1   41   12   50 o    163.3    5.7    0.0000   0.0000          ?        ?   267.5406  18.5171          ?        ?      163.3        5.7       ?       ? 
1 1 1   41   12   51 o    205.2    4.4    0.0000   0.0000          ?        ?   422.0628  17.8786          ?        ?      205.2        4.4       ?       ? 
1 1 1   41   12   52 o    165.7    5.6    0.0000   0.0000          ?        ?   275.8413  18.5171          ?        ?      165.7        5.6       ?       ? 
1 1 1   41   12   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   12   54 o    172.3    5.4    0.0000   0.0000          ?        ?   298.1896  18.5171          ?        ?      172.3        5.4       ?       ? 
1 1 1   41   12   55 o    127.0    7.3    0.0000   0.0000          ?        ?   162.8230  18.5171          ?        ?      127.0        7.3       ?       ? 
1 1 1   41   12   56 o     72.2   13.3    0.0000   0.0000          ?        ?    55.5514  18.5171          ?        ?       72.2       13.3       ?       ? 
1 1 1   41   12   57 o     30.0   13.6    0.0000   0.0000          ?        ?    -9.5778  17.8786          ?        ?       30.0       13.6       ?       ? 
1 1 1   41   13    0 o    243.9    3.4  595.1021  16.6016   595.1021  16.6016   595.1021  16.6016      243.9      3.4      243.9        3.4     0.0     0.0 
1 1 1   41   13    1 o    271.0    2.4    0.0000   0.0000          ?        ?   734.2999  12.7704          ?        ?      271.0        2.4       ?       ? 
1 1 1   41   13    2 o    214.2    2.5    0.0000   0.0000          ?        ?   459.0970  10.8549          ?        ?      214.2        2.5       ?       ? 
1 1 1   41   13    3 o    559.6    2.7    0.0000   0.0000          ?        ?  3131.9485  30.6490          ?        ?      559.6        2.7       ?       ? 
1 1 1   41   13    4 o    196.4    2.4    0.0000   0.0000          ?        ?   385.6671   9.5778          ?        ?      196.4        2.4       ?       ? 
1 1 1   41   13    5 o    210.9    2.6    0.0000   0.0000          ?        ?   445.0496  10.8549          ?        ?      210.9        2.6       ?       ? 
1 1 1   41   13    6 o    241.8    2.5    0.0000   0.0000          ?        ?   584.8858  12.1319          ?        ?      241.8        2.5       ?       ? 
1 1 1   41   13    7 o    439.1    2.3    0.0000   0.0000          ?        ?  1928.3353  20.4327          ?        ?      439.1        2.3       ?       ? 
1 1 1   41   13    8 o     83.8    5.3    0.0000   0.0000          ?        ?    70.2374   8.9393          ?        ?       83.8        5.3       ?       ? 
1 1 1   41   13    9 o    287.6    2.3    0.0000   0.0000          ?        ?   827.5240  13.4090          ?        ?      287.6        2.3       ?       ? 
1 1 1   41   13   10 o    269.4    2.5    0.0000   0.0000          ?        ?   725.9991  13.4090          ?        ?      269.4        2.5       ?       ? 
1 1 1   41   13   11 o    322.7    2.4    0.0000   0.0000          ?        ?  1041.4288  15.3245          ?        ?      322.7        2.4       ?       ? 
1 1 1   41   13   12 o    326.1    2.3    0.0000   0.0000          ?        ?  1063.7771  15.3245          ?        ?      326.1        2.3       ?       ? 
1 1 1   41   13   13 o    379.9    2.4    0.0000   0.0000          ?        ?  1443.6974  18.5171          ?        ?      379.9        2.4       ?       ? 
1 1 1   41   13   14 o    123.5    4.4    0.0000   0.0000          ?        ?   152.6067  10.8549          ?        ?      123.5        4.4       ?       ? 
1 1 1   41   13   15 o    262.1    2.6    0.0000   0.0000          ?        ?   687.0493  13.4090          ?        ?      262.1        2.6       ?       ? 
1 1 1   41   13   16 o    190.7    3.3    0.0000   0.0000          ?        ?   363.9573  12.7704          ?        ?      190.7        3.3       ?       ? 
1 1 1   41   13   17 o    364.1    2.4    0.0000   0.0000          ?        ?  1326.2094  17.2401          ?        ?      364.1        2.4       ?       ? 
1 1 1   41   13   18 o    370.8    2.4    0.0000   0.0000          ?        ?  1375.3755  17.8786          ?        ?      370.8        2.4       ?       ? 
1 1 1   41   13   19 o    450.1    2.6    0.0000   0.0000          ?        ?  2026.6676  22.9868          ?        ?      450.1        2.6       ?       ? 
1 1 1   41   13   20 o    119.5    5.3    0.0000   0.0000          ?        ?   143.0288  12.7704          ?        ?      119.5        5.3       ?       ? 
1 1 1   41   13   21 o    158.3    4.4    0.0000   0.0000          ?        ?   250.9390  14.0475          ?        ?      158.3        4.4       ?       ? 
1 1 1   41   13   22 o    482.0    2.5    0.0000   0.0000          ?        ?  2324.2188  24.2638          ?        ?      482.0        2.5       ?       ? 
1 1 1   41   13   23 o    102.6    6.2    0.0000   0.0000          ?        ?   105.3561  12.7704          ?        ?      102.6        6.2       ?       ? 
1 1 1   41   13   24 o    198.3    3.4    0.0000   0.0000          ?        ?   393.3293  13.4090          ?        ?      198.3        3.4       ?       ? 
1 1 1   41   13   25 o    361.0    2.4    0.0000   0.0000          ?        ?  1303.2227  17.2401          ?        ?      361.0        2.4       ?       ? 
1 1 1   41   13   26 o    308.2    2.7    0.0000   0.0000          ?        ?   950.1202  16.6016          ?        ?      308.2        2.7       ?       ? 
1 1 1   41   13   27 o    132.7    5.3    0.0000   0.0000          ?        ?   176.2320  14.0475          ?        ?      132.7        5.3       ?       ? 
1 1 1   41   13   28 o    310.8    2.7    0.0000   0.0000          ?        ?   966.0833  16.6016          ?        ?      310.8        2.7       ?       ? 
1 1 1   41   13   29 o     17.1    8.6    0.0000   0.0000          ?        ?   -46.6121  14.0475          ?        ?       17.1        8.6       ?       ? 
1 1 1   41   13   30 o    295.4    2.8    0.0000   0.0000          ?        ?   872.8591  16.6016          ?        ?      295.4        2.8       ?       ? 
1 1 1   41   13   31 o     90.2    8.1    0.0000   0.0000          ?        ?    81.7308  14.6860          ?        ?       90.2        8.1       ?       ? 
1 1 1   41   13   32 o    111.4    6.6    0.0000   0.0000          ?        ?   124.5117  14.6860          ?        ?      111.4        6.6       ?       ? 
1 1 1   41   13   33 o    517.4    2.6    0.0000   0.0000          ?        ?  2678.5981  26.8179          ?        ?      517.4        2.6       ?       ? 
1 1 1   41   13   34 o    396.6    2.7    0.0000   0.0000          ?        ?  1573.9558  21.0712          ?        ?      396.6        2.7       ?       ? 
1 1 1   41   13   35 o    233.3    3.6    0.0000   0.0000          ?        ?   544.6590  16.6016          ?        ?      233.3        3.6       ?       ? 
1 1 1   41   13   36 o    472.6    2.7    0.0000   0.0000          ?        ?  2234.1870  25.5409          ?        ?      472.6        2.7       ?       ? 
1 1 1   41   13   37 o    498.6    2.7    0.0000   0.0000          ?        ?  2487.0417  26.8179          ?        ?      498.6        2.7       ?       ? 
1 1 1   41   13   38 o     93.0    8.6    0.0000   0.0000          ?        ?    86.8389  15.9630          ?        ?       93.0        8.6       ?       ? 
1 1 1   41   13   39 f    133.3    6.2    0.0000   0.0000          ?        ?   178.1475  16.6016          ?        ?      133.3        6.2       ?       ? 
1 1 1   41   13   40 o     23.6   11.4    0.0000   0.0000          ?        ?   -24.2638  15.9630          ?        ?       23.6       11.4       ?       ? 
1 1 1   41   13   41 o    188.1    4.4    0.0000   0.0000          ?        ?   354.3795  16.6016          ?        ?      188.1        4.4       ?       ? 
1 1 1   41   13   42 o     19.6    9.8    0.0000   0.0000          ?        ?   -47.8891  16.6016          ?        ?       19.6        9.8       ?       ? 
1 1 1   41   13   43 o    249.7    3.7    0.0000   0.0000          ?        ?   624.4742  18.5171          ?        ?      249.7        3.7       ?       ? 
1 1 1   41   13   44 o     24.3   11.8    0.0000   0.0000          ?        ?   -30.0105  17.8786          ?        ?       24.3       11.8       ?       ? 
1 1 1   41   13   45 o    218.5    4.2    0.0000   0.0000          ?        ?   478.2527  18.5171          ?        ?      218.5        4.2       ?       ? 
1 1 1   41   13   46 f    232.2    4.0    0.0000   0.0000          ?        ?   540.1893  18.5171          ?        ?      232.2        4.0       ?       ? 
1 1 1   41   13   47 o    257.5    3.8    0.0000   0.0000          ?        ?   664.0625  19.7942          ?        ?      257.5        3.8       ?       ? 
1 1 1   41   13   48 o     98.1    9.1    0.0000   0.0000          ?        ?    97.0553  17.8786          ?        ?       98.1        9.1       ?       ? 
1 1 1   41   13   49 o    321.2    3.2    0.0000   0.0000          ?        ?  1033.1281  20.4327          ?        ?      321.2        3.2       ?       ? 
1 1 1   41   13   50 o    128.9    6.9    0.0000   0.0000          ?        ?   167.2927  17.8786          ?        ?      128.9        6.9       ?       ? 
1 1 1   41   13   51 o     32.2   14.1    0.0000   0.0000          ?        ?    -3.1926  17.2401          ?        ?       32.2       14.1       ?       ? 
1 1 1   41   13   52 o    166.5    5.4    0.0000   0.0000          ?        ?   278.3954  17.8786          ?        ?      166.5        5.4       ?       ? 
1 1 1   41   13   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   13   54 o     80.2   11.6    0.0000   0.0000          ?        ?    65.7677  18.5171          ?        ?       80.2       11.6       ?       ? 
1 1 1   41   13   55 o     75.6   11.8    0.0000   0.0000          ?        ?    58.7440  17.8786          ?        ?       75.6       11.8       ?       ? 
1 1 1   41   13   56 o     29.4   13.4    0.0000   0.0000          ?        ?    -9.5778  17.2401          ?        ?       29.4       13.4       ?       ? 
1 1 1   41   14    0 o    221.8    5.0  492.9387  22.3483   492.9387  22.3483   492.9387  22.3483      221.8      5.0      221.8        5.0     0.0     0.0 
1 1 1   41   14    1 o    178.5    4.1    0.0000   0.0000          ?        ?   318.6223  14.6860          ?        ?      178.5        4.1       ?       ? 
1 1 1   41   14    2 o    245.7    2.9    0.0000   0.0000          ?        ?   604.0414  14.0475          ?        ?      245.7        2.9       ?       ? 
1 1 1   41   14    3 o     30.3   11.8    0.0000   0.0000          ?        ?     5.7467  10.2163          ?        ?       30.3       11.8       ?       ? 
1 1 1   41   14    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   14    5 o     67.3    7.6    0.0000   0.0000          ?        ?    45.3350  10.2163          ?        ?       67.3        7.6       ?       ? 
1 1 1   41   14    6 o    184.3    3.1    0.0000   0.0000          ?        ?   339.6935  11.4934          ?        ?      184.3        3.1       ?       ? 
1 1 1   41   14    7 o    501.2    2.7    0.0000   0.0000          ?        ?  2512.5825  26.8179          ?        ?      501.2        2.7       ?       ? 
1 1 1   41   14    8 o    406.0    2.4    0.0000   0.0000          ?        ?  1648.6630  19.1556          ?        ?      406.0        2.4       ?       ? 
1 1 1   41   14    9 o    632.0    2.7    0.0000   0.0000          ?        ?  3995.8682  34.4802          ?        ?      632.0        2.7       ?       ? 
1 1 1   41   14   10 o    199.4    4.2    0.0000   0.0000          ?        ?   397.7990  16.6016          ?        ?      199.4        4.2       ?       ? 
1 1 1   41   14   11 o    862.8    3.4    0.0000   0.0000          ?        ?  7446.4390  58.7440          ?        ?      862.8        3.4       ?       ? 
1 1 1   41   14   12 o    400.7    2.5    0.0000   0.0000          ?        ?  1605.8818  19.7942          ?        ?      400.7        2.5       ?       ? 
1 1 1   41   14   13 o     63.8    8.5    0.0000   0.0000          ?        ?    40.8654  10.8549          ?        ?       63.8        8.5       ?       ? 
1 1 1   41   14   14 o     78.6    6.9    0.0000   0.0000          ?        ?    61.9366  10.8549          ?        ?       78.6        6.9       ?       ? 
1 1 1   41   14   15 o    571.1    2.6    0.0000   0.0000          ?        ?  3262.2070  30.0105          ?        ?      571.1        2.6       ?       ? 
1 1 1   41   14   16 o    314.4    2.5    0.0000   0.0000          ?        ?   988.4315  15.9630          ?        ?      314.4        2.5       ?       ? 
1 1 1   41   14   17 o    116.8    5.5    0.0000   0.0000          ?        ?   136.6436  12.7704          ?        ?      116.8        5.5       ?       ? 
1 1 1   41   14   18 o    185.8    3.3    0.0000   0.0000          ?        ?   345.4402  12.1319          ?        ?      185.8        3.3       ?       ? 
1 1 1   41   14   19 o    449.1    2.5    0.0000   0.0000          ?        ?  2017.7284  22.3483          ?        ?      449.1        2.5       ?       ? 
1 1 1   41   14   20 o    156.7    3.9    0.0000   0.0000          ?        ?   245.8308  12.1319          ?        ?      156.7        3.9       ?       ? 
1 1 1   41   14   21 o     17.4    8.7    0.0000   0.0000          ?        ?   -35.7572  12.7704          ?        ?       17.4        8.7       ?       ? 
1 1 1   41   14   22 o    162.9    3.7    0.0000   0.0000          ?        ?   265.6250  12.1319          ?        ?      162.9        3.7       ?       ? 
1 1 1   41   14   23 o    514.2    2.5    0.0000   0.0000          ?        ?  2644.7566  26.1794          ?        ?      514.2        2.5       ?       ? 
1 1 1   41   14   24 o    261.5    2.8    0.0000   0.0000          ?        ?   683.8566  14.6860          ?        ?      261.5        2.8       ?       ? 
1 1 1   41   14   25 o    424.4    2.4    0.0000   0.0000          ?        ?  1801.9081  20.4327          ?        ?      424.4        2.4       ?       ? 
1 1 1   41   14   26 o    216.6    3.2    0.0000   0.0000          ?        ?   469.3134  14.0475          ?        ?      216.6        3.2       ?       ? 
1 1 1   41   14   27 o     21.3   10.4    0.0000   0.0000          ?        ?   -24.9023  14.0475          ?        ?       21.3       10.4       ?       ? 
1 1 1   41   14   28 o    112.9    5.9    0.0000   0.0000          ?        ?   127.7043  13.4090          ?        ?      112.9        5.9       ?       ? 
1 1 1   41   14   29 o    155.3    4.5    0.0000   0.0000          ?        ?   241.3612  14.0475          ?        ?      155.3        4.5       ?       ? 
1 1 1   41   14   30 o    364.9    2.5    0.0000   0.0000          ?        ?  1331.9562  18.5171          ?        ?      364.9        2.5       ?       ? 
1 1 1   41   14   31 o    393.2    2.5    0.0000   0.0000          ?        ?  1546.4994  19.7942          ?        ?      393.2        2.5       ?       ? 
1 1 1   41   14   32 o    577.6    2.7    0.0000   0.0000          ?        ?  3337.5527  30.6490          ?        ?      577.6        2.7       ?       ? 
1 1 1   41   14   33 o    227.3    3.5    0.0000   0.0000          ?        ?   517.2025  15.9630          ?        ?      227.3        3.5       ?       ? 
1 1 1   41   14   34 o    161.7    4.9    0.0000   0.0000          ?        ?   261.7939  15.9630          ?        ?      161.7        4.9       ?       ? 
1 1 1   41   14   35 o     23.8   11.4    0.0000   0.0000          ?        ?   -21.0712  15.3245          ?        ?       23.8       11.4       ?       ? 
1 1 1   41   14   36 o    202.4    3.9    0.0000   0.0000          ?        ?   409.9309  15.9630          ?        ?      202.4        3.9       ?       ? 
1 1 1   41   14   37 o    206.3    4.0    0.0000   0.0000          ?        ?   425.8939  16.6016          ?        ?      206.3        4.0       ?       ? 
1 1 1   41   14   38 o     22.6   10.9    0.0000   0.0000          ?        ?   -25.5409  15.3245          ?        ?       22.6       10.9       ?       ? 
1 1 1   41   14   39 o    199.8    4.2    0.0000   0.0000          ?        ?   399.7145  16.6016          ?        ?      199.8        4.2       ?       ? 
1 1 1   41   14   40 o    313.8    3.1    0.0000   0.0000          ?        ?   985.2389  19.1556          ?        ?      313.8        3.1       ?       ? 
1 1 1   41   14   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   14   42 o    319.5    3.2    0.0000   0.0000          ?        ?  1021.6346  20.4327          ?        ?      319.5        3.2       ?       ? 
1 1 1   41   14   43 o    313.9    3.2    0.0000   0.0000          ?        ?   986.5159  19.7942          ?        ?      313.9        3.2       ?       ? 
1 1 1   41   14   44 f    177.4    4.9    0.0000   0.0000          ?        ?   315.4297  17.2401          ?        ?      177.4        4.9       ?       ? 
1 1 1   41   14   45 o    471.8    2.7    0.0000   0.0000          ?        ?  2227.8020  25.5409          ?        ?      471.8        2.7       ?       ? 
1 1 1   41   14   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   14   47 o     19.2    9.7    0.0000   0.0000          ?        ?   -54.9129  17.2401          ?        ?       19.2        9.7       ?       ? 
1 1 1   41   14   48 o     56.0   15.8    0.0000   0.0000          ?        ?    33.2031  18.5171          ?        ?       56.0       15.8       ?       ? 
1 1 1   41   14   49 o    164.0    5.4    0.0000   0.0000          ?        ?   270.0946  17.8786          ?        ?      164.0        5.4       ?       ? 
1 1 1   41   14   50 o    243.8    3.9    0.0000   0.0000          ?        ?   595.7407  19.1556          ?        ?      243.8        3.9       ?       ? 
1 1 1   41   14   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   14   52 o    191.2    4.8    0.0000   0.0000          ?        ?   367.1499  18.5171          ?        ?      191.2        4.8       ?       ? 
1 1 1   41   14   53 o    100.1    8.9    0.0000   0.0000          ?        ?   101.5249  17.8786          ?        ?      100.1        8.9       ?       ? 
1 1 1   41   14   54 o     99.4    9.0    0.0000   0.0000          ?        ?   100.2479  17.8786          ?        ?       99.4        9.0       ?       ? 
1 1 1   41   14   55 o    228.5    4.2    0.0000   0.0000          ?        ?   524.2263  19.1556          ?        ?      228.5        4.2       ?       ? 
1 1 1   41   15    0 o     13.8   10.2  -45.3350  17.8786   -45.3350  17.8786   -45.3350  17.8786       13.8     10.2       13.8       10.2     0.0     0.0 
1 1 1   41   15    1 o    197.3    3.7    0.0000   0.0000          ?        ?   389.4982  14.6860          ?        ?      197.3        3.7       ?       ? 
1 1 1   41   15    2 f    291.4    3.0    0.0000   0.0000          ?        ?   849.2338  17.2401          ?        ?      291.4        3.0       ?       ? 
1 1 1   41   15    3 o    366.6    2.9    0.0000   0.0000          ?        ?  1344.0880  21.0712          ?        ?      366.6        2.9       ?       ? 
1 1 1   41   15    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   15    5 o    129.5    4.4    0.0000   0.0000          ?        ?   167.9312  11.4934          ?        ?      129.5        4.4       ?       ? 
1 1 1   41   15    6 o    574.2    2.8    0.0000   0.0000          ?        ?  3297.9641  32.5646          ?        ?      574.2        2.8       ?       ? 
1 1 1   41   15    7 o    159.6    3.6    0.0000   0.0000          ?        ?   254.7701  11.4934          ?        ?      159.6        3.6       ?       ? 
1 1 1   41   15    8 o    275.4    2.8    0.0000   0.0000          ?        ?   758.5637  15.3245          ?        ?      275.4        2.8       ?       ? 
1 1 1   41   15    9 o    577.3    2.8    0.0000   0.0000          ?        ?  3333.7212  31.9261          ?        ?      577.3        2.8       ?       ? 
1 1 1   41   15   10 o    510.3    2.6    0.0000   0.0000          ?        ?  2605.1682  26.8179          ?        ?      510.3        2.6       ?       ? 
1 1 1   41   15   11 f    214.4    2.8    0.0000   0.0000          ?        ?   459.7356  12.1319          ?        ?      214.4        2.8       ?       ? 
1 1 1   41   15   12 o    416.2    2.4    0.0000   0.0000          ?        ?  1732.3091  19.7942          ?        ?      416.2        2.4       ?       ? 
1 1 1   41   15   13 o    403.6    2.5    0.0000   0.0000          ?        ?  1629.5072  19.7942          ?        ?      403.6        2.5       ?       ? 
1 1 1   41   15   14 o    270.6    2.6    0.0000   0.0000          ?        ?   732.3843  14.0475          ?        ?      270.6        2.6       ?       ? 
1 1 1   41   15   15 o    457.6    2.7    0.0000   0.0000          ?        ?  2094.3508  24.2638          ?        ?      457.6        2.7       ?       ? 
1 1 1   41   15   16 o    189.9    3.4    0.0000   0.0000          ?        ?   360.7647  12.7704          ?        ?      189.9        3.4       ?       ? 
1 1 1   41   15   17 o    122.4    4.7    0.0000   0.0000          ?        ?   150.0526  11.4934          ?        ?      122.4        4.7       ?       ? 
1 1 1   41   15   18 o    250.6    2.9    0.0000   0.0000          ?        ?   628.3053  14.6860          ?        ?      250.6        2.9       ?       ? 
1 1 1   41   15   19 o    395.5    2.5    0.0000   0.0000          ?        ?  1564.3779  19.7942          ?        ?      395.5        2.5       ?       ? 
1 1 1   41   15   20 o    530.9    2.6    0.0000   0.0000          ?        ?  2819.0730  28.0950          ?        ?      530.9        2.6       ?       ? 
1 1 1   41   15   21 o    261.6    2.7    0.0000   0.0000          ?        ?   684.4952  14.0475          ?        ?      261.6        2.7       ?       ? 
1 1 1   41   15   22 o    299.0    2.8    0.0000   0.0000          ?        ?   894.5688  16.6016          ?        ?      299.0        2.8       ?       ? 
1 1 1   41   15   23 o    486.4    2.5    0.0000   0.0000          ?        ?  2366.9998  24.2638          ?        ?      486.4        2.5       ?       ? 
1 1 1   41   15   24 o    339.9    2.5    0.0000   0.0000          ?        ?  1155.7241  17.2401          ?        ?      339.9        2.5       ?       ? 
1 1 1   41   15   25 o    181.4    3.9    0.0000   0.0000          ?        ?   329.4771  14.0475          ?        ?      181.4        3.9       ?       ? 
1 1 1   41   15   26 o    207.7    3.2    0.0000   0.0000          ?        ?   431.6406  13.4090          ?        ?      207.7        3.2       ?       ? 
1 1 1   41   15   27 o     85.9    7.4    0.0000   0.0000          ?        ?    74.0685  12.7704          ?        ?       85.9        7.4       ?       ? 
1 1 1   41   15   28 o    225.4    3.3    0.0000   0.0000          ?        ?   508.2632  14.6860          ?        ?      225.4        3.3       ?       ? 
1 1 1   41   15   29 o    330.4    2.7    0.0000   0.0000          ?        ?  1091.8719  17.8786          ?        ?      330.4        2.7       ?       ? 
1 1 1   41   15   30 o     19.4    9.6    0.0000   0.0000          ?        ?   -33.2031  14.0475          ?        ?       19.4        9.6       ?       ? 
1 1 1   41   15   31 o    110.0    7.0    0.0000   0.0000          ?        ?   121.3191  15.3245          ?        ?      110.0        7.0       ?       ? 
1 1 1   41   15   32 o     17.2    8.7    0.0000   0.0000          ?        ?   -45.9736  14.0475          ?        ?       17.2        8.7       ?       ? 
1 1 1   41   15   33 o    151.9    4.8    0.0000   0.0000          ?        ?   231.1448  14.6860          ?        ?      151.9        4.8       ?       ? 
1 1 1   41   15   34 f    284.5    3.0    0.0000   0.0000          ?        ?   809.6454  17.2401          ?        ?      284.5        3.0       ?       ? 
1 1 1   41   15   35 o    153.6    5.2    0.0000   0.0000          ?        ?   236.2530  15.9630          ?        ?      153.6        5.2       ?       ? 
1 1 1   41   15   36 o    300.6    2.9    0.0000   0.0000          ?        ?   904.1467  17.2401          ?        ?      300.6        2.9       ?       ? 
1 1 1   41   15   37 o     22.8   11.1    0.0000   0.0000          ?        ?   -27.4564  15.9630          ?        ?       22.8       11.1       ?       ? 
1 1 1   41   15   38 o    287.0    3.1    0.0000   0.0000          ?        ?   824.3315  17.8786          ?        ?      287.0        3.1       ?       ? 
1 1 1   41   15   39 o    238.7    3.6    0.0000   0.0000          ?        ?   570.1998  17.2401          ?        ?      238.7        3.6       ?       ? 
1 1 1   41   15   40 o    199.3    4.5    0.0000   0.0000          ?        ?   397.7990  17.8786          ?        ?      199.3        4.5       ?       ? 
1 1 1   41   15   41 o    373.7    2.7    0.0000   0.0000          ?        ?  1397.0853  20.4327          ?        ?      373.7        2.7       ?       ? 
1 1 1   41   15   42 o    204.8    4.2    0.0000   0.0000          ?        ?   420.1472  17.2401          ?        ?      204.8        4.2       ?       ? 
1 1 1   41   15   43 o     74.9   11.5    0.0000   0.0000          ?        ?    56.8284  17.2401          ?        ?       74.9       11.5       ?       ? 
1 1 1   41   15   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   15   45 o    109.2    8.2    0.0000   0.0000          ?        ?   120.0421  17.8786          ?        ?      109.2        8.2       ?       ? 
1 1 1   41   15   46 o    128.0    7.0    0.0000   0.0000          ?        ?   164.7386  17.8786          ?        ?      128.0        7.0       ?       ? 
1 1 1   41   15   47 o     92.7    9.3    0.0000   0.0000          ?        ?    86.8389  17.2401          ?        ?       92.7        9.3       ?       ? 
1 1 1   41   15   48 o    285.2    3.4    0.0000   0.0000          ?        ?   814.7536  19.1556          ?        ?      285.2        3.4       ?       ? 
1 1 1   41   15   49 o    186.9    4.8    0.0000   0.0000          ?        ?   350.5484  17.8786          ?        ?      186.9        4.8       ?       ? 
1 1 1   41   15   50 o     51.7   15.5    0.0000   0.0000          ?        ?    28.0950  17.2401          ?        ?       51.7       15.5       ?       ? 
1 1 1   41   15   51 o     68.1   13.1    0.0000   0.0000          ?        ?    49.1662  17.2401          ?        ?       68.1       13.1       ?       ? 
1 1 1   41   15   52 o    192.6    4.6    0.0000   0.0000          ?        ?   372.2581  17.8786          ?        ?      192.6        4.6       ?       ? 
1 1 1   41   15   53 o     19.0    9.6    0.0000   0.0000          ?        ?   -55.5514  17.2401          ?        ?       19.0        9.6       ?       ? 
1 1 1   41   15   54 o     32.3   14.2    0.0000   0.0000          ?        ?    -3.8311  17.8786          ?        ?       32.3       14.2       ?       ? 
1 1 1   41   16    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   16    1 o    126.3    5.6    0.0000   0.0000          ?        ?   159.6304  14.0475          ?        ?      126.3        5.6       ?       ? 
1 1 1   41   16    2 o    383.8    2.7    0.0000   0.0000          ?        ?  1473.7079  21.0712          ?        ?      383.8        2.7       ?       ? 
1 1 1   41   16    3 o    361.0    2.7    0.0000   0.0000          ?        ?  1303.2227  19.7942          ?        ?      361.0        2.7       ?       ? 
1 1 1   41   16    4 o    369.5    2.8    0.0000   0.0000          ?        ?  1365.7977  20.4327          ?        ?      369.5        2.8       ?       ? 
1 1 1   41   16    5 o    207.6    3.5    0.0000   0.0000          ?        ?   431.0021  14.6860          ?        ?      207.6        3.5       ?       ? 
1 1 1   41   16    6 o    148.8    4.1    0.0000   0.0000          ?        ?   221.5670  12.1319          ?        ?      148.8        4.1       ?       ? 
1 1 1   41   16    7 o    247.4    2.7    0.0000   0.0000          ?        ?   612.3422  13.4090          ?        ?      247.4        2.7       ?       ? 
1 1 1   41   16    8 o    201.0    3.0    0.0000   0.0000          ?        ?   404.1842  12.1319          ?        ?      201.0        3.0       ?       ? 
1 1 1   41   16    9 o    283.7    2.7    0.0000   0.0000          ?        ?   805.1758  15.3245          ?        ?      283.7        2.7       ?       ? 
1 1 1   41   16   10 o    390.7    2.7    0.0000   0.0000          ?        ?  1526.7052  21.0712          ?        ?      390.7        2.7       ?       ? 
1 1 1   41   16   11 o    182.2    2.8    0.0000   0.0000          ?        ?   332.0312  10.2163          ?        ?      182.2        2.8       ?       ? 
1 1 1   41   16   12 o    400.3    2.6    0.0000   0.0000          ?        ?  1602.6893  21.0712          ?        ?      400.3        2.6       ?       ? 
1 1 1   41   16   13 o    677.5    3.6    0.0000   0.0000          ?        ?  4592.2476  48.5276          ?        ?      677.5        3.6       ?       ? 
1 1 1   41   16   14 o    345.7    2.7    0.0000   0.0000          ?        ?  1195.3125  18.5171          ?        ?      345.7        2.7       ?       ? 
1 1 1   41   16   15 o    676.8    2.8    0.0000   0.0000          ?        ?  4582.6699  38.3113          ?        ?      676.8        2.8       ?       ? 
1 1 1   41   16   16 o    483.0    2.5    0.0000   0.0000          ?        ?  2333.1580  24.2638          ?        ?      483.0        2.5       ?       ? 
1 1 1   41   16   17 o    380.6    2.5    0.0000   0.0000          ?        ?  1448.8055  19.1556          ?        ?      380.6        2.5       ?       ? 
1 1 1   41   16   18 o    486.1    2.7    0.0000   0.0000          ?        ?  2363.8071  26.1794          ?        ?      486.1        2.7       ?       ? 
1 1 1   41   16   19 o    216.0    3.1    0.0000   0.0000          ?        ?   466.7593  13.4090          ?        ?      216.0        3.1       ?       ? 
1 1 1   41   16   20 o    172.6    3.7    0.0000   0.0000          ?        ?   298.1896  12.7704          ?        ?      172.6        3.7       ?       ? 
1 1 1   41   16   21 o    146.8    4.1    0.0000   0.0000          ?        ?   215.8203  12.1319          ?        ?      146.8        4.1       ?       ? 
1 1 1   41   16   22 o    466.7    2.5    0.0000   0.0000          ?        ?  2179.2742  23.6253          ?        ?      466.7        2.5       ?       ? 
1 1 1   41   16   23 o    192.5    3.6    0.0000   0.0000          ?        ?   370.9810  14.0475          ?        ?      192.5        3.6       ?       ? 
1 1 1   41   16   24 o    388.7    2.5    0.0000   0.0000          ?        ?  1511.3806  19.1556          ?        ?      388.7        2.5       ?       ? 
1 1 1   41   16   25 o    422.1    2.5    0.0000   0.0000          ?        ?  1782.1139  21.0712          ?        ?      422.1        2.5       ?       ? 
1 1 1   41   16   26 o    130.5    5.1    0.0000   0.0000          ?        ?   170.4853  13.4090          ?        ?      130.5        5.1       ?       ? 
1 1 1   41   16   27 o    228.1    3.2    0.0000   0.0000          ?        ?   520.3951  14.6860          ?        ?      228.1        3.2       ?       ? 
1 1 1   41   16   28 o    225.9    3.4    0.0000   0.0000          ?        ?   510.8173  15.3245          ?        ?      225.9        3.4       ?       ? 
1 1 1   41   16   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   16   30 o     50.6   13.6    0.0000   0.0000          ?        ?    26.8179  14.0475          ?        ?       50.6       13.6       ?       ? 
1 1 1   41   16   31 o     85.1    8.6    0.0000   0.0000          ?        ?    72.7915  14.6860          ?        ?       85.1        8.6       ?       ? 
1 1 1   41   16   32 o    119.5    6.1    0.0000   0.0000          ?        ?   143.0288  14.6860          ?        ?      119.5        6.1       ?       ? 
1 1 1   41   16   33 o    222.4    3.6    0.0000   0.0000          ?        ?   494.8542  15.9630          ?        ?      222.4        3.6       ?       ? 
1 1 1   41   16   34 o     60.4   13.1    0.0000   0.0000          ?        ?    38.3113  15.3245          ?        ?       60.4       13.1       ?       ? 
1 1 1   41   16   35 o    134.3    5.7    0.0000   0.0000          ?        ?   180.7016  15.3245          ?        ?      134.3        5.7       ?       ? 
1 1 1   41   16   36 o    150.4    5.1    0.0000   0.0000          ?        ?   226.6752  15.3245          ?        ?      150.4        5.1       ?       ? 
1 1 1   41   16   37 o    122.6    6.3    0.0000   0.0000          ?        ?   150.6911  15.3245          ?        ?      122.6        6.3       ?       ? 
1 1 1   41   16   38 o    397.9    2.8    0.0000   0.0000          ?        ?  1584.1722  22.3483          ?        ?      397.9        2.8       ?       ? 
1 1 1   41   16   39 o    224.6    3.8    0.0000   0.0000          ?        ?   505.0706  17.2401          ?        ?      224.6        3.8       ?       ? 
1 1 1   41   16   40 o    228.2    3.9    0.0000   0.0000          ?        ?   521.6721  17.8786          ?        ?      228.2        3.9       ?       ? 
1 1 1   41   16   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   16   42 o    140.9    5.9    0.0000   0.0000          ?        ?   199.2188  16.6016          ?        ?      140.9        5.9       ?       ? 
1 1 1   41   16   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   16   44 o    233.7    4.0    0.0000   0.0000          ?        ?   547.2130  18.5171          ?        ?      233.7        4.0       ?       ? 
1 1 1   41   16   45 o    276.4    3.5    0.0000   0.0000          ?        ?   764.9489  19.1556          ?        ?      276.4        3.5       ?       ? 
1 1 1   41   16   46 o    192.7    4.6    0.0000   0.0000          ?        ?   372.2581  17.8786          ?        ?      192.7        4.6       ?       ? 
1 1 1   41   16   47 o    159.5    5.6    0.0000   0.0000          ?        ?   255.4086  17.8786          ?        ?      159.5        5.6       ?       ? 
1 1 1   41   16   48 o    205.3    4.5    0.0000   0.0000          ?        ?   422.7013  18.5171          ?        ?      205.3        4.5       ?       ? 
1 1 1   41   16   49 o     60.8   14.4    0.0000   0.0000          ?        ?    39.5883  17.2401          ?        ?       60.8       14.4       ?       ? 
1 1 1   41   16   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   16   51 o    151.6    5.9    0.0000   0.0000          ?        ?   231.1448  17.8786          ?        ?      151.6        5.9       ?       ? 
1 1 1   41   16   52 o    225.6    4.1    0.0000   0.0000          ?        ?   510.8173  18.5171          ?        ?      225.6        4.1       ?       ? 
1 1 1   41   16   53 o    101.5    8.8    0.0000   0.0000          ?        ?   104.7175  17.8786          ?        ?      101.5        8.8       ?       ? 
1 1 1   41   17    0 o    580.7    4.5 3373.9485  51.7203  3373.9485  51.7203  3373.9485  51.7203      580.7      4.5      580.7        4.5     0.0     0.0 
1 1 1   41   17    1 o    279.1    3.0    0.0000   0.0000          ?        ?   778.9964  16.6016          ?        ?      279.1        3.0       ?       ? 
1 1 1   41   17    2 o    327.7    3.0    0.0000   0.0000          ?        ?  1073.9934  19.7942          ?        ?      327.7        3.0       ?       ? 
1 1 1   41   17    3 o    326.1    3.0    0.0000   0.0000          ?        ?  1063.7771  19.7942          ?        ?      326.1        3.0       ?       ? 
1 1 1   41   17    4 o    291.1    2.9    0.0000   0.0000          ?        ?   847.9567  16.6016          ?        ?      291.1        2.9       ?       ? 
1 1 1   41   17    5 o    358.8    3.1    0.0000   0.0000          ?        ?  1287.8981  22.3483          ?        ?      358.8        3.1       ?       ? 
1 1 1   41   17    6 o    112.9    6.2    0.0000   0.0000          ?        ?   127.7043  14.0475          ?        ?      112.9        6.2       ?       ? 
1 1 1   41   17    7 o    577.9    3.1    0.0000   0.0000          ?        ?  3340.7451  35.7572          ?        ?      577.9        3.1       ?       ? 
1 1 1   41   17    8 o    312.0    2.7    0.0000   0.0000          ?        ?   973.7455  16.6016          ?        ?      312.0        2.7       ?       ? 
1 1 1   41   17    9 o    190.9    3.0    0.0000   0.0000          ?        ?   364.5958  11.4934          ?        ?      190.9        3.0       ?       ? 
1 1 1   41   17   10 o    260.5    2.7    0.0000   0.0000          ?        ?   678.7485  14.0475          ?        ?      260.5        2.7       ?       ? 
1 1 1   41   17   11 o    429.3    2.8    0.0000   0.0000          ?        ?  1843.4120  23.6253          ?        ?      429.3        2.8       ?       ? 
1 1 1   41   17   12 o    159.8    4.0    0.0000   0.0000          ?        ?   255.4086  12.7704          ?        ?      159.8        4.0       ?       ? 
1 1 1   41   17   13 o    269.3    2.4    0.0000   0.0000          ?        ?   725.3605  12.7704          ?        ?      269.3        2.4       ?       ? 
1 1 1   41   17   14 o    317.1    2.6    0.0000   0.0000          ?        ?  1005.6716  16.6016          ?        ?      317.1        2.6       ?       ? 
1 1 1   41   17   15 o    347.6    2.8    0.0000   0.0000          ?        ?  1208.7214  19.7942          ?        ?      347.6        2.8       ?       ? 
1 1 1   41   17   16 o    219.9    3.2    0.0000   0.0000          ?        ?   483.9994  14.0475          ?        ?      219.9        3.2       ?       ? 
1 1 1   41   17   17 o    533.3    2.8    0.0000   0.0000          ?        ?  2845.2524  29.3720          ?        ?      533.3        2.8       ?       ? 
1 1 1   41   17   18 o    239.0    2.8    0.0000   0.0000          ?        ?   571.4769  13.4090          ?        ?      239.0        2.8       ?       ? 
1 1 1   41   17   19 o    278.6    2.6    0.0000   0.0000          ?        ?   776.4423  14.6860          ?        ?      278.6        2.6       ?       ? 
1 1 1   41   17   20 o     98.8    5.8    0.0000   0.0000          ?        ?    97.6938  11.4934          ?        ?       98.8        5.8       ?       ? 
1 1 1   41   17   21 o    143.1    4.2    0.0000   0.0000          ?        ?   204.9654  12.1319          ?        ?      143.1        4.2       ?       ? 
1 1 1   41   17   22 o    151.3    4.2    0.0000   0.0000          ?        ?   229.2293  12.7704          ?        ?      151.3        4.2       ?       ? 
1 1 1   41   17   23 o    559.3    2.7    0.0000   0.0000          ?        ?  3129.3945  30.0105          ?        ?      559.3        2.7       ?       ? 
1 1 1   41   17   24 o    226.8    3.1    0.0000   0.0000          ?        ?   514.6484  14.0475          ?        ?      226.8        3.1       ?       ? 
1 1 1   41   17   25 o     76.9    8.3    0.0000   0.0000          ?        ?    59.3825  12.7704          ?        ?       76.9        8.3       ?       ? 
1 1 1   41   17   26 o    278.1    2.9    0.0000   0.0000          ?        ?   773.8882  15.9630          ?        ?      278.1        2.9       ?       ? 
1 1 1   41   17   27 o    309.1    2.7    0.0000   0.0000          ?        ?   955.8669  16.6016          ?        ?      309.1        2.7       ?       ? 
1 1 1   41   17   28 o    117.6    6.0    0.0000   0.0000          ?        ?   138.5592  14.0475          ?        ?      117.6        6.0       ?       ? 
1 1 1   41   17   29 o    239.5    3.2    0.0000   0.0000          ?        ?   574.0309  15.3245          ?        ?      239.5        3.2       ?       ? 
1 1 1   41   17   30 o    360.6    2.6    0.0000   0.0000          ?        ?  1300.6686  18.5171          ?        ?      360.6        2.6       ?       ? 
1 1 1   41   17   31 o    211.2    3.6    0.0000   0.0000          ?        ?   446.3266  15.3245          ?        ?      211.2        3.6       ?       ? 
1 1 1   41   17   32 o    371.8    2.7    0.0000   0.0000          ?        ?  1383.0378  19.7942          ?        ?      371.8        2.7       ?       ? 
1 1 1   41   17   33 o    184.4    4.0    0.0000   0.0000          ?        ?   340.3320  14.6860          ?        ?      184.4        4.0       ?       ? 
1 1 1   41   17   34 o    316.9    2.8    0.0000   0.0000          ?        ?  1005.0330  17.8786          ?        ?      316.9        2.8       ?       ? 
1 1 1   41   17   35 o    418.7    2.6    0.0000   0.0000          ?        ?  1754.0190  21.7097          ?        ?      418.7        2.6       ?       ? 
1 1 1   41   17   36 o    305.2    3.0    0.0000   0.0000          ?        ?   932.2416  18.5171          ?        ?      305.2        3.0       ?       ? 
1 1 1   41   17   37 o    254.6    3.4    0.0000   0.0000          ?        ?   648.7380  17.2401          ?        ?      254.6        3.4       ?       ? 
1 1 1   41   17   38 o     65.7   13.1    0.0000   0.0000          ?        ?    45.3350  16.6016          ?        ?       65.7       13.1       ?       ? 
1 1 1   41   17   39 o    201.4    4.3    0.0000   0.0000          ?        ?   406.0997  17.2401          ?        ?      201.4        4.3       ?       ? 
1 1 1   41   17   40 o    120.6    6.9    0.0000   0.0000          ?        ?   146.2215  16.6016          ?        ?      120.6        6.9       ?       ? 
1 1 1   41   17   41 o    104.4    8.3    0.0000   0.0000          ?        ?   109.8257  17.2401          ?        ?      104.4        8.3       ?       ? 
1 1 1   41   17   42 o    169.1    5.3    0.0000   0.0000          ?        ?   286.6962  17.8786          ?        ?      169.1        5.3       ?       ? 
1 1 1   41   17   43 f    186.7    4.6    0.0000   0.0000          ?        ?   349.2713  17.2401          ?        ?      186.7        4.6       ?       ? 
1 1 1   41   17   44 o    169.1    4.9    0.0000   0.0000          ?        ?   286.6962  16.6016          ?        ?      169.1        4.9       ?       ? 
1 1 1   41   17   45 o     20.5   10.3    0.0000   0.0000          ?        ?   -49.8047  17.8786          ?        ?       20.5       10.3       ?       ? 
1 1 1   41   17   46 o    194.0    4.6    0.0000   0.0000          ?        ?   377.3663  17.8786          ?        ?      194.0        4.6       ?       ? 
1 1 1   41   17   47 o    170.1    5.3    0.0000   0.0000          ?        ?   290.5273  17.8786          ?        ?      170.1        5.3       ?       ? 
1 1 1   41   17   48 o    165.3    5.4    0.0000   0.0000          ?        ?   274.5643  17.8786          ?        ?      165.3        5.4       ?       ? 
1 1 1   41   17   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   17   50 o     84.1   10.2    0.0000   0.0000          ?        ?    72.1529  17.2401          ?        ?       84.1       10.2       ?       ? 
1 1 1   41   17   51 o     63.0   14.0    0.0000   0.0000          ?        ?    42.7809  17.2401          ?        ?       63.0       14.0       ?       ? 
1 1 1   41   17   52 o     64.9   13.7    0.0000   0.0000          ?        ?    45.3350  17.2401          ?        ?       64.9       13.7       ?       ? 
1 1 1   41   18    0 o    211.1    5.9  446.9651  24.9023   446.9651  24.9023   446.9651  24.9023      211.1      5.9      211.1        5.9     0.0     0.0 
1 1 1   41   18    1 o    560.9    3.3    0.0000   0.0000          ?        ?  3147.9116  37.0343          ?        ?      560.9        3.3       ?       ? 
1 1 1   41   18    2 o    250.5    3.2    0.0000   0.0000          ?        ?   627.6667  15.9630          ?        ?      250.5        3.2       ?       ? 
1 1 1   41   18    3 o    220.5    3.3    0.0000   0.0000          ?        ?   486.5535  14.6860          ?        ?      220.5        3.3       ?       ? 
1 1 1   41   18    4 o    403.7    2.9    0.0000   0.0000          ?        ?  1630.1458  23.6253          ?        ?      403.7        2.9       ?       ? 
1 1 1   41   18    5 o    226.8    3.5    0.0000   0.0000          ?        ?   514.6484  15.9630          ?        ?      226.8        3.5       ?       ? 
1 1 1   41   18    6 o    472.6    3.0    0.0000   0.0000          ?        ?  2234.8257  28.0950          ?        ?      472.6        3.0       ?       ? 
1 1 1   41   18    7 o    330.0    3.0    0.0000   0.0000          ?        ?  1089.3180  19.7942          ?        ?      330.0        3.0       ?       ? 
1 1 1   41   18    8 o    527.5    3.1    0.0000   0.0000          ?        ?  2783.9543  32.5646          ?        ?      527.5        3.1       ?       ? 
1 1 1   41   18    9 o    517.0    2.8    0.0000   0.0000          ?        ?  2674.1284  29.3720          ?        ?      517.0        2.8       ?       ? 
1 1 1   41   18   10 o    618.0    3.0    0.0000   0.0000          ?        ?  3820.9136  37.0343          ?        ?      618.0        3.0       ?       ? 
1 1 1   41   18   11 o    159.0    3.6    0.0000   0.0000          ?        ?   252.8546  11.4934          ?        ?      159.0        3.6       ?       ? 
1 1 1   41   18   12 o    261.1    2.8    0.0000   0.0000          ?        ?   681.9411  14.6860          ?        ?      261.1        2.8       ?       ? 
1 1 1   41   18   13 o    415.4    2.8    0.0000   0.0000          ?        ?  1726.5625  22.9868          ?        ?      415.4        2.8       ?       ? 
1 1 1   41   18   14 o    202.0    2.5    0.0000   0.0000          ?        ?   408.0153  10.2163          ?        ?      202.0        2.5       ?       ? 
1 1 1   41   18   15 o    242.2    2.8    0.0000   0.0000          ?        ?   586.8014  13.4090          ?        ?      242.2        2.8       ?       ? 
1 1 1   41   18   16 o    428.7    2.5    0.0000   0.0000          ?        ?  1838.3037  21.7097          ?        ?      428.7        2.5       ?       ? 
1 1 1   41   18   17 o    236.7    2.8    0.0000   0.0000          ?        ?   560.6220  13.4090          ?        ?      236.7        2.8       ?       ? 
1 1 1   41   18   18 f    317.6    2.8    0.0000   0.0000          ?        ?  1008.8642  17.8786          ?        ?      317.6        2.8       ?       ? 
1 1 1   41   18   19 o    176.3    3.8    0.0000   0.0000          ?        ?   310.9600  13.4090          ?        ?      176.3        3.8       ?       ? 
1 1 1   41   18   20 o    317.1    2.6    0.0000   0.0000          ?        ?  1005.6716  16.6016          ?        ?      317.1        2.6       ?       ? 
1 1 1   41   18   21 o    320.5    2.6    0.0000   0.0000          ?        ?  1027.3812  16.6016          ?        ?      320.5        2.6       ?       ? 
1 1 1   41   18   22 o    378.0    2.4    0.0000   0.0000          ?        ?  1429.6499  18.5171          ?        ?      378.0        2.4       ?       ? 
1 1 1   41   18   23 o    103.8    6.2    0.0000   0.0000          ?        ?   107.9102  12.7704          ?        ?      103.8        6.2       ?       ? 
1 1 1   41   18   24 o    139.2    4.6    0.0000   0.0000          ?        ?   194.1106  12.7704          ?        ?      139.2        4.6       ?       ? 
1 1 1   41   18   25 o    104.0    6.8    0.0000   0.0000          ?        ?   108.5487  14.0475          ?        ?      104.0        6.8       ?       ? 
1 1 1   41   18   26 o    422.5    2.5    0.0000   0.0000          ?        ?  1785.9451  21.0712          ?        ?      422.5        2.5       ?       ? 
1 1 1   41   18   27 o    170.5    4.1    0.0000   0.0000          ?        ?   291.1659  14.0475          ?        ?      170.5        4.1       ?       ? 
1 1 1   41   18   28 o    417.6    2.6    0.0000   0.0000          ?        ?  1744.4412  21.7097          ?        ?      417.6        2.6       ?       ? 
1 1 1   41   18   29 f    491.7    2.5    0.0000   0.0000          ?        ?  2418.7197  24.9023          ?        ?      491.7        2.5       ?       ? 
1 1 1   41   18   30 o    134.1    5.5    0.0000   0.0000          ?        ?   180.0631  14.6860          ?        ?      134.1        5.5       ?       ? 
1 1 1   41   18   31 o    211.8    3.6    0.0000   0.0000          ?        ?   448.8807  15.3245          ?        ?      211.8        3.6       ?       ? 
1 1 1   41   18   32 o     76.0    9.2    0.0000   0.0000          ?        ?    58.1055  14.0475          ?        ?       76.0        9.2       ?       ? 
1 1 1   41   18   33 o    349.4    2.6    0.0000   0.0000          ?        ?  1221.4919  18.5171          ?        ?      349.4        2.6       ?       ? 
1 1 1   41   18   34 o    160.3    4.8    0.0000   0.0000          ?        ?   257.3242  15.3245          ?        ?      160.3        4.8       ?       ? 
1 1 1   41   18   35 o    187.4    4.3    0.0000   0.0000          ?        ?   351.8254  15.9630          ?        ?      187.4        4.3       ?       ? 
1 1 1   41   18   36 o     39.7   14.9    0.0000   0.0000          ?        ?    12.1319  15.9630          ?        ?       39.7       14.9       ?       ? 
1 1 1   41   18   37 o     38.8   14.8    0.0000   0.0000          ?        ?    10.8549  15.9630          ?        ?       38.8       14.8       ?       ? 
1 1 1   41   18   38 o     24.8   11.9    0.0000   0.0000          ?        ?   -22.3483  16.6016          ?        ?       24.8       11.9       ?       ? 
1 1 1   41   18   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   18   40 o    124.3    6.4    0.0000   0.0000          ?        ?   155.1608  15.9630          ?        ?      124.3        6.4       ?       ? 
1 1 1   41   18   41 o     23.6   11.4    0.0000   0.0000          ?        ?   -26.8179  16.6016          ?        ?       23.6       11.4       ?       ? 
1 1 1   41   18   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   18   43 o    165.6    5.0    0.0000   0.0000          ?        ?   275.2028  16.6016          ?        ?      165.6        5.0       ?       ? 
1 1 1   41   18   44 o     96.8    8.6    0.0000   0.0000          ?        ?    94.5012  16.6016          ?        ?       96.8        8.6       ?       ? 
1 1 1   41   18   45 o    135.9    6.3    0.0000   0.0000          ?        ?   185.8098  17.2401          ?        ?      135.9        6.3       ?       ? 
1 1 1   41   18   46 o    137.1    6.1    0.0000   0.0000          ?        ?   189.0024  16.6016          ?        ?      137.1        6.1       ?       ? 
1 1 1   41   18   47 o    107.6    8.0    0.0000   0.0000          ?        ?   116.8494  17.2401          ?        ?      107.6        8.0       ?       ? 
1 1 1   41   18   48 o    153.7    5.6    0.0000   0.0000          ?        ?   237.5300  17.2401          ?        ?      153.7        5.6       ?       ? 
1 1 1   41   18   49 o     59.6   14.6    0.0000   0.0000          ?        ?    38.3113  17.2401          ?        ?       59.6       14.6       ?       ? 
1 1 1   41   18   50 o     18.5    9.4    0.0000   0.0000          ?        ?   -59.3825  17.2401          ?        ?       18.5        9.4       ?       ? 
1 1 1   41   18   51 o    142.2    5.8    0.0000   0.0000          ?        ?   203.6884  16.6016          ?        ?      142.2        5.8       ?       ? 
1 1 1   41   19    0 o    102.4    8.5  107.2716  17.2401   107.2716  17.2401   107.2716  17.2401      102.4      8.5      102.4        8.5     0.0     0.0 
1 1 1   41   19    1 o    440.8    3.0    0.0000   0.0000          ?        ?  1943.6598  26.8179          ?        ?      440.8        3.0       ?       ? 
1 1 1   41   19    2 o    194.4    3.8    0.0000   0.0000          ?        ?   378.0048  14.6860          ?        ?      194.4        3.8       ?       ? 
1 1 1   41   19    3 o    244.3    3.1    0.0000   0.0000          ?        ?   597.0177  15.3245          ?        ?      244.3        3.1       ?       ? 
1 1 1   41   19    4 o    273.0    3.2    0.0000   0.0000          ?        ?   745.7933  17.2401          ?        ?      273.0        3.2       ?       ? 
1 1 1   41   19    5 o    197.1    3.9    0.0000   0.0000          ?        ?   388.8597  15.3245          ?        ?      197.1        3.9       ?       ? 
1 1 1   41   19    6 o     97.1    6.9    0.0000   0.0000          ?        ?    94.5012  13.4090          ?        ?       97.1        6.9       ?       ? 
1 1 1   41   19    7 o    289.7    3.5    0.0000   0.0000          ?        ?   839.6559  20.4327          ?        ?      289.7        3.5       ?       ? 
1 1 1   41   19    8 o    576.4    3.2    0.0000   0.0000          ?        ?  3323.5051  37.0343          ?        ?      576.4        3.2       ?       ? 
1 1 1   41   19    9 o    269.1    3.2    0.0000   0.0000          ?        ?   724.7220  17.2401          ?        ?      269.1        3.2       ?       ? 
1 1 1   41   19   10 o    260.2    2.7    0.0000   0.0000          ?        ?   677.4714  14.0475          ?        ?      260.2        2.7       ?       ? 
1 1 1   41   19   11 o    321.1    2.6    0.0000   0.0000          ?        ?  1031.2124  16.6016          ?        ?      321.1        2.6       ?       ? 
1 1 1   41   19   12 o     43.4   13.0    0.0000   0.0000          ?        ?    19.1556  12.1319          ?        ?       43.4       13.0       ?       ? 
1 1 1   41   19   13 o    229.0    3.2    0.0000   0.0000          ?        ?   524.8647  14.6860          ?        ?      229.0        3.2       ?       ? 
1 1 1   41   19   14 o    455.9    3.0    0.0000   0.0000          ?        ?  2079.6650  27.4564          ?        ?      455.9        3.0       ?       ? 
1 1 1   41   19   15 o    144.4    3.8    0.0000   0.0000          ?        ?   208.7966  10.8549          ?        ?      144.4        3.8       ?       ? 
1 1 1   41   19   16 o    246.6    2.6    0.0000   0.0000          ?        ?   608.5111  12.7704          ?        ?      246.6        2.6       ?       ? 
1 1 1   41   19   17 o    255.7    2.5    0.0000   0.0000          ?        ?   653.8461  12.7704          ?        ?      255.7        2.5       ?       ? 
1 1 1   41   19   18 o    290.6    2.4    0.0000   0.0000          ?        ?   844.7642  14.0475          ?        ?      290.6        2.4       ?       ? 
1 1 1   41   19   19 o    201.5    3.2    0.0000   0.0000          ?        ?   406.0997  12.7704          ?        ?      201.5        3.2       ?       ? 
1 1 1   41   19   20 o    256.6    2.9    0.0000   0.0000          ?        ?   658.9543  14.6860          ?        ?      256.6        2.9       ?       ? 
1 1 1   41   19   21 o    142.2    4.5    0.0000   0.0000          ?        ?   202.4114  12.7704          ?        ?      142.2        4.5       ?       ? 
1 1 1   41   19   22 o     22.5   10.7    0.0000   0.0000          ?        ?   -17.8786  13.4090          ?        ?       22.5       10.7       ?       ? 
1 1 1   41   19   23 o    265.2    2.9    0.0000   0.0000          ?        ?   703.6508  15.3245          ?        ?      265.2        2.9       ?       ? 
1 1 1   41   19   24 o     96.7    7.3    0.0000   0.0000          ?        ?    93.8627  14.0475          ?        ?       96.7        7.3       ?       ? 
1 1 1   41   19   25 o    258.6    3.0    0.0000   0.0000          ?        ?   669.1707  15.3245          ?        ?      258.6        3.0       ?       ? 
1 1 1   41   19   26 o    246.7    3.1    0.0000   0.0000          ?        ?   609.1497  15.3245          ?        ?      246.7        3.1       ?       ? 
1 1 1   41   19   27 o    274.6    3.0    0.0000   0.0000          ?        ?   754.7325  16.6016          ?        ?      274.6        3.0       ?       ? 
1 1 1   41   19   28 o    500.4    2.6    0.0000   0.0000          ?        ?  2504.9202  25.5409          ?        ?      500.4        2.6       ?       ? 
1 1 1   41   19   29 o     91.9    8.0    0.0000   0.0000          ?        ?    84.9234  14.6860          ?        ?       91.9        8.0       ?       ? 
1 1 1   41   19   30 o    180.7    4.6    0.0000   0.0000          ?        ?   326.9231  16.6016          ?        ?      180.7        4.6       ?       ? 
1 1 1   41   19   31 o    146.3    5.0    0.0000   0.0000          ?        ?   214.5433  14.6860          ?        ?      146.3        5.0       ?       ? 
1 1 1   41   19   32 o    161.9    4.7    0.0000   0.0000          ?        ?   262.4324  15.3245          ?        ?      161.9        4.7       ?       ? 
1 1 1   41   19   33 o    200.3    4.1    0.0000   0.0000          ?        ?   401.6301  16.6016          ?        ?      200.3        4.1       ?       ? 
1 1 1   41   19   34 o    231.8    3.3    0.0000   0.0000          ?        ?   537.6352  15.3245          ?        ?      231.8        3.3       ?       ? 
1 1 1   41   19   35 o    119.4    6.4    0.0000   0.0000          ?        ?   143.0288  15.3245          ?        ?      119.4        6.4       ?       ? 
1 1 1   41   19   36 o    221.6    3.6    0.0000   0.0000          ?        ?   491.6617  15.9630          ?        ?      221.6        3.6       ?       ? 
1 1 1   41   19   37 o     18.2    9.2    0.0000   0.0000          ?        ?   -52.9973  15.9630          ?        ?       18.2        9.2       ?       ? 
1 1 1   41   19   38 o     95.2    8.4    0.0000   0.0000          ?        ?    91.3086  15.9630          ?        ?       95.2        8.4       ?       ? 
1 1 1   41   19   39 o    171.9    4.8    0.0000   0.0000          ?        ?   296.2740  16.6016          ?        ?      171.9        4.8       ?       ? 
1 1 1   41   19   40 o    179.4    4.6    0.0000   0.0000          ?        ?   322.4534  16.6016          ?        ?      179.4        4.6       ?       ? 
1 1 1   41   19   41 o    142.6    6.0    0.0000   0.0000          ?        ?   204.3269  17.2401          ?        ?      142.6        6.0       ?       ? 
1 1 1   41   19   42 o    492.2    2.7    0.0000   0.0000          ?        ?  2425.1050  26.1794          ?        ?      492.2        2.7       ?       ? 
1 1 1   41   19   43 o    189.6    4.9    0.0000   0.0000          ?        ?   360.7647  18.5171          ?        ?      189.6        4.9       ?       ? 
1 1 1   41   19   44 o     89.5    9.6    0.0000   0.0000          ?        ?    81.0922  17.2401          ?        ?       89.5        9.6       ?       ? 
1 1 1   41   19   45 o     80.4   10.7    0.0000   0.0000          ?        ?    65.7677  17.2401          ?        ?       80.4       10.7       ?       ? 
1 1 1   41   19   46 o    137.0    6.3    0.0000   0.0000          ?        ?   189.0024  17.2401          ?        ?      137.0        6.3       ?       ? 
1 1 1   41   19   47 o     49.3   15.9    0.0000   0.0000          ?        ?    24.9023  17.8786          ?        ?       49.3       15.9       ?       ? 
1 1 1   41   19   48 o     35.6   14.9    0.0000   0.0000          ?        ?     3.1926  17.8786          ?        ?       35.6       14.9       ?       ? 
1 1 1   41   19   49 o     21.9   10.8    0.0000   0.0000          ?        ?   -33.8416  16.6016          ?        ?       21.9       10.8       ?       ? 
1 1 1   41   20    0 o     17.0   12.2  -24.2638  17.8786   -24.2638  17.8786   -24.2638  17.8786       17.0     12.2       17.0       12.2     0.0     0.0 
1 1 1   41   20    1 o    140.6    4.8    0.0000   0.0000          ?        ?   197.9417  13.4090          ?        ?      140.6        4.8       ?       ? 
1 1 1   41   20    2 o     84.8    7.5    0.0000   0.0000          ?        ?    72.1529  12.7704          ?        ?       84.8        7.5       ?       ? 
1 1 1   41   20    3 f    248.5    3.3    0.0000   0.0000          ?        ?   618.0889  16.6016          ?        ?      248.5        3.3       ?       ? 
1 1 1   41   20    4 o    142.6    4.7    0.0000   0.0000          ?        ?   203.6884  13.4090          ?        ?      142.6        4.7       ?       ? 
1 1 1   41   20    5 o    242.6    3.4    0.0000   0.0000          ?        ?   588.7169  16.6016          ?        ?      242.6        3.4       ?       ? 
1 1 1   41   20    6 o    253.3    3.0    0.0000   0.0000          ?        ?   641.7142  15.3245          ?        ?      253.3        3.0       ?       ? 
1 1 1   41   20    7 o     95.4    7.0    0.0000   0.0000          ?        ?    91.3086  13.4090          ?        ?       95.4        7.0       ?       ? 
1 1 1   41   20    8 o     84.8    7.9    0.0000   0.0000          ?        ?    72.1529  13.4090          ?        ?       84.8        7.9       ?       ? 
1 1 1   41   20    9 o     24.1   11.6    0.0000   0.0000          ?        ?   -25.5409  16.6016          ?        ?       24.1       11.6       ?       ? 
1 1 1   41   20   10 o    449.1    3.3    0.0000   0.0000          ?        ?  2017.7284  29.3720          ?        ?      449.1        3.3       ?       ? 
1 1 1   41   20   11 o    211.2    3.0    0.0000   0.0000          ?        ?   446.3266  12.7704          ?        ?      211.2        3.0       ?       ? 
1 1 1   41   20   12 o    361.6    2.6    0.0000   0.0000          ?        ?  1307.6923  18.5171          ?        ?      361.6        2.6       ?       ? 
1 1 1   41   20   13 o    209.8    3.0    0.0000   0.0000          ?        ?   440.5799  12.7704          ?        ?      209.8        3.0       ?       ? 
1 1 1   41   20   14 o    179.1    3.7    0.0000   0.0000          ?        ?   321.1764  13.4090          ?        ?      179.1        3.7       ?       ? 
1 1 1   41   20   15 o    267.8    3.2    0.0000   0.0000          ?        ?   717.6983  17.2401          ?        ?      267.8        3.2       ?       ? 
1 1 1   41   20   16 o    118.4    5.9    0.0000   0.0000          ?        ?   140.4748  14.0475          ?        ?      118.4        5.9       ?       ? 
1 1 1   41   20   17 o    339.0    2.5    0.0000   0.0000          ?        ?  1149.9775  17.2401          ?        ?      339.0        2.5       ?       ? 
1 1 1   41   20   18 o    406.0    2.8    0.0000   0.0000          ?        ?  1649.3013  22.3483          ?        ?      406.0        2.8       ?       ? 
1 1 1   41   20   19 o    390.6    2.7    0.0000   0.0000          ?        ?  1526.0667  21.0712          ?        ?      390.6        2.7       ?       ? 
1 1 1   41   20   20 o     82.1    7.0    0.0000   0.0000          ?        ?    67.6833  11.4934          ?        ?       82.1        7.0       ?       ? 
1 1 1   41   20   21 o    437.2    2.6    0.0000   0.0000          ?        ?  1912.3723  22.3483          ?        ?      437.2        2.6       ?       ? 
1 1 1   41   20   22 o    363.2    2.7    0.0000   0.0000          ?        ?  1319.8242  19.7942          ?        ?      363.2        2.7       ?       ? 
1 1 1   41   20   23 o    428.0    2.6    0.0000   0.0000          ?        ?  1832.5571  22.3483          ?        ?      428.0        2.6       ?       ? 
1 1 1   41   20   24 o    212.1    3.3    0.0000   0.0000          ?        ?   450.1577  14.0475          ?        ?      212.1        3.3       ?       ? 
1 1 1   41   20   25 o    124.4    5.4    0.0000   0.0000          ?        ?   155.1608  13.4090          ?        ?      124.4        5.4       ?       ? 
1 1 1   41   20   26 o    344.8    2.7    0.0000   0.0000          ?        ?  1189.5658  18.5171          ?        ?      344.8        2.7       ?       ? 
1 1 1   41   20   27 f    186.6    4.1    0.0000   0.0000          ?        ?   348.6328  15.3245          ?        ?      186.6        4.1       ?       ? 
1 1 1   41   20   28 o    435.0    2.6    0.0000   0.0000          ?        ?  1893.2167  22.9868          ?        ?      435.0        2.6       ?       ? 
1 1 1   41   20   29 o     29.0   12.7    0.0000   0.0000          ?        ?    -3.1926  14.0475          ?        ?       29.0       12.7       ?       ? 
1 1 1   41   20   30 o     20.3   10.1    0.0000   0.0000          ?        ?   -35.7572  15.3245          ?        ?       20.3       10.1       ?       ? 
1 1 1   41   20   31 o    106.1    7.2    0.0000   0.0000          ?        ?   113.0183  15.3245          ?        ?      106.1        7.2       ?       ? 
1 1 1   41   20   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   20   33 o    222.0    3.6    0.0000   0.0000          ?        ?   493.5772  15.9630          ?        ?      222.0        3.6       ?       ? 
1 1 1   41   20   34 o    164.0    4.7    0.0000   0.0000          ?        ?   269.4561  15.3245          ?        ?      164.0        4.7       ?       ? 
1 1 1   41   20   35 o    214.0    3.7    0.0000   0.0000          ?        ?   458.4586  15.9630          ?        ?      214.0        3.7       ?       ? 
1 1 1   41   20   36 o    106.0    7.8    0.0000   0.0000          ?        ?   113.0183  16.6016          ?        ?      106.0        7.8       ?       ? 
1 1 1   41   20   37 o     91.4    9.1    0.0000   0.0000          ?        ?    84.2849  16.6016          ?        ?       91.4        9.1       ?       ? 
1 1 1   41   20   38 o    119.8    6.7    0.0000   0.0000          ?        ?   144.3059  15.9630          ?        ?      119.8        6.7       ?       ? 
1 1 1   41   20   39 o    262.4    3.3    0.0000   0.0000          ?        ?   689.6033  17.2401          ?        ?      262.4        3.3       ?       ? 
1 1 1   41   20   40 o    296.2    3.1    0.0000   0.0000          ?        ?   878.6058  18.5171          ?        ?      296.2        3.1       ?       ? 
1 1 1   41   20   41 o    350.8    2.8    0.0000   0.0000          ?        ?  1231.7081  19.7942          ?        ?      350.8        2.8       ?       ? 
1 1 1   41   20   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   20   43 o    123.6    7.0    0.0000   0.0000          ?        ?   153.8837  17.2401          ?        ?      123.6        7.0       ?       ? 
1 1 1   41   20   44 o    142.8    5.8    0.0000   0.0000          ?        ?   204.9654  16.6016          ?        ?      142.8        5.8       ?       ? 
1 1 1   41   20   45 o     21.6   10.6    0.0000   0.0000          ?        ?   -35.7572  16.6016          ?        ?       21.6       10.6       ?       ? 
1 1 1   41   20   46 o    205.7    4.3    0.0000   0.0000          ?        ?   424.6169  17.8786          ?        ?      205.7        4.3       ?       ? 
1 1 1   41   20   47 o    144.7    6.0    0.0000   0.0000          ?        ?   210.7121  17.2401          ?        ?      144.7        6.0       ?       ? 
1 1 1   41   20   48 o    102.1    8.8    0.0000   0.0000          ?        ?   105.9946  17.8786          ?        ?      102.1        8.8       ?       ? 
1 1 1   41   21    0 o    532.1    4.3 2833.1206  45.9736  2833.1206  45.9736  2833.1206  45.9736      532.1      4.3      532.1        4.3     0.0     0.0 
1 1 1   41   21    1 o    185.8    3.6    0.0000   0.0000          ?        ?   345.4402  13.4090          ?        ?      185.8        3.6       ?       ? 
1 1 1   41   21    2 o    247.0    3.2    0.0000   0.0000          ?        ?   610.4266  15.9630          ?        ?      247.0        3.2       ?       ? 
1 1 1   41   21    3 o    322.0    3.1    0.0000   0.0000          ?        ?  1037.5977  19.7942          ?        ?      322.0        3.1       ?       ? 
1 1 1   41   21    4 o     72.2    8.8    0.0000   0.0000          ?        ?    52.3588  12.7704          ?        ?       72.2        8.8       ?       ? 
1 1 1   41   21    5 o    317.4    3.1    0.0000   0.0000          ?        ?  1008.2256  19.7942          ?        ?      317.4        3.1       ?       ? 
1 1 1   41   21    6 o    314.6    3.1    0.0000   0.0000          ?        ?   990.3471  19.7942          ?        ?      314.6        3.1       ?       ? 
1 1 1   41   21    7 o    283.6    3.3    0.0000   0.0000          ?        ?   804.5372  18.5171          ?        ?      283.6        3.3       ?       ? 
1 1 1   41   21    8 o    247.5    3.7    0.0000   0.0000          ?        ?   612.9808  18.5171          ?        ?      247.5        3.7       ?       ? 
1 1 1   41   21    9 f     85.5    8.6    0.0000   0.0000          ?        ?    73.4300  14.6860          ?        ?       85.5        8.6       ?       ? 
1 1 1   41   21   10 o    430.8    3.1    0.0000   0.0000          ?        ?  1856.8208  26.8179          ?        ?      430.8        3.1       ?       ? 
1 1 1   41   21   11 o    536.0    3.5    0.0000   0.0000          ?        ?  2875.2627  37.6728          ?        ?      536.0        3.5       ?       ? 
1 1 1   41   21   12 f    382.7    2.7    0.0000   0.0000          ?        ?  1465.4071  20.4327          ?        ?      382.7        2.7       ?       ? 
1 1 1   41   21   13 o    239.0    2.8    0.0000   0.0000          ?        ?   571.4769  13.4090          ?        ?      239.0        2.8       ?       ? 
1 1 1   41   21   14 f    278.2    2.6    0.0000   0.0000          ?        ?   774.5267  14.6860          ?        ?      278.2        2.6       ?       ? 
1 1 1   41   21   15 o     73.9    8.6    0.0000   0.0000          ?        ?    54.9129  12.7704          ?        ?       73.9        8.6       ?       ? 
1 1 1   41   21   16 o    222.9    3.6    0.0000   0.0000          ?        ?   497.4084  15.9630          ?        ?      222.9        3.6       ?       ? 
1 1 1   41   21   17 o    375.4    2.8    0.0000   0.0000          ?        ?  1409.8557  21.0712          ?        ?      375.4        2.8       ?       ? 
1 1 1   41   21   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   21   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   21   20 o     90.6    6.3    0.0000   0.0000          ?        ?    82.3693  11.4934          ?        ?       90.6        6.3       ?       ? 
1 1 1   41   21   21 o    555.7    2.6    0.0000   0.0000          ?        ?  3089.1675  28.7335          ?        ?      555.7        2.6       ?       ? 
1 1 1   41   21   22 o    235.1    3.1    0.0000   0.0000          ?        ?   552.9597  14.6860          ?        ?      235.1        3.1       ?       ? 
1 1 1   41   21   23 o    260.9    2.9    0.0000   0.0000          ?        ?   681.3026  15.3245          ?        ?      260.9        2.9       ?       ? 
1 1 1   41   21   24 o     76.4    8.8    0.0000   0.0000          ?        ?    58.7440  13.4090          ?        ?       76.4        8.8       ?       ? 
1 1 1   41   21   25 o    511.2    2.7    0.0000   0.0000          ?        ?  2614.7461  27.4564          ?        ?      511.2        2.7       ?       ? 
1 1 1   41   21   26 o    161.9    3.9    0.0000   0.0000          ?        ?   262.4324  12.7704          ?        ?      161.9        3.9       ?       ? 
1 1 1   41   21   27 o     16.2    8.2    0.0000   0.0000          ?        ?   -47.8891  13.4090          ?        ?       16.2        8.2       ?       ? 
1 1 1   41   21   28 o    167.7    4.4    0.0000   0.0000          ?        ?   281.5880  14.6860          ?        ?      167.7        4.4       ?       ? 
1 1 1   41   21   29 o     95.0    7.4    0.0000   0.0000          ?        ?    90.6701  14.0475          ?        ?       95.0        7.4       ?       ? 
1 1 1   41   21   30 o     35.3   14.0    0.0000   0.0000          ?        ?     7.0237  14.6860          ?        ?       35.3       14.0       ?       ? 
1 1 1   41   21   31 o     19.4    9.6    0.0000   0.0000          ?        ?   -37.0343  14.6860          ?        ?       19.4        9.6       ?       ? 
1 1 1   41   21   32 o    261.7    3.5    0.0000   0.0000          ?        ?   685.7722  18.5171          ?        ?      261.7        3.5       ?       ? 
1 1 1   41   21   33 o    261.7    3.4    0.0000   0.0000          ?        ?   685.7722  17.8786          ?        ?      261.7        3.4       ?       ? 
1 1 1   41   21   34 o    317.5    3.0    0.0000   0.0000          ?        ?  1008.8642  19.1556          ?        ?      317.5        3.0       ?       ? 
1 1 1   41   21   35 o    216.3    3.8    0.0000   0.0000          ?        ?   468.6749  16.6016          ?        ?      216.3        3.8       ?       ? 
1 1 1   41   21   36 o    289.6    3.0    0.0000   0.0000          ?        ?   839.6559  17.2401          ?        ?      289.6        3.0       ?       ? 
1 1 1   41   21   37 o     20.5   10.2    0.0000   0.0000          ?        ?   -38.3113  15.9630          ?        ?       20.5       10.2       ?       ? 
1 1 1   41   21   38 o    210.0    4.0    0.0000   0.0000          ?        ?   441.8569  16.6016          ?        ?      210.0        4.0       ?       ? 
1 1 1   41   21   39 o    111.5    7.4    0.0000   0.0000          ?        ?   125.1502  16.6016          ?        ?      111.5        7.4       ?       ? 
1 1 1   41   21   40 o    150.5    5.3    0.0000   0.0000          ?        ?   227.3137  15.9630          ?        ?      150.5        5.3       ?       ? 
1 1 1   41   21   41 o     64.4   13.3    0.0000   0.0000          ?        ?    44.0580  16.6016          ?        ?       64.4       13.3       ?       ? 
1 1 1   41   21   42 o    281.4    3.3    0.0000   0.0000          ?        ?   793.0438  18.5171          ?        ?      281.4        3.3       ?       ? 
1 1 1   41   21   43 o    238.8    3.7    0.0000   0.0000          ?        ?   571.4769  17.8786          ?        ?      238.8        3.7       ?       ? 
1 1 1   41   21   44 o    183.6    4.7    0.0000   0.0000          ?        ?   338.4165  17.2401          ?        ?      183.6        4.7       ?       ? 
1 1 1   41   21   45 o    227.0    3.9    0.0000   0.0000          ?        ?   516.5640  17.8786          ?        ?      227.0        3.9       ?       ? 
1 1 1   41   21   46 o     67.9   13.2    0.0000   0.0000          ?        ?    49.1662  17.2401          ?        ?       67.9       13.2       ?       ? 
1 1 1   41   21   47 o     61.4   14.3    0.0000   0.0000          ?        ?    40.8654  17.2401          ?        ?       61.4       14.3       ?       ? 
1 1 1   41   22    0 o     19.6   13.7  -15.3245  18.5171   -15.3245  18.5171   -15.3245  18.5171       19.6     13.7       19.6       13.7     0.0     0.0 
1 1 1   41   22    1 o    128.2    5.2    0.0000   0.0000          ?        ?   164.7386  13.4090          ?        ?      128.2        5.2       ?       ? 
1 1 1   41   22    2 o    399.8    2.9    0.0000   0.0000          ?        ?  1599.4967  22.9868          ?        ?      399.8        2.9       ?       ? 
1 1 1   41   22    3 o    225.8    3.3    0.0000   0.0000          ?        ?   510.1788  14.6860          ?        ?      225.8        3.3       ?       ? 
1 1 1   41   22    4 o    245.3    3.6    0.0000   0.0000          ?        ?   602.1259  17.8786          ?        ?      245.3        3.6       ?       ? 
1 1 1   41   22    5 o    200.0    3.5    0.0000   0.0000          ?        ?   400.3531  14.0475          ?        ?      200.0        3.5       ?       ? 
1 1 1   41   22    6 o    124.7    5.9    0.0000   0.0000          ?        ?   155.7993  14.6860          ?        ?      124.7        5.9       ?       ? 
1 1 1   41   22    7 o     56.2   14.2    0.0000   0.0000          ?        ?    33.2031  15.9630          ?        ?       56.2       14.2       ?       ? 
1 1 1   41   22    8 o     33.0   13.8    0.0000   0.0000          ?        ?     1.9156  15.3245          ?        ?       33.0       13.8       ?       ? 
1 1 1   41   22    9 o    187.3    3.9    0.0000   0.0000          ?        ?   351.1869  14.6860          ?        ?      187.3        3.9       ?       ? 
1 1 1   41   22   10 o    261.9    3.7    0.0000   0.0000          ?        ?   686.4108  19.1556          ?        ?      261.9        3.7       ?       ? 
1 1 1   41   22   11 o    314.7    3.4    0.0000   0.0000          ?        ?   990.9855  21.7097          ?        ?      314.7        3.4       ?       ? 
1 1 1   41   22   12 o    320.8    2.6    0.0000   0.0000          ?        ?  1029.2969  16.6016          ?        ?      320.8        2.6       ?       ? 
1 1 1   41   22   13 o    118.4    4.9    0.0000   0.0000          ?        ?   140.4748  11.4934          ?        ?      118.4        4.9       ?       ? 
1 1 1   41   22   14 o    158.3    4.4    0.0000   0.0000          ?        ?   250.9390  14.0475          ?        ?      158.3        4.4       ?       ? 
1 1 1   41   22   15 o    625.8    3.5    0.0000   0.0000          ?        ?  3919.2456  44.0580          ?        ?      625.8        3.5       ?       ? 
1 1 1   41   22   16 o    362.1    3.0    0.0000   0.0000          ?        ?  1312.1620  21.7097          ?        ?      362.1        3.0       ?       ? 
1 1 1   41   22   17 o    292.6    3.3    0.0000   0.0000          ?        ?   856.8960  19.1556          ?        ?      292.6        3.3       ?       ? 
1 1 1   41   22   18 o    105.0    4.3    0.0000   0.0000          ?        ?   110.4642   8.9393          ?        ?      105.0        4.3       ?       ? 
1 1 1   41   22   19 o    214.9    3.0    0.0000   0.0000          ?        ?   462.2897  12.7704          ?        ?      214.9        3.0       ?       ? 
1 1 1   41   22   20 o    233.6    2.9    0.0000   0.0000          ?        ?   545.9360  13.4090          ?        ?      233.6        2.9       ?       ? 
1 1 1   41   22   21 o    309.3    2.6    0.0000   0.0000          ?        ?   957.1439  15.9630          ?        ?      309.3        2.6       ?       ? 
1 1 1   41   22   22 o    269.1    2.7    0.0000   0.0000          ?        ?   724.7220  14.6860          ?        ?      269.1        2.7       ?       ? 
1 1 1   41   22   23 o    245.8    2.9    0.0000   0.0000          ?        ?   604.6799  14.0475          ?        ?      245.8        2.9       ?       ? 
1 1 1   41   22   24 f    232.8    2.9    0.0000   0.0000          ?        ?   542.1049  13.4090          ?        ?      232.8        2.9       ?       ? 
1 1 1   41   22   25 o    185.6    4.0    0.0000   0.0000          ?        ?   344.8017  14.6860          ?        ?      185.6        4.0       ?       ? 
1 1 1   41   22   26 o    134.5    5.2    0.0000   0.0000          ?        ?   181.3401  14.0475          ?        ?      134.5        5.2       ?       ? 
1 1 1   41   22   27 o    368.3    2.6    0.0000   0.0000          ?        ?  1357.4971  19.1556          ?        ?      368.3        2.6       ?       ? 
1 1 1   41   22   28 o    195.6    3.9    0.0000   0.0000          ?        ?   383.1130  15.3245          ?        ?      195.6        3.9       ?       ? 
1 1 1   41   22   29 o    223.5    3.3    0.0000   0.0000          ?        ?   499.9625  14.6860          ?        ?      223.5        3.3       ?       ? 
1 1 1   41   22   30 o    170.3    4.5    0.0000   0.0000          ?        ?   290.5273  15.3245          ?        ?      170.3        4.5       ?       ? 
1 1 1   41   22   31 o     41.1   14.4    0.0000   0.0000          ?        ?    15.3245  14.6860          ?        ?       41.1       14.4       ?       ? 
1 1 1   41   22   32 o    180.6    4.4    0.0000   0.0000          ?        ?   326.9231  15.9630          ?        ?      180.6        4.4       ?       ? 
1 1 1   41   22   33 o    450.9    2.6    0.0000   0.0000          ?        ?  2034.9685  23.6253          ?        ?      450.9        2.6       ?       ? 
1 1 1   41   22   34 o    248.6    3.5    0.0000   0.0000          ?        ?   618.7275  17.2401          ?        ?      248.6        3.5       ?       ? 
1 1 1   41   22   35 o    198.9    4.3    0.0000   0.0000          ?        ?   396.5219  17.2401          ?        ?      198.9        4.3       ?       ? 
1 1 1   41   22   36 o     97.2    7.9    0.0000   0.0000          ?        ?    95.1397  15.3245          ?        ?       97.2        7.9       ?       ? 
1 1 1   41   22   37 o    121.9    6.5    0.0000   0.0000          ?        ?   149.4141  15.9630          ?        ?      121.9        6.5       ?       ? 
1 1 1   41   22   38 o    133.6    6.0    0.0000   0.0000          ?        ?   179.4246  15.9630          ?        ?      133.6        6.0       ?       ? 
1 1 1   41   22   39 o     28.9   13.1    0.0000   0.0000          ?        ?    -9.5778  16.6016          ?        ?       28.9       13.1       ?       ? 
1 1 1   41   22   40 o     24.4   11.7    0.0000   0.0000          ?        ?   -23.6253  16.6016          ?        ?       24.4       11.7       ?       ? 
1 1 1   41   22   41 o     20.3   10.1    0.0000   0.0000          ?        ?   -42.7809  16.6016          ?        ?       20.3       10.1       ?       ? 
1 1 1   41   22   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   22   43 o    194.7    4.4    0.0000   0.0000          ?        ?   380.5589  17.2401          ?        ?      194.7        4.4       ?       ? 
1 1 1   41   22   44 o    125.3    6.9    0.0000   0.0000          ?        ?   158.3534  17.2401          ?        ?      125.3        6.9       ?       ? 
1 1 1   41   22   45 f     69.7   12.8    0.0000   0.0000          ?        ?    51.7203  17.2401          ?        ?       69.7       12.8       ?       ? 
1 1 1   41   23    0 o    490.7    5.2 2411.0576  51.0817  2411.0576  51.0817  2411.0576  51.0817      490.7      5.2      490.7        5.2     0.0     0.0 
1 1 1   41   23    1 o    733.6    4.5    0.0000   0.0000          ?        ?  5388.4844  66.4062          ?        ?      733.6        4.5       ?       ? 
1 1 1   41   23    2 o    418.0    4.4    0.0000   0.0000          ?        ?  1748.9106  36.3957          ?        ?      418.0        4.4       ?       ? 
1 1 1   41   23    3 o    367.4    3.2    0.0000   0.0000          ?        ?  1350.4733  23.6253          ?        ?      367.4        3.2       ?       ? 
1 1 1   41   23    4 f    214.7    4.2    0.0000   0.0000          ?        ?   461.6512  17.8786          ?        ?      214.7        4.2       ?       ? 
1 1 1   41   23    5 o    490.9    4.1    0.0000   0.0000          ?        ?  2412.3347  40.2269          ?        ?      490.9        4.1       ?       ? 
1 1 1   41   23    6 o    187.3    3.9    0.0000   0.0000          ?        ?   351.1869  14.6860          ?        ?      187.3        3.9       ?       ? 
1 1 1   41   23    7 o    330.1    3.3    0.0000   0.0000          ?        ?  1090.5950  21.7097          ?        ?      330.1        3.3       ?       ? 
1 1 1   41   23    8 o    242.7    3.6    0.0000   0.0000          ?        ?   589.3555  17.2401          ?        ?      242.7        3.6       ?       ? 
1 1 1   41   23    9 o    376.2    3.4    0.0000   0.0000          ?        ?  1416.2410  25.5409          ?        ?      376.2        3.4       ?       ? 
1 1 1   41   23   10 o    345.8    3.5    0.0000   0.0000          ?        ?  1196.5895  24.2638          ?        ?      345.8        3.5       ?       ? 
1 1 1   41   23   11 o    187.6    4.3    0.0000   0.0000          ?        ?   352.4639  15.9630          ?        ?      187.6        4.3       ?       ? 
1 1 1   41   23   12 o    219.3    3.9    0.0000   0.0000          ?        ?   481.4453  17.2401          ?        ?      219.3        3.9       ?       ? 
1 1 1   41   23   13 o    345.7    2.7    0.0000   0.0000          ?        ?  1195.9510  18.5171          ?        ?      345.7        2.7       ?       ? 
1 1 1   41   23   14 o    195.8    3.3    0.0000   0.0000          ?        ?   383.7515  12.7704          ?        ?      195.8        3.3       ?       ? 
1 1 1   41   23   15 o    238.3    3.2    0.0000   0.0000          ?        ?   568.2842  15.3245          ?        ?      238.3        3.2       ?       ? 
1 1 1   41   23   16 o    174.6    3.8    0.0000   0.0000          ?        ?   305.2133  13.4090          ?        ?      174.6        3.8       ?       ? 
1 1 1   41   23   17 o    187.0    3.8    0.0000   0.0000          ?        ?   349.9099  14.0475          ?        ?      187.0        3.8       ?       ? 
1 1 1   41   23   18 o    137.6    5.3    0.0000   0.0000          ?        ?   189.6409  14.6860          ?        ?      137.6        5.3       ?       ? 
1 1 1   41   23   19 o    162.9    3.1    0.0000   0.0000          ?        ?   265.6250  10.2163          ?        ?      162.9        3.1       ?       ? 
1 1 1   41   23   20 o    133.9    4.1    0.0000   0.0000          ?        ?   179.4246  10.8549          ?        ?      133.9        4.1       ?       ? 
1 1 1   41   23   21 o    231.8    2.8    0.0000   0.0000          ?        ?   537.6352  12.7704          ?        ?      231.8        2.8       ?       ? 
1 1 1   41   23   22 o    157.1    3.9    0.0000   0.0000          ?        ?   247.1079  12.1319          ?        ?      157.1        3.9       ?       ? 
1 1 1   41   23   23 o    158.3    4.0    0.0000   0.0000          ?        ?   250.9390  12.7704          ?        ?      158.3        4.0       ?       ? 
1 1 1   41   23   24 f    234.4    3.1    0.0000   0.0000          ?        ?   549.7671  14.6860          ?        ?      234.4        3.1       ?       ? 
1 1 1   41   23   25 o    163.1    4.1    0.0000   0.0000          ?        ?   266.2635  13.4090          ?        ?      163.1        4.1       ?       ? 
1 1 1   41   23   26 o    152.1    4.4    0.0000   0.0000          ?        ?   231.7833  13.4090          ?        ?      152.1        4.4       ?       ? 
1 1 1   41   23   27 o    189.5    3.7    0.0000   0.0000          ?        ?   359.4877  14.0475          ?        ?      189.5        3.7       ?       ? 
1 1 1   41   23   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   23   29 o    151.2    4.6    0.0000   0.0000          ?        ?   229.2293  14.0475          ?        ?      151.2        4.6       ?       ? 
1 1 1   41   23   30 o    165.0    4.5    0.0000   0.0000          ?        ?   272.6487  14.6860          ?        ?      165.0        4.5       ?       ? 
1 1 1   41   23   31 o     63.5   11.5    0.0000   0.0000          ?        ?    42.1424  14.0475          ?        ?       63.5       11.5       ?       ? 
1 1 1   41   23   32 o    223.9    3.4    0.0000   0.0000          ?        ?   501.8780  15.3245          ?        ?      223.9        3.4       ?       ? 
1 1 1   41   23   33 o    175.0    4.7    0.0000   0.0000          ?        ?   307.1289  16.6016          ?        ?      175.0        4.7       ?       ? 
1 1 1   41   23   34 o     84.2    9.1    0.0000   0.0000          ?        ?    71.5144  15.3245          ?        ?       84.2        9.1       ?       ? 
1 1 1   41   23   35 o    168.1    4.7    0.0000   0.0000          ?        ?   283.5036  15.9630          ?        ?      168.1        4.7       ?       ? 
1 1 1   41   23   36 o    185.0    4.3    0.0000   0.0000          ?        ?   342.8861  15.9630          ?        ?      185.0        4.3       ?       ? 
1 1 1   41   23   37 o     70.9   11.3    0.0000   0.0000          ?        ?    51.0817  15.9630          ?        ?       70.9       11.3       ?       ? 
1 1 1   41   23   38 o    239.9    3.6    0.0000   0.0000          ?        ?   576.5850  17.2401          ?        ?      239.9        3.6       ?       ? 
1 1 1   41   23   39 o    117.3    6.8    0.0000   0.0000          ?        ?   138.5592  15.9630          ?        ?      117.3        6.8       ?       ? 
1 1 1   41   23   40 o    165.9    5.2    0.0000   0.0000          ?        ?   276.4799  17.2401          ?        ?      165.9        5.2       ?       ? 
1 1 1   41   23   41 o     57.7   14.0    0.0000   0.0000          ?        ?    35.7572  15.9630          ?        ?       57.7       14.0       ?       ? 
1 1 1   41   23   42 o     23.8   11.5    0.0000   0.0000          ?        ?   -25.5409  16.6016          ?        ?       23.8       11.5       ?       ? 
1 1 1   41   23   43 o     18.3    9.3    0.0000   0.0000          ?        ?   -60.6596  17.2401          ?        ?       18.3        9.3       ?       ? 
1 1 1   41   23   44 o     88.9    9.3    0.0000   0.0000          ?        ?    80.4537  16.6016          ?        ?       88.9        9.3       ?       ? 
1 1 1   41   24    0 o     11.2    8.4  -58.7440  15.9630   -58.7440  15.9630   -58.7440  15.9630       11.2      8.4       11.2        8.4     0.0     0.0 
1 1 1   41   24    1 o    176.2    4.2    0.0000   0.0000          ?        ?   310.9600  14.6860          ?        ?      176.2        4.2       ?       ? 
1 1 1   41   24    2 o    494.2    3.4    0.0000   0.0000          ?        ?  2444.2607  33.2031          ?        ?      494.2        3.4       ?       ? 
1 1 1   41   24    3 o    221.5    3.7    0.0000   0.0000          ?        ?   491.0231  16.6016          ?        ?      221.5        3.7       ?       ? 
1 1 1   41   24    4 o    316.0    3.3    0.0000   0.0000          ?        ?   999.2863  21.0712          ?        ?      316.0        3.3       ?       ? 
1 1 1   41   24    5 o    334.6    3.1    0.0000   0.0000          ?        ?  1120.6055  21.0712          ?        ?      334.6        3.1       ?       ? 
1 1 1   41   24    6 o    281.9    3.2    0.0000   0.0000          ?        ?   794.9594  17.8786          ?        ?      281.9        3.2       ?       ? 
1 1 1   41   24    7 o    165.0    4.3    0.0000   0.0000          ?        ?   272.6487  14.0475          ?        ?      165.0        4.3       ?       ? 
1 1 1   41   24    8 o    743.1    4.4    0.0000   0.0000          ?        ?  5528.3203  65.1292          ?        ?      743.1        4.4       ?       ? 
1 1 1   41   24    9 o    185.6    4.3    0.0000   0.0000          ?        ?   344.8017  15.9630          ?        ?      185.6        4.3       ?       ? 
1 1 1   41   24   10 f    242.8    3.8    0.0000   0.0000          ?        ?   589.9940  18.5171          ?        ?      242.8        3.8       ?       ? 
1 1 1   41   24   11 o     91.6    7.3    0.0000   0.0000          ?        ?    84.2849  13.4090          ?        ?       91.6        7.3       ?       ? 
1 1 1   41   24   12 o    221.5    3.9    0.0000   0.0000          ?        ?   491.0231  17.2401          ?        ?      221.5        3.9       ?       ? 
1 1 1   41   24   13 o    118.4    4.9    0.0000   0.0000          ?        ?   140.4748  11.4934          ?        ?      118.4        4.9       ?       ? 
1 1 1   41   24   14 o     16.1    8.1    0.0000   0.0000          ?        ?   -34.4802  11.4934          ?        ?       16.1        8.1       ?       ? 
1 1 1   41   24   15 o     92.7    6.5    0.0000   0.0000          ?        ?    86.2004  12.1319          ?        ?       92.7        6.5       ?       ? 
1 1 1   41   24   16 o    173.9    4.0    0.0000   0.0000          ?        ?   302.6593  14.0475          ?        ?      173.9        4.0       ?       ? 
1 1 1   41   24   17 f    163.1    4.3    0.0000   0.0000          ?        ?   266.2635  14.0475          ?        ?      163.1        4.3       ?       ? 
1 1 1   41   24   18 o    149.1    4.9    0.0000   0.0000          ?        ?   222.8441  14.6860          ?        ?      149.1        4.9       ?       ? 
1 1 1   41   24   19 o     33.0   13.3    0.0000   0.0000          ?        ?     5.1082  13.4090          ?        ?       33.0       13.3       ?       ? 
1 1 1   41   24   20 o    203.8    2.8    0.0000   0.0000          ?        ?   415.6776  11.4934          ?        ?      203.8        2.8       ?       ? 
1 1 1   41   24   21 o    156.7    3.7    0.0000   0.0000          ?        ?   245.8308  11.4934          ?        ?      156.7        3.7       ?       ? 
1 1 1   41   24   22 o    322.6    2.6    0.0000   0.0000          ?        ?  1041.4288  16.6016          ?        ?      322.6        2.6       ?       ? 
1 1 1   41   24   23 f    122.9    4.9    0.0000   0.0000          ?        ?   151.3296  12.1319          ?        ?      122.9        4.9       ?       ? 
1 1 1   41   24   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   24   25 o     47.5   13.0    0.0000   0.0000          ?        ?    23.6253  12.7704          ?        ?       47.5       13.0       ?       ? 
1 1 1   41   24   26 o    157.0    4.7    0.0000   0.0000          ?        ?   247.1079  14.6860          ?        ?      157.0        4.7       ?       ? 
1 1 1   41   24   27 o     17.0    8.6    0.0000   0.0000          ?        ?   -42.1424  13.4090          ?        ?       17.0        8.6       ?       ? 
1 1 1   41   24   28 o    209.3    3.5    0.0000   0.0000          ?        ?   438.6643  14.6860          ?        ?      209.3        3.5       ?       ? 
1 1 1   41   24   29 o     64.4   11.8    0.0000   0.0000          ?        ?    43.4195  14.6860          ?        ?       64.4       11.8       ?       ? 
1 1 1   41   24   30 o     53.8   13.1    0.0000   0.0000          ?        ?    30.6490  14.0475          ?        ?       53.8       13.1       ?       ? 
1 1 1   41   24   31 o     74.1    9.9    0.0000   0.0000          ?        ?    55.5514  14.6860          ?        ?       74.1        9.9       ?       ? 
1 1 1   41   24   32 o    299.2    2.9    0.0000   0.0000          ?        ?   895.8459  17.2401          ?        ?      299.2        2.9       ?       ? 
1 1 1   41   24   33 o    290.1    3.2    0.0000   0.0000          ?        ?   842.8486  18.5171          ?        ?      290.1        3.2       ?       ? 
1 1 1   41   24   34 o    145.8    5.3    0.0000   0.0000          ?        ?   213.2662  15.3245          ?        ?      145.8        5.3       ?       ? 
1 1 1   41   24   35 o    154.5    4.8    0.0000   0.0000          ?        ?   239.4456  14.6860          ?        ?      154.5        4.8       ?       ? 
1 1 1   41   24   36 o     63.6   13.0    0.0000   0.0000          ?        ?    42.7809  15.9630          ?        ?       63.6       13.0       ?       ? 
1 1 1   41   24   37 o     84.8    9.0    0.0000   0.0000          ?        ?    72.7915  15.3245          ?        ?       84.8        9.0       ?       ? 
1 1 1   41   24   38 o     51.5   14.7    0.0000   0.0000          ?        ?    28.0950  15.9630          ?        ?       51.5       14.7       ?       ? 
1 1 1   41   24   39 o    109.7    7.0    0.0000   0.0000          ?        ?   121.3191  15.3245          ?        ?      109.7        7.0       ?       ? 
1 1 1   41   24   40 o     25.4   12.1    0.0000   0.0000          ?        ?   -19.7942  16.6016          ?        ?       25.4       12.1       ?       ? 
1 1 1   41   24   41 o     35.7   14.4    0.0000   0.0000          ?        ?     6.3852  15.9630          ?        ?       35.7       14.4       ?       ? 
1 1 1   41   24   42 o     21.0   10.4    0.0000   0.0000          ?        ?   -38.3113  16.6016          ?        ?       21.0       10.4       ?       ? 
1 1 1   41   25    0 o    360.1    4.8 1298.7529  34.4802  1298.7529  34.4802  1298.7529  34.4802      360.1      4.8      360.1        4.8     0.0     0.0 
1 1 1   41   25    1 o    115.9    6.3    0.0000   0.0000          ?        ?   134.7281  14.6860          ?        ?      115.9        6.3       ?       ? 
1 1 1   41   25    2 o    388.5    3.3    0.0000   0.0000          ?        ?  1510.1036  25.5409          ?        ?      388.5        3.3       ?       ? 
1 1 1   41   25    3 o    126.3    4.0    0.0000   0.0000          ?        ?   159.6304  10.2163          ?        ?      126.3        4.0       ?       ? 
1 1 1   41   25    4 o    173.0    3.5    0.0000   0.0000          ?        ?   299.4666  12.1319          ?        ?      173.0        3.5       ?       ? 
1 1 1   41   25    5 o    357.6    3.0    0.0000   0.0000          ?        ?  1279.5973  21.7097          ?        ?      357.6        3.0       ?       ? 
1 1 1   41   25    6 o    220.4    3.2    0.0000   0.0000          ?        ?   485.9149  14.0475          ?        ?      220.4        3.2       ?       ? 
1 1 1   41   25    7 o    459.8    3.9    0.0000   0.0000          ?        ?  2116.0605  35.7572          ?        ?      459.8        3.9       ?       ? 
1 1 1   41   25    8 f    225.9    3.5    0.0000   0.0000          ?        ?   510.8173  15.9630          ?        ?      225.9        3.5       ?       ? 
1 1 1   41   25    9 o     98.0    6.5    0.0000   0.0000          ?        ?    96.4168  12.7704          ?        ?       98.0        6.5       ?       ? 
1 1 1   41   25   10 f    328.1    3.3    0.0000   0.0000          ?        ?  1077.1859  21.7097          ?        ?      328.1        3.3       ?       ? 
1 1 1   41   25   11 o    262.1    3.4    0.0000   0.0000          ?        ?   687.6877  17.8786          ?        ?      262.1        3.4       ?       ? 
1 1 1   41   25   12 o    287.5    3.3    0.0000   0.0000          ?        ?   827.5240  19.1556          ?        ?      287.5        3.3       ?       ? 
1 1 1   41   25   13 o     99.6    7.7    0.0000   0.0000          ?        ?    99.6094  15.3245          ?        ?       99.6        7.7       ?       ? 
1 1 1   41   25   14 o    512.7    3.4    0.0000   0.0000          ?        ?  2631.3477  35.1187          ?        ?      512.7        3.4       ?       ? 
1 1 1   41   25   15 o    245.3    3.0    0.0000   0.0000          ?        ?   602.1259  14.6860          ?        ?      245.3        3.0       ?       ? 
1 1 1   41   25   16 o    198.4    3.5    0.0000   0.0000          ?        ?   393.9678  14.0475          ?        ?      198.4        3.5       ?       ? 
1 1 1   41   25   17 o     25.9   11.8    0.0000   0.0000          ?        ?    -8.3008  13.4090          ?        ?       25.9       11.8       ?       ? 
1 1 1   41   25   18 o     20.6   10.2    0.0000   0.0000          ?        ?   -30.6490  14.6860          ?        ?       20.6       10.2       ?       ? 
1 1 1   41   25   19 o     23.0   11.0    0.0000   0.0000          ?        ?   -18.5171  14.0475          ?        ?       23.0       11.0       ?       ? 
1 1 1   41   25   20 o    221.0    3.5    0.0000   0.0000          ?        ?   489.1075  15.3245          ?        ?      221.0        3.5       ?       ? 
1 1 1   41   25   21 o    155.1    3.5    0.0000   0.0000          ?        ?   240.7227  10.8549          ?        ?      155.1        3.5       ?       ? 
1 1 1   41   25   22 o     96.1    6.0    0.0000   0.0000          ?        ?    92.5856  11.4934          ?        ?       96.1        6.0       ?       ? 
1 1 1   41   25   23 o     24.3   11.1    0.0000   0.0000          ?        ?    -8.3008  12.1319          ?        ?       24.3       11.1       ?       ? 
1 1 1   41   25   24 o    157.5    4.3    0.0000   0.0000          ?        ?   248.3849  13.4090          ?        ?      157.5        4.3       ?       ? 
1 1 1   41   25   25 o     31.4   12.8    0.0000   0.0000          ?        ?     3.8311  12.7704          ?        ?       31.4       12.8       ?       ? 
1 1 1   41   25   26 o    140.5    4.8    0.0000   0.0000          ?        ?   197.9417  13.4090          ?        ?      140.5        4.8       ?       ? 
1 1 1   41   25   27 o    338.3    2.6    0.0000   0.0000          ?        ?  1145.5078  17.8786          ?        ?      338.3        2.6       ?       ? 
1 1 1   41   25   28 o    301.4    2.9    0.0000   0.0000          ?        ?   909.2548  17.2401          ?        ?      301.4        2.9       ?       ? 
1 1 1   41   25   29 o    371.0    2.8    0.0000   0.0000          ?        ?  1377.9297  20.4327          ?        ?      371.0        2.8       ?       ? 
1 1 1   41   25   30 o    272.5    3.2    0.0000   0.0000          ?        ?   743.2392  17.2401          ?        ?      272.5        3.2       ?       ? 
1 1 1   41   25   31 o     98.5    7.1    0.0000   0.0000          ?        ?    97.6938  14.0475          ?        ?       98.5        7.1       ?       ? 
1 1 1   41   25   32 o    175.8    4.4    0.0000   0.0000          ?        ?   309.6830  15.3245          ?        ?      175.8        4.4       ?       ? 
1 1 1   41   25   33 o    224.7    3.6    0.0000   0.0000          ?        ?   505.7091  15.9630          ?        ?      224.7        3.6       ?       ? 
1 1 1   41   25   34 o     68.6   11.2    0.0000   0.0000          ?        ?    47.8891  15.3245          ?        ?       68.6       11.2       ?       ? 
1 1 1   41   25   35 o     30.6   13.5    0.0000   0.0000          ?        ?    -3.8311  15.9630          ?        ?       30.6       13.5       ?       ? 
1 1 1   41   25   36 o    141.4    5.9    0.0000   0.0000          ?        ?   201.1343  16.6016          ?        ?      141.4        5.9       ?       ? 
1 1 1   41   25   37 o     42.5   15.0    0.0000   0.0000          ?        ?    16.6016  15.9630          ?        ?       42.5       15.0       ?       ? 
1 1 1   41   25   38 o    171.2    4.7    0.0000   0.0000          ?        ?   294.3585  15.9630          ?        ?      171.2        4.7       ?       ? 
1 1 1   41   25   39 o    140.3    5.7    0.0000   0.0000          ?        ?   197.9417  15.9630          ?        ?      140.3        5.7       ?       ? 
1 1 1   41   25   40 o    152.0    5.2    0.0000   0.0000          ?        ?   232.4219  15.9630          ?        ?      152.0        5.2       ?       ? 
1 1 1   41   25   41 o    168.9    4.9    0.0000   0.0000          ?        ?   286.6962  16.6016          ?        ?      168.9        4.9       ?       ? 
1 1 1   41   26    0 o    190.6   18.1  377.3663  67.6833   377.3663  67.6833   377.3663  67.6833      190.6     18.1      190.6       18.1     0.0     0.0 
1 1 1   41   26    1 o    274.4    5.0    0.0000   0.0000          ?        ?   754.0941  27.4564          ?        ?      274.4        5.0       ?       ? 
1 1 1   41   26    2 o     63.4   13.0    0.0000   0.0000          ?        ?    42.1424  15.9630          ?        ?       63.4       13.0       ?       ? 
1 1 1   41   26    3 o    127.1    6.8    0.0000   0.0000          ?        ?   162.1845  17.2401          ?        ?      127.1        6.8       ?       ? 
1 1 1   41   26    4 o    185.5    5.3    0.0000   0.0000          ?        ?   344.8017  19.7942          ?        ?      185.5        5.3       ?       ? 
1 1 1   41   26    5 o    147.4    5.4    0.0000   0.0000          ?        ?   217.7359  15.9630          ?        ?      147.4        5.4       ?       ? 
1 1 1   41   26    6 o    127.2    6.3    0.0000   0.0000          ?        ?   162.1845  15.9630          ?        ?      127.2        6.3       ?       ? 
1 1 1   41   26    7 o    145.6    5.7    0.0000   0.0000          ?        ?   212.6277  16.6016          ?        ?      145.6        5.7       ?       ? 
1 1 1   41   26    8 o    158.4    5.4    0.0000   0.0000          ?        ?   251.5775  17.2401          ?        ?      158.4        5.4       ?       ? 
1 1 1   41   26    9 o    192.2    3.5    0.0000   0.0000          ?        ?   369.7040  13.4090          ?        ?      192.2        3.5       ?       ? 
1 1 1   41   26   10 o    220.3    3.3    0.0000   0.0000          ?        ?   485.9149  14.6860          ?        ?      220.3        3.3       ?       ? 
1 1 1   41   26   11 o    280.2    3.5    0.0000   0.0000          ?        ?   786.0201  19.7942          ?        ?      280.2        3.5       ?       ? 
1 1 1   41   26   12 o    305.9    3.9    0.0000   0.0000          ?        ?   936.7112  23.6253          ?        ?      305.9        3.9       ?       ? 
1 1 1   41   26   13 o    121.0    6.3    0.0000   0.0000          ?        ?   146.8600  15.3245          ?        ?      121.0        6.3       ?       ? 
1 1 1   41   26   14 o    180.3    4.6    0.0000   0.0000          ?        ?   325.6460  16.6016          ?        ?      180.3        4.6       ?       ? 
1 1 1   41   26   15 o    236.1    3.2    0.0000   0.0000          ?        ?   558.0679  15.3245          ?        ?      236.1        3.2       ?       ? 
1 1 1   41   26   16 o    214.6    3.4    0.0000   0.0000          ?        ?   461.0126  14.6860          ?        ?      214.6        3.4       ?       ? 
1 1 1   41   26   17 o    107.3    5.9    0.0000   0.0000          ?        ?   115.5724  12.7704          ?        ?      107.3        5.9       ?       ? 
1 1 1   41   26   18 o    149.4    4.5    0.0000   0.0000          ?        ?   223.4826  13.4090          ?        ?      149.4        4.5       ?       ? 
1 1 1   41   26   19 o    317.0    3.1    0.0000   0.0000          ?        ?  1005.6716  19.7942          ?        ?      317.0        3.1       ?       ? 
1 1 1   41   26   20 o     85.1    7.5    0.0000   0.0000          ?        ?    72.7915  12.7704          ?        ?       85.1        7.5       ?       ? 
1 1 1   41   26   21 o    221.2    3.5    0.0000   0.0000          ?        ?   489.7461  15.3245          ?        ?      221.2        3.5       ?       ? 
1 1 1   41   26   22 o    190.7    3.2    0.0000   0.0000          ?        ?   363.9573  12.1319          ?        ?      190.7        3.2       ?       ? 
1 1 1   41   26   23 o    224.5    3.0    0.0000   0.0000          ?        ?   504.4321  13.4090          ?        ?      224.5        3.0       ?       ? 
1 1 1   41   26   24 o    120.2    5.0    0.0000   0.0000          ?        ?   144.9444  12.1319          ?        ?      120.2        5.0       ?       ? 
1 1 1   41   26   25 o    200.6    3.5    0.0000   0.0000          ?        ?   402.9071  14.0475          ?        ?      200.6        3.5       ?       ? 
1 1 1   41   26   26 o    180.8    3.9    0.0000   0.0000          ?        ?   327.5616  14.0475          ?        ?      180.8        3.9       ?       ? 
1 1 1   41   26   27 o     96.3    7.3    0.0000   0.0000          ?        ?    93.2242  14.0475          ?        ?       96.3        7.3       ?       ? 
1 1 1   41   26   28 o     68.8    9.7    0.0000   0.0000          ?        ?    47.8891  13.4090          ?        ?       68.8        9.7       ?       ? 
1 1 1   41   26   29 o    136.8    5.1    0.0000   0.0000          ?        ?   187.7254  14.0475          ?        ?      136.8        5.1       ?       ? 
1 1 1   41   26   30 o    125.6    5.8    0.0000   0.0000          ?        ?   158.3534  14.6860          ?        ?      125.6        5.8       ?       ? 
1 1 1   41   26   31 o     18.7    9.3    0.0000   0.0000          ?        ?   -36.3957  14.0475          ?        ?       18.7        9.3       ?       ? 
1 1 1   41   26   32 o     72.8    9.7    0.0000   0.0000          ?        ?    53.6358  14.0475          ?        ?       72.8        9.7       ?       ? 
1 1 1   41   26   33 o    214.1    3.6    0.0000   0.0000          ?        ?   459.0970  15.3245          ?        ?      214.1        3.6       ?       ? 
1 1 1   41   26   34 o    330.6    2.8    0.0000   0.0000          ?        ?  1094.4260  18.5171          ?        ?      330.6        2.8       ?       ? 
1 1 1   41   26   35 o     56.9   12.7    0.0000   0.0000          ?        ?    34.4802  14.0475          ?        ?       56.9       12.7       ?       ? 
1 1 1   41   26   36 o    264.3    3.3    0.0000   0.0000          ?        ?   699.8197  17.2401          ?        ?      264.3        3.3       ?       ? 
1 1 1   41   26   37 o     43.0   14.8    0.0000   0.0000          ?        ?    17.8786  15.3245          ?        ?       43.0       14.8       ?       ? 
1 1 1   41   26   38 o     19.9    9.9    0.0000   0.0000          ?        ?   -37.0343  15.3245          ?        ?       19.9        9.9       ?       ? 
1 1 1   41   26   39 o     17.8    9.0    0.0000   0.0000          ?        ?   -50.4432  15.3245          ?        ?       17.8        9.0       ?       ? 
1 1 1   41   27    0 o    124.3   19.7  165.3771  45.9736   165.3771  45.9736   165.3771  45.9736      124.3     19.7      124.3       19.7     0.0     0.0 
1 1 1   41   27    1 o     40.4   18.4    0.0000   0.0000          ?        ?   -20.4327  33.2031          ?        ?       40.4       18.4       ?       ? 
1 1 1   41   27    2 o    186.1    9.1    0.0000   0.0000          ?        ?   348.6328  33.8416          ?        ?      186.1        9.1       ?       ? 
1 1 1   41   27    3 o     38.1   17.4    0.0000   0.0000          ?        ?   -19.7942  30.0105          ?        ?       38.1       17.4       ?       ? 
1 1 1   41   27    4 f    175.1    5.3    0.0000   0.0000          ?        ?   307.1289  18.5171          ?        ?      175.1        5.3       ?       ? 
1 1 1   41   27    5 o    423.5    4.9    0.0000   0.0000          ?        ?  1796.7998  41.5039          ?        ?      423.5        4.9       ?       ? 
1 1 1   41   27    6 o     68.0   16.6    0.0000   0.0000          ?        ?    49.1662  22.3483          ?        ?       68.0       16.6       ?       ? 
1 1 1   41   27    7 o    228.9    4.2    0.0000   0.0000          ?        ?   524.8647  19.1556          ?        ?      228.9        4.2       ?       ? 
1 1 1   41   27    8 o     63.5   15.7    0.0000   0.0000          ?        ?    42.7809  19.7942          ?        ?       63.5       15.7       ?       ? 
1 1 1   41   27    9 o    252.4    4.2    0.0000   0.0000          ?        ?   637.8831  21.0712          ?        ?      252.4        4.2       ?       ? 
1 1 1   41   27   10 o     98.8    9.0    0.0000   0.0000          ?        ?    98.3323  17.8786          ?        ?       98.8        9.0       ?       ? 
1 1 1   41   27   11 o    288.3    4.7    0.0000   0.0000          ?        ?   832.6321  26.8179          ?        ?      288.3        4.7       ?       ? 
1 1 1   41   27   12 o    135.5    4.7    0.0000   0.0000          ?        ?   183.8942  12.7704          ?        ?      135.5        4.7       ?       ? 
1 1 1   41   27   13 o    291.9    3.4    0.0000   0.0000          ?        ?   853.0649  19.7942          ?        ?      291.9        3.4       ?       ? 
1 1 1   41   27   14 o     43.6   14.4    0.0000   0.0000          ?        ?    18.5171  14.6860          ?        ?       43.6       14.4       ?       ? 
1 1 1   41   27   15 o    321.4    3.3    0.0000   0.0000          ?        ?  1033.7665  21.0712          ?        ?      321.4        3.3       ?       ? 
1 1 1   41   27   16 o    143.0    4.2    0.0000   0.0000          ?        ?   204.9654  12.1319          ?        ?      143.0        4.2       ?       ? 
1 1 1   41   27   17 o    174.9    4.2    0.0000   0.0000          ?        ?   306.4904  14.6860          ?        ?      174.9        4.2       ?       ? 
1 1 1   41   27   18 o    144.3    5.1    0.0000   0.0000          ?        ?   208.7966  14.6860          ?        ?      144.3        5.1       ?       ? 
1 1 1   41   27   19 o     47.8   14.3    0.0000   0.0000          ?        ?    23.6253  14.6860          ?        ?       47.8       14.3       ?       ? 
1 1 1   41   27   20 o    303.9    2.9    0.0000   0.0000          ?        ?   924.5793  17.8786          ?        ?      303.9        2.9       ?       ? 
1 1 1   41   27   21 o    250.5    3.3    0.0000   0.0000          ?        ?   628.3053  16.6016          ?        ?      250.5        3.3       ?       ? 
1 1 1   41   27   22 o    257.7    2.5    0.0000   0.0000          ?        ?   664.7010  12.7704          ?        ?      257.7        2.5       ?       ? 
1 1 1   41   27   23 o    290.4    2.6    0.0000   0.0000          ?        ?   844.1255  15.3245          ?        ?      290.4        2.6       ?       ? 
1 1 1   41   27   24 o    242.3    2.9    0.0000   0.0000          ?        ?   587.4399  14.0475          ?        ?      242.3        2.9       ?       ? 
1 1 1   41   27   25 o    442.3    2.5    0.0000   0.0000          ?        ?  1957.7074  21.7097          ?        ?      442.3        2.5       ?       ? 
1 1 1   41   27   26 o    143.2    4.7    0.0000   0.0000          ?        ?   205.6040  13.4090          ?        ?      143.2        4.7       ?       ? 
1 1 1   41   27   27 o    205.4    3.6    0.0000   0.0000          ?        ?   422.7013  14.6860          ?        ?      205.4        3.6       ?       ? 
1 1 1   41   27   28 o    219.7    3.3    0.0000   0.0000          ?        ?   483.3608  14.6860          ?        ?      219.7        3.3       ?       ? 
1 1 1   41   27   29 o    240.5    3.2    0.0000   0.0000          ?        ?   579.1391  15.3245          ?        ?      240.5        3.2       ?       ? 
1 1 1   41   27   30 o    174.3    4.0    0.0000   0.0000          ?        ?   304.5748  14.0475          ?        ?      174.3        4.0       ?       ? 
1 1 1   41   27   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   27   32 o     95.8    7.3    0.0000   0.0000          ?        ?    92.5856  14.0475          ?        ?       95.8        7.3       ?       ? 
1 1 1   41   27   33 f    218.2    3.5    0.0000   0.0000          ?        ?   476.9756  15.3245          ?        ?      218.2        3.5       ?       ? 
1 1 1   41   27   34 o     22.7   10.9    0.0000   0.0000          ?        ?   -21.7097  14.6860          ?        ?       22.7       10.9       ?       ? 
1 1 1   41   27   35 o    135.4    5.9    0.0000   0.0000          ?        ?   184.5327  15.9630          ?        ?      135.4        5.9       ?       ? 
1 1 1   41   27   36 o     94.4    7.4    0.0000   0.0000          ?        ?    90.0316  14.0475          ?        ?       94.4        7.4       ?       ? 
1 1 1   41   27   37 o    153.5    5.0    0.0000   0.0000          ?        ?   236.8915  15.3245          ?        ?      153.5        5.0       ?       ? 
1 1 1   41   28    0 o    336.9    7.7 1139.7611  51.7203  1139.7611  51.7203  1139.7611  51.7203      336.9      7.7      336.9        7.7     0.0     0.0 
1 1 1   41   28    1 o    136.7   11.7    0.0000   0.0000          ?        ?   189.0024  31.9261          ?        ?      136.7       11.7       ?       ? 
1 1 1   41   28    2 o     61.1   22.6    0.0000   0.0000          ?        ?    31.9261  36.3957          ?        ?       61.1       22.6       ?       ? 
1 1 1   41   28    3 f    355.2    6.2    0.0000   0.0000          ?        ?  1266.1884  44.0580          ?        ?      355.2        6.2       ?       ? 
1 1 1   41   28    4 o    336.0    6.7    0.0000   0.0000          ?        ?  1133.3759  44.6965          ?        ?      336.0        6.7       ?       ? 
1 1 1   41   28    5 o    256.7    8.0    0.0000   0.0000          ?        ?   662.7855  40.8654          ?        ?      256.7        8.0       ?       ? 
1 1 1   41   28    6 o     66.3   14.8    0.0000   0.0000          ?        ?    46.6121  19.1556          ?        ?       66.3       14.8       ?       ? 
1 1 1   41   28    7 o     84.4   12.1    0.0000   0.0000          ?        ?    72.1529  20.4327          ?        ?       84.4       12.1       ?       ? 
1 1 1   41   28    8 o    339.6    4.2    0.0000   0.0000          ?        ?  1155.0856  28.7335          ?        ?      339.6        4.2       ?       ? 
1 1 1   41   28    9 o    129.1    6.7    0.0000   0.0000          ?        ?   167.2927  17.2401          ?        ?      129.1        6.7       ?       ? 
1 1 1   41   28   10 o     98.8    9.4    0.0000   0.0000          ?        ?    98.3323  18.5171          ?        ?       98.8        9.4       ?       ? 
1 1 1   41   28   11 o     95.7   10.3    0.0000   0.0000          ?        ?    92.5856  19.7942          ?        ?       95.7       10.3       ?       ? 
1 1 1   41   28   12 o    305.6    4.3    0.0000   0.0000          ?        ?   935.4342  26.1794          ?        ?      305.6        4.3       ?       ? 
1 1 1   41   28   13 o     73.9   14.3    0.0000   0.0000          ?        ?    57.4669  20.4327          ?        ?       73.9       14.3       ?       ? 
1 1 1   41   28   14 o    122.3    5.0    0.0000   0.0000          ?        ?   150.0526  12.1319          ?        ?      122.3        5.0       ?       ? 
1 1 1   41   28   15 o    235.0    3.5    0.0000   0.0000          ?        ?   552.9597  16.6016          ?        ?      235.0        3.5       ?       ? 
1 1 1   41   28   16 o    110.6    4.9    0.0000   0.0000          ?        ?   122.5962  10.8549          ?        ?      110.6        4.9       ?       ? 
1 1 1   41   28   17 o     75.5    8.5    0.0000   0.0000          ?        ?    57.4669  12.7704          ?        ?       75.5        8.5       ?       ? 
1 1 1   41   28   18 o    197.2    3.9    0.0000   0.0000          ?        ?   389.4982  15.3245          ?        ?      197.2        3.9       ?       ? 
1 1 1   41   28   19 o    159.4    4.4    0.0000   0.0000          ?        ?   254.7701  14.0475          ?        ?      159.4        4.4       ?       ? 
1 1 1   41   28   20 o    101.5    6.6    0.0000   0.0000          ?        ?   103.4405  13.4090          ?        ?      101.5        6.6       ?       ? 
1 1 1   41   28   21 o    179.9    4.1    0.0000   0.0000          ?        ?   324.3690  14.6860          ?        ?      179.9        4.1       ?       ? 
1 1 1   41   28   22 o    252.4    3.3    0.0000   0.0000          ?        ?   637.8831  16.6016          ?        ?      252.4        3.3       ?       ? 
1 1 1   41   28   23 o    221.2    2.7    0.0000   0.0000          ?        ?   489.7461  12.1319          ?        ?      221.2        2.7       ?       ? 
1 1 1   41   28   24 o    214.7    3.0    0.0000   0.0000          ?        ?   461.6512  12.7704          ?        ?      214.7        3.0       ?       ? 
1 1 1   41   28   25 o     16.4    8.2    0.0000   0.0000          ?        ?   -32.5646  11.4934          ?        ?       16.4        8.2       ?       ? 
1 1 1   41   28   26 o    181.9    3.5    0.0000   0.0000          ?        ?   331.3927  12.7704          ?        ?      181.9        3.5       ?       ? 
1 1 1   41   28   27 o    262.2    2.9    0.0000   0.0000          ?        ?   688.3264  15.3245          ?        ?      262.2        2.9       ?       ? 
1 1 1   41   28   28 f     24.5   11.3    0.0000   0.0000          ?        ?    -9.5778  12.7704          ?        ?       24.5       11.3       ?       ? 
1 1 1   41   28   29 f    112.4    6.0    0.0000   0.0000          ?        ?   127.0658  13.4090          ?        ?      112.4        6.0       ?       ? 
1 1 1   41   28   30 o    108.3    6.2    0.0000   0.0000          ?        ?   118.1265  13.4090          ?        ?      108.3        6.2       ?       ? 
1 1 1   41   28   31 o    129.0    5.2    0.0000   0.0000          ?        ?   167.2927  13.4090          ?        ?      129.0        5.2       ?       ? 
1 1 1   41   28   32 o     39.9   14.1    0.0000   0.0000          ?        ?    14.6860  14.0475          ?        ?       39.9       14.1       ?       ? 
1 1 1   41   28   33 o    107.4    6.5    0.0000   0.0000          ?        ?   116.2109  14.0475          ?        ?      107.4        6.5       ?       ? 
1 1 1   41   28   34 o     83.6    8.4    0.0000   0.0000          ?        ?    70.8759  14.0475          ?        ?       83.6        8.4       ?       ? 
1 1 1   41   28   35 o    152.7    4.8    0.0000   0.0000          ?        ?   234.3374  14.6860          ?        ?      152.7        4.8       ?       ? 
1 1 1   41   29    0 o    119.7   21.0  157.0763  45.9736   157.0763  45.9736   157.0763  45.9736      119.7     21.0      119.7       21.0     0.0     0.0 
1 1 1   41   29    1 o    179.5   15.1    0.0000   0.0000          ?        ?   329.4771  54.2743          ?        ?      179.5       15.1       ?       ? 
1 1 1   41   29    2 o    135.7   17.6    0.0000   0.0000          ?        ?   189.6409  47.8891          ?        ?      135.7       17.6       ?       ? 
1 1 1   41   29    3 o    266.8    8.0    0.0000   0.0000          ?        ?   716.4213  42.7809          ?        ?      266.8        8.0       ?       ? 
1 1 1   41   29    4 o    402.2    5.8    0.0000   0.0000          ?        ?  1623.1219  46.6121          ?        ?      402.2        5.8       ?       ? 
1 1 1   41   29    5 o    264.0    6.4    0.0000   0.0000          ?        ?   699.8197  33.8416          ?        ?      264.0        6.4       ?       ? 
1 1 1   41   29    6 o    229.6   15.9    0.0000   0.0000          ?        ?   540.1893  72.7915          ?        ?      229.6       15.9       ?       ? 
1 1 1   41   29    7 o     96.2   17.9    0.0000   0.0000          ?        ?    98.3323  33.2031          ?        ?       96.2       17.9       ?       ? 
1 1 1   41   29    8 o    244.9    8.9    0.0000   0.0000          ?        ?   604.6799  43.4195          ?        ?      244.9        8.9       ?       ? 
1 1 1   41   29    9 o    129.4    5.4    0.0000   0.0000          ?        ?   167.9312  14.0475          ?        ?      129.4        5.4       ?       ? 
1 1 1   41   29   10 o    129.5    6.7    0.0000   0.0000          ?        ?   168.5697  17.2401          ?        ?      129.5        6.7       ?       ? 
1 1 1   41   29   11 o    112.0    8.8    0.0000   0.0000          ?        ?   126.4273  19.7942          ?        ?      112.0        8.8       ?       ? 
1 1 1   41   29   12 o     61.0   15.6    0.0000   0.0000          ?        ?    39.5883  19.1556          ?        ?       61.0       15.6       ?       ? 
1 1 1   41   29   13 o    191.2    6.0    0.0000   0.0000          ?        ?   367.1499  22.9868          ?        ?      191.2        6.0       ?       ? 
1 1 1   41   29   14 o    134.8    8.8    0.0000   0.0000          ?        ?   183.2557  23.6253          ?        ?      134.8        8.8       ?       ? 
1 1 1   41   29   15 f     45.3   17.4    0.0000   0.0000          ?        ?    14.6860  22.3483          ?        ?       45.3       17.4       ?       ? 
1 1 1   41   29   16 o    175.5    3.3    0.0000   0.0000          ?        ?   308.4059  11.4934          ?        ?      175.5        3.3       ?       ? 
1 1 1   41   29   17 o    212.5    3.2    0.0000   0.0000          ?        ?   452.0733  13.4090          ?        ?      212.5        3.2       ?       ? 
1 1 1   41   29   18 o    169.2    3.8    0.0000   0.0000          ?        ?   286.6962  12.7704          ?        ?      169.2        3.8       ?       ? 
1 1 1   41   29   19 o     32.2   13.0    0.0000   0.0000          ?        ?     5.1082  12.7704          ?        ?       32.2       13.0       ?       ? 
1 1 1   41   29   20 o    211.1    3.5    0.0000   0.0000          ?        ?   446.3266  14.6860          ?        ?      211.1        3.5       ?       ? 
1 1 1   41   29   21 o     52.0   12.9    0.0000   0.0000          ?        ?    28.7335  13.4090          ?        ?       52.0       12.9       ?       ? 
1 1 1   41   29   22 o     52.0   13.4    0.0000   0.0000          ?        ?    28.7335  14.0475          ?        ?       52.0       13.4       ?       ? 
1 1 1   41   29   23 o    138.4    5.3    0.0000   0.0000          ?        ?   192.1950  14.6860          ?        ?      138.4        5.3       ?       ? 
1 1 1   41   29   24 o    168.4    3.4    0.0000   0.0000          ?        ?   284.1421  11.4934          ?        ?      168.4        3.4       ?       ? 
1 1 1   41   29   25 o     70.2    8.2    0.0000   0.0000          ?        ?    49.8047  11.4934          ?        ?       70.2        8.2       ?       ? 
1 1 1   41   29   26 o    176.5    3.6    0.0000   0.0000          ?        ?   312.2371  12.7704          ?        ?      176.5        3.6       ?       ? 
1 1 1   41   29   27 o     50.8   12.1    0.0000   0.0000          ?        ?    27.4564  12.1319          ?        ?       50.8       12.1       ?       ? 
1 1 1   41   29   28 o    248.0    3.1    0.0000   0.0000          ?        ?   616.1733  15.3245          ?        ?      248.0        3.1       ?       ? 
1 1 1   41   29   29 o     86.3    7.8    0.0000   0.0000          ?        ?    75.3456  13.4090          ?        ?       86.3        7.8       ?       ? 
1 1 1   41   29   30 o    124.5    5.4    0.0000   0.0000          ?        ?   155.7993  13.4090          ?        ?      124.5        5.4       ?       ? 
1 1 1   41   29   31 o     17.6    8.8    0.0000   0.0000          ?        ?   -38.3113  13.4090          ?        ?       17.6        8.8       ?       ? 
1 1 1   41   29   32 o     83.6    8.4    0.0000   0.0000          ?        ?    70.8759  14.0475          ?        ?       83.6        8.4       ?       ? 
1 1 1   41   29   33 o     84.3    8.3    0.0000   0.0000          ?        ?    72.1529  14.0475          ?        ?       84.3        8.3       ?       ? 
1 1 1   41   30    0 o     30.9   21.8  -44.6965  49.1662   -44.6965  49.1662   -44.6965  49.1662       30.9     21.8       30.9       21.8     0.0     0.0 
1 1 1   41   30    1 o    144.5   11.7    0.0000   0.0000          ?        ?   211.9892  33.8416          ?        ?      144.5       11.7       ?       ? 
1 1 1   41   30    2 o    252.5    7.0    0.0000   0.0000          ?        ?   641.0757  35.1187          ?        ?      252.5        7.0       ?       ? 
1 1 1   41   30    3 o     86.5   22.1    0.0000   0.0000          ?        ?    81.7308  38.3113          ?        ?       86.5       22.1       ?       ? 
1 1 1   41   30    4 o     36.1   17.4    0.0000   0.0000          ?        ?   -52.9973  37.0343          ?        ?       36.1       17.4       ?       ? 
1 1 1   41   30    5 o     36.6   18.0    0.0000   0.0000          ?        ?   -93.8627  46.6121          ?        ?       36.6       18.0       ?       ? 
1 1 1   41   30    6 o    182.0    9.6    0.0000   0.0000          ?        ?   334.5853  35.1187          ?        ?      182.0        9.6       ?       ? 
1 1 1   41   30    7 o    137.7   15.8    0.0000   0.0000          ?        ?   194.7491  43.4195          ?        ?      137.7       15.8       ?       ? 
1 1 1   41   30    8 f    125.7   17.5    0.0000   0.0000          ?        ?   163.4615  44.0580          ?        ?      125.7       17.5       ?       ? 
1 1 1   41   30    9 o    102.5   33.9    0.0000   0.0000          ?        ?   118.1265  81.0922          ?        ?      102.5       33.9       ?       ? 
1 1 1   41   30   10 o    196.6   10.4    0.0000   0.0000          ?        ?   391.4138  40.8654          ?        ?      196.6       10.4       ?       ? 
1 1 1   41   30   11 f    100.8    7.0    0.0000   0.0000          ?        ?   102.1635  14.0475          ?        ?      100.8        7.0       ?       ? 
1 1 1   41   30   12 o     35.2   14.4    0.0000   0.0000          ?        ?     5.1082  15.9630          ?        ?       35.2       14.4       ?       ? 
1 1 1   41   30   13 f     31.5   14.4    0.0000   0.0000          ?        ?   -13.4090  20.4327          ?        ?       31.5       14.4       ?       ? 
1 1 1   41   30   14 o    208.1    4.8    0.0000   0.0000          ?        ?   434.1947  19.7942          ?        ?      208.1        4.8       ?       ? 
1 1 1   41   30   15 f    434.7    5.0    0.0000   0.0000          ?        ?  1895.7706  43.4195          ?        ?      434.7        5.0       ?       ? 
1 1 1   41   30   16 o     93.6   12.6    0.0000   0.0000          ?        ?    89.3930  23.6253          ?        ?       93.6       12.6       ?       ? 
1 1 1   41   30   17 f    107.7    4.4    0.0000   0.0000          ?        ?   116.2109   9.5778          ?        ?      107.7        4.4       ?       ? 
1 1 1   41   30   18 o    405.9    3.0    0.0000   0.0000          ?        ?  1649.3013  24.2638          ?        ?      405.9        3.0       ?       ? 
1 1 1   41   30   19 o     70.7    8.6    0.0000   0.0000          ?        ?    50.4432  12.1319          ?        ?       70.7        8.6       ?       ? 
1 1 1   41   30   20 o    238.5    3.3    0.0000   0.0000          ?        ?   569.5613  15.9630          ?        ?      238.5        3.3       ?       ? 
1 1 1   41   30   21 o    200.2    3.7    0.0000   0.0000          ?        ?   401.6301  14.6860          ?        ?      200.2        3.7       ?       ? 
1 1 1   41   30   22 o    226.4    3.2    0.0000   0.0000          ?        ?   513.3714  14.6860          ?        ?      226.4        3.2       ?       ? 
1 1 1   41   30   23 o    149.0    4.9    0.0000   0.0000          ?        ?   222.8441  14.6860          ?        ?      149.0        4.9       ?       ? 
1 1 1   41   30   24 o    204.4    2.8    0.0000   0.0000          ?        ?   418.2317  11.4934          ?        ?      204.4        2.8       ?       ? 
1 1 1   41   30   25 o    227.4    2.8    0.0000   0.0000          ?        ?   517.8410  12.7704          ?        ?      227.4        2.8       ?       ? 
1 1 1   41   30   26 o    249.6    2.8    0.0000   0.0000          ?        ?   623.8356  14.0475          ?        ?      249.6        2.8       ?       ? 
1 1 1   41   30   27 o     25.0   11.3    0.0000   0.0000          ?        ?    -6.3852  12.1319          ?        ?       25.0       11.3       ?       ? 
1 1 1   41   30   28 o    109.8    5.5    0.0000   0.0000          ?        ?   121.3191  12.1319          ?        ?      109.8        5.5       ?       ? 
1 1 1   41   30   29 o    142.9    4.2    0.0000   0.0000          ?        ?   204.9654  12.1319          ?        ?      142.9        4.2       ?       ? 
1 1 1   41   30   30 o     35.1   13.3    0.0000   0.0000          ?        ?     9.5778  12.7704          ?        ?       35.1       13.3       ?       ? 
1 1 1   41   31    0 o    643.1   10.5 4165.7153 134.7281  4165.7153 134.7281  4165.7153 134.7281      643.1     10.5      643.1       10.5     0.0     0.0 
1 1 1   41   31    1 o    307.7    6.8    0.0000   0.0000          ?        ?   952.0358  42.1424          ?        ?      307.7        6.8       ?       ? 
1 1 1   41   31    2 o    447.6    8.8    0.0000   0.0000          ?        ?  2022.1981  78.5382          ?        ?      447.6        8.8       ?       ? 
1 1 1   41   31    3 o    236.5   10.3    0.0000   0.0000          ?        ?   566.3687  48.5276          ?        ?      236.5       10.3       ?       ? 
1 1 1   41   31    4 o    511.5    7.4    0.0000   0.0000          ?        ?  2633.2632  75.9841          ?        ?      511.5        7.4       ?       ? 
1 1 1   41   31    5 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   31    6 o    107.1   23.3    0.0000   0.0000          ?        ?   126.4273  48.5276          ?        ?      107.1       23.3       ?       ? 
1 1 1   41   31    7 o    177.2   15.5    0.0000   0.0000          ?        ?   323.0919  54.9129          ?        ?      177.2       15.5       ?       ? 
1 1 1   41   31    8 o    426.1    8.2    0.0000   0.0000          ?        ?  1830.6416  69.5989          ?        ?      426.1        8.2       ?       ? 
1 1 1   41   31    9 o    198.3   10.3    0.0000   0.0000          ?        ?   398.4375  40.8654          ?        ?      198.3       10.3       ?       ? 
1 1 1   41   31   10 o    198.6   16.1    0.0000   0.0000          ?        ?   407.3768  63.8522          ?        ?      198.6       16.1       ?       ? 
1 1 1   41   31   11 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   31   12 f    137.7    5.6    0.0000   0.0000          ?        ?   190.2794  15.3245          ?        ?      137.7        5.6       ?       ? 
1 1 1   41   31   13 o    382.3    4.3    0.0000   0.0000          ?        ?  1464.7686  32.5646          ?        ?      382.3        4.3       ?       ? 
1 1 1   41   31   14 o    298.8    4.8    0.0000   0.0000          ?        ?   895.8459  28.7335          ?        ?      298.8        4.8       ?       ? 
1 1 1   41   31   15 o    189.3    6.1    0.0000   0.0000          ?        ?   360.1262  22.9868          ?        ?      189.3        6.1       ?       ? 
1 1 1   41   31   16 o     77.6   14.5    0.0000   0.0000          ?        ?    63.8522  21.7097          ?        ?       77.6       14.5       ?       ? 
1 1 1   41   31   17 o     84.8    9.4    0.0000   0.0000          ?        ?    72.7915  15.9630          ?        ?       84.8        9.4       ?       ? 
1 1 1   41   31   18 o    136.0    5.9    0.0000   0.0000          ?        ?   185.8098  15.9630          ?        ?      136.0        5.9       ?       ? 
1 1 1   41   31   19 o    114.7    5.0    0.0000   0.0000          ?        ?   132.1740  11.4934          ?        ?      114.7        5.0       ?       ? 
1 1 1   41   31   20 o     76.7    7.9    0.0000   0.0000          ?        ?    59.3825  12.1319          ?        ?       76.7        7.9       ?       ? 
1 1 1   41   31   21 o     33.0   13.1    0.0000   0.0000          ?        ?     6.3852  12.7704          ?        ?       33.0       13.1       ?       ? 
1 1 1   41   31   22 o    150.7    4.4    0.0000   0.0000          ?        ?   227.9522  13.4090          ?        ?      150.7        4.4       ?       ? 
1 1 1   41   31   23 o     81.7    8.6    0.0000   0.0000          ?        ?    67.6833  14.0475          ?        ?       81.7        8.6       ?       ? 
1 1 1   41   31   24 o    122.7    5.7    0.0000   0.0000          ?        ?   151.3296  14.0475          ?        ?      122.7        5.7       ?       ? 
1 1 1   41   31   25 o     25.6   11.0    0.0000   0.0000          ?        ?    -0.6385  10.2163          ?        ?       25.6       11.0       ?       ? 
1 1 1   41   31   26 f     72.4    7.9    0.0000   0.0000          ?        ?    52.9973  11.4934          ?        ?       72.4        7.9       ?       ? 
1 1 1   41   31   27 o    113.8    5.0    0.0000   0.0000          ?        ?   130.2584  11.4934          ?        ?      113.8        5.0       ?       ? 
1 1 1   41   31   28 o     79.0    7.7    0.0000   0.0000          ?        ?    63.2136  12.1319          ?        ?       79.0        7.7       ?       ? 
1 1 1   41   32    0 o    207.8   17.9  450.1577  73.4300   450.1577  73.4300   450.1577  73.4300      207.8     17.9      207.8       17.9     0.0     0.0 
1 1 1   41   32    1 o    296.1    9.1    0.0000   0.0000          ?        ?   886.2681  53.6358          ?        ?      296.1        9.1       ?       ? 
1 1 1   41   32    2 o    108.9   31.0    0.0000   0.0000          ?        ?   137.9207  70.8759          ?        ?      108.9       31.0       ?       ? 
1 1 1   41   32    3 o    109.6   24.5    0.0000   0.0000          ?        ?   134.0895  52.3588          ?        ?      109.6       24.5       ?       ? 
1 1 1   41   32    4 f    164.3   16.9    0.0000   0.0000          ?        ?   280.3110  55.5514          ?        ?      164.3       16.9       ?       ? 
1 1 1   41   32    5 o     79.1   24.7    0.0000   0.0000          ?        ?    68.3218  43.4195          ?        ?       79.1       24.7       ?       ? 
1 1 1   41   32    6 o    200.1   10.2    0.0000   0.0000          ?        ?   406.0997  40.8654          ?        ?      200.1       10.2       ?       ? 
1 1 1   41   32    7 o    160.0   15.4    0.0000   0.0000          ?        ?   264.3480  49.1662          ?        ?      160.0       15.4       ?       ? 
1 1 1   41   32    8 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   32    9 o    248.9   17.4    0.0000   0.0000          ?        ?   645.5453  86.8389          ?        ?      248.9       17.4       ?       ? 
1 1 1   41   32   10 o    324.5   10.2    0.0000   0.0000          ?        ?  1068.8851  66.4062          ?        ?      324.5       10.2       ?       ? 
1 1 1   41   32   11 o     83.6   24.4    0.0000   0.0000          ?        ?    77.8996  43.4195          ?        ?       83.6       24.4       ?       ? 
1 1 1   41   32   12 o     66.4   27.0    0.0000   0.0000          ?        ?    28.0950  56.1899          ?        ?       66.4       27.0       ?       ? 
1 1 1   41   32   13 o    167.1    4.8    0.0000   0.0000          ?        ?   280.3110  15.9630          ?        ?      167.1        4.8       ?       ? 
1 1 1   41   32   14 o    215.3    5.2    0.0000   0.0000          ?        ?   465.4823  22.3483          ?        ?      215.3        5.2       ?       ? 
1 1 1   41   32   15 o     43.2   17.4    0.0000   0.0000          ?        ?    10.2163  22.9868          ?        ?       43.2       17.4       ?       ? 
1 1 1   41   32   16 o     84.6   12.8    0.0000   0.0000          ?        ?    73.4300  21.7097          ?        ?       84.6       12.8       ?       ? 
1 1 1   41   32   17 o     64.0   14.8    0.0000   0.0000          ?        ?    44.0580  18.5171          ?        ?       64.0       14.8       ?       ? 
1 1 1   41   32   18 o     47.8   13.0    0.0000   0.0000          ?        ?    24.2638  12.7704          ?        ?       47.8       13.0       ?       ? 
1 1 1   41   32   19 o     95.0    8.4    0.0000   0.0000          ?        ?    91.3086  15.9630          ?        ?       95.0        8.4       ?       ? 
1 1 1   41   32   20 o    153.1    3.5    0.0000   0.0000          ?        ?   234.9760  10.8549          ?        ?      153.1        3.5       ?       ? 
1 1 1   41   32   21 o    286.6    2.9    0.0000   0.0000          ?        ?   822.4159  16.6016          ?        ?      286.6        2.9       ?       ? 
1 1 1   41   32   22 o    144.9    4.4    0.0000   0.0000          ?        ?   210.7121  12.7704          ?        ?      144.9        4.4       ?       ? 
1 1 1   41   32   23 o    105.6    6.0    0.0000   0.0000          ?        ?   112.3798  12.7704          ?        ?      105.6        6.0       ?       ? 
1 1 1   41   32   24 o     74.3    9.0    0.0000   0.0000          ?        ?    56.1899  13.4090          ?        ?       74.3        9.0       ?       ? 
1 1 1   41   32   25 o    107.9    4.4    0.0000   0.0000          ?        ?   116.8494   9.5778          ?        ?      107.9        4.4       ?       ? 
1 1 1   41   33    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   33    1 o    123.8   24.3    0.0000   0.0000          ?        ?   171.1238  58.1055          ?        ?      123.8       24.3       ?       ? 
1 1 1   41   33    2 o    135.3   13.9    0.0000   0.0000          ?        ?   188.3639  37.6728          ?        ?      135.3       13.9       ?       ? 
1 1 1   41   33    3 o     58.9   24.4    0.0000   0.0000          ?        ?    15.9630  47.2506          ?        ?       58.9       24.4       ?       ? 
1 1 1   41   33    4 f    211.3   13.6    0.0000   0.0000          ?        ?   459.0970  57.4669          ?        ?      211.3       13.6       ?       ? 
1 1 1   41   33    5 o    210.3   19.9    0.0000   0.0000          ?        ?   468.6749  83.6463          ?        ?      210.3       19.9       ?       ? 
1 1 1   41   33    6 f    205.6   13.2    0.0000   0.0000          ?        ?   434.1947  54.2743          ?        ?      205.6       13.2       ?       ? 
1 1 1   41   33    7 o    134.3   19.5    0.0000   0.0000          ?        ?   190.9180  52.3588          ?        ?      134.3       19.5       ?       ? 
1 1 1   41   33    8 o    175.3   15.7    0.0000   0.0000          ?        ?   319.2608  54.9129          ?        ?      175.3       15.7       ?       ? 
1 1 1   41   33    9 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   33   10 o     91.2   30.6    0.0000   0.0000          ?        ?    95.1397  65.7677          ?        ?       91.2       30.6       ?       ? 
1 1 1   41   33   11 o     75.8   25.6    0.0000   0.0000          ?        ?    61.9366  45.9736          ?        ?       75.8       25.6       ?       ? 
1 1 1   41   33   12 f    233.4   19.3    0.0000   0.0000          ?        ?   578.5006  90.0316          ?        ?      233.4       19.3       ?       ? 
1 1 1   41   33   13 o    166.7   23.7    0.0000   0.0000          ?        ?   304.5748  79.1767          ?        ?      166.7       23.7       ?       ? 
1 1 1   41   33   14 o    150.6    7.8    0.0000   0.0000          ?        ?   229.2293  23.6253          ?        ?      150.6        7.8       ?       ? 
1 1 1   41   33   15 o    258.6    4.3    0.0000   0.0000          ?        ?   671.0862  22.3483          ?        ?      258.6        4.3       ?       ? 
1 1 1   41   33   16 o     60.4   16.8    0.0000   0.0000          ?        ?    39.5883  21.0712          ?        ?       60.4       16.8       ?       ? 
1 1 1   41   33   17 o    135.5    8.2    0.0000   0.0000          ?        ?   185.8098  22.3483          ?        ?      135.5        8.2       ?       ? 
1 1 1   41   33   18 o    102.0    5.6    0.0000   0.0000          ?        ?   104.7175  11.4934          ?        ?      102.0        5.6       ?       ? 
1 1 1   41   33   19 o    124.9    5.6    0.0000   0.0000          ?        ?   157.0763  14.0475          ?        ?      124.9        5.6       ?       ? 
1 1 1   41   33   20 o     91.7    7.3    0.0000   0.0000          ?        ?    84.9234  13.4090          ?        ?       91.7        7.3       ?       ? 
1 1 1   41   33   21 o    179.8    4.3    0.0000   0.0000          ?        ?   324.3690  15.3245          ?        ?      179.8        4.3       ?       ? 
1 1 1   41   34    0 o    249.4   18.4  649.3765  90.6701   649.3765  90.6701   649.3765  90.6701      249.4     18.4      249.4       18.4     0.0     0.0 
1 1 1   41   34    1 o     58.8   27.3    0.0000   0.0000          ?        ?   -46.6121  77.8996          ?        ?       58.8       27.3       ?       ? 
1 1 1   41   34    2 o    144.4   31.8    0.0000   0.0000          ?        ?   250.9390  89.3930          ?        ?      144.4       31.8       ?       ? 
1 1 1   41   34    3 o    264.1   16.0    0.0000   0.0000          ?        ?   727.9147  84.2849          ?        ?      264.1       16.0       ?       ? 
1 1 1   41   34    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   34    5 f    134.2   27.1    0.0000   0.0000          ?        ?   208.1580  70.2374          ?        ?      134.2       27.1       ?       ? 
1 1 1   41   34    6 o    148.7   16.1    0.0000   0.0000          ?        ?   231.1448  47.8891          ?        ?      148.7       16.1       ?       ? 
1 1 1   41   34    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   34    8 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   34    9 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   34   10 o    244.6   10.8    0.0000   0.0000          ?        ?   611.0652  52.9973          ?        ?      244.6       10.8       ?       ? 
1 1 1   41   34   11 o    296.6   11.6    0.0000   0.0000          ?        ?   902.2311  68.9603          ?        ?      296.6       11.6       ?       ? 
1 1 1   41   34   12 o    143.6   28.6    0.0000   0.0000          ?        ?   243.2767  79.1767          ?        ?      143.6       28.6       ?       ? 
1 1 1   41   34   13 o    213.0   21.1    0.0000   0.0000          ?        ?   492.9387  90.0316          ?        ?      213.0       21.1       ?       ? 
1 1 1   41   34   14 o     75.3   30.5    0.0000   0.0000          ?        ?    47.8891  71.5144          ?        ?       75.3       30.5       ?       ? 
1 1 1   41   34   15 o     46.7   14.0    0.0000   0.0000          ?        ?    22.9868  14.0475          ?        ?       46.7       14.0       ?       ? 
1 1 1   41   34   16 o     47.3   15.4    0.0000   0.0000          ?        ?    22.9868  16.6016          ?        ?       47.3       15.4       ?       ? 
1 1 1   41   34   17 o     28.5   13.3    0.0000   0.0000          ?        ?   -15.9630  18.5171          ?        ?       28.5       13.3       ?       ? 
1 1 1   41   35    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   35    1 o    103.3   31.5    0.0000   0.0000          ?        ?   131.5355  70.8759          ?        ?      103.3       31.5       ?       ? 
1 1 1   41   35    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   35    3 f    210.5   19.0    0.0000   0.0000          ?        ?   474.4216  79.8152          ?        ?      210.5       19.0       ?       ? 
1 1 1   41   35    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   35    5 o    321.2   14.5    0.0000   0.0000          ?        ?  1074.6320  93.2242          ?        ?      321.2       14.5       ?       ? 
1 1 1   41   35    6 o    168.6   16.7    0.0000   0.0000          ?        ?   300.1052  56.1899          ?        ?      168.6       16.7       ?       ? 
1 1 1   41   35    7 o    125.3   33.7    0.0000   0.0000          ?        ?   199.8573  86.2004          ?        ?      125.3       33.7       ?       ? 
1 1 1   41   35    8 o     95.8   33.7    0.0000   0.0000          ?        ?   113.0183  80.4537          ?        ?       95.8       33.7       ?       ? 
1 1 1   41   35    9 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   35   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   41   35   11 o    244.9   11.9    0.0000   0.0000          ?        ?   618.0889  58.1055          ?        ?      244.9       11.9       ?       ? 
1 1 1   42    0    0 o    312.1    5.4  975.0225  33.8416   975.0225  33.8416   975.0225  33.8416      312.1      5.4      312.1        5.4     0.0     0.0 
1 1 1   42    0    1 o   1068.9    5.5 11428.8984 116.8494 11428.8984 116.8494 11428.8984 116.8494     1068.9      5.5     1068.9        5.5     0.0     0.0 
1 1 1   42    0    2 o    296.4    4.3  879.2443  25.5409   879.2443  25.5409   879.2443  25.5409      296.4      4.3      296.4        4.3     0.0     0.0 
1 1 1   42    0    3 f   1741.9    8.3 30355.9570 289.2503 30355.9570 289.2503 30355.9570 289.2503     1741.9      8.3     1741.9        8.3     0.0     0.0 
1 1 1   42    0    4 o    328.2    4.1 1077.8246  26.8179  1077.8246  26.8179  1077.8246  26.8179      328.2      4.1      328.2        4.1     0.0     0.0 
1 1 1   42    0    5 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    0    6 o     35.6   18.6   18.5171  17.2401    18.5171  17.2401    18.5171  17.2401       35.6     18.6       35.6       18.6     0.0     0.0 
1 1 1   42    0    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    0    8 o    243.1    4.9  591.9095  23.6253   591.9095  23.6253   591.9095  23.6253      243.1      4.9      243.1        4.9     0.0     0.0 
1 1 1   42    0    9 o   1246.1    6.4 15533.9541 159.6304 15533.9541 159.6304 15533.9541 159.6304     1246.1      6.4     1246.1        6.4     0.0     0.0 
1 1 1   42    0   10 o    404.8    3.5 1639.0851  28.7335  1639.0851  28.7335  1639.0851  28.7335      404.8      3.5      404.8        3.5     0.0     0.0 
1 1 1   42    0   11 o    179.9    4.6  324.3690  16.6016   324.3690  16.6016   324.3690  16.6016      179.9      4.6      179.9        4.6     0.0     0.0 
1 1 1   42    0   12 o    448.8    3.4 2014.5358  30.6490  2014.5358  30.6490  2014.5358  30.6490      448.8      3.4      448.8        3.4     0.0     0.0 
1 1 1   42    0   13 o    197.3    4.5  390.1367  17.8786   390.1367  17.8786   390.1367  17.8786      197.3      4.5      197.3        4.5     0.0     0.0 
1 1 1   42    0   14 o    565.0    4.0 3192.6082  44.6965  3192.6082  44.6965  3192.6082  44.6965      565.0      4.0      565.0        4.0     0.0     0.0 
1 1 1   42    0   15 o    583.0    4.0 3400.1277  46.6121  3400.1277  46.6121  3400.1277  46.6121      583.0      4.0      583.0        4.0     0.0     0.0 
1 1 1   42    0   16 o    413.8    3.4 1712.5151  28.0950  1712.5151  28.0950  1712.5151  28.0950      413.8      3.4      413.8        3.4     0.0     0.0 
1 1 1   42    0   17 o    615.8    3.9 3792.8184  48.5276  3792.8184  48.5276  3792.8184  48.5276      615.8      3.9      615.8        3.9     0.0     0.0 
1 1 1   42    0   18 o    105.1    9.3  113.0183  19.1556   113.0183  19.1556   113.0183  19.1556      105.1      9.3      105.1        9.3     0.0     0.0 
1 1 1   42    0   19 o    649.5    4.1 4219.3506  52.9973  4219.3506  52.9973  4219.3506  52.9973      649.5      4.1      649.5        4.1     0.0     0.0 
1 1 1   42    0   20 o   1029.1    5.3 10594.3506 109.1872 10594.3506 109.1872 10594.3506 109.1872     1029.1      5.3     1029.1        5.3     0.0     0.0 
1 1 1   42    0   21 o    222.3    4.6  494.8542  20.4327   494.8542  20.4327   494.8542  20.4327      222.3      4.6      222.3        4.6     0.0     0.0 
1 1 1   42    0   22 o    797.4    4.6 6360.9526  73.4300  6360.9526  73.4300  6360.9526  73.4300      797.4      4.6      797.4        4.6     0.0     0.0 
1 1 1   42    0   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    0   24 o     31.4   18.7   10.8549  20.4327    10.8549  20.4327    10.8549  20.4327       31.4     18.7       31.4       18.7     0.0     0.0 
1 1 1   42    0   25 o    516.0    3.6 2663.2737  37.0343  2663.2737  37.0343  2663.2737  37.0343      516.0      3.6      516.0        3.6     0.0     0.0 
1 1 1   42    0   26 f    403.2    3.5 1626.3146  28.0950  1626.3146  28.0950  1626.3146  28.0950      403.2      3.5      403.2        3.5     0.0     0.0 
1 1 1   42    0   27 o    436.4    3.5 1905.3485  30.6490  1905.3485  30.6490  1905.3485  30.6490      436.4      3.5      436.4        3.5     0.0     0.0 
1 1 1   42    0   28 o    666.8    4.1 4447.3032  54.2743  4447.3032  54.2743  4447.3032  54.2743      666.8      4.1      666.8        4.1     0.0     0.0 
1 1 1   42    0   29 o    215.5    5.2  465.4823  22.3483   465.4823  22.3483   465.4823  22.3483      215.5      5.2      215.5        5.2     0.0     0.0 
1 1 1   42    0   30 o    134.7    7.4  183.2557  19.7942   183.2557  19.7942   183.2557  19.7942      134.7      7.4      134.7        7.4     0.0     0.0 
1 1 1   42    0   31 f    229.1    4.6  525.5033  21.0712   525.5033  21.0712   525.5033  21.0712      229.1      4.6      229.1        4.6     0.0     0.0 
1 1 1   42    0   32 o     64.6   17.2   49.8047  19.1556    49.8047  19.1556    49.8047  19.1556       64.6     17.2       64.6       17.2     0.0     0.0 
1 1 1   42    0   33 o     53.8   19.9   38.9498  19.7942    38.9498  19.7942    38.9498  19.7942       53.8     19.9       53.8       19.9     0.0     0.0 
1 1 1   42    0   34 o     66.2   18.4   52.9973  21.0712    52.9973  21.0712    52.9973  21.0712       66.2     18.4       66.2       18.4     0.0     0.0 
1 1 1   42    0   35 o    380.5    3.6 1448.1671  27.4564  1448.1671  27.4564  1448.1671  27.4564      380.5      3.6      380.5        3.6     0.0     0.0 
1 1 1   42    0   36 o     14.3   10.6  -68.3218  22.3483   -68.3218  22.3483   -68.3218  22.3483       14.3     10.6       14.3       10.6     0.0     0.0 
1 1 1   42    0   37 o    290.7    4.3  846.0411  24.9023   846.0411  24.9023   846.0411  24.9023      290.7      4.3      290.7        4.3     0.0     0.0 
1 1 1   42    0   38 o    484.8    3.9 2351.0366  37.6728  2351.0366  37.6728  2351.0366  37.6728      484.8      3.9      484.8        3.9     0.0     0.0 
1 1 1   42    0   39 o    137.0    8.7  190.2794  23.6253   190.2794  23.6253   190.2794  23.6253      137.0      8.7      137.0        8.7     0.0     0.0 
1 1 1   42    0   40 o    662.9    3.9 4396.2212  52.3588  4396.2212  52.3588  4396.2212  52.3588      662.9      3.9      662.9        3.9     0.0     0.0 
1 1 1   42    0   41 o    333.8    3.8 1114.8588  25.5409  1114.8588  25.5409  1114.8588  25.5409      333.8      3.8      333.8        3.8     0.0     0.0 
1 1 1   42    0   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    0   43 o    356.0    3.9 1268.1040  27.4564  1268.1040  27.4564  1268.1040  27.4564      356.0      3.9      356.0        3.9     0.0     0.0 
1 1 1   42    0   44 o    225.5    5.1  509.5403  22.9868   509.5403  22.9868   509.5403  22.9868      225.5      5.1      225.5        5.1     0.0     0.0 
1 1 1   42    0   45 o     16.6   12.2  -45.9736  22.3483   -45.9736  22.3483   -45.9736  22.3483       16.6     12.2       16.6       12.2     0.0     0.0 
1 1 1   42    0   46 o     14.6   10.9  -68.9603  22.9868   -68.9603  22.9868   -68.9603  22.9868       14.6     10.9       14.6       10.9     0.0     0.0 
1 1 1   42    0   47 o    503.0    3.7 2531.0996  37.0343  2531.0996  37.0343  2531.0996  37.0343      503.0      3.7      503.0        3.7     0.0     0.0 
1 1 1   42    0   48 o     14.4   10.7  -71.5144  22.9868   -71.5144  22.9868   -71.5144  22.9868       14.4     10.7       14.4       10.7     0.0     0.0 
1 1 1   42    0   49 o     61.5   21.3   49.8047  23.6253    49.8047  23.6253    49.8047  23.6253       61.5     21.3       61.5       21.3     0.0     0.0 
1 1 1   42    0   50 o    125.9   10.3  162.1845  25.5409   162.1845  25.5409   162.1845  25.5409      125.9     10.3      125.9       10.3     0.0     0.0 
1 1 1   42    0   51 o    285.6    4.9  817.3077  28.0950   817.3077  28.0950   817.3077  28.0950      285.6      4.9      285.6        4.9     0.0     0.0 
1 1 1   42    0   52 o    159.0    8.1  255.4086  25.5409   255.4086  25.5409   255.4086  25.5409      159.0      8.1      159.0        8.1     0.0     0.0 
1 1 1   42    0   53 o    113.4   10.9  132.8125  24.2638   132.8125  24.2638   132.8125  24.2638      113.4     10.9      113.4       10.9     0.0     0.0 
1 1 1   42    0   54 o    501.1    4.0 2513.2212  39.5883  2513.2212  39.5883  2513.2212  39.5883      501.1      4.0      501.1        4.0     0.0     0.0 
1 1 1   42    0   55 o    324.9    5.0 1057.3918  32.5646  1057.3918  32.5646  1057.3918  32.5646      324.9      5.0      324.9        5.0     0.0     0.0 
1 1 1   42    0   56 o    398.5    4.3 1589.9188  34.4802  1589.9188  34.4802  1589.9188  34.4802      398.5      4.3      398.5        4.3     0.0     0.0 
1 1 1   42    0   57 o    173.7    7.8  304.5748  26.8179   304.5748  26.8179   304.5748  26.8179      173.7      7.8      173.7        7.8     0.0     0.0 
1 1 1   42    0   58 o    180.1    8.2  327.5616  29.3720   327.5616  29.3720   327.5616  29.3720      180.1      8.2      180.1        8.2     0.0     0.0 
1 1 1   42    0   59 o     93.6   15.4   94.5012  26.8179    94.5012  26.8179    94.5012  26.8179       93.6     15.4       93.6       15.4     0.0     0.0 
1 1 1   42    0   60 o     92.2   17.3   94.5012  28.7335    94.5012  28.7335    94.5012  28.7335       92.2     17.3       92.2       17.3     0.0     0.0 
1 1 1   42    0   61 o    222.4    6.2  497.4084  27.4564   497.4084  27.4564   497.4084  27.4564      222.4      6.2      222.4        6.2     0.0     0.0 
1 1 1   42    0   62 o     17.0   12.5  -58.7440  25.5409   -58.7440  25.5409   -58.7440  25.5409       17.0     12.5       17.0       12.5     0.0     0.0 
1 1 1   42    0   63 o    135.2   10.3  187.7254  27.4564   187.7254  27.4564   187.7254  27.4564      135.2     10.3      135.2       10.3     0.0     0.0 
1 1 1   42    0   64 o     21.8   15.6  -33.8416  28.0950   -33.8416  28.0950   -33.8416  28.0950       21.8     15.6       21.8       15.6     0.0     0.0 
1 1 1   42    1    0 o   1152.4    5.9 13284.4424 135.3666 13284.4424 135.3666 13284.4424 135.3666     1152.4      5.9     1152.4        5.9     0.0     0.0 
1 1 1   42    1    1 o    344.1    2.8    0.0000   0.0000          ?        ?  1184.4576  19.1556          ?        ?      344.1        2.8       ?       ? 
1 1 1   42    1    2 o    620.4    2.8    0.0000   0.0000          ?        ?  3849.0083  34.4802          ?        ?      620.4        2.8       ?       ? 
1 1 1   42    1    3 o    728.5    3.2    0.0000   0.0000          ?        ?  5307.3916  46.6121          ?        ?      728.5        3.2       ?       ? 
1 1 1   42    1    4 o    931.0    3.6    0.0000   0.0000          ?        ?  8669.2080  66.4062          ?        ?      931.0        3.6       ?       ? 
1 1 1   42    1    5 o    532.5    2.6    0.0000   0.0000          ?        ?  2835.6746  28.0950          ?        ?      532.5        2.6       ?       ? 
1 1 1   42    1    6 o    490.2    2.5    0.0000   0.0000          ?        ?  2403.3953  24.9023          ?        ?      490.2        2.5       ?       ? 
1 1 1   42    1    7 o    485.5    2.7    0.0000   0.0000          ?        ?  2357.4219  26.1794          ?        ?      485.5        2.7       ?       ? 
1 1 1   42    1    8 o   1298.8    4.7    0.0000   0.0000          ?        ? 16874.2109 121.3191          ?        ?     1298.8        4.7       ?       ? 
1 1 1   42    1    9 o    207.0    3.2    0.0000   0.0000          ?        ?   428.4480  13.4090          ?        ?      207.0        3.2       ?       ? 
1 1 1   42    1   10 o    433.5    2.5    0.0000   0.0000          ?        ?  1879.8076  21.7097          ?        ?      433.5        2.5       ?       ? 
1 1 1   42    1   11 o    785.1    3.1    0.0000   0.0000          ?        ?  6164.2881  49.1662          ?        ?      785.1        3.1       ?       ? 
1 1 1   42    1   12 o    189.2    3.2    0.0000   0.0000          ?        ?   358.2106  12.1319          ?        ?      189.2        3.2       ?       ? 
1 1 1   42    1   13 o    737.7    3.0    0.0000   0.0000          ?        ?  5442.7583  44.6965          ?        ?      737.7        3.0       ?       ? 
1 1 1   42    1   14 o     16.2    8.1    0.0000   0.0000          ?        ?   -33.8416  11.4934          ?        ?       16.2        8.1       ?       ? 
1 1 1   42    1   15 o    408.3    2.4    0.0000   0.0000          ?        ?  1667.1801  19.7942          ?        ?      408.3        2.4       ?       ? 
1 1 1   42    1   16 o     51.9   11.9    0.0000   0.0000          ?        ?    28.0950  12.1319          ?        ?       51.9       11.9       ?       ? 
1 1 1   42    1   17 o    591.1    2.6    0.0000   0.0000          ?        ?  3494.6287  30.6490          ?        ?      591.1        2.6       ?       ? 
1 1 1   42    1   18 o    207.1    3.1    0.0000   0.0000          ?        ?   429.0865  12.7704          ?        ?      207.1        3.1       ?       ? 
1 1 1   42    1   19 f    930.5    3.4    0.0000   0.0000          ?        ?  8660.9072  63.8522          ?        ?      930.5        3.4       ?       ? 
1 1 1   42    1   20 o    647.7    2.9    0.0000   0.0000          ?        ?  4195.7256  37.6728          ?        ?      647.7        2.9       ?       ? 
1 1 1   42    1   21 o    353.9    2.3    0.0000   0.0000          ?        ?  1252.7794  16.6016          ?        ?      353.9        2.3       ?       ? 
1 1 1   42    1   22 o     42.0   13.5    0.0000   0.0000          ?        ?    17.2401  12.7704          ?        ?       42.0       13.5       ?       ? 
1 1 1   42    1   23 o    295.7    2.6    0.0000   0.0000          ?        ?   874.7747  15.3245          ?        ?      295.7        2.6       ?       ? 
1 1 1   42    1   24 o    489.6    2.4    0.0000   0.0000          ?        ?  2397.0103  23.6253          ?        ?      489.6        2.4       ?       ? 
1 1 1   42    1   25 o    308.2    2.7    0.0000   0.0000          ?        ?   950.1202  16.6016          ?        ?      308.2        2.7       ?       ? 
1 1 1   42    1   26 o    123.5    5.2    0.0000   0.0000          ?        ?   152.6067  12.7704          ?        ?      123.5        5.2       ?       ? 
1 1 1   42    1   27 o    298.2    2.8    0.0000   0.0000          ?        ?   889.4606  16.6016          ?        ?      298.2        2.8       ?       ? 
1 1 1   42    1   28 o    151.1    4.6    0.0000   0.0000          ?        ?   228.5907  14.0475          ?        ?      151.1        4.6       ?       ? 
1 1 1   42    1   29 o    479.5    2.5    0.0000   0.0000          ?        ?  2299.9551  23.6253          ?        ?      479.5        2.5       ?       ? 
1 1 1   42    1   30 o    229.6    3.5    0.0000   0.0000          ?        ?   527.4188  15.9630          ?        ?      229.6        3.5       ?       ? 
1 1 1   42    1   31 o    229.3    3.3    0.0000   0.0000          ?        ?   526.1418  15.3245          ?        ?      229.3        3.3       ?       ? 
1 1 1   42    1   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    1   33 o     17.3    8.7    0.0000   0.0000          ?        ?   -50.4432  14.6860          ?        ?       17.3        8.7       ?       ? 
1 1 1   42    1   34 o    155.1    4.7    0.0000   0.0000          ?        ?   240.7227  14.6860          ?        ?      155.1        4.7       ?       ? 
1 1 1   42    1   35 o    103.8    6.8    0.0000   0.0000          ?        ?   107.9102  14.0475          ?        ?      103.8        6.8       ?       ? 
1 1 1   42    1   36 o     48.6   14.2    0.0000   0.0000          ?        ?    24.2638  14.6860          ?        ?       48.6       14.2       ?       ? 
1 1 1   42    1   37 o    433.1    2.5    0.0000   0.0000          ?        ?  1875.9764  21.7097          ?        ?      433.1        2.5       ?       ? 
1 1 1   42    1   38 o    140.8    5.4    0.0000   0.0000          ?        ?   198.5802  15.3245          ?        ?      140.8        5.4       ?       ? 
1 1 1   42    1   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    1   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    1   41 o    262.3    3.3    0.0000   0.0000          ?        ?   688.3264  17.2401          ?        ?      262.3        3.3       ?       ? 
1 1 1   42    1   42 o    183.3    4.5    0.0000   0.0000          ?        ?   336.5009  16.6016          ?        ?      183.3        4.5       ?       ? 
1 1 1   42    1   43 o    160.5    5.0    0.0000   0.0000          ?        ?   257.9627  15.9630          ?        ?      160.5        5.0       ?       ? 
1 1 1   42    1   44 o     81.6   10.2    0.0000   0.0000          ?        ?    67.0448  16.6016          ?        ?       81.6       10.2       ?       ? 
1 1 1   42    1   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    1   46 o    286.1    3.2    0.0000   0.0000          ?        ?   819.2233  18.5171          ?        ?      286.1        3.2       ?       ? 
1 1 1   42    1   47 o    262.5    3.5    0.0000   0.0000          ?        ?   689.6033  18.5171          ?        ?      262.5        3.5       ?       ? 
1 1 1   42    1   48 o     21.5   10.7    0.0000   0.0000          ?        ?   -44.0580  17.8786          ?        ?       21.5       10.7       ?       ? 
1 1 1   42    1   49 o     20.2   10.1    0.0000   0.0000          ?        ?   -47.8891  17.2401          ?        ?       20.2       10.1       ?       ? 
1 1 1   42    1   50 o     24.2   11.7    0.0000   0.0000          ?        ?   -30.6490  17.8786          ?        ?       24.2       11.7       ?       ? 
1 1 1   42    1   51 o    264.5    3.5    0.0000   0.0000          ?        ?   700.4582  18.5171          ?        ?      264.5        3.5       ?       ? 
1 1 1   42    1   52 o    144.5    6.4    0.0000   0.0000          ?        ?   209.4351  18.5171          ?        ?      144.5        6.4       ?       ? 
1 1 1   42    1   53 o     20.3   10.2    0.0000   0.0000          ?        ?   -55.5514  18.5171          ?        ?       20.3       10.2       ?       ? 
1 1 1   42    1   54 o    211.6    4.7    0.0000   0.0000          ?        ?   448.8807  19.7942          ?        ?      211.6        4.7       ?       ? 
1 1 1   42    1   55 o     42.6   16.2    0.0000   0.0000          ?        ?    13.4090  19.1556          ?        ?       42.6       16.2       ?       ? 
1 1 1   42    1   56 o    252.1    3.8    0.0000   0.0000          ?        ?   636.6060  19.1556          ?        ?      252.1        3.8       ?       ? 
1 1 1   42    1   57 o    194.5    4.9    0.0000   0.0000          ?        ?   379.2819  19.1556          ?        ?      194.5        4.9       ?       ? 
1 1 1   42    1   58 o     57.9   15.6    0.0000   0.0000          ?        ?    35.7572  18.5171          ?        ?       57.9       15.6       ?       ? 
1 1 1   42    1   59 o    106.6    9.0    0.0000   0.0000          ?        ?   114.9339  19.1556          ?        ?      106.6        9.0       ?       ? 
1 1 1   42    1   60 o     83.7   11.4    0.0000   0.0000          ?        ?    71.5144  19.1556          ?        ?       83.7       11.4       ?       ? 
1 1 1   42    1   61 o    115.1    8.6    0.0000   0.0000          ?        ?   134.0895  19.7942          ?        ?      115.1        8.6       ?       ? 
1 1 1   42    1   62 o    128.7    7.2    0.0000   0.0000          ?        ?   167.2927  18.5171          ?        ?      128.7        7.2       ?       ? 
1 1 1   42    1   63 o     32.4   14.4    0.0000   0.0000          ?        ?    -5.1082  18.5171          ?        ?       32.4       14.4       ?       ? 
1 1 1   42    2    0 o    179.9    4.6  324.3690  16.6016   324.3690  16.6016   324.3690  16.6016      179.9      4.6      179.9        4.6     0.0     0.0 
1 1 1   42    2    1 o    486.6    2.5    0.0000   0.0000          ?        ?  2367.6382  24.2638          ?        ?      486.6        2.5       ?       ? 
1 1 1   42    2    2 o    129.8    5.2    0.0000   0.0000          ?        ?   168.5697  13.4090          ?        ?      129.8        5.2       ?       ? 
1 1 1   42    2    3 o   1229.0    4.4    0.0000   0.0000          ?        ? 15107.4219 107.2716          ?        ?     1229.0        4.4       ?       ? 
1 1 1   42    2    4 o    221.6    3.2    0.0000   0.0000          ?        ?   491.0231  14.0475          ?        ?      221.6        3.2       ?       ? 
1 1 1   42    2    5 o    354.7    2.4    0.0000   0.0000          ?        ?  1257.8876  17.2401          ?        ?      354.7        2.4       ?       ? 
1 1 1   42    2    6 o    641.4    2.9    0.0000   0.0000          ?        ?  4114.6333  37.0343          ?        ?      641.4        2.9       ?       ? 
1 1 1   42    2    7 o    298.5    2.5    0.0000   0.0000          ?        ?   891.3762  14.6860          ?        ?      298.5        2.5       ?       ? 
1 1 1   42    2    8 o    699.4    2.9    0.0000   0.0000          ?        ?  4891.7139  40.8654          ?        ?      699.4        2.9       ?       ? 
1 1 1   42    2    9 o    584.4    2.7    0.0000   0.0000          ?        ?  3415.4524  31.9261          ?        ?      584.4        2.7       ?       ? 
1 1 1   42    2   10 o    445.4    2.4    0.0000   0.0000          ?        ?  1983.8867  21.0712          ?        ?      445.4        2.4       ?       ? 
1 1 1   42    2   11 o    459.2    2.5    0.0000   0.0000          ?        ?  2109.0369  22.9868          ?        ?      459.2        2.5       ?       ? 
1 1 1   42    2   12 o    274.0    2.4    0.0000   0.0000          ?        ?   750.9014  13.4090          ?        ?      274.0        2.4       ?       ? 
1 1 1   42    2   13 o    251.5    2.7    0.0000   0.0000          ?        ?   632.7749  13.4090          ?        ?      251.5        2.7       ?       ? 
1 1 1   42    2   14 o    258.3    2.6    0.0000   0.0000          ?        ?   667.2551  13.4090          ?        ?      258.3        2.6       ?       ? 
1 1 1   42    2   15 o     27.3   12.0    0.0000   0.0000          ?        ?    -3.8311  12.7704          ?        ?       27.3       12.0       ?       ? 
1 1 1   42    2   16 o    395.8    2.6    0.0000   0.0000          ?        ?  1566.9320  20.4327          ?        ?      395.8        2.6       ?       ? 
1 1 1   42    2   17 o    282.5    2.6    0.0000   0.0000          ?        ?   798.1520  14.6860          ?        ?      282.5        2.6       ?       ? 
1 1 1   42    2   18 o    381.6    2.3    0.0000   0.0000          ?        ?  1456.4679  17.8786          ?        ?      381.6        2.3       ?       ? 
1 1 1   42    2   19 o    202.9    3.3    0.0000   0.0000          ?        ?   411.8464  13.4090          ?        ?      202.9        3.3       ?       ? 
1 1 1   42    2   20 o    939.8    3.4    0.0000   0.0000          ?        ?  8833.9463  64.4907          ?        ?      939.8        3.4       ?       ? 
1 1 1   42    2   21 o    153.5    4.2    0.0000   0.0000          ?        ?   235.6145  12.7704          ?        ?      153.5        4.2       ?       ? 
1 1 1   42    2   22 o    332.1    2.5    0.0000   0.0000          ?        ?  1103.3654  16.6016          ?        ?      332.1        2.5       ?       ? 
1 1 1   42    2   23 o     17.0    8.6    0.0000   0.0000          ?        ?   -42.7809  13.4090          ?        ?       17.0        8.6       ?       ? 
1 1 1   42    2   24 o    250.4    2.9    0.0000   0.0000          ?        ?   627.0282  14.6860          ?        ?      250.4        2.9       ?       ? 
1 1 1   42    2   25 o     33.1   13.3    0.0000   0.0000          ?        ?     5.1082  13.4090          ?        ?       33.1       13.3       ?       ? 
1 1 1   42    2   26 o    287.9    2.8    0.0000   0.0000          ?        ?   828.8011  15.9630          ?        ?      287.9        2.8       ?       ? 
1 1 1   42    2   27 o     68.6   10.7    0.0000   0.0000          ?        ?    47.2506  14.6860          ?        ?       68.6       10.7       ?       ? 
1 1 1   42    2   28 o     29.0   12.6    0.0000   0.0000          ?        ?    -1.9156  13.4090          ?        ?       29.0       12.6       ?       ? 
1 1 1   42    2   29 o     20.1    9.9    0.0000   0.0000          ?        ?   -30.0105  14.0475          ?        ?       20.1        9.9       ?       ? 
1 1 1   42    2   30 o     82.9    8.9    0.0000   0.0000          ?        ?    68.9603  14.6860          ?        ?       82.9        8.9       ?       ? 
1 1 1   42    2   31 o    158.2    4.6    0.0000   0.0000          ?        ?   250.3005  14.6860          ?        ?      158.2        4.6       ?       ? 
1 1 1   42    2   32 o    302.2    2.6    0.0000   0.0000          ?        ?   913.7245  15.9630          ?        ?      302.2        2.6       ?       ? 
1 1 1   42    2   33 o    373.5    2.6    0.0000   0.0000          ?        ?  1395.1698  19.1556          ?        ?      373.5        2.6       ?       ? 
1 1 1   42    2   34 o    339.3    2.7    0.0000   0.0000          ?        ?  1151.2545  18.5171          ?        ?      339.3        2.7       ?       ? 
1 1 1   42    2   35 o    330.4    2.8    0.0000   0.0000          ?        ?  1091.8719  18.5171          ?        ?      330.4        2.8       ?       ? 
1 1 1   42    2   36 o    177.5    4.3    0.0000   0.0000          ?        ?   315.4297  15.3245          ?        ?      177.5        4.3       ?       ? 
1 1 1   42    2   37 o    150.5    5.1    0.0000   0.0000          ?        ?   226.6752  15.3245          ?        ?      150.5        5.1       ?       ? 
1 1 1   42    2   38 o    162.7    4.9    0.0000   0.0000          ?        ?   264.9865  15.9630          ?        ?      162.7        4.9       ?       ? 
1 1 1   42    2   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    2   40 o    361.6    2.7    0.0000   0.0000          ?        ?  1307.6923  19.7942          ?        ?      361.6        2.7       ?       ? 
1 1 1   42    2   41 o     19.1    9.6    0.0000   0.0000          ?        ?   -56.1899  17.2401          ?        ?       19.1        9.6       ?       ? 
1 1 1   42    2   42 o    104.0    7.7    0.0000   0.0000          ?        ?   108.5487  15.9630          ?        ?      104.0        7.7       ?       ? 
1 1 1   42    2   43 o    312.4    3.0    0.0000   0.0000          ?        ?   976.2995  18.5171          ?        ?      312.4        3.0       ?       ? 
1 1 1   42    2   44 o    218.2    3.8    0.0000   0.0000          ?        ?   476.3371  16.6016          ?        ?      218.2        3.8       ?       ? 
1 1 1   42    2   45 o     18.1    9.2    0.0000   0.0000          ?        ?   -53.6358  15.9630          ?        ?       18.1        9.2       ?       ? 
1 1 1   42    2   46 o    326.9    3.0    0.0000   0.0000          ?        ?  1069.5237  19.7942          ?        ?      326.9        3.0       ?       ? 
1 1 1   42    2   47 f    128.9    6.4    0.0000   0.0000          ?        ?   166.6541  16.6016          ?        ?      128.9        6.4       ?       ? 
1 1 1   42    2   48 f    248.4    3.5    0.0000   0.0000          ?        ?   617.4504  17.2401          ?        ?      248.4        3.5       ?       ? 
1 1 1   42    2   49 o     39.4   15.1    0.0000   0.0000          ?        ?    10.8549  16.6016          ?        ?       39.4       15.1       ?       ? 
1 1 1   42    2   50 o     67.6   13.2    0.0000   0.0000          ?        ?    47.8891  17.2401          ?        ?       67.6       13.2       ?       ? 
1 1 1   42    2   51 o     81.1   10.6    0.0000   0.0000          ?        ?    66.4062  17.2401          ?        ?       81.1       10.6       ?       ? 
1 1 1   42    2   52 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    2   53 o    314.6    3.1    0.0000   0.0000          ?        ?   990.3471  19.7942          ?        ?      314.6        3.1       ?       ? 
1 1 1   42    2   54 o     40.3   15.8    0.0000   0.0000          ?        ?    10.2163  18.5171          ?        ?       40.3       15.8       ?       ? 
1 1 1   42    2   55 o    167.3    5.5    0.0000   0.0000          ?        ?   280.9495  18.5171          ?        ?      167.3        5.5       ?       ? 
1 1 1   42    2   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    2   57 o    174.0    5.5    0.0000   0.0000          ?        ?   303.9363  19.1556          ?        ?      174.0        5.5       ?       ? 
1 1 1   42    2   58 o    123.3    7.8    0.0000   0.0000          ?        ?   153.2452  19.1556          ?        ?      123.3        7.8       ?       ? 
1 1 1   42    2   59 o     29.1   13.5    0.0000   0.0000          ?        ?   -14.6860  18.5171          ?        ?       29.1       13.5       ?       ? 
1 1 1   42    2   60 o     25.3   12.3    0.0000   0.0000          ?        ?   -33.8416  19.7942          ?        ?       25.3       12.3       ?       ? 
1 1 1   42    2   61 o    197.9    4.8    0.0000   0.0000          ?        ?   393.3293  19.1556          ?        ?      197.9        4.8       ?       ? 
1 1 1   42    2   62 o    171.1    5.6    0.0000   0.0000          ?        ?   294.3585  19.1556          ?        ?      171.1        5.6       ?       ? 
1 1 1   42    2   63 o    125.6    7.6    0.0000   0.0000          ?        ?   159.6304  19.1556          ?        ?      125.6        7.6       ?       ? 
1 1 1   42    3    0 o    166.9    5.8  279.6725  19.1556   279.6725  19.1556   279.6725  19.1556      166.9      5.8      166.9        5.8     0.0     0.0 
1 1 1   42    3    1 o    769.7    3.1    0.0000   0.0000          ?        ?  5925.4805  47.2506          ?        ?      769.7        3.1       ?       ? 
1 1 1   42    3    2 o    311.1    2.6    0.0000   0.0000          ?        ?   967.9988  15.9630          ?        ?      311.1        2.6       ?       ? 
1 1 1   42    3    3 o    122.0    5.0    0.0000   0.0000          ?        ?   148.7755  12.1319          ?        ?      122.0        5.0       ?       ? 
1 1 1   42    3    4 o    192.4    3.3    0.0000   0.0000          ?        ?   370.3425  12.7704          ?        ?      192.4        3.3       ?       ? 
1 1 1   42    3    5 o    747.5    3.2    0.0000   0.0000          ?        ?  5588.9795  47.2506          ?        ?      747.5        3.2       ?       ? 
1 1 1   42    3    6 o    582.1    2.7    0.0000   0.0000          ?        ?  3388.6343  31.9261          ?        ?      582.1        2.7       ?       ? 
1 1 1   42    3    7 o    329.7    2.6    0.0000   0.0000          ?        ?  1087.4023  17.2401          ?        ?      329.7        2.6       ?       ? 
1 1 1   42    3    8 o   1002.2    3.8    0.0000   0.0000          ?        ? 10047.1377  75.3456          ?        ?     1002.2        3.8       ?       ? 
1 1 1   42    3    9 o    830.9    3.3    0.0000   0.0000          ?        ?  6905.6113  54.9129          ?        ?      830.9        3.3       ?       ? 
1 1 1   42    3   10 o    436.8    2.5    0.0000   0.0000          ?        ?  1907.9026  21.7097          ?        ?      436.8        2.5       ?       ? 
1 1 1   42    3   11 o    186.2    3.3    0.0000   0.0000          ?        ?   346.7172  12.1319          ?        ?      186.2        3.3       ?       ? 
1 1 1   42    3   12 o    306.0    2.5    0.0000   0.0000          ?        ?   936.7112  15.3245          ?        ?      306.0        2.5       ?       ? 
1 1 1   42    3   13 o     66.8    8.6    0.0000   0.0000          ?        ?    44.6965  11.4934          ?        ?       66.8        8.6       ?       ? 
1 1 1   42    3   14 o    498.7    2.5    0.0000   0.0000          ?        ?  2487.0417  24.9023          ?        ?      498.7        2.5       ?       ? 
1 1 1   42    3   15 o    620.1    2.7    0.0000   0.0000          ?        ?  3845.8157  33.8416          ?        ?      620.1        2.7       ?       ? 
1 1 1   42    3   16 o    523.6    2.6    0.0000   0.0000          ?        ?  2742.4504  26.8179          ?        ?      523.6        2.6       ?       ? 
1 1 1   42    3   17 o    539.4    2.6    0.0000   0.0000          ?        ?  2909.7432  28.0950          ?        ?      539.4        2.6       ?       ? 
1 1 1   42    3   18 o    245.8    2.7    0.0000   0.0000          ?        ?   604.0414  13.4090          ?        ?      245.8        2.7       ?       ? 
1 1 1   42    3   19 o    335.5    2.5    0.0000   0.0000          ?        ?  1125.7136  16.6016          ?        ?      335.5        2.5       ?       ? 
1 1 1   42    3   20 o    107.2    6.0    0.0000   0.0000          ?        ?   114.9339  12.7704          ?        ?      107.2        6.0       ?       ? 
1 1 1   42    3   21 o    584.4    2.7    0.0000   0.0000          ?        ?  3415.4524  31.2876          ?        ?      584.4        2.7       ?       ? 
1 1 1   42    3   22 o     92.8    7.2    0.0000   0.0000          ?        ?    86.2004  13.4090          ?        ?       92.8        7.2       ?       ? 
1 1 1   42    3   23 o    446.7    2.4    0.0000   0.0000          ?        ?  1996.0187  21.0712          ?        ?      446.7        2.4       ?       ? 
1 1 1   42    3   24 o    424.5    2.5    0.0000   0.0000          ?        ?  1801.9081  21.0712          ?        ?      424.5        2.5       ?       ? 
1 1 1   42    3   25 f    441.0    2.4    0.0000   0.0000          ?        ?  1944.9369  21.0712          ?        ?      441.0        2.4       ?       ? 
1 1 1   42    3   26 o    457.5    2.6    0.0000   0.0000          ?        ?  2093.0737  23.6253          ?        ?      457.5        2.6       ?       ? 
1 1 1   42    3   27 o    370.5    2.3    0.0000   0.0000          ?        ?  1372.8215  17.2401          ?        ?      370.5        2.3       ?       ? 
1 1 1   42    3   28 o    212.9    3.4    0.0000   0.0000          ?        ?   453.3503  14.6860          ?        ?      212.9        3.4       ?       ? 
1 1 1   42    3   29 o    516.6    2.5    0.0000   0.0000          ?        ?  2669.6589  25.5409          ?        ?      516.6        2.5       ?       ? 
1 1 1   42    3   30 o    151.3    4.9    0.0000   0.0000          ?        ?   229.2293  14.6860          ?        ?      151.3        4.9       ?       ? 
1 1 1   42    3   31 o     53.6   13.2    0.0000   0.0000          ?        ?    30.0105  14.0475          ?        ?       53.6       13.2       ?       ? 
1 1 1   42    3   32 o    555.6    2.7    0.0000   0.0000          ?        ?  3087.8906  30.0105          ?        ?      555.6        2.7       ?       ? 
1 1 1   42    3   33 o    129.0    5.7    0.0000   0.0000          ?        ?   166.6541  14.6860          ?        ?      129.0        5.7       ?       ? 
1 1 1   42    3   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    3   35 o    221.8    3.7    0.0000   0.0000          ?        ?   492.3002  16.6016          ?        ?      221.8        3.7       ?       ? 
1 1 1   42    3   36 o    370.1    2.6    0.0000   0.0000          ?        ?  1370.2675  19.1556          ?        ?      370.1        2.6       ?       ? 
1 1 1   42    3   37 o    312.5    2.9    0.0000   0.0000          ?        ?   976.9381  17.8786          ?        ?      312.5        2.9       ?       ? 
1 1 1   42    3   38 o    583.6    2.7    0.0000   0.0000          ?        ?  3406.5129  31.2876          ?        ?      583.6        2.7       ?       ? 
1 1 1   42    3   39 o    366.4    2.7    0.0000   0.0000          ?        ?  1342.8110  19.7942          ?        ?      366.4        2.7       ?       ? 
1 1 1   42    3   40 o     58.9   12.8    0.0000   0.0000          ?        ?    36.3957  14.6860          ?        ?       58.9       12.8       ?       ? 
1 1 1   42    3   41 o    187.0    4.3    0.0000   0.0000          ?        ?   349.9099  15.9630          ?        ?      187.0        4.3       ?       ? 
1 1 1   42    3   42 o    164.4    5.2    0.0000   0.0000          ?        ?   270.7332  17.2401          ?        ?      164.4        5.2       ?       ? 
1 1 1   42    3   43 o    373.9    2.7    0.0000   0.0000          ?        ?  1398.3623  20.4327          ?        ?      373.9        2.7       ?       ? 
1 1 1   42    3   44 o    189.5    4.4    0.0000   0.0000          ?        ?   359.4877  16.6016          ?        ?      189.5        4.4       ?       ? 
1 1 1   42    3   45 o    411.0    2.6    0.0000   0.0000          ?        ?  1689.5283  21.7097          ?        ?      411.0        2.6       ?       ? 
1 1 1   42    3   46 f    198.8    4.3    0.0000   0.0000          ?        ?   395.8834  17.2401          ?        ?      198.8        4.3       ?       ? 
1 1 1   42    3   47 o    117.5    7.3    0.0000   0.0000          ?        ?   138.5592  17.2401          ?        ?      117.5        7.3       ?       ? 
1 1 1   42    3   48 o    294.4    3.3    0.0000   0.0000          ?        ?   867.1124  19.1556          ?        ?      294.4        3.3       ?       ? 
1 1 1   42    3   49 o    152.5    5.7    0.0000   0.0000          ?        ?   233.0604  17.2401          ?        ?      152.5        5.7       ?       ? 
1 1 1   42    3   50 o     84.6    9.8    0.0000   0.0000          ?        ?    72.1529  16.6016          ?        ?       84.6        9.8       ?       ? 
1 1 1   42    3   51 o    197.0    4.5    0.0000   0.0000          ?        ?   388.8597  17.8786          ?        ?      197.0        4.5       ?       ? 
1 1 1   42    3   52 o    331.4    3.1    0.0000   0.0000          ?        ?  1099.5342  20.4327          ?        ?      331.4        3.1       ?       ? 
1 1 1   42    3   53 o    267.1    3.6    0.0000   0.0000          ?        ?   714.5057  19.1556          ?        ?      267.1        3.6       ?       ? 
1 1 1   42    3   54 o    123.9    7.5    0.0000   0.0000          ?        ?   154.5222  18.5171          ?        ?      123.9        7.5       ?       ? 
1 1 1   42    3   55 o    232.9    4.3    0.0000   0.0000          ?        ?   543.3819  19.7942          ?        ?      232.9        4.3       ?       ? 
1 1 1   42    3   56 o    100.3    8.9    0.0000   0.0000          ?        ?   101.5249  17.8786          ?        ?      100.3        8.9       ?       ? 
1 1 1   42    3   57 o    107.3    8.6    0.0000   0.0000          ?        ?   116.2109  18.5171          ?        ?      107.3        8.6       ?       ? 
1 1 1   42    3   58 o    250.0    3.8    0.0000   0.0000          ?        ?   626.3897  19.1556          ?        ?      250.0        3.8       ?       ? 
1 1 1   42    3   59 o     19.1    9.7    0.0000   0.0000          ?        ?   -69.5989  19.1556          ?        ?       19.1        9.7       ?       ? 
1 1 1   42    3   60 o    175.1    5.7    0.0000   0.0000          ?        ?   308.4059  19.7942          ?        ?      175.1        5.7       ?       ? 
1 1 1   42    3   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    3   62 o     32.4   14.3    0.0000   0.0000          ?        ?    -5.1082  18.5171          ?        ?       32.4       14.3       ?       ? 
1 1 1   42    4    0 o    615.6    3.9 3790.2642  47.8891  3790.2642  47.8891  3790.2642  47.8891      615.6      3.9      615.6        3.9     0.0     0.0 
1 1 1   42    4    1 o    304.6    2.4    0.0000   0.0000          ?        ?   927.7720  14.6860          ?        ?      304.6        2.4       ?       ? 
1 1 1   42    4    2 o    754.3    3.0    0.0000   0.0000          ?        ?  5691.1431  45.3350          ?        ?      754.3        3.0       ?       ? 
1 1 1   42    4    3 o    541.2    2.5    0.0000   0.0000          ?        ?  2928.8987  27.4564          ?        ?      541.2        2.5       ?       ? 
1 1 1   42    4    4 o    182.4    3.2    0.0000   0.0000          ?        ?   332.6698  11.4934          ?        ?      182.4        3.2       ?       ? 
1 1 1   42    4    5 o    464.4    2.5    0.0000   0.0000          ?        ?  2156.9260  22.9868          ?        ?      464.4        2.5       ?       ? 
1 1 1   42    4    6 o    126.8    4.3    0.0000   0.0000          ?        ?   160.9075  10.8549          ?        ?      126.8        4.3       ?       ? 
1 1 1   42    4    7 o    583.6    2.6    0.0000   0.0000          ?        ?  3406.5129  30.6490          ?        ?      583.6        2.6       ?       ? 
1 1 1   42    4    8 o    341.1    2.4    0.0000   0.0000          ?        ?  1163.3864  16.6016          ?        ?      341.1        2.4       ?       ? 
1 1 1   42    4    9 o    351.8    2.4    0.0000   0.0000          ?        ?  1238.0934  17.2401          ?        ?      351.8        2.4       ?       ? 
1 1 1   42    4   10 o    227.3    2.7    0.0000   0.0000          ?        ?   516.5640  12.1319          ?        ?      227.3        2.7       ?       ? 
1 1 1   42    4   11 o    318.3    2.4    0.0000   0.0000          ?        ?  1013.3338  15.3245          ?        ?      318.3        2.4       ?       ? 
1 1 1   42    4   12 o   1004.4    3.8    0.0000   0.0000          ?        ? 10091.8340  75.3456          ?        ?     1004.4        3.8       ?       ? 
1 1 1   42    4   13 o    358.2    2.5    0.0000   0.0000          ?        ?  1283.4285  17.8786          ?        ?      358.2        2.5       ?       ? 
1 1 1   42    4   14 o    526.7    2.6    0.0000   0.0000          ?        ?  2775.0151  27.4564          ?        ?      526.7        2.6       ?       ? 
1 1 1   42    4   15 o    337.3    2.5    0.0000   0.0000          ?        ?  1137.8455  16.6016          ?        ?      337.3        2.5       ?       ? 
1 1 1   42    4   16 o    228.8    3.3    0.0000   0.0000          ?        ?   523.5877  15.3245          ?        ?      228.8        3.3       ?       ? 
1 1 1   42    4   17 o    376.7    2.5    0.0000   0.0000          ?        ?  1419.4336  18.5171          ?        ?      376.7        2.5       ?       ? 
1 1 1   42    4   18 o    326.6    2.5    0.0000   0.0000          ?        ?  1066.9697  16.6016          ?        ?      326.6        2.5       ?       ? 
1 1 1   42    4   19 o    704.5    2.9    0.0000   0.0000          ?        ?  4964.5059  41.5039          ?        ?      704.5        2.9       ?       ? 
1 1 1   42    4   20 o    585.1    2.6    0.0000   0.0000          ?        ?  3424.3914  30.6490          ?        ?      585.1        2.6       ?       ? 
1 1 1   42    4   21 o    257.5    3.0    0.0000   0.0000          ?        ?   663.4240  15.3245          ?        ?      257.5        3.0       ?       ? 
1 1 1   42    4   22 o    354.4    2.4    0.0000   0.0000          ?        ?  1255.9720  17.2401          ?        ?      354.4        2.4       ?       ? 
1 1 1   42    4   23 o    348.4    2.5    0.0000   0.0000          ?        ?  1213.8297  17.2401          ?        ?      348.4        2.5       ?       ? 
1 1 1   42    4   24 o    210.0    3.6    0.0000   0.0000          ?        ?   441.2184  15.3245          ?        ?      210.0        3.6       ?       ? 
1 1 1   42    4   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    4   26 o    239.3    3.1    0.0000   0.0000          ?        ?   572.7539  14.6860          ?        ?      239.3        3.1       ?       ? 
1 1 1   42    4   27 o    237.3    3.1    0.0000   0.0000          ?        ?   563.1760  14.6860          ?        ?      237.3        3.1       ?       ? 
1 1 1   42    4   28 o    237.3    3.1    0.0000   0.0000          ?        ?   563.1760  14.6860          ?        ?      237.3        3.1       ?       ? 
1 1 1   42    4   29 o    366.3    2.7    0.0000   0.0000          ?        ?  1342.1725  19.7942          ?        ?      366.3        2.7       ?       ? 
1 1 1   42    4   30 o    322.8    2.6    0.0000   0.0000          ?        ?  1042.0673  16.6016          ?        ?      322.8        2.6       ?       ? 
1 1 1   42    4   31 o    608.9    2.7    0.0000   0.0000          ?        ?  3708.5334  32.5646          ?        ?      608.9        2.7       ?       ? 
1 1 1   42    4   32 o    120.3    6.1    0.0000   0.0000          ?        ?   144.9444  14.6860          ?        ?      120.3        6.1       ?       ? 
1 1 1   42    4   33 o    519.5    2.6    0.0000   0.0000          ?        ?  2699.6694  27.4564          ?        ?      519.5        2.6       ?       ? 
1 1 1   42    4   34 o    240.7    3.3    0.0000   0.0000          ?        ?   579.7776  15.9630          ?        ?      240.7        3.3       ?       ? 
1 1 1   42    4   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    4   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    4   37 o     78.1    9.8    0.0000   0.0000          ?        ?    61.2981  15.3245          ?        ?       78.1        9.8       ?       ? 
1 1 1   42    4   38 o    313.0    2.9    0.0000   0.0000          ?        ?   980.1307  17.8786          ?        ?      313.0        2.9       ?       ? 
1 1 1   42    4   39 o    193.2    4.1    0.0000   0.0000          ?        ?   373.5352  15.9630          ?        ?      193.2        4.1       ?       ? 
1 1 1   42    4   40 o    181.6    4.6    0.0000   0.0000          ?        ?   330.1157  16.6016          ?        ?      181.6        4.6       ?       ? 
1 1 1   42    4   41 o    305.5    3.0    0.0000   0.0000          ?        ?   933.5186  18.5171          ?        ?      305.5        3.0       ?       ? 
1 1 1   42    4   42 o    479.6    2.7    0.0000   0.0000          ?        ?  2301.2319  25.5409          ?        ?      479.6        2.7       ?       ? 
1 1 1   42    4   43 o     21.3   10.6    0.0000   0.0000          ?        ?   -41.5039  17.2401          ?        ?       21.3       10.6       ?       ? 
1 1 1   42    4   44 o     23.9   11.6    0.0000   0.0000          ?        ?   -28.7335  17.2401          ?        ?       23.9       11.6       ?       ? 
1 1 1   42    4   45 o     89.8    9.2    0.0000   0.0000          ?        ?    81.0922  16.6016          ?        ?       89.8        9.2       ?       ? 
1 1 1   42    4   46 o    659.9    2.8    0.0000   0.0000          ?        ?  4356.6328  36.3957          ?        ?      659.9        2.8       ?       ? 
1 1 1   42    4   47 o    164.0    5.3    0.0000   0.0000          ?        ?   269.4561  17.2401          ?        ?      164.0        5.3       ?       ? 
1 1 1   42    4   48 o    159.6    5.4    0.0000   0.0000          ?        ?   255.4086  17.2401          ?        ?      159.6        5.4       ?       ? 
1 1 1   42    4   49 o    289.3    3.2    0.0000   0.0000          ?        ?   837.7404  18.5171          ?        ?      289.3        3.2       ?       ? 
1 1 1   42    4   50 o    113.6    7.9    0.0000   0.0000          ?        ?   129.6199  17.8786          ?        ?      113.6        7.9       ?       ? 
1 1 1   42    4   51 o     52.7   15.8    0.0000   0.0000          ?        ?    28.7335  17.8786          ?        ?       52.7       15.8       ?       ? 
1 1 1   42    4   52 o     30.7   13.7    0.0000   0.0000          ?        ?    -7.0237  17.2401          ?        ?       30.7       13.7       ?       ? 
1 1 1   42    4   53 f    194.9    4.8    0.0000   0.0000          ?        ?   380.5589  18.5171          ?        ?      194.9        4.8       ?       ? 
1 1 1   42    4   54 o    333.0    3.3    0.0000   0.0000          ?        ?  1110.3890  21.7097          ?        ?      333.0        3.3       ?       ? 
1 1 1   42    4   55 o    276.9    3.7    0.0000   0.0000          ?        ?   768.1415  20.4327          ?        ?      276.9        3.7       ?       ? 
1 1 1   42    4   56 o    168.0    5.7    0.0000   0.0000          ?        ?   283.5036  19.1556          ?        ?      168.0        5.7       ?       ? 
1 1 1   42    4   57 o    213.4    4.5    0.0000   0.0000          ?        ?   456.5430  19.1556          ?        ?      213.4        4.5       ?       ? 
1 1 1   42    4   58 o     82.9   11.9    0.0000   0.0000          ?        ?    70.2374  19.7942          ?        ?       82.9       11.9       ?       ? 
1 1 1   42    4   59 o    116.5    8.5    0.0000   0.0000          ?        ?   137.2822  19.7942          ?        ?      116.5        8.5       ?       ? 
1 1 1   42    4   60 o     80.9   11.4    0.0000   0.0000          ?        ?    67.0448  18.5171          ?        ?       80.9       11.4       ?       ? 
1 1 1   42    4   61 o    186.2    5.3    0.0000   0.0000          ?        ?   348.6328  19.7942          ?        ?      186.2        5.3       ?       ? 
1 1 1   42    5    0 o    203.1    4.6  413.1235  18.5171   413.1235  18.5171   413.1235  18.5171      203.1      4.6      203.1        4.6     0.0     0.0 
1 1 1   42    5    1 o    738.1    3.1    0.0000   0.0000          ?        ?  5449.1436  45.3350          ?        ?      738.1        3.1       ?       ? 
1 1 1   42    5    2 o    406.6    2.4    0.0000   0.0000          ?        ?  1653.1324  19.7942          ?        ?      406.6        2.4       ?       ? 
1 1 1   42    5    3 o    768.8    3.1    0.0000   0.0000          ?        ?  5910.7949  47.2506          ?        ?      768.8        3.1       ?       ? 
1 1 1   42    5    4 o    129.1    4.2    0.0000   0.0000          ?        ?   166.6541  10.8549          ?        ?      129.1        4.2       ?       ? 
1 1 1   42    5    5 o    238.1    2.7    0.0000   0.0000          ?        ?   567.0072  12.7704          ?        ?      238.1        2.7       ?       ? 
1 1 1   42    5    6 o    437.1    2.3    0.0000   0.0000          ?        ?  1910.4568  20.4327          ?        ?      437.1        2.3       ?       ? 
1 1 1   42    5    7 o    499.3    2.4    0.0000   0.0000          ?        ?  2492.7883  24.2638          ?        ?      499.3        2.4       ?       ? 
1 1 1   42    5    8 o    170.4    3.2    0.0000   0.0000          ?        ?   290.5273  10.8549          ?        ?      170.4        3.2       ?       ? 
1 1 1   42    5    9 o    422.0    2.3    0.0000   0.0000          ?        ?  1780.8368  19.7942          ?        ?      422.0        2.3       ?       ? 
1 1 1   42    5   10 o    500.3    2.6    0.0000   0.0000          ?        ?  2503.0049  26.1794          ?        ?      500.3        2.6       ?       ? 
1 1 1   42    5   11 o    171.0    3.4    0.0000   0.0000          ?        ?   292.4429  11.4934          ?        ?      171.0        3.4       ?       ? 
1 1 1   42    5   12 f    123.2    4.9    0.0000   0.0000          ?        ?   151.9681  12.1319          ?        ?      123.2        4.9       ?       ? 
1 1 1   42    5   13 o    488.1    2.6    0.0000   0.0000          ?        ?  2382.3242  24.9023          ?        ?      488.1        2.6       ?       ? 
1 1 1   42    5   14 o    524.2    2.8    0.0000   0.0000          ?        ?  2748.1970  29.3720          ?        ?      524.2        2.8       ?       ? 
1 1 1   42    5   15 o    545.7    2.6    0.0000   0.0000          ?        ?  2978.7034  28.7335          ?        ?      545.7        2.6       ?       ? 
1 1 1   42    5   16 o    383.4    2.3    0.0000   0.0000          ?        ?  1470.5154  17.8786          ?        ?      383.4        2.3       ?       ? 
1 1 1   42    5   17 o    106.3    6.0    0.0000   0.0000          ?        ?   113.0183  12.7704          ?        ?      106.3        6.0       ?       ? 
1 1 1   42    5   18 o    249.0    2.8    0.0000   0.0000          ?        ?   620.0045  14.0475          ?        ?      249.0        2.8       ?       ? 
1 1 1   42    5   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    5   20 o     15.8    8.0    0.0000   0.0000          ?        ?   -40.8654  12.1319          ?        ?       15.8        8.0       ?       ? 
1 1 1   42    5   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    5   22 o    360.1    2.5    0.0000   0.0000          ?        ?  1296.8374  17.8786          ?        ?      360.1        2.5       ?       ? 
1 1 1   42    5   23 o     15.8    8.0    0.0000   0.0000          ?        ?   -45.9736  12.7704          ?        ?       15.8        8.0       ?       ? 
1 1 1   42    5   24 o     41.4   13.5    0.0000   0.0000          ?        ?    16.6016  12.7704          ?        ?       41.4       13.5       ?       ? 
1 1 1   42    5   25 o    302.9    2.5    0.0000   0.0000          ?        ?   917.5555  15.3245          ?        ?      302.9        2.5       ?       ? 
1 1 1   42    5   26 o    123.2    5.4    0.0000   0.0000          ?        ?   151.9681  13.4090          ?        ?      123.2        5.4       ?       ? 
1 1 1   42    5   27 o    472.3    2.5    0.0000   0.0000          ?        ?  2230.9946  23.6253          ?        ?      472.3        2.5       ?       ? 
1 1 1   42    5   28 o    185.6    3.8    0.0000   0.0000          ?        ?   344.8017  14.0475          ?        ?      185.6        3.8       ?       ? 
1 1 1   42    5   29 o    287.0    2.8    0.0000   0.0000          ?        ?   823.6929  15.9630          ?        ?      287.0        2.8       ?       ? 
1 1 1   42    5   30 o    153.2    4.6    0.0000   0.0000          ?        ?   234.9760  14.0475          ?        ?      153.2        4.6       ?       ? 
1 1 1   42    5   31 o    185.6    4.0    0.0000   0.0000          ?        ?   344.8017  14.6860          ?        ?      185.6        4.0       ?       ? 
1 1 1   42    5   32 o    319.0    2.8    0.0000   0.0000          ?        ?  1017.8034  17.8786          ?        ?      319.0        2.8       ?       ? 
1 1 1   42    5   33 o    124.2    6.2    0.0000   0.0000          ?        ?   154.5222  15.3245          ?        ?      124.2        6.2       ?       ? 
1 1 1   42    5   34 o    435.9    2.5    0.0000   0.0000          ?        ?  1900.2404  21.7097          ?        ?      435.9        2.5       ?       ? 
1 1 1   42    5   35 o    235.5    3.5    0.0000   0.0000          ?        ?   554.8753  16.6016          ?        ?      235.5        3.5       ?       ? 
1 1 1   42    5   36 o    128.5    6.0    0.0000   0.0000          ?        ?   165.3771  15.3245          ?        ?      128.5        6.0       ?       ? 
1 1 1   42    5   37 o    363.8    2.6    0.0000   0.0000          ?        ?  1323.6554  19.1556          ?        ?      363.8        2.6       ?       ? 
1 1 1   42    5   38 o    272.4    3.0    0.0000   0.0000          ?        ?   742.6006  16.6016          ?        ?      272.4        3.0       ?       ? 
1 1 1   42    5   39 o     17.0    8.6    0.0000   0.0000          ?        ?   -51.7203  14.6860          ?        ?       17.0        8.6       ?       ? 
1 1 1   42    5   40 o    289.2    3.1    0.0000   0.0000          ?        ?   837.1019  17.8786          ?        ?      289.2        3.1       ?       ? 
1 1 1   42    5   41 o    134.0    6.0    0.0000   0.0000          ?        ?   180.0631  15.9630          ?        ?      134.0        6.0       ?       ? 
1 1 1   42    5   42 o    119.4    7.0    0.0000   0.0000          ?        ?   143.0288  16.6016          ?        ?      119.4        7.0       ?       ? 
1 1 1   42    5   43 o    129.4    6.4    0.0000   0.0000          ?        ?   167.9312  16.6016          ?        ?      129.4        6.4       ?       ? 
1 1 1   42    5   44 o    290.7    3.2    0.0000   0.0000          ?        ?   845.4026  18.5171          ?        ?      290.7        3.2       ?       ? 
1 1 1   42    5   45 o    262.6    3.4    0.0000   0.0000          ?        ?   690.2419  17.8786          ?        ?      262.6        3.4       ?       ? 
1 1 1   42    5   46 o    168.0    5.1    0.0000   0.0000          ?        ?   282.8651  17.2401          ?        ?      168.0        5.1       ?       ? 
1 1 1   42    5   47 o    342.4    3.0    0.0000   0.0000          ?        ?  1172.9642  20.4327          ?        ?      342.4        3.0       ?       ? 
1 1 1   42    5   48 o    170.5    5.2    0.0000   0.0000          ?        ?   291.1659  17.8786          ?        ?      170.5        5.2       ?       ? 
1 1 1   42    5   49 o    274.1    3.5    0.0000   0.0000          ?        ?   752.1785  19.1556          ?        ?      274.1        3.5       ?       ? 
1 1 1   42    5   50 o    203.2    4.4    0.0000   0.0000          ?        ?   413.7620  17.8786          ?        ?      203.2        4.4       ?       ? 
1 1 1   42    5   51 o    121.1    7.6    0.0000   0.0000          ?        ?   147.4985  18.5171          ?        ?      121.1        7.6       ?       ? 
1 1 1   42    5   52 o    107.4    8.3    0.0000   0.0000          ?        ?   116.2109  17.8786          ?        ?      107.4        8.3       ?       ? 
1 1 1   42    5   53 o    139.2    6.7    0.0000   0.0000          ?        ?   194.7491  18.5171          ?        ?      139.2        6.7       ?       ? 
1 1 1   42    5   54 o    145.3    6.4    0.0000   0.0000          ?        ?   211.9892  18.5171          ?        ?      145.3        6.4       ?       ? 
1 1 1   42    5   55 o    106.4    8.4    0.0000   0.0000          ?        ?   114.2954  17.8786          ?        ?      106.4        8.4       ?       ? 
1 1 1   42    5   56 o     21.8   10.8    0.0000   0.0000          ?        ?   -42.1424  17.8786          ?        ?       21.8       10.8       ?       ? 
1 1 1   42    5   57 o     91.9    9.7    0.0000   0.0000          ?        ?    85.5619  17.8786          ?        ?       91.9        9.7       ?       ? 
1 1 1   42    5   58 o     33.9   14.6    0.0000   0.0000          ?        ?    -0.6385  17.8786          ?        ?       33.9       14.6       ?       ? 
1 1 1   42    5   59 o     27.2   12.9    0.0000   0.0000          ?        ?   -22.9868  19.1556          ?        ?       27.2       12.9       ?       ? 
1 1 1   42    5   60 o    155.8    6.1    0.0000   0.0000          ?        ?   244.5538  19.1556          ?        ?      155.8        6.1       ?       ? 
1 1 1   42    5   61 o    289.7    3.5    0.0000   0.0000          ?        ?   841.5715  20.4327          ?        ?      289.7        3.5       ?       ? 
1 1 1   42    6    0 o    408.5    3.7 1669.7340  30.0105  1669.7340  30.0105  1669.7340  30.0105      408.5      3.7      408.5        3.7     0.0     0.0 
1 1 1   42    6    1 o    852.9    3.3    0.0000   0.0000          ?        ?  7275.3154  56.1899          ?        ?      852.9        3.3       ?       ? 
1 1 1   42    6    2 o    392.5    2.5    0.0000   0.0000          ?        ?  1540.7527  19.7942          ?        ?      392.5        2.5       ?       ? 
1 1 1   42    6    3 o    463.8    2.4    0.0000   0.0000          ?        ?  2151.8179  22.3483          ?        ?      463.8        2.4       ?       ? 
1 1 1   42    6    4 o    248.7    2.7    0.0000   0.0000          ?        ?   618.7275  13.4090          ?        ?      248.7        2.7       ?       ? 
1 1 1   42    6    5 o    678.7    2.8    0.0000   0.0000          ?        ?  4606.9336  38.3113          ?        ?      678.7        2.8       ?       ? 
1 1 1   42    6    6 o    577.4    2.7    0.0000   0.0000          ?        ?  3334.3601  30.6490          ?        ?      577.4        2.7       ?       ? 
1 1 1   42    6    7 o    285.0    2.5    0.0000   0.0000          ?        ?   812.1995  14.0475          ?        ?      285.0        2.5       ?       ? 
1 1 1   42    6    8 o    497.1    2.5    0.0000   0.0000          ?        ?  2471.7173  24.9023          ?        ?      497.1        2.5       ?       ? 
1 1 1   42    6    9 o    414.3    2.5    0.0000   0.0000          ?        ?  1716.9846  20.4327          ?        ?      414.3        2.5       ?       ? 
1 1 1   42    6   10 o    346.5    2.3    0.0000   0.0000          ?        ?  1201.0592  15.9630          ?        ?      346.5        2.3       ?       ? 
1 1 1   42    6   11 o    405.5    2.4    0.0000   0.0000          ?        ?  1644.8318  19.7942          ?        ?      405.5        2.4       ?       ? 
1 1 1   42    6   12 o    791.6    3.1    0.0000   0.0000          ?        ?  6267.0898  49.8047          ?        ?      791.6        3.1       ?       ? 
1 1 1   42    6   13 o    596.7    2.7    0.0000   0.0000          ?        ?  3561.6736  31.9261          ?        ?      596.7        2.7       ?       ? 
1 1 1   42    6   14 o    132.2    4.3    0.0000   0.0000          ?        ?   174.9549  11.4934          ?        ?      132.2        4.3       ?       ? 
1 1 1   42    6   15 o    485.1    2.6    0.0000   0.0000          ?        ?  2353.5908  24.9023          ?        ?      485.1        2.6       ?       ? 
1 1 1   42    6   16 o    825.9    3.5    0.0000   0.0000          ?        ?  6822.6035  58.1055          ?        ?      825.9        3.5       ?       ? 
1 1 1   42    6   17 o    158.0    4.4    0.0000   0.0000          ?        ?   249.6619  14.0475          ?        ?      158.0        4.4       ?       ? 
1 1 1   42    6   18 o    295.1    2.6    0.0000   0.0000          ?        ?   870.9435  15.3245          ?        ?      295.1        2.6       ?       ? 
1 1 1   42    6   19 o    447.4    2.5    0.0000   0.0000          ?        ?  2002.4038  22.3483          ?        ?      447.4        2.5       ?       ? 
1 1 1   42    6   20 o    290.1    2.5    0.0000   0.0000          ?        ?   841.5715  14.6860          ?        ?      290.1        2.5       ?       ? 
1 1 1   42    6   21 o    268.6    2.7    0.0000   0.0000          ?        ?   721.5294  14.6860          ?        ?      268.6        2.7       ?       ? 
1 1 1   42    6   22 o    305.2    2.6    0.0000   0.0000          ?        ?   931.6030  15.9630          ?        ?      305.2        2.6       ?       ? 
1 1 1   42    6   23 o    480.2    2.5    0.0000   0.0000          ?        ?  2306.3401  23.6253          ?        ?      480.2        2.5       ?       ? 
1 1 1   42    6   24 o    162.9    4.1    0.0000   0.0000          ?        ?   265.6250  13.4090          ?        ?      162.9        4.1       ?       ? 
1 1 1   42    6   25 o    423.8    2.4    0.0000   0.0000          ?        ?  1796.1613  20.4327          ?        ?      423.8        2.4       ?       ? 
1 1 1   42    6   26 o    238.9    3.1    0.0000   0.0000          ?        ?   570.8383  14.6860          ?        ?      238.9        3.1       ?       ? 
1 1 1   42    6   27 o    459.1    2.4    0.0000   0.0000          ?        ?  2108.3984  22.3483          ?        ?      459.1        2.4       ?       ? 
1 1 1   42    6   28 o    395.2    2.5    0.0000   0.0000          ?        ?  1561.8240  19.7942          ?        ?      395.2        2.5       ?       ? 
1 1 1   42    6   29 o     22.7   10.9    0.0000   0.0000          ?        ?   -19.7942  14.0475          ?        ?       22.7       10.9       ?       ? 
1 1 1   42    6   30 o    153.8    4.8    0.0000   0.0000          ?        ?   236.8915  14.6860          ?        ?      153.8        4.8       ?       ? 
1 1 1   42    6   31 o    332.4    2.7    0.0000   0.0000          ?        ?  1105.2810  17.8786          ?        ?      332.4        2.7       ?       ? 
1 1 1   42    6   32 o    513.3    2.6    0.0000   0.0000          ?        ?  2635.1787  26.1794          ?        ?      513.3        2.6       ?       ? 
1 1 1   42    6   33 o    422.3    2.6    0.0000   0.0000          ?        ?  1784.0294  22.3483          ?        ?      422.3        2.6       ?       ? 
1 1 1   42    6   34 o    392.1    2.6    0.0000   0.0000          ?        ?  1538.1986  20.4327          ?        ?      392.1        2.6       ?       ? 
1 1 1   42    6   35 o    161.5    4.5    0.0000   0.0000          ?        ?   261.1554  14.6860          ?        ?      161.5        4.5       ?       ? 
1 1 1   42    6   36 o    357.4    2.6    0.0000   0.0000          ?        ?  1277.6818  18.5171          ?        ?      357.4        2.6       ?       ? 
1 1 1   42    6   37 o     29.3   13.0    0.0000   0.0000          ?        ?    -5.7467  15.3245          ?        ?       29.3       13.0       ?       ? 
1 1 1   42    6   38 o    346.7    2.8    0.0000   0.0000          ?        ?  1202.3362  19.1556          ?        ?      346.7        2.8       ?       ? 
1 1 1   42    6   39 o    219.2    3.6    0.0000   0.0000          ?        ?   480.8068  15.9630          ?        ?      219.2        3.6       ?       ? 
1 1 1   42    6   40 o     31.0   13.4    0.0000   0.0000          ?        ?    -1.9156  15.3245          ?        ?       31.0       13.4       ?       ? 
1 1 1   42    6   41 o    501.7    2.6    0.0000   0.0000          ?        ?  2518.3293  26.1794          ?        ?      501.7        2.6       ?       ? 
1 1 1   42    6   42 o     39.0   15.0    0.0000   0.0000          ?        ?    10.2163  16.6016          ?        ?       39.0       15.0       ?       ? 
1 1 1   42    6   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    6   44 o    267.1    3.3    0.0000   0.0000          ?        ?   713.8672  17.8786          ?        ?      267.1        3.3       ?       ? 
1 1 1   42    6   45 o    294.0    3.1    0.0000   0.0000          ?        ?   865.1968  18.5171          ?        ?      294.0        3.1       ?       ? 
1 1 1   42    6   46 o    148.9    5.8    0.0000   0.0000          ?        ?   222.2055  17.2401          ?        ?      148.9        5.8       ?       ? 
1 1 1   42    6   47 o    266.6    3.5    0.0000   0.0000          ?        ?   711.3131  18.5171          ?        ?      266.6        3.5       ?       ? 
1 1 1   42    6   48 o    101.7    8.8    0.0000   0.0000          ?        ?   104.0790  17.8786          ?        ?      101.7        8.8       ?       ? 
1 1 1   42    6   49 o    227.0    4.1    0.0000   0.0000          ?        ?   515.9255  18.5171          ?        ?      227.0        4.1       ?       ? 
1 1 1   42    6   50 o    460.1    2.7    0.0000   0.0000          ?        ?  2117.9763  24.9023          ?        ?      460.1        2.7       ?       ? 
1 1 1   42    6   51 o    194.5    4.8    0.0000   0.0000          ?        ?   379.2819  18.5171          ?        ?      194.5        4.8       ?       ? 
1 1 1   42    6   52 o    136.5    6.6    0.0000   0.0000          ?        ?   187.0868  17.8786          ?        ?      136.5        6.6       ?       ? 
1 1 1   42    6   53 o     36.7   14.9    0.0000   0.0000          ?        ?     5.7467  17.2401          ?        ?       36.7       14.9       ?       ? 
1 1 1   42    6   54 o    326.1    3.1    0.0000   0.0000          ?        ?  1064.4155  20.4327          ?        ?      326.1        3.1       ?       ? 
1 1 1   42    6   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    6   56 o     25.2   12.2    0.0000   0.0000          ?        ?   -31.2876  19.1556          ?        ?       25.2       12.2       ?       ? 
1 1 1   42    6   57 o    242.3    4.0    0.0000   0.0000          ?        ?   588.7169  19.1556          ?        ?      242.3        4.0       ?       ? 
1 1 1   42    6   58 o     23.1   11.4    0.0000   0.0000          ?        ?   -38.3113  18.5171          ?        ?       23.1       11.4       ?       ? 
1 1 1   42    6   59 o     49.2   16.5    0.0000   0.0000          ?        ?    24.2638  19.1556          ?        ?       49.2       16.5       ?       ? 
1 1 1   42    6   60 f    172.1    5.8    0.0000   0.0000          ?        ?   298.1896  19.7942          ?        ?      172.1        5.8       ?       ? 
1 1 1   42    7    0 o     80.0    9.0   66.4062  14.0475    66.4062  14.0475    66.4062  14.0475       80.0      9.0       80.0        9.0     0.0     0.0 
1 1 1   42    7    1 o    414.8    2.5    0.0000   0.0000          ?        ?  1720.8158  20.4327          ?        ?      414.8        2.5       ?       ? 
1 1 1   42    7    2 o    844.8    3.4    0.0000   0.0000          ?        ?  7139.3101  57.4669          ?        ?      844.8        3.4       ?       ? 
1 1 1   42    7    3 o    132.0    4.4    0.0000   0.0000          ?        ?   174.3164  11.4934          ?        ?      132.0        4.4       ?       ? 
1 1 1   42    7    4 o    348.0    2.4    0.0000   0.0000          ?        ?  1211.2755  16.6016          ?        ?      348.0        2.4       ?       ? 
1 1 1   42    7    5 o    136.8    4.2    0.0000   0.0000          ?        ?   187.0868  11.4934          ?        ?      136.8        4.2       ?       ? 
1 1 1   42    7    6 o    229.5    2.8    0.0000   0.0000          ?        ?   526.7803  12.7704          ?        ?      229.5        2.8       ?       ? 
1 1 1   42    7    7 o    599.5    2.7    0.0000   0.0000          ?        ?  3594.8767  32.5646          ?        ?      599.5        2.7       ?       ? 
1 1 1   42    7    8 o    616.8    2.9    0.0000   0.0000          ?        ?  3805.5889  35.7572          ?        ?      616.8        2.9       ?       ? 
1 1 1   42    7    9 o     31.5   12.1    0.0000   0.0000          ?        ?     6.3852  10.8549          ?        ?       31.5       12.1       ?       ? 
1 1 1   42    7   10 o    247.8    2.7    0.0000   0.0000          ?        ?   614.2578  13.4090          ?        ?      247.8        2.7       ?       ? 
1 1 1   42    7   11 o    157.8    3.6    0.0000   0.0000          ?        ?   249.0234  11.4934          ?        ?      157.8        3.6       ?       ? 
1 1 1   42    7   12 o    311.7    2.6    0.0000   0.0000          ?        ?   971.8299  15.9630          ?        ?      311.7        2.6       ?       ? 
1 1 1   42    7   13 o    356.5    2.4    0.0000   0.0000          ?        ?  1271.2966  17.2401          ?        ?      356.5        2.4       ?       ? 
1 1 1   42    7   14 o    238.4    2.8    0.0000   0.0000          ?        ?   568.2842  13.4090          ?        ?      238.4        2.8       ?       ? 
1 1 1   42    7   15 o    618.7    2.7    0.0000   0.0000          ?        ?  3829.2144  33.8416          ?        ?      618.7        2.7       ?       ? 
1 1 1   42    7   16 o    456.4    2.6    0.0000   0.0000          ?        ?  2083.4961  23.6253          ?        ?      456.4        2.6       ?       ? 
1 1 1   42    7   17 o    627.2    2.7    0.0000   0.0000          ?        ?  3935.2087  34.4802          ?        ?      627.2        2.7       ?       ? 
1 1 1   42    7   18 o    982.4    3.8    0.0000   0.0000          ?        ?  9655.7236  75.3456          ?        ?      982.4        3.8       ?       ? 
1 1 1   42    7   19 o    626.7    2.8    0.0000   0.0000          ?        ?  3928.1851  35.1187          ?        ?      626.7        2.8       ?       ? 
1 1 1   42    7   20 o    254.4    2.9    0.0000   0.0000          ?        ?   647.4609  14.6860          ?        ?      254.4        2.9       ?       ? 
1 1 1   42    7   21 o    221.8    3.3    0.0000   0.0000          ?        ?   492.3002  14.6860          ?        ?      221.8        3.3       ?       ? 
1 1 1   42    7   22 o    197.0    3.2    0.0000   0.0000          ?        ?   388.2211  12.7704          ?        ?      197.0        3.2       ?       ? 
1 1 1   42    7   23 o    404.1    2.4    0.0000   0.0000          ?        ?  1633.3384  19.1556          ?        ?      404.1        2.4       ?       ? 
1 1 1   42    7   24 o    119.5    5.3    0.0000   0.0000          ?        ?   143.0288  12.7704          ?        ?      119.5        5.3       ?       ? 
1 1 1   42    7   25 o    192.1    3.7    0.0000   0.0000          ?        ?   369.0655  14.0475          ?        ?      192.1        3.7       ?       ? 
1 1 1   42    7   26 o    264.4    2.9    0.0000   0.0000          ?        ?   699.1812  15.3245          ?        ?      264.4        2.9       ?       ? 
1 1 1   42    7   27 o    413.2    2.5    0.0000   0.0000          ?        ?  1707.4067  20.4327          ?        ?      413.2        2.5       ?       ? 
1 1 1   42    7   28 o    242.3    3.2    0.0000   0.0000          ?        ?   587.4399  15.3245          ?        ?      242.3        3.2       ?       ? 
1 1 1   42    7   29 o    260.0    2.9    0.0000   0.0000          ?        ?   676.1944  15.3245          ?        ?      260.0        2.9       ?       ? 
1 1 1   42    7   30 o    252.6    3.0    0.0000   0.0000          ?        ?   638.5216  15.3245          ?        ?      252.6        3.0       ?       ? 
1 1 1   42    7   31 o    182.7    4.0    0.0000   0.0000          ?        ?   333.9468  14.6860          ?        ?      182.7        4.0       ?       ? 
1 1 1   42    7   32 o    237.3    3.2    0.0000   0.0000          ?        ?   563.1760  15.3245          ?        ?      237.3        3.2       ?       ? 
1 1 1   42    7   33 o    357.7    2.6    0.0000   0.0000          ?        ?  1280.2358  18.5171          ?        ?      357.7        2.6       ?       ? 
1 1 1   42    7   34 o    304.3    2.8    0.0000   0.0000          ?        ?   926.4949  17.2401          ?        ?      304.3        2.8       ?       ? 
1 1 1   42    7   35 o     93.0    7.9    0.0000   0.0000          ?        ?    86.8389  14.6860          ?        ?       93.0        7.9       ?       ? 
1 1 1   42    7   36 o    300.9    2.9    0.0000   0.0000          ?        ?   906.0621  17.2401          ?        ?      300.9        2.9       ?       ? 
1 1 1   42    7   37 o    158.1    4.6    0.0000   0.0000          ?        ?   250.3005  14.6860          ?        ?      158.1        4.6       ?       ? 
1 1 1   42    7   38 o    305.8    3.0    0.0000   0.0000          ?        ?   935.4342  18.5171          ?        ?      305.8        3.0       ?       ? 
1 1 1   42    7   39 o    132.4    6.0    0.0000   0.0000          ?        ?   175.5934  15.9630          ?        ?      132.4        6.0       ?       ? 
1 1 1   42    7   40 o    197.3    4.0    0.0000   0.0000          ?        ?   389.4982  15.9630          ?        ?      197.3        4.0       ?       ? 
1 1 1   42    7   41 o    419.0    2.6    0.0000   0.0000          ?        ?  1756.5730  21.7097          ?        ?      419.0        2.6       ?       ? 
1 1 1   42    7   42 o     45.6   15.4    0.0000   0.0000          ?        ?    19.7942  16.6016          ?        ?       45.6       15.4       ?       ? 
1 1 1   42    7   43 o    170.7    5.2    0.0000   0.0000          ?        ?   291.8044  17.8786          ?        ?      170.7        5.2       ?       ? 
1 1 1   42    7   44 o    276.2    3.4    0.0000   0.0000          ?        ?   763.6719  18.5171          ?        ?      276.2        3.4       ?       ? 
1 1 1   42    7   45 o    180.5    4.8    0.0000   0.0000          ?        ?   326.2845  17.2401          ?        ?      180.5        4.8       ?       ? 
1 1 1   42    7   46 o     45.3   15.9    0.0000   0.0000          ?        ?    18.5171  17.8786          ?        ?       45.3       15.9       ?       ? 
1 1 1   42    7   47 o    263.8    3.6    0.0000   0.0000          ?        ?   696.6271  19.1556          ?        ?      263.8        3.6       ?       ? 
1 1 1   42    7   48 o    176.5    5.1    0.0000   0.0000          ?        ?   312.2371  17.8786          ?        ?      176.5        5.1       ?       ? 
1 1 1   42    7   49 o    173.2    5.2    0.0000   0.0000          ?        ?   300.7437  17.8786          ?        ?      173.2        5.2       ?       ? 
1 1 1   42    7   50 o    150.5    6.2    0.0000   0.0000          ?        ?   227.3137  18.5171          ?        ?      150.5        6.2       ?       ? 
1 1 1   42    7   51 o    186.8    4.8    0.0000   0.0000          ?        ?   349.9099  17.8786          ?        ?      186.8        4.8       ?       ? 
1 1 1   42    7   52 o     84.0   11.0    0.0000   0.0000          ?        ?    71.5144  18.5171          ?        ?       84.0       11.0       ?       ? 
1 1 1   42    7   53 o     27.8   13.0    0.0000   0.0000          ?        ?   -16.6016  17.8786          ?        ?       27.8       13.0       ?       ? 
1 1 1   42    7   54 o     24.6   11.9    0.0000   0.0000          ?        ?   -31.2876  18.5171          ?        ?       24.6       11.9       ?       ? 
1 1 1   42    7   55 f    104.8    8.8    0.0000   0.0000          ?        ?   111.1028  18.5171          ?        ?      104.8        8.8       ?       ? 
1 1 1   42    7   56 o     25.8   12.4    0.0000   0.0000          ?        ?   -28.7335  19.1556          ?        ?       25.8       12.4       ?       ? 
1 1 1   42    7   57 o     44.7   16.1    0.0000   0.0000          ?        ?    17.8786  18.5171          ?        ?       44.7       16.1       ?       ? 
1 1 1   42    7   58 o    183.2    5.2    0.0000   0.0000          ?        ?   337.1394  19.1556          ?        ?      183.2        5.2       ?       ? 
1 1 1   42    7   59 o    115.6    8.3    0.0000   0.0000          ?        ?   135.3666  19.1556          ?        ?      115.6        8.3       ?       ? 
1 1 1   42    8    0 o    561.4    3.7 3152.3813  41.5039  3152.3813  41.5039  3152.3813  41.5039      561.4      3.7      561.4        3.7     0.0     0.0 
1 1 1   42    8    1 o     52.7   10.1    0.0000   0.0000          ?        ?    28.7335  10.2163          ?        ?       52.7       10.1       ?       ? 
1 1 1   42    8    2 o    236.6    2.8    0.0000   0.0000          ?        ?   559.9835  13.4090          ?        ?      236.6        2.8       ?       ? 
1 1 1   42    8    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    8    4 o    385.4    2.4    0.0000   0.0000          ?        ?  1485.8398  18.5171          ?        ?      385.4        2.4       ?       ? 
1 1 1   42    8    5 f    398.4    2.4    0.0000   0.0000          ?        ?  1587.3647  19.1556          ?        ?      398.4        2.4       ?       ? 
1 1 1   42    8    6 o    249.2    2.7    0.0000   0.0000          ?        ?   621.2816  13.4090          ?        ?      249.2        2.7       ?       ? 
1 1 1   42    8    7 o    309.8    2.6    0.0000   0.0000          ?        ?   959.6980  15.9630          ?        ?      309.8        2.6       ?       ? 
1 1 1   42    8    8 o    823.3    3.3    0.0000   0.0000          ?        ?  6780.4614  54.2743          ?        ?      823.3        3.3       ?       ? 
1 1 1   42    8    9 o   1213.8    4.5    0.0000   0.0000          ?        ? 14739.6328 109.1872          ?        ?     1213.8        4.5       ?       ? 
1 1 1   42    8   10 o    434.4    2.7    0.0000   0.0000          ?        ?  1887.4700  23.6253          ?        ?      434.4        2.7       ?       ? 
1 1 1   42    8   11 o    146.4    3.9    0.0000   0.0000          ?        ?   214.5433  11.4934          ?        ?      146.4        3.9       ?       ? 
1 1 1   42    8   12 o    561.4    2.6    0.0000   0.0000          ?        ?  3152.3813  29.3720          ?        ?      561.4        2.6       ?       ? 
1 1 1   42    8   13 o    424.2    2.4    0.0000   0.0000          ?        ?  1799.3539  20.4327          ?        ?      424.2        2.4       ?       ? 
1 1 1   42    8   14 o    533.1    2.6    0.0000   0.0000          ?        ?  2842.6982  27.4564          ?        ?      533.1        2.6       ?       ? 
1 1 1   42    8   15 o    356.0    2.4    0.0000   0.0000          ?        ?  1267.4655  17.2401          ?        ?      356.0        2.4       ?       ? 
1 1 1   42    8   16 o    254.0    2.8    0.0000   0.0000          ?        ?   645.5453  14.0475          ?        ?      254.0        2.8       ?       ? 
1 1 1   42    8   17 o    582.3    2.7    0.0000   0.0000          ?        ?  3391.8269  31.9261          ?        ?      582.3        2.7       ?       ? 
1 1 1   42    8   18 o    437.3    2.6    0.0000   0.0000          ?        ?  1912.3723  22.3483          ?        ?      437.3        2.6       ?       ? 
1 1 1   42    8   19 o    144.7    4.4    0.0000   0.0000          ?        ?   209.4351  12.7704          ?        ?      144.7        4.4       ?       ? 
1 1 1   42    8   20 o    456.9    2.5    0.0000   0.0000          ?        ?  2087.9658  22.9868          ?        ?      456.9        2.5       ?       ? 
1 1 1   42    8   21 o    416.0    2.5    0.0000   0.0000          ?        ?  1731.0322  20.4327          ?        ?      416.0        2.5       ?       ? 
1 1 1   42    8   22 o    158.6    4.4    0.0000   0.0000          ?        ?   251.5775  14.0475          ?        ?      158.6        4.4       ?       ? 
1 1 1   42    8   23 o     55.8   12.3    0.0000   0.0000          ?        ?    32.5646  13.4090          ?        ?       55.8       12.3       ?       ? 
1 1 1   42    8   24 o    430.9    2.4    0.0000   0.0000          ?        ?  1856.8208  20.4327          ?        ?      430.9        2.4       ?       ? 
1 1 1   42    8   25 o    368.7    2.5    0.0000   0.0000          ?        ?  1359.4125  18.5171          ?        ?      368.7        2.5       ?       ? 
1 1 1   42    8   26 o     86.7    8.5    0.0000   0.0000          ?        ?    75.3456  14.6860          ?        ?       86.7        8.5       ?       ? 
1 1 1   42    8   27 o     16.6    8.4    0.0000   0.0000          ?        ?   -49.8047  14.0475          ?        ?       16.6        8.4       ?       ? 
1 1 1   42    8   28 o    368.7    2.6    0.0000   0.0000          ?        ?  1359.4125  19.1556          ?        ?      368.7        2.6       ?       ? 
1 1 1   42    8   29 f    440.2    2.5    0.0000   0.0000          ?        ?  1938.5518  21.7097          ?        ?      440.2        2.5       ?       ? 
1 1 1   42    8   30 o     43.0   14.1    0.0000   0.0000          ?        ?    17.8786  14.0475          ?        ?       43.0       14.1       ?       ? 
1 1 1   42    8   31 o    226.9    3.2    0.0000   0.0000          ?        ?   515.2869  14.6860          ?        ?      226.9        3.2       ?       ? 
1 1 1   42    8   32 o    201.8    3.8    0.0000   0.0000          ?        ?   407.3768  15.3245          ?        ?      201.8        3.8       ?       ? 
1 1 1   42    8   33 o     46.2   14.0    0.0000   0.0000          ?        ?    21.7097  14.0475          ?        ?       46.2       14.0       ?       ? 
1 1 1   42    8   34 o    196.6    4.1    0.0000   0.0000          ?        ?   386.9441  15.9630          ?        ?      196.6        4.1       ?       ? 
1 1 1   42    8   35 o    196.0    3.9    0.0000   0.0000          ?        ?   384.3900  15.3245          ?        ?      196.0        3.9       ?       ? 
1 1 1   42    8   36 o    411.0    2.6    0.0000   0.0000          ?        ?  1690.1669  21.0712          ?        ?      411.0        2.6       ?       ? 
1 1 1   42    8   37 o    566.7    2.6    0.0000   0.0000          ?        ?  3213.0410  30.0105          ?        ?      566.7        2.6       ?       ? 
1 1 1   42    8   38 o    151.3    5.3    0.0000   0.0000          ?        ?   229.2293  15.9630          ?        ?      151.3        5.3       ?       ? 
1 1 1   42    8   39 o     29.1   12.9    0.0000   0.0000          ?        ?    -4.4697  14.6860          ?        ?       29.1       12.9       ?       ? 
1 1 1   42    8   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    8   41 o    160.5    5.2    0.0000   0.0000          ?        ?   257.9627  16.6016          ?        ?      160.5        5.2       ?       ? 
1 1 1   42    8   42 o    136.4    6.1    0.0000   0.0000          ?        ?   186.4483  16.6016          ?        ?      136.4        6.1       ?       ? 
1 1 1   42    8   43 o    214.6    4.2    0.0000   0.0000          ?        ?   461.0126  17.8786          ?        ?      214.6        4.2       ?       ? 
1 1 1   42    8   44 o    354.3    2.9    0.0000   0.0000          ?        ?  1255.9720  20.4327          ?        ?      354.3        2.9       ?       ? 
1 1 1   42    8   45 o     91.9    9.0    0.0000   0.0000          ?        ?    84.9234  16.6016          ?        ?       91.9        9.0       ?       ? 
1 1 1   42    8   46 o    285.7    3.2    0.0000   0.0000          ?        ?   816.6692  18.5171          ?        ?      285.7        3.2       ?       ? 
1 1 1   42    8   47 o    240.6    3.8    0.0000   0.0000          ?        ?   579.7776  18.5171          ?        ?      240.6        3.8       ?       ? 
1 1 1   42    8   48 f     26.2   12.5    0.0000   0.0000          ?        ?   -24.9023  18.5171          ?        ?       26.2       12.5       ?       ? 
1 1 1   42    8   49 o     71.4   13.9    0.0000   0.0000          ?        ?    53.6358  19.1556          ?        ?       71.4       13.9       ?       ? 
1 1 1   42    8   50 o    226.1    4.1    0.0000   0.0000          ?        ?   512.0943  18.5171          ?        ?      226.1        4.1       ?       ? 
1 1 1   42    8   51 o    283.4    3.6    0.0000   0.0000          ?        ?   804.5372  20.4327          ?        ?      283.4        3.6       ?       ? 
1 1 1   42    8   52 o     41.3   15.9    0.0000   0.0000          ?        ?    12.1319  18.5171          ?        ?       41.3       15.9       ?       ? 
1 1 1   42    8   53 o    119.9    7.7    0.0000   0.0000          ?        ?   144.9444  18.5171          ?        ?      119.9        7.7       ?       ? 
1 1 1   42    8   54 o    184.1    5.2    0.0000   0.0000          ?        ?   340.3320  19.1556          ?        ?      184.1        5.2       ?       ? 
1 1 1   42    8   55 o     20.0   10.1    0.0000   0.0000          ?        ?   -57.4669  18.5171          ?        ?       20.0       10.1       ?       ? 
1 1 1   42    8   56 o    150.7    6.1    0.0000   0.0000          ?        ?   228.5907  18.5171          ?        ?      150.7        6.1       ?       ? 
1 1 1   42    8   57 o    312.0    3.4    0.0000   0.0000          ?        ?   975.6611  21.0712          ?        ?      312.0        3.4       ?       ? 
1 1 1   42    8   58 o    141.9    6.5    0.0000   0.0000          ?        ?   203.0499  18.5171          ?        ?      141.9        6.5       ?       ? 
1 1 1   42    8   59 o     62.9   14.1    0.0000   0.0000          ?        ?    42.7809  17.2401          ?        ?       62.9       14.1       ?       ? 
1 1 1   42    9    0 o    577.0    3.8 3330.5286  44.0580  3330.5286  44.0580  3330.5286  44.0580      577.0      3.8      577.0        3.8     0.0     0.0 
1 1 1   42    9    1 o    539.8    2.5    0.0000   0.0000          ?        ?  2914.2126  27.4564          ?        ?      539.8        2.5       ?       ? 
1 1 1   42    9    2 o    124.5    4.1    0.0000   0.0000          ?        ?   155.1608  10.2163          ?        ?      124.5        4.1       ?       ? 
1 1 1   42    9    3 o    628.7    2.7    0.0000   0.0000          ?        ?  3953.7261  33.8416          ?        ?      628.7        2.7       ?       ? 
1 1 1   42    9    4 f     89.3    5.4    0.0000   0.0000          ?        ?    79.8152   9.5778          ?        ?       89.3        5.4       ?       ? 
1 1 1   42    9    5 o    446.9    2.4    0.0000   0.0000          ?        ?  1997.2955  21.0712          ?        ?      446.9        2.4       ?       ? 
1 1 1   42    9    6 o    121.4    4.2    0.0000   0.0000          ?        ?   147.4985  10.2163          ?        ?      121.4        4.2       ?       ? 
1 1 1   42    9    7 o    512.7    2.7    0.0000   0.0000          ?        ?  2629.4319  28.0950          ?        ?      512.7        2.7       ?       ? 
1 1 1   42    9    8 o    290.4    2.5    0.0000   0.0000          ?        ?   843.4871  14.6860          ?        ?      290.4        2.5       ?       ? 
1 1 1   42    9    9 o    308.9    2.5    0.0000   0.0000          ?        ?   954.5898  15.3245          ?        ?      308.9        2.5       ?       ? 
1 1 1   42    9   10 o     69.6    7.3    0.0000   0.0000          ?        ?    48.5276  10.2163          ?        ?       69.6        7.3       ?       ? 
1 1 1   42    9   11 o    335.5    2.4    0.0000   0.0000          ?        ?  1125.7136  15.9630          ?        ?      335.5        2.4       ?       ? 
1 1 1   42    9   12 o    481.1    2.6    0.0000   0.0000          ?        ?  2315.2795  24.9023          ?        ?      481.1        2.6       ?       ? 
1 1 1   42    9   13 o    100.7    5.7    0.0000   0.0000          ?        ?   101.5249  11.4934          ?        ?      100.7        5.7       ?       ? 
1 1 1   42    9   14 o    167.4    3.6    0.0000   0.0000          ?        ?   280.3110  12.1319          ?        ?      167.4        3.6       ?       ? 
1 1 1   42    9   15 o    387.1    2.4    0.0000   0.0000          ?        ?  1498.6102  18.5171          ?        ?      387.1        2.4       ?       ? 
1 1 1   42    9   16 o    388.8    2.5    0.0000   0.0000          ?        ?  1512.0193  19.1556          ?        ?      388.8        2.5       ?       ? 
1 1 1   42    9   17 o     32.6   12.5    0.0000   0.0000          ?        ?     7.0237  11.4934          ?        ?       32.6       12.5       ?       ? 
1 1 1   42    9   18 o    286.1    2.7    0.0000   0.0000          ?        ?   818.5847  15.3245          ?        ?      286.1        2.7       ?       ? 
1 1 1   42    9   19 o    479.5    2.4    0.0000   0.0000          ?        ?  2299.3164  22.9868          ?        ?      479.5        2.4       ?       ? 
1 1 1   42    9   20 o    291.2    2.7    0.0000   0.0000          ?        ?   847.9567  15.9630          ?        ?      291.2        2.7       ?       ? 
1 1 1   42    9   21 o    153.0    4.6    0.0000   0.0000          ?        ?   234.3374  14.0475          ?        ?      153.0        4.6       ?       ? 
1 1 1   42    9   22 o    272.2    2.7    0.0000   0.0000          ?        ?   741.3236  14.6860          ?        ?      272.2        2.7       ?       ? 
1 1 1   42    9   23 o    161.0    4.2    0.0000   0.0000          ?        ?   259.2398  13.4090          ?        ?      161.0        4.2       ?       ? 
1 1 1   42    9   24 o    218.9    3.2    0.0000   0.0000          ?        ?   479.5297  14.0475          ?        ?      218.9        3.2       ?       ? 
1 1 1   42    9   25 o    393.8    2.4    0.0000   0.0000          ?        ?  1550.9690  19.1556          ?        ?      393.8        2.4       ?       ? 
1 1 1   42    9   26 f    235.1    3.1    0.0000   0.0000          ?        ?   552.9597  14.6860          ?        ?      235.1        3.1       ?       ? 
1 1 1   42    9   27 o    251.5    3.0    0.0000   0.0000          ?        ?   632.7749  15.3245          ?        ?      251.5        3.0       ?       ? 
1 1 1   42    9   28 o    233.3    3.3    0.0000   0.0000          ?        ?   544.6590  15.3245          ?        ?      233.3        3.3       ?       ? 
1 1 1   42    9   29 o    304.5    2.7    0.0000   0.0000          ?        ?   927.7720  16.6016          ?        ?      304.5        2.7       ?       ? 
1 1 1   42    9   30 o    319.0    2.6    0.0000   0.0000          ?        ?  1017.8034  16.6016          ?        ?      319.0        2.6       ?       ? 
1 1 1   42    9   31 o    216.7    3.4    0.0000   0.0000          ?        ?   469.9519  14.6860          ?        ?      216.7        3.4       ?       ? 
1 1 1   42    9   32 o    154.4    5.0    0.0000   0.0000          ?        ?   238.8071  15.3245          ?        ?      154.4        5.0       ?       ? 
1 1 1   42    9   33 o    240.1    3.2    0.0000   0.0000          ?        ?   576.5850  15.3245          ?        ?      240.1        3.2       ?       ? 
1 1 1   42    9   34 o    163.5    4.9    0.0000   0.0000          ?        ?   267.5406  15.9630          ?        ?      163.5        4.9       ?       ? 
1 1 1   42    9   35 f    463.3    2.5    0.0000   0.0000          ?        ?  2147.3481  22.9868          ?        ?      463.3        2.5       ?       ? 
1 1 1   42    9   36 o     69.9   10.5    0.0000   0.0000          ?        ?    49.1662  14.6860          ?        ?       69.9       10.5       ?       ? 
1 1 1   42    9   37 o    117.5    6.8    0.0000   0.0000          ?        ?   138.5592  15.9630          ?        ?      117.5        6.8       ?       ? 
1 1 1   42    9   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    9   39 o     89.5    8.6    0.0000   0.0000          ?        ?    80.4537  15.3245          ?        ?       89.5        8.6       ?       ? 
1 1 1   42    9   40 o    218.6    3.8    0.0000   0.0000          ?        ?   478.2527  16.6016          ?        ?      218.6        3.8       ?       ? 
1 1 1   42    9   41 o    171.3    4.7    0.0000   0.0000          ?        ?   293.7199  15.9630          ?        ?      171.3        4.7       ?       ? 
1 1 1   42    9   42 o    178.9    4.6    0.0000   0.0000          ?        ?   320.5379  16.6016          ?        ?      178.9        4.6       ?       ? 
1 1 1   42    9   43 o    201.2    4.4    0.0000   0.0000          ?        ?   405.4612  17.8786          ?        ?      201.2        4.4       ?       ? 
1 1 1   42    9   44 o     23.1   11.3    0.0000   0.0000          ?        ?   -32.5646  17.2401          ?        ?       23.1       11.3       ?       ? 
1 1 1   42    9   45 o    137.0    6.3    0.0000   0.0000          ?        ?   188.3639  17.2401          ?        ?      137.0        6.3       ?       ? 
1 1 1   42    9   46 o    208.4    4.1    0.0000   0.0000          ?        ?   434.8332  17.2401          ?        ?      208.4        4.1       ?       ? 
1 1 1   42    9   47 o    259.8    3.6    0.0000   0.0000          ?        ?   675.5559  18.5171          ?        ?      259.8        3.6       ?       ? 
1 1 1   42    9   48 o    140.6    6.4    0.0000   0.0000          ?        ?   198.5802  17.8786          ?        ?      140.6        6.4       ?       ? 
1 1 1   42    9   49 o    293.5    3.5    0.0000   0.0000          ?        ?   862.6428  20.4327          ?        ?      293.5        3.5       ?       ? 
1 1 1   42    9   50 o    166.0    5.8    0.0000   0.0000          ?        ?   276.4799  19.1556          ?        ?      166.0        5.8       ?       ? 
1 1 1   42    9   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42    9   52 o    132.8    7.0    0.0000   0.0000          ?        ?   177.5090  18.5171          ?        ?      132.8        7.0       ?       ? 
1 1 1   42    9   53 o    120.9    7.9    0.0000   0.0000          ?        ?   147.4985  19.1556          ?        ?      120.9        7.9       ?       ? 
1 1 1   42    9   54 o    268.7    3.7    0.0000   0.0000          ?        ?   723.4450  19.7942          ?        ?      268.7        3.7       ?       ? 
1 1 1   42    9   55 o     58.2   15.6    0.0000   0.0000          ?        ?    36.3957  18.5171          ?        ?       58.2       15.6       ?       ? 
1 1 1   42    9   56 o    180.6    5.1    0.0000   0.0000          ?        ?   327.5616  18.5171          ?        ?      180.6        5.1       ?       ? 
1 1 1   42    9   57 o    156.0    6.3    0.0000   0.0000          ?        ?   245.1923  19.7942          ?        ?      156.0        6.3       ?       ? 
1 1 1   42    9   58 o     62.4   14.6    0.0000   0.0000          ?        ?    42.1424  17.8786          ?        ?       62.4       14.6       ?       ? 
1 1 1   42   10    0 o    620.0    4.1 3845.1772  51.0817  3845.1772  51.0817  3845.1772  51.0817      620.0      4.1      620.0        4.1     0.0     0.0 
1 1 1   42   10    1 o    516.9    2.7    0.0000   0.0000          ?        ?  2672.2129  27.4564          ?        ?      516.9        2.7       ?       ? 
1 1 1   42   10    2 o    499.9    2.6    0.0000   0.0000          ?        ?  2499.1736  26.1794          ?        ?      499.9        2.6       ?       ? 
1 1 1   42   10    3 o    458.9    2.5    0.0000   0.0000          ?        ?  2106.4829  22.9868          ?        ?      458.9        2.5       ?       ? 
1 1 1   42   10    4 o    546.5    2.7    0.0000   0.0000          ?        ?  2987.0042  29.3720          ?        ?      546.5        2.7       ?       ? 
1 1 1   42   10    5 o    276.7    2.4    0.0000   0.0000          ?        ?   765.5875  13.4090          ?        ?      276.7        2.4       ?       ? 
1 1 1   42   10    6 o    496.0    2.6    0.0000   0.0000          ?        ?  2460.2236  25.5409          ?        ?      496.0        2.6       ?       ? 
1 1 1   42   10    7 o    364.8    2.5    0.0000   0.0000          ?        ?  1331.3176  17.8786          ?        ?      364.8        2.5       ?       ? 
1 1 1   42   10    8 o    359.1    2.5    0.0000   0.0000          ?        ?  1289.8137  17.8786          ?        ?      359.1        2.5       ?       ? 
1 1 1   42   10    9 o    154.1    3.9    0.0000   0.0000          ?        ?   237.5300  12.1319          ?        ?      154.1        3.9       ?       ? 
1 1 1   42   10   10 o    765.9    3.2    0.0000   0.0000          ?        ?  5867.3755  48.5276          ?        ?      765.9        3.2       ?       ? 
1 1 1   42   10   11 o     66.3    8.2    0.0000   0.0000          ?        ?    44.0580  10.8549          ?        ?       66.3        8.2       ?       ? 
1 1 1   42   10   12 o    118.8    4.6    0.0000   0.0000          ?        ?   141.1133  10.8549          ?        ?      118.8        4.6       ?       ? 
1 1 1   42   10   13 o    163.1    3.5    0.0000   0.0000          ?        ?   266.2635  11.4934          ?        ?      163.1        3.5       ?       ? 
1 1 1   42   10   14 o     35.1   13.0    0.0000   0.0000          ?        ?     9.5778  12.1319          ?        ?       35.1       13.0       ?       ? 
1 1 1   42   10   15 o    505.1    2.7    0.0000   0.0000          ?        ?  2552.1709  26.8179          ?        ?      505.1        2.7       ?       ? 
1 1 1   42   10   16 o    101.3    5.7    0.0000   0.0000          ?        ?   102.8020  11.4934          ?        ?      101.3        5.7       ?       ? 
1 1 1   42   10   17 o    625.2    3.0    0.0000   0.0000          ?        ?  3910.3066  37.0343          ?        ?      625.2        3.0       ?       ? 
1 1 1   42   10   18 o    363.7    2.5    0.0000   0.0000          ?        ?  1323.0168  18.5171          ?        ?      363.7        2.5       ?       ? 
1 1 1   42   10   19 o    389.6    2.5    0.0000   0.0000          ?        ?  1518.4044  19.1556          ?        ?      389.6        2.5       ?       ? 
1 1 1   42   10   20 o    324.7    2.5    0.0000   0.0000          ?        ?  1054.8376  15.9630          ?        ?      324.7        2.5       ?       ? 
1 1 1   42   10   21 o    319.2    2.5    0.0000   0.0000          ?        ?  1019.0806  15.9630          ?        ?      319.2        2.5       ?       ? 
1 1 1   42   10   22 o    215.0    3.3    0.0000   0.0000          ?        ?   462.2897  14.0475          ?        ?      215.0        3.3       ?       ? 
1 1 1   42   10   23 o    500.8    2.5    0.0000   0.0000          ?        ?  2508.1128  24.9023          ?        ?      500.8        2.5       ?       ? 
1 1 1   42   10   24 o     45.9   14.4    0.0000   0.0000          ?        ?    21.0712  14.6860          ?        ?       45.9       14.4       ?       ? 
1 1 1   42   10   25 o    346.6    2.5    0.0000   0.0000          ?        ?  1201.6976  17.2401          ?        ?      346.6        2.5       ?       ? 
1 1 1   42   10   26 o    165.4    4.2    0.0000   0.0000          ?        ?   273.9258  14.0475          ?        ?      165.4        4.2       ?       ? 
1 1 1   42   10   27 o    167.2    4.4    0.0000   0.0000          ?        ?   279.6725  14.6860          ?        ?      167.2        4.4       ?       ? 
1 1 1   42   10   28 o     30.7   13.1    0.0000   0.0000          ?        ?     0.0000  14.0475          ?        ?       30.7       13.1       ?       ? 
1 1 1   42   10   29 o    216.7    3.4    0.0000   0.0000          ?        ?   469.9519  14.6860          ?        ?      216.7        3.4       ?       ? 
1 1 1   42   10   30 o    282.8    2.8    0.0000   0.0000          ?        ?   800.0676  15.9630          ?        ?      282.8        2.8       ?       ? 
1 1 1   42   10   31 o     32.9   13.4    0.0000   0.0000          ?        ?     3.8311  14.0475          ?        ?       32.9       13.4       ?       ? 
1 1 1   42   10   32 o     28.1   12.5    0.0000   0.0000          ?        ?    -5.1082  14.0475          ?        ?       28.1       12.5       ?       ? 
1 1 1   42   10   33 f     19.2    9.5    0.0000   0.0000          ?        ?   -38.3113  14.6860          ?        ?       19.2        9.5       ?       ? 
1 1 1   42   10   34 o    216.4    3.5    0.0000   0.0000          ?        ?   468.6749  15.3245          ?        ?      216.4        3.5       ?       ? 
1 1 1   42   10   35 o    126.2    6.3    0.0000   0.0000          ?        ?   159.6304  15.9630          ?        ?      126.2        6.3       ?       ? 
1 1 1   42   10   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   10   37 o    210.7    3.8    0.0000   0.0000          ?        ?   444.4110  15.9630          ?        ?      210.7        3.8       ?       ? 
1 1 1   42   10   38 o    307.6    2.9    0.0000   0.0000          ?        ?   946.9276  17.8786          ?        ?      307.6        2.9       ?       ? 
1 1 1   42   10   39 o    298.6    3.1    0.0000   0.0000          ?        ?   892.0147  18.5171          ?        ?      298.6        3.1       ?       ? 
1 1 1   42   10   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   10   41 o    403.8    2.7    0.0000   0.0000          ?        ?  1631.4227  21.7097          ?        ?      403.8        2.7       ?       ? 
1 1 1   42   10   42 o    178.0    4.7    0.0000   0.0000          ?        ?   317.3452  16.6016          ?        ?      178.0        4.7       ?       ? 
1 1 1   42   10   43 o     18.7    9.5    0.0000   0.0000          ?        ?   -58.7440  17.2401          ?        ?       18.7        9.5       ?       ? 
1 1 1   42   10   44 o     75.9   10.9    0.0000   0.0000          ?        ?    58.1055  16.6016          ?        ?       75.9       10.9       ?       ? 
1 1 1   42   10   45 o     41.0   15.4    0.0000   0.0000          ?        ?    12.7704  17.2401          ?        ?       41.0       15.4       ?       ? 
1 1 1   42   10   46 o    274.9    3.6    0.0000   0.0000          ?        ?   756.6481  19.7942          ?        ?      274.9        3.6       ?       ? 
1 1 1   42   10   47 o     22.8   11.2    0.0000   0.0000          ?        ?   -33.8416  17.2401          ?        ?       22.8       11.2       ?       ? 
1 1 1   42   10   48 o    147.7    6.1    0.0000   0.0000          ?        ?   219.0129  17.8786          ?        ?      147.7        6.1       ?       ? 
1 1 1   42   10   49 o    144.0    6.4    0.0000   0.0000          ?        ?   208.1580  18.5171          ?        ?      144.0        6.4       ?       ? 
1 1 1   42   10   50 f    335.9    3.1    0.0000   0.0000          ?        ?  1129.5447  21.0712          ?        ?      335.9        3.1       ?       ? 
1 1 1   42   10   51 f    226.7    4.2    0.0000   0.0000          ?        ?   515.2869  19.1556          ?        ?      226.7        4.2       ?       ? 
1 1 1   42   10   52 o    179.4    5.3    0.0000   0.0000          ?        ?   323.0919  19.1556          ?        ?      179.4        5.3       ?       ? 
1 1 1   42   10   53 o     84.3   10.6    0.0000   0.0000          ?        ?    72.1529  17.8786          ?        ?       84.3       10.6       ?       ? 
1 1 1   42   10   54 o    173.0    5.4    0.0000   0.0000          ?        ?   300.7437  18.5171          ?        ?      173.0        5.4       ?       ? 
1 1 1   42   10   55 o     81.4   11.4    0.0000   0.0000          ?        ?    67.6833  18.5171          ?        ?       81.4       11.4       ?       ? 
1 1 1   42   10   56 o    110.6    8.4    0.0000   0.0000          ?        ?   123.8732  18.5171          ?        ?      110.6        8.4       ?       ? 
1 1 1   42   10   57 o    178.5    5.2    0.0000   0.0000          ?        ?   320.5379  18.5171          ?        ?      178.5        5.2       ?       ? 
1 1 1   42   11    0 o     31.6   16.5   14.6860  13.4090    14.6860  13.4090    14.6860  13.4090       31.6     16.5       31.6       16.5     0.0     0.0 
1 1 1   42   11    1 o    486.2    2.4    0.0000   0.0000          ?        ?  2364.4456  23.6253          ?        ?      486.2        2.4       ?       ? 
1 1 1   42   11    2 o    201.0    2.9    0.0000   0.0000          ?        ?   404.1842  11.4934          ?        ?      201.0        2.9       ?       ? 
1 1 1   42   11    3 o    185.5    2.9    0.0000   0.0000          ?        ?   344.1632  10.8549          ?        ?      185.5        2.9       ?       ? 
1 1 1   42   11    4 o    393.9    2.4    0.0000   0.0000          ?        ?  1551.6075  18.5171          ?        ?      393.9        2.4       ?       ? 
1 1 1   42   11    5 o    166.6    3.1    0.0000   0.0000          ?        ?   277.7569  10.2163          ?        ?      166.6        3.1       ?       ? 
1 1 1   42   11    6 o    486.7    2.6    0.0000   0.0000          ?        ?  2369.5537  24.9023          ?        ?      486.7        2.6       ?       ? 
1 1 1   42   11    7 o    359.5    2.4    0.0000   0.0000          ?        ?  1292.3677  17.2401          ?        ?      359.5        2.4       ?       ? 
1 1 1   42   11    8 o    401.4    2.4    0.0000   0.0000          ?        ?  1611.6285  19.1556          ?        ?      401.4        2.4       ?       ? 
1 1 1   42   11    9 o    216.9    2.8    0.0000   0.0000          ?        ?   470.5904  12.1319          ?        ?      216.9        2.8       ?       ? 
1 1 1   42   11   10 o    329.9    2.3    0.0000   0.0000          ?        ?  1088.6793  15.3245          ?        ?      329.9        2.3       ?       ? 
1 1 1   42   11   11 o    164.1    3.5    0.0000   0.0000          ?        ?   269.4561  11.4934          ?        ?      164.1        3.5       ?       ? 
1 1 1   42   11   12 o    206.2    2.9    0.0000   0.0000          ?        ?   425.2554  12.1319          ?        ?      206.2        2.9       ?       ? 
1 1 1   42   11   13 o    105.1    5.2    0.0000   0.0000          ?        ?   110.4642  10.8549          ?        ?      105.1        5.2       ?       ? 
1 1 1   42   11   14 o     95.8    6.0    0.0000   0.0000          ?        ?    91.9471  11.4934          ?        ?       95.8        6.0       ?       ? 
1 1 1   42   11   15 o    661.9    2.8    0.0000   0.0000          ?        ?  4382.1738  37.6728          ?        ?      661.9        2.8       ?       ? 
1 1 1   42   11   16 o    317.3    2.5    0.0000   0.0000          ?        ?  1006.9486  15.9630          ?        ?      317.3        2.5       ?       ? 
1 1 1   42   11   17 o    530.2    2.7    0.0000   0.0000          ?        ?  2811.4106  28.7335          ?        ?      530.2        2.7       ?       ? 
1 1 1   42   11   18 o    196.3    3.4    0.0000   0.0000          ?        ?   385.6671  13.4090          ?        ?      196.3        3.4       ?       ? 
1 1 1   42   11   19 o    127.5    5.0    0.0000   0.0000          ?        ?   162.8230  12.7704          ?        ?      127.5        5.0       ?       ? 
1 1 1   42   11   20 o     21.3   10.3    0.0000   0.0000          ?        ?   -21.7097  13.4090          ?        ?       21.3       10.3       ?       ? 
1 1 1   42   11   21 o    261.8    2.8    0.0000   0.0000          ?        ?   685.7722  14.6860          ?        ?      261.8        2.8       ?       ? 
1 1 1   42   11   22 o    137.2    4.9    0.0000   0.0000          ?        ?   188.3639  13.4090          ?        ?      137.2        4.9       ?       ? 
1 1 1   42   11   23 o    201.5    3.5    0.0000   0.0000          ?        ?   406.0997  14.0475          ?        ?      201.5        3.5       ?       ? 
1 1 1   42   11   24 f    800.9    3.3    0.0000   0.0000          ?        ?  6417.1426  52.9973          ?        ?      800.9        3.3       ?       ? 
1 1 1   42   11   25 o     98.7    7.4    0.0000   0.0000          ?        ?    97.6938  14.6860          ?        ?       98.7        7.4       ?       ? 
1 1 1   42   11   26 o    159.0    4.2    0.0000   0.0000          ?        ?   252.8546  13.4090          ?        ?      159.0        4.2       ?       ? 
1 1 1   42   11   27 f    381.7    2.6    0.0000   0.0000          ?        ?  1457.1063  19.7942          ?        ?      381.7        2.6       ?       ? 
1 1 1   42   11   28 o    297.3    2.8    0.0000   0.0000          ?        ?   884.3525  16.6016          ?        ?      297.3        2.8       ?       ? 
1 1 1   42   11   29 o    222.2    3.4    0.0000   0.0000          ?        ?   494.2158  15.3245          ?        ?      222.2        3.4       ?       ? 
1 1 1   42   11   30 o    451.2    2.5    0.0000   0.0000          ?        ?  2036.2455  22.9868          ?        ?      451.2        2.5       ?       ? 
1 1 1   42   11   31 o     69.9   10.0    0.0000   0.0000          ?        ?    49.1662  14.0475          ?        ?       69.9       10.0       ?       ? 
1 1 1   42   11   32 o    255.9    3.1    0.0000   0.0000          ?        ?   655.1232  15.9630          ?        ?      255.9        3.1       ?       ? 
1 1 1   42   11   33 o     17.8    9.0    0.0000   0.0000          ?        ?   -51.0817  15.3245          ?        ?       17.8        9.0       ?       ? 
1 1 1   42   11   34 o    193.4    3.8    0.0000   0.0000          ?        ?   374.1737  14.6860          ?        ?      193.4        3.8       ?       ? 
1 1 1   42   11   35 o    357.5    2.8    0.0000   0.0000          ?        ?  1278.3203  19.7942          ?        ?      357.5        2.8       ?       ? 
1 1 1   42   11   36 o     63.0   12.6    0.0000   0.0000          ?        ?    41.5039  15.3245          ?        ?       63.0       12.6       ?       ? 
1 1 1   42   11   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   11   38 o     25.3   11.9    0.0000   0.0000          ?        ?   -15.9630  15.3245          ?        ?       25.3       11.9       ?       ? 
1 1 1   42   11   39 o     78.4   10.6    0.0000   0.0000          ?        ?    61.9366  16.6016          ?        ?       78.4       10.6       ?       ? 
1 1 1   42   11   40 f    222.2    3.7    0.0000   0.0000          ?        ?   494.2158  16.6016          ?        ?      222.2        3.7       ?       ? 
1 1 1   42   11   41 o     41.1   15.2    0.0000   0.0000          ?        ?    13.4090  16.6016          ?        ?       41.1       15.2       ?       ? 
1 1 1   42   11   42 o    249.1    3.5    0.0000   0.0000          ?        ?   621.2816  17.2401          ?        ?      249.1        3.5       ?       ? 
1 1 1   42   11   43 o    140.7    6.1    0.0000   0.0000          ?        ?   198.5802  17.2401          ?        ?      140.7        6.1       ?       ? 
1 1 1   42   11   44 o    213.7    4.2    0.0000   0.0000          ?        ?   457.1815  17.8786          ?        ?      213.7        4.2       ?       ? 
1 1 1   42   11   45 o     38.4   15.4    0.0000   0.0000          ?        ?     7.6623  17.8786          ?        ?       38.4       15.4       ?       ? 
1 1 1   42   11   46 o    102.0    8.8    0.0000   0.0000          ?        ?   104.7175  17.8786          ?        ?      102.0        8.8       ?       ? 
1 1 1   42   11   47 o    181.6    4.9    0.0000   0.0000          ?        ?   330.7542  17.8786          ?        ?      181.6        4.9       ?       ? 
1 1 1   42   11   48 o    206.0    4.5    0.0000   0.0000          ?        ?   425.2554  18.5171          ?        ?      206.0        4.5       ?       ? 
1 1 1   42   11   49 o    203.2    4.6    0.0000   0.0000          ?        ?   413.7620  18.5171          ?        ?      203.2        4.6       ?       ? 
1 1 1   42   11   50 o    199.2    4.6    0.0000   0.0000          ?        ?   397.7990  18.5171          ?        ?      199.2        4.6       ?       ? 
1 1 1   42   11   51 o    194.1    4.8    0.0000   0.0000          ?        ?   378.0048  18.5171          ?        ?      194.1        4.8       ?       ? 
1 1 1   42   11   52 o    126.4    7.1    0.0000   0.0000          ?        ?   160.9075  17.8786          ?        ?      126.4        7.1       ?       ? 
1 1 1   42   11   53 o    160.0    5.6    0.0000   0.0000          ?        ?   257.3242  17.8786          ?        ?      160.0        5.6       ?       ? 
1 1 1   42   11   54 o     20.1   10.1    0.0000   0.0000          ?        ?   -47.8891  17.2401          ?        ?       20.1       10.1       ?       ? 
1 1 1   42   11   55 o     18.0    9.2    0.0000   0.0000          ?        ?   -63.2136  17.2401          ?        ?       18.0        9.2       ?       ? 
1 1 1   42   11   56 o    108.2    8.3    0.0000   0.0000          ?        ?   118.7650  17.8786          ?        ?      108.2        8.3       ?       ? 
1 1 1   42   12    0 o    341.6    3.3 1167.2175  22.3483  1167.2175  22.3483  1167.2175  22.3483      341.6      3.3      341.6        3.3     0.0     0.0 
1 1 1   42   12    1 o    234.9    2.4    0.0000   0.0000          ?        ?   551.6827  11.4934          ?        ?      234.9        2.4       ?       ? 
1 1 1   42   12    2 o    213.8    2.5    0.0000   0.0000          ?        ?   457.1815  10.8549          ?        ?      213.8        2.5       ?       ? 
1 1 1   42   12    3 o    282.7    2.3    0.0000   0.0000          ?        ?   799.4291  12.7704          ?        ?      282.7        2.3       ?       ? 
1 1 1   42   12    4 o    428.8    2.4    0.0000   0.0000          ?        ?  1838.9423  20.4327          ?        ?      428.8        2.4       ?       ? 
1 1 1   42   12    5 o    507.9    2.5    0.0000   0.0000          ?        ?  2580.2659  25.5409          ?        ?      507.9        2.5       ?       ? 
1 1 1   42   12    6 o    430.0    2.5    0.0000   0.0000          ?        ?  1849.1587  21.7097          ?        ?      430.0        2.5       ?       ? 
1 1 1   42   12    7 o    283.5    2.5    0.0000   0.0000          ?        ?   803.8987  14.0475          ?        ?      283.5        2.5       ?       ? 
1 1 1   42   12    8 o    449.8    2.6    0.0000   0.0000          ?        ?  2023.4750  22.9868          ?        ?      449.8        2.6       ?       ? 
1 1 1   42   12    9 o    405.1    2.4    0.0000   0.0000          ?        ?  1641.6392  19.7942          ?        ?      405.1        2.4       ?       ? 
1 1 1   42   12   10 o    433.4    2.4    0.0000   0.0000          ?        ?  1878.5308  21.0712          ?        ?      433.4        2.4       ?       ? 
1 1 1   42   12   11 o    458.9    2.4    0.0000   0.0000          ?        ?  2106.4829  22.3483          ?        ?      458.9        2.4       ?       ? 
1 1 1   42   12   12 f    379.2    2.4    0.0000   0.0000          ?        ?  1437.9507  17.8786          ?        ?      379.2        2.4       ?       ? 
1 1 1   42   12   13 o    147.3    3.9    0.0000   0.0000          ?        ?   217.0974  11.4934          ?        ?      147.3        3.9       ?       ? 
1 1 1   42   12   14 o    165.8    3.9    0.0000   0.0000          ?        ?   275.2028  12.7704          ?        ?      165.8        3.9       ?       ? 
1 1 1   42   12   15 o    220.6    2.8    0.0000   0.0000          ?        ?   486.5535  12.1319          ?        ?      220.6        2.8       ?       ? 
1 1 1   42   12   16 o    369.1    2.4    0.0000   0.0000          ?        ?  1362.6051  17.8786          ?        ?      369.1        2.4       ?       ? 
1 1 1   42   12   17 o    342.4    2.4    0.0000   0.0000          ?        ?  1172.9642  16.6016          ?        ?      342.4        2.4       ?       ? 
1 1 1   42   12   18 o    377.1    2.5    0.0000   0.0000          ?        ?  1422.6262  18.5171          ?        ?      377.1        2.5       ?       ? 
1 1 1   42   12   19 f    302.0    2.5    0.0000   0.0000          ?        ?   912.4474  15.3245          ?        ?      302.0        2.5       ?       ? 
1 1 1   42   12   20 o    295.8    2.7    0.0000   0.0000          ?        ?   875.4132  15.9630          ?        ?      295.8        2.7       ?       ? 
1 1 1   42   12   21 f    253.8    2.9    0.0000   0.0000          ?        ?   644.2683  14.6860          ?        ?      253.8        2.9       ?       ? 
1 1 1   42   12   22 o    294.7    2.7    0.0000   0.0000          ?        ?   869.0280  15.9630          ?        ?      294.7        2.7       ?       ? 
1 1 1   42   12   23 o    315.3    2.7    0.0000   0.0000          ?        ?   994.1782  17.2401          ?        ?      315.3        2.7       ?       ? 
1 1 1   42   12   24 o    288.0    2.8    0.0000   0.0000          ?        ?   829.4396  15.9630          ?        ?      288.0        2.8       ?       ? 
1 1 1   42   12   25 o    268.7    2.9    0.0000   0.0000          ?        ?   722.1680  15.3245          ?        ?      268.7        2.9       ?       ? 
1 1 1   42   12   26 o     74.0    8.6    0.0000   0.0000          ?        ?    54.9129  12.7704          ?        ?       74.0        8.6       ?       ? 
1 1 1   42   12   27 o    157.1    4.5    0.0000   0.0000          ?        ?   247.1079  14.0475          ?        ?      157.1        4.5       ?       ? 
1 1 1   42   12   28 o    130.0    5.6    0.0000   0.0000          ?        ?   169.2082  14.6860          ?        ?      130.0        5.6       ?       ? 
1 1 1   42   12   29 o    546.3    2.6    0.0000   0.0000          ?        ?  2985.7271  28.0950          ?        ?      546.3        2.6       ?       ? 
1 1 1   42   12   30 o     78.5    8.9    0.0000   0.0000          ?        ?    61.9366  14.0475          ?        ?       78.5        8.9       ?       ? 
1 1 1   42   12   31 f    387.0    2.6    0.0000   0.0000          ?        ?  1497.9718  19.7942          ?        ?      387.0        2.6       ?       ? 
1 1 1   42   12   32 o    135.2    5.7    0.0000   0.0000          ?        ?   183.2557  15.3245          ?        ?      135.2        5.7       ?       ? 
1 1 1   42   12   33 o    283.5    3.0    0.0000   0.0000          ?        ?   803.8987  17.2401          ?        ?      283.5        3.0       ?       ? 
1 1 1   42   12   34 o    208.4    3.8    0.0000   0.0000          ?        ?   434.8332  15.9630          ?        ?      208.4        3.8       ?       ? 
1 1 1   42   12   35 o     89.1    9.0    0.0000   0.0000          ?        ?    79.8152  15.9630          ?        ?       89.1        9.0       ?       ? 
1 1 1   42   12   36 o    403.7    2.7    0.0000   0.0000          ?        ?  1630.1458  21.7097          ?        ?      403.7        2.7       ?       ? 
1 1 1   42   12   37 o    198.5    4.0    0.0000   0.0000          ?        ?   394.6064  15.9630          ?        ?      198.5        4.0       ?       ? 
1 1 1   42   12   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   12   39 o     63.3   13.5    0.0000   0.0000          ?        ?    42.1424  16.6016          ?        ?       63.3       13.5       ?       ? 
1 1 1   42   12   40 o    108.8    7.3    0.0000   0.0000          ?        ?   118.7650  15.9630          ?        ?      108.8        7.3       ?       ? 
1 1 1   42   12   41 o    338.3    2.9    0.0000   0.0000          ?        ?  1145.5078  19.7942          ?        ?      338.3        2.9       ?       ? 
1 1 1   42   12   42 o    251.3    3.7    0.0000   0.0000          ?        ?   632.1364  18.5171          ?        ?      251.3        3.7       ?       ? 
1 1 1   42   12   43 o    286.3    3.3    0.0000   0.0000          ?        ?   820.5003  19.1556          ?        ?      286.3        3.3       ?       ? 
1 1 1   42   12   44 o    428.3    2.7    0.0000   0.0000          ?        ?  1835.7496  22.9868          ?        ?      428.3        2.7       ?       ? 
1 1 1   42   12   45 o     44.3   15.9    0.0000   0.0000          ?        ?    17.2401  17.8786          ?        ?       44.3       15.9       ?       ? 
1 1 1   42   12   46 o    255.5    3.7    0.0000   0.0000          ?        ?   653.8461  19.1556          ?        ?      255.5        3.7       ?       ? 
1 1 1   42   12   47 o     98.7    9.4    0.0000   0.0000          ?        ?    98.3323  18.5171          ?        ?       98.7        9.4       ?       ? 
1 1 1   42   12   48 o    312.4    3.4    0.0000   0.0000          ?        ?   976.9381  21.0712          ?        ?      312.4        3.4       ?       ? 
1 1 1   42   12   49 o    179.5    5.2    0.0000   0.0000          ?        ?   323.0919  18.5171          ?        ?      179.5        5.2       ?       ? 
1 1 1   42   12   50 o    176.7    5.4    0.0000   0.0000          ?        ?   313.5141  19.1556          ?        ?      176.7        5.4       ?       ? 
1 1 1   42   12   51 o    197.0    4.7    0.0000   0.0000          ?        ?   389.4982  18.5171          ?        ?      197.0        4.7       ?       ? 
1 1 1   42   12   52 o     44.0   15.9    0.0000   0.0000          ?        ?    17.2401  17.8786          ?        ?       44.0       15.9       ?       ? 
1 1 1   42   12   53 o    108.9    8.5    0.0000   0.0000          ?        ?   120.0421  18.5171          ?        ?      108.9        8.5       ?       ? 
1 1 1   42   12   54 o     19.5    9.9    0.0000   0.0000          ?        ?   -61.2981  18.5171          ?        ?       19.5        9.9       ?       ? 
1 1 1   42   12   55 o    309.6    3.2    0.0000   0.0000          ?        ?   960.3365  19.7942          ?        ?      309.6        3.2       ?       ? 
1 1 1   42   13    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   13    1 o    287.1    2.3    0.0000   0.0000          ?        ?   824.3315  13.4090          ?        ?      287.1        2.3       ?       ? 
1 1 1   42   13    2 o    325.4    2.4    0.0000   0.0000          ?        ?  1059.3074  15.3245          ?        ?      325.4        2.4       ?       ? 
1 1 1   42   13    3 f    470.2    2.6    0.0000   0.0000          ?        ?  2211.2002  24.2638          ?        ?      470.2        2.6       ?       ? 
1 1 1   42   13    4 o    297.2    2.4    0.0000   0.0000          ?        ?   883.7139  14.0475          ?        ?      297.2        2.4       ?       ? 
1 1 1   42   13    5 o    413.2    2.4    0.0000   0.0000          ?        ?  1707.4067  19.7942          ?        ?      413.2        2.4       ?       ? 
1 1 1   42   13    6 o    507.8    2.5    0.0000   0.0000          ?        ?  2578.9888  24.9023          ?        ?      507.8        2.5       ?       ? 
1 1 1   42   13    7 o    167.2    3.1    0.0000   0.0000          ?        ?   279.6725  10.2163          ?        ?      167.2        3.1       ?       ? 
1 1 1   42   13    8 o    390.6    2.4    0.0000   0.0000          ?        ?  1526.0667  18.5171          ?        ?      390.6        2.4       ?       ? 
1 1 1   42   13    9 o    441.3    2.5    0.0000   0.0000          ?        ?  1947.4910  21.7097          ?        ?      441.3        2.5       ?       ? 
1 1 1   42   13   10 o    168.9    3.2    0.0000   0.0000          ?        ?   285.4192  10.8549          ?        ?      168.9        3.2       ?       ? 
1 1 1   42   13   11 o    373.1    2.4    0.0000   0.0000          ?        ?  1392.6157  17.8786          ?        ?      373.1        2.4       ?       ? 
1 1 1   42   13   12 o     14.7    7.4    0.0000   0.0000          ?        ?   -38.3113  10.8549          ?        ?       14.7        7.4       ?       ? 
1 1 1   42   13   13 o    101.7    5.0    0.0000   0.0000          ?        ?   103.4405  10.2163          ?        ?      101.7        5.0       ?       ? 
1 1 1   42   13   14 o     32.5   12.3    0.0000   0.0000          ?        ?     7.6623  10.8549          ?        ?       32.5       12.3       ?       ? 
1 1 1   42   13   15 o    210.2    3.0    0.0000   0.0000          ?        ?   441.8569  12.7704          ?        ?      210.2        3.0       ?       ? 
1 1 1   42   13   16 o    557.9    2.9    0.0000   0.0000          ?        ?  3113.4314  32.5646          ?        ?      557.9        2.9       ?       ? 
1 1 1   42   13   17 o    191.1    3.3    0.0000   0.0000          ?        ?   365.2344  12.7704          ?        ?      191.1        3.3       ?       ? 
1 1 1   42   13   18 o    459.9    2.6    0.0000   0.0000          ?        ?  2115.4221  24.2638          ?        ?      459.9        2.6       ?       ? 
1 1 1   42   13   19 o    513.6    2.6    0.0000   0.0000          ?        ?  2638.3713  26.8179          ?        ?      513.6        2.6       ?       ? 
1 1 1   42   13   20 o    483.0    2.6    0.0000   0.0000          ?        ?  2333.1580  25.5409          ?        ?      483.0        2.6       ?       ? 
1 1 1   42   13   21 o     66.3    9.2    0.0000   0.0000          ?        ?    44.0580  12.1319          ?        ?       66.3        9.2       ?       ? 
1 1 1   42   13   22 o    181.1    3.7    0.0000   0.0000          ?        ?   328.2001  13.4090          ?        ?      181.1        3.7       ?       ? 
1 1 1   42   13   23 o     25.7   11.6    0.0000   0.0000          ?        ?    -7.0237  12.7704          ?        ?       25.7       11.6       ?       ? 
1 1 1   42   13   24 o    144.7    4.4    0.0000   0.0000          ?        ?   209.4351  12.7704          ?        ?      144.7        4.4       ?       ? 
1 1 1   42   13   25 o    246.9    2.8    0.0000   0.0000          ?        ?   609.7881  14.0475          ?        ?      246.9        2.8       ?       ? 
1 1 1   42   13   26 o    176.8    4.0    0.0000   0.0000          ?        ?   312.8756  14.0475          ?        ?      176.8        4.0       ?       ? 
1 1 1   42   13   27 o     41.3   13.5    0.0000   0.0000          ?        ?    16.6016  12.7704          ?        ?       41.3       13.5       ?       ? 
1 1 1   42   13   28 o     47.1   13.5    0.0000   0.0000          ?        ?    22.9868  13.4090          ?        ?       47.1       13.5       ?       ? 
1 1 1   42   13   29 o    386.0    2.6    0.0000   0.0000          ?        ?  1490.3094  19.7942          ?        ?      386.0        2.6       ?       ? 
1 1 1   42   13   30 o     72.2    9.7    0.0000   0.0000          ?        ?    52.3588  14.0475          ?        ?       72.2        9.7       ?       ? 
1 1 1   42   13   31 o    172.2    4.3    0.0000   0.0000          ?        ?   296.9126  14.6860          ?        ?      172.2        4.3       ?       ? 
1 1 1   42   13   32 o     41.6   14.7    0.0000   0.0000          ?        ?    15.3245  15.3245          ?        ?       41.6       14.7       ?       ? 
1 1 1   42   13   33 o    101.2    7.6    0.0000   0.0000          ?        ?   102.8020  15.3245          ?        ?      101.2        7.6       ?       ? 
1 1 1   42   13   34 o    334.8    2.9    0.0000   0.0000          ?        ?  1121.2440  19.1556          ?        ?      334.8        2.9       ?       ? 
1 1 1   42   13   35 o     34.3   14.2    0.0000   0.0000          ?        ?     3.1926  15.9630          ?        ?       34.3       14.2       ?       ? 
1 1 1   42   13   36 o    260.0    3.6    0.0000   0.0000          ?        ?   676.8329  18.5171          ?        ?      260.0        3.6       ?       ? 
1 1 1   42   13   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   13   38 f    513.6    2.6    0.0000   0.0000          ?        ?  2639.6484  26.8179          ?        ?      513.6        2.6       ?       ? 
1 1 1   42   13   39 o    239.2    3.6    0.0000   0.0000          ?        ?   572.7539  17.2401          ?        ?      239.2        3.6       ?       ? 
1 1 1   42   13   40 o    270.6    3.4    0.0000   0.0000          ?        ?   733.0228  18.5171          ?        ?      270.6        3.4       ?       ? 
1 1 1   42   13   41 o     86.1   10.0    0.0000   0.0000          ?        ?    74.7070  17.2401          ?        ?       86.1       10.0       ?       ? 
1 1 1   42   13   42 o    365.7    2.9    0.0000   0.0000          ?        ?  1338.3413  21.0712          ?        ?      365.7        2.9       ?       ? 
1 1 1   42   13   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   13   44 o    175.8    4.9    0.0000   0.0000          ?        ?   309.6830  17.2401          ?        ?      175.8        4.9       ?       ? 
1 1 1   42   13   45 o     18.8    9.5    0.0000   0.0000          ?        ?   -62.5751  17.8786          ?        ?       18.8        9.5       ?       ? 
1 1 1   42   13   46 o     27.9   13.0    0.0000   0.0000          ?        ?   -16.6016  17.8786          ?        ?       27.9       13.0       ?       ? 
1 1 1   42   13   47 o     64.4   14.3    0.0000   0.0000          ?        ?    44.0580  17.8786          ?        ?       64.4       14.3       ?       ? 
1 1 1   42   13   48 o    170.9    5.2    0.0000   0.0000          ?        ?   293.0815  17.8786          ?        ?      170.9        5.2       ?       ? 
1 1 1   42   13   49 o    175.5    5.3    0.0000   0.0000          ?        ?   309.0445  18.5171          ?        ?      175.5        5.3       ?       ? 
1 1 1   42   13   50 o     31.7   14.3    0.0000   0.0000          ?        ?    -8.9393  19.1556          ?        ?       31.7       14.3       ?       ? 
1 1 1   42   13   51 o     36.0   15.1    0.0000   0.0000          ?        ?     2.5541  18.5171          ?        ?       36.0       15.1       ?       ? 
1 1 1   42   13   52 o     53.7   15.7    0.0000   0.0000          ?        ?    30.6490  17.8786          ?        ?       53.7       15.7       ?       ? 
1 1 1   42   13   53 o     60.5   15.3    0.0000   0.0000          ?        ?    39.5883  18.5171          ?        ?       60.5       15.3       ?       ? 
1 1 1   42   13   54 o    132.5    7.2    0.0000   0.0000          ?        ?   177.5090  19.1556          ?        ?      132.5        7.2       ?       ? 
1 1 1   42   14    0 f     17.7   12.6  -23.6253  18.5171   -23.6253  18.5171   -23.6253  18.5171       17.7     12.6       17.7       12.6     0.0     0.0 
1 1 1   42   14    1 o    217.8    3.4    0.0000   0.0000          ?        ?   474.4216  14.6860          ?        ?      217.8        3.4       ?       ? 
1 1 1   42   14    2 o    202.1    2.8    0.0000   0.0000          ?        ?   408.6538  11.4934          ?        ?      202.1        2.8       ?       ? 
1 1 1   42   14    3 o     20.7   10.0    0.0000   0.0000          ?        ?   -21.0712  12.7704          ?        ?       20.7       10.0       ?       ? 
1 1 1   42   14    4 o    237.7    2.7    0.0000   0.0000          ?        ?   565.0916  12.7704          ?        ?      237.7        2.7       ?       ? 
1 1 1   42   14    5 o    479.7    2.8    0.0000   0.0000          ?        ?  2301.8704  26.8179          ?        ?      479.7        2.8       ?       ? 
1 1 1   42   14    6 o     81.0    6.7    0.0000   0.0000          ?        ?    65.7677  10.8549          ?        ?       81.0        6.7       ?       ? 
1 1 1   42   14    7 o    328.1    2.5    0.0000   0.0000          ?        ?  1076.5475  16.6016          ?        ?      328.1        2.5       ?       ? 
1 1 1   42   14    8 o    226.7    2.7    0.0000   0.0000          ?        ?   514.0099  12.1319          ?        ?      226.7        2.7       ?       ? 
1 1 1   42   14    9 o    189.6    2.7    0.0000   0.0000          ?        ?   359.4877  10.2163          ?        ?      189.6        2.7       ?       ? 
1 1 1   42   14   10 o    506.5    2.5    0.0000   0.0000          ?        ?  2566.2183  24.9023          ?        ?      506.5        2.5       ?       ? 
1 1 1   42   14   11 f    350.9    2.5    0.0000   0.0000          ?        ?  1231.7081  17.2401          ?        ?      350.9        2.5       ?       ? 
1 1 1   42   14   12 o    151.4    3.6    0.0000   0.0000          ?        ?   229.2293  10.8549          ?        ?      151.4        3.6       ?       ? 
1 1 1   42   14   13 o    181.7    3.3    0.0000   0.0000          ?        ?   330.1157  12.1319          ?        ?      181.7        3.3       ?       ? 
1 1 1   42   14   14 o    433.3    2.6    0.0000   0.0000          ?        ?  1877.8921  22.3483          ?        ?      433.3        2.6       ?       ? 
1 1 1   42   14   15 o     18.4    9.1    0.0000   0.0000          ?        ?   -23.6253  11.4934          ?        ?       18.4        9.1       ?       ? 
1 1 1   42   14   16 o    132.7    4.3    0.0000   0.0000          ?        ?   176.2320  11.4934          ?        ?      132.7        4.3       ?       ? 
1 1 1   42   14   17 o    262.8    2.8    0.0000   0.0000          ?        ?   690.8804  14.6860          ?        ?      262.8        2.8       ?       ? 
1 1 1   42   14   18 o    249.5    2.9    0.0000   0.0000          ?        ?   622.5586  14.6860          ?        ?      249.5        2.9       ?       ? 
1 1 1   42   14   19 o     17.0    8.5    0.0000   0.0000          ?        ?   -33.8416  12.1319          ?        ?       17.0        8.5       ?       ? 
1 1 1   42   14   20 o    394.6    2.6    0.0000   0.0000          ?        ?  1557.3542  20.4327          ?        ?      394.6        2.6       ?       ? 
1 1 1   42   14   21 o    227.2    3.4    0.0000   0.0000          ?        ?   516.5640  15.3245          ?        ?      227.2        3.4       ?       ? 
1 1 1   42   14   22 o    343.3    2.4    0.0000   0.0000          ?        ?  1178.7109  16.6016          ?        ?      343.3        2.4       ?       ? 
1 1 1   42   14   23 o     81.0    7.5    0.0000   0.0000          ?        ?    65.7677  12.1319          ?        ?       81.0        7.5       ?       ? 
1 1 1   42   14   24 o    157.1    4.5    0.0000   0.0000          ?        ?   247.1079  14.0475          ?        ?      157.1        4.5       ?       ? 
1 1 1   42   14   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   14   26 o     27.7   12.2    0.0000   0.0000          ?        ?    -4.4697  13.4090          ?        ?       27.7       12.2       ?       ? 
1 1 1   42   14   27 o    241.6    3.2    0.0000   0.0000          ?        ?   584.2473  15.3245          ?        ?      241.6        3.2       ?       ? 
1 1 1   42   14   28 o    139.7    5.3    0.0000   0.0000          ?        ?   195.3876  14.6860          ?        ?      139.7        5.3       ?       ? 
1 1 1   42   14   29 o    100.0    7.0    0.0000   0.0000          ?        ?   100.2479  14.0475          ?        ?      100.0        7.0       ?       ? 
1 1 1   42   14   30 o     23.8   11.3    0.0000   0.0000          ?        ?   -18.5171  14.6860          ?        ?       23.8       11.3       ?       ? 
1 1 1   42   14   31 o    343.8    2.7    0.0000   0.0000          ?        ?  1182.5420  18.5171          ?        ?      343.8        2.7       ?       ? 
1 1 1   42   14   32 o    122.6    6.0    0.0000   0.0000          ?        ?   150.6911  14.6860          ?        ?      122.6        6.0       ?       ? 
1 1 1   42   14   33 o    264.0    3.0    0.0000   0.0000          ?        ?   697.2656  15.9630          ?        ?      264.0        3.0       ?       ? 
1 1 1   42   14   34 o    175.5    4.4    0.0000   0.0000          ?        ?   308.4059  15.3245          ?        ?      175.5        4.4       ?       ? 
1 1 1   42   14   35 o    389.2    2.7    0.0000   0.0000          ?        ?  1515.2118  21.0712          ?        ?      389.2        2.7       ?       ? 
1 1 1   42   14   36 o    144.4    5.3    0.0000   0.0000          ?        ?   208.7966  15.3245          ?        ?      144.4        5.3       ?       ? 
1 1 1   42   14   37 o    206.3    3.9    0.0000   0.0000          ?        ?   425.8939  15.9630          ?        ?      206.3        3.9       ?       ? 
1 1 1   42   14   38 o    426.2    2.7    0.0000   0.0000          ?        ?  1817.2325  22.9868          ?        ?      426.2        2.7       ?       ? 
1 1 1   42   14   39 o    380.3    2.8    0.0000   0.0000          ?        ?  1446.8900  21.0712          ?        ?      380.3        2.8       ?       ? 
1 1 1   42   14   40 o    356.6    2.8    0.0000   0.0000          ?        ?  1272.5736  19.7942          ?        ?      356.6        2.8       ?       ? 
1 1 1   42   14   41 o    318.2    3.0    0.0000   0.0000          ?        ?  1013.3338  19.1556          ?        ?      318.2        3.0       ?       ? 
1 1 1   42   14   42 f     45.5   15.4    0.0000   0.0000          ?        ?    19.7942  16.6016          ?        ?       45.5       15.4       ?       ? 
1 1 1   42   14   43 o    133.5    6.2    0.0000   0.0000          ?        ?   178.7861  16.6016          ?        ?      133.5        6.2       ?       ? 
1 1 1   42   14   44 o    151.8    5.7    0.0000   0.0000          ?        ?   231.1448  17.2401          ?        ?      151.8        5.7       ?       ? 
1 1 1   42   14   45 o     89.2   10.0    0.0000   0.0000          ?        ?    80.4537  17.8786          ?        ?       89.2       10.0       ?       ? 
1 1 1   42   14   46 o     84.8   10.5    0.0000   0.0000          ?        ?    72.7915  17.8786          ?        ?       84.8       10.5       ?       ? 
1 1 1   42   14   47 o    146.2    5.9    0.0000   0.0000          ?        ?   214.5433  17.2401          ?        ?      146.2        5.9       ?       ? 
1 1 1   42   14   48 o     34.6   14.7    0.0000   0.0000          ?        ?     0.6385  17.8786          ?        ?       34.6       14.7       ?       ? 
1 1 1   42   14   49 o    376.6    3.1    0.0000   0.0000          ?        ?  1420.0720  22.9868          ?        ?      376.6        3.1       ?       ? 
1 1 1   42   14   50 o    222.7    4.3    0.0000   0.0000          ?        ?   497.4084  19.1556          ?        ?      222.7        4.3       ?       ? 
1 1 1   42   14   51 o    133.2    7.0    0.0000   0.0000          ?        ?   178.7861  18.5171          ?        ?      133.2        7.0       ?       ? 
1 1 1   42   14   52 o    106.2    8.4    0.0000   0.0000          ?        ?   114.2954  17.8786          ?        ?      106.2        8.4       ?       ? 
1 1 1   42   14   53 o    228.9    4.0    0.0000   0.0000          ?        ?   525.5033  18.5171          ?        ?      228.9        4.0       ?       ? 
1 1 1   42   15    0 o    214.9    5.4  462.9282  22.9868   462.9282  22.9868   462.9282  22.9868      214.9      5.4      214.9        5.4     0.0     0.0 
1 1 1   42   15    1 o    388.7    2.7    0.0000   0.0000          ?        ?  1511.3806  21.0712          ?        ?      388.7        2.7       ?       ? 
1 1 1   42   15    2 o    153.4    4.6    0.0000   0.0000          ?        ?   235.6145  14.0475          ?        ?      153.4        4.6       ?       ? 
1 1 1   42   15    3 o    414.1    2.8    0.0000   0.0000          ?        ?  1715.0691  22.9868          ?        ?      414.1        2.8       ?       ? 
1 1 1   42   15    4 o    565.4    3.0    0.0000   0.0000          ?        ?  3198.3547  33.8416          ?        ?      565.4        3.0       ?       ? 
1 1 1   42   15    5 o    413.6    2.8    0.0000   0.0000          ?        ?  1711.2379  22.9868          ?        ?      413.6        2.8       ?       ? 
1 1 1   42   15    6 o    438.1    2.8    0.0000   0.0000          ?        ?  1920.0347  24.2638          ?        ?      438.1        2.8       ?       ? 
1 1 1   42   15    7 f    494.3    2.6    0.0000   0.0000          ?        ?  2443.6223  26.1794          ?        ?      494.3        2.6       ?       ? 
1 1 1   42   15    8 o    231.7    2.9    0.0000   0.0000          ?        ?   536.9967  13.4090          ?        ?      231.7        2.9       ?       ? 
1 1 1   42   15    9 o    241.9    3.2    0.0000   0.0000          ?        ?   585.5243  15.3245          ?        ?      241.9        3.2       ?       ? 
1 1 1   42   15   10 o    680.8    3.1    0.0000   0.0000          ?        ?  4636.9443  42.7809          ?        ?      680.8        3.1       ?       ? 
1 1 1   42   15   11 o    322.9    2.5    0.0000   0.0000          ?        ?  1042.7058  15.9630          ?        ?      322.9        2.5       ?       ? 
1 1 1   42   15   12 o    411.8    2.4    0.0000   0.0000          ?        ?  1696.5520  19.7942          ?        ?      411.8        2.4       ?       ? 
1 1 1   42   15   13 o     19.9    9.6    0.0000   0.0000          ?        ?   -15.3245  10.8549          ?        ?       19.9        9.6       ?       ? 
1 1 1   42   15   14 o    126.3    4.3    0.0000   0.0000          ?        ?   159.6304  10.8549          ?        ?      126.3        4.3       ?       ? 
1 1 1   42   15   15 o    495.5    2.6    0.0000   0.0000          ?        ?  2456.3928  25.5409          ?        ?      495.5        2.6       ?       ? 
1 1 1   42   15   16 o    193.7    3.3    0.0000   0.0000          ?        ?   375.4507  12.7704          ?        ?      193.7        3.3       ?       ? 
1 1 1   42   15   17 o    397.6    2.6    0.0000   0.0000          ?        ?  1580.9796  20.4327          ?        ?      397.6        2.6       ?       ? 
1 1 1   42   15   18 o    121.9    5.0    0.0000   0.0000          ?        ?   148.7755  12.1319          ?        ?      121.9        5.0       ?       ? 
1 1 1   42   15   19 o    285.3    2.8    0.0000   0.0000          ?        ?   814.1151  15.9630          ?        ?      285.3        2.8       ?       ? 
1 1 1   42   15   20 o    147.3    4.3    0.0000   0.0000          ?        ?   217.0974  12.7704          ?        ?      147.3        4.3       ?       ? 
1 1 1   42   15   21 o     64.8    9.4    0.0000   0.0000          ?        ?    42.1424  12.1319          ?        ?       64.8        9.4       ?       ? 
1 1 1   42   15   22 o     21.1   10.2    0.0000   0.0000          ?        ?   -22.3483  13.4090          ?        ?       21.1       10.2       ?       ? 
1 1 1   42   15   23 o    196.5    3.6    0.0000   0.0000          ?        ?   386.3056  14.0475          ?        ?      196.5        3.6       ?       ? 
1 1 1   42   15   24 o    247.0    3.0    0.0000   0.0000          ?        ?   610.4266  14.6860          ?        ?      247.0        3.0       ?       ? 
1 1 1   42   15   25 o    298.2    2.8    0.0000   0.0000          ?        ?   889.4606  16.6016          ?        ?      298.2        2.8       ?       ? 
1 1 1   42   15   26 o    206.6    3.4    0.0000   0.0000          ?        ?   427.1710  14.0475          ?        ?      206.6        3.4       ?       ? 
1 1 1   42   15   27 o     74.8    9.0    0.0000   0.0000          ?        ?    56.1899  13.4090          ?        ?       74.8        9.0       ?       ? 
1 1 1   42   15   28 o    169.6    4.1    0.0000   0.0000          ?        ?   287.9732  14.0475          ?        ?      169.6        4.1       ?       ? 
1 1 1   42   15   29 o    276.6    3.1    0.0000   0.0000          ?        ?   765.5875  17.2401          ?        ?      276.6        3.1       ?       ? 
1 1 1   42   15   30 o    352.5    2.6    0.0000   0.0000          ?        ?  1243.2015  18.5171          ?        ?      352.5        2.6       ?       ? 
1 1 1   42   15   31 o    173.7    4.2    0.0000   0.0000          ?        ?   302.0207  14.6860          ?        ?      173.7        4.2       ?       ? 
1 1 1   42   15   32 o    326.8    2.7    0.0000   0.0000          ?        ?  1068.2467  17.8786          ?        ?      326.8        2.7       ?       ? 
1 1 1   42   15   33 o    180.9    4.1    0.0000   0.0000          ?        ?   327.5616  14.6860          ?        ?      180.9        4.1       ?       ? 
1 1 1   42   15   34 o    246.6    3.2    0.0000   0.0000          ?        ?   608.5111  15.9630          ?        ?      246.6        3.2       ?       ? 
1 1 1   42   15   35 o    128.4    6.2    0.0000   0.0000          ?        ?   165.3771  15.9630          ?        ?      128.4        6.2       ?       ? 
1 1 1   42   15   36 o    405.7    2.6    0.0000   0.0000          ?        ?  1646.7472  21.0712          ?        ?      405.7        2.6       ?       ? 
1 1 1   42   15   37 o    237.2    3.8    0.0000   0.0000          ?        ?   563.1760  17.8786          ?        ?      237.2        3.8       ?       ? 
1 1 1   42   15   38 o    252.7    3.5    0.0000   0.0000          ?        ?   639.1602  17.8786          ?        ?      252.7        3.5       ?       ? 
1 1 1   42   15   39 f    183.6    4.5    0.0000   0.0000          ?        ?   337.7780  16.6016          ?        ?      183.6        4.5       ?       ? 
1 1 1   42   15   40 o    153.7    5.4    0.0000   0.0000          ?        ?   236.8915  16.6016          ?        ?      153.7        5.4       ?       ? 
1 1 1   42   15   41 o     67.6   12.7    0.0000   0.0000          ?        ?    47.8891  16.6016          ?        ?       67.6       12.7       ?       ? 
1 1 1   42   15   42 o    278.1    3.3    0.0000   0.0000          ?        ?   774.5267  18.5171          ?        ?      278.1        3.3       ?       ? 
1 1 1   42   15   43 o    184.3    4.7    0.0000   0.0000          ?        ?   340.3320  17.2401          ?        ?      184.3        4.7       ?       ? 
1 1 1   42   15   44 o    134.3    6.4    0.0000   0.0000          ?        ?   181.3401  17.2401          ?        ?      134.3        6.4       ?       ? 
1 1 1   42   15   45 o    314.7    3.1    0.0000   0.0000          ?        ?   991.6241  19.7942          ?        ?      314.7        3.1       ?       ? 
1 1 1   42   15   46 o     34.6   14.6    0.0000   0.0000          ?        ?     1.9156  17.2401          ?        ?       34.6       14.6       ?       ? 
1 1 1   42   15   47 o    146.5    6.1    0.0000   0.0000          ?        ?   215.8203  17.8786          ?        ?      146.5        6.1       ?       ? 
1 1 1   42   15   48 o    222.6    4.3    0.0000   0.0000          ?        ?   496.7698  19.1556          ?        ?      222.6        4.3       ?       ? 
1 1 1   42   15   49 o    160.0    5.6    0.0000   0.0000          ?        ?   257.3242  17.8786          ?        ?      160.0        5.6       ?       ? 
1 1 1   42   15   50 o    215.1    4.5    0.0000   0.0000          ?        ?   464.2052  19.1556          ?        ?      215.1        4.5       ?       ? 
1 1 1   42   15   51 f    188.1    5.1    0.0000   0.0000          ?        ?   355.6566  19.1556          ?        ?      188.1        5.1       ?       ? 
1 1 1   42   15   52 o     34.6   14.9    0.0000   0.0000          ?        ?     0.0000  18.5171          ?        ?       34.6       14.9       ?       ? 
1 1 1   42   16    0 o    572.4    4.4 3278.1702  50.4432  3278.1702  50.4432  3278.1702  50.4432      572.4      4.4      572.4        4.4     0.0     0.0 
1 1 1   42   16    1 o    471.5    2.8    0.0000   0.0000          ?        ?  2223.9707  26.8179          ?        ?      471.5        2.8       ?       ? 
1 1 1   42   16    2 o    258.9    3.3    0.0000   0.0000          ?        ?   670.4477  17.2401          ?        ?      258.9        3.3       ?       ? 
1 1 1   42   16    3 o    417.4    3.1    0.0000   0.0000          ?        ?  1742.5255  26.1794          ?        ?      417.4        3.1       ?       ? 
1 1 1   42   16    4 o    191.2    4.0    0.0000   0.0000          ?        ?   365.8729  15.3245          ?        ?      191.2        4.0       ?       ? 
1 1 1   42   16    5 o    308.8    2.8    0.0000   0.0000          ?        ?   953.9513  17.2401          ?        ?      308.8        2.8       ?       ? 
1 1 1   42   16    6 o    123.5    4.4    0.0000   0.0000          ?        ?   152.6067  10.8549          ?        ?      123.5        4.4       ?       ? 
1 1 1   42   16    7 f    568.9    3.1    0.0000   0.0000          ?        ?  3237.3047  35.1187          ?        ?      568.9        3.1       ?       ? 
1 1 1   42   16    8 o    414.1    2.7    0.0000   0.0000          ?        ?  1715.7076  22.3483          ?        ?      414.1        2.7       ?       ? 
1 1 1   42   16    9 o    140.9    4.1    0.0000   0.0000          ?        ?   198.5802  11.4934          ?        ?      140.9        4.1       ?       ? 
1 1 1   42   16   10 o     21.3   10.1    0.0000   0.0000          ?        ?   -14.0475  11.4934          ?        ?       21.3       10.1       ?       ? 
1 1 1   42   16   11 o    282.2    2.8    0.0000   0.0000          ?        ?   796.8750  15.9630          ?        ?      282.2        2.8       ?       ? 
1 1 1   42   16   12 o    173.4    3.1    0.0000   0.0000          ?        ?   300.7437  10.8549          ?        ?      173.4        3.1       ?       ? 
1 1 1   42   16   13 o     99.7    5.8    0.0000   0.0000          ?        ?    99.6094  11.4934          ?        ?       99.7        5.8       ?       ? 
1 1 1   42   16   14 o     16.4    8.2    0.0000   0.0000          ?        ?   -32.5646  11.4934          ?        ?       16.4        8.2       ?       ? 
1 1 1   42   16   15 o    409.6    2.5    0.0000   0.0000          ?        ?  1678.0348  20.4327          ?        ?      409.6        2.5       ?       ? 
1 1 1   42   16   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   16   17 o     97.4    6.2    0.0000   0.0000          ?        ?    95.1397  12.1319          ?        ?       97.4        6.2       ?       ? 
1 1 1   42   16   18 o     80.6    7.5    0.0000   0.0000          ?        ?    65.1292  12.1319          ?        ?       80.6        7.5       ?       ? 
1 1 1   42   16   19 o    252.0    2.9    0.0000   0.0000          ?        ?   635.3290  14.6860          ?        ?      252.0        2.9       ?       ? 
1 1 1   42   16   20 o    457.9    2.6    0.0000   0.0000          ?        ?  2097.5435  24.2638          ?        ?      457.9        2.6       ?       ? 
1 1 1   42   16   21 o    230.6    3.0    0.0000   0.0000          ?        ?   531.8885  14.0475          ?        ?      230.6        3.0       ?       ? 
1 1 1   42   16   22 o    225.1    3.0    0.0000   0.0000          ?        ?   506.9862  13.4090          ?        ?      225.1        3.0       ?       ? 
1 1 1   42   16   23 o    398.7    2.5    0.0000   0.0000          ?        ?  1589.9188  19.7942          ?        ?      398.7        2.5       ?       ? 
1 1 1   42   16   24 o    500.3    2.6    0.0000   0.0000          ?        ?  2503.6433  26.1794          ?        ?      500.3        2.6       ?       ? 
1 1 1   42   16   25 o    139.4    5.3    0.0000   0.0000          ?        ?   194.7491  14.6860          ?        ?      139.4        5.3       ?       ? 
1 1 1   42   16   26 o    344.3    2.6    0.0000   0.0000          ?        ?  1185.7346  17.8786          ?        ?      344.3        2.6       ?       ? 
1 1 1   42   16   27 o    110.6    6.1    0.0000   0.0000          ?        ?   122.5962  13.4090          ?        ?      110.6        6.1       ?       ? 
1 1 1   42   16   28 o     19.1    9.5    0.0000   0.0000          ?        ?   -34.4802  14.0475          ?        ?       19.1        9.5       ?       ? 
1 1 1   42   16   29 o    323.0    2.8    0.0000   0.0000          ?        ?  1043.9829  17.8786          ?        ?      323.0        2.8       ?       ? 
1 1 1   42   16   30 o    259.2    3.1    0.0000   0.0000          ?        ?   672.3633  15.9630          ?        ?      259.2        3.1       ?       ? 
1 1 1   42   16   31 o    353.2    2.8    0.0000   0.0000          ?        ?  1248.3098  19.7942          ?        ?      353.2        2.8       ?       ? 
1 1 1   42   16   32 o     80.5    9.1    0.0000   0.0000          ?        ?    65.1292  14.6860          ?        ?       80.5        9.1       ?       ? 
1 1 1   42   16   33 o     73.0    9.6    0.0000   0.0000          ?        ?    53.6358  14.0475          ?        ?       73.0        9.6       ?       ? 
1 1 1   42   16   34 o    113.9    6.7    0.0000   0.0000          ?        ?   130.2584  15.3245          ?        ?      113.9        6.7       ?       ? 
1 1 1   42   16   35 f    248.0    3.3    0.0000   0.0000          ?        ?   615.5349  16.6016          ?        ?      248.0        3.3       ?       ? 
1 1 1   42   16   36 o    210.7    3.9    0.0000   0.0000          ?        ?   444.4110  16.6016          ?        ?      210.7        3.9       ?       ? 
1 1 1   42   16   37 o    351.9    2.9    0.0000   0.0000          ?        ?  1239.3705  20.4327          ?        ?      351.9        2.9       ?       ? 
1 1 1   42   16   38 o    228.0    3.8    0.0000   0.0000          ?        ?   520.3951  17.2401          ?        ?      228.0        3.8       ?       ? 
1 1 1   42   16   39 o     72.8   11.4    0.0000   0.0000          ?        ?    53.6358  16.6016          ?        ?       72.8       11.4       ?       ? 
1 1 1   42   16   40 o    235.0    3.9    0.0000   0.0000          ?        ?   552.9597  18.5171          ?        ?      235.0        3.9       ?       ? 
1 1 1   42   16   41 o    282.1    3.4    0.0000   0.0000          ?        ?   796.8750  19.1556          ?        ?      282.1        3.4       ?       ? 
1 1 1   42   16   42 o     79.4   10.4    0.0000   0.0000          ?        ?    63.8522  16.6016          ?        ?       79.4       10.4       ?       ? 
1 1 1   42   16   43 o    320.9    3.0    0.0000   0.0000          ?        ?  1030.5739  19.1556          ?        ?      320.9        3.0       ?       ? 
1 1 1   42   16   44 o     46.5   15.7    0.0000   0.0000          ?        ?    21.0712  17.2401          ?        ?       46.5       15.7       ?       ? 
1 1 1   42   16   45 o     83.6   10.7    0.0000   0.0000          ?        ?    70.8759  17.8786          ?        ?       83.6       10.7       ?       ? 
1 1 1   42   16   46 o    282.1    3.4    0.0000   0.0000          ?        ?   796.8750  19.1556          ?        ?      282.1        3.4       ?       ? 
1 1 1   42   16   47 o    110.5    7.8    0.0000   0.0000          ?        ?   123.2347  17.2401          ?        ?      110.5        7.8       ?       ? 
1 1 1   42   16   48 o     51.0   15.2    0.0000   0.0000          ?        ?    27.4564  16.6016          ?        ?       51.0       15.2       ?       ? 
1 1 1   42   16   49 o     28.3   13.1    0.0000   0.0000          ?        ?   -12.7704  17.2401          ?        ?       28.3       13.1       ?       ? 
1 1 1   42   16   50 o     99.4    8.7    0.0000   0.0000          ?        ?   100.2479  17.2401          ?        ?       99.4        8.7       ?       ? 
1 1 1   42   16   51 o    256.2    3.6    0.0000   0.0000          ?        ?   658.3158  18.5171          ?        ?      256.2        3.6       ?       ? 
1 1 1   42   17    0 o    749.4    5.7 5621.5444  84.9234  5621.5444  84.9234  5621.5444  84.9234      749.4      5.7      749.4        5.7     0.0     0.0 
1 1 1   42   17    1 o    119.5    6.4    0.0000   0.0000          ?        ?   143.0288  15.3245          ?        ?      119.5        6.4       ?       ? 
1 1 1   42   17    2 o    105.6    6.3    0.0000   0.0000          ?        ?   111.7413  13.4090          ?        ?      105.6        6.3       ?       ? 
1 1 1   42   17    3 o    446.3    3.1    0.0000   0.0000          ?        ?  1992.8260  27.4564          ?        ?      446.3        3.1       ?       ? 
1 1 1   42   17    4 o    540.6    3.4    0.0000   0.0000          ?        ?  2924.4290  37.0343          ?        ?      540.6        3.4       ?       ? 
1 1 1   42   17    5 o    372.3    3.3    0.0000   0.0000          ?        ?  1386.8689  24.9023          ?        ?      372.3        3.3       ?       ? 
1 1 1   42   17    6 o    560.3    3.1    0.0000   0.0000          ?        ?  3140.2493  34.4802          ?        ?      560.3        3.1       ?       ? 
1 1 1   42   17    7 o    348.6    3.1    0.0000   0.0000          ?        ?  1215.7451  21.7097          ?        ?      348.6        3.1       ?       ? 
1 1 1   42   17    8 o     36.1   13.1    0.0000   0.0000          ?        ?    10.8549  12.1319          ?        ?       36.1       13.1       ?       ? 
1 1 1   42   17    9 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   17   10 o     50.0   11.1    0.0000   0.0000          ?        ?    26.1794  10.8549          ?        ?       50.0       11.1       ?       ? 
1 1 1   42   17   11 o    176.5    3.8    0.0000   0.0000          ?        ?   311.5985  13.4090          ?        ?      176.5        3.8       ?       ? 
1 1 1   42   17   12 o    588.4    3.4    0.0000   0.0000          ?        ?  3463.9797  40.2269          ?        ?      588.4        3.4       ?       ? 
1 1 1   42   17   13 o    311.7    2.3    0.0000   0.0000          ?        ?   971.8299  14.0475          ?        ?      311.7        2.3       ?       ? 
1 1 1   42   17   14 o    202.6    3.0    0.0000   0.0000          ?        ?   410.5694  12.1319          ?        ?      202.6        3.0       ?       ? 
1 1 1   42   17   15 o    505.2    3.0    0.0000   0.0000          ?        ?  2553.4480  30.0105          ?        ?      505.2        3.0       ?       ? 
1 1 1   42   17   16 o    291.6    2.7    0.0000   0.0000          ?        ?   850.5108  15.9630          ?        ?      291.6        2.7       ?       ? 
1 1 1   42   17   17 f     25.2   11.4    0.0000   0.0000          ?        ?    -6.3852  12.1319          ?        ?       25.2       11.4       ?       ? 
1 1 1   42   17   18 o    196.8    3.2    0.0000   0.0000          ?        ?   387.5826  12.7704          ?        ?      196.8        3.2       ?       ? 
1 1 1   42   17   19 o     25.3   11.2    0.0000   0.0000          ?        ?    -4.4697  11.4934          ?        ?       25.3       11.2       ?       ? 
1 1 1   42   17   20 o    399.5    2.6    0.0000   0.0000          ?        ?  1596.3041  21.0712          ?        ?      399.5        2.6       ?       ? 
1 1 1   42   17   21 o    391.6    2.5    0.0000   0.0000          ?        ?  1533.7289  19.7942          ?        ?      391.6        2.5       ?       ? 
1 1 1   42   17   22 o     54.1   12.1    0.0000   0.0000          ?        ?    30.6490  12.7704          ?        ?       54.1       12.1       ?       ? 
1 1 1   42   17   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   17   24 o    350.7    2.5    0.0000   0.0000          ?        ?  1230.4312  17.8786          ?        ?      350.7        2.5       ?       ? 
1 1 1   42   17   25 o    255.8    2.9    0.0000   0.0000          ?        ?   654.4847  14.6860          ?        ?      255.8        2.9       ?       ? 
1 1 1   42   17   26 f     32.8   13.0    0.0000   0.0000          ?        ?     5.7467  12.7704          ?        ?       32.8       13.0       ?       ? 
1 1 1   42   17   27 o    435.5    2.6    0.0000   0.0000          ?        ?  1897.0479  22.3483          ?        ?      435.5        2.6       ?       ? 
1 1 1   42   17   28 o    167.7    4.2    0.0000   0.0000          ?        ?   281.5880  14.0475          ?        ?      167.7        4.2       ?       ? 
1 1 1   42   17   29 o     34.1   14.0    0.0000   0.0000          ?        ?     3.8311  15.3245          ?        ?       34.1       14.0       ?       ? 
1 1 1   42   17   30 o     34.2   13.4    0.0000   0.0000          ?        ?     7.0237  13.4090          ?        ?       34.2       13.4       ?       ? 
1 1 1   42   17   31 o    322.6    2.9    0.0000   0.0000          ?        ?  1041.4288  18.5171          ?        ?      322.6        2.9       ?       ? 
1 1 1   42   17   32 o    209.6    3.7    0.0000   0.0000          ?        ?   439.9414  15.3245          ?        ?      209.6        3.7       ?       ? 
1 1 1   42   17   33 o    333.4    2.8    0.0000   0.0000          ?        ?  1112.3047  18.5171          ?        ?      333.4        2.8       ?       ? 
1 1 1   42   17   34 o    123.1    6.2    0.0000   0.0000          ?        ?   151.9681  15.3245          ?        ?      123.1        6.2       ?       ? 
1 1 1   42   17   35 o    179.8    4.6    0.0000   0.0000          ?        ?   323.7305  16.6016          ?        ?      179.8        4.6       ?       ? 
1 1 1   42   17   36 o     31.0   13.6    0.0000   0.0000          ?        ?    -3.1926  15.9630          ?        ?       31.0       13.6       ?       ? 
1 1 1   42   17   37 o    231.3    3.7    0.0000   0.0000          ?        ?   535.7197  17.2401          ?        ?      231.3        3.7       ?       ? 
1 1 1   42   17   38 o    190.3    4.4    0.0000   0.0000          ?        ?   362.6803  16.6016          ?        ?      190.3        4.4       ?       ? 
1 1 1   42   17   39 o    194.1    4.3    0.0000   0.0000          ?        ?   377.3663  16.6016          ?        ?      194.1        4.3       ?       ? 
1 1 1   42   17   40 o    266.7    3.4    0.0000   0.0000          ?        ?   711.9516  17.8786          ?        ?      266.7        3.4       ?       ? 
1 1 1   42   17   41 o    117.7    6.8    0.0000   0.0000          ?        ?   139.1977  15.9630          ?        ?      117.7        6.8       ?       ? 
1 1 1   42   17   42 o     84.2    9.1    0.0000   0.0000          ?        ?    71.5144  15.3245          ?        ?       84.2        9.1       ?       ? 
1 1 1   42   17   43 o    319.5    3.1    0.0000   0.0000          ?        ?  1022.2732  19.7942          ?        ?      319.5        3.1       ?       ? 
1 1 1   42   17   44 o    113.7    7.9    0.0000   0.0000          ?        ?   130.2584  17.8786          ?        ?      113.7        7.9       ?       ? 
1 1 1   42   17   45 o    219.5    4.1    0.0000   0.0000          ?        ?   482.7224  17.8786          ?        ?      219.5        4.1       ?       ? 
1 1 1   42   17   46 o    123.6    7.0    0.0000   0.0000          ?        ?   153.8837  17.2401          ?        ?      123.6        7.0       ?       ? 
1 1 1   42   17   47 o     26.2   12.5    0.0000   0.0000          ?        ?   -21.7097  17.8786          ?        ?       26.2       12.5       ?       ? 
1 1 1   42   17   48 o    184.1    4.9    0.0000   0.0000          ?        ?   340.3320  17.8786          ?        ?      184.1        4.9       ?       ? 
1 1 1   42   17   49 o    291.4    3.3    0.0000   0.0000          ?        ?   851.1494  19.1556          ?        ?      291.4        3.3       ?       ? 
1 1 1   42   17   50 o     25.7   12.2    0.0000   0.0000          ?        ?   -21.0712  17.2401          ?        ?       25.7       12.2       ?       ? 
1 1 1   42   18    0 o     30.4   19.9   -1.2770  28.7335    -1.2770  28.7335    -1.2770  28.7335       30.4     19.9       30.4       19.9     0.0     0.0 
1 1 1   42   18    1 o    303.9    3.0    0.0000   0.0000          ?        ?   923.9408  18.5171          ?        ?      303.9        3.0       ?       ? 
1 1 1   42   18    2 o    249.2    3.3    0.0000   0.0000          ?        ?   621.2816  16.6016          ?        ?      249.2        3.3       ?       ? 
1 1 1   42   18    3 o    131.5    5.1    0.0000   0.0000          ?        ?   173.0394  13.4090          ?        ?      131.5        5.1       ?       ? 
1 1 1   42   18    4 o    314.2    3.1    0.0000   0.0000          ?        ?   987.7929  19.7942          ?        ?      314.2        3.1       ?       ? 
1 1 1   42   18    5 o     16.5    8.3    0.0000   0.0000          ?        ?   -40.8654  12.7704          ?        ?       16.5        8.3       ?       ? 
1 1 1   42   18    6 o     30.3   13.0    0.0000   0.0000          ?        ?    -0.6385  14.0475          ?        ?       30.3       13.0       ?       ? 
1 1 1   42   18    7 o    159.5    4.6    0.0000   0.0000          ?        ?   254.7701  14.6860          ?        ?      159.5        4.6       ?       ? 
1 1 1   42   18    8 o    364.8    3.0    0.0000   0.0000          ?        ?  1331.3176  21.7097          ?        ?      364.8        3.0       ?       ? 
1 1 1   42   18    9 o    190.2    2.9    0.0000   0.0000          ?        ?   362.0418  10.8549          ?        ?      190.2        2.9       ?       ? 
1 1 1   42   18   10 o    342.1    2.6    0.0000   0.0000          ?        ?  1171.0486  17.8786          ?        ?      342.1        2.6       ?       ? 
1 1 1   42   18   11 o    358.9    2.6    0.0000   0.0000          ?        ?  1288.5366  18.5171          ?        ?      358.9        2.6       ?       ? 
1 1 1   42   18   12 o    284.1    2.8    0.0000   0.0000          ?        ?   807.7299  15.9630          ?        ?      284.1        2.8       ?       ? 
1 1 1   42   18   13 o    232.5    3.0    0.0000   0.0000          ?        ?   540.8278  14.0475          ?        ?      232.5        3.0       ?       ? 
1 1 1   42   18   14 o    185.4    3.8    0.0000   0.0000          ?        ?   344.1632  14.0475          ?        ?      185.4        3.8       ?       ? 
1 1 1   42   18   15 f    282.2    2.7    0.0000   0.0000          ?        ?   796.8750  15.3245          ?        ?      282.2        2.7       ?       ? 
1 1 1   42   18   16 o    157.8    3.4    0.0000   0.0000          ?        ?   249.0234  10.8549          ?        ?      157.8        3.4       ?       ? 
1 1 1   42   18   17 o    114.3    5.0    0.0000   0.0000          ?        ?   130.8969  11.4934          ?        ?      114.3        5.0       ?       ? 
1 1 1   42   18   18 o    265.1    2.8    0.0000   0.0000          ?        ?   703.0123  14.6860          ?        ?      265.1        2.8       ?       ? 
1 1 1   42   18   19 o    151.1    4.4    0.0000   0.0000          ?        ?   228.5907  13.4090          ?        ?      151.1        4.4       ?       ? 
1 1 1   42   18   20 o    272.9    2.7    0.0000   0.0000          ?        ?   745.1547  14.6860          ?        ?      272.9        2.7       ?       ? 
1 1 1   42   18   21 o    214.0    3.4    0.0000   0.0000          ?        ?   458.4586  14.6860          ?        ?      214.0        3.4       ?       ? 
1 1 1   42   18   22 o    320.9    2.6    0.0000   0.0000          ?        ?  1029.9354  16.6016          ?        ?      320.9        2.6       ?       ? 
1 1 1   42   18   23 o    341.9    2.6    0.0000   0.0000          ?        ?  1169.7716  17.8786          ?        ?      341.9        2.6       ?       ? 
1 1 1   42   18   24 o    385.6    2.4    0.0000   0.0000          ?        ?  1487.7554  18.5171          ?        ?      385.6        2.4       ?       ? 
1 1 1   42   18   25 o    247.4    3.0    0.0000   0.0000          ?        ?   612.3422  14.6860          ?        ?      247.4        3.0       ?       ? 
1 1 1   42   18   26 o    344.5    2.6    0.0000   0.0000          ?        ?  1187.0117  17.8786          ?        ?      344.5        2.6       ?       ? 
1 1 1   42   18   27 o    220.3    3.5    0.0000   0.0000          ?        ?   485.9149  15.3245          ?        ?      220.3        3.5       ?       ? 
1 1 1   42   18   28 o    461.8    2.6    0.0000   0.0000          ?        ?  2133.3008  23.6253          ?        ?      461.8        2.6       ?       ? 
1 1 1   42   18   29 o    127.9    6.0    0.0000   0.0000          ?        ?   164.1001  15.3245          ?        ?      127.9        6.0       ?       ? 
1 1 1   42   18   30 o     56.2   12.8    0.0000   0.0000          ?        ?    33.2031  14.0475          ?        ?       56.2       12.8       ?       ? 
1 1 1   42   18   31 o    174.4    4.2    0.0000   0.0000          ?        ?   304.5748  14.6860          ?        ?      174.4        4.2       ?       ? 
1 1 1   42   18   32 o    374.9    2.7    0.0000   0.0000          ?        ?  1406.6632  20.4327          ?        ?      374.9        2.7       ?       ? 
1 1 1   42   18   33 o    318.5    2.9    0.0000   0.0000          ?        ?  1015.2494  18.5171          ?        ?      318.5        2.9       ?       ? 
1 1 1   42   18   34 o    130.4    6.1    0.0000   0.0000          ?        ?   170.4853  15.9630          ?        ?      130.4        6.1       ?       ? 
1 1 1   42   18   35 o     18.5    9.2    0.0000   0.0000          ?        ?   -42.1424  14.6860          ?        ?       18.5        9.2       ?       ? 
1 1 1   42   18   36 o    255.8    3.2    0.0000   0.0000          ?        ?   655.1232  16.6016          ?        ?      255.8        3.2       ?       ? 
1 1 1   42   18   37 o     22.7   11.0    0.0000   0.0000          ?        ?   -24.9023  15.3245          ?        ?       22.7       11.0       ?       ? 
1 1 1   42   18   38 o    181.1    4.8    0.0000   0.0000          ?        ?   328.8386  17.2401          ?        ?      181.1        4.8       ?       ? 
1 1 1   42   18   39 o    315.4    3.0    0.0000   0.0000          ?        ?   995.4552  19.1556          ?        ?      315.4        3.0       ?       ? 
1 1 1   42   18   40 o    185.5    4.6    0.0000   0.0000          ?        ?   344.8017  17.2401          ?        ?      185.5        4.6       ?       ? 
1 1 1   42   18   41 o    251.4    3.6    0.0000   0.0000          ?        ?   632.7749  17.8786          ?        ?      251.4        3.6       ?       ? 
1 1 1   42   18   42 o    367.5    2.9    0.0000   0.0000          ?        ?  1351.7502  21.0712          ?        ?      367.5        2.9       ?       ? 
1 1 1   42   18   43 o    222.9    4.0    0.0000   0.0000          ?        ?   498.0469  17.8786          ?        ?      222.9        4.0       ?       ? 
1 1 1   42   18   44 o     90.2    9.2    0.0000   0.0000          ?        ?    82.3693  16.6016          ?        ?       90.2        9.2       ?       ? 
1 1 1   42   18   45 o     70.5   12.7    0.0000   0.0000          ?        ?    52.3588  17.2401          ?        ?       70.5       12.7       ?       ? 
1 1 1   42   18   46 o    131.1    6.6    0.0000   0.0000          ?        ?   173.0394  17.2401          ?        ?      131.1        6.6       ?       ? 
1 1 1   42   18   47 o     48.1   15.7    0.0000   0.0000          ?        ?    23.6253  17.2401          ?        ?       48.1       15.7       ?       ? 
1 1 1   42   18   48 o    194.2    4.8    0.0000   0.0000          ?        ?   378.6433  18.5171          ?        ?      194.2        4.8       ?       ? 
1 1 1   42   18   49 o    140.6    6.1    0.0000   0.0000          ?        ?   199.2188  17.2401          ?        ?      140.6        6.1       ?       ? 
1 1 1   42   19    0 o    172.8    6.1  300.1052  21.0712   300.1052  21.0712   300.1052  21.0712      172.8      6.1      172.8        6.1     0.0     0.0 
1 1 1   42   19    1 o     38.0   13.7    0.0000   0.0000          ?        ?    12.1319  13.4090          ?        ?       38.0       13.7       ?       ? 
1 1 1   42   19    2 o    120.0    5.6    0.0000   0.0000          ?        ?   144.3059  13.4090          ?        ?      120.0        5.6       ?       ? 
1 1 1   42   19    3 o    120.0    5.6    0.0000   0.0000          ?        ?   144.3059  13.4090          ?        ?      120.0        5.6       ?       ? 
1 1 1   42   19    4 o    517.4    3.5    0.0000   0.0000          ?        ?  2679.2368  35.7572          ?        ?      517.4        3.5       ?       ? 
1 1 1   42   19    5 o    167.7    4.2    0.0000   0.0000          ?        ?   281.5880  14.0475          ?        ?      167.7        4.2       ?       ? 
1 1 1   42   19    6 o    357.3    3.1    0.0000   0.0000          ?        ?  1277.0432  22.3483          ?        ?      357.3        3.1       ?       ? 
1 1 1   42   19    7 o     69.0    9.7    0.0000   0.0000          ?        ?    47.8891  13.4090          ?        ?       69.0        9.7       ?       ? 
1 1 1   42   19    8 o    127.0    5.8    0.0000   0.0000          ?        ?   161.5460  14.6860          ?        ?      127.0        5.8       ?       ? 
1 1 1   42   19    9 o    569.4    3.4    0.0000   0.0000          ?        ?  3244.3284  38.3113          ?        ?      569.4        3.4       ?       ? 
1 1 1   42   19   10 o    214.4    3.0    0.0000   0.0000          ?        ?   459.7356  12.7704          ?        ?      214.4        3.0       ?       ? 
1 1 1   42   19   11 o     43.6   12.0    0.0000   0.0000          ?        ?    19.7942  10.8549          ?        ?       43.6       12.0       ?       ? 
1 1 1   42   19   12 o    257.9    3.0    0.0000   0.0000          ?        ?   665.3395  15.3245          ?        ?      257.9        3.0       ?       ? 
1 1 1   42   19   13 o    142.2    4.5    0.0000   0.0000          ?        ?   202.4114  12.7704          ?        ?      142.2        4.5       ?       ? 
1 1 1   42   19   14 o    209.2    4.0    0.0000   0.0000          ?        ?   438.0258  16.6016          ?        ?      209.2        4.0       ?       ? 
1 1 1   42   19   15 o    105.6    6.4    0.0000   0.0000          ?        ?   111.7413  13.4090          ?        ?      105.6        6.4       ?       ? 
1 1 1   42   19   16 o    297.9    2.5    0.0000   0.0000          ?        ?   887.5450  14.6860          ?        ?      297.9        2.5       ?       ? 
1 1 1   42   19   17 o    129.5    4.2    0.0000   0.0000          ?        ?   167.9312  10.8549          ?        ?      129.5        4.2       ?       ? 
1 1 1   42   19   18 o    246.7    2.8    0.0000   0.0000          ?        ?   609.1497  14.0475          ?        ?      246.7        2.8       ?       ? 
1 1 1   42   19   19 o    181.6    3.3    0.0000   0.0000          ?        ?   330.1157  12.1319          ?        ?      181.6        3.3       ?       ? 
1 1 1   42   19   20 o     30.2   12.2    0.0000   0.0000          ?        ?     3.8311  11.4934          ?        ?       30.2       12.2       ?       ? 
1 1 1   42   19   21 o    106.5    6.3    0.0000   0.0000          ?        ?   113.6568  13.4090          ?        ?      106.5        6.3       ?       ? 
1 1 1   42   19   22 f    197.9    3.7    0.0000   0.0000          ?        ?   392.0523  14.6860          ?        ?      197.9        3.7       ?       ? 
1 1 1   42   19   23 o    157.3    4.5    0.0000   0.0000          ?        ?   247.7464  14.0475          ?        ?      157.3        4.5       ?       ? 
1 1 1   42   19   24 f    139.2    5.3    0.0000   0.0000          ?        ?   194.1106  14.6860          ?        ?      139.2        5.3       ?       ? 
1 1 1   42   19   25 o    410.9    2.7    0.0000   0.0000          ?        ?  1689.5283  22.3483          ?        ?      410.9        2.7       ?       ? 
1 1 1   42   19   26 o    281.4    2.8    0.0000   0.0000          ?        ?   792.4053  15.9630          ?        ?      281.4        2.8       ?       ? 
1 1 1   42   19   27 o    271.1    2.9    0.0000   0.0000          ?        ?   735.5769  15.9630          ?        ?      271.1        2.9       ?       ? 
1 1 1   42   19   28 o    211.3    3.5    0.0000   0.0000          ?        ?   446.9651  14.6860          ?        ?      211.3        3.5       ?       ? 
1 1 1   42   19   29 o    175.5    4.0    0.0000   0.0000          ?        ?   308.4059  14.0475          ?        ?      175.5        4.0       ?       ? 
1 1 1   42   19   30 o     38.8   14.6    0.0000   0.0000          ?        ?    11.4934  15.3245          ?        ?       38.8       14.6       ?       ? 
1 1 1   42   19   31 o     24.2   11.4    0.0000   0.0000          ?        ?   -17.2401  14.6860          ?        ?       24.2       11.4       ?       ? 
1 1 1   42   19   32 o    270.0    3.1    0.0000   0.0000          ?        ?   729.8303  16.6016          ?        ?      270.0        3.1       ?       ? 
1 1 1   42   19   33 o    325.3    2.9    0.0000   0.0000          ?        ?  1059.3074  19.1556          ?        ?      325.3        2.9       ?       ? 
1 1 1   42   19   34 o     99.9    7.4    0.0000   0.0000          ?        ?   100.2479  14.6860          ?        ?       99.9        7.4       ?       ? 
1 1 1   42   19   35 o    237.2    3.5    0.0000   0.0000          ?        ?   563.1760  16.6016          ?        ?      237.2        3.5       ?       ? 
1 1 1   42   19   36 o     24.1   11.5    0.0000   0.0000          ?        ?   -19.7942  15.3245          ?        ?       24.1       11.5       ?       ? 
1 1 1   42   19   37 o     41.9   14.7    0.0000   0.0000          ?        ?    15.9630  15.3245          ?        ?       41.9       14.7       ?       ? 
1 1 1   42   19   38 o    143.8    5.8    0.0000   0.0000          ?        ?   207.5195  16.6016          ?        ?      143.8        5.8       ?       ? 
1 1 1   42   19   39 o    167.8    4.9    0.0000   0.0000          ?        ?   282.2266  16.6016          ?        ?      167.8        4.9       ?       ? 
1 1 1   42   19   40 o    174.2    5.1    0.0000   0.0000          ?        ?   304.5748  17.8786          ?        ?      174.2        5.1       ?       ? 
1 1 1   42   19   41 o    182.5    4.7    0.0000   0.0000          ?        ?   333.9468  17.2401          ?        ?      182.5        4.7       ?       ? 
1 1 1   42   19   42 o     83.9   10.7    0.0000   0.0000          ?        ?    71.5144  17.8786          ?        ?       83.9       10.7       ?       ? 
1 1 1   42   19   43 o     60.8   14.8    0.0000   0.0000          ?        ?    39.5883  17.8786          ?        ?       60.8       14.8       ?       ? 
1 1 1   42   19   44 o    179.1    4.6    0.0000   0.0000          ?        ?   321.8149  16.6016          ?        ?      179.1        4.6       ?       ? 
1 1 1   42   19   45 o     99.8    8.6    0.0000   0.0000          ?        ?   100.8864  17.2401          ?        ?       99.8        8.6       ?       ? 
1 1 1   42   19   46 o     27.9   12.9    0.0000   0.0000          ?        ?   -14.0475  17.2401          ?        ?       27.9       12.9       ?       ? 
1 1 1   42   19   47 o    117.1    7.1    0.0000   0.0000          ?        ?   138.5592  16.6016          ?        ?      117.1        7.1       ?       ? 
1 1 1   42   19   48 o     27.8   12.7    0.0000   0.0000          ?        ?   -10.2163  15.9630          ?        ?       27.8       12.7       ?       ? 
1 1 1   42   20    0 o    263.5    4.5  695.3500  23.6253   695.3500  23.6253   695.3500  23.6253      263.5      4.5      263.5        4.5     0.0     0.0 
1 1 1   42   20    1 o    233.3    3.4    0.0000   0.0000          ?        ?   544.6590  15.9630          ?        ?      233.3        3.4       ?       ? 
1 1 1   42   20    2 o    222.2    3.7    0.0000   0.0000          ?        ?   494.2158  16.6016          ?        ?      222.2        3.7       ?       ? 
1 1 1   42   20    3 o    102.5    6.9    0.0000   0.0000          ?        ?   105.3561  14.0475          ?        ?      102.5        6.9       ?       ? 
1 1 1   42   20    4 f    444.4    3.2    0.0000   0.0000          ?        ?  1976.2245  28.0950          ?        ?      444.4        3.2       ?       ? 
1 1 1   42   20    5 o    101.9    6.9    0.0000   0.0000          ?        ?   104.0790  14.0475          ?        ?      101.9        6.9       ?       ? 
1 1 1   42   20    6 o     91.3    7.3    0.0000   0.0000          ?        ?    83.6463  13.4090          ?        ?       91.3        7.3       ?       ? 
1 1 1   42   20    7 o    229.3    3.5    0.0000   0.0000          ?        ?   526.1418  15.9630          ?        ?      229.3        3.5       ?       ? 
1 1 1   42   20    8 o     61.2   11.4    0.0000   0.0000          ?        ?    38.9498  13.4090          ?        ?       61.2       11.4       ?       ? 
1 1 1   42   20    9 o    195.3    3.9    0.0000   0.0000          ?        ?   381.8359  15.3245          ?        ?      195.3        3.9       ?       ? 
1 1 1   42   20   10 o    299.5    3.4    0.0000   0.0000          ?        ?   897.7615  20.4327          ?        ?      299.5        3.4       ?       ? 
1 1 1   42   20   11 o    179.1    3.6    0.0000   0.0000          ?        ?   321.1764  12.7704          ?        ?      179.1        3.6       ?       ? 
1 1 1   42   20   12 o    241.4    3.2    0.0000   0.0000          ?        ?   582.9703  15.3245          ?        ?      241.4        3.2       ?       ? 
1 1 1   42   20   13 o    131.0    4.6    0.0000   0.0000          ?        ?   171.7623  12.1319          ?        ?      131.0        4.6       ?       ? 
1 1 1   42   20   14 o    152.8    4.4    0.0000   0.0000          ?        ?   233.6989  13.4090          ?        ?      152.8        4.4       ?       ? 
1 1 1   42   20   15 o    336.6    2.9    0.0000   0.0000          ?        ?  1133.3759  19.7942          ?        ?      336.6        2.9       ?       ? 
1 1 1   42   20   16 o    251.9    3.2    0.0000   0.0000          ?        ?   634.6905  15.9630          ?        ?      251.9        3.2       ?       ? 
1 1 1   42   20   17 o    303.6    2.6    0.0000   0.0000          ?        ?   922.0252  15.9630          ?        ?      303.6        2.6       ?       ? 
1 1 1   42   20   18 o    452.8    2.7    0.0000   0.0000          ?        ?  2051.5698  24.2638          ?        ?      452.8        2.7       ?       ? 
1 1 1   42   20   19 f     54.3   10.4    0.0000   0.0000          ?        ?    30.6490  10.8549          ?        ?       54.3       10.4       ?       ? 
1 1 1   42   20   20 o    260.6    2.7    0.0000   0.0000          ?        ?   679.3870  14.0475          ?        ?      260.6        2.7       ?       ? 
1 1 1   42   20   21 o    270.7    2.8    0.0000   0.0000          ?        ?   733.0228  15.3245          ?        ?      270.7        2.8       ?       ? 
1 1 1   42   20   22 o    425.1    2.6    0.0000   0.0000          ?        ?  1808.2933  22.3483          ?        ?      425.1        2.6       ?       ? 
1 1 1   42   20   23 o    306.1    2.6    0.0000   0.0000          ?        ?   937.3498  15.9630          ?        ?      306.1        2.6       ?       ? 
1 1 1   42   20   24 o    482.4    2.6    0.0000   0.0000          ?        ?  2328.0498  25.5409          ?        ?      482.4        2.6       ?       ? 
1 1 1   42   20   25 o    245.4    3.4    0.0000   0.0000          ?        ?   602.7644  16.6016          ?        ?      245.4        3.4       ?       ? 
1 1 1   42   20   26 o    190.0    3.7    0.0000   0.0000          ?        ?   361.4032  14.0475          ?        ?      190.0        3.7       ?       ? 
1 1 1   42   20   27 o    401.3    2.7    0.0000   0.0000          ?        ?  1611.6285  21.7097          ?        ?      401.3        2.7       ?       ? 
1 1 1   42   20   28 o    381.0    2.8    0.0000   0.0000          ?        ?  1452.6367  21.0712          ?        ?      381.0        2.8       ?       ? 
1 1 1   42   20   29 o    195.4    4.1    0.0000   0.0000          ?        ?   382.4745  15.9630          ?        ?      195.4        4.1       ?       ? 
1 1 1   42   20   30 o    151.0    5.1    0.0000   0.0000          ?        ?   228.5907  15.3245          ?        ?      151.0        5.1       ?       ? 
1 1 1   42   20   31 o    224.0    3.6    0.0000   0.0000          ?        ?   502.5165  15.9630          ?        ?      224.0        3.6       ?       ? 
1 1 1   42   20   32 o    153.7    5.0    0.0000   0.0000          ?        ?   236.8915  15.3245          ?        ?      153.7        5.0       ?       ? 
1 1 1   42   20   33 o    185.8    4.6    0.0000   0.0000          ?        ?   346.0787  17.2401          ?        ?      185.8        4.6       ?       ? 
1 1 1   42   20   34 o    219.0    3.8    0.0000   0.0000          ?        ?   480.1682  16.6016          ?        ?      219.0        3.8       ?       ? 
1 1 1   42   20   35 o    235.9    3.5    0.0000   0.0000          ?        ?   557.4294  16.6016          ?        ?      235.9        3.5       ?       ? 
1 1 1   42   20   36 o     57.6   13.5    0.0000   0.0000          ?        ?    35.1187  15.3245          ?        ?       57.6       13.5       ?       ? 
1 1 1   42   20   37 o     93.8    8.5    0.0000   0.0000          ?        ?    88.7545  15.9630          ?        ?       93.8        8.5       ?       ? 
1 1 1   42   20   38 o    125.8    6.3    0.0000   0.0000          ?        ?   158.9919  15.9630          ?        ?      125.8        6.3       ?       ? 
1 1 1   42   20   39 o    100.6    8.6    0.0000   0.0000          ?        ?   102.1635  17.2401          ?        ?      100.6        8.6       ?       ? 
1 1 1   42   20   40 o    174.8    4.7    0.0000   0.0000          ?        ?   306.4904  16.6016          ?        ?      174.8        4.7       ?       ? 
1 1 1   42   20   41 o     28.9   13.1    0.0000   0.0000          ?        ?    -9.5778  16.6016          ?        ?       28.9       13.1       ?       ? 
1 1 1   42   20   42 o    146.5    5.7    0.0000   0.0000          ?        ?   215.8203  16.6016          ?        ?      146.5        5.7       ?       ? 
1 1 1   42   20   43 o    138.3    5.8    0.0000   0.0000          ?        ?   192.1950  15.9630          ?        ?      138.3        5.8       ?       ? 
1 1 1   42   20   44 o    157.8    5.5    0.0000   0.0000          ?        ?   250.3005  17.2401          ?        ?      157.8        5.5       ?       ? 
1 1 1   42   20   45 o    177.8    4.8    0.0000   0.0000          ?        ?   317.3452  17.2401          ?        ?      177.8        4.8       ?       ? 
1 1 1   42   20   46 o     70.9   11.7    0.0000   0.0000          ?        ?    51.7203  16.6016          ?        ?       70.9       11.7       ?       ? 
1 1 1   42   21    0 o    594.5    5.6 3538.0481  66.4062  3538.0481  66.4062  3538.0481  66.4062      594.5      5.6      594.5        5.6     0.0     0.0 
1 1 1   42   21    1 f    132.9    5.5    0.0000   0.0000          ?        ?   176.8705  14.6860          ?        ?      132.9        5.5       ?       ? 
1 1 1   42   21    2 o    402.4    3.2    0.0000   0.0000          ?        ?  1619.9293  25.5409          ?        ?      402.4        3.2       ?       ? 
1 1 1   42   21    3 o    371.6    3.0    0.0000   0.0000          ?        ?  1381.7607  22.3483          ?        ?      371.6        3.0       ?       ? 
1 1 1   42   21    4 f    260.1    3.3    0.0000   0.0000          ?        ?   676.8329  17.2401          ?        ?      260.1        3.3       ?       ? 
1 1 1   42   21    5 o    287.1    3.3    0.0000   0.0000          ?        ?   824.9699  19.1556          ?        ?      287.1        3.3       ?       ? 
1 1 1   42   21    6 o    195.3    4.6    0.0000   0.0000          ?        ?   381.8359  17.8786          ?        ?      195.3        4.6       ?       ? 
1 1 1   42   21    7 o    638.9    3.8    0.0000   0.0000          ?        ?  4085.9001  48.5276          ?        ?      638.9        3.8       ?       ? 
1 1 1   42   21    8 o    270.7    4.0    0.0000   0.0000          ?        ?   733.6614  21.7097          ?        ?      270.7        4.0       ?       ? 
1 1 1   42   21    9 o    365.8    3.8    0.0000   0.0000          ?        ?  1338.9799  27.4564          ?        ?      365.8        3.8       ?       ? 
1 1 1   42   21   10 f    242.9    3.5    0.0000   0.0000          ?        ?   590.6325  17.2401          ?        ?      242.9        3.5       ?       ? 
1 1 1   42   21   11 o    468.8    3.9    0.0000   0.0000          ?        ?  2199.7070  36.3957          ?        ?      468.8        3.9       ?       ? 
1 1 1   42   21   12 o    127.3    4.8    0.0000   0.0000          ?        ?   162.1845  12.1319          ?        ?      127.3        4.8       ?       ? 
1 1 1   42   21   13 o    172.2    3.7    0.0000   0.0000          ?        ?   296.9126  12.7704          ?        ?      172.2        3.7       ?       ? 
1 1 1   42   21   14 f     17.2    8.6    0.0000   0.0000          ?        ?   -28.7335  11.4934          ?        ?       17.2        8.6       ?       ? 
1 1 1   42   21   15 o    199.2    3.7    0.0000   0.0000          ?        ?   397.1605  14.6860          ?        ?      199.2        3.7       ?       ? 
1 1 1   42   21   16 o    194.3    4.1    0.0000   0.0000          ?        ?   378.0048  15.9630          ?        ?      194.3        4.1       ?       ? 
1 1 1   42   21   17 o    278.9    3.4    0.0000   0.0000          ?        ?   778.3578  19.1556          ?        ?      278.9        3.4       ?       ? 
1 1 1   42   21   18 o    565.5    3.0    0.0000   0.0000          ?        ?  3200.2705  33.8416          ?        ?      565.5        3.0       ?       ? 
1 1 1   42   21   19 o    195.7    3.3    0.0000   0.0000          ?        ?   383.1130  12.7704          ?        ?      195.7        3.3       ?       ? 
1 1 1   42   21   20 o    585.5    2.7    0.0000   0.0000          ?        ?  3430.1382  31.9261          ?        ?      585.5        2.7       ?       ? 
1 1 1   42   21   21 o     40.9   13.1    0.0000   0.0000          ?        ?    16.6016  12.1319          ?        ?       40.9       13.1       ?       ? 
1 1 1   42   21   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   21   23 o     34.1   13.2    0.0000   0.0000          ?        ?     7.6623  12.7704          ?        ?       34.1       13.2       ?       ? 
1 1 1   42   21   24 o    224.1    3.3    0.0000   0.0000          ?        ?   502.5165  14.6860          ?        ?      224.1        3.3       ?       ? 
1 1 1   42   21   25 o     31.8   13.1    0.0000   0.0000          ?        ?     3.1926  13.4090          ?        ?       31.8       13.1       ?       ? 
1 1 1   42   21   26 o    150.8    4.7    0.0000   0.0000          ?        ?   227.9522  14.0475          ?        ?      150.8        4.7       ?       ? 
1 1 1   42   21   27 o    171.8    4.1    0.0000   0.0000          ?        ?   295.6355  14.0475          ?        ?      171.8        4.1       ?       ? 
1 1 1   42   21   28 o    161.5    4.3    0.0000   0.0000          ?        ?   261.1554  14.0475          ?        ?      161.5        4.3       ?       ? 
1 1 1   42   21   29 o     17.1    8.7    0.0000   0.0000          ?        ?   -51.0817  14.6860          ?        ?       17.1        8.7       ?       ? 
1 1 1   42   21   30 o    179.2    4.5    0.0000   0.0000          ?        ?   321.8149  15.9630          ?        ?      179.2        4.5       ?       ? 
1 1 1   42   21   31 o    100.8    7.9    0.0000   0.0000          ?        ?   102.1635  15.9630          ?        ?      100.8        7.9       ?       ? 
1 1 1   42   21   32 o    210.3    3.9    0.0000   0.0000          ?        ?   443.1340  16.6016          ?        ?      210.3        3.9       ?       ? 
1 1 1   42   21   33 o    305.9    3.0    0.0000   0.0000          ?        ?   936.7112  18.5171          ?        ?      305.9        3.0       ?       ? 
1 1 1   42   21   34 o     55.4   14.7    0.0000   0.0000          ?        ?    32.5646  16.6016          ?        ?       55.4       14.7       ?       ? 
1 1 1   42   21   35 o    131.5    5.8    0.0000   0.0000          ?        ?   173.6779  15.3245          ?        ?      131.5        5.8       ?       ? 
1 1 1   42   21   36 o     63.7   13.0    0.0000   0.0000          ?        ?    42.7809  15.9630          ?        ?       63.7       13.0       ?       ? 
1 1 1   42   21   37 o    168.1    4.7    0.0000   0.0000          ?        ?   283.5036  15.9630          ?        ?      168.1        4.7       ?       ? 
1 1 1   42   21   38 o     70.8   11.7    0.0000   0.0000          ?        ?    51.0817  16.6016          ?        ?       70.8       11.7       ?       ? 
1 1 1   42   21   39 o    146.8    5.7    0.0000   0.0000          ?        ?   216.4588  16.6016          ?        ?      146.8        5.7       ?       ? 
1 1 1   42   21   40 o    163.9    4.9    0.0000   0.0000          ?        ?   269.4561  15.9630          ?        ?      163.9        4.9       ?       ? 
1 1 1   42   21   41 o    300.5    3.1    0.0000   0.0000          ?        ?   904.1467  18.5171          ?        ?      300.5        3.1       ?       ? 
1 1 1   42   21   42 o    136.8    6.1    0.0000   0.0000          ?        ?   188.3639  16.6016          ?        ?      136.8        6.1       ?       ? 
1 1 1   42   21   43 o     47.2   15.0    0.0000   0.0000          ?        ?    22.9868  15.9630          ?        ?       47.2       15.0       ?       ? 
1 1 1   42   21   44 o    199.6    4.3    0.0000   0.0000          ?        ?   399.7145  17.2401          ?        ?      199.6        4.3       ?       ? 
1 1 1   42   21   45 o     95.4    9.0    0.0000   0.0000          ?        ?    92.5856  17.2401          ?        ?       95.4        9.0       ?       ? 
1 1 1   42   22    0 o     34.0   18.6   16.6016  17.8786    16.6016  17.8786    16.6016  17.8786       34.0     18.6       34.0       18.6     0.0     0.0 
1 1 1   42   22    1 o    117.3    5.4    0.0000   0.0000          ?        ?   137.9207  12.7704          ?        ?      117.3        5.4       ?       ? 
1 1 1   42   22    2 o    191.9    3.8    0.0000   0.0000          ?        ?   368.4270  14.6860          ?        ?      191.9        3.8       ?       ? 
1 1 1   42   22    3 o    275.2    3.4    0.0000   0.0000          ?        ?   757.9252  18.5171          ?        ?      275.2        3.4       ?       ? 
1 1 1   42   22    4 o    546.7    3.5    0.0000   0.0000          ?        ?  2990.8352  38.3113          ?        ?      546.7        3.5       ?       ? 
1 1 1   42   22    5 o    125.2    6.1    0.0000   0.0000          ?        ?   157.0763  15.3245          ?        ?      125.2        6.1       ?       ? 
1 1 1   42   22    6 o    278.3    3.9    0.0000   0.0000          ?        ?   775.1653  21.7097          ?        ?      278.3        3.9       ?       ? 
1 1 1   42   22    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   22    8 o     92.6    9.0    0.0000   0.0000          ?        ?    86.2004  16.6016          ?        ?       92.6        9.0       ?       ? 
1 1 1   42   22    9 o    157.3    4.7    0.0000   0.0000          ?        ?   247.7464  14.6860          ?        ?      157.3        4.7       ?       ? 
1 1 1   42   22   10 o    389.6    3.3    0.0000   0.0000          ?        ?  1519.0430  25.5409          ?        ?      389.6        3.3       ?       ? 
1 1 1   42   22   11 o    432.5    3.4    0.0000   0.0000          ?        ?  1872.1455  29.3720          ?        ?      432.5        3.4       ?       ? 
1 1 1   42   22   12 o    221.5    3.2    0.0000   0.0000          ?        ?   491.0231  14.0475          ?        ?      221.5        3.2       ?       ? 
1 1 1   42   22   13 o    241.5    3.0    0.0000   0.0000          ?        ?   583.6088  14.6860          ?        ?      241.5        3.0       ?       ? 
1 1 1   42   22   14 o    342.5    2.9    0.0000   0.0000          ?        ?  1173.6028  19.7942          ?        ?      342.5        2.9       ?       ? 
1 1 1   42   22   15 o    275.1    3.1    0.0000   0.0000          ?        ?   757.2866  17.2401          ?        ?      275.1        3.1       ?       ? 
1 1 1   42   22   16 o    426.8    3.0    0.0000   0.0000          ?        ?  1822.3407  25.5409          ?        ?      426.8        3.0       ?       ? 
1 1 1   42   22   17 o    253.7    3.5    0.0000   0.0000          ?        ?   644.2683  17.8786          ?        ?      253.7        3.5       ?       ? 
1 1 1   42   22   18 o    290.6    3.4    0.0000   0.0000          ?        ?   845.4026  19.7942          ?        ?      290.6        3.4       ?       ? 
1 1 1   42   22   19 o    159.9    3.4    0.0000   0.0000          ?        ?   256.0471  10.8549          ?        ?      159.9        3.4       ?       ? 
1 1 1   42   22   20 o    189.0    3.0    0.0000   0.0000          ?        ?   357.5721  11.4934          ?        ?      189.0        3.0       ?       ? 
1 1 1   42   22   21 o    225.5    3.0    0.0000   0.0000          ?        ?   508.9017  13.4090          ?        ?      225.5        3.0       ?       ? 
1 1 1   42   22   22 o    330.8    2.6    0.0000   0.0000          ?        ?  1095.0646  17.2401          ?        ?      330.8        2.6       ?       ? 
1 1 1   42   22   23 o    153.6    4.2    0.0000   0.0000          ?        ?   236.2530  12.7704          ?        ?      153.6        4.2       ?       ? 
1 1 1   42   22   24 o    181.4    3.7    0.0000   0.0000          ?        ?   329.4771  13.4090          ?        ?      181.4        3.7       ?       ? 
1 1 1   42   22   25 o    139.9    5.0    0.0000   0.0000          ?        ?   196.0261  14.0475          ?        ?      139.9        5.0       ?       ? 
1 1 1   42   22   26 o    174.2    4.0    0.0000   0.0000          ?        ?   303.9363  14.0475          ?        ?      174.2        4.0       ?       ? 
1 1 1   42   22   27 o     73.0    9.2    0.0000   0.0000          ?        ?    53.6358  13.4090          ?        ?       73.0        9.2       ?       ? 
1 1 1   42   22   28 o    194.9    3.9    0.0000   0.0000          ?        ?   380.5589  15.3245          ?        ?      194.9        3.9       ?       ? 
1 1 1   42   22   29 o     20.9   10.2    0.0000   0.0000          ?        ?   -26.1794  14.0475          ?        ?       20.9       10.2       ?       ? 
1 1 1   42   22   30 o    105.2    6.7    0.0000   0.0000          ?        ?   111.1028  14.0475          ?        ?      105.2        6.7       ?       ? 
1 1 1   42   22   31 o    434.9    2.7    0.0000   0.0000          ?        ?  1893.2167  23.6253          ?        ?      434.9        2.7       ?       ? 
1 1 1   42   22   32 o    289.7    3.1    0.0000   0.0000          ?        ?   840.2945  17.8786          ?        ?      289.7        3.1       ?       ? 
1 1 1   42   22   33 o    210.8    3.6    0.0000   0.0000          ?        ?   445.0496  15.3245          ?        ?      210.8        3.6       ?       ? 
1 1 1   42   22   34 o    141.3    5.4    0.0000   0.0000          ?        ?   200.4958  15.3245          ?        ?      141.3        5.4       ?       ? 
1 1 1   42   22   35 o     29.5   13.2    0.0000   0.0000          ?        ?    -6.3852  15.9630          ?        ?       29.5       13.2       ?       ? 
1 1 1   42   22   36 o    200.0    4.5    0.0000   0.0000          ?        ?   400.9916  17.8786          ?        ?      200.0        4.5       ?       ? 
1 1 1   42   22   37 o    219.6    3.9    0.0000   0.0000          ?        ?   483.3608  17.2401          ?        ?      219.6        3.9       ?       ? 
1 1 1   42   22   38 o    139.9    6.2    0.0000   0.0000          ?        ?   196.6647  17.2401          ?        ?      139.9        6.2       ?       ? 
1 1 1   42   22   39 o    117.8    7.0    0.0000   0.0000          ?        ?   139.8362  16.6016          ?        ?      117.8        7.0       ?       ? 
1 1 1   42   22   40 o     75.4   11.4    0.0000   0.0000          ?        ?    58.1055  17.2401          ?        ?       75.4       11.4       ?       ? 
1 1 1   42   22   41 o     87.9    9.8    0.0000   0.0000          ?        ?    78.5382  17.2401          ?        ?       87.9        9.8       ?       ? 
1 1 1   42   22   42 o     50.9   15.2    0.0000   0.0000          ?        ?    27.4564  16.6016          ?        ?       50.9       15.2       ?       ? 
1 1 1   42   22   43 o    218.7    3.8    0.0000   0.0000          ?        ?   479.5297  16.6016          ?        ?      218.7        3.8       ?       ? 
1 1 1   42   22   44 o    229.3    3.6    0.0000   0.0000          ?        ?   527.4188  16.6016          ?        ?      229.3        3.6       ?       ? 
1 1 1   42   23    0 o     83.9   12.3   73.4300  19.7942    73.4300  19.7942    73.4300  19.7942       83.9     12.3       83.9       12.3     0.0     0.0 
1 1 1   42   23    1 o    331.3    3.0    0.0000   0.0000          ?        ?  1098.2572  19.7942          ?        ?      331.3        3.0       ?       ? 
1 1 1   42   23    2 o    381.3    3.2    0.0000   0.0000          ?        ?  1454.5522  24.2638          ?        ?      381.3        3.2       ?       ? 
1 1 1   42   23    3 o    200.1    4.8    0.0000   0.0000          ?        ?   400.9916  19.1556          ?        ?      200.1        4.8       ?       ? 
1 1 1   42   23    4 o    163.6    4.7    0.0000   0.0000          ?        ?   268.1791  15.3245          ?        ?      163.6        4.7       ?       ? 
1 1 1   42   23    5 o    190.7    4.5    0.0000   0.0000          ?        ?   363.9573  17.2401          ?        ?      190.7        4.5       ?       ? 
1 1 1   42   23    6 o    160.1    5.6    0.0000   0.0000          ?        ?   256.6857  17.8786          ?        ?      160.1        5.6       ?       ? 
1 1 1   42   23    7 o    179.4    4.8    0.0000   0.0000          ?        ?   322.4534  17.2401          ?        ?      179.4        4.8       ?       ? 
1 1 1   42   23    8 o    222.9    3.7    0.0000   0.0000          ?        ?   497.4084  16.6016          ?        ?      222.9        3.7       ?       ? 
1 1 1   42   23    9 o    218.4    3.9    0.0000   0.0000          ?        ?   477.6142  17.2401          ?        ?      218.4        3.9       ?       ? 
1 1 1   42   23   10 o    286.2    3.8    0.0000   0.0000          ?        ?   819.8618  21.7097          ?        ?      286.2        3.8       ?       ? 
1 1 1   42   23   11 o    104.9    7.0    0.0000   0.0000          ?        ?   110.4642  14.6860          ?        ?      104.9        7.0       ?       ? 
1 1 1   42   23   12 o    105.2    7.3    0.0000   0.0000          ?        ?   111.1028  15.3245          ?        ?      105.2        7.3       ?       ? 
1 1 1   42   23   13 o     66.2    9.2    0.0000   0.0000          ?        ?    44.0580  12.1319          ?        ?       66.2        9.2       ?       ? 
1 1 1   42   23   14 o    318.8    3.1    0.0000   0.0000          ?        ?  1017.1650  19.7942          ?        ?      318.8        3.1       ?       ? 
1 1 1   42   23   15 o    138.0    5.1    0.0000   0.0000          ?        ?   190.9180  14.0475          ?        ?      138.0        5.1       ?       ? 
1 1 1   42   23   16 o    236.7    3.2    0.0000   0.0000          ?        ?   560.6220  15.3245          ?        ?      236.7        3.2       ?       ? 
1 1 1   42   23   17 o    209.6    3.5    0.0000   0.0000          ?        ?   439.9414  14.6860          ?        ?      209.6        3.5       ?       ? 
1 1 1   42   23   18 o    112.6    6.2    0.0000   0.0000          ?        ?   127.0658  14.0475          ?        ?      112.6        6.2       ?       ? 
1 1 1   42   23   19 o    235.6    3.5    0.0000   0.0000          ?        ?   555.5138  16.6016          ?        ?      235.6        3.5       ?       ? 
1 1 1   42   23   20 o    117.9    4.3    0.0000   0.0000          ?        ?   139.1977  10.2163          ?        ?      117.9        4.3       ?       ? 
1 1 1   42   23   21 o     74.4    7.3    0.0000   0.0000          ?        ?    55.5514  10.8549          ?        ?       74.4        7.3       ?       ? 
1 1 1   42   23   22 o    273.1    2.7    0.0000   0.0000          ?        ?   746.4318  14.6860          ?        ?      273.1        2.7       ?       ? 
1 1 1   42   23   23 o     20.5    9.9    0.0000   0.0000          ?        ?   -21.7097  12.7704          ?        ?       20.5        9.9       ?       ? 
1 1 1   42   23   24 f    308.6    2.6    0.0000   0.0000          ?        ?   952.6743  15.9630          ?        ?      308.6        2.6       ?       ? 
1 1 1   42   23   25 o    320.7    2.8    0.0000   0.0000          ?        ?  1029.2969  17.8786          ?        ?      320.7        2.8       ?       ? 
1 1 1   42   23   26 o    270.2    3.0    0.0000   0.0000          ?        ?   730.4688  15.9630          ?        ?      270.2        3.0       ?       ? 
1 1 1   42   23   27 o    207.9    3.5    0.0000   0.0000          ?        ?   432.9177  14.6860          ?        ?      207.9        3.5       ?       ? 
1 1 1   42   23   28 o    153.3    4.8    0.0000   0.0000          ?        ?   235.6145  14.6860          ?        ?      153.3        4.8       ?       ? 
1 1 1   42   23   29 o    310.6    2.8    0.0000   0.0000          ?        ?   965.4447  17.2401          ?        ?      310.6        2.8       ?       ? 
1 1 1   42   23   30 o    206.4    3.7    0.0000   0.0000          ?        ?   426.5325  15.3245          ?        ?      206.4        3.7       ?       ? 
1 1 1   42   23   31 o    267.3    3.3    0.0000   0.0000          ?        ?   715.1442  17.8786          ?        ?      267.3        3.3       ?       ? 
1 1 1   42   23   32 o     28.3   12.8    0.0000   0.0000          ?        ?    -7.6623  15.3245          ?        ?       28.3       12.8       ?       ? 
1 1 1   42   23   33 o    158.2    4.8    0.0000   0.0000          ?        ?   250.9390  15.3245          ?        ?      158.2        4.8       ?       ? 
1 1 1   42   23   34 o    197.5    4.0    0.0000   0.0000          ?        ?   390.7752  15.9630          ?        ?      197.5        4.0       ?       ? 
1 1 1   42   23   35 o    281.8    3.2    0.0000   0.0000          ?        ?   794.9594  17.8786          ?        ?      281.8        3.2       ?       ? 
1 1 1   42   23   36 o     57.9   13.5    0.0000   0.0000          ?        ?    35.7572  15.3245          ?        ?       57.9       13.5       ?       ? 
1 1 1   42   23   37 o    182.3    4.4    0.0000   0.0000          ?        ?   333.3083  15.9630          ?        ?      182.3        4.4       ?       ? 
1 1 1   42   23   38 o    298.8    3.1    0.0000   0.0000          ?        ?   893.9303  18.5171          ?        ?      298.8        3.1       ?       ? 
1 1 1   42   23   39 o     79.2   10.1    0.0000   0.0000          ?        ?    63.8522  15.9630          ?        ?       79.2       10.1       ?       ? 
1 1 1   42   23   40 o    206.5    4.3    0.0000   0.0000          ?        ?   427.8095  17.8786          ?        ?      206.5        4.3       ?       ? 
1 1 1   42   23   41 o    142.5    5.8    0.0000   0.0000          ?        ?   204.3269  16.6016          ?        ?      142.5        5.8       ?       ? 
1 1 1   42   23   42 o     31.9   13.7    0.0000   0.0000          ?        ?    -0.6385  15.9630          ?        ?       31.9       13.7       ?       ? 
1 1 1   42   24    0 o     24.2   15.4    2.5541  15.9630     2.5541  15.9630     2.5541  15.9630       24.2     15.4       24.2       15.4     0.0     0.0 
1 1 1   42   24    1 o    265.2    3.1    0.0000   0.0000          ?        ?   703.6508  16.6016          ?        ?      265.2        3.1       ?       ? 
1 1 1   42   24    2 o    209.9    4.0    0.0000   0.0000          ?        ?   441.2184  16.6016          ?        ?      209.9        4.0       ?       ? 
1 1 1   42   24    3 o    227.3    3.5    0.0000   0.0000          ?        ?   517.2025  15.9630          ?        ?      227.3        3.5       ?       ? 
1 1 1   42   24    4 o    125.4    5.9    0.0000   0.0000          ?        ?   157.7148  14.6860          ?        ?      125.4        5.9       ?       ? 
1 1 1   42   24    5 o    280.3    3.3    0.0000   0.0000          ?        ?   786.0201  18.5171          ?        ?      280.3        3.3       ?       ? 
1 1 1   42   24    6 o    323.8    3.0    0.0000   0.0000          ?        ?  1049.0911  19.1556          ?        ?      323.8        3.0       ?       ? 
1 1 1   42   24    7 o    159.3    4.4    0.0000   0.0000          ?        ?   254.1316  14.0475          ?        ?      159.3        4.4       ?       ? 
1 1 1   42   24    8 o     32.1   13.3    0.0000   0.0000          ?        ?     2.5541  14.0475          ?        ?       32.1       13.3       ?       ? 
1 1 1   42   24    9 o     67.6    9.9    0.0000   0.0000          ?        ?    45.9736  13.4090          ?        ?       67.6        9.9       ?       ? 
1 1 1   42   24   10 o    231.7    4.0    0.0000   0.0000          ?        ?   537.6352  18.5171          ?        ?      231.7        4.0       ?       ? 
1 1 1   42   24   11 o    256.1    4.0    0.0000   0.0000          ?        ?   656.4003  20.4327          ?        ?      256.1        4.0       ?       ? 
1 1 1   42   24   12 f    198.3    4.3    0.0000   0.0000          ?        ?   393.9678  17.2401          ?        ?      198.3        4.3       ?       ? 
1 1 1   42   24   13 o    262.0    3.9    0.0000   0.0000          ?        ?   687.0493  20.4327          ?        ?      262.0        3.9       ?       ? 
1 1 1   42   24   14 o    128.7    4.5    0.0000   0.0000          ?        ?   166.0156  11.4934          ?        ?      128.7        4.5       ?       ? 
1 1 1   42   24   15 o    131.4    4.6    0.0000   0.0000          ?        ?   173.0394  12.1319          ?        ?      131.4        4.6       ?       ? 
1 1 1   42   24   16 o    271.5    3.1    0.0000   0.0000          ?        ?   737.4925  16.6016          ?        ?      271.5        3.1       ?       ? 
1 1 1   42   24   17 o    215.3    3.6    0.0000   0.0000          ?        ?   464.2052  15.3245          ?        ?      215.3        3.6       ?       ? 
1 1 1   42   24   18 o    189.1    4.1    0.0000   0.0000          ?        ?   358.2106  15.3245          ?        ?      189.1        4.1       ?       ? 
1 1 1   42   24   19 o    232.3    3.3    0.0000   0.0000          ?        ?   540.1893  15.3245          ?        ?      232.3        3.3       ?       ? 
1 1 1   42   24   20 o    277.1    3.3    0.0000   0.0000          ?        ?   768.7800  18.5171          ?        ?      277.1        3.3       ?       ? 
1 1 1   42   24   21 o    239.6    2.8    0.0000   0.0000          ?        ?   574.6694  13.4090          ?        ?      239.6        2.8       ?       ? 
1 1 1   42   24   22 o    110.0    5.2    0.0000   0.0000          ?        ?   121.3191  11.4934          ?        ?      110.0        5.2       ?       ? 
1 1 1   42   24   23 o    156.3    4.1    0.0000   0.0000          ?        ?   244.5538  12.7704          ?        ?      156.3        4.1       ?       ? 
1 1 1   42   24   24 o     38.1   13.1    0.0000   0.0000          ?        ?    13.4090  12.1319          ?        ?       38.1       13.1       ?       ? 
1 1 1   42   24   25 o    309.4    2.8    0.0000   0.0000          ?        ?   957.7824  17.2401          ?        ?      309.4        2.8       ?       ? 
1 1 1   42   24   26 o    329.7    2.8    0.0000   0.0000          ?        ?  1088.0408  18.5171          ?        ?      329.7        2.8       ?       ? 
1 1 1   42   24   27 o    346.6    2.8    0.0000   0.0000          ?        ?  1202.3362  19.1556          ?        ?      346.6        2.8       ?       ? 
1 1 1   42   24   28 o    123.1    5.4    0.0000   0.0000          ?        ?   151.9681  13.4090          ?        ?      123.1        5.4       ?       ? 
1 1 1   42   24   29 o    136.3    5.4    0.0000   0.0000          ?        ?   186.4483  14.6860          ?        ?      136.3        5.4       ?       ? 
1 1 1   42   24   30 o    323.9    2.8    0.0000   0.0000          ?        ?  1050.3680  17.8786          ?        ?      323.9        2.8       ?       ? 
1 1 1   42   24   31 o    197.0    4.1    0.0000   0.0000          ?        ?   388.8597  15.9630          ?        ?      197.0        4.1       ?       ? 
1 1 1   42   24   32 o    100.1    7.3    0.0000   0.0000          ?        ?   100.8864  14.6860          ?        ?      100.1        7.3       ?       ? 
1 1 1   42   24   33 o     25.9   12.2    0.0000   0.0000          ?        ?   -15.9630  15.9630          ?        ?       25.9       12.2       ?       ? 
1 1 1   42   24   34 f    127.5    6.0    0.0000   0.0000          ?        ?   163.4615  15.3245          ?        ?      127.5        6.0       ?       ? 
1 1 1   42   24   35 o    216.7    3.7    0.0000   0.0000          ?        ?   470.5904  15.9630          ?        ?      216.7        3.7       ?       ? 
1 1 1   42   24   36 o     79.0    9.3    0.0000   0.0000          ?        ?    63.2136  14.6860          ?        ?       79.0        9.3       ?       ? 
1 1 1   42   24   37 o     88.8    8.6    0.0000   0.0000          ?        ?    79.8152  15.3245          ?        ?       88.8        8.6       ?       ? 
1 1 1   42   24   38 o    106.9    7.8    0.0000   0.0000          ?        ?   115.5724  16.6016          ?        ?      106.9        7.8       ?       ? 
1 1 1   42   24   39 o     32.9   13.9    0.0000   0.0000          ?        ?     1.2770  15.9630          ?        ?       32.9       13.9       ?       ? 
1 1 1   42   24   40 o     91.4    9.1    0.0000   0.0000          ?        ?    84.9234  16.6016          ?        ?       91.4        9.1       ?       ? 
1 1 1   42   25    0 o     23.3   15.9  -10.2163  21.7097   -10.2163  21.7097   -10.2163  21.7097       23.3     15.9       23.3       15.9     0.0     0.0 
1 1 1   42   25    1 o    207.4    4.6    0.0000   0.0000          ?        ?   431.0021  19.1556          ?        ?      207.4        4.6       ?       ? 
1 1 1   42   25    2 o    101.9    6.0    0.0000   0.0000          ?        ?   104.0790  12.1319          ?        ?      101.9        6.0       ?       ? 
1 1 1   42   25    3 o    185.4    3.4    0.0000   0.0000          ?        ?   344.1632  12.7704          ?        ?      185.4        3.4       ?       ? 
1 1 1   42   25    4 o    159.3    3.8    0.0000   0.0000          ?        ?   254.1316  12.1319          ?        ?      159.3        3.8       ?       ? 
1 1 1   42   25    5 o    106.2    5.4    0.0000   0.0000          ?        ?   113.0183  11.4934          ?        ?      106.2        5.4       ?       ? 
1 1 1   42   25    6 o    118.4    5.1    0.0000   0.0000          ?        ?   140.4748  12.1319          ?        ?      118.4        5.1       ?       ? 
1 1 1   42   25    7 o     65.2    9.8    0.0000   0.0000          ?        ?    42.7809  12.7704          ?        ?       65.2        9.8       ?       ? 
1 1 1   42   25    8 o    219.3    3.5    0.0000   0.0000          ?        ?   481.4453  15.3245          ?        ?      219.3        3.5       ?       ? 
1 1 1   42   25    9 o    375.7    3.3    0.0000   0.0000          ?        ?  1413.0483  24.9023          ?        ?      375.7        3.3       ?       ? 
1 1 1   42   25   10 o    355.8    3.4    0.0000   0.0000          ?        ?  1267.4655  24.2638          ?        ?      355.8        3.4       ?       ? 
1 1 1   42   25   11 o    122.6    6.0    0.0000   0.0000          ?        ?   150.6911  14.6860          ?        ?      122.6        6.0       ?       ? 
1 1 1   42   25   12 o    346.1    3.2    0.0000   0.0000          ?        ?  1199.1437  22.3483          ?        ?      346.1        3.2       ?       ? 
1 1 1   42   25   13 o    375.4    3.7    0.0000   0.0000          ?        ?  1411.1328  27.4564          ?        ?      375.4        3.7       ?       ? 
1 1 1   42   25   14 o     69.0    8.8    0.0000   0.0000          ?        ?    47.8891  12.1319          ?        ?       69.0        8.8       ?       ? 
1 1 1   42   25   15 o    195.0    3.4    0.0000   0.0000          ?        ?   380.5589  13.4090          ?        ?      195.0        3.4       ?       ? 
1 1 1   42   25   16 o    145.0    4.6    0.0000   0.0000          ?        ?   210.7121  13.4090          ?        ?      145.0        4.6       ?       ? 
1 1 1   42   25   17 o    176.8    4.0    0.0000   0.0000          ?        ?   312.8756  14.0475          ?        ?      176.8        4.0       ?       ? 
1 1 1   42   25   18 o    256.7    3.1    0.0000   0.0000          ?        ?   659.5928  15.9630          ?        ?      256.7        3.1       ?       ? 
1 1 1   42   25   19 o    120.7    5.8    0.0000   0.0000          ?        ?   146.2215  14.0475          ?        ?      120.7        5.8       ?       ? 
1 1 1   42   25   20 o    127.7    5.8    0.0000   0.0000          ?        ?   163.4615  14.6860          ?        ?      127.7        5.8       ?       ? 
1 1 1   42   25   21 o    112.1    4.3    0.0000   0.0000          ?        ?   125.7888   9.5778          ?        ?      112.1        4.3       ?       ? 
1 1 1   42   25   22 o    110.0    5.2    0.0000   0.0000          ?        ?   121.3191  11.4934          ?        ?      110.0        5.2       ?       ? 
1 1 1   42   25   23 o     74.7    8.1    0.0000   0.0000          ?        ?    56.1899  12.1319          ?        ?       74.7        8.1       ?       ? 
1 1 1   42   25   24 o     91.9    6.6    0.0000   0.0000          ?        ?    84.9234  12.1319          ?        ?       91.9        6.6       ?       ? 
1 1 1   42   25   25 o    288.5    2.9    0.0000   0.0000          ?        ?   833.2708  16.6016          ?        ?      288.5        2.9       ?       ? 
1 1 1   42   25   26 o    316.7    2.8    0.0000   0.0000          ?        ?  1003.7560  17.8786          ?        ?      316.7        2.8       ?       ? 
1 1 1   42   25   27 o    219.3    3.3    0.0000   0.0000          ?        ?   481.4453  14.6860          ?        ?      219.3        3.3       ?       ? 
1 1 1   42   25   28 o     19.9    9.8    0.0000   0.0000          ?        ?   -30.6490  14.0475          ?        ?       19.9        9.8       ?       ? 
1 1 1   42   25   29 o    120.9    5.8    0.0000   0.0000          ?        ?   146.8600  14.0475          ?        ?      120.9        5.8       ?       ? 
1 1 1   42   25   30 o    422.0    2.6    0.0000   0.0000          ?        ?  1782.1139  22.3483          ?        ?      422.0        2.6       ?       ? 
1 1 1   42   25   31 o    172.1    4.5    0.0000   0.0000          ?        ?   296.9126  15.3245          ?        ?      172.1        4.5       ?       ? 
1 1 1   42   25   32 o    309.4    2.9    0.0000   0.0000          ?        ?   958.4210  17.8786          ?        ?      309.4        2.9       ?       ? 
1 1 1   42   25   33 o    167.9    4.6    0.0000   0.0000          ?        ?   282.8651  15.3245          ?        ?      167.9        4.6       ?       ? 
1 1 1   42   25   34 o     97.7    7.5    0.0000   0.0000          ?        ?    96.4168  14.6860          ?        ?       97.7        7.5       ?       ? 
1 1 1   42   25   35 o    106.1    7.2    0.0000   0.0000          ?        ?   113.6568  15.3245          ?        ?      106.1        7.2       ?       ? 
1 1 1   42   25   36 o    138.5    5.5    0.0000   0.0000          ?        ?   192.8335  15.3245          ?        ?      138.5        5.5       ?       ? 
1 1 1   42   25   37 o     29.8   13.1    0.0000   0.0000          ?        ?    -3.8311  15.3245          ?        ?       29.8       13.1       ?       ? 
1 1 1   42   25   38 o    127.1    6.3    0.0000   0.0000          ?        ?   162.8230  15.9630          ?        ?      127.1        6.3       ?       ? 
1 1 1   42   25   39 o     19.6    9.7    0.0000   0.0000          ?        ?   -35.1187  14.6860          ?        ?       19.6        9.7       ?       ? 
1 1 1   42   26    0 o    455.6    5.4 2079.0264  49.1662  2079.0264  49.1662  2079.0264  49.1662      455.6      5.4      455.6        5.4     0.0     0.0 
1 1 1   42   26    1 o    324.7    4.4    0.0000   0.0000          ?        ?  1056.1147  28.7335          ?        ?      324.7        4.4       ?       ? 
1 1 1   42   26    2 o    222.7    4.7    0.0000   0.0000          ?        ?   496.7698  21.0712          ?        ?      222.7        4.7       ?       ? 
1 1 1   42   26    3 o    243.2    5.0    0.0000   0.0000          ?        ?   592.5481  24.2638          ?        ?      243.2        5.0       ?       ? 
1 1 1   42   26    4 o    301.3    4.5    0.0000   0.0000          ?        ?   909.2548  26.8179          ?        ?      301.3        4.5       ?       ? 
1 1 1   42   26    5 f     72.5   10.6    0.0000   0.0000          ?        ?    52.9973  15.3245          ?        ?       72.5       10.6       ?       ? 
1 1 1   42   26    6 o    135.9    5.4    0.0000   0.0000          ?        ?   185.1713  14.6860          ?        ?      135.9        5.4       ?       ? 
1 1 1   42   26    7 o    223.0    4.3    0.0000   0.0000          ?        ?   498.0469  19.1556          ?        ?      223.0        4.3       ?       ? 
1 1 1   42   26    8 o    144.6    4.0    0.0000   0.0000          ?        ?   209.4351  11.4934          ?        ?      144.6        4.0       ?       ? 
1 1 1   42   26    9 f    136.4    4.4    0.0000   0.0000          ?        ?   186.4483  12.1319          ?        ?      136.4        4.4       ?       ? 
1 1 1   42   26   10 o    200.1    3.7    0.0000   0.0000          ?        ?   400.9916  14.6860          ?        ?      200.1        3.7       ?       ? 
1 1 1   42   26   11 o    200.4    4.0    0.0000   0.0000          ?        ?   402.2686  15.9630          ?        ?      200.4        4.0       ?       ? 
1 1 1   42   26   12 o    350.8    3.5    0.0000   0.0000          ?        ?  1231.7081  24.9023          ?        ?      350.8        3.5       ?       ? 
1 1 1   42   26   13 o    175.4    4.7    0.0000   0.0000          ?        ?   308.4059  16.6016          ?        ?      175.4        4.7       ?       ? 
1 1 1   42   26   14 f    107.8    7.4    0.0000   0.0000          ?        ?   116.8494  15.9630          ?        ?      107.8        7.4       ?       ? 
1 1 1   42   26   15 o     15.9    7.9    0.0000   0.0000          ?        ?   -31.2876  10.8549          ?        ?       15.9        7.9       ?       ? 
1 1 1   42   26   16 o    288.7    3.0    0.0000   0.0000          ?        ?   833.9093  17.2401          ?        ?      288.7        3.0       ?       ? 
1 1 1   42   26   17 o    144.6    4.6    0.0000   0.0000          ?        ?   209.4351  13.4090          ?        ?      144.6        4.6       ?       ? 
1 1 1   42   26   18 o     83.9    8.0    0.0000   0.0000          ?        ?    70.8759  13.4090          ?        ?       83.9        8.0       ?       ? 
1 1 1   42   26   19 o     60.1   11.0    0.0000   0.0000          ?        ?    37.6728  12.7704          ?        ?       60.1       11.0       ?       ? 
1 1 1   42   26   20 o     83.1    8.5    0.0000   0.0000          ?        ?    69.5989  14.0475          ?        ?       83.1        8.5       ?       ? 
1 1 1   42   26   21 o    188.4    4.1    0.0000   0.0000          ?        ?   355.6566  15.3245          ?        ?      188.4        4.1       ?       ? 
1 1 1   42   26   22 o    256.2    2.6    0.0000   0.0000          ?        ?   657.0388  13.4090          ?        ?      256.2        2.6       ?       ? 
1 1 1   42   26   23 o    111.1    5.2    0.0000   0.0000          ?        ?   123.8732  11.4934          ?        ?      111.1        5.2       ?       ? 
1 1 1   42   26   24 o     18.0    8.9    0.0000   0.0000          ?        ?   -24.9023  11.4934          ?        ?       18.0        8.9       ?       ? 
1 1 1   42   26   25 o    149.8    4.3    0.0000   0.0000          ?        ?   224.7596  12.7704          ?        ?      149.8        4.3       ?       ? 
1 1 1   42   26   26 o    166.9    4.0    0.0000   0.0000          ?        ?   279.0340  13.4090          ?        ?      166.9        4.0       ?       ? 
1 1 1   42   26   27 o    216.2    3.4    0.0000   0.0000          ?        ?   468.0364  14.6860          ?        ?      216.2        3.4       ?       ? 
1 1 1   42   26   28 o    259.7    3.1    0.0000   0.0000          ?        ?   675.5559  15.9630          ?        ?      259.7        3.1       ?       ? 
1 1 1   42   26   29 o    262.3    3.0    0.0000   0.0000          ?        ?   688.9648  15.9630          ?        ?      262.3        3.0       ?       ? 
1 1 1   42   26   30 o    187.9    3.7    0.0000   0.0000          ?        ?   353.7410  14.0475          ?        ?      187.9        3.7       ?       ? 
1 1 1   42   26   31 o    243.0    3.3    0.0000   0.0000          ?        ?   591.2710  15.9630          ?        ?      243.0        3.3       ?       ? 
1 1 1   42   26   32 o     31.4   13.3    0.0000   0.0000          ?        ?     0.6385  14.6860          ?        ?       31.4       13.3       ?       ? 
1 1 1   42   26   33 o    128.8    5.5    0.0000   0.0000          ?        ?   166.6541  14.0475          ?        ?      128.8        5.5       ?       ? 
1 1 1   42   26   34 f    200.6    3.8    0.0000   0.0000          ?        ?   403.5457  15.3245          ?        ?      200.6        3.8       ?       ? 
1 1 1   42   26   35 o    142.4    5.2    0.0000   0.0000          ?        ?   203.6884  14.6860          ?        ?      142.4        5.2       ?       ? 
1 1 1   42   26   36 o     99.6    7.4    0.0000   0.0000          ?        ?   100.2479  14.6860          ?        ?       99.6        7.4       ?       ? 
1 1 1   42   26   37 o    108.7    7.0    0.0000   0.0000          ?        ?   119.4035  15.3245          ?        ?      108.7        7.0       ?       ? 
1 1 1   42   27    0 o     85.8   30.9  100.2479  48.5276   100.2479  48.5276   100.2479  48.5276       85.8     30.9       85.8       30.9     0.0     0.0 
1 1 1   42   27    1 o    260.7    9.1    0.0000   0.0000          ?        ?   684.4952  47.2506          ?        ?      260.7        9.1       ?       ? 
1 1 1   42   27    2 o    207.8    7.5    0.0000   0.0000          ?        ?   434.1947  31.2876          ?        ?      207.8        7.5       ?       ? 
1 1 1   42   27    3 o     74.6   10.7    0.0000   0.0000          ?        ?    56.1899  15.9630          ?        ?       74.6       10.7       ?       ? 
1 1 1   42   27    4 f    402.8    5.2    0.0000   0.0000          ?        ?  1626.3146  41.5039          ?        ?      402.8        5.2       ?       ? 
1 1 1   42   27    5 o    299.2    4.4    0.0000   0.0000          ?        ?   896.4843  26.1794          ?        ?      299.2        4.4       ?       ? 
1 1 1   42   27    6 o    227.3    4.9    0.0000   0.0000          ?        ?   517.8410  22.3483          ?        ?      227.3        4.9       ?       ? 
1 1 1   42   27    7 f    100.2    8.0    0.0000   0.0000          ?        ?   100.8864  15.9630          ?        ?      100.2        8.0       ?       ? 
1 1 1   42   27    8 o    179.3    5.3    0.0000   0.0000          ?        ?   322.4534  19.1556          ?        ?      179.3        5.3       ?       ? 
1 1 1   42   27    9 o    158.3    6.5    0.0000   0.0000          ?        ?   251.5775  20.4327          ?        ?      158.3        6.5       ?       ? 
1 1 1   42   27   10 o    259.8    4.8    0.0000   0.0000          ?        ?   676.1944  24.9023          ?        ?      259.8        4.8       ?       ? 
1 1 1   42   27   11 o    421.6    3.2    0.0000   0.0000          ?        ?  1779.5598  26.8179          ?        ?      421.6        3.2       ?       ? 
1 1 1   42   27   12 o    236.1    3.4    0.0000   0.0000          ?        ?   558.0679  15.9630          ?        ?      236.1        3.4       ?       ? 
1 1 1   42   27   13 o    217.5    3.8    0.0000   0.0000          ?        ?   473.7830  16.6016          ?        ?      217.5        3.8       ?       ? 
1 1 1   42   27   14 o    112.2    6.3    0.0000   0.0000          ?        ?   126.4273  14.0475          ?        ?      112.2        6.3       ?       ? 
1 1 1   42   27   15 o    242.6    3.9    0.0000   0.0000          ?        ?   589.3555  19.1556          ?        ?      242.6        3.9       ?       ? 
1 1 1   42   27   16 o     87.3    6.6    0.0000   0.0000          ?        ?    76.6226  11.4934          ?        ?       87.3        6.6       ?       ? 
1 1 1   42   27   17 o    283.0    3.2    0.0000   0.0000          ?        ?   801.9832  17.8786          ?        ?      283.0        3.2       ?       ? 
1 1 1   42   27   18 o    246.3    3.2    0.0000   0.0000          ?        ?   607.2341  15.9630          ?        ?      246.3        3.2       ?       ? 
1 1 1   42   27   19 o     83.1    8.8    0.0000   0.0000          ?        ?    69.5989  14.6860          ?        ?       83.1        8.8       ?       ? 
1 1 1   42   27   20 o    328.3    3.4    0.0000   0.0000          ?        ?  1079.1016  22.3483          ?        ?      328.3        3.4       ?       ? 
1 1 1   42   27   21 o    307.2    3.0    0.0000   0.0000          ?        ?   945.0120  18.5171          ?        ?      307.2        3.0       ?       ? 
1 1 1   42   27   22 o    199.4    3.8    0.0000   0.0000          ?        ?   398.4375  15.3245          ?        ?      199.4        3.8       ?       ? 
1 1 1   42   27   23 o    149.8    3.8    0.0000   0.0000          ?        ?   224.7596  11.4934          ?        ?      149.8        3.8       ?       ? 
1 1 1   42   27   24 o    139.9    4.1    0.0000   0.0000          ?        ?   196.0261  11.4934          ?        ?      139.9        4.1       ?       ? 
1 1 1   42   27   25 o    107.3    5.4    0.0000   0.0000          ?        ?   115.5724  11.4934          ?        ?      107.3        5.4       ?       ? 
1 1 1   42   27   26 o     96.9    6.3    0.0000   0.0000          ?        ?    94.5012  12.1319          ?        ?       96.9        6.3       ?       ? 
1 1 1   42   27   27 o    177.8    4.0    0.0000   0.0000          ?        ?   316.7067  14.0475          ?        ?      177.8        4.0       ?       ? 
1 1 1   42   27   28 o    107.2    6.3    0.0000   0.0000          ?        ?   115.5724  13.4090          ?        ?      107.2        6.3       ?       ? 
1 1 1   42   27   29 o     90.0    7.4    0.0000   0.0000          ?        ?    81.7308  13.4090          ?        ?       90.0        7.4       ?       ? 
1 1 1   42   27   30 o    290.0    2.9    0.0000   0.0000          ?        ?   842.2100  16.6016          ?        ?      290.0        2.9       ?       ? 
1 1 1   42   27   31 o     25.5   11.6    0.0000   0.0000          ?        ?    -8.9393  13.4090          ?        ?       25.5       11.6       ?       ? 
1 1 1   42   27   32 o    120.2    6.1    0.0000   0.0000          ?        ?   145.5829  14.6860          ?        ?      120.2        6.1       ?       ? 
1 1 1   42   27   33 o    105.0    6.7    0.0000   0.0000          ?        ?   111.1028  14.0475          ?        ?      105.0        6.7       ?       ? 
1 1 1   42   27   34 o     41.3   14.1    0.0000   0.0000          ?        ?    16.6016  14.0475          ?        ?       41.3       14.1       ?       ? 
1 1 1   42   27   35 o     56.6   13.2    0.0000   0.0000          ?        ?    34.4802  14.6860          ?        ?       56.6       13.2       ?       ? 
1 1 1   42   28    0 o     73.8   31.8   80.4537  47.8891    80.4537  47.8891    80.4537  47.8891       73.8     31.8       73.8       31.8     0.0     0.0 
1 1 1   42   28    1 o    135.9   19.5    0.0000   0.0000          ?        ?   191.5565  52.9973          ?        ?      135.9       19.5       ?       ? 
1 1 1   42   28    2 o    259.0    6.0    0.0000   0.0000          ?        ?   673.0018  31.2876          ?        ?      259.0        6.0       ?       ? 
1 1 1   42   28    3 o    205.5   10.1    0.0000   0.0000          ?        ?   426.5325  41.5039          ?        ?      205.5       10.1       ?       ? 
1 1 1   42   28    4 o    217.1    9.1    0.0000   0.0000          ?        ?   475.0601  39.5883          ?        ?      217.1        9.1       ?       ? 
1 1 1   42   28    5 o     55.3   23.7    0.0000   0.0000          ?        ?     2.5541  46.6121          ?        ?       55.3       23.7       ?       ? 
1 1 1   42   28    6 o    136.9    7.0    0.0000   0.0000          ?        ?   188.3639  19.1556          ?        ?      136.9        7.0       ?       ? 
1 1 1   42   28    7 o    285.8    4.4    0.0000   0.0000          ?        ?   818.5847  24.9023          ?        ?      285.8        4.4       ?       ? 
1 1 1   42   28    8 o    133.9    6.2    0.0000   0.0000          ?        ?   180.0631  16.6016          ?        ?      133.9        6.2       ?       ? 
1 1 1   42   28    9 o    274.4    4.4    0.0000   0.0000          ?        ?   754.7325  24.2638          ?        ?      274.4        4.4       ?       ? 
1 1 1   42   28   10 o    179.6    5.9    0.0000   0.0000          ?        ?   323.7305  21.0712          ?        ?      179.6        5.9       ?       ? 
1 1 1   42   28   11 o     95.3   10.7    0.0000   0.0000          ?        ?    91.9471  20.4327          ?        ?       95.3       10.7       ?       ? 
1 1 1   42   28   12 o     28.6   13.4    0.0000   0.0000          ?        ?   -18.5171  19.1556          ?        ?       28.6       13.4       ?       ? 
1 1 1   42   28   13 o    129.1    7.9    0.0000   0.0000          ?        ?   167.9312  20.4327          ?        ?      129.1        7.9       ?       ? 
1 1 1   42   28   14 o    270.7    3.4    0.0000   0.0000          ?        ?   733.6614  18.5171          ?        ?      270.7        3.4       ?       ? 
1 1 1   42   28   15 o    193.7    4.3    0.0000   0.0000          ?        ?   376.0892  16.6016          ?        ?      193.7        4.3       ?       ? 
1 1 1   42   28   16 o     50.4   11.6    0.0000   0.0000          ?        ?    26.8179  11.4934          ?        ?       50.4       11.6       ?       ? 
1 1 1   42   28   17 o    241.8    3.3    0.0000   0.0000          ?        ?   585.5243  15.9630          ?        ?      241.8        3.3       ?       ? 
1 1 1   42   28   18 o    143.6    4.7    0.0000   0.0000          ?        ?   206.8810  13.4090          ?        ?      143.6        4.7       ?       ? 
1 1 1   42   28   19 o    220.1    3.5    0.0000   0.0000          ?        ?   485.2764  15.3245          ?        ?      220.1        3.5       ?       ? 
1 1 1   42   28   20 o    100.2    6.7    0.0000   0.0000          ?        ?   100.8864  13.4090          ?        ?      100.2        6.7       ?       ? 
1 1 1   42   28   21 f    199.1    3.8    0.0000   0.0000          ?        ?   397.1605  15.3245          ?        ?      199.1        3.8       ?       ? 
1 1 1   42   28   22 o    163.9    4.5    0.0000   0.0000          ?        ?   269.4561  14.6860          ?        ?      163.9        4.5       ?       ? 
1 1 1   42   28   23 o     51.1   10.4    0.0000   0.0000          ?        ?    27.4564  10.2163          ?        ?       51.1       10.4       ?       ? 
1 1 1   42   28   24 o    301.0    2.5    0.0000   0.0000          ?        ?   906.7007  15.3245          ?        ?      301.0        2.5       ?       ? 
1 1 1   42   28   25 o    121.2    5.0    0.0000   0.0000          ?        ?   147.4985  12.1319          ?        ?      121.2        5.0       ?       ? 
1 1 1   42   28   26 o     20.7   10.0    0.0000   0.0000          ?        ?   -17.8786  12.1319          ?        ?       20.7       10.0       ?       ? 
1 1 1   42   28   27 o     23.2   10.9    0.0000   0.0000          ?        ?   -12.7704  12.7704          ?        ?       23.2       10.9       ?       ? 
1 1 1   42   28   28 o    191.6    3.5    0.0000   0.0000          ?        ?   367.7885  13.4090          ?        ?      191.6        3.5       ?       ? 
1 1 1   42   28   29 o    444.7    2.5    0.0000   0.0000          ?        ?  1980.0555  22.3483          ?        ?      444.7        2.5       ?       ? 
1 1 1   42   28   30 o    104.7    6.4    0.0000   0.0000          ?        ?   110.4642  13.4090          ?        ?      104.7        6.4       ?       ? 
1 1 1   42   28   31 o     91.7    7.3    0.0000   0.0000          ?        ?    84.9234  13.4090          ?        ?       91.7        7.3       ?       ? 
1 1 1   42   28   32 o    128.2    5.5    0.0000   0.0000          ?        ?   165.3771  14.0475          ?        ?      128.2        5.5       ?       ? 
1 1 1   42   28   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   29    0 o    211.7   17.0  463.5667  70.8759   463.5667  70.8759   463.5667  70.8759      211.7     17.0      211.7       17.0     0.0     0.0 
1 1 1   42   29    1 o    311.8    7.1    0.0000   0.0000          ?        ?   977.5767  44.0580          ?        ?      311.8        7.1       ?       ? 
1 1 1   42   29    2 f    129.4   12.8    0.0000   0.0000          ?        ?   170.4853  33.2031          ?        ?      129.4       12.8       ?       ? 
1 1 1   42   29    3 o     80.2   23.8    0.0000   0.0000          ?        ?    69.5989  40.8654          ?        ?       80.2       23.8       ?       ? 
1 1 1   42   29    4 o    170.9   10.6    0.0000   0.0000          ?        ?   295.6355  36.3957          ?        ?      170.9       10.6       ?       ? 
1 1 1   42   29    5 o    326.5    5.7    0.0000   0.0000          ?        ?  1069.5237  37.0343          ?        ?      326.5        5.7       ?       ? 
1 1 1   42   29    6 o    113.8   15.1    0.0000   0.0000          ?        ?   132.8125  34.4802          ?        ?      113.8       15.1       ?       ? 
1 1 1   42   29    7 o    171.7   11.2    0.0000   0.0000          ?        ?   298.8281  38.3113          ?        ?      171.7       11.2       ?       ? 
1 1 1   42   29    8 o    269.4    5.1    0.0000   0.0000          ?        ?   727.9147  27.4564          ?        ?      269.4        5.1       ?       ? 
1 1 1   42   29    9 o    286.5    5.0    0.0000   0.0000          ?        ?   823.0543  28.7335          ?        ?      286.5        5.0       ?       ? 
1 1 1   42   29   10 o     82.1   10.9    0.0000   0.0000          ?        ?    68.3218  17.8786          ?        ?       82.1       10.9       ?       ? 
1 1 1   42   29   11 o    124.6    7.7    0.0000   0.0000          ?        ?   156.4378  19.1556          ?        ?      124.6        7.7       ?       ? 
1 1 1   42   29   12 o     61.4   15.2    0.0000   0.0000          ?        ?    40.2269  18.5171          ?        ?       61.4       15.2       ?       ? 
1 1 1   42   29   13 f    139.1    7.3    0.0000   0.0000          ?        ?   194.7491  20.4327          ?        ?      139.1        7.3       ?       ? 
1 1 1   42   29   14 o    171.0    7.1    0.0000   0.0000          ?        ?   294.3585  24.2638          ?        ?      171.0        7.1       ?       ? 
1 1 1   42   29   15 o     88.2   11.9    0.0000   0.0000          ?        ?    79.1767  21.0712          ?        ?       88.2       11.9       ?       ? 
1 1 1   42   29   16 o    155.6    4.1    0.0000   0.0000          ?        ?   242.6382  12.7704          ?        ?      155.6        4.1       ?       ? 
1 1 1   42   29   17 o    166.9    3.6    0.0000   0.0000          ?        ?   279.0340  12.1319          ?        ?      166.9        3.6       ?       ? 
1 1 1   42   29   18 o    212.9    3.4    0.0000   0.0000          ?        ?   453.9889  14.6860          ?        ?      212.9        3.4       ?       ? 
1 1 1   42   29   19 o    137.3    4.9    0.0000   0.0000          ?        ?   189.0024  13.4090          ?        ?      137.3        4.9       ?       ? 
1 1 1   42   29   20 o     63.4   10.6    0.0000   0.0000          ?        ?    40.8654  13.4090          ?        ?       63.4       10.6       ?       ? 
1 1 1   42   29   21 o    150.3    4.9    0.0000   0.0000          ?        ?   226.6752  14.6860          ?        ?      150.3        4.9       ?       ? 
1 1 1   42   29   22 o     67.3   10.4    0.0000   0.0000          ?        ?    45.9736  14.0475          ?        ?       67.3       10.4       ?       ? 
1 1 1   42   29   23 o    128.8    5.5    0.0000   0.0000          ?        ?   166.6541  14.0475          ?        ?      128.8        5.5       ?       ? 
1 1 1   42   29   24 f    128.9    4.0    0.0000   0.0000          ?        ?   166.6541  10.2163          ?        ?      128.9        4.0       ?       ? 
1 1 1   42   29   25 o    164.9    3.7    0.0000   0.0000          ?        ?   272.6487  12.1319          ?        ?      164.9        3.7       ?       ? 
1 1 1   42   29   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   29   27 o    168.3    3.8    0.0000   0.0000          ?        ?   284.1421  12.7704          ?        ?      168.3        3.8       ?       ? 
1 1 1   42   29   28 o    194.5    3.6    0.0000   0.0000          ?        ?   379.2819  14.0475          ?        ?      194.5        3.6       ?       ? 
1 1 1   42   29   29 o    125.3    5.1    0.0000   0.0000          ?        ?   157.7148  12.7704          ?        ?      125.3        5.1       ?       ? 
1 1 1   42   29   30 o     23.6   11.0    0.0000   0.0000          ?        ?   -11.4934  12.7704          ?        ?       23.6       11.0       ?       ? 
1 1 1   42   30    0 o     57.6   32.3   49.8047  55.5514    49.8047  55.5514    49.8047  55.5514       57.6     32.3       57.6       32.3     0.0     0.0 
1 1 1   42   30    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   30    2 o    134.1   28.7    0.0000   0.0000          ?        ?   203.6884  74.7070          ?        ?      134.1       28.7       ?       ? 
1 1 1   42   30    3 o    395.2    6.9    0.0000   0.0000          ?        ?  1570.7632  54.9129          ?        ?      395.2        6.9       ?       ? 
1 1 1   42   30    4 o    183.3   14.6    0.0000   0.0000          ?        ?   344.8017  53.6358          ?        ?      183.3       14.6       ?       ? 
1 1 1   42   30    5 o    310.7    7.8    0.0000   0.0000          ?        ?   972.4684  48.5276          ?        ?      310.7        7.8       ?       ? 
1 1 1   42   30    6 f    217.0    9.3    0.0000   0.0000          ?        ?   475.6986  40.2269          ?        ?      217.0        9.3       ?       ? 
1 1 1   42   30    7 o    328.1    6.4    0.0000   0.0000          ?        ?  1082.2942  42.1424          ?        ?      328.1        6.4       ?       ? 
1 1 1   42   30    8 o    325.7    9.1    0.0000   0.0000          ?        ?  1072.0778  59.3825          ?        ?      325.7        9.1       ?       ? 
1 1 1   42   30    9 o    254.2    9.3    0.0000   0.0000          ?        ?   653.2076  47.2506          ?        ?      254.2        9.3       ?       ? 
1 1 1   42   30   10 f    226.5   17.2    0.0000   0.0000          ?        ?   532.5270  77.8996          ?        ?      226.5       17.2       ?       ? 
1 1 1   42   30   11 o    241.6    3.7    0.0000   0.0000          ?        ?   584.8858  17.8786          ?        ?      241.6        3.7       ?       ? 
1 1 1   42   30   12 o     21.9   10.9    0.0000   0.0000          ?        ?   -45.3350  18.5171          ?        ?       21.9       10.9       ?       ? 
1 1 1   42   30   13 o    248.0    5.4    0.0000   0.0000          ?        ?   617.4504  26.8179          ?        ?      248.0        5.4       ?       ? 
1 1 1   42   30   14 o     66.3   16.0    0.0000   0.0000          ?        ?    47.2506  21.0712          ?        ?       66.3       16.0       ?       ? 
1 1 1   42   30   15 o    115.8   10.2    0.0000   0.0000          ?        ?   136.0051  23.6253          ?        ?      115.8       10.2       ?       ? 
1 1 1   42   30   16 f    109.8   11.1    0.0000   0.0000          ?        ?   122.5962  24.2638          ?        ?      109.8       11.1       ?       ? 
1 1 1   42   30   17 f    199.8    2.9    0.0000   0.0000          ?        ?   399.7145  11.4934          ?        ?      199.8        2.9       ?       ? 
1 1 1   42   30   18 o     65.6    7.8    0.0000   0.0000          ?        ?    43.4195  10.2163          ?        ?       65.6        7.8       ?       ? 
1 1 1   42   30   19 o    208.3    3.5    0.0000   0.0000          ?        ?   434.8332  14.6860          ?        ?      208.3        3.5       ?       ? 
1 1 1   42   30   20 o     88.2    7.6    0.0000   0.0000          ?        ?    78.5382  13.4090          ?        ?       88.2        7.6       ?       ? 
1 1 1   42   30   21 o    176.3    4.0    0.0000   0.0000          ?        ?   311.5985  14.0475          ?        ?      176.3        4.0       ?       ? 
1 1 1   42   30   22 o     74.1    8.6    0.0000   0.0000          ?        ?    55.5514  12.7704          ?        ?       74.1        8.6       ?       ? 
1 1 1   42   30   23 o     39.4   14.1    0.0000   0.0000          ?        ?    14.0475  14.0475          ?        ?       39.4       14.1       ?       ? 
1 1 1   42   30   24 o    140.4    5.0    0.0000   0.0000          ?        ?   197.9417  14.0475          ?        ?      140.4        5.0       ?       ? 
1 1 1   42   30   25 o     92.6    5.5    0.0000   0.0000          ?        ?    86.2004  10.2163          ?        ?       92.6        5.5       ?       ? 
1 1 1   42   30   26 o    171.4    3.5    0.0000   0.0000          ?        ?   294.3585  12.1319          ?        ?      171.4        3.5       ?       ? 
1 1 1   42   30   27 o    167.2    3.8    0.0000   0.0000          ?        ?   280.3110  12.7704          ?        ?      167.2        3.8       ?       ? 
1 1 1   42   31    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   31    1 o     44.2   20.3    0.0000   0.0000          ?        ?   -26.8179  41.5039          ?        ?       44.2       20.3       ?       ? 
1 1 1   42   31    2 o     36.0   17.3    0.0000   0.0000          ?        ?   -50.4432  36.3957          ?        ?       36.0       17.3       ?       ? 
1 1 1   42   31    3 o    207.2   14.3    0.0000   0.0000          ?        ?   441.2184  59.3825          ?        ?      207.2       14.3       ?       ? 
1 1 1   42   31    4 o    117.9   34.9    0.0000   0.0000          ?        ?   166.6541  88.1160          ?        ?      117.9       34.9       ?       ? 
1 1 1   42   31    5 o     67.5   24.7    0.0000   0.0000          ?        ?    42.7809  43.4195          ?        ?       67.5       24.7       ?       ? 
1 1 1   42   31    6 o     64.8   24.7    0.0000   0.0000          ?        ?    35.1187  44.6965          ?        ?       64.8       24.7       ?       ? 
1 1 1   42   31    7 o    264.4   16.9    0.0000   0.0000          ?        ?   726.6376  89.3930          ?        ?      264.4       16.9       ?       ? 
1 1 1   42   31    8 o     80.2   24.0    0.0000   0.0000          ?        ?    70.8759  41.5039          ?        ?       80.2       24.0       ?       ? 
1 1 1   42   31    9 f    304.3    7.0    0.0000   0.0000          ?        ?   932.2416  42.7809          ?        ?      304.3        7.0       ?       ? 
1 1 1   42   31   10 o     85.9   27.0    0.0000   0.0000          ?        ?    82.3693  51.7203          ?        ?       85.9       27.0       ?       ? 
1 1 1   42   31   11 f     62.2   23.6    0.0000   0.0000          ?        ?    33.2031  40.2269          ?        ?       62.2       23.6       ?       ? 
1 1 1   42   31   12 o     38.1   14.3    0.0000   0.0000          ?        ?    11.4934  14.6860          ?        ?       38.1       14.3       ?       ? 
1 1 1   42   31   13 o    110.4    8.7    0.0000   0.0000          ?        ?   123.2347  19.1556          ?        ?      110.4        8.7       ?       ? 
1 1 1   42   31   14 o     69.3   13.8    0.0000   0.0000          ?        ?    51.0817  18.5171          ?        ?       69.3       13.8       ?       ? 
1 1 1   42   31   15 o    288.0    5.0    0.0000   0.0000          ?        ?   832.6321  28.7335          ?        ?      288.0        5.0       ?       ? 
1 1 1   42   31   16 o     77.7   14.9    0.0000   0.0000          ?        ?    64.4907  22.3483          ?        ?       77.7       14.9       ?       ? 
1 1 1   42   31   17 f    137.5    7.7    0.0000   0.0000          ?        ?   190.9180  21.0712          ?        ?      137.5        7.7       ?       ? 
1 1 1   42   31   18 o    237.3    3.6    0.0000   0.0000          ?        ?   564.4531  17.2401          ?        ?      237.3        3.6       ?       ? 
1 1 1   42   31   19 o     97.6    5.6    0.0000   0.0000          ?        ?    95.7782  10.8549          ?        ?       97.6        5.6       ?       ? 
1 1 1   42   31   20 o    178.8    3.6    0.0000   0.0000          ?        ?   320.5379  12.7704          ?        ?      178.8        3.6       ?       ? 
1 1 1   42   31   21 o     17.1    8.6    0.0000   0.0000          ?        ?   -37.0343  12.7704          ?        ?       17.1        8.6       ?       ? 
1 1 1   42   31   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   31   23 o    101.2    6.9    0.0000   0.0000          ?        ?   103.4405  14.0475          ?        ?      101.2        6.9       ?       ? 
1 1 1   42   31   24 o     78.9    8.5    0.0000   0.0000          ?        ?    63.2136  13.4090          ?        ?       78.9        8.5       ?       ? 
1 1 1   42   32    0 o    198.3   14.0  404.8227  54.9129   404.8227  54.9129   404.8227  54.9129      198.3     14.0      198.3       14.0     0.0     0.0 
1 1 1   42   32    1 o    300.1    8.4    0.0000   0.0000          ?        ?   909.8933  50.4432          ?        ?      300.1        8.4       ?       ? 
1 1 1   42   32    2 o    248.4   12.5    0.0000   0.0000          ?        ?   631.4979  61.9366          ?        ?      248.4       12.5       ?       ? 
1 1 1   42   32    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   32    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   32    5 o    131.0   16.6    0.0000   0.0000          ?        ?   178.7861  43.4195          ?        ?      131.0       16.6       ?       ? 
1 1 1   42   32    6 o    245.9   12.2    0.0000   0.0000          ?        ?   618.7275  60.0210          ?        ?      245.9       12.2       ?       ? 
1 1 1   42   32    7 o    185.7   11.9    0.0000   0.0000          ?        ?   352.4639  44.0580          ?        ?      185.7       11.9       ?       ? 
1 1 1   42   32    8 o    188.3   11.9    0.0000   0.0000          ?        ?   362.6803  44.6965          ?        ?      188.3       11.9       ?       ? 
1 1 1   42   32    9 o     82.7   31.2    0.0000   0.0000          ?        ?    68.9603  70.2374          ?        ?       82.7       31.2       ?       ? 
1 1 1   42   32   10 o     99.0   23.3    0.0000   0.0000          ?        ?   110.4642  45.3350          ?        ?       99.0       23.3       ?       ? 
1 1 1   42   32   11 f    260.5   12.0    0.0000   0.0000          ?        ?   694.7115  62.5751          ?        ?      260.5       12.0       ?       ? 
1 1 1   42   32   12 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   32   13 o    380.0    6.1    0.0000   0.0000          ?        ?  1453.2753  46.6121          ?        ?      380.0        6.1       ?       ? 
1 1 1   42   32   14 o    187.7    5.1    0.0000   0.0000          ?        ?   353.7410  19.1556          ?        ?      187.7        5.1       ?       ? 
1 1 1   42   32   15 o    136.5    7.7    0.0000   0.0000          ?        ?   188.3639  21.0712          ?        ?      136.5        7.7       ?       ? 
1 1 1   42   32   16 o    203.1    6.0    0.0000   0.0000          ?        ?   415.0391  24.2638          ?        ?      203.1        6.0       ?       ? 
1 1 1   42   32   17 o    177.8    5.6    0.0000   0.0000          ?        ?   317.9838  19.7942          ?        ?      177.8        5.6       ?       ? 
1 1 1   42   32   18 o     27.4   12.4    0.0000   0.0000          ?        ?    -7.6623  14.6860          ?        ?       27.4       12.4       ?       ? 
1 1 1   42   32   19 o     34.0   13.6    0.0000   0.0000          ?        ?     6.3852  14.0475          ?        ?       34.0       13.6       ?       ? 
1 1 1   42   32   20 o     53.8    8.9    0.0000   0.0000          ?        ?    29.3720   9.5778          ?        ?       53.8        8.9       ?       ? 
1 1 1   42   32   21 o     18.6    9.1    0.0000   0.0000          ?        ?   -19.1556  10.8549          ?        ?       18.6        9.1       ?       ? 
1 1 1   42   33    0 o     73.2   34.9   86.2004  58.1055    86.2004  58.1055    86.2004  58.1055       73.2     34.9       73.2       34.9     0.0     0.0 
1 1 1   42   33    1 o     75.9   32.7    0.0000   0.0000          ?        ?    24.9023  90.0316          ?        ?       75.9       32.7       ?       ? 
1 1 1   42   33    2 o    112.0   23.3    0.0000   0.0000          ?        ?   141.1133  50.4432          ?        ?      112.0       23.3       ?       ? 
1 1 1   42   33    3 o    112.5   29.9    0.0000   0.0000          ?        ?   151.3296  68.3218          ?        ?      112.5       29.9       ?       ? 
1 1 1   42   33    4 o     59.1   24.3    0.0000   0.0000          ?        ?    19.7942  45.9736          ?        ?       59.1       24.3       ?       ? 
1 1 1   42   33    5 o    133.5   19.6    0.0000   0.0000          ?        ?   190.2794  52.3588          ?        ?      133.5       19.6       ?       ? 
1 1 1   42   33    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   33    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   33    8 o     54.0   26.0    0.0000   0.0000          ?        ?   -91.9471  81.7308          ?        ?       54.0       26.0       ?       ? 
1 1 1   42   33    9 o     52.7   22.0    0.0000   0.0000          ?        ?    12.1319  38.3113          ?        ?       52.7       22.0       ?       ? 
1 1 1   42   33   10 o    124.0   29.7    0.0000   0.0000          ?        ?   184.5327  72.7915          ?        ?      124.0       29.7       ?       ? 
1 1 1   42   33   11 o     75.7   30.3    0.0000   0.0000          ?        ?    49.8047  69.5989          ?        ?       75.7       30.3       ?       ? 
1 1 1   42   33   12 o    213.4   20.3    0.0000   0.0000          ?        ?   491.6617  86.8389          ?        ?      213.4       20.3       ?       ? 
1 1 1   42   33   13 o    135.5   28.0    0.0000   0.0000          ?        ?   217.0974  73.4300          ?        ?      135.5       28.0       ?       ? 
1 1 1   42   33   14 o     32.1   14.5    0.0000   0.0000          ?        ?    -8.9393  19.7942          ?        ?       32.1       14.5       ?       ? 
1 1 1   42   33   15 o     61.9   14.7    0.0000   0.0000          ?        ?    41.5039  17.8786          ?        ?       61.9       14.7       ?       ? 
1 1 1   42   33   16 o    120.6    8.2    0.0000   0.0000          ?        ?   147.4985  19.7942          ?        ?      120.6        8.2       ?       ? 
1 1 1   42   33   17 o    185.7    5.8    0.0000   0.0000          ?        ?   347.3558  21.7097          ?        ?      185.7        5.8       ?       ? 
1 1 1   42   34    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   34    1 o    112.7   31.0    0.0000   0.0000          ?        ?   156.4378  72.1529          ?        ?      112.7       31.0       ?       ? 
1 1 1   42   34    2 o    138.6   18.9    0.0000   0.0000          ?        ?   205.6040  52.3588          ?        ?      138.6       18.9       ?       ? 
1 1 1   42   34    3 o    132.7   16.1    0.0000   0.0000          ?        ?   185.1713  42.7809          ?        ?      132.7       16.1       ?       ? 
1 1 1   42   34    4 o     71.7   26.7    0.0000   0.0000          ?        ?    51.7203  51.0817          ?        ?       71.7       26.7       ?       ? 
1 1 1   42   34    5 o    156.9   23.2    0.0000   0.0000          ?        ?   272.6487  72.7915          ?        ?      156.9       23.2       ?       ? 
1 1 1   42   34    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   42   34    7 o    150.1   23.6    0.0000   0.0000          ?        ?   250.9390  70.8759          ?        ?      150.1       23.6       ?       ? 
1 1 1   42   34    8 o    226.9   17.4    0.0000   0.0000          ?        ?   547.2130  79.1767          ?        ?      226.9       17.4       ?       ? 
1 1 1   42   34    9 o    220.6   12.9    0.0000   0.0000          ?        ?   503.7936  56.8284          ?        ?      220.6       12.9       ?       ? 
1 1 1   42   34   10 o    181.9   22.5    0.0000   0.0000          ?        ?   366.5114  81.7308          ?        ?      181.9       22.5       ?       ? 
1 1 1   42   34   11 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    0    0 f    751.9    6.2 5655.3862  93.8627  5655.3862  93.8627  5655.3862  93.8627      751.9      6.2      751.9        6.2     0.0     0.0 
1 1 1   43    0    1 o    388.5    3.5 1510.1036  27.4564  1510.1036  27.4564  1510.1036  27.4564      388.5      3.5      388.5        3.5     0.0     0.0 
1 1 1   43    0    2 o    198.2    4.5  393.3293  17.8786   393.3293  17.8786   393.3293  17.8786      198.2      4.5      198.2        4.5     0.0     0.0 
1 1 1   43    0    3 o     88.6   10.3   81.7308  17.8786    81.7308  17.8786    81.7308  17.8786       88.6     10.3       88.6       10.3     0.0     0.0 
1 1 1   43    0    4 o    542.6    4.2 2944.8618  45.3350  2944.8618  45.3350  2944.8618  45.3350      542.6      4.2      542.6        4.2     0.0     0.0 
1 1 1   43    0    5 o   1375.4    6.8 18925.7812 186.4483 18925.7812 186.4483 18925.7812 186.4483     1375.4      6.8     1375.4        6.8     0.0     0.0 
1 1 1   43    0    6 o    253.0    4.8  641.0757  24.2638   641.0757  24.2638   641.0757  24.2638      253.0      4.8      253.0        4.8     0.0     0.0 
1 1 1   43    0    7 f   1111.4    5.8 12356.6699 129.6199 12356.6699 129.6199 12356.6699 129.6199     1111.4      5.8     1111.4        5.8     0.0     0.0 
1 1 1   43    0    8 o    436.7    3.4 1907.2642  30.0105  1907.2642  30.0105  1907.2642  30.0105      436.7      3.4      436.7        3.4     0.0     0.0 
1 1 1   43    0    9 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    0   10 o    413.8    3.3 1713.1534  27.4564  1713.1534  27.4564  1713.1534  27.4564      413.8      3.3      413.8        3.3     0.0     0.0 
1 1 1   43    0   11 o     62.3   15.4   45.3350  16.6016    45.3350  16.6016    45.3350  16.6016       62.3     15.4       62.3       15.4     0.0     0.0 
1 1 1   43    0   12 o    423.7    3.5 1796.1613  29.3720  1796.1613  29.3720  1796.1613  29.3720      423.7      3.5      423.7        3.5     0.0     0.0 
1 1 1   43    0   13 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    0   14 o     34.6   18.7   17.2401  17.8786    17.2401  17.8786    17.2401  17.8786       34.6     18.7       34.6       18.7     0.0     0.0 
1 1 1   43    0   15 o     12.2    9.1  -65.7677  18.5171   -65.7677  18.5171   -65.7677  18.5171       12.2      9.1       12.2        9.1     0.0     0.0 
1 1 1   43    0   16 o    197.2    4.2  389.4982  16.6016   389.4982  16.6016   389.4982  16.6016      197.2      4.2      197.2        4.2     0.0     0.0 
1 1 1   43    0   17 o    679.6    4.1 4619.7041  55.5514  4619.7041  55.5514  4619.7041  55.5514      679.6      4.1      679.6        4.1     0.0     0.0 
1 1 1   43    0   18 o    261.8    4.1  685.7722  21.7097   685.7722  21.7097   685.7722  21.7097      261.8      4.1      261.8        4.1     0.0     0.0 
1 1 1   43    0   19 o    342.8    3.7 1175.5183  25.5409  1175.5183  25.5409  1175.5183  25.5409      342.8      3.7      342.8        3.7     0.0     0.0 
1 1 1   43    0   20 o     52.2   18.3   35.7572  17.2401    35.7572  17.2401    35.7572  17.2401       52.2     18.3       52.2       18.3     0.0     0.0 
1 1 1   43    0   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    0   22 o    308.2    3.8  950.7587  23.6253   950.7587  23.6253   950.7587  23.6253      308.2      3.8      308.2        3.8     0.0     0.0 
1 1 1   43    0   23 o    502.3    3.4 2523.4375  34.4802  2523.4375  34.4802  2523.4375  34.4802      502.3      3.4      502.3        3.4     0.0     0.0 
1 1 1   43    0   24 o    195.2    5.2  381.8359  20.4327   381.8359  20.4327   381.8359  20.4327      195.2      5.2      195.2        5.2     0.0     0.0 
1 1 1   43    0   25 o    109.8    7.9  122.5962  17.2401   122.5962  17.2401   122.5962  17.2401      109.8      7.9      109.8        7.9     0.0     0.0 
1 1 1   43    0   26 o    696.5    4.1 4853.4028  57.4669  4853.4028  57.4669  4853.4028  57.4669      696.5      4.1      696.5        4.1     0.0     0.0 
1 1 1   43    0   27 o    215.3    4.8  464.2052  20.4327   464.2052  20.4327   464.2052  20.4327      215.3      4.8      215.3        4.8     0.0     0.0 
1 1 1   43    0   28 o    294.9    3.8  870.3050  22.3483   870.3050  22.3483   870.3050  22.3483      294.9      3.8      294.9        3.8     0.0     0.0 
1 1 1   43    0   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    0   30 o    405.9    3.5 1648.0244  28.7335  1648.0244  28.7335  1648.0244  28.7335      405.9      3.5      405.9        3.5     0.0     0.0 
1 1 1   43    0   31 o    709.7    4.0 5039.2129  57.4669  5039.2129  57.4669  5039.2129  57.4669      709.7      4.0      709.7        4.0     0.0     0.0 
1 1 1   43    0   32 o    187.3    5.5  351.8254  20.4327   351.8254  20.4327   351.8254  20.4327      187.3      5.5      187.3        5.5     0.0     0.0 
1 1 1   43    0   33 o     18.9   13.5  -24.2638  20.4327   -24.2638  20.4327   -24.2638  20.4327       18.9     13.5       18.9       13.5     0.0     0.0 
1 1 1   43    0   34 o    291.9    4.4  853.0649  25.5409   853.0649  25.5409   853.0649  25.5409      291.9      4.4      291.9        4.4     0.0     0.0 
1 1 1   43    0   35 o     13.4   10.0  -52.3588  18.5171   -52.3588  18.5171   -52.3588  18.5171       13.4     10.0       13.4       10.0     0.0     0.0 
1 1 1   43    0   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    0   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    0   38 o     14.8   11.0  -58.7440  21.7097   -58.7440  21.7097   -58.7440  21.7097       14.8     11.0       14.8       11.0     0.0     0.0 
1 1 1   43    0   39 o    348.6    4.1 1216.3837  28.7335  1216.3837  28.7335  1216.3837  28.7335      348.6      4.1      348.6        4.1     0.0     0.0 
1 1 1   43    0   40 o     51.3   21.0   37.0343  21.0712    37.0343  21.0712    37.0343  21.0712       51.3     21.0       51.3       21.0     0.0     0.0 
1 1 1   43    0   41 o    270.9    4.6  734.9384  24.9023   734.9384  24.9023   734.9384  24.9023      270.9      4.6      270.9        4.6     0.0     0.0 
1 1 1   43    0   42 o     35.2   20.4   15.9630  22.9868    15.9630  22.9868    15.9630  22.9868       35.2     20.4       35.2       20.4     0.0     0.0 
1 1 1   43    0   43 f    185.6    6.4  346.0787  23.6253   346.0787  23.6253   346.0787  23.6253      185.6      6.4      185.6        6.4     0.0     0.0 
1 1 1   43    0   44 o    198.9    5.8  397.1605  22.9868   397.1605  22.9868   397.1605  22.9868      198.9      5.8      198.9        5.8     0.0     0.0 
1 1 1   43    0   45 o     22.7   15.9  -20.4327  24.9023   -20.4327  24.9023   -20.4327  24.9023       22.7     15.9       22.7       15.9     0.0     0.0 
1 1 1   43    0   46 o    172.8    7.2  300.7437  24.9023   300.7437  24.9023   300.7437  24.9023      172.8      7.2      172.8        7.2     0.0     0.0 
1 1 1   43    0   47 o     83.9   16.2   77.8996  24.2638    77.8996  24.2638    77.8996  24.2638       83.9     16.2       83.9       16.2     0.0     0.0 
1 1 1   43    0   48 o     19.4   14.1  -40.2269  25.5409   -40.2269  25.5409   -40.2269  25.5409       19.4     14.1       19.4       14.1     0.0     0.0 
1 1 1   43    0   49 o     20.3   14.5  -30.0105  24.2638   -30.0105  24.2638   -30.0105  24.2638       20.3     14.5       20.3       14.5     0.0     0.0 
1 1 1   43    0   50 o    133.8    9.9  182.6172  26.1794   182.6172  26.1794   182.6172  26.1794      133.8      9.9      133.8        9.9     0.0     0.0 
1 1 1   43    0   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    0   52 o    239.5    5.9  575.3080  28.0950   575.3080  28.0950   575.3080  28.0950      239.5      5.9      239.5        5.9     0.0     0.0 
1 1 1   43    0   53 o    135.3   10.3  187.0868  27.4564   187.0868  27.4564   187.0868  27.4564      135.3     10.3      135.3       10.3     0.0     0.0 
1 1 1   43    0   54 o    173.0    7.8  302.0207  26.8179   302.0207  26.8179   302.0207  26.8179      173.0      7.8      173.0        7.8     0.0     0.0 
1 1 1   43    0   55 o     27.9   18.6   -5.1082  26.8179    -5.1082  26.8179    -5.1082  26.8179       27.9     18.6       27.9       18.6     0.0     0.0 
1 1 1   43    0   56 o     14.9   11.2 -100.8864  28.0950  -100.8864  28.0950  -100.8864  28.0950       14.9     11.2       14.9       11.2     0.0     0.0 
1 1 1   43    0   57 o    103.8   12.9  113.6568  26.1794   113.6568  26.1794   113.6568  26.1794      103.8     12.9      103.8       12.9     0.0     0.0 
1 1 1   43    0   58 o     47.0   23.8   33.8416  27.4564    33.8416  27.4564    33.8416  27.4564       47.0     23.8       47.0       23.8     0.0     0.0 
1 1 1   43    0   59 o     14.7   11.0  -98.9709  27.4564   -98.9709  27.4564   -98.9709  27.4564       14.7     11.0       14.7       11.0     0.0     0.0 
1 1 1   43    0   60 f     40.8   22.8   24.2638  27.4564    24.2638  27.4564    24.2638  27.4564       40.8     22.8       40.8       22.8     0.0     0.0 
1 1 1   43    0   61 o     32.6   20.5    7.6623  27.4564     7.6623  27.4564     7.6623  27.4564       32.6     20.5       32.6       20.5     0.0     0.0 
1 1 1   43    0   62 o    208.1    6.6  436.1103  27.4564   436.1103  27.4564   436.1103  27.4564      208.1      6.6      208.1        6.6     0.0     0.0 
1 1 1   43    0   63 o     62.9   22.8   54.2743  26.1794    54.2743  26.1794    54.2743  26.1794       62.9     22.8       62.9       22.8     0.0     0.0 
1 1 1   43    1    0 o     25.0   16.3   -0.6385  19.1556    -0.6385  19.1556    -0.6385  19.1556       25.0     16.3       25.0       16.3     0.0     0.0 
1 1 1   43    1    1 o    820.3    3.3    0.0000   0.0000          ?        ?  6730.6562  54.9129          ?        ?      820.3        3.3       ?       ? 
1 1 1   43    1    2 o    587.9    2.8    0.0000   0.0000          ?        ?  3456.3174  33.2031          ?        ?      587.9        2.8       ?       ? 
1 1 1   43    1    3 o     79.5    7.2    0.0000   0.0000          ?        ?    63.2136  11.4934          ?        ?       79.5        7.2       ?       ? 
1 1 1   43    1    4 o    347.2    2.5    0.0000   0.0000          ?        ?  1205.5288  17.2401          ?        ?      347.2        2.5       ?       ? 
1 1 1   43    1    5 o    602.7    2.8    0.0000   0.0000          ?        ?  3632.5498  33.8416          ?        ?      602.7        2.8       ?       ? 
1 1 1   43    1    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    1    7 o    346.5    2.6    0.0000   0.0000          ?        ?  1201.0592  17.8786          ?        ?      346.5        2.6       ?       ? 
1 1 1   43    1    8 o    461.2    2.6    0.0000   0.0000          ?        ?  2126.9155  23.6253          ?        ?      461.2        2.6       ?       ? 
1 1 1   43    1    9 o    377.4    2.3    0.0000   0.0000          ?        ?  1424.5417  17.2401          ?        ?      377.4        2.3       ?       ? 
1 1 1   43    1   10 o    194.4    3.1    0.0000   0.0000          ?        ?   378.0048  12.1319          ?        ?      194.4        3.1       ?       ? 
1 1 1   43    1   11 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    1   12 o    111.3    4.9    0.0000   0.0000          ?        ?   123.8732  10.8549          ?        ?      111.3        4.9       ?       ? 
1 1 1   43    1   13 o    507.9    2.5    0.0000   0.0000          ?        ?  2579.6274  25.5409          ?        ?      507.9        2.5       ?       ? 
1 1 1   43    1   14 o    400.6    2.4    0.0000   0.0000          ?        ?  1605.2433  19.1556          ?        ?      400.6        2.4       ?       ? 
1 1 1   43    1   15 o    342.7    2.4    0.0000   0.0000          ?        ?  1174.2412  16.6016          ?        ?      342.7        2.4       ?       ? 
1 1 1   43    1   16 o    414.7    2.4    0.0000   0.0000          ?        ?  1720.1772  19.7942          ?        ?      414.7        2.4       ?       ? 
1 1 1   43    1   17 o     72.7    8.8    0.0000   0.0000          ?        ?    52.9973  12.7704          ?        ?       72.7        8.8       ?       ? 
1 1 1   43    1   18 o    342.7    2.4    0.0000   0.0000          ?        ?  1174.2412  16.6016          ?        ?      342.7        2.4       ?       ? 
1 1 1   43    1   19 f    715.8    2.9    0.0000   0.0000          ?        ?  5124.7744  42.1424          ?        ?      715.8        2.9       ?       ? 
1 1 1   43    1   20 o    576.1    2.7    0.0000   0.0000          ?        ?  3319.0354  31.2876          ?        ?      576.1        2.7       ?       ? 
1 1 1   43    1   21 o     77.4    7.8    0.0000   0.0000          ?        ?    60.0210  12.1319          ?        ?       77.4        7.8       ?       ? 
1 1 1   43    1   22 o    381.4    2.3    0.0000   0.0000          ?        ?  1455.1908  17.8786          ?        ?      381.4        2.3       ?       ? 
1 1 1   43    1   23 o    324.1    2.6    0.0000   0.0000          ?        ?  1050.3680  16.6016          ?        ?      324.1        2.6       ?       ? 
1 1 1   43    1   24 o    240.2    2.9    0.0000   0.0000          ?        ?   577.2236  14.0475          ?        ?      240.2        2.9       ?       ? 
1 1 1   43    1   25 o     96.5    6.9    0.0000   0.0000          ?        ?    93.2242  13.4090          ?        ?       96.5        6.9       ?       ? 
1 1 1   43    1   26 o    405.0    2.4    0.0000   0.0000          ?        ?  1640.3621  19.1556          ?        ?      405.0        2.4       ?       ? 
1 1 1   43    1   27 o    409.4    2.5    0.0000   0.0000          ?        ?  1676.7578  20.4327          ?        ?      409.4        2.5       ?       ? 
1 1 1   43    1   28 o    252.4    3.0    0.0000   0.0000          ?        ?   637.2446  15.3245          ?        ?      252.4        3.0       ?       ? 
1 1 1   43    1   29 o    450.7    2.4    0.0000   0.0000          ?        ?  2031.7759  21.7097          ?        ?      450.7        2.4       ?       ? 
1 1 1   43    1   30 o    416.1    2.5    0.0000   0.0000          ?        ?  1731.6708  21.0712          ?        ?      416.1        2.5       ?       ? 
1 1 1   43    1   31 o    483.5    2.5    0.0000   0.0000          ?        ?  2338.2664  24.2638          ?        ?      483.5        2.5       ?       ? 
1 1 1   43    1   32 o    618.0    2.7    0.0000   0.0000          ?        ?  3819.6365  33.2031          ?        ?      618.0        2.7       ?       ? 
1 1 1   43    1   33 o    152.0    5.0    0.0000   0.0000          ?        ?   231.1448  15.3245          ?        ?      152.0        5.0       ?       ? 
1 1 1   43    1   34 o    158.7    4.6    0.0000   0.0000          ?        ?   252.2160  14.6860          ?        ?      158.7        4.6       ?       ? 
1 1 1   43    1   35 o    412.5    2.6    0.0000   0.0000          ?        ?  1701.6602  21.0712          ?        ?      412.5        2.6       ?       ? 
1 1 1   43    1   36 f     21.4   10.5    0.0000   0.0000          ?        ?   -30.6490  15.3245          ?        ?       21.4       10.5       ?       ? 
1 1 1   43    1   37 o    360.1    2.7    0.0000   0.0000          ?        ?  1296.8374  19.7942          ?        ?      360.1        2.7       ?       ? 
1 1 1   43    1   38 o    541.2    2.6    0.0000   0.0000          ?        ?  2930.1758  28.0950          ?        ?      541.2        2.6       ?       ? 
1 1 1   43    1   39 o    169.8    4.7    0.0000   0.0000          ?        ?   288.6118  15.9630          ?        ?      169.8        4.7       ?       ? 
1 1 1   43    1   40 o     66.5   11.9    0.0000   0.0000          ?        ?    45.9736  15.3245          ?        ?       66.5       11.9       ?       ? 
1 1 1   43    1   41 o    228.3    3.6    0.0000   0.0000          ?        ?   521.6721  16.6016          ?        ?      228.3        3.6       ?       ? 
1 1 1   43    1   42 o    106.4    7.2    0.0000   0.0000          ?        ?   113.6568  15.3245          ?        ?      106.4        7.2       ?       ? 
1 1 1   43    1   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    1   44 o    344.0    2.9    0.0000   0.0000          ?        ?  1183.8191  19.7942          ?        ?      344.0        2.9       ?       ? 
1 1 1   43    1   45 o    338.1    2.8    0.0000   0.0000          ?        ?  1143.5923  19.1556          ?        ?      338.1        2.8       ?       ? 
1 1 1   43    1   46 o    108.8    7.6    0.0000   0.0000          ?        ?   118.7650  16.6016          ?        ?      108.8        7.6       ?       ? 
1 1 1   43    1   47 o    215.3    4.0    0.0000   0.0000          ?        ?   464.2052  17.2401          ?        ?      215.3        4.0       ?       ? 
1 1 1   43    1   48 o    124.9    6.9    0.0000   0.0000          ?        ?   156.4378  17.2401          ?        ?      124.9        6.9       ?       ? 
1 1 1   43    1   49 o     61.2   14.8    0.0000   0.0000          ?        ?    39.5883  17.8786          ?        ?       61.2       14.8       ?       ? 
1 1 1   43    1   50 o    106.6    8.4    0.0000   0.0000          ?        ?   114.2954  17.8786          ?        ?      106.6        8.4       ?       ? 
1 1 1   43    1   51 o    335.5    3.1    0.0000   0.0000          ?        ?  1126.3521  21.0712          ?        ?      335.5        3.1       ?       ? 
1 1 1   43    1   52 o    229.7    4.3    0.0000   0.0000          ?        ?   528.6959  19.7942          ?        ?      229.7        4.3       ?       ? 
1 1 1   43    1   53 o    371.2    2.8    0.0000   0.0000          ?        ?  1379.2067  21.0712          ?        ?      371.2        2.8       ?       ? 
1 1 1   43    1   54 o     42.2   16.0    0.0000   0.0000          ?        ?    13.4090  18.5171          ?        ?       42.2       16.0       ?       ? 
1 1 1   43    1   55 o    118.1    8.1    0.0000   0.0000          ?        ?   140.4748  19.1556          ?        ?      118.1        8.1       ?       ? 
1 1 1   43    1   56 o     20.0   10.1    0.0000   0.0000          ?        ?   -52.9973  17.8786          ?        ?       20.0       10.1       ?       ? 
1 1 1   43    1   57 o     43.3   16.3    0.0000   0.0000          ?        ?    14.6860  19.1556          ?        ?       43.3       16.3       ?       ? 
1 1 1   43    1   58 o     35.7   15.1    0.0000   0.0000          ?        ?     1.9156  18.5171          ?        ?       35.7       15.1       ?       ? 
1 1 1   43    1   59 o    120.7    7.4    0.0000   0.0000          ?        ?   146.8600  17.8786          ?        ?      120.7        7.4       ?       ? 
1 1 1   43    1   60 o     52.4   16.4    0.0000   0.0000          ?        ?    28.7335  19.1556          ?        ?       52.4       16.4       ?       ? 
1 1 1   43    1   61 o    130.2    7.1    0.0000   0.0000          ?        ?   171.1238  18.5171          ?        ?      130.2        7.1       ?       ? 
1 1 1   43    1   62 f     31.0   14.1    0.0000   0.0000          ?        ?   -10.2163  19.1556          ?        ?       31.0       14.1       ?       ? 
1 1 1   43    2    0 o    623.9    3.9 3893.7048  49.1662  3893.7048  49.1662  3893.7048  49.1662      623.9      3.9      623.9        3.9     0.0     0.0 
1 1 1   43    2    1 o    276.4    2.7    0.0000   0.0000          ?        ?   764.3104  14.6860          ?        ?      276.4        2.7       ?       ? 
1 1 1   43    2    2 o    839.5    3.3    0.0000   0.0000          ?        ?  7048.6406  56.1899          ?        ?      839.5        3.3       ?       ? 
1 1 1   43    2    3 f    248.1    3.1    0.0000   0.0000          ?        ?   615.5349  15.3245          ?        ?      248.1        3.1       ?       ? 
1 1 1   43    2    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    2    5 o    246.8    2.7    0.0000   0.0000          ?        ?   609.1497  13.4090          ?        ?      246.8        2.7       ?       ? 
1 1 1   43    2    6 o    578.7    2.7    0.0000   0.0000          ?        ?  3349.6843  31.2876          ?        ?      578.7        2.7       ?       ? 
1 1 1   43    2    7 o    399.0    2.6    0.0000   0.0000          ?        ?  1591.8345  20.4327          ?        ?      399.0        2.6       ?       ? 
1 1 1   43    2    8 o    780.5    3.2    0.0000   0.0000          ?        ?  6092.7734  49.8047          ?        ?      780.5        3.2       ?       ? 
1 1 1   43    2    9 f    395.7    2.6    0.0000   0.0000          ?        ?  1565.6550  20.4327          ?        ?      395.7        2.6       ?       ? 
1 1 1   43    2   10 o     18.1    8.9    0.0000   0.0000          ?        ?   -21.7097  10.8549          ?        ?       18.1        8.9       ?       ? 
1 1 1   43    2   11 o    238.9    2.8    0.0000   0.0000          ?        ?   570.8383  13.4090          ?        ?      238.9        2.8       ?       ? 
1 1 1   43    2   12 o    305.5    2.4    0.0000   0.0000          ?        ?   933.5186  14.6860          ?        ?      305.5        2.4       ?       ? 
1 1 1   43    2   13 o    400.2    2.4    0.0000   0.0000          ?        ?  1602.0508  19.1556          ?        ?      400.2        2.4       ?       ? 
1 1 1   43    2   14 o    187.2    3.4    0.0000   0.0000          ?        ?   350.5484  12.7704          ?        ?      187.2        3.4       ?       ? 
1 1 1   43    2   15 o    340.3    2.6    0.0000   0.0000          ?        ?  1158.2782  17.8786          ?        ?      340.3        2.6       ?       ? 
1 1 1   43    2   16 o    551.1    2.7    0.0000   0.0000          ?        ?  3038.0859  29.3720          ?        ?      551.1        2.7       ?       ? 
1 1 1   43    2   17 o    428.1    2.5    0.0000   0.0000          ?        ?  1832.5571  21.0712          ?        ?      428.1        2.5       ?       ? 
1 1 1   43    2   18 o    132.7    4.6    0.0000   0.0000          ?        ?   176.2320  12.1319          ?        ?      132.7        4.6       ?       ? 
1 1 1   43    2   19 o    751.1    3.0    0.0000   0.0000          ?        ?  5642.6157  44.6965          ?        ?      751.1        3.0       ?       ? 
1 1 1   43    2   20 o    169.8    4.1    0.0000   0.0000          ?        ?   288.6118  14.0475          ?        ?      169.8        4.1       ?       ? 
1 1 1   43    2   21 o     27.9   12.2    0.0000   0.0000          ?        ?    -2.5541  12.7704          ?        ?       27.9       12.2       ?       ? 
1 1 1   43    2   22 o    224.7    3.1    0.0000   0.0000          ?        ?   505.0706  14.0475          ?        ?      224.7        3.1       ?       ? 
1 1 1   43    2   23 o    492.3    2.4    0.0000   0.0000          ?        ?  2423.8281  23.6253          ?        ?      492.3        2.4       ?       ? 
1 1 1   43    2   24 o    280.9    2.6    0.0000   0.0000          ?        ?   789.2127  14.6860          ?        ?      280.9        2.6       ?       ? 
1 1 1   43    2   25 o    123.0    5.7    0.0000   0.0000          ?        ?   151.3296  14.0475          ?        ?      123.0        5.7       ?       ? 
1 1 1   43    2   26 o    494.5    2.6    0.0000   0.0000          ?        ?  2446.1763  25.5409          ?        ?      494.5        2.6       ?       ? 
1 1 1   43    2   27 o    557.6    2.5    0.0000   0.0000          ?        ?  3110.2388  28.0950          ?        ?      557.6        2.5       ?       ? 
1 1 1   43    2   28 o    189.9    3.7    0.0000   0.0000          ?        ?   360.7647  14.0475          ?        ?      189.9        3.7       ?       ? 
1 1 1   43    2   29 o    193.4    3.6    0.0000   0.0000          ?        ?   374.1737  14.0475          ?        ?      193.4        3.6       ?       ? 
1 1 1   43    2   30 o    358.3    2.6    0.0000   0.0000          ?        ?  1284.0670  18.5171          ?        ?      358.3        2.6       ?       ? 
1 1 1   43    2   31 f    527.0    2.5    0.0000   0.0000          ?        ?  2777.5691  26.8179          ?        ?      527.0        2.5       ?       ? 
1 1 1   43    2   32 o    163.5    4.5    0.0000   0.0000          ?        ?   267.5406  14.6860          ?        ?      163.5        4.5       ?       ? 
1 1 1   43    2   33 o    256.9    3.1    0.0000   0.0000          ?        ?   660.2314  15.9630          ?        ?      256.9        3.1       ?       ? 
1 1 1   43    2   34 o    108.0    6.5    0.0000   0.0000          ?        ?   116.8494  14.0475          ?        ?      108.0        6.5       ?       ? 
1 1 1   43    2   35 o     27.0   12.3    0.0000   0.0000          ?        ?    -9.5778  14.6860          ?        ?       27.0       12.3       ?       ? 
1 1 1   43    2   36 o    382.6    2.7    0.0000   0.0000          ?        ?  1464.1301  20.4327          ?        ?      382.6        2.7       ?       ? 
1 1 1   43    2   37 o    211.9    3.8    0.0000   0.0000          ?        ?   449.5192  15.9630          ?        ?      211.9        3.8       ?       ? 
1 1 1   43    2   38 o    126.2    6.1    0.0000   0.0000          ?        ?   159.6304  15.3245          ?        ?      126.2        6.1       ?       ? 
1 1 1   43    2   39 o    259.7    3.2    0.0000   0.0000          ?        ?   674.9174  16.6016          ?        ?      259.7        3.2       ?       ? 
1 1 1   43    2   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    2   41 f    304.6    3.0    0.0000   0.0000          ?        ?   928.4104  18.5171          ?        ?      304.6        3.0       ?       ? 
1 1 1   43    2   42 o    228.2    3.5    0.0000   0.0000          ?        ?   521.0336  15.9630          ?        ?      228.2        3.5       ?       ? 
1 1 1   43    2   43 o    222.1    3.9    0.0000   0.0000          ?        ?   493.5772  17.2401          ?        ?      222.1        3.9       ?       ? 
1 1 1   43    2   44 o     47.3   15.0    0.0000   0.0000          ?        ?    22.3483  15.9630          ?        ?       47.3       15.0       ?       ? 
1 1 1   43    2   45 o    277.1    3.3    0.0000   0.0000          ?        ?   768.1415  18.5171          ?        ?      277.1        3.3       ?       ? 
1 1 1   43    2   46 o    252.7    3.7    0.0000   0.0000          ?        ?   639.1602  18.5171          ?        ?      252.7        3.7       ?       ? 
1 1 1   43    2   47 o    119.1    7.0    0.0000   0.0000          ?        ?   142.3903  16.6016          ?        ?      119.1        7.0       ?       ? 
1 1 1   43    2   48 o    220.1    4.2    0.0000   0.0000          ?        ?   485.2764  18.5171          ?        ?      220.1        4.2       ?       ? 
1 1 1   43    2   49 o    211.0    4.2    0.0000   0.0000          ?        ?   445.6881  17.8786          ?        ?      211.0        4.2       ?       ? 
1 1 1   43    2   50 o    202.9    4.6    0.0000   0.0000          ?        ?   412.4850  18.5171          ?        ?      202.9        4.6       ?       ? 
1 1 1   43    2   51 o    204.0    4.5    0.0000   0.0000          ?        ?   416.9547  18.5171          ?        ?      204.0        4.5       ?       ? 
1 1 1   43    2   52 o     91.0    9.8    0.0000   0.0000          ?        ?    83.6463  17.8786          ?        ?       91.0        9.8       ?       ? 
1 1 1   43    2   53 o    150.1    6.0    0.0000   0.0000          ?        ?   226.0367  17.8786          ?        ?      150.1        6.0       ?       ? 
1 1 1   43    2   54 o     84.7   11.3    0.0000   0.0000          ?        ?    72.7915  19.1556          ?        ?       84.7       11.3       ?       ? 
1 1 1   43    2   55 o     28.9   13.4    0.0000   0.0000          ?        ?   -15.3245  18.5171          ?        ?       28.9       13.4       ?       ? 
1 1 1   43    2   56 o    247.9    4.0    0.0000   0.0000          ?        ?   615.5349  19.7942          ?        ?      247.9        4.0       ?       ? 
1 1 1   43    2   57 o    204.8    4.8    0.0000   0.0000          ?        ?   420.7858  19.7942          ?        ?      204.8        4.8       ?       ? 
1 1 1   43    2   58 o    115.3    8.0    0.0000   0.0000          ?        ?   134.0895  18.5171          ?        ?      115.3        8.0       ?       ? 
1 1 1   43    2   59 o     78.1   12.7    0.0000   0.0000          ?        ?    62.5751  19.7942          ?        ?       78.1       12.7       ?       ? 
1 1 1   43    2   60 o    256.8    4.1    0.0000   0.0000          ?        ?   661.5084  21.0712          ?        ?      256.8        4.1       ?       ? 
1 1 1   43    2   61 o     21.1   10.6    0.0000   0.0000          ?        ?   -53.6358  19.1556          ?        ?       21.1       10.6       ?       ? 
1 1 1   43    2   62 o    169.5    5.7    0.0000   0.0000          ?        ?   289.2503  19.1556          ?        ?      169.5        5.7       ?       ? 
1 1 1   43    3    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    3    1 o    274.6    2.6    0.0000   0.0000          ?        ?   754.0941  14.0475          ?        ?      274.6        2.6       ?       ? 
1 1 1   43    3    2 o    794.1    3.3    0.0000   0.0000          ?        ?  6306.6782  52.9973          ?        ?      794.1        3.3       ?       ? 
1 1 1   43    3    3 o    238.5    2.7    0.0000   0.0000          ?        ?   568.9227  12.7704          ?        ?      238.5        2.7       ?       ? 
1 1 1   43    3    4 o    306.8    2.6    0.0000   0.0000          ?        ?   941.1808  15.9630          ?        ?      306.8        2.6       ?       ? 
1 1 1   43    3    5 o    439.8    2.5    0.0000   0.0000          ?        ?  1934.0819  21.7097          ?        ?      439.8        2.5       ?       ? 
1 1 1   43    3    6 o    660.6    2.9    0.0000   0.0000          ?        ?  4364.2954  37.6728          ?        ?      660.6        2.9       ?       ? 
1 1 1   43    3    7 o    388.0    2.5    0.0000   0.0000          ?        ?  1505.6340  19.1556          ?        ?      388.0        2.5       ?       ? 
1 1 1   43    3    8 o    116.6    4.9    0.0000   0.0000          ?        ?   136.0051  11.4934          ?        ?      116.6        4.9       ?       ? 
1 1 1   43    3    9 o    194.2    3.1    0.0000   0.0000          ?        ?   377.3663  12.1319          ?        ?      194.2        3.1       ?       ? 
1 1 1   43    3   10 o    284.6    2.6    0.0000   0.0000          ?        ?   810.2839  14.6860          ?        ?      284.6        2.6       ?       ? 
1 1 1   43    3   11 o    553.6    2.7    0.0000   0.0000          ?        ?  3065.5425  29.3720          ?        ?      553.6        2.7       ?       ? 
1 1 1   43    3   12 f    493.4    2.5    0.0000   0.0000          ?        ?  2434.6829  24.2638          ?        ?      493.4        2.5       ?       ? 
1 1 1   43    3   13 o    253.9    2.6    0.0000   0.0000          ?        ?   644.9069  13.4090          ?        ?      253.9        2.6       ?       ? 
1 1 1   43    3   14 o    270.6    2.6    0.0000   0.0000          ?        ?   732.3843  14.0475          ?        ?      270.6        2.6       ?       ? 
1 1 1   43    3   15 o    274.2    2.7    0.0000   0.0000          ?        ?   752.1785  14.6860          ?        ?      274.2        2.7       ?       ? 
1 1 1   43    3   16 o    584.5    2.8    0.0000   0.0000          ?        ?  3416.7290  32.5646          ?        ?      584.5        2.8       ?       ? 
1 1 1   43    3   17 o    270.4    2.7    0.0000   0.0000          ?        ?   731.1072  14.6860          ?        ?      270.4        2.7       ?       ? 
1 1 1   43    3   18 o    218.5    2.9    0.0000   0.0000          ?        ?   477.6142  12.7704          ?        ?      218.5        2.9       ?       ? 
1 1 1   43    3   19 o    471.2    2.4    0.0000   0.0000          ?        ?  2220.7781  22.9868          ?        ?      471.2        2.4       ?       ? 
1 1 1   43    3   20 o     96.8    6.6    0.0000   0.0000          ?        ?    93.8627  12.7704          ?        ?       96.8        6.6       ?       ? 
1 1 1   43    3   21 o    293.6    2.7    0.0000   0.0000          ?        ?   862.0042  15.9630          ?        ?      293.6        2.7       ?       ? 
1 1 1   43    3   22 f    271.7    2.7    0.0000   0.0000          ?        ?   738.1310  14.6860          ?        ?      271.7        2.7       ?       ? 
1 1 1   43    3   23 o    303.0    2.6    0.0000   0.0000          ?        ?   918.1941  15.9630          ?        ?      303.0        2.6       ?       ? 
1 1 1   43    3   24 o    383.2    2.4    0.0000   0.0000          ?        ?  1468.5997  18.5171          ?        ?      383.2        2.4       ?       ? 
1 1 1   43    3   25 o    236.1    3.2    0.0000   0.0000          ?        ?   557.4294  15.3245          ?        ?      236.1        3.2       ?       ? 
1 1 1   43    3   26 o    341.1    2.5    0.0000   0.0000          ?        ?  1164.0249  17.2401          ?        ?      341.1        2.5       ?       ? 
1 1 1   43    3   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    3   28 o    273.4    2.8    0.0000   0.0000          ?        ?   747.7088  15.3245          ?        ?      273.4        2.8       ?       ? 
1 1 1   43    3   29 o    139.5    5.0    0.0000   0.0000          ?        ?   194.7491  14.0475          ?        ?      139.5        5.0       ?       ? 
1 1 1   43    3   30 o    492.9    2.5    0.0000   0.0000          ?        ?  2429.5747  24.2638          ?        ?      492.9        2.5       ?       ? 
1 1 1   43    3   31 o    298.5    2.9    0.0000   0.0000          ?        ?   891.3762  17.2401          ?        ?      298.5        2.9       ?       ? 
1 1 1   43    3   32 o    376.8    2.5    0.0000   0.0000          ?        ?  1420.0720  19.1556          ?        ?      376.8        2.5       ?       ? 
1 1 1   43    3   33 o    157.9    4.9    0.0000   0.0000          ?        ?   249.6619  15.3245          ?        ?      157.9        4.9       ?       ? 
1 1 1   43    3   34 o    180.0    4.3    0.0000   0.0000          ?        ?   324.3690  15.3245          ?        ?      180.0        4.3       ?       ? 
1 1 1   43    3   35 o    168.7    4.7    0.0000   0.0000          ?        ?   284.7806  15.9630          ?        ?      168.7        4.7       ?       ? 
1 1 1   43    3   36 o    732.9    2.9    0.0000   0.0000          ?        ?  5373.7979  42.7809          ?        ?      732.9        2.9       ?       ? 
1 1 1   43    3   37 o    210.1    3.8    0.0000   0.0000          ?        ?   441.8569  15.9630          ?        ?      210.1        3.8       ?       ? 
1 1 1   43    3   38 o    647.1    2.8    0.0000   0.0000          ?        ?  4189.3403  35.7572          ?        ?      647.1        2.8       ?       ? 
1 1 1   43    3   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    3   40 o    104.3    7.7    0.0000   0.0000          ?        ?   109.1872  15.9630          ?        ?      104.3        7.7       ?       ? 
1 1 1   43    3   41 o     36.4   14.7    0.0000   0.0000          ?        ?     5.7467  16.6016          ?        ?       36.4       14.7       ?       ? 
1 1 1   43    3   42 o    460.7    2.6    0.0000   0.0000          ?        ?  2123.0845  24.2638          ?        ?      460.7        2.6       ?       ? 
1 1 1   43    3   43 o    340.6    2.9    0.0000   0.0000          ?        ?  1160.8323  19.7942          ?        ?      340.6        2.9       ?       ? 
1 1 1   43    3   44 o     26.1   12.2    0.0000   0.0000          ?        ?   -15.9630  15.9630          ?        ?       26.1       12.2       ?       ? 
1 1 1   43    3   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    3   46 o    202.3    4.4    0.0000   0.0000          ?        ?   409.9309  17.8786          ?        ?      202.3        4.4       ?       ? 
1 1 1   43    3   47 o    380.3    2.9    0.0000   0.0000          ?        ?  1447.5286  21.7097          ?        ?      380.3        2.9       ?       ? 
1 1 1   43    3   48 o    182.9    4.9    0.0000   0.0000          ?        ?   335.2238  17.8786          ?        ?      182.9        4.9       ?       ? 
1 1 1   43    3   49 o    296.1    3.2    0.0000   0.0000          ?        ?   877.3287  19.1556          ?        ?      296.1        3.2       ?       ? 
1 1 1   43    3   50 o    161.4    5.5    0.0000   0.0000          ?        ?   261.1554  17.8786          ?        ?      161.4        5.5       ?       ? 
1 1 1   43    3   51 o    152.6    5.6    0.0000   0.0000          ?        ?   233.6989  17.2401          ?        ?      152.6        5.6       ?       ? 
1 1 1   43    3   52 o    240.5    4.1    0.0000   0.0000          ?        ?   579.1391  19.7942          ?        ?      240.5        4.1       ?       ? 
1 1 1   43    3   53 o    156.9    5.9    0.0000   0.0000          ?        ?   247.1079  18.5171          ?        ?      156.9        5.9       ?       ? 
1 1 1   43    3   54 o    242.7    3.8    0.0000   0.0000          ?        ?   589.9940  18.5171          ?        ?      242.7        3.8       ?       ? 
1 1 1   43    3   55 o    147.0    6.3    0.0000   0.0000          ?        ?   217.0974  18.5171          ?        ?      147.0        6.3       ?       ? 
1 1 1   43    3   56 o    214.8    4.8    0.0000   0.0000          ?        ?   462.9282  20.4327          ?        ?      214.8        4.8       ?       ? 
1 1 1   43    3   57 o    158.2    6.1    0.0000   0.0000          ?        ?   251.5775  19.1556          ?        ?      158.2        6.1       ?       ? 
1 1 1   43    3   58 o     85.7   10.8    0.0000   0.0000          ?        ?    74.7070  18.5171          ?        ?       85.7       10.8       ?       ? 
1 1 1   43    3   59 o    317.8    3.4    0.0000   0.0000          ?        ?  1012.0568  21.7097          ?        ?      317.8        3.4       ?       ? 
1 1 1   43    3   60 o     26.5   12.7    0.0000   0.0000          ?        ?   -25.5409  19.1556          ?        ?       26.5       12.7       ?       ? 
1 1 1   43    3   61 o     27.9   13.2    0.0000   0.0000          ?        ?   -22.3483  19.7942          ?        ?       27.9       13.2       ?       ? 
1 1 1   43    4    0 o    736.9    4.4 5431.9033  64.4907  5431.9033  64.4907  5431.9033  64.4907      736.9      4.4      736.9        4.4     0.0     0.0 
1 1 1   43    4    1 o    386.1    2.5    0.0000   0.0000          ?        ?  1490.9480  19.1556          ?        ?      386.1        2.5       ?       ? 
1 1 1   43    4    2 o    611.0    2.8    0.0000   0.0000          ?        ?  3734.0745  33.8416          ?        ?      611.0        2.8       ?       ? 
1 1 1   43    4    3 o    488.8    2.5    0.0000   0.0000          ?        ?  2389.9863  24.9023          ?        ?      488.8        2.5       ?       ? 
1 1 1   43    4    4 o    495.4    2.6    0.0000   0.0000          ?        ?  2454.4771  25.5409          ?        ?      495.4        2.6       ?       ? 
1 1 1   43    4    5 o    566.7    2.7    0.0000   0.0000          ?        ?  3212.4023  30.6490          ?        ?      566.7        2.7       ?       ? 
1 1 1   43    4    6 o    261.7    2.6    0.0000   0.0000          ?        ?   685.1337  13.4090          ?        ?      261.7        2.6       ?       ? 
1 1 1   43    4    7 o    146.9    3.7    0.0000   0.0000          ?        ?   215.8203  10.8549          ?        ?      146.9        3.7       ?       ? 
1 1 1   43    4    8 o    301.5    2.5    0.0000   0.0000          ?        ?   909.2548  15.3245          ?        ?      301.5        2.5       ?       ? 
1 1 1   43    4    9 o    599.4    2.6    0.0000   0.0000          ?        ?  3593.5996  30.6490          ?        ?      599.4        2.6       ?       ? 
1 1 1   43    4   10 o     76.6    7.1    0.0000   0.0000          ?        ?    58.7440  10.8549          ?        ?       76.6        7.1       ?       ? 
1 1 1   43    4   11 o    345.8    2.4    0.0000   0.0000          ?        ?  1195.9510  16.6016          ?        ?      345.8        2.4       ?       ? 
1 1 1   43    4   12 o     17.3    8.6    0.0000   0.0000          ?        ?   -32.5646  12.1319          ?        ?       17.3        8.6       ?       ? 
1 1 1   43    4   13 o    243.5    2.8    0.0000   0.0000          ?        ?   593.1866  13.4090          ?        ?      243.5        2.8       ?       ? 
1 1 1   43    4   14 o    546.8    2.6    0.0000   0.0000          ?        ?  2990.1968  28.7335          ?        ?      546.8        2.6       ?       ? 
1 1 1   43    4   15 o    469.8    2.8    0.0000   0.0000          ?        ?  2208.0078  26.1794          ?        ?      469.8        2.8       ?       ? 
1 1 1   43    4   16 o    110.7    5.5    0.0000   0.0000          ?        ?   122.5962  12.1319          ?        ?      110.7        5.5       ?       ? 
1 1 1   43    4   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    4   18 o     90.7    7.0    0.0000   0.0000          ?        ?    82.3693  12.7704          ?        ?       90.7        7.0       ?       ? 
1 1 1   43    4   19 o    951.1    3.6    0.0000   0.0000          ?        ?  9049.1279  68.3218          ?        ?      951.1        3.6       ?       ? 
1 1 1   43    4   20 o    561.6    2.6    0.0000   0.0000          ?        ?  3154.2969  29.3720          ?        ?      561.6        2.6       ?       ? 
1 1 1   43    4   21 o    377.0    2.6    0.0000   0.0000          ?        ?  1421.3491  19.7942          ?        ?      377.0        2.6       ?       ? 
1 1 1   43    4   22 o    115.5    5.8    0.0000   0.0000          ?        ?   133.4510  13.4090          ?        ?      115.5        5.8       ?       ? 
1 1 1   43    4   23 f    746.1    3.0    0.0000   0.0000          ?        ?  5567.9087  44.0580          ?        ?      746.1        3.0       ?       ? 
1 1 1   43    4   24 o    273.6    3.0    0.0000   0.0000          ?        ?   748.9859  16.6016          ?        ?      273.6        3.0       ?       ? 
1 1 1   43    4   25 o    664.4    2.7    0.0000   0.0000          ?        ?  4414.7388  36.3957          ?        ?      664.4        2.7       ?       ? 
1 1 1   43    4   26 f    157.8    4.5    0.0000   0.0000          ?        ?   249.0234  14.0475          ?        ?      157.8        4.5       ?       ? 
1 1 1   43    4   27 o    545.2    2.5    0.0000   0.0000          ?        ?  2973.5952  27.4564          ?        ?      545.2        2.5       ?       ? 
1 1 1   43    4   28 o    581.2    2.6    0.0000   0.0000          ?        ?  3379.0566  30.6490          ?        ?      581.2        2.6       ?       ? 
1 1 1   43    4   29 f     64.7   11.8    0.0000   0.0000          ?        ?    43.4195  14.6860          ?        ?       64.7       11.8       ?       ? 
1 1 1   43    4   30 o    112.9    5.9    0.0000   0.0000          ?        ?   127.7043  13.4090          ?        ?      112.9        5.9       ?       ? 
1 1 1   43    4   31 o     29.2   12.9    0.0000   0.0000          ?        ?    -4.4697  14.6860          ?        ?       29.2       12.9       ?       ? 
1 1 1   43    4   32 o    120.8    6.3    0.0000   0.0000          ?        ?   146.2215  15.3245          ?        ?      120.8        6.3       ?       ? 
1 1 1   43    4   33 o    580.7    2.6    0.0000   0.0000          ?        ?  3373.3096  30.6490          ?        ?      580.7        2.6       ?       ? 
1 1 1   43    4   34 o    503.5    2.6    0.0000   0.0000          ?        ?  2535.5693  26.1794          ?        ?      503.5        2.6       ?       ? 
1 1 1   43    4   35 o    109.4    6.7    0.0000   0.0000          ?        ?   120.0421  14.6860          ?        ?      109.4        6.7       ?       ? 
1 1 1   43    4   36 o    307.2    3.0    0.0000   0.0000          ?        ?   944.3735  18.5171          ?        ?      307.2        3.0       ?       ? 
1 1 1   43    4   37 o    436.6    2.6    0.0000   0.0000          ?        ?  1907.2642  22.3483          ?        ?      436.6        2.6       ?       ? 
1 1 1   43    4   38 o     22.0   10.7    0.0000   0.0000          ?        ?   -28.0950  15.3245          ?        ?       22.0       10.7       ?       ? 
1 1 1   43    4   39 o    351.3    2.8    0.0000   0.0000          ?        ?  1234.9008  19.7942          ?        ?      351.3        2.8       ?       ? 
1 1 1   43    4   40 o    149.2    5.1    0.0000   0.0000          ?        ?   222.8441  15.3245          ?        ?      149.2        5.1       ?       ? 
1 1 1   43    4   41 o    161.3    5.1    0.0000   0.0000          ?        ?   260.5168  16.6016          ?        ?      161.3        5.1       ?       ? 
1 1 1   43    4   42 o    105.2    7.3    0.0000   0.0000          ?        ?   111.1028  15.3245          ?        ?      105.2        7.3       ?       ? 
1 1 1   43    4   43 o    409.1    2.9    0.0000   0.0000          ?        ?  1674.8422  23.6253          ?        ?      409.1        2.9       ?       ? 
1 1 1   43    4   44 o    120.7    7.1    0.0000   0.0000          ?        ?   146.2215  17.2401          ?        ?      120.7        7.1       ?       ? 
1 1 1   43    4   45 o    246.7    3.5    0.0000   0.0000          ?        ?   609.1497  17.2401          ?        ?      246.7        3.5       ?       ? 
1 1 1   43    4   46 o     93.6    9.2    0.0000   0.0000          ?        ?    88.1160  17.2401          ?        ?       93.6        9.2       ?       ? 
1 1 1   43    4   47 o     86.5   10.0    0.0000   0.0000          ?        ?    75.3456  17.2401          ?        ?       86.5       10.0       ?       ? 
1 1 1   43    4   48 o    178.0    5.0    0.0000   0.0000          ?        ?   317.3452  17.8786          ?        ?      178.0        5.0       ?       ? 
1 1 1   43    4   49 o     18.7    9.5    0.0000   0.0000          ?        ?   -63.8522  17.8786          ?        ?       18.7        9.5       ?       ? 
1 1 1   43    4   50 o     92.8    9.6    0.0000   0.0000          ?        ?    86.8389  17.8786          ?        ?       92.8        9.6       ?       ? 
1 1 1   43    4   51 o     56.6   15.4    0.0000   0.0000          ?        ?    33.8416  17.8786          ?        ?       56.6       15.4       ?       ? 
1 1 1   43    4   52 o    173.5    5.3    0.0000   0.0000          ?        ?   302.0207  18.5171          ?        ?      173.5        5.3       ?       ? 
1 1 1   43    4   53 o    182.8    4.9    0.0000   0.0000          ?        ?   335.2238  17.8786          ?        ?      182.8        4.9       ?       ? 
1 1 1   43    4   54 f    151.0    6.3    0.0000   0.0000          ?        ?   229.2293  19.1556          ?        ?      151.0        6.3       ?       ? 
1 1 1   43    4   55 o     18.8    9.5    0.0000   0.0000          ?        ?   -67.6833  18.5171          ?        ?       18.8        9.5       ?       ? 
1 1 1   43    4   56 f    133.3    6.9    0.0000   0.0000          ?        ?   178.7861  18.5171          ?        ?      133.3        6.9       ?       ? 
1 1 1   43    4   57 o     89.9   11.0    0.0000   0.0000          ?        ?    82.3693  19.7942          ?        ?       89.9       11.0       ?       ? 
1 1 1   43    4   58 o    206.9    4.8    0.0000   0.0000          ?        ?   429.7251  19.7942          ?        ?      206.9        4.8       ?       ? 
1 1 1   43    4   59 o     21.8   10.8    0.0000   0.0000          ?        ?   -45.3350  18.5171          ?        ?       21.8       10.8       ?       ? 
1 1 1   43    4   60 o     47.8   16.5    0.0000   0.0000          ?        ?    22.3483  19.1556          ?        ?       47.8       16.5       ?       ? 
1 1 1   43    5    0 o    318.8    3.6 1017.1650  22.9868  1017.1650  22.9868  1017.1650  22.9868      318.8      3.6      318.8        3.6     0.0     0.0 
1 1 1   43    5    1 o    524.4    2.6    0.0000   0.0000          ?        ?  2750.7510  27.4564          ?        ?      524.4        2.6       ?       ? 
1 1 1   43    5    2 o    258.0    2.6    0.0000   0.0000          ?        ?   665.9781  13.4090          ?        ?      258.0        2.6       ?       ? 
1 1 1   43    5    3 o    206.4    3.1    0.0000   0.0000          ?        ?   425.8939  12.7704          ?        ?      206.4        3.1       ?       ? 
1 1 1   43    5    4 o    226.0    2.8    0.0000   0.0000          ?        ?   510.8173  12.7704          ?        ?      226.0        2.8       ?       ? 
1 1 1   43    5    5 o    394.1    2.3    0.0000   0.0000          ?        ?  1553.5232  18.5171          ?        ?      394.1        2.3       ?       ? 
1 1 1   43    5    6 o    484.7    2.4    0.0000   0.0000          ?        ?  2349.7595  23.6253          ?        ?      484.7        2.4       ?       ? 
1 1 1   43    5    7 o    232.9    2.7    0.0000   0.0000          ?        ?   542.7434  12.7704          ?        ?      232.9        2.7       ?       ? 
1 1 1   43    5    8 o    277.4    2.5    0.0000   0.0000          ?        ?   769.4186  14.0475          ?        ?      277.4        2.5       ?       ? 
1 1 1   43    5    9 o    250.6    2.5    0.0000   0.0000          ?        ?   628.3053  12.7704          ?        ?      250.6        2.5       ?       ? 
1 1 1   43    5   10 o    204.0    3.0    0.0000   0.0000          ?        ?   416.3161  12.1319          ?        ?      204.0        3.0       ?       ? 
1 1 1   43    5   11 o    285.1    2.6    0.0000   0.0000          ?        ?   812.8381  14.6860          ?        ?      285.1        2.6       ?       ? 
1 1 1   43    5   12 o    422.8    2.5    0.0000   0.0000          ?        ?  1787.8606  21.0712          ?        ?      422.8        2.5       ?       ? 
1 1 1   43    5   13 o    261.1    2.8    0.0000   0.0000          ?        ?   681.9411  14.6860          ?        ?      261.1        2.8       ?       ? 
1 1 1   43    5   14 o    386.5    2.4    0.0000   0.0000          ?        ?  1494.1406  18.5171          ?        ?      386.5        2.4       ?       ? 
1 1 1   43    5   15 o    302.4    2.5    0.0000   0.0000          ?        ?   914.3630  15.3245          ?        ?      302.4        2.5       ?       ? 
1 1 1   43    5   16 o    252.9    2.8    0.0000   0.0000          ?        ?   639.7986  14.0475          ?        ?      252.9        2.8       ?       ? 
1 1 1   43    5   17 o    609.7    2.9    0.0000   0.0000          ?        ?  3718.7500  35.1187          ?        ?      609.7        2.9       ?       ? 
1 1 1   43    5   18 o    445.5    2.7    0.0000   0.0000          ?        ?  1985.1637  24.2638          ?        ?      445.5        2.7       ?       ? 
1 1 1   43    5   19 f    306.1    2.6    0.0000   0.0000          ?        ?   937.3498  15.9630          ?        ?      306.1        2.6       ?       ? 
1 1 1   43    5   20 o    263.3    2.7    0.0000   0.0000          ?        ?   693.4344  14.0475          ?        ?      263.3        2.7       ?       ? 
1 1 1   43    5   21 o    374.3    2.4    0.0000   0.0000          ?        ?  1401.5549  17.8786          ?        ?      374.3        2.4       ?       ? 
1 1 1   43    5   22 o    432.2    2.5    0.0000   0.0000          ?        ?  1868.3143  21.7097          ?        ?      432.2        2.5       ?       ? 
1 1 1   43    5   23 o     15.8    8.0    0.0000   0.0000          ?        ?   -45.9736  12.7704          ?        ?       15.8        8.0       ?       ? 
1 1 1   43    5   24 o    241.5    3.0    0.0000   0.0000          ?        ?   583.6088  14.6860          ?        ?      241.5        3.0       ?       ? 
1 1 1   43    5   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    5   26 o    175.4    3.8    0.0000   0.0000          ?        ?   307.7674  13.4090          ?        ?      175.4        3.8       ?       ? 
1 1 1   43    5   27 o    353.1    2.4    0.0000   0.0000          ?        ?  1247.0327  17.2401          ?        ?      353.1        2.4       ?       ? 
1 1 1   43    5   28 o    174.7    4.0    0.0000   0.0000          ?        ?   305.2133  14.0475          ?        ?      174.7        4.0       ?       ? 
1 1 1   43    5   29 o    285.1    2.7    0.0000   0.0000          ?        ?   812.8381  15.3245          ?        ?      285.1        2.7       ?       ? 
1 1 1   43    5   30 o     81.8    8.2    0.0000   0.0000          ?        ?    67.0448  13.4090          ?        ?       81.8        8.2       ?       ? 
1 1 1   43    5   31 o    328.3    2.6    0.0000   0.0000          ?        ?  1077.8246  17.2401          ?        ?      328.3        2.6       ?       ? 
1 1 1   43    5   32 o    409.7    2.6    0.0000   0.0000          ?        ?  1679.3119  21.7097          ?        ?      409.7        2.6       ?       ? 
1 1 1   43    5   33 o    106.5    6.9    0.0000   0.0000          ?        ?   113.6568  14.6860          ?        ?      106.5        6.9       ?       ? 
1 1 1   43    5   34 o    179.7    4.1    0.0000   0.0000          ?        ?   323.0919  14.6860          ?        ?      179.7        4.1       ?       ? 
1 1 1   43    5   35 o    339.7    2.7    0.0000   0.0000          ?        ?  1154.4471  18.5171          ?        ?      339.7        2.7       ?       ? 
1 1 1   43    5   36 o    458.2    2.6    0.0000   0.0000          ?        ?  2100.0977  23.6253          ?        ?      458.2        2.6       ?       ? 
1 1 1   43    5   37 o    171.8    4.6    0.0000   0.0000          ?        ?   295.6355  15.9630          ?        ?      171.8        4.6       ?       ? 
1 1 1   43    5   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    5   39 o    187.1    4.3    0.0000   0.0000          ?        ?   350.5484  15.9630          ?        ?      187.1        4.3       ?       ? 
1 1 1   43    5   40 o    172.9    4.6    0.0000   0.0000          ?        ?   299.4666  15.9630          ?        ?      172.9        4.6       ?       ? 
1 1 1   43    5   41 o     78.4   10.6    0.0000   0.0000          ?        ?    61.9366  16.6016          ?        ?       78.4       10.6       ?       ? 
1 1 1   43    5   42 o    407.5    2.7    0.0000   0.0000          ?        ?  1661.4333  22.3483          ?        ?      407.5        2.7       ?       ? 
1 1 1   43    5   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    5   44 f     72.0   11.5    0.0000   0.0000          ?        ?    52.3588  16.6016          ?        ?       72.0       11.5       ?       ? 
1 1 1   43    5   45 o    238.3    3.9    0.0000   0.0000          ?        ?   568.2842  18.5171          ?        ?      238.3        3.9       ?       ? 
1 1 1   43    5   46 o     19.5    9.8    0.0000   0.0000          ?        ?   -44.0580  15.9630          ?        ?       19.5        9.8       ?       ? 
1 1 1   43    5   47 o    382.8    2.9    0.0000   0.0000          ?        ?  1466.0457  22.3483          ?        ?      382.8        2.9       ?       ? 
1 1 1   43    5   48 o    114.9    7.8    0.0000   0.0000          ?        ?   132.8125  17.8786          ?        ?      114.9        7.8       ?       ? 
1 1 1   43    5   49 o    270.6    3.5    0.0000   0.0000          ?        ?   733.0228  19.1556          ?        ?      270.6        3.5       ?       ? 
1 1 1   43    5   50 o     18.4    9.4    0.0000   0.0000          ?        ?   -65.7677  17.8786          ?        ?       18.4        9.4       ?       ? 
1 1 1   43    5   51 f     23.8   11.6    0.0000   0.0000          ?        ?   -31.9261  17.8786          ?        ?       23.8       11.6       ?       ? 
1 1 1   43    5   52 o     88.5   10.5    0.0000   0.0000          ?        ?    79.1767  18.5171          ?        ?       88.5       10.5       ?       ? 
1 1 1   43    5   53 o    274.4    3.7    0.0000   0.0000          ?        ?   754.0941  20.4327          ?        ?      274.4        3.7       ?       ? 
1 1 1   43    5   54 o    136.4    6.8    0.0000   0.0000          ?        ?   187.0868  18.5171          ?        ?      136.4        6.8       ?       ? 
1 1 1   43    5   55 o     21.4   10.7    0.0000   0.0000          ?        ?   -44.0580  17.8786          ?        ?       21.4       10.7       ?       ? 
1 1 1   43    5   56 o    253.3    3.9    0.0000   0.0000          ?        ?   642.9913  19.7942          ?        ?      253.3        3.9       ?       ? 
1 1 1   43    5   57 o     28.8   13.4    0.0000   0.0000          ?        ?   -15.3245  18.5171          ?        ?       28.8       13.4       ?       ? 
1 1 1   43    5   58 o     27.6   13.0    0.0000   0.0000          ?        ?   -19.1556  18.5171          ?        ?       27.6       13.0       ?       ? 
1 1 1   43    5   59 f     98.3    9.4    0.0000   0.0000          ?        ?    98.3323  18.5171          ?        ?       98.3        9.4       ?       ? 
1 1 1   43    5   60 o    146.1    6.3    0.0000   0.0000          ?        ?   215.1818  18.5171          ?        ?      146.1        6.3       ?       ? 
1 1 1   43    6    0 o    171.9    4.5  296.2740  15.3245   296.2740  15.3245   296.2740  15.3245      171.9      4.5      171.9        4.5     0.0     0.0 
1 1 1   43    6    1 o    270.5    2.6    0.0000   0.0000          ?        ?   731.7458  14.0475          ?        ?      270.5        2.6       ?       ? 
1 1 1   43    6    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    6    3 o    370.4    2.4    0.0000   0.0000          ?        ?  1372.1830  17.8786          ?        ?      370.4        2.4       ?       ? 
1 1 1   43    6    4 f    259.0    2.6    0.0000   0.0000          ?        ?   671.0862  13.4090          ?        ?      259.0        2.6       ?       ? 
1 1 1   43    6    5 f    368.2    2.4    0.0000   0.0000          ?        ?  1355.5814  17.8786          ?        ?      368.2        2.4       ?       ? 
1 1 1   43    6    6 f    238.6    2.7    0.0000   0.0000          ?        ?   569.5613  12.7704          ?        ?      238.6        2.7       ?       ? 
1 1 1   43    6    7 o    536.9    2.7    0.0000   0.0000          ?        ?  2882.9250  28.7335          ?        ?      536.9        2.7       ?       ? 
1 1 1   43    6    8 o    235.4    2.7    0.0000   0.0000          ?        ?   554.2368  12.7704          ?        ?      235.4        2.7       ?       ? 
1 1 1   43    6    9 o    459.9    2.4    0.0000   0.0000          ?        ?  2115.4221  22.3483          ?        ?      459.9        2.4       ?       ? 
1 1 1   43    6   10 o    221.9    2.9    0.0000   0.0000          ?        ?   492.3002  12.7704          ?        ?      221.9        2.9       ?       ? 
1 1 1   43    6   11 o    140.4    4.3    0.0000   0.0000          ?        ?   197.3032  12.1319          ?        ?      140.4        4.3       ?       ? 
1 1 1   43    6   12 o    222.1    3.0    0.0000   0.0000          ?        ?   493.5772  13.4090          ?        ?      222.1        3.0       ?       ? 
1 1 1   43    6   13 o    228.9    2.9    0.0000   0.0000          ?        ?   524.2263  13.4090          ?        ?      228.9        2.9       ?       ? 
1 1 1   43    6   14 o    468.9    2.5    0.0000   0.0000          ?        ?  2199.0684  22.9868          ?        ?      468.9        2.5       ?       ? 
1 1 1   43    6   15 o    233.2    2.9    0.0000   0.0000          ?        ?   544.0204  13.4090          ?        ?      233.2        2.9       ?       ? 
1 1 1   43    6   16 o    528.8    2.7    0.0000   0.0000          ?        ?  2797.3633  28.0950          ?        ?      528.8        2.7       ?       ? 
1 1 1   43    6   17 o    291.7    2.5    0.0000   0.0000          ?        ?   851.1494  14.6860          ?        ?      291.7        2.5       ?       ? 
1 1 1   43    6   18 o    637.8    2.9    0.0000   0.0000          ?        ?  4068.6599  37.0343          ?        ?      637.8        2.9       ?       ? 
1 1 1   43    6   19 o    212.6    3.5    0.0000   0.0000          ?        ?   452.0733  14.6860          ?        ?      212.6        3.5       ?       ? 
1 1 1   43    6   20 o    349.3    2.5    0.0000   0.0000          ?        ?  1220.2148  17.2401          ?        ?      349.3        2.5       ?       ? 
1 1 1   43    6   21 o    174.7    3.7    0.0000   0.0000          ?        ?   305.2133  12.7704          ?        ?      174.7        3.7       ?       ? 
1 1 1   43    6   22 o    361.8    2.5    0.0000   0.0000          ?        ?  1308.9694  17.8786          ?        ?      361.8        2.5       ?       ? 
1 1 1   43    6   23 o    337.1    2.7    0.0000   0.0000          ?        ?  1136.5685  17.8786          ?        ?      337.1        2.7       ?       ? 
1 1 1   43    6   24 o   1068.5    3.9    0.0000   0.0000          ?        ? 11421.8750  83.6463          ?        ?     1068.5        3.9       ?       ? 
1 1 1   43    6   25 o    234.8    3.4    0.0000   0.0000          ?        ?   551.6827  15.9630          ?        ?      234.8        3.4       ?       ? 
1 1 1   43    6   26 o    214.1    3.3    0.0000   0.0000          ?        ?   458.4586  14.0475          ?        ?      214.1        3.3       ?       ? 
1 1 1   43    6   27 o    201.8    3.5    0.0000   0.0000          ?        ?   407.3768  14.0475          ?        ?      201.8        3.5       ?       ? 
1 1 1   43    6   28 o    500.1    2.6    0.0000   0.0000          ?        ?  2501.7275  25.5409          ?        ?      500.1        2.6       ?       ? 
1 1 1   43    6   29 o    285.8    2.8    0.0000   0.0000          ?        ?   817.3077  15.9630          ?        ?      285.8        2.8       ?       ? 
1 1 1   43    6   30 f    448.5    2.6    0.0000   0.0000          ?        ?  2011.9817  22.9868          ?        ?      448.5        2.6       ?       ? 
1 1 1   43    6   31 o    536.1    2.6    0.0000   0.0000          ?        ?  2874.6245  28.0950          ?        ?      536.1        2.6       ?       ? 
1 1 1   43    6   32 o    313.4    2.9    0.0000   0.0000          ?        ?   982.6848  17.8786          ?        ?      313.4        2.9       ?       ? 
1 1 1   43    6   33 o    346.0    2.7    0.0000   0.0000          ?        ?  1197.8666  18.5171          ?        ?      346.0        2.7       ?       ? 
1 1 1   43    6   34 o    417.1    2.5    0.0000   0.0000          ?        ?  1740.6100  21.0712          ?        ?      417.1        2.5       ?       ? 
1 1 1   43    6   35 o    244.4    3.3    0.0000   0.0000          ?        ?   597.6562  15.9630          ?        ?      244.4        3.3       ?       ? 
1 1 1   43    6   36 o    563.3    2.7    0.0000   0.0000          ?        ?  3174.7295  30.6490          ?        ?      563.3        2.7       ?       ? 
1 1 1   43    6   37 o    167.7    4.6    0.0000   0.0000          ?        ?   281.5880  15.3245          ?        ?      167.7        4.6       ?       ? 
1 1 1   43    6   38 o     24.2   11.5    0.0000   0.0000          ?        ?   -19.7942  15.3245          ?        ?       24.2       11.5       ?       ? 
1 1 1   43    6   39 o    162.1    4.9    0.0000   0.0000          ?        ?   263.0709  15.9630          ?        ?      162.1        4.9       ?       ? 
1 1 1   43    6   40 o    209.6    4.1    0.0000   0.0000          ?        ?   439.9414  17.2401          ?        ?      209.6        4.1       ?       ? 
1 1 1   43    6   41 o    354.6    2.9    0.0000   0.0000          ?        ?  1257.8876  20.4327          ?        ?      354.6        2.9       ?       ? 
1 1 1   43    6   42 o    145.9    5.7    0.0000   0.0000          ?        ?   213.2662  16.6016          ?        ?      145.9        5.7       ?       ? 
1 1 1   43    6   43 o    497.4    2.6    0.0000   0.0000          ?        ?  2474.9099  26.1794          ?        ?      497.4        2.6       ?       ? 
1 1 1   43    6   44 o    326.3    3.0    0.0000   0.0000          ?        ?  1065.6925  19.7942          ?        ?      326.3        3.0       ?       ? 
1 1 1   43    6   45 o     61.3   13.4    0.0000   0.0000          ?        ?    39.5883  15.9630          ?        ?       61.3       13.4       ?       ? 
1 1 1   43    6   46 o    123.8    7.0    0.0000   0.0000          ?        ?   153.8837  17.2401          ?        ?      123.8        7.0       ?       ? 
1 1 1   43    6   47 o     31.1   13.7    0.0000   0.0000          ?        ?    -4.4697  16.6016          ?        ?       31.1       13.7       ?       ? 
1 1 1   43    6   48 o    327.3    3.1    0.0000   0.0000          ?        ?  1072.0778  20.4327          ?        ?      327.3        3.1       ?       ? 
1 1 1   43    6   49 o     81.0   11.4    0.0000   0.0000          ?        ?    66.4062  18.5171          ?        ?       81.0       11.4       ?       ? 
1 1 1   43    6   50 o    104.1    8.9    0.0000   0.0000          ?        ?   109.1872  18.5171          ?        ?      104.1        8.9       ?       ? 
1 1 1   43    6   51 o     20.9   10.4    0.0000   0.0000          ?        ?   -47.8891  17.8786          ?        ?       20.9       10.4       ?       ? 
1 1 1   43    6   52 o    118.4    7.8    0.0000   0.0000          ?        ?   141.1133  18.5171          ?        ?      118.4        7.8       ?       ? 
1 1 1   43    6   53 o    193.8    4.9    0.0000   0.0000          ?        ?   376.7278  19.1556          ?        ?      193.8        4.9       ?       ? 
1 1 1   43    6   54 o     98.9    9.4    0.0000   0.0000          ?        ?    98.9709  18.5171          ?        ?       98.9        9.4       ?       ? 
1 1 1   43    6   55 o    377.0    3.0    0.0000   0.0000          ?        ?  1423.2646  22.9868          ?        ?      377.0        3.0       ?       ? 
1 1 1   43    6   56 o     21.3   10.7    0.0000   0.0000          ?        ?   -60.6596  20.4327          ?        ?       21.3       10.7       ?       ? 
1 1 1   43    6   57 o    173.0    5.5    0.0000   0.0000          ?        ?   300.7437  19.1556          ?        ?      173.0        5.5       ?       ? 
1 1 1   43    6   58 o    135.8    6.6    0.0000   0.0000          ?        ?   185.8098  17.8786          ?        ?      135.8        6.6       ?       ? 
1 1 1   43    6   59 f     93.9   10.2    0.0000   0.0000          ?        ?    90.0316  19.1556          ?        ?       93.9       10.2       ?       ? 
1 1 1   43    7    0 o     61.9   13.6   43.4195  14.6860    43.4195  14.6860    43.4195  14.6860       61.9     13.6       61.9       13.6     0.0     0.0 
1 1 1   43    7    1 o    429.2    2.5    0.0000   0.0000          ?        ?  1842.7734  21.0712          ?        ?      429.2        2.5       ?       ? 
1 1 1   43    7    2 o    822.9    3.3    0.0000   0.0000          ?        ?  6774.0762  54.2743          ?        ?      822.9        3.3       ?       ? 
1 1 1   43    7    3 o    631.1    2.8    0.0000   0.0000          ?        ?  3983.0979  35.7572          ?        ?      631.1        2.8       ?       ? 
1 1 1   43    7    4 f    462.5    2.5    0.0000   0.0000          ?        ?  2139.6860  22.9868          ?        ?      462.5        2.5       ?       ? 
1 1 1   43    7    5 o    199.6    3.0    0.0000   0.0000          ?        ?   398.4375  12.1319          ?        ?      199.6        3.0       ?       ? 
1 1 1   43    7    6 o    416.1    2.5    0.0000   0.0000          ?        ?  1731.6708  20.4327          ?        ?      416.1        2.5       ?       ? 
1 1 1   43    7    7 o    569.1    2.7    0.0000   0.0000          ?        ?  3239.2202  31.2876          ?        ?      569.1        2.7       ?       ? 
1 1 1   43    7    8 o    196.2    3.3    0.0000   0.0000          ?        ?   385.0285  12.7704          ?        ?      196.2        3.3       ?       ? 
1 1 1   43    7    9 o     16.1    8.1    0.0000   0.0000          ?        ?   -34.4802  11.4934          ?        ?       16.1        8.1       ?       ? 
1 1 1   43    7   10 o    195.9    3.3    0.0000   0.0000          ?        ?   383.7515  12.7704          ?        ?      195.9        3.3       ?       ? 
1 1 1   43    7   11 o    198.5    3.2    0.0000   0.0000          ?        ?   393.9678  12.7704          ?        ?      198.5        3.2       ?       ? 
1 1 1   43    7   12 o    488.1    2.7    0.0000   0.0000          ?        ?  2382.9629  26.1794          ?        ?      488.1        2.7       ?       ? 
1 1 1   43    7   13 o    294.2    2.6    0.0000   0.0000          ?        ?   865.8354  15.3245          ?        ?      294.2        2.6       ?       ? 
1 1 1   43    7   14 o    266.8    2.6    0.0000   0.0000          ?        ?   711.9516  14.0475          ?        ?      266.8        2.6       ?       ? 
1 1 1   43    7   15 o    426.7    2.5    0.0000   0.0000          ?        ?  1821.0637  21.7097          ?        ?      426.7        2.5       ?       ? 
1 1 1   43    7   16 o    677.8    3.1    0.0000   0.0000          ?        ?  4595.4404  41.5039          ?        ?      677.8        3.1       ?       ? 
1 1 1   43    7   17 o    291.7    2.7    0.0000   0.0000          ?        ?   851.1494  15.9630          ?        ?      291.7        2.7       ?       ? 
1 1 1   43    7   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    7   19 o    382.3    2.5    0.0000   0.0000          ?        ?  1461.5759  19.1556          ?        ?      382.3        2.5       ?       ? 
1 1 1   43    7   20 o    292.8    2.6    0.0000   0.0000          ?        ?   857.5345  15.3245          ?        ?      292.8        2.6       ?       ? 
1 1 1   43    7   21 o    465.6    2.4    0.0000   0.0000          ?        ?  2168.4194  22.3483          ?        ?      465.6        2.4       ?       ? 
1 1 1   43    7   22 o    322.0    2.5    0.0000   0.0000          ?        ?  1036.9591  15.9630          ?        ?      322.0        2.5       ?       ? 
1 1 1   43    7   23 o    360.1    2.5    0.0000   0.0000          ?        ?  1296.8374  17.8786          ?        ?      360.1        2.5       ?       ? 
1 1 1   43    7   24 o    340.2    2.6    0.0000   0.0000          ?        ?  1157.6398  17.8786          ?        ?      340.2        2.6       ?       ? 
1 1 1   43    7   25 o    343.0    2.6    0.0000   0.0000          ?        ?  1176.7954  17.8786          ?        ?      343.0        2.6       ?       ? 
1 1 1   43    7   26 f     33.9   13.4    0.0000   0.0000          ?        ?     6.3852  13.4090          ?        ?       33.9       13.4       ?       ? 
1 1 1   43    7   27 o    565.2    2.5    0.0000   0.0000          ?        ?  3195.8008  28.7335          ?        ?      565.2        2.5       ?       ? 
1 1 1   43    7   28 o    234.0    3.3    0.0000   0.0000          ?        ?   547.8516  15.3245          ?        ?      234.0        3.3       ?       ? 
1 1 1   43    7   29 o    164.5    4.5    0.0000   0.0000          ?        ?   270.7332  14.6860          ?        ?      164.5        4.5       ?       ? 
1 1 1   43    7   30 o    196.6    3.9    0.0000   0.0000          ?        ?   386.9441  15.3245          ?        ?      196.6        3.9       ?       ? 
1 1 1   43    7   31 o    246.0    3.2    0.0000   0.0000          ?        ?   605.3185  15.9630          ?        ?      246.0        3.2       ?       ? 
1 1 1   43    7   32 o     37.6   14.0    0.0000   0.0000          ?        ?    10.8549  14.0475          ?        ?       37.6       14.0       ?       ? 
1 1 1   43    7   33 o    222.5    3.4    0.0000   0.0000          ?        ?   495.4928  15.3245          ?        ?      222.5        3.4       ?       ? 
1 1 1   43    7   34 o    221.1    3.5    0.0000   0.0000          ?        ?   489.1075  15.3245          ?        ?      221.1        3.5       ?       ? 
1 1 1   43    7   35 o    252.6    3.2    0.0000   0.0000          ?        ?   638.5216  15.9630          ?        ?      252.6        3.2       ?       ? 
1 1 1   43    7   36 o    236.1    3.5    0.0000   0.0000          ?        ?   558.0679  16.6016          ?        ?      236.1        3.5       ?       ? 
1 1 1   43    7   37 o    193.2    4.1    0.0000   0.0000          ?        ?   373.5352  15.9630          ?        ?      193.2        4.1       ?       ? 
1 1 1   43    7   38 o    285.2    3.0    0.0000   0.0000          ?        ?   814.1151  17.2401          ?        ?      285.2        3.0       ?       ? 
1 1 1   43    7   39 o    231.1    3.6    0.0000   0.0000          ?        ?   534.4426  16.6016          ?        ?      231.1        3.6       ?       ? 
1 1 1   43    7   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    7   41 o    140.5    5.9    0.0000   0.0000          ?        ?   197.9417  16.6016          ?        ?      140.5        5.9       ?       ? 
1 1 1   43    7   42 o    311.5    3.0    0.0000   0.0000          ?        ?   971.1914  18.5171          ?        ?      311.5        3.0       ?       ? 
1 1 1   43    7   43 o    197.2    4.4    0.0000   0.0000          ?        ?   389.4982  17.2401          ?        ?      197.2        4.4       ?       ? 
1 1 1   43    7   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43    7   45 o     79.2   10.5    0.0000   0.0000          ?        ?    63.2136  16.6016          ?        ?       79.2       10.5       ?       ? 
1 1 1   43    7   46 o     95.6    9.0    0.0000   0.0000          ?        ?    91.9471  17.2401          ?        ?       95.6        9.0       ?       ? 
1 1 1   43    7   47 o    246.8    4.0    0.0000   0.0000          ?        ?   609.7881  19.7942          ?        ?      246.8        4.0       ?       ? 
1 1 1   43    7   48 o    289.7    3.5    0.0000   0.0000          ?        ?   840.2945  20.4327          ?        ?      289.7        3.5       ?       ? 
1 1 1   43    7   49 o    118.2    7.6    0.0000   0.0000          ?        ?   140.4748  17.8786          ?        ?      118.2        7.6       ?       ? 
1 1 1   43    7   50 o    126.0    7.3    0.0000   0.0000          ?        ?   159.6304  18.5171          ?        ?      126.0        7.3       ?       ? 
1 1 1   43    7   51 o    138.1    6.5    0.0000   0.0000          ?        ?   191.5565  17.8786          ?        ?      138.1        6.5       ?       ? 
1 1 1   43    7   52 o    112.6    7.7    0.0000   0.0000          ?        ?   127.7043  17.2401          ?        ?      112.6        7.7       ?       ? 
1 1 1   43    7   53 o     93.3    9.9    0.0000   0.0000          ?        ?    88.1160  18.5171          ?        ?       93.3        9.9       ?       ? 
1 1 1   43    7   54 o    111.6    8.6    0.0000   0.0000          ?        ?   125.7888  19.1556          ?        ?      111.6        8.6       ?       ? 
1 1 1   43    7   55 o    194.4    4.9    0.0000   0.0000          ?        ?   379.2819  19.1556          ?        ?      194.4        4.9       ?       ? 
1 1 1   43    7   56 o     31.2   14.1    0.0000   0.0000          ?        ?    -8.3008  18.5171          ?        ?       31.2       14.1       ?       ? 
1 1 1   43    7   57 o    224.5    4.4    0.0000   0.0000          ?        ?   505.7091  19.7942          ?        ?      224.5        4.4       ?       ? 
1 1 1   43    7   58 o     28.3   13.1    0.0000   0.0000          ?        ?   -14.6860  17.8786          ?        ?       28.3       13.1       ?       ? 
1 1 1   43    8    0 o    167.0    4.6  279.6725  15.3245   279.6725  15.3245   279.6725  15.3245      167.0      4.6      167.0        4.6     0.0     0.0 
1 1 1   43    8    1 o    446.4    2.5    0.0000   0.0000          ?        ?  1992.8260  22.3483          ?        ?      446.4        2.5       ?       ? 
1 1 1   43    8    2 o    312.7    2.6    0.0000   0.0000          ?        ?   978.2151  15.9630          ?        ?      312.7        2.6       ?       ? 
1 1 1   43    8    3 o    331.8    2.6    0.0000   0.0000          ?        ?  1100.8113  17.2401          ?        ?      331.8        2.6       ?       ? 
1 1 1   43    8    4 o    268.9    2.6    0.0000   0.0000          ?        ?   723.4450  14.0475          ?        ?      268.9        2.6       ?       ? 
1 1 1   43    8    5 o    394.4    2.5    0.0000   0.0000          ?        ?  1555.4387  19.7942          ?        ?      394.4        2.5       ?       ? 
1 1 1   43    8    6 o    588.6    2.8    0.0000   0.0000          ?        ?  3465.2568  32.5646          ?        ?      588.6        2.8       ?       ? 
1 1 1   43    8    7 o    224.1    2.8    0.0000   0.0000          ?        ?   502.5165  12.7704          ?        ?      224.1        2.8       ?       ? 
1 1 1   43    8    8 o    463.2    2.5    0.0000   0.0000          ?        ?  2146.0713  22.9868          ?        ?      463.2        2.5       ?       ? 
1 1 1   43    8    9 o    249.7    3.1    0.0000   0.0000          ?        ?   623.8356  15.3245          ?        ?      249.7        3.1       ?       ? 
1 1 1   43    8   10 o    881.1    3.6    0.0000   0.0000          ?        ?  7765.6997  63.8522          ?        ?      881.1        3.6       ?       ? 
1 1 1   43    8   11 o    525.5    2.7    0.0000   0.0000          ?        ?  2762.2446  28.0950          ?        ?      525.5        2.7       ?       ? 
1 1 1   43    8   12 o    431.3    2.4    0.0000   0.0000          ?        ?  1860.6520  21.0712          ?        ?      431.3        2.4       ?       ? 
1 1 1   43    8   13 o    107.8    5.3    0.0000   0.0000          ?        ?   116.2109  11.4934          ?        ?      107.8        5.3       ?       ? 
1 1 1   43    8   14 o    481.0    2.6    0.0000   0.0000          ?        ?  2314.0024  24.9023          ?        ?      481.0        2.6       ?       ? 
1 1 1   43    8   15 f    310.6    2.9    0.0000   0.0000          ?        ?   964.8062  17.8786          ?        ?      310.6        2.9       ?       ? 
1 1 1   43    8   16 o    352.5    2.4    0.0000   0.0000          ?        ?  1242.5631  17.2401          ?        ?      352.5        2.4       ?       ? 
1 1 1   43    8   17 o    176.3    3.6    0.0000   0.0000          ?        ?   310.9600  12.7704          ?        ?      176.3        3.6       ?       ? 
1 1 1   43    8   18 o    268.8    2.7    0.0000   0.0000          ?        ?   722.8065  14.6860          ?        ?      268.8        2.7       ?       ? 
1 1 1   43    8   19 o    557.0    2.6    0.0000   0.0000          ?        ?  3103.2151  29.3720          ?        ?      557.0        2.6       ?       ? 
1 1 1   43    8   20 o    437.2    2.4    0.0000   0.0000          ?        ?  1911.7338  21.0712          ?        ?      437.2        2.4       ?       ? 
1 1 1   43    8   21 o    309.0    2.8    0.0000   0.0000          ?        ?   955.2284  17.2401          ?        ?      309.0        2.8       ?       ? 
1 1 1   43    8   22 o    428.9    2.6    0.0000   0.0000          ?        ?  1840.2194  22.3483          ?        ?      428.9        2.6       ?       ? 
1 1 1   43    8   23 o    116.6    5.5    0.0000   0.0000          ?        ?   136.0051  12.7704          ?        ?      116.6        5.5       ?       ? 
1 1 1   43    8   24 o    558.1    2.5    0.0000   0.0000          ?        ?  3115.3469  28.0950          ?        ?      558.1        2.5       ?       ? 
1 1 1   43    8   25 f    241.8    3.0    0.0000   0.0000          ?        ?   584.8858  14.6860          ?        ?      241.8        3.0       ?       ? 
1 1 1   43    8   26 o    333.6    2.7    0.0000   0.0000          ?        ?  1112.9432  17.8786          ?        ?      333.6        2.7       ?       ? 
1 1 1   43    8   27 o     95.8    7.0    0.0000   0.0000          ?        ?    91.9471  13.4090          ?        ?       95.8        7.0       ?       ? 
1 1 1   43    8   28 o    321.8    2.8    0.0000   0.0000          ?        ?  1035.6820  17.8786          ?        ?      321.8        2.8       ?       ? 
1 1 1   43    8   29 o    579.7    2.8    0.0000   0.0000          ?        ?  3361.8164  31.9261          ?        ?      579.7        2.8       ?       ? 
1 1 1   43    8   30 o     29.5   12.9    0.0000   0.0000          ?        ?    -3.8311  14.6860          ?        ?       29.5       12.9       ?       ? 
1 1 1   43    8   31 o    227.4    3.4    0.0000   0.0000          ?        ?   517.2025  15.3245          ?        ?      227.4        3.4       ?       ? 
1 1 1   43    8   32 o    348.4    2.7    0.0000   0.0000          ?        ?  1214.4681  18.5171          ?        ?      348.4        2.7       ?       ? 
1 1 1   43    8   33 o    324.8    2.9    0.0000   0.0000          ?        ?  1055.4763  18.5171          ?        ?      324.8        2.9       ?       ? 
1 1 1   43    8   34 o    245.6    3.4    0.0000   0.0000          ?        ?   603.4030  16.6016          ?        ?      245.6        3.4       ?       ? 
1 1 1   43    8   35 o    106.4    7.2    0.0000   0.0000          ?        ?   113.6568  15.3245          ?        ?      106.4        7.2       ?       ? 
1 1 1   43    8   36 o    172.0    4.6    0.0000   0.0000          ?        ?   296.2740  15.9630          ?        ?      172.0        4.6       ?       ? 
1 1 1   43    8   37 o    369.7    2.7    0.0000   0.0000          ?        ?  1367.7133  19.7942          ?        ?      369.7        2.7       ?       ? 
1 1 1   43    8   38 o     72.6   10.1    0.0000   0.0000          ?        ?    52.9973  14.6860          ?        ?       72.6       10.1       ?       ? 
1 1 1   43    8   39 o     58.8   13.8    0.0000   0.0000          ?        ?    36.3957  15.9630          ?        ?       58.8       13.8       ?       ? 
1 1 1   43    8   40 o    269.9    3.3    0.0000   0.0000          ?        ?   729.1917  17.8786          ?        ?      269.9        3.3       ?       ? 
1 1 1   43    8   41 o    458.8    2.6    0.0000   0.0000          ?        ?  2105.8442  24.2638          ?        ?      458.8        2.6       ?       ? 
1 1 1   43    8   42 o    151.9    5.5    0.0000   0.0000          ?        ?   231.1448  16.6016          ?        ?      151.9        5.5       ?       ? 
1 1 1   43    8   43 o    108.1    8.0    0.0000   0.0000          ?        ?   117.4880  17.2401          ?        ?      108.1        8.0       ?       ? 
1 1 1   43    8   44 o     34.3   14.2    0.0000   0.0000          ?        ?     3.1926  15.9630          ?        ?       34.3       14.2       ?       ? 
1 1 1   43    8   45 o     63.7   13.4    0.0000   0.0000          ?        ?    42.7809  16.6016          ?        ?       63.7       13.4       ?       ? 
1 1 1   43    8   46 o     27.9   12.9    0.0000   0.0000          ?        ?   -14.6860  17.2401          ?        ?       27.9       12.9       ?       ? 
1 1 1   43    8   47 o    224.3    4.1    0.0000   0.0000          ?        ?   503.7936  18.5171          ?        ?      224.3        4.1       ?       ? 
1 1 1   43    8   48 o    177.9    5.4    0.0000   0.0000          ?        ?   317.3452  19.1556          ?        ?      177.9        5.4       ?       ? 
1 1 1   43    8   49 o    155.9    6.1    0.0000   0.0000          ?        ?   243.9153  19.1556          ?        ?      155.9        6.1       ?       ? 
1 1 1   43    8   50 o    111.2    7.8    0.0000   0.0000          ?        ?   124.5117  17.2401          ?        ?      111.2        7.8       ?       ? 
1 1 1   43    8   51 o     35.5   14.9    0.0000   0.0000          ?        ?     2.5541  17.8786          ?        ?       35.5       14.9       ?       ? 
1 1 1   43    8   52 o    128.9    7.2    0.0000   0.0000          ?        ?   167.2927  18.5171          ?        ?      128.9        7.2       ?       ? 
1 1 1   43    8   53 f     34.8   14.8    0.0000   0.0000          ?        ?     1.2770  17.8786          ?        ?       34.8       14.8       ?       ? 
1 1 1   43    8   54 o     36.6   15.3    0.0000   0.0000          ?        ?     3.8311  18.5171          ?        ?       36.6       15.3       ?       ? 
1 1 1   43    8   55 o    134.6    6.9    0.0000   0.0000          ?        ?   182.6172  18.5171          ?        ?      134.6        6.9       ?       ? 
1 1 1   43    8   56 o    200.2    4.6    0.0000   0.0000          ?        ?   402.2686  18.5171          ?        ?      200.2        4.6       ?       ? 
1 1 1   43    8   57 o    281.9    3.5    0.0000   0.0000          ?        ?   796.8750  19.7942          ?        ?      281.9        3.5       ?       ? 
1 1 1   43    9    0 o    149.9    4.9  225.3981  14.6860   225.3981  14.6860   225.3981  14.6860      149.9      4.9      149.9        4.9     0.0     0.0 
1 1 1   43    9    1 o    325.6    2.5    0.0000   0.0000          ?        ?  1060.5845  16.6016          ?        ?      325.6        2.5       ?       ? 
1 1 1   43    9    2 o    300.0    2.4    0.0000   0.0000          ?        ?   900.3155  14.6860          ?        ?      300.0        2.4       ?       ? 
1 1 1   43    9    3 o    426.5    2.5    0.0000   0.0000          ?        ?  1819.1481  21.0712          ?        ?      426.5        2.5       ?       ? 
1 1 1   43    9    4 f    227.5    2.7    0.0000   0.0000          ?        ?   517.8410  12.1319          ?        ?      227.5        2.7       ?       ? 
1 1 1   43    9    5 o     71.0    7.6    0.0000   0.0000          ?        ?    50.4432  10.8549          ?        ?       71.0        7.6       ?       ? 
1 1 1   43    9    6 o    332.3    2.4    0.0000   0.0000          ?        ?  1104.6425  15.9630          ?        ?      332.3        2.4       ?       ? 
1 1 1   43    9    7 o    407.3    2.4    0.0000   0.0000          ?        ?  1659.5177  19.7942          ?        ?      407.3        2.4       ?       ? 
1 1 1   43    9    8 o    134.6    4.3    0.0000   0.0000          ?        ?   181.3401  11.4934          ?        ?      134.6        4.3       ?       ? 
1 1 1   43    9    9 o    303.8    2.6    0.0000   0.0000          ?        ?   923.3023  15.9630          ?        ?      303.8        2.6       ?       ? 
1 1 1   43    9   10 o    378.6    2.5    0.0000   0.0000          ?        ?  1433.4811  19.1556          ?        ?      378.6        2.5       ?       ? 
1 1 1   43    9   11 o    185.3    3.4    0.0000   0.0000          ?        ?   343.5246  12.7704          ?        ?      185.3        3.4       ?       ? 
1 1 1   43    9   12 o    213.5    3.0    0.0000   0.0000          ?        ?   455.9044  12.7704          ?        ?      213.5        3.0       ?       ? 
1 1 1   43    9   13 o    395.6    2.4    0.0000   0.0000          ?        ?  1565.6550  19.1556          ?        ?      395.6        2.4       ?       ? 
1 1 1   43    9   14 o    256.7    2.7    0.0000   0.0000          ?        ?   658.9543  14.0475          ?        ?      256.7        2.7       ?       ? 
1 1 1   43    9   15 o    300.9    2.4    0.0000   0.0000          ?        ?   905.4237  14.6860          ?        ?      300.9        2.4       ?       ? 
1 1 1   43    9   16 o    149.0    4.3    0.0000   0.0000          ?        ?   222.2055  12.7704          ?        ?      149.0        4.3       ?       ? 
1 1 1   43    9   17 o    371.6    2.6    0.0000   0.0000          ?        ?  1381.1223  19.1556          ?        ?      371.6        2.6       ?       ? 
1 1 1   43    9   18 o    420.3    2.4    0.0000   0.0000          ?        ?  1766.7894  20.4327          ?        ?      420.3        2.4       ?       ? 
1 1 1   43    9   19 o    355.8    2.6    0.0000   0.0000          ?        ?  1266.1884  18.5171          ?        ?      355.8        2.6       ?       ? 
1 1 1   43    9   20 o    520.5    2.6    0.0000   0.0000          ?        ?  2709.8857  26.8179          ?        ?      520.5        2.6       ?       ? 
1 1 1   43    9   21 o    536.7    2.5    0.0000   0.0000          ?        ?  2881.6479  26.8179          ?        ?      536.7        2.5       ?       ? 
1 1 1   43    9   22 o    320.7    2.6    0.0000   0.0000          ?        ?  1028.6583  16.6016          ?        ?      320.7        2.6       ?       ? 
1 1 1   43    9   23 o    300.1    2.7    0.0000   0.0000          ?        ?   900.9540  15.9630          ?        ?      300.1        2.7       ?       ? 
1 1 1   43    9   24 f    121.6    5.5    0.0000   0.0000          ?        ?   148.1370  13.4090          ?        ?      121.6        5.5       ?       ? 
1 1 1   43    9   25 o    299.2    2.8    0.0000   0.0000          ?        ?   895.2073  16.6016          ?        ?      299.2        2.8       ?       ? 
1 1 1   43    9   26 o    171.3    4.3    0.0000   0.0000          ?        ?   293.7199  14.6860          ?        ?      171.3        4.3       ?       ? 
1 1 1   43    9   27 o    255.7    3.0    0.0000   0.0000          ?        ?   653.8461  15.3245          ?        ?      255.7        3.0       ?       ? 
1 1 1   43    9   28 o     81.0    8.7    0.0000   0.0000          ?        ?    65.7677  14.0475          ?        ?       81.0        8.7       ?       ? 
1 1 1   43    9   29 o    122.7    5.7    0.0000   0.0000          ?        ?   150.6911  14.0475          ?        ?      122.7        5.7       ?       ? 
1 1 1   43    9   30 o     24.1   11.3    0.0000   0.0000          ?        ?   -15.3245  14.0475          ?        ?       24.1       11.3       ?       ? 
1 1 1   43    9   31 o     43.0   14.1    0.0000   0.0000          ?        ?    17.8786  14.0475          ?        ?       43.0       14.1       ?       ? 
1 1 1   43    9   32 o    363.7    2.5    0.0000   0.0000          ?        ?  1323.0168  18.5171          ?        ?      363.7        2.5       ?       ? 
1 1 1   43    9   33 o    268.5    3.0    0.0000   0.0000          ?        ?   721.5294  15.9630          ?        ?      268.5        3.0       ?       ? 
1 1 1   43    9   34 o    231.9    3.6    0.0000   0.0000          ?        ?   538.2737  16.6016          ?        ?      231.9        3.6       ?       ? 
1 1 1   43    9   35 o     86.6    8.5    0.0000   0.0000          ?        ?    75.3456  14.6860          ?        ?       86.6        8.5       ?       ? 
1 1 1   43    9   36 o     39.8   14.6    0.0000   0.0000          ?        ?    12.7704  15.3245          ?        ?       39.8       14.6       ?       ? 
1 1 1   43    9   37 o     68.9   11.1    0.0000   0.0000          ?        ?    47.8891  15.3245          ?        ?       68.9       11.1       ?       ? 
1 1 1   43    9   38 o     62.5   12.7    0.0000   0.0000          ?        ?    40.8654  15.3245          ?        ?       62.5       12.7       ?       ? 
1 1 1   43    9   39 o    269.0    3.1    0.0000   0.0000          ?        ?   724.0836  16.6016          ?        ?      269.0        3.1       ?       ? 
1 1 1   43    9   40 o    213.8    4.0    0.0000   0.0000          ?        ?   457.8200  17.2401          ?        ?      213.8        4.0       ?       ? 
1 1 1   43    9   41 o     72.9   11.4    0.0000   0.0000          ?        ?    53.6358  16.6016          ?        ?       72.9       11.4       ?       ? 
1 1 1   43    9   42 o     38.9   15.0    0.0000   0.0000          ?        ?    10.2163  16.6016          ?        ?       38.9       15.0       ?       ? 
1 1 1   43    9   43 o     60.8   13.9    0.0000   0.0000          ?        ?    38.9498  16.6016          ?        ?       60.8       13.9       ?       ? 
1 1 1   43    9   44 o     57.1   14.9    0.0000   0.0000          ?        ?    34.4802  17.2401          ?        ?       57.1       14.9       ?       ? 
1 1 1   43    9   45 o    263.9    3.5    0.0000   0.0000          ?        ?   697.2656  18.5171          ?        ?      263.9        3.5       ?       ? 
1 1 1   43    9   46 o    110.4    7.8    0.0000   0.0000          ?        ?   122.5962  17.2401          ?        ?      110.4        7.8       ?       ? 
1 1 1   43    9   47 o    137.7    6.5    0.0000   0.0000          ?        ?   190.2794  17.8786          ?        ?      137.7        6.5       ?       ? 
1 1 1   43    9   48 o    122.7    7.3    0.0000   0.0000          ?        ?   151.3296  17.8786          ?        ?      122.7        7.3       ?       ? 
1 1 1   43    9   49 o     25.8   12.3    0.0000   0.0000          ?        ?   -21.0712  17.2401          ?        ?       25.8       12.3       ?       ? 
1 1 1   43    9   50 o     38.1   15.5    0.0000   0.0000          ?        ?     6.3852  18.5171          ?        ?       38.1       15.5       ?       ? 
1 1 1   43    9   51 o    280.3    3.6    0.0000   0.0000          ?        ?   787.2972  20.4327          ?        ?      280.3        3.6       ?       ? 
1 1 1   43    9   52 o    243.2    3.8    0.0000   0.0000          ?        ?   592.5481  18.5171          ?        ?      243.2        3.8       ?       ? 
1 1 1   43    9   53 o     37.1   15.2    0.0000   0.0000          ?        ?     5.7467  17.8786          ?        ?       37.1       15.2       ?       ? 
1 1 1   43    9   54 o    210.0    4.4    0.0000   0.0000          ?        ?   442.4955  18.5171          ?        ?      210.0        4.4       ?       ? 
1 1 1   43    9   55 o     38.0   15.3    0.0000   0.0000          ?        ?     7.6623  17.8786          ?        ?       38.0       15.3       ?       ? 
1 1 1   43    9   56 o    262.8    3.8    0.0000   0.0000          ?        ?   692.7960  19.7942          ?        ?      262.8        3.8       ?       ? 
1 1 1   43    9   57 o     30.4   13.8    0.0000   0.0000          ?        ?   -10.2163  18.5171          ?        ?       30.4       13.8       ?       ? 
1 1 1   43   10    0 o    294.9    3.6  870.3050  21.0712   870.3050  21.0712   870.3050  21.0712      294.9      3.6      294.9        3.6     0.0     0.0 
1 1 1   43   10    1 o    142.9    3.6    0.0000   0.0000          ?        ?   204.3269  10.2163          ?        ?      142.9        3.6       ?       ? 
1 1 1   43   10    2 o     87.1    5.9    0.0000   0.0000          ?        ?    75.9841  10.2163          ?        ?       87.1        5.9       ?       ? 
1 1 1   43   10    3 o    322.9    2.5    0.0000   0.0000          ?        ?  1042.7058  15.9630          ?        ?      322.9        2.5       ?       ? 
1 1 1   43   10    4 o    451.6    2.5    0.0000   0.0000          ?        ?  2040.0765  22.3483          ?        ?      451.6        2.5       ?       ? 
1 1 1   43   10    5 o    374.2    2.5    0.0000   0.0000          ?        ?  1400.2780  18.5171          ?        ?      374.2        2.5       ?       ? 
1 1 1   43   10    6 o    649.3    3.0    0.0000   0.0000          ?        ?  4217.4355  38.3113          ?        ?      649.3        3.0       ?       ? 
1 1 1   43   10    7 o    370.1    2.5    0.0000   0.0000          ?        ?  1370.2675  18.5171          ?        ?      370.1        2.5       ?       ? 
1 1 1   43   10    8 o    641.6    2.9    0.0000   0.0000          ?        ?  4117.8262  37.0343          ?        ?      641.6        2.9       ?       ? 
1 1 1   43   10    9 o    314.7    2.4    0.0000   0.0000          ?        ?   990.3471  15.3245          ?        ?      314.7        2.4       ?       ? 
1 1 1   43   10   10 o    344.3    2.5    0.0000   0.0000          ?        ?  1185.7346  17.2401          ?        ?      344.3        2.5       ?       ? 
1 1 1   43   10   11 o    307.9    2.4    0.0000   0.0000          ?        ?   948.2046  14.6860          ?        ?      307.9        2.4       ?       ? 
1 1 1   43   10   12 o    431.0    2.4    0.0000   0.0000          ?        ?  1858.0979  21.0712          ?        ?      431.0        2.4       ?       ? 
1 1 1   43   10   13 o    225.3    3.1    0.0000   0.0000          ?        ?   507.6247  14.0475          ?        ?      225.3        3.1       ?       ? 
1 1 1   43   10   14 o    901.4    3.6    0.0000   0.0000          ?        ?  8128.3804  65.1292          ?        ?      901.4        3.6       ?       ? 
1 1 1   43   10   15 o    221.1    3.2    0.0000   0.0000          ?        ?   489.1075  14.0475          ?        ?      221.1        3.2       ?       ? 
1 1 1   43   10   16 o     87.1    6.6    0.0000   0.0000          ?        ?    75.9841  11.4934          ?        ?       87.1        6.6       ?       ? 
1 1 1   43   10   17 o    527.6    2.8    0.0000   0.0000          ?        ?  2783.9543  29.3720          ?        ?      527.6        2.8       ?       ? 
1 1 1   43   10   18 o    585.0    2.8    0.0000   0.0000          ?        ?  3423.1143  32.5646          ?        ?      585.0        2.8       ?       ? 
1 1 1   43   10   19 o    698.1    3.2    0.0000   0.0000          ?        ?  4875.1128  44.0580          ?        ?      698.1        3.2       ?       ? 
1 1 1   43   10   20 o    378.2    2.5    0.0000   0.0000          ?        ?  1430.9270  19.1556          ?        ?      378.2        2.5       ?       ? 
1 1 1   43   10   21 o    223.0    3.4    0.0000   0.0000          ?        ?   497.4084  15.3245          ?        ?      223.0        3.4       ?       ? 
1 1 1   43   10   22 o    497.2    2.4    0.0000   0.0000          ?        ?  2472.3557  24.2638          ?        ?      497.2        2.4       ?       ? 
1 1 1   43   10   23 o    605.7    2.7    0.0000   0.0000          ?        ?  3669.5840  33.2031          ?        ?      605.7        2.7       ?       ? 
1 1 1   43   10   24 o    537.6    2.6    0.0000   0.0000          ?        ?  2890.5874  28.0950          ?        ?      537.6        2.6       ?       ? 
1 1 1   43   10   25 o    279.4    2.9    0.0000   0.0000          ?        ?   780.9120  15.9630          ?        ?      279.4        2.9       ?       ? 
1 1 1   43   10   26 o    383.8    2.5    0.0000   0.0000          ?        ?  1473.7079  19.1556          ?        ?      383.8        2.5       ?       ? 
1 1 1   43   10   27 o     72.6    9.7    0.0000   0.0000          ?        ?    52.9973  14.0475          ?        ?       72.6        9.7       ?       ? 
1 1 1   43   10   28 o    337.8    2.6    0.0000   0.0000          ?        ?  1141.6766  17.2401          ?        ?      337.8        2.6       ?       ? 
1 1 1   43   10   29 o    444.6    2.5    0.0000   0.0000          ?        ?  1977.5016  22.3483          ?        ?      444.6        2.5       ?       ? 
1 1 1   43   10   30 o     23.4   11.2    0.0000   0.0000          ?        ?   -19.7942  14.6860          ?        ?       23.4       11.2       ?       ? 
1 1 1   43   10   31 o    190.5    3.9    0.0000   0.0000          ?        ?   363.3188  14.6860          ?        ?      190.5        3.9       ?       ? 
1 1 1   43   10   32 o     19.9    9.8    0.0000   0.0000          ?        ?   -34.4802  14.6860          ?        ?       19.9        9.8       ?       ? 
1 1 1   43   10   33 o    404.8    2.7    0.0000   0.0000          ?        ?  1639.7235  21.7097          ?        ?      404.8        2.7       ?       ? 
1 1 1   43   10   34 o    250.5    3.2    0.0000   0.0000          ?        ?   627.6667  15.9630          ?        ?      250.5        3.2       ?       ? 
1 1 1   43   10   35 o    233.3    3.6    0.0000   0.0000          ?        ?   544.6590  16.6016          ?        ?      233.3        3.6       ?       ? 
1 1 1   43   10   36 o    120.2    6.4    0.0000   0.0000          ?        ?   144.9444  15.3245          ?        ?      120.2        6.4       ?       ? 
1 1 1   43   10   37 o    243.2    3.4    0.0000   0.0000          ?        ?   591.9095  16.6016          ?        ?      243.2        3.4       ?       ? 
1 1 1   43   10   38 o    407.2    2.7    0.0000   0.0000          ?        ?  1658.8792  21.7097          ?        ?      407.2        2.7       ?       ? 
1 1 1   43   10   39 o    225.0    3.8    0.0000   0.0000          ?        ?   506.9862  17.2401          ?        ?      225.0        3.8       ?       ? 
1 1 1   43   10   40 o    148.5    5.4    0.0000   0.0000          ?        ?   220.9285  15.9630          ?        ?      148.5        5.4       ?       ? 
1 1 1   43   10   41 f     63.3   13.5    0.0000   0.0000          ?        ?    42.1424  16.6016          ?        ?       63.3       13.5       ?       ? 
1 1 1   43   10   42 o     98.9    8.1    0.0000   0.0000          ?        ?    98.3323  15.9630          ?        ?       98.9        8.1       ?       ? 
1 1 1   43   10   43 o    150.2    5.5    0.0000   0.0000          ?        ?   226.0367  16.6016          ?        ?      150.2        5.5       ?       ? 
1 1 1   43   10   44 o    155.8    5.1    0.0000   0.0000          ?        ?   243.2767  15.9630          ?        ?      155.8        5.1       ?       ? 
1 1 1   43   10   45 o    149.5    5.6    0.0000   0.0000          ?        ?   224.1211  16.6016          ?        ?      149.5        5.6       ?       ? 
1 1 1   43   10   46 o     66.0   13.5    0.0000   0.0000          ?        ?    45.9736  17.2401          ?        ?       66.0       13.5       ?       ? 
1 1 1   43   10   47 o    187.5    4.8    0.0000   0.0000          ?        ?   352.4639  17.8786          ?        ?      187.5        4.8       ?       ? 
1 1 1   43   10   48 o    301.6    3.3    0.0000   0.0000          ?        ?   910.5319  19.7942          ?        ?      301.6        3.3       ?       ? 
1 1 1   43   10   49 o    192.7    4.8    0.0000   0.0000          ?        ?   372.2581  18.5171          ?        ?      192.7        4.8       ?       ? 
1 1 1   43   10   50 o     19.6    9.9    0.0000   0.0000          ?        ?   -56.1899  17.8786          ?        ?       19.6        9.9       ?       ? 
1 1 1   43   10   51 o    140.8    6.4    0.0000   0.0000          ?        ?   199.2188  17.8786          ?        ?      140.8        6.4       ?       ? 
1 1 1   43   10   52 o     29.1   13.4    0.0000   0.0000          ?        ?   -14.6860  18.5171          ?        ?       29.1       13.4       ?       ? 
1 1 1   43   10   53 o    242.4    4.1    0.0000   0.0000          ?        ?   589.3555  19.7942          ?        ?      242.4        4.1       ?       ? 
1 1 1   43   10   54 o     54.7   16.0    0.0000   0.0000          ?        ?    31.9261  18.5171          ?        ?       54.7       16.0       ?       ? 
1 1 1   43   10   55 o     35.6   14.9    0.0000   0.0000          ?        ?     3.1926  17.8786          ?        ?       35.6       14.9       ?       ? 
1 1 1   43   10   56 o    121.8    7.6    0.0000   0.0000          ?        ?   150.0526  18.5171          ?        ?      121.8        7.6       ?       ? 
1 1 1   43   11    0 o    522.5    3.6 2730.9570  37.6728  2730.9570  37.6728  2730.9570  37.6728      522.5      3.6      522.5        3.6     0.0     0.0 
1 1 1   43   11    1 o    264.4    2.4    0.0000   0.0000          ?        ?   699.1812  12.7704          ?        ?      264.4        2.4       ?       ? 
1 1 1   43   11    2 o    548.6    2.6    0.0000   0.0000          ?        ?  3009.9910  28.7335          ?        ?      548.6        2.6       ?       ? 
1 1 1   43   11    3 o    249.2    2.6    0.0000   0.0000          ?        ?   621.2816  12.7704          ?        ?      249.2        2.6       ?       ? 
1 1 1   43   11    4 o    265.5    2.6    0.0000   0.0000          ?        ?   704.9279  14.0475          ?        ?      265.5        2.6       ?       ? 
1 1 1   43   11    5 o    415.1    2.5    0.0000   0.0000          ?        ?  1723.3699  21.0712          ?        ?      415.1        2.5       ?       ? 
1 1 1   43   11    6 o    317.8    2.4    0.0000   0.0000          ?        ?  1010.1412  15.3245          ?        ?      317.8        2.4       ?       ? 
1 1 1   43   11    7 o    500.0    2.7    0.0000   0.0000          ?        ?  2500.4507  26.8179          ?        ?      500.0        2.7       ?       ? 
1 1 1   43   11    8 o    179.0    3.2    0.0000   0.0000          ?        ?   320.5379  11.4934          ?        ?      179.0        3.2       ?       ? 
1 1 1   43   11    9 f    166.1    3.3    0.0000   0.0000          ?        ?   275.8413  10.8549          ?        ?      166.1        3.3       ?       ? 
1 1 1   43   11   10 o    192.7    3.0    0.0000   0.0000          ?        ?   371.6196  11.4934          ?        ?      192.7        3.0       ?       ? 
1 1 1   43   11   11 o    153.5    3.7    0.0000   0.0000          ?        ?   235.6145  11.4934          ?        ?      153.5        3.7       ?       ? 
1 1 1   43   11   12 o    117.4    4.9    0.0000   0.0000          ?        ?   137.9207  11.4934          ?        ?      117.4        4.9       ?       ? 
1 1 1   43   11   13 o    450.8    2.8    0.0000   0.0000          ?        ?  2033.0529  24.9023          ?        ?      450.8        2.8       ?       ? 
1 1 1   43   11   14 o    149.7    4.1    0.0000   0.0000          ?        ?   224.1211  12.1319          ?        ?      149.7        4.1       ?       ? 
1 1 1   43   11   15 o    144.0    4.4    0.0000   0.0000          ?        ?   207.5195  12.7704          ?        ?      144.0        4.4       ?       ? 
1 1 1   43   11   16 o    654.2    3.0    0.0000   0.0000          ?        ?  4281.2876  38.9498          ?        ?      654.2        3.0       ?       ? 
1 1 1   43   11   17 o    317.7    2.7    0.0000   0.0000          ?        ?  1009.5027  17.2401          ?        ?      317.7        2.7       ?       ? 
1 1 1   43   11   18 o     39.9   13.1    0.0000   0.0000          ?        ?    15.3245  12.1319          ?        ?       39.9       13.1       ?       ? 
1 1 1   43   11   19 o     89.6    7.5    0.0000   0.0000          ?        ?    80.4537  13.4090          ?        ?       89.6        7.5       ?       ? 
1 1 1   43   11   20 o    729.2    3.2    0.0000   0.0000          ?        ?  5318.8853  46.6121          ?        ?      729.2        3.2       ?       ? 
1 1 1   43   11   21 o    143.8    4.4    0.0000   0.0000          ?        ?   206.8810  12.7704          ?        ?      143.8        4.4       ?       ? 
1 1 1   43   11   22 o    566.9    2.7    0.0000   0.0000          ?        ?  3214.3179  30.6490          ?        ?      566.9        2.7       ?       ? 
1 1 1   43   11   23 o    602.4    2.8    0.0000   0.0000          ?        ?  3630.6338  33.2031          ?        ?      602.4        2.8       ?       ? 
1 1 1   43   11   24 o    228.2    3.4    0.0000   0.0000          ?        ?   521.0336  15.3245          ?        ?      228.2        3.4       ?       ? 
1 1 1   43   11   25 o     73.1    9.2    0.0000   0.0000          ?        ?    53.6358  13.4090          ?        ?       73.1        9.2       ?       ? 
1 1 1   43   11   26 o    279.2    3.0    0.0000   0.0000          ?        ?   779.6349  16.6016          ?        ?      279.2        3.0       ?       ? 
1 1 1   43   11   27 o     73.1    9.6    0.0000   0.0000          ?        ?    53.6358  14.0475          ?        ?       73.1        9.6       ?       ? 
1 1 1   43   11   28 o    120.0    5.6    0.0000   0.0000          ?        ?   144.3059  13.4090          ?        ?      120.0        5.6       ?       ? 
1 1 1   43   11   29 o    254.6    3.1    0.0000   0.0000          ?        ?   648.7380  15.9630          ?        ?      254.6        3.1       ?       ? 
1 1 1   43   11   30 o    211.3    3.5    0.0000   0.0000          ?        ?   446.9651  14.6860          ?        ?      211.3        3.5       ?       ? 
1 1 1   43   11   31 o    397.7    2.5    0.0000   0.0000          ?        ?  1582.2566  19.7942          ?        ?      397.7        2.5       ?       ? 
1 1 1   43   11   32 o    386.6    2.6    0.0000   0.0000          ?        ?  1495.4176  19.7942          ?        ?      386.6        2.6       ?       ? 
1 1 1   43   11   33 o    182.3    4.2    0.0000   0.0000          ?        ?   332.6698  15.3245          ?        ?      182.3        4.2       ?       ? 
1 1 1   43   11   34 o    242.3    3.3    0.0000   0.0000          ?        ?   587.4399  15.9630          ?        ?      242.3        3.3       ?       ? 
1 1 1   43   11   35 f    227.2    3.7    0.0000   0.0000          ?        ?   516.5640  16.6016          ?        ?      227.2        3.7       ?       ? 
1 1 1   43   11   36 f    108.8    7.0    0.0000   0.0000          ?        ?   118.7650  15.3245          ?        ?      108.8        7.0       ?       ? 
1 1 1   43   11   37 o    450.1    2.6    0.0000   0.0000          ?        ?  2026.6676  22.9868          ?        ?      450.1        2.6       ?       ? 
1 1 1   43   11   38 o    198.0    4.2    0.0000   0.0000          ?        ?   392.6908  16.6016          ?        ?      198.0        4.2       ?       ? 
1 1 1   43   11   39 f    273.1    3.3    0.0000   0.0000          ?        ?   746.4318  17.8786          ?        ?      273.1        3.3       ?       ? 
1 1 1   43   11   40 o     19.5    9.8    0.0000   0.0000          ?        ?   -44.0580  15.9630          ?        ?       19.5        9.8       ?       ? 
1 1 1   43   11   41 o     87.2    9.9    0.0000   0.0000          ?        ?    76.6226  17.2401          ?        ?       87.2        9.9       ?       ? 
1 1 1   43   11   42 o    327.5    2.9    0.0000   0.0000          ?        ?  1073.3549  19.1556          ?        ?      327.5        2.9       ?       ? 
1 1 1   43   11   43 o    305.6    3.1    0.0000   0.0000          ?        ?   934.7956  19.1556          ?        ?      305.6        3.1       ?       ? 
1 1 1   43   11   44 o    176.3    5.1    0.0000   0.0000          ?        ?   311.5985  17.8786          ?        ?      176.3        5.1       ?       ? 
1 1 1   43   11   45 o     85.6   10.4    0.0000   0.0000          ?        ?    74.0685  17.8786          ?        ?       85.6       10.4       ?       ? 
1 1 1   43   11   46 o    301.7    3.2    0.0000   0.0000          ?        ?   911.1703  19.1556          ?        ?      301.7        3.2       ?       ? 
1 1 1   43   11   47 o    122.1    7.3    0.0000   0.0000          ?        ?   150.0526  17.8786          ?        ?      122.1        7.3       ?       ? 
1 1 1   43   11   48 o     62.9   14.5    0.0000   0.0000          ?        ?    42.1424  17.8786          ?        ?       62.9       14.5       ?       ? 
1 1 1   43   11   49 o    145.6    6.6    0.0000   0.0000          ?        ?   213.2662  19.1556          ?        ?      145.6        6.6       ?       ? 
1 1 1   43   11   50 o    204.6    4.4    0.0000   0.0000          ?        ?   419.5087  17.8786          ?        ?      204.6        4.4       ?       ? 
1 1 1   43   11   51 o    184.0    5.0    0.0000   0.0000          ?        ?   339.6935  18.5171          ?        ?      184.0        5.0       ?       ? 
1 1 1   43   11   52 o    155.9    5.9    0.0000   0.0000          ?        ?   244.5538  18.5171          ?        ?      155.9        5.9       ?       ? 
1 1 1   43   11   53 f    198.1    5.0    0.0000   0.0000          ?        ?   393.9678  19.7942          ?        ?      198.1        5.0       ?       ? 
1 1 1   43   11   54 o    112.8    8.2    0.0000   0.0000          ?        ?   128.9814  18.5171          ?        ?      112.8        8.2       ?       ? 
1 1 1   43   11   55 o    193.6    4.8    0.0000   0.0000          ?        ?   376.7278  18.5171          ?        ?      193.6        4.8       ?       ? 
1 1 1   43   12    0 o    570.9    3.9 3260.2915  44.0580  3260.2915  44.0580  3260.2915  44.0580      570.9      3.9      570.9        3.9     0.0     0.0 
1 1 1   43   12    1 o    180.8    2.8    0.0000   0.0000          ?        ?   326.9231  10.2163          ?        ?      180.8        2.8       ?       ? 
1 1 1   43   12    2 o    223.1    2.7    0.0000   0.0000          ?        ?   498.0469  12.1319          ?        ?      223.1        2.7       ?       ? 
1 1 1   43   12    3 o    154.5    3.1    0.0000   0.0000          ?        ?   238.8071   9.5778          ?        ?      154.5        3.1       ?       ? 
1 1 1   43   12    4 o    343.8    2.4    0.0000   0.0000          ?        ?  1182.5420  16.6016          ?        ?      343.8        2.4       ?       ? 
1 1 1   43   12    5 o    233.5    2.6    0.0000   0.0000          ?        ?   545.2975  12.1319          ?        ?      233.5        2.6       ?       ? 
1 1 1   43   12    6 o    393.2    2.4    0.0000   0.0000          ?        ?  1546.4994  19.1556          ?        ?      393.2        2.4       ?       ? 
1 1 1   43   12    7 o    308.9    2.4    0.0000   0.0000          ?        ?   954.5898  14.6860          ?        ?      308.9        2.4       ?       ? 
1 1 1   43   12    8 o    152.0    3.8    0.0000   0.0000          ?        ?   231.1448  11.4934          ?        ?      152.0        3.8       ?       ? 
1 1 1   43   12    9 o     27.1   11.3    0.0000   0.0000          ?        ?     1.2770  10.2163          ?        ?       27.1       11.3       ?       ? 
1 1 1   43   12   10 o    164.3    3.5    0.0000   0.0000          ?        ?   270.0946  11.4934          ?        ?      164.3        3.5       ?       ? 
1 1 1   43   12   11 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43   12   12 o    268.7    2.6    0.0000   0.0000          ?        ?   722.1680  14.0475          ?        ?      268.7        2.6       ?       ? 
1 1 1   43   12   13 o    274.5    2.4    0.0000   0.0000          ?        ?   753.4555  13.4090          ?        ?      274.5        2.4       ?       ? 
1 1 1   43   12   14 o    210.3    2.9    0.0000   0.0000          ?        ?   442.4955  12.1319          ?        ?      210.3        2.9       ?       ? 
1 1 1   43   12   15 o    286.3    2.7    0.0000   0.0000          ?        ?   819.8618  15.3245          ?        ?      286.3        2.7       ?       ? 
1 1 1   43   12   16 o    353.4    2.4    0.0000   0.0000          ?        ?  1248.9484  17.2401          ?        ?      353.4        2.4       ?       ? 
1 1 1   43   12   17 o     41.9   13.5    0.0000   0.0000          ?        ?    17.2401  12.7704          ?        ?       41.9       13.5       ?       ? 
1 1 1   43   12   18 o    104.7    5.8    0.0000   0.0000          ?        ?   109.8257  12.1319          ?        ?      104.7        5.8       ?       ? 
1 1 1   43   12   19 o    300.4    2.8    0.0000   0.0000          ?        ?   902.8696  16.6016          ?        ?      300.4        2.8       ?       ? 
1 1 1   43   12   20 o    707.0    3.1    0.0000   0.0000          ?        ?  5000.9014  43.4195          ?        ?      707.0        3.1       ?       ? 
1 1 1   43   12   21 o    314.9    2.7    0.0000   0.0000          ?        ?   992.2626  17.2401          ?        ?      314.9        2.7       ?       ? 
1 1 1   43   12   22 o     25.7   11.6    0.0000   0.0000          ?        ?    -7.0237  12.7704          ?        ?       25.7       11.6       ?       ? 
1 1 1   43   12   23 o     17.2    8.6    0.0000   0.0000          ?        ?   -41.5039  13.4090          ?        ?       17.2        8.6       ?       ? 
1 1 1   43   12   24 o     17.0    8.6    0.0000   0.0000          ?        ?   -42.7809  13.4090          ?        ?       17.0        8.6       ?       ? 
1 1 1   43   12   25 o    237.8    3.2    0.0000   0.0000          ?        ?   565.7302  15.3245          ?        ?      237.8        3.2       ?       ? 
1 1 1   43   12   26 o    320.6    2.6    0.0000   0.0000          ?        ?  1028.0198  16.6016          ?        ?      320.6        2.6       ?       ? 
1 1 1   43   12   27 o    300.3    2.7    0.0000   0.0000          ?        ?   902.2311  15.9630          ?        ?      300.3        2.7       ?       ? 
1 1 1   43   12   28 o    248.2    3.0    0.0000   0.0000          ?        ?   616.1733  14.6860          ?        ?      248.2        3.0       ?       ? 
1 1 1   43   12   29 o    234.8    3.1    0.0000   0.0000          ?        ?   551.6827  14.6860          ?        ?      234.8        3.1       ?       ? 
1 1 1   43   12   30 f     99.7    7.0    0.0000   0.0000          ?        ?    99.6094  14.0475          ?        ?       99.7        7.0       ?       ? 
1 1 1   43   12   31 o    380.2    2.6    0.0000   0.0000          ?        ?  1446.2515  19.7942          ?        ?      380.2        2.6       ?       ? 
1 1 1   43   12   32 o    137.1    5.4    0.0000   0.0000          ?        ?   188.3639  14.6860          ?        ?      137.1        5.4       ?       ? 
1 1 1   43   12   33 o    147.7    5.0    0.0000   0.0000          ?        ?   218.3744  14.6860          ?        ?      147.7        5.0       ?       ? 
1 1 1   43   12   34 o    352.3    2.8    0.0000   0.0000          ?        ?  1241.9246  19.7942          ?        ?      352.3        2.8       ?       ? 
1 1 1   43   12   35 o    225.2    3.7    0.0000   0.0000          ?        ?   507.6247  16.6016          ?        ?      225.2        3.7       ?       ? 
1 1 1   43   12   36 o    363.3    2.9    0.0000   0.0000          ?        ?  1320.4628  21.0712          ?        ?      363.3        2.9       ?       ? 
1 1 1   43   12   37 o    203.0    4.1    0.0000   0.0000          ?        ?   412.4850  16.6016          ?        ?      203.0        4.1       ?       ? 
1 1 1   43   12   38 o    279.1    3.0    0.0000   0.0000          ?        ?   779.6349  16.6016          ?        ?      279.1        3.0       ?       ? 
1 1 1   43   12   39 o    116.1    6.9    0.0000   0.0000          ?        ?   135.3666  15.9630          ?        ?      116.1        6.9       ?       ? 
1 1 1   43   12   40 o    239.2    3.6    0.0000   0.0000          ?        ?   572.7539  17.2401          ?        ?      239.2        3.6       ?       ? 
1 1 1   43   12   41 o    215.9    4.0    0.0000   0.0000          ?        ?   466.7593  17.2401          ?        ?      215.9        4.0       ?       ? 
1 1 1   43   12   42 o     63.1   14.0    0.0000   0.0000          ?        ?    42.1424  17.2401          ?        ?       63.1       14.0       ?       ? 
1 1 1   43   12   43 o    378.3    2.9    0.0000   0.0000          ?        ?  1432.2040  21.7097          ?        ?      378.3        2.9       ?       ? 
1 1 1   43   12   44 o    372.9    2.9    0.0000   0.0000          ?        ?  1391.9772  21.7097          ?        ?      372.9        2.9       ?       ? 
1 1 1   43   12   45 o     65.6   13.1    0.0000   0.0000          ?        ?    45.3350  16.6016          ?        ?       65.6       13.1       ?       ? 
1 1 1   43   12   46 o     32.5   14.2    0.0000   0.0000          ?        ?    -2.5541  17.2401          ?        ?       32.5       14.2       ?       ? 
1 1 1   43   12   47 o    264.9    3.5    0.0000   0.0000          ?        ?   703.0123  18.5171          ?        ?      264.9        3.5       ?       ? 
1 1 1   43   12   48 o    193.3    4.8    0.0000   0.0000          ?        ?   374.8122  18.5171          ?        ?      193.3        4.8       ?       ? 
1 1 1   43   12   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43   12   50 o    109.4    7.9    0.0000   0.0000          ?        ?   120.6806  17.2401          ?        ?      109.4        7.9       ?       ? 
1 1 1   43   12   51 o     21.3   10.6    0.0000   0.0000          ?        ?   -44.6965  17.8786          ?        ?       21.3       10.6       ?       ? 
1 1 1   43   12   52 o    124.5    7.2    0.0000   0.0000          ?        ?   156.4378  17.8786          ?        ?      124.5        7.2       ?       ? 
1 1 1   43   12   53 o    119.2    7.8    0.0000   0.0000          ?        ?   143.6674  18.5171          ?        ?      119.2        7.8       ?       ? 
1 1 1   43   12   54 o     98.9    9.4    0.0000   0.0000          ?        ?    99.6094  18.5171          ?        ?       98.9        9.4       ?       ? 
1 1 1   43   13    0 o     47.4   14.7   28.0950  12.1319    28.0950  12.1319    28.0950  12.1319       47.4     14.7       47.4       14.7     0.0     0.0 
1 1 1   43   13    1 o    408.3    2.4    0.0000   0.0000          ?        ?  1667.8186  19.7942          ?        ?      408.3        2.4       ?       ? 
1 1 1   43   13    2 o     92.1    4.9    0.0000   0.0000          ?        ?    84.9234   8.9393          ?        ?       92.1        4.9       ?       ? 
1 1 1   43   13    3 o    325.4    2.5    0.0000   0.0000          ?        ?  1059.3074  15.9630          ?        ?      325.4        2.5       ?       ? 
1 1 1   43   13    4 o    171.0    2.8    0.0000   0.0000          ?        ?   292.4429   9.5778          ?        ?      171.0        2.8       ?       ? 
1 1 1   43   13    5 o    337.1    2.4    0.0000   0.0000          ?        ?  1136.5685  15.9630          ?        ?      337.1        2.4       ?       ? 
1 1 1   43   13    6 o    297.5    2.5    0.0000   0.0000          ?        ?   884.9910  14.6860          ?        ?      297.5        2.5       ?       ? 
1 1 1   43   13    7 o    176.7    3.1    0.0000   0.0000          ?        ?   312.2371  10.8549          ?        ?      176.7        3.1       ?       ? 
1 1 1   43   13    8 o    173.4    2.9    0.0000   0.0000          ?        ?   300.7437  10.2163          ?        ?      173.4        2.9       ?       ? 
1 1 1   43   13    9 o    268.9    2.4    0.0000   0.0000          ?        ?   723.4450  12.7704          ?        ?      268.9        2.4       ?       ? 
1 1 1   43   13   10 o    357.6    2.4    0.0000   0.0000          ?        ?  1278.9589  17.2401          ?        ?      357.6        2.4       ?       ? 
1 1 1   43   13   11 o    202.9    3.0    0.0000   0.0000          ?        ?   411.8464  12.1319          ?        ?      202.9        3.0       ?       ? 
1 1 1   43   13   12 o    180.9    3.4    0.0000   0.0000          ?        ?   327.5616  12.1319          ?        ?      180.9        3.4       ?       ? 
1 1 1   43   13   13 o    367.8    2.4    0.0000   0.0000          ?        ?  1353.0273  17.8786          ?        ?      367.8        2.4       ?       ? 
1 1 1   43   13   14 o    477.5    2.6    0.0000   0.0000          ?        ?  2280.7993  24.9023          ?        ?      477.5        2.6       ?       ? 
1 1 1   43   13   15 f    126.0    4.6    0.0000   0.0000          ?        ?   158.9919  11.4934          ?        ?      126.0        4.6       ?       ? 
1 1 1   43   13   16 o    207.6    3.2    0.0000   0.0000          ?        ?   431.0021  13.4090          ?        ?      207.6        3.2       ?       ? 
1 1 1   43   13   17 o    335.7    2.6    0.0000   0.0000          ?        ?  1126.9907  17.2401          ?        ?      335.7        2.6       ?       ? 
1 1 1   43   13   18 o    420.6    2.6    0.0000   0.0000          ?        ?  1769.3435  21.7097          ?        ?      420.6        2.6       ?       ? 
1 1 1   43   13   19 o    176.1    3.8    0.0000   0.0000          ?        ?   310.3215  13.4090          ?        ?      176.1        3.8       ?       ? 
1 1 1   43   13   20 o     90.3    7.1    0.0000   0.0000          ?        ?    81.7308  12.7704          ?        ?       90.3        7.1       ?       ? 
1 1 1   43   13   21 o    138.3    4.8    0.0000   0.0000          ?        ?   191.5565  13.4090          ?        ?      138.3        4.8       ?       ? 
1 1 1   43   13   22 o     20.8   10.1    0.0000   0.0000          ?        ?   -23.6253  13.4090          ?        ?       20.8       10.1       ?       ? 
1 1 1   43   13   23 o    134.3    5.0    0.0000   0.0000          ?        ?   180.7016  13.4090          ?        ?      134.3        5.0       ?       ? 
1 1 1   43   13   24 o    291.9    2.7    0.0000   0.0000          ?        ?   852.4264  15.9630          ?        ?      291.9        2.7       ?       ? 
1 1 1   43   13   25 o    295.6    2.8    0.0000   0.0000          ?        ?   874.1360  16.6016          ?        ?      295.6        2.8       ?       ? 
1 1 1   43   13   26 o    302.4    2.6    0.0000   0.0000          ?        ?   915.0015  15.9630          ?        ?      302.4        2.6       ?       ? 
1 1 1   43   13   27 o    157.3    4.5    0.0000   0.0000          ?        ?   247.7464  14.0475          ?        ?      157.3        4.5       ?       ? 
1 1 1   43   13   28 o     61.2   11.4    0.0000   0.0000          ?        ?    38.9498  13.4090          ?        ?       61.2       11.4       ?       ? 
1 1 1   43   13   29 o    237.4    3.2    0.0000   0.0000          ?        ?   563.8146  15.3245          ?        ?      237.4        3.2       ?       ? 
1 1 1   43   13   30 o    170.0    4.3    0.0000   0.0000          ?        ?   289.2503  14.6860          ?        ?      170.0        4.3       ?       ? 
1 1 1   43   13   31 o    258.8    3.2    0.0000   0.0000          ?        ?   670.4477  16.6016          ?        ?      258.8        3.2       ?       ? 
1 1 1   43   13   32 o    115.7    6.3    0.0000   0.0000          ?        ?   134.0895  14.6860          ?        ?      115.7        6.3       ?       ? 
1 1 1   43   13   33 o    451.6    2.6    0.0000   0.0000          ?        ?  2040.7152  23.6253          ?        ?      451.6        2.6       ?       ? 
1 1 1   43   13   34 o    149.1    5.4    0.0000   0.0000          ?        ?   222.8441  15.9630          ?        ?      149.1        5.4       ?       ? 
1 1 1   43   13   35 o    306.7    2.7    0.0000   0.0000          ?        ?   941.1808  16.6016          ?        ?      306.7        2.7       ?       ? 
1 1 1   43   13   36 o    295.7    3.1    0.0000   0.0000          ?        ?   874.7747  18.5171          ?        ?      295.7        3.1       ?       ? 
1 1 1   43   13   37 o    210.1    4.1    0.0000   0.0000          ?        ?   441.8569  17.2401          ?        ?      210.1        4.1       ?       ? 
1 1 1   43   13   38 o    126.4    6.3    0.0000   0.0000          ?        ?   160.2689  15.9630          ?        ?      126.4        6.3       ?       ? 
1 1 1   43   13   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43   13   40 o     76.3   10.5    0.0000   0.0000          ?        ?    58.7440  15.9630          ?        ?       76.3       10.5       ?       ? 
1 1 1   43   13   41 o    111.6    7.4    0.0000   0.0000          ?        ?   125.1502  16.6016          ?        ?      111.6        7.4       ?       ? 
1 1 1   43   13   42 o    155.5    5.5    0.0000   0.0000          ?        ?   242.6382  17.2401          ?        ?      155.5        5.5       ?       ? 
1 1 1   43   13   43 o     21.5   10.7    0.0000   0.0000          ?        ?   -40.2269  17.2401          ?        ?       21.5       10.7       ?       ? 
1 1 1   43   13   44 o    141.1    6.1    0.0000   0.0000          ?        ?   199.8573  17.2401          ?        ?      141.1        6.1       ?       ? 
1 1 1   43   13   45 o     76.5   11.7    0.0000   0.0000          ?        ?    59.3825  17.8786          ?        ?       76.5       11.7       ?       ? 
1 1 1   43   13   46 o    238.4    3.9    0.0000   0.0000          ?        ?   569.5613  18.5171          ?        ?      238.4        3.9       ?       ? 
1 1 1   43   13   47 o    138.9    6.7    0.0000   0.0000          ?        ?   194.1106  18.5171          ?        ?      138.9        6.7       ?       ? 
1 1 1   43   13   48 o     78.8   11.3    0.0000   0.0000          ?        ?    63.2136  17.8786          ?        ?       78.8       11.3       ?       ? 
1 1 1   43   13   49 o    105.2    8.2    0.0000   0.0000          ?        ?   111.7413  17.2401          ?        ?      105.2        8.2       ?       ? 
1 1 1   43   13   50 o    203.4    4.6    0.0000   0.0000          ?        ?   415.0391  18.5171          ?        ?      203.4        4.6       ?       ? 
1 1 1   43   13   51 o     38.6   15.2    0.0000   0.0000          ?        ?     9.5778  17.2401          ?        ?       38.6       15.2       ?       ? 
1 1 1   43   13   52 f    134.1    6.7    0.0000   0.0000          ?        ?   181.3401  17.8786          ?        ?      134.1        6.7       ?       ? 
1 1 1   43   13   53 o    278.2    3.6    0.0000   0.0000          ?        ?   775.8038  19.7942          ?        ?      278.2        3.6       ?       ? 
1 1 1   43   14    0 o    170.7    5.8  292.4429  19.7942   292.4429  19.7942   292.4429  19.7942      170.7      5.8      170.7        5.8     0.0     0.0 
1 1 1   43   14    1 o    289.9    3.0    0.0000   0.0000          ?        ?   840.9330  17.2401          ?        ?      289.9        3.0       ?       ? 
1 1 1   43   14    2 o    492.3    2.7    0.0000   0.0000          ?        ?  2424.4668  26.1794          ?        ?      492.3        2.7       ?       ? 
1 1 1   43   14    3 o    233.3    2.9    0.0000   0.0000          ?        ?   544.6590  13.4090          ?        ?      233.3        2.9       ?       ? 
1 1 1   43   14    4 o    117.7    4.3    0.0000   0.0000          ?        ?   138.5592  10.2163          ?        ?      117.7        4.3       ?       ? 
1 1 1   43   14    5 o    415.2    2.7    0.0000   0.0000          ?        ?  1724.0084  22.3483          ?        ?      415.2        2.7       ?       ? 
1 1 1   43   14    6 o    232.2    2.9    0.0000   0.0000          ?        ?   539.5508  13.4090          ?        ?      232.2        2.9       ?       ? 
1 1 1   43   14    7 o    286.9    2.6    0.0000   0.0000          ?        ?   823.0543  14.6860          ?        ?      286.9        2.6       ?       ? 
1 1 1   43   14    8 o    105.1    4.6    0.0000   0.0000          ?        ?   110.4642   9.5778          ?        ?      105.1        4.6       ?       ? 
1 1 1   43   14    9 o    322.0    2.4    0.0000   0.0000          ?        ?  1036.9591  15.3245          ?        ?      322.0        2.4       ?       ? 
1 1 1   43   14   10 o    315.2    2.4    0.0000   0.0000          ?        ?   993.5397  15.3245          ?        ?      315.2        2.4       ?       ? 
1 1 1   43   14   11 o    162.9    3.3    0.0000   0.0000          ?        ?   265.6250  10.8549          ?        ?      162.9        3.3       ?       ? 
1 1 1   43   14   12 o    209.6    2.7    0.0000   0.0000          ?        ?   439.3029  11.4934          ?        ?      209.6        2.7       ?       ? 
1 1 1   43   14   13 o    430.7    2.7    0.0000   0.0000          ?        ?  1855.5439  22.9868          ?        ?      430.7        2.7       ?       ? 
1 1 1   43   14   14 o    153.9    3.7    0.0000   0.0000          ?        ?   236.8915  11.4934          ?        ?      153.9        3.7       ?       ? 
1 1 1   43   14   15 o    467.1    2.7    0.0000   0.0000          ?        ?  2182.4668  24.9023          ?        ?      467.1        2.7       ?       ? 
1 1 1   43   14   16 o    206.8    3.2    0.0000   0.0000          ?        ?   427.8095  13.4090          ?        ?      206.8        3.2       ?       ? 
1 1 1   43   14   17 o    259.9    2.8    0.0000   0.0000          ?        ?   675.5559  14.6860          ?        ?      259.9        2.8       ?       ? 
1 1 1   43   14   18 o    320.8    2.5    0.0000   0.0000          ?        ?  1029.2969  15.9630          ?        ?      320.8        2.5       ?       ? 
1 1 1   43   14   19 o    403.2    2.4    0.0000   0.0000          ?        ?  1626.3146  19.1556          ?        ?      403.2        2.4       ?       ? 
1 1 1   43   14   20 o    237.8    3.1    0.0000   0.0000          ?        ?   565.7302  14.6860          ?        ?      237.8        3.1       ?       ? 
1 1 1   43   14   21 o    397.3    2.5    0.0000   0.0000          ?        ?  1579.0640  19.7942          ?        ?      397.3        2.5       ?       ? 
1 1 1   43   14   22 o    208.0    3.2    0.0000   0.0000          ?        ?   432.9177  13.4090          ?        ?      208.0        3.2       ?       ? 
1 1 1   43   14   23 o    221.2    3.5    0.0000   0.0000          ?        ?   489.7461  15.3245          ?        ?      221.2        3.5       ?       ? 
1 1 1   43   14   24 o    103.8    6.5    0.0000   0.0000          ?        ?   107.9102  13.4090          ?        ?      103.8        6.5       ?       ? 
1 1 1   43   14   25 o    206.5    3.4    0.0000   0.0000          ?        ?   426.5325  14.0475          ?        ?      206.5        3.4       ?       ? 
1 1 1   43   14   26 o     46.2   14.0    0.0000   0.0000          ?        ?    21.7097  14.0475          ?        ?       46.2       14.0       ?       ? 
1 1 1   43   14   27 o    108.9    6.2    0.0000   0.0000          ?        ?   118.7650  13.4090          ?        ?      108.9        6.2       ?       ? 
1 1 1   43   14   28 o    143.5    4.9    0.0000   0.0000          ?        ?   206.2425  14.0475          ?        ?      143.5        4.9       ?       ? 
1 1 1   43   14   29 o    407.1    2.5    0.0000   0.0000          ?        ?  1658.2407  20.4327          ?        ?      407.1        2.5       ?       ? 
1 1 1   43   14   30 o    230.8    3.5    0.0000   0.0000          ?        ?   533.1656  15.9630          ?        ?      230.8        3.5       ?       ? 
1 1 1   43   14   31 o    271.0    2.9    0.0000   0.0000          ?        ?   734.9384  15.9630          ?        ?      271.0        2.9       ?       ? 
1 1 1   43   14   32 o     65.2   10.8    0.0000   0.0000          ?        ?    42.7809  14.0475          ?        ?       65.2       10.8       ?       ? 
1 1 1   43   14   33 f    293.6    2.9    0.0000   0.0000          ?        ?   862.6428  17.2401          ?        ?      293.6        2.9       ?       ? 
1 1 1   43   14   34 o    219.7    3.8    0.0000   0.0000          ?        ?   483.3608  16.6016          ?        ?      219.7        3.8       ?       ? 
1 1 1   43   14   35 o    428.3    2.7    0.0000   0.0000          ?        ?  1835.7496  22.9868          ?        ?      428.3        2.7       ?       ? 
1 1 1   43   14   36 o    358.1    2.8    0.0000   0.0000          ?        ?  1282.7899  19.7942          ?        ?      358.1        2.8       ?       ? 
1 1 1   43   14   37 o    470.9    2.6    0.0000   0.0000          ?        ?  2218.8625  24.9023          ?        ?      470.9        2.6       ?       ? 
1 1 1   43   14   38 o     86.1    9.3    0.0000   0.0000          ?        ?    74.7070  15.9630          ?        ?       86.1        9.3       ?       ? 
1 1 1   43   14   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43   14   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43   14   41 o    198.0    4.4    0.0000   0.0000          ?        ?   392.6908  17.2401          ?        ?      198.0        4.4       ?       ? 
1 1 1   43   14   42 f    169.8    5.1    0.0000   0.0000          ?        ?   289.2503  17.2401          ?        ?      169.8        5.1       ?       ? 
1 1 1   43   14   43 o     75.3   11.5    0.0000   0.0000          ?        ?    57.4669  17.2401          ?        ?       75.3       11.5       ?       ? 
1 1 1   43   14   44 o    142.9    5.8    0.0000   0.0000          ?        ?   204.9654  16.6016          ?        ?      142.9        5.8       ?       ? 
1 1 1   43   14   45 o    367.6    2.9    0.0000   0.0000          ?        ?  1352.3888  21.0712          ?        ?      367.6        2.9       ?       ? 
1 1 1   43   14   46 o    131.6    6.8    0.0000   0.0000          ?        ?   174.3164  17.8786          ?        ?      131.6        6.8       ?       ? 
1 1 1   43   14   47 o    229.6    3.9    0.0000   0.0000          ?        ?   528.0574  17.8786          ?        ?      229.6        3.9       ?       ? 
1 1 1   43   14   48 f    158.6    5.6    0.0000   0.0000          ?        ?   252.8546  17.8786          ?        ?      158.6        5.6       ?       ? 
1 1 1   43   14   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43   14   50 o     20.2   10.1    0.0000   0.0000          ?        ?   -47.2506  17.2401          ?        ?       20.2       10.1       ?       ? 
1 1 1   43   14   51 o    146.9    5.9    0.0000   0.0000          ?        ?   217.0974  17.2401          ?        ?      146.9        5.9       ?       ? 
1 1 1   43   14   52 o    100.0    8.6    0.0000   0.0000          ?        ?   101.5249  17.2401          ?        ?      100.0        8.6       ?       ? 
1 1 1   43   15    0 o     18.4   13.1  -22.3483  19.1556   -22.3483  19.1556   -22.3483  19.1556       18.4     13.1       18.4       13.1     0.0     0.0 
1 1 1   43   15    1 o    126.5    5.6    0.0000   0.0000          ?        ?   160.2689  14.0475          ?        ?      126.5        5.6       ?       ? 
1 1 1   43   15    2 o    384.8    3.1    0.0000   0.0000          ?        ?  1481.3701  23.6253          ?        ?      384.8        3.1       ?       ? 
1 1 1   43   15    3 o    246.5    3.2    0.0000   0.0000          ?        ?   607.8726  15.9630          ?        ?      246.5        3.2       ?       ? 
1 1 1   43   15    4 o    411.2    3.0    0.0000   0.0000          ?        ?  1691.4437  24.9023          ?        ?      411.2        3.0       ?       ? 
1 1 1   43   15    5 o    207.1    3.2    0.0000   0.0000          ?        ?   429.0865  13.4090          ?        ?      207.1        3.2       ?       ? 
1 1 1   43   15    6 o    369.1    2.8    0.0000   0.0000          ?        ?  1362.6051  20.4327          ?        ?      369.1        2.8       ?       ? 
1 1 1   43   15    7 o    162.7    3.7    0.0000   0.0000          ?        ?   264.9865  12.1319          ?        ?      162.7        3.7       ?       ? 
1 1 1   43   15    8 o    441.5    2.7    0.0000   0.0000          ?        ?  1949.4065  23.6253          ?        ?      441.5        2.7       ?       ? 
1 1 1   43   15    9 o    263.3    2.9    0.0000   0.0000          ?        ?   693.4344  15.3245          ?        ?      263.3        2.9       ?       ? 
1 1 1   43   15   10 o    214.2    2.8    0.0000   0.0000          ?        ?   459.0970  12.1319          ?        ?      214.2        2.8       ?       ? 
1 1 1   43   15   11 o    287.6    2.8    0.0000   0.0000          ?        ?   827.5240  15.9630          ?        ?      287.6        2.8       ?       ? 
1 1 1   43   15   12 o    107.1    5.1    0.0000   0.0000          ?        ?   114.9339  10.8549          ?        ?      107.1        5.1       ?       ? 
1 1 1   43   15   13 o    324.6    2.5    0.0000   0.0000          ?        ?  1054.1992  15.9630          ?        ?      324.6        2.5       ?       ? 
1 1 1   43   15   14 o    174.8    3.3    0.0000   0.0000          ?        ?   305.8519  11.4934          ?        ?      174.8        3.3       ?       ? 
1 1 1   43   15   15 o    162.7    3.5    0.0000   0.0000          ?        ?   264.9865  11.4934          ?        ?      162.7        3.5       ?       ? 
1 1 1   43   15   16 o    411.7    2.6    0.0000   0.0000          ?        ?  1695.2749  21.0712          ?        ?      411.7        2.6       ?       ? 
1 1 1   43   15   17 o    219.7    3.1    0.0000   0.0000          ?        ?   482.7224  13.4090          ?        ?      219.7        3.1       ?       ? 
1 1 1   43   15   18 o    278.9    2.7    0.0000   0.0000          ?        ?   778.3578  15.3245          ?        ?      278.9        2.7       ?       ? 
1 1 1   43   15   19 o    135.1    4.7    0.0000   0.0000          ?        ?   182.6172  12.7704          ?        ?      135.1        4.7       ?       ? 
1 1 1   43   15   20 o    236.7    3.1    0.0000   0.0000          ?        ?   560.6220  14.6860          ?        ?      236.7        3.1       ?       ? 
1 1 1   43   15   21 o    235.2    3.1    0.0000   0.0000          ?        ?   553.5982  14.6860          ?        ?      235.2        3.1       ?       ? 
1 1 1   43   15   22 o    183.5    3.7    0.0000   0.0000          ?        ?   337.1394  13.4090          ?        ?      183.5        3.7       ?       ? 
1 1 1   43   15   23 o    517.0    2.6    0.0000   0.0000          ?        ?  2673.4902  26.8179          ?        ?      517.0        2.6       ?       ? 
1 1 1   43   15   24 o    147.3    4.6    0.0000   0.0000          ?        ?   217.0974  13.4090          ?        ?      147.3        4.6       ?       ? 
1 1 1   43   15   25 o     82.1    7.8    0.0000   0.0000          ?        ?    67.6833  12.7704          ?        ?       82.1        7.8       ?       ? 
1 1 1   43   15   26 o    297.5    2.8    0.0000   0.0000          ?        ?   885.6295  16.6016          ?        ?      297.5        2.8       ?       ? 
1 1 1   43   15   27 o    488.0    2.7    0.0000   0.0000          ?        ?  2382.9629  26.1794          ?        ?      488.0        2.7       ?       ? 
1 1 1   43   15   28 o    299.0    2.9    0.0000   0.0000          ?        ?   894.5688  17.2401          ?        ?      299.0        2.9       ?       ? 
1 1 1   43   15   29 o    412.2    2.6    0.0000   0.0000          ?        ?  1699.7446  21.0712          ?        ?      412.2        2.6       ?       ? 
1 1 1   43   15   30 o     28.0   12.6    0.0000   0.0000          ?        ?    -7.0237  14.6860          ?        ?       28.0       12.6       ?       ? 
1 1 1   43   15   31 o    121.0    5.8    0.0000   0.0000          ?        ?   146.8600  14.0475          ?        ?      121.0        5.8       ?       ? 
1 1 1   43   15   32 o    252.7    3.2    0.0000   0.0000          ?        ?   639.1602  15.9630          ?        ?      252.7        3.2       ?       ? 
1 1 1   43   15   33 o    176.8    4.3    0.0000   0.0000          ?        ?   312.8756  15.3245          ?        ?      176.8        4.3       ?       ? 
1 1 1   43   15   34 o     97.0    7.9    0.0000   0.0000          ?        ?    94.5012  15.3245          ?        ?       97.0        7.9       ?       ? 
1 1 1   43   15   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43   15   36 o    118.6    6.7    0.0000   0.0000          ?        ?   141.1133  15.9630          ?        ?      118.6        6.7       ?       ? 
1 1 1   43   15   37 o     56.6   14.6    0.0000   0.0000          ?        ?    33.8416  16.6016          ?        ?       56.6       14.6       ?       ? 
1 1 1   43   15   38 o    227.8    3.8    0.0000   0.0000          ?        ?   519.7566  17.2401          ?        ?      227.8        3.8       ?       ? 
1 1 1   43   15   39 o    111.0    7.5    0.0000   0.0000          ?        ?   123.8732  16.6016          ?        ?      111.0        7.5       ?       ? 
1 1 1   43   15   40 o    213.8    4.0    0.0000   0.0000          ?        ?   457.8200  17.2401          ?        ?      213.8        4.0       ?       ? 
1 1 1   43   15   41 o     78.2   11.0    0.0000   0.0000          ?        ?    61.9366  17.2401          ?        ?       78.2       11.0       ?       ? 
1 1 1   43   15   42 o     99.4    8.7    0.0000   0.0000          ?        ?    99.6094  17.2401          ?        ?       99.4        8.7       ?       ? 
1 1 1   43   15   43 o    184.2    4.9    0.0000   0.0000          ?        ?   340.3320  17.8786          ?        ?      184.2        4.9       ?       ? 
1 1 1   43   15   44 o    463.8    2.7    0.0000   0.0000          ?        ?  2153.0950  24.9023          ?        ?      463.8        2.7       ?       ? 
1 1 1   43   15   45 o    134.8    6.4    0.0000   0.0000          ?        ?   182.6172  17.2401          ?        ?      134.8        6.4       ?       ? 
1 1 1   43   15   46 o     97.0    8.9    0.0000   0.0000          ?        ?    95.1397  17.2401          ?        ?       97.0        8.9       ?       ? 
1 1 1   43   15   47 o     19.3    9.7    0.0000   0.0000          ?        ?   -53.6358  17.2401          ?        ?       19.3        9.7       ?       ? 
1 1 1   43   15   48 o    321.6    3.2    0.0000   0.0000          ?        ?  1035.6820  20.4327          ?        ?      321.6        3.2       ?       ? 
1 1 1   43   15   49 o    123.7    7.2    0.0000   0.0000          ?        ?   154.5222  17.8786          ?        ?      123.7        7.2       ?       ? 
1 1 1   43   15   50 o     52.4   15.0    0.0000   0.0000          ?        ?    29.3720  16.6016          ?        ?       52.4       15.0       ?       ? 
1 1 1   43   15   51 f     29.3   13.4    0.0000   0.0000          ?        ?   -11.4934  17.8786          ?        ?       29.3       13.4       ?       ? 
1 1 1   43   16    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43   16    1 o     21.2   10.2    0.0000   0.0000          ?        ?   -22.3483  13.4090          ?        ?       21.2       10.2       ?       ? 
1 1 1   43   16    2 o     19.0    9.4    0.0000   0.0000          ?        ?   -31.2876  13.4090          ?        ?       19.0        9.4       ?       ? 
1 1 1   43   16    3 o    326.4    3.1    0.0000   0.0000          ?        ?  1065.6925  20.4327          ?        ?      326.4        3.1       ?       ? 
1 1 1   43   16    4 o    194.8    4.1    0.0000   0.0000          ?        ?   379.9204  15.9630          ?        ?      194.8        4.1       ?       ? 
1 1 1   43   16    5 f    272.2    3.4    0.0000   0.0000          ?        ?   741.3236  18.5171          ?        ?      272.2        3.4       ?       ? 
1 1 1   43   16    6 o     16.7    8.3    0.0000   0.0000          ?        ?   -23.6253  10.2163          ?        ?       16.7        8.3       ?       ? 
1 1 1   43   16    7 o    165.8    3.5    0.0000   0.0000          ?        ?   275.2028  11.4934          ?        ?      165.8        3.5       ?       ? 
1 1 1   43   16    8 o    226.7    3.1    0.0000   0.0000          ?        ?   514.0099  14.0475          ?        ?      226.7        3.1       ?       ? 
1 1 1   43   16    9 o     20.6    9.9    0.0000   0.0000          ?        ?   -15.9630  11.4934          ?        ?       20.6        9.9       ?       ? 
1 1 1   43   16   10 o    136.0    4.5    0.0000   0.0000          ?        ?   185.1713  12.1319          ?        ?      136.0        4.5       ?       ? 
1 1 1   43   16   11 o    277.9    3.0    0.0000   0.0000          ?        ?   772.6111  16.6016          ?        ?      277.9        3.0       ?       ? 
1 1 1   43   16   12 o    178.1    3.4    0.0000   0.0000          ?        ?   317.3452  12.1319          ?        ?      178.1        3.4       ?       ? 
1 1 1   43   16   13 o    271.9    2.9    0.0000   0.0000          ?        ?   739.4081  15.9630          ?        ?      271.9        2.9       ?       ? 
1 1 1   43   16   14 o     72.2    8.0    0.0000   0.0000          ?        ?    52.3588  11.4934          ?        ?       72.2        8.0       ?       ? 
1 1 1   43   16   15 o    134.6    4.0    0.0000   0.0000          ?        ?   181.3401  10.8549          ?        ?      134.6        4.0       ?       ? 
1 1 1   43   16   16 o    394.3    2.6    0.0000   0.0000          ?        ?  1555.4387  20.4327          ?        ?      394.3        2.6       ?       ? 
1 1 1   43   16   17 o    128.3    5.0    0.0000   0.0000          ?        ?   164.7386  12.7704          ?        ?      128.3        5.0       ?       ? 
1 1 1   43   16   18 f    221.7    3.5    0.0000   0.0000          ?        ?   491.6617  15.3245          ?        ?      221.7        3.5       ?       ? 
1 1 1   43   16   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43   16   20 o     86.3    7.0    0.0000   0.0000          ?        ?    74.7070  12.1319          ?        ?       86.3        7.0       ?       ? 
1 1 1   43   16   21 o    203.0    3.5    0.0000   0.0000          ?        ?   412.4850  14.0475          ?        ?      203.0        3.5       ?       ? 
1 1 1   43   16   22 o    185.4    3.6    0.0000   0.0000          ?        ?   344.1632  13.4090          ?        ?      185.4        3.6       ?       ? 
1 1 1   43   16   23 o    163.9    4.1    0.0000   0.0000          ?        ?   268.8176  13.4090          ?        ?      163.9        4.1       ?       ? 
1 1 1   43   16   24 o    190.2    3.5    0.0000   0.0000          ?        ?   362.0418  13.4090          ?        ?      190.2        3.5       ?       ? 
1 1 1   43   16   25 o     27.3   12.2    0.0000   0.0000          ?        ?    -5.1082  13.4090          ?        ?       27.3       12.2       ?       ? 
1 1 1   43   16   26 o    402.4    2.5    0.0000   0.0000          ?        ?  1619.9293  20.4327          ?        ?      402.4        2.5       ?       ? 
1 1 1   43   16   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43   16   28 o    118.1    6.2    0.0000   0.0000          ?        ?   139.8362  14.6860          ?        ?      118.1        6.2       ?       ? 
1 1 1   43   16   29 o    359.9    2.6    0.0000   0.0000          ?        ?  1296.1989  18.5171          ?        ?      359.9        2.6       ?       ? 
1 1 1   43   16   30 o    255.2    3.1    0.0000   0.0000          ?        ?   651.9305  15.9630          ?        ?      255.2        3.1       ?       ? 
1 1 1   43   16   31 o    123.6    5.9    0.0000   0.0000          ?        ?   153.2452  14.6860          ?        ?      123.6        5.9       ?       ? 
1 1 1   43   16   32 o     87.7    8.4    0.0000   0.0000          ?        ?    77.2611  14.6860          ?        ?       87.7        8.4       ?       ? 
1 1 1   43   16   33 o    100.8    7.6    0.0000   0.0000          ?        ?   102.1635  15.3245          ?        ?      100.8        7.6       ?       ? 
1 1 1   43   16   34 o     29.1   12.8    0.0000   0.0000          ?        ?    -4.4697  14.6860          ?        ?       29.1       12.8       ?       ? 
1 1 1   43   16   35 f    353.6    2.7    0.0000   0.0000          ?        ?  1250.8638  19.1556          ?        ?      353.6        2.7       ?       ? 
1 1 1   43   16   36 o    106.0    7.5    0.0000   0.0000          ?        ?   113.0183  15.9630          ?        ?      106.0        7.5       ?       ? 
1 1 1   43   16   37 o    299.7    3.0    0.0000   0.0000          ?        ?   899.0385  17.8786          ?        ?      299.7        3.0       ?       ? 
1 1 1   43   16   38 o    438.8    2.7    0.0000   0.0000          ?        ?  1926.4198  23.6253          ?        ?      438.8        2.7       ?       ? 
1 1 1   43   16   39 o    103.5    8.0    0.0000   0.0000          ?        ?   107.9102  16.6016          ?        ?      103.5        8.0       ?       ? 
1 1 1   43   16   40 o    247.0    3.5    0.0000   0.0000          ?        ?   611.0652  17.2401          ?        ?      247.0        3.5       ?       ? 
1 1 1   43   16   41 o    157.1    5.3    0.0000   0.0000          ?        ?   247.7464  16.6016          ?        ?      157.1        5.3       ?       ? 
1 1 1   43   16   42 o     43.1   15.0    0.0000   0.0000          ?        ?    17.2401  15.9630          ?        ?       43.1       15.0       ?       ? 
1 1 1   43   16   43 o    166.2    5.4    0.0000   0.0000          ?        ?   277.1184  17.8786          ?        ?      166.2        5.4       ?       ? 
1 1 1   43   16   44 o     40.8   15.4    0.0000   0.0000          ?        ?    12.7704  17.2401          ?        ?       40.8       15.4       ?       ? 
1 1 1   43   16   45 o     84.3   10.2    0.0000   0.0000          ?        ?    72.1529  17.2401          ?        ?       84.3       10.2       ?       ? 
1 1 1   43   16   46 f     94.2    9.5    0.0000   0.0000          ?        ?    90.0316  17.8786          ?        ?       94.2        9.5       ?       ? 
1 1 1   43   16   47 o    171.8    5.0    0.0000   0.0000          ?        ?   296.2740  17.2401          ?        ?      171.8        5.0       ?       ? 
1 1 1   43   16   48 o    132.5    6.5    0.0000   0.0000          ?        ?   176.8705  17.2401          ?        ?      132.5        6.5       ?       ? 
1 1 1   43   16   49 o     70.6   13.2    0.0000   0.0000          ?        ?    52.9973  17.8786          ?        ?       70.6       13.2       ?       ? 
1 1 1   43   16   50 o     35.8   15.0    0.0000   0.0000          ?        ?     3.8311  17.8786          ?        ?       35.8       15.0       ?       ? 
1 1 1   43   17    0 o    169.9    5.8  289.8888  19.7942   289.8888  19.7942   289.8888  19.7942      169.9      5.8      169.9        5.8     0.0     0.0 
1 1 1   43   17    1 o    132.7    5.5    0.0000   0.0000          ?        ?   176.2320  14.6860          ?        ?      132.7        5.5       ?       ? 
1 1 1   43   17    2 o    261.4    3.5    0.0000   0.0000          ?        ?   683.8566  18.5171          ?        ?      261.4        3.5       ?       ? 
1 1 1   43   17    3 o    385.9    3.1    0.0000   0.0000          ?        ?  1489.6710  24.2638          ?        ?      385.9        3.1       ?       ? 
1 1 1   43   17    4 o     41.3   14.4    0.0000   0.0000          ?        ?    15.3245  14.6860          ?        ?       41.3       14.4       ?       ? 
1 1 1   43   17    5 o    347.2    3.1    0.0000   0.0000          ?        ?  1206.1674  21.7097          ?        ?      347.2        3.1       ?       ? 
1 1 1   43   17    6 o    214.5    3.9    0.0000   0.0000          ?        ?   460.3741  16.6016          ?        ?      214.5        3.9       ?       ? 
1 1 1   43   17    7 o    543.8    3.2    0.0000   0.0000          ?        ?  2958.2705  34.4802          ?        ?      543.8        3.2       ?       ? 
1 1 1   43   17    8 o    214.4    2.8    0.0000   0.0000          ?        ?   459.7356  12.1319          ?        ?      214.4        2.8       ?       ? 
1 1 1   43   17    9 o    119.5    4.5    0.0000   0.0000          ?        ?   143.0288  10.8549          ?        ?      119.5        4.5       ?       ? 
1 1 1   43   17   10 o     82.9    6.9    0.0000   0.0000          ?        ?    68.9603  11.4934          ?        ?       82.9        6.9       ?       ? 
1 1 1   43   17   11 o    186.0    3.4    0.0000   0.0000          ?        ?   346.0787  12.7704          ?        ?      186.0        3.4       ?       ? 
1 1 1   43   17   12 o    238.8    3.3    0.0000   0.0000          ?        ?   570.8383  15.9630          ?        ?      238.8        3.3       ?       ? 
1 1 1   43   17   13 o    150.7    3.0    0.0000   0.0000          ?        ?   227.3137   8.9393          ?        ?      150.7        3.0       ?       ? 
1 1 1   43   17   14 o    388.9    2.8    0.0000   0.0000          ?        ?  1513.2963  21.7097          ?        ?      388.9        2.8       ?       ? 
1 1 1   43   17   15 o    134.3    4.8    0.0000   0.0000          ?        ?   180.7016  12.7704          ?        ?      134.3        4.8       ?       ? 
1 1 1   43   17   16 o    323.2    3.0    0.0000   0.0000          ?        ?  1045.2599  19.1556          ?        ?      323.2        3.0       ?       ? 
1 1 1   43   17   17 o    110.3    5.8    0.0000   0.0000          ?        ?   121.9576  12.7704          ?        ?      110.3        5.8       ?       ? 
1 1 1   43   17   18 o    170.2    3.9    0.0000   0.0000          ?        ?   289.8888  13.4090          ?        ?      170.2        3.9       ?       ? 
1 1 1   43   17   19 o    271.0    2.7    0.0000   0.0000          ?        ?   734.9384  14.6860          ?        ?      271.0        2.7       ?       ? 
1 1 1   43   17   20 o     72.7    7.9    0.0000   0.0000          ?        ?    52.9973  11.4934          ?        ?       72.7        7.9       ?       ? 
1 1 1   43   17   21 o    221.4    3.3    0.0000   0.0000          ?        ?   490.3846  14.6860          ?        ?      221.4        3.3       ?       ? 
1 1 1   43   17   22 o    440.5    2.5    0.0000   0.0000          ?        ?  1941.1057  22.3483          ?        ?      440.5        2.5       ?       ? 
1 1 1   43   17   23 o    128.7    5.0    0.0000   0.0000          ?        ?   166.0156  12.7704          ?        ?      128.7        5.0       ?       ? 
1 1 1   43   17   24 o    196.1    3.4    0.0000   0.0000          ?        ?   385.0285  13.4090          ?        ?      196.1        3.4       ?       ? 
1 1 1   43   17   25 o     38.0   13.7    0.0000   0.0000          ?        ?    12.1319  13.4090          ?        ?       38.0       13.7       ?       ? 
1 1 1   43   17   26 o    303.6    2.8    0.0000   0.0000          ?        ?   922.0252  17.2401          ?        ?      303.6        2.8       ?       ? 
1 1 1   43   17   27 o    426.6    2.6    0.0000   0.0000          ?        ?  1820.4252  22.3483          ?        ?      426.6        2.6       ?       ? 
1 1 1   43   17   28 o    488.7    2.6    0.0000   0.0000          ?        ?  2389.3479  25.5409          ?        ?      488.7        2.6       ?       ? 
1 1 1   43   17   29 o     46.8   14.3    0.0000   0.0000          ?        ?    22.3483  14.6860          ?        ?       46.8       14.3       ?       ? 
1 1 1   43   17   30 o    359.6    2.7    0.0000   0.0000          ?        ?  1293.6449  19.1556          ?        ?      359.6        2.7       ?       ? 
1 1 1   43   17   31 o    505.2    2.7    0.0000   0.0000          ?        ?  2554.0864  27.4564          ?        ?      505.2        2.7       ?       ? 
1 1 1   43   17   32 o    255.5    3.2    0.0000   0.0000          ?        ?   653.2076  16.6016          ?        ?      255.5        3.2       ?       ? 
1 1 1   43   17   33 o    247.1    3.5    0.0000   0.0000          ?        ?   611.0652  17.2401          ?        ?      247.1        3.5       ?       ? 
1 1 1   43   17   34 o    233.1    3.6    0.0000   0.0000          ?        ?   544.0204  16.6016          ?        ?      233.1        3.6       ?       ? 
1 1 1   43   17   35 o    240.5    3.5    0.0000   0.0000          ?        ?   579.1391  16.6016          ?        ?      240.5        3.5       ?       ? 
1 1 1   43   17   36 o     28.8   13.1    0.0000   0.0000          ?        ?   -10.2163  16.6016          ?        ?       28.8       13.1       ?       ? 
1 1 1   43   17   37 f     41.9   15.0    0.0000   0.0000          ?        ?    15.3245  15.9630          ?        ?       41.9       15.0       ?       ? 
1 1 1   43   17   38 o    162.5    5.3    0.0000   0.0000          ?        ?   264.9865  17.2401          ?        ?      162.5        5.3       ?       ? 
1 1 1   43   17   39 o    235.8    3.5    0.0000   0.0000          ?        ?   556.7908  16.6016          ?        ?      235.8        3.5       ?       ? 
1 1 1   43   17   40 o     19.7    9.9    0.0000   0.0000          ?        ?   -51.0817  17.2401          ?        ?       19.7        9.9       ?       ? 
1 1 1   43   17   41 o    190.9    4.7    0.0000   0.0000          ?        ?   365.2344  17.8786          ?        ?      190.9        4.7       ?       ? 
1 1 1   43   17   42 o    190.4    4.5    0.0000   0.0000          ?        ?   363.3188  17.2401          ?        ?      190.4        4.5       ?       ? 
1 1 1   43   17   43 o    115.1    7.2    0.0000   0.0000          ?        ?   133.4510  16.6016          ?        ?      115.1        7.2       ?       ? 
1 1 1   43   17   44 o    209.8    4.1    0.0000   0.0000          ?        ?   441.2184  17.2401          ?        ?      209.8        4.1       ?       ? 
1 1 1   43   17   45 o    135.8    6.6    0.0000   0.0000          ?        ?   185.8098  17.8786          ?        ?      135.8        6.6       ?       ? 
1 1 1   43   17   46 f    133.7    6.2    0.0000   0.0000          ?        ?   180.0631  16.6016          ?        ?      133.7        6.2       ?       ? 
1 1 1   43   17   47 o    108.9    8.2    0.0000   0.0000          ?        ?   120.0421  17.8786          ?        ?      108.9        8.2       ?       ? 
1 1 1   43   17   48 o    160.1    5.6    0.0000   0.0000          ?        ?   257.9627  17.8786          ?        ?      160.1        5.6       ?       ? 
1 1 1   43   17   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43   18    0 o    530.9    5.2 2821.6270  55.5514  2821.6270  55.5514  2821.6270  55.5514      530.9      5.2      530.9        5.2     0.0     0.0 
1 1 1   43   18    1 f    409.7    3.2    0.0000   0.0000          ?        ?  1679.3119  26.1794          ?        ?      409.7        3.2       ?       ? 
1 1 1   43   18    2 o    425.8    3.2    0.0000   0.0000          ?        ?  1814.0400  27.4564          ?        ?      425.8        3.2       ?       ? 
1 1 1   43   18    3 o    146.0    4.6    0.0000   0.0000          ?        ?   213.2662  13.4090          ?        ?      146.0        4.6       ?       ? 
1 1 1   43   18    4 o    286.0    3.1    0.0000   0.0000          ?        ?   818.5847  17.8786          ?        ?      286.0        3.1       ?       ? 
1 1 1   43   18    5 o    431.5    3.2    0.0000   0.0000          ?        ?  1863.2061  27.4564          ?        ?      431.5        3.2       ?       ? 
1 1 1   43   18    6 o    253.8    3.8    0.0000   0.0000          ?        ?   644.9069  19.1556          ?        ?      253.8        3.8       ?       ? 
1 1 1   43   18    7 o     40.4   14.1    0.0000   0.0000          ?        ?    14.6860  14.0475          ?        ?       40.4       14.1       ?       ? 
1 1 1   43   18    8 o    411.5    3.0    0.0000   0.0000          ?        ?  1693.9978  24.9023          ?        ?      411.5        3.0       ?       ? 
1 1 1   43   18    9 o    286.8    2.8    0.0000   0.0000          ?        ?   823.0543  15.9630          ?        ?      286.8        2.8       ?       ? 
1 1 1   43   18   10 o     97.5    5.6    0.0000   0.0000          ?        ?    95.1397  10.8549          ?        ?       97.5        5.6       ?       ? 
1 1 1   43   18   11 o    173.4    3.5    0.0000   0.0000          ?        ?   300.7437  12.1319          ?        ?      173.4        3.5       ?       ? 
1 1 1   43   18   12 o    254.9    3.1    0.0000   0.0000          ?        ?   650.0150  15.9630          ?        ?      254.9        3.1       ?       ? 
1 1 1   43   18   13 f    102.8    6.5    0.0000   0.0000          ?        ?   105.9946  13.4090          ?        ?      102.8        6.5       ?       ? 
1 1 1   43   18   14 o     99.4    6.1    0.0000   0.0000          ?        ?    98.9709  12.1319          ?        ?       99.4        6.1       ?       ? 
1 1 1   43   18   15 f    135.6    3.5    0.0000   0.0000          ?        ?   183.8942   9.5778          ?        ?      135.6        3.5       ?       ? 
1 1 1   43   18   16 o    188.5    3.2    0.0000   0.0000          ?        ?   355.6566  12.1319          ?        ?      188.5        3.2       ?       ? 
1 1 1   43   18   17 o    292.0    2.6    0.0000   0.0000          ?        ?   853.0649  15.3245          ?        ?      292.0        2.6       ?       ? 
1 1 1   43   18   18 o    330.3    3.0    0.0000   0.0000          ?        ?  1091.8719  19.7942          ?        ?      330.3        3.0       ?       ? 
1 1 1   43   18   19 o    189.0    3.5    0.0000   0.0000          ?        ?   357.5721  13.4090          ?        ?      189.0        3.5       ?       ? 
1 1 1   43   18   20 o    179.5    3.9    0.0000   0.0000          ?        ?   322.4534  14.0475          ?        ?      179.5        3.9       ?       ? 
1 1 1   43   18   21 o    532.4    2.7    0.0000   0.0000          ?        ?  2835.6746  28.7335          ?        ?      532.4        2.7       ?       ? 
1 1 1   43   18   22 o    363.0    2.6    0.0000   0.0000          ?        ?  1318.5471  18.5171          ?        ?      363.0        2.6       ?       ? 
1 1 1   43   18   23 o    254.0    2.9    0.0000   0.0000          ?        ?   645.5453  14.6860          ?        ?      254.0        2.9       ?       ? 
1 1 1   43   18   24 o    113.4    5.9    0.0000   0.0000          ?        ?   128.9814  13.4090          ?        ?      113.4        5.9       ?       ? 
1 1 1   43   18   25 o    265.3    2.9    0.0000   0.0000          ?        ?   704.2894  15.3245          ?        ?      265.3        2.9       ?       ? 
1 1 1   43   18   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43   18   27 o     20.5   10.1    0.0000   0.0000          ?        ?   -28.0950  14.0475          ?        ?       20.5       10.1       ?       ? 
1 1 1   43   18   28 o    295.4    2.8    0.0000   0.0000          ?        ?   872.8591  16.6016          ?        ?      295.4        2.8       ?       ? 
1 1 1   43   18   29 f    129.9    5.7    0.0000   0.0000          ?        ?   169.2082  14.6860          ?        ?      129.9        5.7       ?       ? 
1 1 1   43   18   30 o    302.0    2.9    0.0000   0.0000          ?        ?   912.4474  17.2401          ?        ?      302.0        2.9       ?       ? 
1 1 1   43   18   31 o    195.0    3.9    0.0000   0.0000          ?        ?   380.5589  15.3245          ?        ?      195.0        3.9       ?       ? 
1 1 1   43   18   32 o     19.4    9.7    0.0000   0.0000          ?        ?   -40.8654  15.3245          ?        ?       19.4        9.7       ?       ? 
1 1 1   43   18   33 o    116.1    6.3    0.0000   0.0000          ?        ?   135.3666  14.6860          ?        ?      116.1        6.3       ?       ? 
1 1 1   43   18   34 o    105.7    7.2    0.0000   0.0000          ?        ?   112.3798  15.3245          ?        ?      105.7        7.2       ?       ? 
1 1 1   43   18   35 o     83.8    9.1    0.0000   0.0000          ?        ?    70.8759  15.3245          ?        ?       83.8        9.1       ?       ? 
1 1 1   43   18   36 o    133.0    6.0    0.0000   0.0000          ?        ?   177.5090  15.9630          ?        ?      133.0        6.0       ?       ? 
1 1 1   43   18   37 o    213.5    4.0    0.0000   0.0000          ?        ?   456.5430  17.2401          ?        ?      213.5        4.0       ?       ? 
1 1 1   43   18   38 o    264.9    3.3    0.0000   0.0000          ?        ?   702.3738  17.2401          ?        ?      264.9        3.3       ?       ? 
1 1 1   43   18   39 o    221.2    3.9    0.0000   0.0000          ?        ?   490.3846  17.2401          ?        ?      221.2        3.9       ?       ? 
1 1 1   43   18   40 o    155.9    5.3    0.0000   0.0000          ?        ?   243.9153  16.6016          ?        ?      155.9        5.3       ?       ? 
1 1 1   43   18   41 o    175.7    4.7    0.0000   0.0000          ?        ?   309.6830  16.6016          ?        ?      175.7        4.7       ?       ? 
1 1 1   43   18   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43   18   43 o     63.3   14.0    0.0000   0.0000          ?        ?    42.7809  17.2401          ?        ?       63.3       14.0       ?       ? 
1 1 1   43   18   44 o     24.3   11.8    0.0000   0.0000          ?        ?   -29.3720  17.8786          ?        ?       24.3       11.8       ?       ? 
1 1 1   43   18   45 o    203.9    4.4    0.0000   0.0000          ?        ?   416.9547  17.8786          ?        ?      203.9        4.4       ?       ? 
1 1 1   43   18   46 o    101.4    8.2    0.0000   0.0000          ?        ?   104.0790  16.6016          ?        ?      101.4        8.2       ?       ? 
1 1 1   43   18   47 o    174.5    4.8    0.0000   0.0000          ?        ?   305.8519  16.6016          ?        ?      174.5        4.8       ?       ? 
1 1 1   43   19    0 o    162.2    6.1  264.3480  19.7942   264.3480  19.7942   264.3480  19.7942      162.2      6.1      162.2        6.1     0.0     0.0 
1 1 1   43   19    1 o    261.4    3.3    0.0000   0.0000          ?        ?   683.8566  17.2401          ?        ?      261.4        3.3       ?       ? 
1 1 1   43   19    2 o    323.7    3.3    0.0000   0.0000          ?        ?  1048.4525  21.0712          ?        ?      323.7        3.3       ?       ? 
1 1 1   43   19    3 o    267.1    3.6    0.0000   0.0000          ?        ?   713.8672  19.1556          ?        ?      267.1        3.6       ?       ? 
1 1 1   43   19    4 o    496.8    3.3    0.0000   0.0000          ?        ?  2469.8015  33.2031          ?        ?      496.8        3.3       ?       ? 
1 1 1   43   19    5 o    165.8    4.2    0.0000   0.0000          ?        ?   275.2028  14.0475          ?        ?      165.8        4.2       ?       ? 
1 1 1   43   19    6 o     81.3    8.6    0.0000   0.0000          ?        ?    66.4062  14.0475          ?        ?       81.3        8.6       ?       ? 
1 1 1   43   19    7 o    392.6    3.3    0.0000   0.0000          ?        ?  1542.6683  25.5409          ?        ?      392.6        3.3       ?       ? 
1 1 1   43   19    8 o    411.1    3.2    0.0000   0.0000          ?        ?  1691.4437  26.1794          ?        ?      411.1        3.2       ?       ? 
1 1 1   43   19    9 o    350.5    3.0    0.0000   0.0000          ?        ?  1229.1542  21.0712          ?        ?      350.5        3.0       ?       ? 
1 1 1   43   19   10 o    208.3    3.4    0.0000   0.0000          ?        ?   434.1947  14.0475          ?        ?      208.3        3.4       ?       ? 
1 1 1   43   19   11 o    182.0    3.7    0.0000   0.0000          ?        ?   331.3927  13.4090          ?        ?      182.0        3.7       ?       ? 
1 1 1   43   19   12 o    684.7    3.5    0.0000   0.0000          ?        ?  4691.2183  48.5276          ?        ?      684.7        3.5       ?       ? 
1 1 1   43   19   13 o    136.4    5.1    0.0000   0.0000          ?        ?   186.4483  14.0475          ?        ?      136.4        5.1       ?       ? 
1 1 1   43   19   14 o    390.0    2.9    0.0000   0.0000          ?        ?  1521.5970  22.9868          ?        ?      390.0        2.9       ?       ? 
1 1 1   43   19   15 o     38.0   13.4    0.0000   0.0000          ?        ?    12.7704  12.7704          ?        ?       38.0       13.4       ?       ? 
1 1 1   43   19   16 o    161.6    3.2    0.0000   0.0000          ?        ?   261.1554  10.2163          ?        ?      161.6        3.2       ?       ? 
1 1 1   43   19   17 o    218.6    2.9    0.0000   0.0000          ?        ?   478.2527  12.7704          ?        ?      218.6        2.9       ?       ? 
1 1 1   43   19   18 o    286.3    2.7    0.0000   0.0000          ?        ?   819.8618  15.3245          ?        ?      286.3        2.7       ?       ? 
1 1 1   43   19   19 o    539.7    2.9    0.0000   0.0000          ?        ?  2914.8513  31.2876          ?        ?      539.7        2.9       ?       ? 
1 1 1   43   19   20 o     33.1   12.8    0.0000   0.0000          ?        ?     7.0237  12.1319          ?        ?       33.1       12.8       ?       ? 
1 1 1   43   19   21 o    128.0    5.2    0.0000   0.0000          ?        ?   164.1001  13.4090          ?        ?      128.0        5.2       ?       ? 
1 1 1   43   19   22 f     25.1   11.4    0.0000   0.0000          ?        ?    -8.3008  12.7704          ?        ?       25.1       11.4       ?       ? 
1 1 1   43   19   23 o    327.6    2.7    0.0000   0.0000          ?        ?  1073.9934  17.8786          ?        ?      327.6        2.7       ?       ? 
1 1 1   43   19   24 o    330.6    2.8    0.0000   0.0000          ?        ?  1093.7876  18.5171          ?        ?      330.6        2.8       ?       ? 
1 1 1   43   19   25 f    110.0    6.7    0.0000   0.0000          ?        ?   121.3191  14.6860          ?        ?      110.0        6.7       ?       ? 
1 1 1   43   19   26 o    133.8    5.0    0.0000   0.0000          ?        ?   179.4246  13.4090          ?        ?      133.8        5.0       ?       ? 
1 1 1   43   19   27 o    292.5    2.8    0.0000   0.0000          ?        ?   856.2576  16.6016          ?        ?      292.5        2.8       ?       ? 
1 1 1   43   19   28 f    231.2    3.3    0.0000   0.0000          ?        ?   535.0811  15.3245          ?        ?      231.2        3.3       ?       ? 
1 1 1   43   19   29 f    179.1    4.1    0.0000   0.0000          ?        ?   321.1764  14.6860          ?        ?      179.1        4.1       ?       ? 
1 1 1   43   19   30 o     38.4   14.5    0.0000   0.0000          ?        ?    10.8549  15.3245          ?        ?       38.4       14.5       ?       ? 
1 1 1   43   19   31 o    122.6    5.7    0.0000   0.0000          ?        ?   150.6911  14.0475          ?        ?      122.6        5.7       ?       ? 
1 1 1   43   19   32 o     37.1   14.4    0.0000   0.0000          ?        ?     8.9393  15.3245          ?        ?       37.1       14.4       ?       ? 
1 1 1   43   19   33 o    222.3    3.6    0.0000   0.0000          ?        ?   494.8542  15.9630          ?        ?      222.3        3.6       ?       ? 
1 1 1   43   19   34 o     81.5    9.0    0.0000   0.0000          ?        ?    67.0448  14.6860          ?        ?       81.5        9.0       ?       ? 
1 1 1   43   19   35 o    197.7    4.0    0.0000   0.0000          ?        ?   391.4138  15.9630          ?        ?      197.7        4.0       ?       ? 
1 1 1   43   19   36 o     65.7   12.6    0.0000   0.0000          ?        ?    45.3350  15.9630          ?        ?       65.7       12.6       ?       ? 
1 1 1   43   19   37 o    416.4    2.8    0.0000   0.0000          ?        ?  1735.5017  22.9868          ?        ?      416.4        2.8       ?       ? 
1 1 1   43   19   38 o     37.1   14.6    0.0000   0.0000          ?        ?     8.3008  15.9630          ?        ?       37.1       14.6       ?       ? 
1 1 1   43   19   39 o    180.6    4.6    0.0000   0.0000          ?        ?   326.9231  16.6016          ?        ?      180.6        4.6       ?       ? 
1 1 1   43   19   40 o     75.6   11.0    0.0000   0.0000          ?        ?    58.1055  16.6016          ?        ?       75.6       11.0       ?       ? 
1 1 1   43   19   41 o    210.5    4.2    0.0000   0.0000          ?        ?   444.4110  17.8786          ?        ?      210.5        4.2       ?       ? 
1 1 1   43   19   42 o     43.3   15.3    0.0000   0.0000          ?        ?    17.2401  16.6016          ?        ?       43.3       15.3       ?       ? 
1 1 1   43   19   43 o     94.3    8.8    0.0000   0.0000          ?        ?    90.0316  16.6016          ?        ?       94.3        8.8       ?       ? 
1 1 1   43   19   44 o     20.2   10.1    0.0000   0.0000          ?        ?   -43.4195  16.6016          ?        ?       20.2       10.1       ?       ? 
1 1 1   43   19   45 o    158.6    5.2    0.0000   0.0000          ?        ?   252.8546  16.6016          ?        ?      158.6        5.2       ?       ? 
1 1 1   43   19   46 o     94.5    8.8    0.0000   0.0000          ?        ?    90.6701  16.6016          ?        ?       94.5        8.8       ?       ? 
1 1 1   43   20    0 o    192.0    6.3  370.3425  24.2638   370.3425  24.2638   370.3425  24.2638      192.0      6.3      192.0        6.3     0.0     0.0 
1 1 1   43   20    1 f    206.9    4.0    0.0000   0.0000          ?        ?   428.4480  16.6016          ?        ?      206.9        4.0       ?       ? 
1 1 1   43   20    2 o    307.6    3.1    0.0000   0.0000          ?        ?   946.9276  19.1556          ?        ?      307.6        3.1       ?       ? 
1 1 1   43   20    3 o     92.0    7.6    0.0000   0.0000          ?        ?    84.9234  14.0475          ?        ?       92.0        7.6       ?       ? 
1 1 1   43   20    4 o    167.3    4.4    0.0000   0.0000          ?        ?   280.3110  14.6860          ?        ?      167.3        4.4       ?       ? 
1 1 1   43   20    5 o    433.7    3.7    0.0000   0.0000          ?        ?  1882.3617  31.9261          ?        ?      433.7        3.7       ?       ? 
1 1 1   43   20    6 o    190.5    4.5    0.0000   0.0000          ?        ?   363.3188  17.2401          ?        ?      190.5        4.5       ?       ? 
1 1 1   43   20    7 o     94.0    7.8    0.0000   0.0000          ?        ?    88.7545  14.6860          ?        ?       94.0        7.8       ?       ? 
1 1 1   43   20    8 o    172.7    5.0    0.0000   0.0000          ?        ?   298.8281  17.2401          ?        ?      172.7        5.0       ?       ? 
1 1 1   43   20    9 o    107.4    6.8    0.0000   0.0000          ?        ?   115.5724  14.6860          ?        ?      107.4        6.8       ?       ? 
1 1 1   43   20   10 o    196.1    4.6    0.0000   0.0000          ?        ?   385.0285  17.8786          ?        ?      196.1        4.6       ?       ? 
1 1 1   43   20   11 o    307.1    2.9    0.0000   0.0000          ?        ?   943.7350  17.8786          ?        ?      307.1        2.9       ?       ? 
1 1 1   43   20   12 o    235.9    3.2    0.0000   0.0000          ?        ?   556.7908  15.3245          ?        ?      235.9        3.2       ?       ? 
1 1 1   43   20   13 o    262.8    2.9    0.0000   0.0000          ?        ?   690.8804  15.3245          ?        ?      262.8        2.9       ?       ? 
1 1 1   43   20   14 o    226.1    3.4    0.0000   0.0000          ?        ?   511.4558  15.3245          ?        ?      226.1        3.4       ?       ? 
1 1 1   43   20   15 o    299.1    3.2    0.0000   0.0000          ?        ?   895.2073  19.1556          ?        ?      299.1        3.2       ?       ? 
1 1 1   43   20   16 o    475.1    3.0    0.0000   0.0000          ?        ?  2258.4512  28.7335          ?        ?      475.1        3.0       ?       ? 
1 1 1   43   20   17 o     38.5   11.0    0.0000   0.0000          ?        ?    15.3245   8.9393          ?        ?       38.5       11.0       ?       ? 
1 1 1   43   20   18 o     81.4    6.7    0.0000   0.0000          ?        ?    66.4062  10.8549          ?        ?       81.4        6.7       ?       ? 
1 1 1   43   20   19 f    322.4    2.6    0.0000   0.0000          ?        ?  1040.1517  16.6016          ?        ?      322.4        2.6       ?       ? 
1 1 1   43   20   20 o     46.2   12.2    0.0000   0.0000          ?        ?    22.3483  11.4934          ?        ?       46.2       12.2       ?       ? 
1 1 1   43   20   21 o    200.6    3.3    0.0000   0.0000          ?        ?   402.9071  13.4090          ?        ?      200.6        3.3       ?       ? 
1 1 1   43   20   22 o    308.4    2.8    0.0000   0.0000          ?        ?   951.3972  17.2401          ?        ?      308.4        2.8       ?       ? 
1 1 1   43   20   23 o    295.1    2.7    0.0000   0.0000          ?        ?   871.5820  15.9630          ?        ?      295.1        2.7       ?       ? 
1 1 1   43   20   24 o    304.6    2.9    0.0000   0.0000          ?        ?   928.4104  17.8786          ?        ?      304.6        2.9       ?       ? 
1 1 1   43   20   25 o    362.7    2.6    0.0000   0.0000          ?        ?  1315.9932  19.1556          ?        ?      362.7        2.6       ?       ? 
1 1 1   43   20   26 o    239.6    3.3    0.0000   0.0000          ?        ?   574.6694  15.9630          ?        ?      239.6        3.3       ?       ? 
1 1 1   43   20   27 o    309.5    3.0    0.0000   0.0000          ?        ?   958.4210  18.5171          ?        ?      309.5        3.0       ?       ? 
1 1 1   43   20   28 o    193.3    4.1    0.0000   0.0000          ?        ?   374.1737  15.9630          ?        ?      193.3        4.1       ?       ? 
1 1 1   43   20   29 o    432.2    2.7    0.0000   0.0000          ?        ?  1868.9529  23.6253          ?        ?      432.2        2.7       ?       ? 
1 1 1   43   20   30 o     69.0   12.5    0.0000   0.0000          ?        ?    49.8047  16.6016          ?        ?       69.0       12.5       ?       ? 
1 1 1   43   20   31 o    303.3    2.9    0.0000   0.0000          ?        ?   920.7482  17.8786          ?        ?      303.3        2.9       ?       ? 
1 1 1   43   20   32 o    158.8    5.0    0.0000   0.0000          ?        ?   252.8546  15.9630          ?        ?      158.8        5.0       ?       ? 
1 1 1   43   20   33 o    214.5    3.9    0.0000   0.0000          ?        ?   461.0126  16.6016          ?        ?      214.5        3.9       ?       ? 
1 1 1   43   20   34 o     84.9    9.0    0.0000   0.0000          ?        ?    72.7915  15.3245          ?        ?       84.9        9.0       ?       ? 
1 1 1   43   20   35 o    131.3    5.8    0.0000   0.0000          ?        ?   173.0394  15.3245          ?        ?      131.3        5.8       ?       ? 
1 1 1   43   20   36 o    250.1    3.4    0.0000   0.0000          ?        ?   626.3897  17.2401          ?        ?      250.1        3.4       ?       ? 
1 1 1   43   20   37 o     90.0    8.5    0.0000   0.0000          ?        ?    81.7308  15.3245          ?        ?       90.0        8.5       ?       ? 
1 1 1   43   20   38 o    224.4    3.8    0.0000   0.0000          ?        ?   504.4321  17.2401          ?        ?      224.4        3.8       ?       ? 
1 1 1   43   20   39 o     79.3   10.5    0.0000   0.0000          ?        ?    63.8522  16.6016          ?        ?       79.3       10.5       ?       ? 
1 1 1   43   20   40 o     25.9   12.1    0.0000   0.0000          ?        ?   -15.9630  15.9630          ?        ?       25.9       12.1       ?       ? 
1 1 1   43   20   41 o    122.3    6.8    0.0000   0.0000          ?        ?   150.6911  16.6016          ?        ?      122.3        6.8       ?       ? 
1 1 1   43   20   42 o     39.0   15.3    0.0000   0.0000          ?        ?    10.2163  17.2401          ?        ?       39.0       15.3       ?       ? 
1 1 1   43   20   43 o    315.4    3.0    0.0000   0.0000          ?        ?   996.7323  19.1556          ?        ?      315.4        3.0       ?       ? 
1 1 1   43   20   44 o    185.7    4.5    0.0000   0.0000          ?        ?   346.0787  16.6016          ?        ?      185.7        4.5       ?       ? 
1 1 1   43   20   45 o     33.5   14.1    0.0000   0.0000          ?        ?     2.5541  15.9630          ?        ?       33.5       14.1       ?       ? 
1 1 1   43   21    0 o    275.6    4.2  760.4792  22.9868   760.4792  22.9868   760.4792  22.9868      275.6      4.2      275.6        4.2     0.0     0.0 
1 1 1   43   21    1 o    286.5    3.3    0.0000   0.0000          ?        ?   821.1389  19.1556          ?        ?      286.5        3.3       ?       ? 
1 1 1   43   21    2 o    178.2    4.5    0.0000   0.0000          ?        ?   317.9838  15.9630          ?        ?      178.2        4.5       ?       ? 
1 1 1   43   21    3 o     74.8    9.4    0.0000   0.0000          ?        ?    56.1899  14.0475          ?        ?       74.8        9.4       ?       ? 
1 1 1   43   21    4 o    254.6    3.5    0.0000   0.0000          ?        ?   648.7380  17.8786          ?        ?      254.6        3.5       ?       ? 
1 1 1   43   21    5 o    181.2    4.4    0.0000   0.0000          ?        ?   328.8386  15.9630          ?        ?      181.2        4.4       ?       ? 
1 1 1   43   21    6 o    465.6    3.5    0.0000   0.0000          ?        ?  2169.6963  32.5646          ?        ?      465.6        3.5       ?       ? 
1 1 1   43   21    7 o    329.4    3.6    0.0000   0.0000          ?        ?  1086.1254  23.6253          ?        ?      329.4        3.6       ?       ? 
1 1 1   43   21    8 o    270.0    3.7    0.0000   0.0000          ?        ?   729.8303  19.7942          ?        ?      270.0        3.7       ?       ? 
1 1 1   43   21    9 o     47.6   15.4    0.0000   0.0000          ?        ?    22.3483  16.6016          ?        ?       47.6       15.4       ?       ? 
1 1 1   43   21   10 o    180.5    5.0    0.0000   0.0000          ?        ?   326.2845  17.8786          ?        ?      180.5        5.0       ?       ? 
1 1 1   43   21   11 o    298.6    4.0    0.0000   0.0000          ?        ?   892.6533  23.6253          ?        ?      298.6        4.0       ?       ? 
1 1 1   43   21   12 o    361.1    3.1    0.0000   0.0000          ?        ?  1304.4998  22.3483          ?        ?      361.1        3.1       ?       ? 
1 1 1   43   21   13 o     22.4   10.5    0.0000   0.0000          ?        ?   -10.8549  11.4934          ?        ?       22.4       10.5       ?       ? 
1 1 1   43   21   14 o     53.6   11.1    0.0000   0.0000          ?        ?    30.0105  11.4934          ?        ?       53.6       11.1       ?       ? 
1 1 1   43   21   15 o     20.5   10.0    0.0000   0.0000          ?        ?   -24.9023  13.4090          ?        ?       20.5       10.0       ?       ? 
1 1 1   43   21   16 o    186.6    4.3    0.0000   0.0000          ?        ?   348.6328  15.9630          ?        ?      186.6        4.3       ?       ? 
1 1 1   43   21   17 o    298.2    3.0    0.0000   0.0000          ?        ?   890.0991  17.8786          ?        ?      298.2        3.0       ?       ? 
1 1 1   43   21   18 o    264.5    2.7    0.0000   0.0000          ?        ?   699.8197  14.0475          ?        ?      264.5        2.7       ?       ? 
1 1 1   43   21   19 o    119.0    4.8    0.0000   0.0000          ?        ?   141.7518  11.4934          ?        ?      119.0        4.8       ?       ? 
1 1 1   43   21   20 o    100.6    6.0    0.0000   0.0000          ?        ?   101.5249  12.1319          ?        ?      100.6        6.0       ?       ? 
1 1 1   43   21   21 o    262.3    2.8    0.0000   0.0000          ?        ?   688.3264  14.6860          ?        ?      262.3        2.8       ?       ? 
1 1 1   43   21   22 o    233.7    3.1    0.0000   0.0000          ?        ?   546.5745  14.6860          ?        ?      233.7        3.1       ?       ? 
1 1 1   43   21   23 o     96.4    6.6    0.0000   0.0000          ?        ?    93.2242  12.7704          ?        ?       96.4        6.6       ?       ? 
1 1 1   43   21   24 o    150.6    4.7    0.0000   0.0000          ?        ?   227.3137  14.0475          ?        ?      150.6        4.7       ?       ? 
1 1 1   43   21   25 o    305.5    2.8    0.0000   0.0000          ?        ?   934.1572  17.2401          ?        ?      305.5        2.8       ?       ? 
1 1 1   43   21   26 o    140.3    5.2    0.0000   0.0000          ?        ?   197.3032  14.6860          ?        ?      140.3        5.2       ?       ? 
1 1 1   43   21   27 o     83.5    8.4    0.0000   0.0000          ?        ?    70.2374  14.0475          ?        ?       83.5        8.4       ?       ? 
1 1 1   43   21   28 o     85.1    7.9    0.0000   0.0000          ?        ?    72.7915  13.4090          ?        ?       85.1        7.9       ?       ? 
1 1 1   43   21   29 o    134.2    5.5    0.0000   0.0000          ?        ?   180.7016  14.6860          ?        ?      134.2        5.5       ?       ? 
1 1 1   43   21   30 o    209.3    4.0    0.0000   0.0000          ?        ?   438.6643  16.6016          ?        ?      209.3        4.0       ?       ? 
1 1 1   43   21   31 o    144.7    5.5    0.0000   0.0000          ?        ?   210.0736  15.9630          ?        ?      144.7        5.5       ?       ? 
1 1 1   43   21   32 o    386.5    2.9    0.0000   0.0000          ?        ?  1495.4176  22.3483          ?        ?      386.5        2.9       ?       ? 
1 1 1   43   21   33 f    180.1    4.6    0.0000   0.0000          ?        ?   325.0075  16.6016          ?        ?      180.1        4.6       ?       ? 
1 1 1   43   21   34 o    282.6    3.3    0.0000   0.0000          ?        ?   799.4291  18.5171          ?        ?      282.6        3.3       ?       ? 
1 1 1   43   21   35 f     29.2   13.1    0.0000   0.0000          ?        ?    -7.0237  15.9630          ?        ?       29.2       13.1       ?       ? 
1 1 1   43   21   36 o    144.0    5.5    0.0000   0.0000          ?        ?   208.1580  15.9630          ?        ?      144.0        5.5       ?       ? 
1 1 1   43   21   37 o    158.3    5.2    0.0000   0.0000          ?        ?   251.5775  16.6016          ?        ?      158.3        5.2       ?       ? 
1 1 1   43   21   38 o    168.8    4.9    0.0000   0.0000          ?        ?   286.0577  16.6016          ?        ?      168.8        4.9       ?       ? 
1 1 1   43   21   39 o    184.0    4.5    0.0000   0.0000          ?        ?   339.6935  16.6016          ?        ?      184.0        4.5       ?       ? 
1 1 1   43   21   40 o     83.6    9.2    0.0000   0.0000          ?        ?    70.8759  15.3245          ?        ?       83.6        9.2       ?       ? 
1 1 1   43   21   41 o     21.6   10.6    0.0000   0.0000          ?        ?   -35.7572  16.6016          ?        ?       21.6       10.6       ?       ? 
1 1 1   43   21   42 o     22.2   10.8    0.0000   0.0000          ?        ?   -29.3720  15.9630          ?        ?       22.2       10.8       ?       ? 
1 1 1   43   21   43 o     59.0   14.2    0.0000   0.0000          ?        ?    37.6728  16.6016          ?        ?       59.0       14.2       ?       ? 
1 1 1   43   22    0 o    166.7    6.5  279.6725  21.7097   279.6725  21.7097   279.6725  21.7097      166.7      6.5      166.7        6.5     0.0     0.0 
1 1 1   43   22    1 o    126.7    5.5    0.0000   0.0000          ?        ?   160.9075  14.0475          ?        ?      126.7        5.5       ?       ? 
1 1 1   43   22    2 o     43.2   13.8    0.0000   0.0000          ?        ?    18.5171  13.4090          ?        ?       43.2       13.8       ?       ? 
1 1 1   43   22    3 o    272.0    3.8    0.0000   0.0000          ?        ?   740.6851  20.4327          ?        ?      272.0        3.8       ?       ? 
1 1 1   43   22    4 o    130.9    5.4    0.0000   0.0000          ?        ?   171.7623  14.0475          ?        ?      130.9        5.4       ?       ? 
1 1 1   43   22    5 o     91.6    8.0    0.0000   0.0000          ?        ?    84.2849  14.6860          ?        ?       91.6        8.0       ?       ? 
1 1 1   43   22    6 o    514.3    3.7    0.0000   0.0000          ?        ?  2647.3108  38.3113          ?        ?      514.3        3.7       ?       ? 
1 1 1   43   22    7 o    218.4    4.2    0.0000   0.0000          ?        ?   477.6142  18.5171          ?        ?      218.4        4.2       ?       ? 
1 1 1   43   22    8 o    439.9    3.6    0.0000   0.0000          ?        ?  1937.2745  31.9261          ?        ?      439.9        3.6       ?       ? 
1 1 1   43   22    9 o    256.4    4.1    0.0000   0.0000          ?        ?   658.3158  21.0712          ?        ?      256.4        4.1       ?       ? 
1 1 1   43   22   10 o     28.6   13.1    0.0000   0.0000          ?        ?   -12.7704  17.2401          ?        ?       28.6       13.1       ?       ? 
1 1 1   43   22   11 o    125.9    6.6    0.0000   0.0000          ?        ?   158.9919  16.6016          ?        ?      125.9        6.6       ?       ? 
1 1 1   43   22   12 o     19.9    9.9    0.0000   0.0000          ?        ?   -42.1424  15.9630          ?        ?       19.9        9.9       ?       ? 
1 1 1   43   22   13 o     91.0    6.3    0.0000   0.0000          ?        ?    83.0078  11.4934          ?        ?       91.0        6.3       ?       ? 
1 1 1   43   22   14 o    120.3    5.6    0.0000   0.0000          ?        ?   144.9444  13.4090          ?        ?      120.3        5.6       ?       ? 
1 1 1   43   22   15 o     98.7    6.5    0.0000   0.0000          ?        ?    97.6938  12.7704          ?        ?       98.7        6.5       ?       ? 
1 1 1   43   22   16 o    285.5    3.2    0.0000   0.0000          ?        ?   816.0306  18.5171          ?        ?      285.5        3.2       ?       ? 
1 1 1   43   22   17 f    313.2    3.4    0.0000   0.0000          ?        ?   982.0463  21.0712          ?        ?      313.2        3.4       ?       ? 
1 1 1   43   22   18 o    263.4    3.6    0.0000   0.0000          ?        ?   694.7115  19.1556          ?        ?      263.4        3.6       ?       ? 
1 1 1   43   22   19 o    354.0    2.7    0.0000   0.0000          ?        ?  1254.0564  19.1556          ?        ?      354.0        2.7       ?       ? 
1 1 1   43   22   20 o    251.9    2.7    0.0000   0.0000          ?        ?   634.6905  13.4090          ?        ?      251.9        2.7       ?       ? 
1 1 1   43   22   21 o    175.7    3.8    0.0000   0.0000          ?        ?   309.0445  13.4090          ?        ?      175.7        3.8       ?       ? 
1 1 1   43   22   22 o    156.1    4.3    0.0000   0.0000          ?        ?   243.9153  13.4090          ?        ?      156.1        4.3       ?       ? 
1 1 1   43   22   23 o     16.0    8.1    0.0000   0.0000          ?        ?   -39.5883  12.1319          ?        ?       16.0        8.1       ?       ? 
1 1 1   43   22   24 o     20.8   10.1    0.0000   0.0000          ?        ?   -20.4327  12.7704          ?        ?       20.8       10.1       ?       ? 
1 1 1   43   22   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43   22   26 o    127.2    5.3    0.0000   0.0000          ?        ?   162.1845  13.4090          ?        ?      127.2        5.3       ?       ? 
1 1 1   43   22   27 o     98.3    7.1    0.0000   0.0000          ?        ?    97.0553  14.0475          ?        ?       98.3        7.1       ?       ? 
1 1 1   43   22   28 o     82.3    8.5    0.0000   0.0000          ?        ?    68.3218  14.0475          ?        ?       82.3        8.5       ?       ? 
1 1 1   43   22   29 o    126.4    5.8    0.0000   0.0000          ?        ?   160.2689  14.6860          ?        ?      126.4        5.8       ?       ? 
1 1 1   43   22   30 o    162.0    4.5    0.0000   0.0000          ?        ?   263.0709  14.6860          ?        ?      162.0        4.5       ?       ? 
1 1 1   43   22   31 o    208.8    4.0    0.0000   0.0000          ?        ?   436.7488  16.6016          ?        ?      208.8        4.0       ?       ? 
1 1 1   43   22   32 o    293.4    3.0    0.0000   0.0000          ?        ?   862.0042  17.8786          ?        ?      293.4        3.0       ?       ? 
1 1 1   43   22   33 o    154.5    5.2    0.0000   0.0000          ?        ?   239.4456  15.9630          ?        ?      154.5        5.2       ?       ? 
1 1 1   43   22   34 o    112.9    7.1    0.0000   0.0000          ?        ?   128.3428  15.9630          ?        ?      112.9        7.1       ?       ? 
1 1 1   43   22   35 o     53.6   14.1    0.0000   0.0000          ?        ?    30.6490  15.3245          ?        ?       53.6       14.1       ?       ? 
1 1 1   43   22   36 o     33.3   14.3    0.0000   0.0000          ?        ?    -0.6385  17.2401          ?        ?       33.3       14.3       ?       ? 
1 1 1   43   22   37 f    277.8    3.3    0.0000   0.0000          ?        ?   773.2497  18.5171          ?        ?      277.8        3.3       ?       ? 
1 1 1   43   22   38 o    210.2    4.1    0.0000   0.0000          ?        ?   443.1340  17.2401          ?        ?      210.2        4.1       ?       ? 
1 1 1   43   22   39 o     17.8    9.0    0.0000   0.0000          ?        ?   -55.5514  15.9630          ?        ?       17.8        9.0       ?       ? 
1 1 1   43   22   40 o     26.4   12.4    0.0000   0.0000          ?        ?   -18.5171  17.2401          ?        ?       26.4       12.4       ?       ? 
1 1 1   43   22   41 o     40.1   15.3    0.0000   0.0000          ?        ?    12.1319  17.2401          ?        ?       40.1       15.3       ?       ? 
1 1 1   43   22   42 o    189.2    4.6    0.0000   0.0000          ?        ?   359.4877  17.2401          ?        ?      189.2        4.6       ?       ? 
1 1 1   43   23    0 o     97.3    9.7   97.6938  18.5171    97.6938  18.5171    97.6938  18.5171       97.3      9.7       97.3        9.7     0.0     0.0 
1 1 1   43   23    1 o     63.2   10.1    0.0000   0.0000          ?        ?    40.2269  12.7704          ?        ?       63.2       10.1       ?       ? 
1 1 1   43   23    2 o    328.8    3.3    0.0000   0.0000          ?        ?  1081.6556  21.7097          ?        ?      328.8        3.3       ?       ? 
1 1 1   43   23    3 o    290.9    3.3    0.0000   0.0000          ?        ?   846.6797  19.1556          ?        ?      290.9        3.3       ?       ? 
1 1 1   43   23    4 o    280.0    3.5    0.0000   0.0000          ?        ?   784.7431  19.7942          ?        ?      280.0        3.5       ?       ? 
1 1 1   43   23    5 o    470.7    3.7    0.0000   0.0000          ?        ?  2217.5854  34.4802          ?        ?      470.7        3.7       ?       ? 
1 1 1   43   23    6 o    200.8    4.3    0.0000   0.0000          ?        ?   403.5457  17.2401          ?        ?      200.8        4.3       ?       ? 
1 1 1   43   23    7 o    322.8    3.8    0.0000   0.0000          ?        ?  1043.3442  24.2638          ?        ?      322.8        3.8       ?       ? 
1 1 1   43   23    8 o     32.6   13.7    0.0000   0.0000          ?        ?     1.2770  15.3245          ?        ?       32.6       13.7       ?       ? 
1 1 1   43   23    9 o    153.1    5.4    0.0000   0.0000          ?        ?   234.9760  16.6016          ?        ?      153.1        5.4       ?       ? 
1 1 1   43   23   10 o    370.3    3.8    0.0000   0.0000          ?        ?  1372.8215  28.0950          ?        ?      370.3        3.8       ?       ? 
1 1 1   43   23   11 o     97.3    7.9    0.0000   0.0000          ?        ?    95.1397  15.3245          ?        ?       97.3        7.9       ?       ? 
1 1 1   43   23   12 o    266.5    3.5    0.0000   0.0000          ?        ?   710.6746  18.5171          ?        ?      266.5        3.5       ?       ? 
1 1 1   43   23   13 o    202.7    3.3    0.0000   0.0000          ?        ?   411.2079  13.4090          ?        ?      202.7        3.3       ?       ? 
1 1 1   43   23   14 o    387.1    3.1    0.0000   0.0000          ?        ?  1499.2488  23.6253          ?        ?      387.1        3.1       ?       ? 
1 1 1   43   23   15 o    118.9    5.6    0.0000   0.0000          ?        ?   141.7518  13.4090          ?        ?      118.9        5.6       ?       ? 
1 1 1   43   23   16 o    164.2    4.5    0.0000   0.0000          ?        ?   270.0946  14.6860          ?        ?      164.2        4.5       ?       ? 
1 1 1   43   23   17 o    235.4    3.7    0.0000   0.0000          ?        ?   554.8753  17.2401          ?        ?      235.4        3.7       ?       ? 
1 1 1   43   23   18 f    380.4    3.2    0.0000   0.0000          ?        ?  1448.1671  24.2638          ?        ?      380.4        3.2       ?       ? 
1 1 1   43   23   19 o    282.5    3.4    0.0000   0.0000          ?        ?   798.7905  19.1556          ?        ?      282.5        3.4       ?       ? 
1 1 1   43   23   20 o    134.3    3.8    0.0000   0.0000          ?        ?   180.7016  10.2163          ?        ?      134.3        3.8       ?       ? 
1 1 1   43   23   21 o     24.0   10.9    0.0000   0.0000          ?        ?    -7.0237  11.4934          ?        ?       24.0       10.9       ?       ? 
1 1 1   43   23   22 o    266.5    2.8    0.0000   0.0000          ?        ?   710.6746  14.6860          ?        ?      266.5        2.8       ?       ? 
1 1 1   43   23   23 o    183.0    3.5    0.0000   0.0000          ?        ?   335.2238  12.7704          ?        ?      183.0        3.5       ?       ? 
1 1 1   43   23   24 o    196.6    3.4    0.0000   0.0000          ?        ?   386.9441  13.4090          ?        ?      196.6        3.4       ?       ? 
1 1 1   43   23   25 o    178.9    3.7    0.0000   0.0000          ?        ?   320.5379  13.4090          ?        ?      178.9        3.7       ?       ? 
1 1 1   43   23   26 o     91.9    7.3    0.0000   0.0000          ?        ?    84.9234  13.4090          ?        ?       91.9        7.3       ?       ? 
1 1 1   43   23   27 o    151.0    4.7    0.0000   0.0000          ?        ?   228.5907  14.0475          ?        ?      151.0        4.7       ?       ? 
1 1 1   43   23   28 o    171.9    4.3    0.0000   0.0000          ?        ?   296.2740  14.6860          ?        ?      171.9        4.3       ?       ? 
1 1 1   43   23   29 o    338.1    2.6    0.0000   0.0000          ?        ?  1144.2307  17.8786          ?        ?      338.1        2.6       ?       ? 
1 1 1   43   23   30 o    105.1    7.0    0.0000   0.0000          ?        ?   111.1028  14.6860          ?        ?      105.1        7.0       ?       ? 
1 1 1   43   23   31 o    385.4    2.7    0.0000   0.0000          ?        ?  1486.4784  21.0712          ?        ?      385.4        2.7       ?       ? 
1 1 1   43   23   32 o     21.3   10.4    0.0000   0.0000          ?        ?   -27.4564  14.6860          ?        ?       21.3       10.4       ?       ? 
1 1 1   43   23   33 o    109.5    7.0    0.0000   0.0000          ?        ?   120.6806  15.3245          ?        ?      109.5        7.0       ?       ? 
1 1 1   43   23   34 o    251.2    3.3    0.0000   0.0000          ?        ?   632.1364  16.6016          ?        ?      251.2        3.3       ?       ? 
1 1 1   43   23   35 o     56.3   13.7    0.0000   0.0000          ?        ?    33.8416  15.3245          ?        ?       56.3       13.7       ?       ? 
1 1 1   43   23   36 o    238.3    3.6    0.0000   0.0000          ?        ?   568.9227  17.2401          ?        ?      238.3        3.6       ?       ? 
1 1 1   43   23   37 o    281.5    3.1    0.0000   0.0000          ?        ?   793.6824  17.2401          ?        ?      281.5        3.1       ?       ? 
1 1 1   43   23   38 o    135.4    5.9    0.0000   0.0000          ?        ?   184.5327  15.9630          ?        ?      135.4        5.9       ?       ? 
1 1 1   43   23   39 o     85.4    9.0    0.0000   0.0000          ?        ?    74.0685  15.3245          ?        ?       85.4        9.0       ?       ? 
1 1 1   43   23   40 o    198.6    4.3    0.0000   0.0000          ?        ?   395.8834  17.2401          ?        ?      198.6        4.3       ?       ? 
1 1 1   43   24    0 o    339.8    4.3 1156.3627  29.3720  1156.3627  29.3720  1156.3627  29.3720      339.8      4.3      339.8        4.3     0.0     0.0 
1 1 1   43   24    1 o    327.4    3.2    0.0000   0.0000          ?        ?  1072.7163  21.0712          ?        ?      327.4        3.2       ?       ? 
1 1 1   43   24    2 o    211.8    3.6    0.0000   0.0000          ?        ?   448.8807  15.3245          ?        ?      211.8        3.6       ?       ? 
1 1 1   43   24    3 o    139.6    5.5    0.0000   0.0000          ?        ?   195.3876  15.3245          ?        ?      139.6        5.5       ?       ? 
1 1 1   43   24    4 o    114.2    6.4    0.0000   0.0000          ?        ?   130.8969  14.6860          ?        ?      114.2        6.4       ?       ? 
1 1 1   43   24    5 o    237.9    4.3    0.0000   0.0000          ?        ?   567.0072  20.4327          ?        ?      237.9        4.3       ?       ? 
1 1 1   43   24    6 o    249.2    3.7    0.0000   0.0000          ?        ?   621.9200  18.5171          ?        ?      249.2        3.7       ?       ? 
1 1 1   43   24    7 f    141.9    4.9    0.0000   0.0000          ?        ?   201.7728  14.0475          ?        ?      141.9        4.9       ?       ? 
1 1 1   43   24    8 o    331.3    3.7    0.0000   0.0000          ?        ?  1098.8958  24.2638          ?        ?      331.3        3.7       ?       ? 
1 1 1   43   24    9 o    220.5    3.6    0.0000   0.0000          ?        ?   486.5535  15.9630          ?        ?      220.5        3.6       ?       ? 
1 1 1   43   24   10 o    357.7    3.3    0.0000   0.0000          ?        ?  1280.8744  23.6253          ?        ?      357.7        3.3       ?       ? 
1 1 1   43   24   11 o    165.7    5.0    0.0000   0.0000          ?        ?   275.2028  16.6016          ?        ?      165.7        5.0       ?       ? 
1 1 1   43   24   12 o    277.3    3.8    0.0000   0.0000          ?        ?   770.0571  21.0712          ?        ?      277.3        3.8       ?       ? 
1 1 1   43   24   13 o    138.9    6.2    0.0000   0.0000          ?        ?   193.4720  17.2401          ?        ?      138.9        6.2       ?       ? 
1 1 1   43   24   14 o    311.6    3.4    0.0000   0.0000          ?        ?   971.8299  21.0712          ?        ?      311.6        3.4       ?       ? 
1 1 1   43   24   15 o    127.7    5.3    0.0000   0.0000          ?        ?   163.4615  13.4090          ?        ?      127.7        5.3       ?       ? 
1 1 1   43   24   16 o    152.3    4.8    0.0000   0.0000          ?        ?   232.4219  14.6860          ?        ?      152.3        4.8       ?       ? 
1 1 1   43   24   17 o     27.0   12.1    0.0000   0.0000          ?        ?    -5.7467  13.4090          ?        ?       27.0       12.1       ?       ? 
1 1 1   43   24   18 o     48.4   14.2    0.0000   0.0000          ?        ?    24.2638  14.6860          ?        ?       48.4       14.2       ?       ? 
1 1 1   43   24   19 o     90.1    8.1    0.0000   0.0000          ?        ?    81.7308  14.6860          ?        ?       90.1        8.1       ?       ? 
1 1 1   43   24   20 o    157.8    4.7    0.0000   0.0000          ?        ?   249.6619  14.6860          ?        ?      157.8        4.7       ?       ? 
1 1 1   43   24   21 o    145.7    3.5    0.0000   0.0000          ?        ?   212.6277  10.2163          ?        ?      145.7        3.5       ?       ? 
1 1 1   43   24   22 o    145.0    4.0    0.0000   0.0000          ?        ?   210.7121  11.4934          ?        ?      145.0        4.0       ?       ? 
1 1 1   43   24   23 o    196.1    3.3    0.0000   0.0000          ?        ?   385.0285  12.7704          ?        ?      196.1        3.3       ?       ? 
1 1 1   43   24   24 o    186.3    3.4    0.0000   0.0000          ?        ?   347.3558  12.7704          ?        ?      186.3        3.4       ?       ? 
1 1 1   43   24   25 o    172.9    3.9    0.0000   0.0000          ?        ?   299.4666  13.4090          ?        ?      172.9        3.9       ?       ? 
1 1 1   43   24   26 o    161.2    4.4    0.0000   0.0000          ?        ?   260.5168  14.0475          ?        ?      161.2        4.4       ?       ? 
1 1 1   43   24   27 o    112.5    6.2    0.0000   0.0000          ?        ?   127.0658  14.0475          ?        ?      112.5        6.2       ?       ? 
1 1 1   43   24   28 o     34.2   13.7    0.0000   0.0000          ?        ?     6.3852  14.0475          ?        ?       34.2       13.7       ?       ? 
1 1 1   43   24   29 o     65.9   10.7    0.0000   0.0000          ?        ?    44.0580  14.0475          ?        ?       65.9       10.7       ?       ? 
1 1 1   43   24   30 o    290.8    3.0    0.0000   0.0000          ?        ?   846.6797  17.2401          ?        ?      290.8        3.0       ?       ? 
1 1 1   43   24   31 o    129.3    5.9    0.0000   0.0000          ?        ?   167.9312  15.3245          ?        ?      129.3        5.9       ?       ? 
1 1 1   43   24   32 o    457.2    2.6    0.0000   0.0000          ?        ?  2092.4355  23.6253          ?        ?      457.2        2.6       ?       ? 
1 1 1   43   24   33 o    147.0    5.4    0.0000   0.0000          ?        ?   217.0974  15.9630          ?        ?      147.0        5.4       ?       ? 
1 1 1   43   24   34 o    148.3    5.2    0.0000   0.0000          ?        ?   220.9285  15.3245          ?        ?      148.3        5.2       ?       ? 
1 1 1   43   24   35 o    170.2    4.3    0.0000   0.0000          ?        ?   290.5273  14.6860          ?        ?      170.2        4.3       ?       ? 
1 1 1   43   24   36 o     33.1   13.7    0.0000   0.0000          ?        ?     3.8311  14.6860          ?        ?       33.1       13.7       ?       ? 
1 1 1   43   24   37 o     45.8   14.4    0.0000   0.0000          ?        ?    21.7097  14.6860          ?        ?       45.8       14.4       ?       ? 
1 1 1   43   24   38 o    153.9    5.0    0.0000   0.0000          ?        ?   238.1686  15.3245          ?        ?      153.9        5.0       ?       ? 
1 1 1   43   25    0 f     54.7   20.7   40.8654  21.0712    40.8654  21.0712    40.8654  21.0712       54.7     20.7       54.7       20.7     0.0     0.0 
1 1 1   43   25    1 o    146.3    4.6    0.0000   0.0000          ?        ?   214.5433  13.4090          ?        ?      146.3        4.6       ?       ? 
1 1 1   43   25    2 o    143.2    4.9    0.0000   0.0000          ?        ?   205.6040  14.0475          ?        ?      143.2        4.9       ?       ? 
1 1 1   43   25    3 o    136.4    5.1    0.0000   0.0000          ?        ?   186.4483  14.0475          ?        ?      136.4        5.1       ?       ? 
1 1 1   43   25    4 o    269.3    3.3    0.0000   0.0000          ?        ?   725.9991  17.8786          ?        ?      269.3        3.3       ?       ? 
1 1 1   43   25    5 o    340.1    3.3    0.0000   0.0000          ?        ?  1157.6398  22.3483          ?        ?      340.1        3.3       ?       ? 
1 1 1   43   25    6 o    269.3    3.4    0.0000   0.0000          ?        ?   725.9991  18.5171          ?        ?      269.3        3.4       ?       ? 
1 1 1   43   25    7 o    228.6    3.5    0.0000   0.0000          ?        ?   522.9492  15.9630          ?        ?      228.6        3.5       ?       ? 
1 1 1   43   25    8 o    160.1    4.4    0.0000   0.0000          ?        ?   256.6857  14.0475          ?        ?      160.1        4.4       ?       ? 
1 1 1   43   25    9 o    162.4    4.5    0.0000   0.0000          ?        ?   264.3480  14.6860          ?        ?      162.4        4.5       ?       ? 
1 1 1   43   25   10 o    137.1    5.1    0.0000   0.0000          ?        ?   188.3639  14.0475          ?        ?      137.1        5.1       ?       ? 
1 1 1   43   25   11 o    278.5    3.4    0.0000   0.0000          ?        ?   776.4423  19.1556          ?        ?      278.5        3.4       ?       ? 
1 1 1   43   25   12 o    193.4    4.5    0.0000   0.0000          ?        ?   374.8122  17.2401          ?        ?      193.4        4.5       ?       ? 
1 1 1   43   25   13 o     20.2   10.1    0.0000   0.0000          ?        ?   -47.8891  17.2401          ?        ?       20.2       10.1       ?       ? 
1 1 1   43   25   14 o    203.5    4.4    0.0000   0.0000          ?        ?   415.0391  17.8786          ?        ?      203.5        4.4       ?       ? 
1 1 1   43   25   15 o    306.8    2.9    0.0000   0.0000          ?        ?   941.8194  17.8786          ?        ?      306.8        2.9       ?       ? 
1 1 1   43   25   16 o    119.7    5.3    0.0000   0.0000          ?        ?   143.6674  12.7704          ?        ?      119.7        5.3       ?       ? 
1 1 1   43   25   17 o    272.7    3.2    0.0000   0.0000          ?        ?   744.5162  17.2401          ?        ?      272.7        3.2       ?       ? 
1 1 1   43   25   18 o    176.0    4.2    0.0000   0.0000          ?        ?   310.3215  14.6860          ?        ?      176.0        4.2       ?       ? 
1 1 1   43   25   19 o    269.5    3.4    0.0000   0.0000          ?        ?   727.2761  18.5171          ?        ?      269.5        3.4       ?       ? 
1 1 1   43   25   20 o    178.8    4.5    0.0000   0.0000          ?        ?   320.5379  15.9630          ?        ?      178.8        4.5       ?       ? 
1 1 1   43   25   21 o     29.6   13.0    0.0000   0.0000          ?        ?    -3.1926  14.6860          ?        ?       29.6       13.0       ?       ? 
1 1 1   43   25   22 o     61.6    8.8    0.0000   0.0000          ?        ?    38.3113  10.8549          ?        ?       61.6        8.8       ?       ? 
1 1 1   43   25   23 o    122.1    4.7    0.0000   0.0000          ?        ?   149.4141  11.4934          ?        ?      122.1        4.7       ?       ? 
1 1 1   43   25   24 o    139.4    4.4    0.0000   0.0000          ?        ?   194.7491  12.1319          ?        ?      139.4        4.4       ?       ? 
1 1 1   43   25   25 o     64.6    9.4    0.0000   0.0000          ?        ?    42.1424  12.1319          ?        ?       64.6        9.4       ?       ? 
1 1 1   43   25   26 o    181.7    3.9    0.0000   0.0000          ?        ?   330.7542  14.0475          ?        ?      181.7        3.9       ?       ? 
1 1 1   43   25   27 o     44.0   13.7    0.0000   0.0000          ?        ?    19.7942  13.4090          ?        ?       44.0       13.7       ?       ? 
1 1 1   43   25   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43   25   29 o     22.7   10.9    0.0000   0.0000          ?        ?   -19.1556  14.0475          ?        ?       22.7       10.9       ?       ? 
1 1 1   43   25   30 o    119.0    5.9    0.0000   0.0000          ?        ?   142.3903  14.0475          ?        ?      119.0        5.9       ?       ? 
1 1 1   43   25   31 o    122.1    6.0    0.0000   0.0000          ?        ?   150.0526  14.6860          ?        ?      122.1        6.0       ?       ? 
1 1 1   43   25   32 o    158.3    4.8    0.0000   0.0000          ?        ?   251.5775  15.3245          ?        ?      158.3        4.8       ?       ? 
1 1 1   43   25   33 o     26.4   12.1    0.0000   0.0000          ?        ?   -10.2163  14.6860          ?        ?       26.4       12.1       ?       ? 
1 1 1   43   25   34 o    117.5    6.8    0.0000   0.0000          ?        ?   139.1977  15.9630          ?        ?      117.5        6.8       ?       ? 
1 1 1   43   25   35 o     73.0   10.1    0.0000   0.0000          ?        ?    54.2743  14.6860          ?        ?       73.0       10.1       ?       ? 
1 1 1   43   25   36 f     41.5   14.7    0.0000   0.0000          ?        ?    15.9630  15.3245          ?        ?       41.5       14.7       ?       ? 
1 1 1   43   26    0 o     89.2   11.0   83.6463  19.1556    83.6463  19.1556    83.6463  19.1556       89.2     11.0       89.2       11.0     0.0     0.0 
1 1 1   43   26    1 o    245.4    3.8    0.0000   0.0000          ?        ?   602.7644  18.5171          ?        ?      245.4        3.8       ?       ? 
1 1 1   43   26    2 o     78.1   12.7    0.0000   0.0000          ?        ?    61.9366  19.7942          ?        ?       78.1       12.7       ?       ? 
1 1 1   43   26    3 o     25.0   12.2    0.0000   0.0000          ?        ?   -35.7572  19.7942          ?        ?       25.0       12.2       ?       ? 
1 1 1   43   26    4 o    157.4    5.3    0.0000   0.0000          ?        ?   248.3849  16.6016          ?        ?      157.4        5.3       ?       ? 
1 1 1   43   26    5 o    246.7    4.3    0.0000   0.0000          ?        ?   609.7881  21.0712          ?        ?      246.7        4.3       ?       ? 
1 1 1   43   26    6 o    169.6    5.6    0.0000   0.0000          ?        ?   288.6118  19.1556          ?        ?      169.6        5.6       ?       ? 
1 1 1   43   26    7 o     27.3   11.5    0.0000   0.0000          ?        ?     0.6385  10.8549          ?        ?       27.3       11.5       ?       ? 
1 1 1   43   26    8 o    123.1    5.7    0.0000   0.0000          ?        ?   151.9681  14.0475          ?        ?      123.1        5.7       ?       ? 
1 1 1   43   26    9 o     79.7    7.6    0.0000   0.0000          ?        ?    63.8522  12.1319          ?        ?       79.7        7.6       ?       ? 
1 1 1   43   26   10 o    254.2    3.8    0.0000   0.0000          ?        ?   646.8224  19.1556          ?        ?      254.2        3.8       ?       ? 
1 1 1   43   26   11 o    411.8    4.5    0.0000   0.0000          ?        ?  1699.1061  37.0343          ?        ?      411.8        4.5       ?       ? 
1 1 1   43   26   12 f    123.0    6.7    0.0000   0.0000          ?        ?   151.9681  16.6016          ?        ?      123.0        6.7       ?       ? 
1 1 1   43   26   13 o    110.2    6.7    0.0000   0.0000          ?        ?   121.9576  14.6860          ?        ?      110.2        6.7       ?       ? 
1 1 1   43   26   14 o    283.3    3.6    0.0000   0.0000          ?        ?   803.8987  20.4327          ?        ?      283.3        3.6       ?       ? 
1 1 1   43   26   15 o    254.6    3.3    0.0000   0.0000          ?        ?   648.7380  16.6016          ?        ?      254.6        3.3       ?       ? 
1 1 1   43   26   16 o    368.3    3.2    0.0000   0.0000          ?        ?  1358.1355  23.6253          ?        ?      368.3        3.2       ?       ? 
1 1 1   43   26   17 o    146.7    4.6    0.0000   0.0000          ?        ?   215.8203  13.4090          ?        ?      146.7        4.6       ?       ? 
1 1 1   43   26   18 o    222.7    3.6    0.0000   0.0000          ?        ?   496.7698  15.9630          ?        ?      222.7        3.6       ?       ? 
1 1 1   43   26   19 o    204.8    3.9    0.0000   0.0000          ?        ?   420.1472  15.9630          ?        ?      204.8        3.9       ?       ? 
1 1 1   43   26   20 o    291.2    3.2    0.0000   0.0000          ?        ?   849.2338  18.5171          ?        ?      291.2        3.2       ?       ? 
1 1 1   43   26   21 o    230.0    3.7    0.0000   0.0000          ?        ?   529.9730  17.2401          ?        ?      230.0        3.7       ?       ? 
1 1 1   43   26   22 o     67.3   10.9    0.0000   0.0000          ?        ?    45.9736  14.6860          ?        ?       67.3       10.9       ?       ? 
1 1 1   43   26   23 f    272.9    2.6    0.0000   0.0000          ?        ?   745.1547  14.0475          ?        ?      272.9        2.6       ?       ? 
1 1 1   43   26   24 f    195.3    3.3    0.0000   0.0000          ?        ?   381.8359  12.7704          ?        ?      195.3        3.3       ?       ? 
1 1 1   43   26   25 o    173.2    3.9    0.0000   0.0000          ?        ?   300.7437  13.4090          ?        ?      173.2        3.9       ?       ? 
1 1 1   43   26   26 o     16.1    8.1    0.0000   0.0000          ?        ?   -43.4195  12.7704          ?        ?       16.1        8.1       ?       ? 
1 1 1   43   26   27 o    135.1    5.0    0.0000   0.0000          ?        ?   183.2557  13.4090          ?        ?      135.1        5.0       ?       ? 
1 1 1   43   26   28 o    263.0    2.9    0.0000   0.0000          ?        ?   692.7960  15.3245          ?        ?      263.0        2.9       ?       ? 
1 1 1   43   26   29 o     78.6    8.9    0.0000   0.0000          ?        ?    62.5751  14.0475          ?        ?       78.6        8.9       ?       ? 
1 1 1   43   26   30 o    103.5    6.5    0.0000   0.0000          ?        ?   107.9102  13.4090          ?        ?      103.5        6.5       ?       ? 
1 1 1   43   26   31 o    204.7    3.6    0.0000   0.0000          ?        ?   420.1472  14.6860          ?        ?      204.7        3.6       ?       ? 
1 1 1   43   26   32 o    280.9    3.1    0.0000   0.0000          ?        ?   790.4898  17.2401          ?        ?      280.9        3.1       ?       ? 
1 1 1   43   26   33 o    142.2    4.9    0.0000   0.0000          ?        ?   203.0499  14.0475          ?        ?      142.2        4.9       ?       ? 
1 1 1   43   26   34 o     29.4   12.9    0.0000   0.0000          ?        ?    -3.1926  14.6860          ?        ?       29.4       12.9       ?       ? 
1 1 1   43   27    0 o    264.8   11.7  710.0360  61.9366   710.0360  61.9366   710.0360  61.9366      264.8     11.7      264.8       11.7     0.0     0.0 
1 1 1   43   27    1 o     65.6   24.4    0.0000   0.0000          ?        ?    37.0343  42.7809          ?        ?       65.6       24.4       ?       ? 
1 1 1   43   27    2 o     71.9   23.3    0.0000   0.0000          ?        ?    53.6358  38.3113          ?        ?       71.9       23.3       ?       ? 
1 1 1   43   27    3 o    133.1    7.0    0.0000   0.0000          ?        ?   178.1475  18.5171          ?        ?      133.1        7.0       ?       ? 
1 1 1   43   27    4 o     51.0   15.5    0.0000   0.0000          ?        ?    26.8179  17.2401          ?        ?       51.0       15.5       ?       ? 
1 1 1   43   27    5 o     60.5   16.1    0.0000   0.0000          ?        ?    38.9498  19.7942          ?        ?       60.5       16.1       ?       ? 
1 1 1   43   27    6 o     78.3    9.4    0.0000   0.0000          ?        ?    61.9366  14.6860          ?        ?       78.3        9.4       ?       ? 
1 1 1   43   27    7 o    107.4    8.0    0.0000   0.0000          ?        ?   116.2109  17.2401          ?        ?      107.4        8.0       ?       ? 
1 1 1   43   27    8 o    157.7    5.7    0.0000   0.0000          ?        ?   249.6619  17.8786          ?        ?      157.7        5.7       ?       ? 
1 1 1   43   27    9 o    134.4    6.7    0.0000   0.0000          ?        ?   181.3401  17.8786          ?        ?      134.4        6.7       ?       ? 
1 1 1   43   27   10 o     36.1   15.4    0.0000   0.0000          ?        ?     0.0000  19.7942          ?        ?       36.1       15.4       ?       ? 
1 1 1   43   27   11 o     53.8   13.1    0.0000   0.0000          ?        ?    30.6490  14.0475          ?        ?       53.8       13.1       ?       ? 
1 1 1   43   27   12 f     43.9   13.4    0.0000   0.0000          ?        ?    19.7942  12.7704          ?        ?       43.9       13.4       ?       ? 
1 1 1   43   27   13 o    287.4    3.6    0.0000   0.0000          ?        ?   826.8855  20.4327          ?        ?      287.4        3.6       ?       ? 
1 1 1   43   27   14 o     37.0   14.4    0.0000   0.0000          ?        ?     8.9393  15.3245          ?        ?       37.0       14.4       ?       ? 
1 1 1   43   27   15 o    163.3    5.3    0.0000   0.0000          ?        ?   267.5406  17.2401          ?        ?      163.3        5.3       ?       ? 
1 1 1   43   27   16 o    290.3    2.9    0.0000   0.0000          ?        ?   843.4871  16.6016          ?        ?      290.3        2.9       ?       ? 
1 1 1   43   27   17 o    132.8    4.8    0.0000   0.0000          ?        ?   176.8705  12.7704          ?        ?      132.8        4.8       ?       ? 
1 1 1   43   27   18 o    177.3    4.0    0.0000   0.0000          ?        ?   314.7912  14.0475          ?        ?      177.3        4.0       ?       ? 
1 1 1   43   27   19 o     98.2    7.2    0.0000   0.0000          ?        ?    97.0553  14.0475          ?        ?       98.2        7.2       ?       ? 
1 1 1   43   27   20 o     31.6   13.1    0.0000   0.0000          ?        ?     3.1926  13.4090          ?        ?       31.6       13.1       ?       ? 
1 1 1   43   27   21 o    106.3    6.6    0.0000   0.0000          ?        ?   113.6568  14.0475          ?        ?      106.3        6.6       ?       ? 
1 1 1   43   27   22 o     88.3    7.6    0.0000   0.0000          ?        ?    78.5382  13.4090          ?        ?       88.3        7.6       ?       ? 
1 1 1   43   27   23 o    144.4    3.5    0.0000   0.0000          ?        ?   208.7966  10.2163          ?        ?      144.4        3.5       ?       ? 
1 1 1   43   27   24 o     81.6    6.6    0.0000   0.0000          ?        ?    67.0448  10.8549          ?        ?       81.6        6.6       ?       ? 
1 1 1   43   27   25 o     92.5    6.6    0.0000   0.0000          ?        ?    86.2004  12.1319          ?        ?       92.5        6.6       ?       ? 
1 1 1   43   27   26 o     77.1    7.9    0.0000   0.0000          ?        ?    60.0210  12.1319          ?        ?       77.1        7.9       ?       ? 
1 1 1   43   27   27 o    126.0    5.3    0.0000   0.0000          ?        ?   159.6304  13.4090          ?        ?      126.0        5.3       ?       ? 
1 1 1   43   27   28 o    126.0    5.3    0.0000   0.0000          ?        ?   159.6304  13.4090          ?        ?      126.0        5.3       ?       ? 
1 1 1   43   27   29 o    147.3    4.6    0.0000   0.0000          ?        ?   217.7359  13.4090          ?        ?      147.3        4.6       ?       ? 
1 1 1   43   27   30 o    281.0    3.0    0.0000   0.0000          ?        ?   791.1283  16.6016          ?        ?      281.0        3.0       ?       ? 
1 1 1   43   27   31 o     34.7   13.5    0.0000   0.0000          ?        ?     8.3008  13.4090          ?        ?       34.7       13.5       ?       ? 
1 1 1   43   27   32 o    290.9    3.0    0.0000   0.0000          ?        ?   847.9567  17.2401          ?        ?      290.9        3.0       ?       ? 
1 1 1   43   28    0 o    105.2   43.2  166.0156  89.3930   166.0156  89.3930   166.0156  89.3930      105.2     43.2      105.2       43.2     0.0     0.0 
1 1 1   43   28    1 f    140.0   16.2    0.0000   0.0000          ?        ?   201.7728  45.3350          ?        ?      140.0       16.2       ?       ? 
1 1 1   43   28    2 o     38.4   18.5    0.0000   0.0000          ?        ?   -58.1055  41.5039          ?        ?       38.4       18.5       ?       ? 
1 1 1   43   28    3 o     60.6   24.4    0.0000   0.0000          ?        ?    21.7097  45.3350          ?        ?       60.6       24.4       ?       ? 
1 1 1   43   28    4 o    173.4   10.1    0.0000   0.0000          ?        ?   303.9363  35.1187          ?        ?      173.4       10.1       ?       ? 
1 1 1   43   28    5 o    178.6    5.2    0.0000   0.0000          ?        ?   319.8993  18.5171          ?        ?      178.6        5.2       ?       ? 
1 1 1   43   28    6 o    240.5    5.6    0.0000   0.0000          ?        ?   580.4161  26.8179          ?        ?      240.5        5.6       ?       ? 
1 1 1   43   28    7 o    146.3    8.3    0.0000   0.0000          ?        ?   215.8203  24.2638          ?        ?      146.3        8.3       ?       ? 
1 1 1   43   28    8 o    164.5    5.2    0.0000   0.0000          ?        ?   271.3717  17.2401          ?        ?      164.5        5.2       ?       ? 
1 1 1   43   28    9 o    190.1    5.4    0.0000   0.0000          ?        ?   362.6803  20.4327          ?        ?      190.1        5.4       ?       ? 
1 1 1   43   28   10 o    159.8    6.8    0.0000   0.0000          ?        ?   256.6857  21.7097          ?        ?      159.8        6.8       ?       ? 
1 1 1   43   28   11 o    247.9    4.8    0.0000   0.0000          ?        ?   616.1733  23.6253          ?        ?      247.9        4.8       ?       ? 
1 1 1   43   28   12 o    406.9    4.4    0.0000   0.0000          ?        ?  1659.5177  35.7572          ?        ?      406.9        4.4       ?       ? 
1 1 1   43   28   13 o    107.8    9.2    0.0000   0.0000          ?        ?   117.4880  19.7942          ?        ?      107.8        9.2       ?       ? 
1 1 1   43   28   14 o     80.8    7.9    0.0000   0.0000          ?        ?    65.7677  12.7704          ?        ?       80.8        7.9       ?       ? 
1 1 1   43   28   15 o     59.8   12.2    0.0000   0.0000          ?        ?    37.6728  14.0475          ?        ?       59.8       12.2       ?       ? 
1 1 1   43   28   16 o     79.1    9.3    0.0000   0.0000          ?        ?    63.2136  14.6860          ?        ?       79.1        9.3       ?       ? 
1 1 1   43   28   17 o    115.0    5.3    0.0000   0.0000          ?        ?   132.8125  12.1319          ?        ?      115.0        5.3       ?       ? 
1 1 1   43   28   18 o    250.1    3.1    0.0000   0.0000          ?        ?   626.3897  15.3245          ?        ?      250.1        3.1       ?       ? 
1 1 1   43   28   19 o    257.4    3.2    0.0000   0.0000          ?        ?   663.4240  16.6016          ?        ?      257.4        3.2       ?       ? 
1 1 1   43   28   20 o    192.2    3.8    0.0000   0.0000          ?        ?   370.3425  14.6860          ?        ?      192.2        3.8       ?       ? 
1 1 1   43   28   21 o    161.4    4.6    0.0000   0.0000          ?        ?   261.1554  14.6860          ?        ?      161.4        4.6       ?       ? 
1 1 1   43   28   22 o     56.3   13.2    0.0000   0.0000          ?        ?    33.8416  14.6860          ?        ?       56.3       13.2       ?       ? 
1 1 1   43   28   23 o    192.7    4.0    0.0000   0.0000          ?        ?   372.2581  15.3245          ?        ?      192.7        4.0       ?       ? 
1 1 1   43   28   24 f    100.9    5.1    0.0000   0.0000          ?        ?   102.1635  10.2163          ?        ?      100.9        5.1       ?       ? 
1 1 1   43   28   25 o    108.4    5.3    0.0000   0.0000          ?        ?   118.1265  11.4934          ?        ?      108.4        5.3       ?       ? 
1 1 1   43   28   26 o    200.4    3.3    0.0000   0.0000          ?        ?   402.2686  13.4090          ?        ?      200.4        3.3       ?       ? 
1 1 1   43   28   27 o     25.2   11.5    0.0000   0.0000          ?        ?    -7.6623  12.7704          ?        ?       25.2       11.5       ?       ? 
1 1 1   43   28   28 o    247.1    3.0    0.0000   0.0000          ?        ?   611.7037  14.6860          ?        ?      247.1        3.0       ?       ? 
1 1 1   43   28   29 o    109.8    5.8    0.0000   0.0000          ?        ?   121.3191  12.7704          ?        ?      109.8        5.8       ?       ? 
1 1 1   43   28   30 o     58.3   12.4    0.0000   0.0000          ?        ?    36.3957  14.0475          ?        ?       58.3       12.4       ?       ? 
1 1 1   43   29    0 o    123.5   33.8  190.9180  72.1529   190.9180  72.1529   190.9180  72.1529      123.5     33.8      123.5       33.8     0.0     0.0 
1 1 1   43   29    1 o    183.9   11.3    0.0000   0.0000          ?        ?   343.5246  41.5039          ?        ?      183.9       11.3       ?       ? 
1 1 1   43   29    2 o    287.6    7.5    0.0000   0.0000          ?        ?   832.6321  43.4195          ?        ?      287.6        7.5       ?       ? 
1 1 1   43   29    3 o    151.8   10.7    0.0000   0.0000          ?        ?   233.6989  32.5646          ?        ?      151.8       10.7       ?       ? 
1 1 1   43   29    4 o    334.5    8.1    0.0000   0.0000          ?        ?  1127.6293  54.2743          ?        ?      334.5        8.1       ?       ? 
1 1 1   43   29    5 o    139.1   12.6    0.0000   0.0000          ?        ?   197.3032  35.1187          ?        ?      139.1       12.6       ?       ? 
1 1 1   43   29    6 o    253.9    6.5    0.0000   0.0000          ?        ?   648.0994  33.2031          ?        ?      253.9        6.5       ?       ? 
1 1 1   43   29    7 o    201.0    9.5    0.0000   0.0000          ?        ?   408.6538  38.3113          ?        ?      201.0        9.5       ?       ? 
1 1 1   43   29    8 o    484.1    5.7    0.0000   0.0000          ?        ?  2353.5908  55.5514          ?        ?      484.1        5.7       ?       ? 
1 1 1   43   29    9 o    242.0    5.5    0.0000   0.0000          ?        ?   588.0784  26.8179          ?        ?      242.0        5.5       ?       ? 
1 1 1   43   29   10 o     83.2   10.7    0.0000   0.0000          ?        ?    70.2374  17.8786          ?        ?       83.2       10.7       ?       ? 
1 1 1   43   29   11 o    182.5    6.1    0.0000   0.0000          ?        ?   334.5853  22.3483          ?        ?      182.5        6.1       ?       ? 
1 1 1   43   29   12 o     41.6   16.7    0.0000   0.0000          ?        ?     9.5778  21.0712          ?        ?       41.6       16.7       ?       ? 
1 1 1   43   29   13 o    263.4    5.0    0.0000   0.0000          ?        ?   695.9886  26.1794          ?        ?      263.4        5.0       ?       ? 
1 1 1   43   29   14 o    270.4    5.4    0.0000   0.0000          ?        ?   734.2999  29.3720          ?        ?      270.4        5.4       ?       ? 
1 1 1   43   29   15 o     49.3   18.6    0.0000   0.0000          ?        ?    19.7942  24.9023          ?        ?       49.3       18.6       ?       ? 
1 1 1   43   29   16 o    133.7    4.8    0.0000   0.0000          ?        ?   179.4246  12.7704          ?        ?      133.7        4.8       ?       ? 
1 1 1   43   29   17 o    137.3    4.4    0.0000   0.0000          ?        ?   189.0024  12.1319          ?        ?      137.3        4.4       ?       ? 
1 1 1   43   29   18 o    134.9    4.5    0.0000   0.0000          ?        ?   182.6172  12.1319          ?        ?      134.9        4.5       ?       ? 
1 1 1   43   29   19 o    130.5    5.4    0.0000   0.0000          ?        ?   171.1238  14.0475          ?        ?      130.5        5.4       ?       ? 
1 1 1   43   29   20 o    128.3    5.0    0.0000   0.0000          ?        ?   165.3771  12.7704          ?        ?      128.3        5.0       ?       ? 
1 1 1   43   29   21 o     26.5   12.0    0.0000   0.0000          ?        ?    -6.3852  13.4090          ?        ?       26.5       12.0       ?       ? 
1 1 1   43   29   22 o     78.6    8.9    0.0000   0.0000          ?        ?    62.5751  14.0475          ?        ?       78.6        8.9       ?       ? 
1 1 1   43   29   23 f    111.7    6.6    0.0000   0.0000          ?        ?   125.7888  14.6860          ?        ?      111.7        6.6       ?       ? 
1 1 1   43   29   24 f    156.5    4.7    0.0000   0.0000          ?        ?   245.8308  14.6860          ?        ?      156.5        4.7       ?       ? 
1 1 1   43   29   25 o    153.1    3.8    0.0000   0.0000          ?        ?   234.9760  11.4934          ?        ?      153.1        3.8       ?       ? 
1 1 1   43   29   26 o    194.5    3.3    0.0000   0.0000          ?        ?   379.2819  12.7704          ?        ?      194.5        3.3       ?       ? 
1 1 1   43   29   27 o    391.2    2.5    0.0000   0.0000          ?        ?  1532.4519  19.7942          ?        ?      391.2        2.5       ?       ? 
1 1 1   43   30    0 o    237.7   16.1  582.3317  75.9841   582.3317  75.9841   582.3317  75.9841      237.7     16.1      237.7       16.1     0.0     0.0 
1 1 1   43   30    1 o    117.5   21.7    0.0000   0.0000          ?        ?   150.6911  49.1662          ?        ?      117.5       21.7       ?       ? 
1 1 1   43   30    2 o     91.0   27.7    0.0000   0.0000          ?        ?    93.2242  54.9129          ?        ?       91.0       27.7       ?       ? 
1 1 1   43   30    3 o    192.4   15.6    0.0000   0.0000          ?        ?   382.4745  60.0210          ?        ?      192.4       15.6       ?       ? 
1 1 1   43   30    4 o     41.7   19.5    0.0000   0.0000          ?        ?   -34.4802  40.2269          ?        ?       41.7       19.5       ?       ? 
1 1 1   43   30    5 o     87.4   20.4    0.0000   0.0000          ?        ?    83.6463  35.1187          ?        ?       87.4       20.4       ?       ? 
1 1 1   43   30    6 o    270.0   15.6    0.0000   0.0000          ?        ?   753.4555  84.2849          ?        ?      270.0       15.6       ?       ? 
1 1 1   43   30    7 o    181.8   18.1    0.0000   0.0000          ?        ?   345.4402  65.7677          ?        ?      181.8       18.1       ?       ? 
1 1 1   43   30    8 o    141.6   14.2    0.0000   0.0000          ?        ?   206.2425  40.2269          ?        ?      141.6       14.2       ?       ? 
1 1 1   43   30    9 o    248.7   11.4    0.0000   0.0000          ?        ?   630.2208  56.8284          ?        ?      248.7       11.4       ?       ? 
1 1 1   43   30   10 o     88.8   14.0    0.0000   0.0000          ?        ?    81.0922  24.9023          ?        ?       88.8       14.0       ?       ? 
1 1 1   43   30   11 o    208.7    4.0    0.0000   0.0000          ?        ?   436.7488  16.6016          ?        ?      208.7        4.0       ?       ? 
1 1 1   43   30   12 o    393.4    5.1    0.0000   0.0000          ?        ?  1553.5232  40.2269          ?        ?      393.4        5.1       ?       ? 
1 1 1   43   30   13 o     37.1   16.4    0.0000   0.0000          ?        ?    -5.1082  23.6253          ?        ?       37.1       16.4       ?       ? 
1 1 1   43   30   14 o    133.3    8.1    0.0000   0.0000          ?        ?   179.4246  21.7097          ?        ?      133.3        8.1       ?       ? 
1 1 1   43   30   15 o    167.3    7.1    0.0000   0.0000          ?        ?   282.2266  23.6253          ?        ?      167.3        7.1       ?       ? 
1 1 1   43   30   16 o    217.0    5.6    0.0000   0.0000          ?        ?   473.1445  24.2638          ?        ?      217.0        5.6       ?       ? 
1 1 1   43   30   17 o    177.9    4.1    0.0000   0.0000          ?        ?   317.3452  14.6860          ?        ?      177.9        4.1       ?       ? 
1 1 1   43   30   18 f    259.5    3.0    0.0000   0.0000          ?        ?   674.2788  15.3245          ?        ?      259.5        3.0       ?       ? 
1 1 1   43   30   19 o    131.3    4.9    0.0000   0.0000          ?        ?   173.0394  12.7704          ?        ?      131.3        4.9       ?       ? 
1 1 1   43   30   20 o     95.5    7.0    0.0000   0.0000          ?        ?    91.9471  13.4090          ?        ?       95.5        7.0       ?       ? 
1 1 1   43   30   21 o     66.2   10.1    0.0000   0.0000          ?        ?    44.6965  13.4090          ?        ?       66.2       10.1       ?       ? 
1 1 1   43   30   22 o    216.1    3.7    0.0000   0.0000          ?        ?   468.0364  15.9630          ?        ?      216.1        3.7       ?       ? 
1 1 1   43   30   23 o     87.7    8.0    0.0000   0.0000          ?        ?    77.8996  14.0475          ?        ?       87.7        8.0       ?       ? 
1 1 1   43   30   24 o    307.2    2.9    0.0000   0.0000          ?        ?   945.6506  17.8786          ?        ?      307.2        2.9       ?       ? 
1 1 1   43   31    0 o     71.0   41.0   80.4537  92.5856    80.4537  92.5856    80.4537  92.5856       71.0     41.0       71.0       41.0     0.0     0.0 
1 1 1   43   31    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43   31    2 o    114.5   26.0    0.0000   0.0000          ?        ?   149.4141  58.1055          ?        ?      114.5       26.0       ?       ? 
1 1 1   43   31    3 o     39.2   17.5    0.0000   0.0000          ?        ?    -9.5778  28.0950          ?        ?       39.2       17.5       ?       ? 
1 1 1   43   31    4 o    176.7   11.6    0.0000   0.0000          ?        ?   318.6223  40.8654          ?        ?      176.7       11.6       ?       ? 
1 1 1   43   31    5 o    240.1   12.0    0.0000   0.0000          ?        ?   589.3555  57.4669          ?        ?      240.1       12.0       ?       ? 
1 1 1   43   31    6 o    183.0   12.2    0.0000   0.0000          ?        ?   342.8861  44.6965          ?        ?      183.0       12.2       ?       ? 
1 1 1   43   31    7 o    140.1   28.3    0.0000   0.0000          ?        ?   226.6752  76.6226          ?        ?      140.1       28.3       ?       ? 
1 1 1   43   31    8 o    281.6   17.0    0.0000   0.0000          ?        ?   830.0781  95.7782          ?        ?      281.6       17.0       ?       ? 
1 1 1   43   31    9 o    196.0   10.8    0.0000   0.0000          ?        ?   391.4138  42.1424          ?        ?      196.0       10.8       ?       ? 
1 1 1   43   31   10 o    134.5   28.4    0.0000   0.0000          ?        ?   210.7121  74.0685          ?        ?      134.5       28.4       ?       ? 
1 1 1   43   31   11 o     42.6   20.2    0.0000   0.0000          ?        ?   -49.8047  46.6121          ?        ?       42.6       20.2       ?       ? 
1 1 1   43   31   12 o     84.0    8.7    0.0000   0.0000          ?        ?    71.5144  14.6860          ?        ?       84.0        8.7       ?       ? 
1 1 1   43   31   13 o    228.2    3.9    0.0000   0.0000          ?        ?   522.3107  17.8786          ?        ?      228.2        3.9       ?       ? 
1 1 1   43   31   14 o    113.5    7.9    0.0000   0.0000          ?        ?   130.2584  17.8786          ?        ?      113.5        7.9       ?       ? 
1 1 1   43   31   15 o     85.3   12.0    0.0000   0.0000          ?        ?    74.7070  20.4327          ?        ?       85.3       12.0       ?       ? 
1 1 1   43   31   16 o    184.8    6.6    0.0000   0.0000          ?        ?   344.1632  24.2638          ?        ?      184.8        6.6       ?       ? 
1 1 1   43   31   17 o    116.4   10.7    0.0000   0.0000          ?        ?   138.5592  24.9023          ?        ?      116.4       10.7       ?       ? 
1 1 1   43   31   18 o    195.5    4.4    0.0000   0.0000          ?        ?   383.7515  17.2401          ?        ?      195.5        4.4       ?       ? 
1 1 1   43   31   19 o     87.3    5.5    0.0000   0.0000          ?        ?    76.6226   9.5778          ?        ?       87.3        5.5       ?       ? 
1 1 1   43   31   20 o    131.5    4.4    0.0000   0.0000          ?        ?   173.6779  11.4934          ?        ?      131.5        4.4       ?       ? 
1 1 1   43   32    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43   32    1 o    104.7   26.7    0.0000   0.0000          ?        ?   127.7043  56.1899          ?        ?      104.7       26.7       ?       ? 
1 1 1   43   32    2 o     87.5   28.1    0.0000   0.0000          ?        ?    88.1160  55.5514          ?        ?       87.5       28.1       ?       ? 
1 1 1   43   32    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43   32    4 o    111.1   21.2    0.0000   0.0000          ?        ?   136.6436  45.3350          ?        ?      111.1       21.2       ?       ? 
1 1 1   43   32    5 f    106.4   25.3    0.0000   0.0000          ?        ?   130.2584  52.9973          ?        ?      106.4       25.3       ?       ? 
1 1 1   43   32    6 o     58.5   26.5    0.0000   0.0000          ?        ?   -18.5171  66.4062          ?        ?       58.5       26.5       ?       ? 
1 1 1   43   32    7 o     51.7   24.7    0.0000   0.0000          ?        ?   -72.7915  70.8759          ?        ?       51.7       24.7       ?       ? 
1 1 1   43   32    8 o    129.1   18.8    0.0000   0.0000          ?        ?   177.5090  48.5276          ?        ?      129.1       18.8       ?       ? 
1 1 1   43   32    9 o    207.6   20.1    0.0000   0.0000          ?        ?   463.5667  83.6463          ?        ?      207.6       20.1       ?       ? 
1 1 1   43   32   10 o    141.9   28.9    0.0000   0.0000          ?        ?   238.1686  79.1767          ?        ?      141.9       28.9       ?       ? 
1 1 1   43   32   11 o    140.9   26.8    0.0000   0.0000          ?        ?   230.5063  72.7915          ?        ?      140.9       26.8       ?       ? 
1 1 1   43   32   12 f    244.5   12.3    0.0000   0.0000          ?        ?   615.5349  60.0210          ?        ?      244.5       12.3       ?       ? 
1 1 1   43   32   13 o    105.2    8.8    0.0000   0.0000          ?        ?   112.3798  18.5171          ?        ?      105.2        8.8       ?       ? 
1 1 1   43   32   14 o    146.8    5.9    0.0000   0.0000          ?        ?   217.0974  17.2401          ?        ?      146.8        5.9       ?       ? 
1 1 1   43   32   15 o    140.5    6.6    0.0000   0.0000          ?        ?   199.2188  18.5171          ?        ?      140.5        6.6       ?       ? 
1 1 1   43   32   16 o     22.8   11.1    0.0000   0.0000          ?        ?   -26.8179  15.9630          ?        ?       22.8       11.1       ?       ? 
1 1 1   43   33    0 o     64.7   37.1   68.3218  74.7070    68.3218  74.7070    68.3218  74.7070       64.7     37.1       64.7       37.1     0.0     0.0 
1 1 1   43   33    1 o     63.2   28.1    0.0000   0.0000          ?        ?    -3.1926  71.5144          ?        ?       63.2       28.1       ?       ? 
1 1 1   43   33    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   43   33    3 o     56.0   26.3    0.0000   0.0000          ?        ?   -51.7203  74.7070          ?        ?       56.0       26.3       ?       ? 
1 1 1   43   33    4 o    232.5   17.7    0.0000   0.0000          ?        ?   574.6694  82.3693          ?        ?      232.5       17.7       ?       ? 
1 1 1   43   33    5 o    108.8   23.8    0.0000   0.0000          ?        ?   136.0051  50.4432          ?        ?      108.8       23.8       ?       ? 
1 1 1   43   33    6 o    143.2   18.7    0.0000   0.0000          ?        ?   219.6514  53.6358          ?        ?      143.2       18.7       ?       ? 
1 1 1   43   33    7 o    270.5   12.4    0.0000   0.0000          ?        ?   754.7325  67.0448          ?        ?      270.5       12.4       ?       ? 
1 1 1   43   33    8 o    249.8   14.3    0.0000   0.0000          ?        ?   650.6536  71.5144          ?        ?      249.8       14.3       ?       ? 
1 1 1   43   33    9 o    290.2    9.5    0.0000   0.0000          ?        ?   858.1730  54.9129          ?        ?      290.2        9.5       ?       ? 
1 1 1   43   33   10 o     98.4   37.0    0.0000   0.0000          ?        ?   123.2347  98.9709          ?        ?       98.4       37.0       ?       ? 
1 1 1   44    0    0 o   1056.2    7.8 11160.0811 164.7386 11160.0811 164.7386 11160.0811 164.7386     1056.2      7.8     1056.2        7.8     0.0     0.0 
1 1 1   44    0    1 o    711.0    4.2 5057.0913  60.0210  5057.0913  60.0210  5057.0913  60.0210      711.0      4.2      711.0        4.2     0.0     0.0 
1 1 1   44    0    2 o    287.9    3.7  829.4396  21.0712   829.4396  21.0712   829.4396  21.0712      287.9      3.7      287.9        3.7     0.0     0.0 
1 1 1   44    0    3 o    740.2    4.4 5479.7925  64.4907  5479.7925  64.4907  5479.7925  64.4907      740.2      4.4      740.2        4.4     0.0     0.0 
1 1 1   44    0    4 f     44.6   18.7   28.0950  16.6016    28.0950  16.6016    28.0950  16.6016       44.6     18.7       44.6       18.7     0.0     0.0 
1 1 1   44    0    5 o     13.0    9.8  -65.1292  19.7942   -65.1292  19.7942   -65.1292  19.7942       13.0      9.8       13.0        9.8     0.0     0.0 
1 1 1   44    0    6 o    576.9    3.7 3329.2520  42.7809  3329.2520  42.7809  3329.2520  42.7809      576.9      3.7      576.9        3.7     0.0     0.0 
1 1 1   44    0    7 o    256.5    4.2  658.3158  21.7097   658.3158  21.7097   658.3158  21.7097      256.5      4.2      256.5        4.2     0.0     0.0 
1 1 1   44    0    8 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    0    9 o    452.9    3.7 2051.5698  33.2031  2051.5698  33.2031  2051.5698  33.2031      452.9      3.7      452.9        3.7     0.0     0.0 
1 1 1   44    0   10 o     76.2   11.4   60.6596  16.6016    60.6596  16.6016    60.6596  16.6016       76.2     11.4       76.2       11.4     0.0     0.0 
1 1 1   44    0   11 o    143.3    5.4  206.2425  15.3245   206.2425  15.3245   206.2425  15.3245      143.3      5.4      143.3        5.4     0.0     0.0 
1 1 1   44    0   12 o    112.6    7.1  128.3428  15.9630   128.3428  15.9630   128.3428  15.9630      112.6      7.1      112.6        7.1     0.0     0.0 
1 1 1   44    0   13 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    0   14 o    173.2    4.8  300.7437  16.6016   300.7437  16.6016   300.7437  16.6016      173.2      4.8      173.2        4.8     0.0     0.0 
1 1 1   44    0   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    0   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    0   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    0   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    0   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    0   20 o    138.3    6.7  192.8335  18.5171   192.8335  18.5171   192.8335  18.5171      138.3      6.7      138.3        6.7     0.0     0.0 
1 1 1   44    0   21 o    111.8    8.1  127.0658  17.8786   127.0658  17.8786   127.0658  17.8786      111.8      8.1      111.8        8.1     0.0     0.0 
1 1 1   44    0   22 o    210.0    4.7  441.8569  19.7942   441.8569  19.7942   441.8569  19.7942      210.0      4.7      210.0        4.7     0.0     0.0 
1 1 1   44    0   23 o    449.9    3.5 2024.7521  31.9261  2024.7521  31.9261  2024.7521  31.9261      449.9      3.5      449.9        3.5     0.0     0.0 
1 1 1   44    0   24 o    772.1    4.3 5963.1538  65.7677  5963.1538  65.7677  5963.1538  65.7677      772.1      4.3      772.1        4.3     0.0     0.0 
1 1 1   44    0   25 o    614.8    3.8 3780.6863  47.2506  3780.6863  47.2506  3780.6863  47.2506      614.8      3.8      614.8        3.8     0.0     0.0 
1 1 1   44    0   26 o    493.1    3.8 2432.1289  37.0343  2432.1289  37.0343  2432.1289  37.0343      493.1      3.8      493.1        3.8     0.0     0.0 
1 1 1   44    0   27 o     97.2   10.0   97.6938  19.1556    97.6938  19.1556    97.6938  19.1556       97.2     10.0       97.2       10.0     0.0     0.0 
1 1 1   44    0   28 o     37.8   19.7   21.0712  19.1556    21.0712  19.1556    21.0712  19.1556       37.8     19.7       37.8       19.7     0.0     0.0 
1 1 1   44    0   29 o    714.4    4.1 5105.6187  58.1055  5105.6187  58.1055  5105.6187  58.1055      714.4      4.1      714.4        4.1     0.0     0.0 
1 1 1   44    0   30 o    473.8    3.5 2245.6807  33.2031  2245.6807  33.2031  2245.6807  33.2031      473.8      3.5      473.8        3.5     0.0     0.0 
1 1 1   44    0   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    0   32 o    178.1    6.3  318.6223  22.3483   318.6223  22.3483   318.6223  22.3483      178.1      6.3      178.1        6.3     0.0     0.0 
1 1 1   44    0   33 o    562.4    3.7 3163.8748  41.5039  3163.8748  41.5039  3163.8748  41.5039      562.4      3.7      562.4        3.7     0.0     0.0 
1 1 1   44    0   34 o    280.4    4.2  787.2972  23.6253   787.2972  23.6253   787.2972  23.6253      280.4      4.2      280.4        4.2     0.0     0.0 
1 1 1   44    0   35 o    157.0    7.1  248.3849  22.3483   248.3849  22.3483   248.3849  22.3483      157.0      7.1      157.0        7.1     0.0     0.0 
1 1 1   44    0   36 o    538.9    3.7 2905.9119  39.5883  2905.9119  39.5883  2905.9119  39.5883      538.9      3.7      538.9        3.7     0.0     0.0 
1 1 1   44    0   37 o    312.9    4.0  980.1307  24.9023   980.1307  24.9023   980.1307  24.9023      312.9      4.0      312.9        4.0     0.0     0.0 
1 1 1   44    0   38 o     65.2   19.7   52.9973  22.3483    52.9973  22.3483    52.9973  22.3483       65.2     19.7       65.2       19.7     0.0     0.0 
1 1 1   44    0   39 o     21.7   15.1  -17.8786  22.3483   -17.8786  22.3483   -17.8786  22.3483       21.7     15.1       21.7       15.1     0.0     0.0 
1 1 1   44    0   40 o    129.4    9.2  170.4853  23.6253   170.4853  23.6253   170.4853  23.6253      129.4      9.2      129.4        9.2     0.0     0.0 
1 1 1   44    0   41 o    179.5    5.9  323.7305  21.0712   323.7305  21.0712   323.7305  21.0712      179.5      5.9      179.5        5.9     0.0     0.0 
1 1 1   44    0   42 o    179.1    6.6  322.4534  23.6253   322.4534  23.6253   322.4534  23.6253      179.1      6.6      179.1        6.6     0.0     0.0 
1 1 1   44    0   43 o     16.1   11.9  -60.6596  24.2638   -60.6596  24.2638   -60.6596  24.2638       16.1     11.9       16.1       11.9     0.0     0.0 
1 1 1   44    0   44 o    260.3    4.9  678.7485  25.5409   678.7485  25.5409   678.7485  25.5409      260.3      4.9      260.3        4.9     0.0     0.0 
1 1 1   44    0   45 o    255.7    5.1  655.1232  26.1794   655.1232  26.1794   655.1232  26.1794      255.7      5.1      255.7        5.1     0.0     0.0 
1 1 1   44    0   46 o    130.2    9.2  172.4008  23.6253   172.4008  23.6253   172.4008  23.6253      130.2      9.2      130.2        9.2     0.0     0.0 
1 1 1   44    0   47 o     20.9   14.9  -29.3720  24.9023   -29.3720  24.9023   -29.3720  24.9023       20.9     14.9       20.9       14.9     0.0     0.0 
1 1 1   44    0   48 o    152.4    8.2  234.9760  24.9023   234.9760  24.9023   234.9760  24.9023      152.4      8.2      152.4        8.2     0.0     0.0 
1 1 1   44    0   49 o     18.8   13.6  -41.5039  24.9023   -41.5039  24.9023   -41.5039  24.9023       18.8     13.6       18.8       13.6     0.0     0.0 
1 1 1   44    0   50 o    478.0    3.9 2286.5459  37.6728  2286.5459  37.6728  2286.5459  37.6728      478.0      3.9      478.0        3.9     0.0     0.0 
1 1 1   44    0   51 o    168.4    7.8  286.0577  26.1794   286.0577  26.1794   286.0577  26.1794      168.4      7.8      168.4        7.8     0.0     0.0 
1 1 1   44    0   52 o    171.6    7.5  296.9126  25.5409   296.9126  25.5409   296.9126  25.5409      171.6      7.5      171.6        7.5     0.0     0.0 
1 1 1   44    0   53 o    249.4    5.4  623.8356  26.8179   623.8356  26.8179   623.8356  26.8179      249.4      5.4      249.4        5.4     0.0     0.0 
1 1 1   44    0   54 o    188.0    6.5  355.6566  24.2638   355.6566  24.2638   355.6566  24.2638      188.0      6.5      188.0        6.5     0.0     0.0 
1 1 1   44    0   55 o     59.4   23.5   49.8047  26.8179    49.8047  26.8179    49.8047  26.8179       59.4     23.5       59.4       23.5     0.0     0.0 
1 1 1   44    0   56 f    246.2    5.8  608.5111  28.7335   608.5111  28.7335   608.5111  28.7335      246.2      5.8      246.2        5.8     0.0     0.0 
1 1 1   44    0   57 o    140.5    9.4  201.1343  26.1794   201.1343  26.1794   201.1343  26.1794      140.5      9.4      140.5        9.4     0.0     0.0 
1 1 1   44    0   58 o     28.5   19.0   -3.8311  27.4564    -3.8311  27.4564    -3.8311  27.4564       28.5     19.0       28.5       19.0     0.0     0.0 
1 1 1   44    0   59 o     23.3   16.4  -26.1794  28.0950   -26.1794  28.0950   -26.1794  28.0950       23.3     16.4       23.3       16.4     0.0     0.0 
1 1 1   44    0   60 o    206.6    7.4  430.3636  30.6490   430.3636  30.6490   430.3636  30.6490      206.6      7.4      206.6        7.4     0.0     0.0 
1 1 1   44    0   61 o    218.8    6.7  482.0838  29.3720   482.0838  29.3720   482.0838  29.3720      218.8      6.7      218.8        6.7     0.0     0.0 
1 1 1   44    0   62 o     17.5   12.8  -47.2506  24.2638   -47.2506  24.2638   -47.2506  24.2638       17.5     12.8       17.5       12.8     0.0     0.0 
1 1 1   44    1    0 o    540.1    3.7 2918.0439  40.2269  2918.0439  40.2269  2918.0439  40.2269      540.1      3.7      540.1        3.7     0.0     0.0 
1 1 1   44    1    1 o    760.0    3.2    0.0000   0.0000          ?        ?  5776.7051  47.8891          ?        ?      760.0        3.2       ?       ? 
1 1 1   44    1    2 o    256.1    2.7    0.0000   0.0000          ?        ?   655.7617  14.0475          ?        ?      256.1        2.7       ?       ? 
1 1 1   44    1    3 o    300.7    2.4    0.0000   0.0000          ?        ?   904.1467  14.6860          ?        ?      300.7        2.4       ?       ? 
1 1 1   44    1    4 o    406.6    2.4    0.0000   0.0000          ?        ?  1653.7710  19.1556          ?        ?      406.6        2.4       ?       ? 
1 1 1   44    1    5 o    543.0    2.6    0.0000   0.0000          ?        ?  2948.6929  28.0950          ?        ?      543.0        2.6       ?       ? 
1 1 1   44    1    6 o    189.4    3.2    0.0000   0.0000          ?        ?   358.8492  12.1319          ?        ?      189.4        3.2       ?       ? 
1 1 1   44    1    7 o    547.6    2.7    0.0000   0.0000          ?        ?  2999.1362  29.3720          ?        ?      547.6        2.7       ?       ? 
1 1 1   44    1    8 o    372.3    2.4    0.0000   0.0000          ?        ?  1386.2305  17.8786          ?        ?      372.3        2.4       ?       ? 
1 1 1   44    1    9 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    1   10 o    258.3    2.6    0.0000   0.0000          ?        ?   667.2551  13.4090          ?        ?      258.3        2.6       ?       ? 
1 1 1   44    1   11 f    162.4    3.5    0.0000   0.0000          ?        ?   263.7094  11.4934          ?        ?      162.4        3.5       ?       ? 
1 1 1   44    1   12 o    139.8    4.3    0.0000   0.0000          ?        ?   195.3876  12.1319          ?        ?      139.8        4.3       ?       ? 
1 1 1   44    1   13 o    338.6    2.5    0.0000   0.0000          ?        ?  1146.7849  17.2401          ?        ?      338.6        2.5       ?       ? 
1 1 1   44    1   14 o    541.7    2.5    0.0000   0.0000          ?        ?  2934.6455  27.4564          ?        ?      541.7        2.5       ?       ? 
1 1 1   44    1   15 o    600.2    2.7    0.0000   0.0000          ?        ?  3602.5391  31.9261          ?        ?      600.2        2.7       ?       ? 
1 1 1   44    1   16 o    537.7    2.6    0.0000   0.0000          ?        ?  2891.2258  28.0950          ?        ?      537.7        2.6       ?       ? 
1 1 1   44    1   17 o    159.4    4.0    0.0000   0.0000          ?        ?   254.1316  12.7704          ?        ?      159.4        4.0       ?       ? 
1 1 1   44    1   18 o    377.2    2.5    0.0000   0.0000          ?        ?  1423.2646  18.5171          ?        ?      377.2        2.5       ?       ? 
1 1 1   44    1   19 o    528.2    2.6    0.0000   0.0000          ?        ?  2790.3396  27.4564          ?        ?      528.2        2.6       ?       ? 
1 1 1   44    1   20 o    645.2    2.7    0.0000   0.0000          ?        ?  4163.1611  35.1187          ?        ?      645.2        2.7       ?       ? 
1 1 1   44    1   21 o    137.2    4.9    0.0000   0.0000          ?        ?   188.3639  13.4090          ?        ?      137.2        4.9       ?       ? 
1 1 1   44    1   22 o    317.4    2.5    0.0000   0.0000          ?        ?  1007.5872  15.9630          ?        ?      317.4        2.5       ?       ? 
1 1 1   44    1   23 o     96.8    6.6    0.0000   0.0000          ?        ?    93.8627  12.7704          ?        ?       96.8        6.6       ?       ? 
1 1 1   44    1   24 o    175.9    4.0    0.0000   0.0000          ?        ?   309.6830  14.0475          ?        ?      175.9        4.0       ?       ? 
1 1 1   44    1   25 o    193.6    3.6    0.0000   0.0000          ?        ?   374.8122  14.0475          ?        ?      193.6        3.6       ?       ? 
1 1 1   44    1   26 o    408.3    2.4    0.0000   0.0000          ?        ?  1667.1801  19.7942          ?        ?      408.3        2.4       ?       ? 
1 1 1   44    1   27 o    617.4    2.7    0.0000   0.0000          ?        ?  3813.2512  33.8416          ?        ?      617.4        2.7       ?       ? 
1 1 1   44    1   28 o    367.1    2.4    0.0000   0.0000          ?        ?  1347.9192  17.8786          ?        ?      367.1        2.4       ?       ? 
1 1 1   44    1   29 o     19.4    9.6    0.0000   0.0000          ?        ?   -33.2031  14.0475          ?        ?       19.4        9.6       ?       ? 
1 1 1   44    1   30 o    127.5    5.5    0.0000   0.0000          ?        ?   162.8230  14.0475          ?        ?      127.5        5.5       ?       ? 
1 1 1   44    1   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    1   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    1   33 o     76.1   10.1    0.0000   0.0000          ?        ?    58.1055  15.3245          ?        ?       76.1       10.1       ?       ? 
1 1 1   44    1   34 o    351.7    2.6    0.0000   0.0000          ?        ?  1237.4550  18.5171          ?        ?      351.7        2.6       ?       ? 
1 1 1   44    1   35 o    105.0    7.0    0.0000   0.0000          ?        ?   110.4642  14.6860          ?        ?      105.0        7.0       ?       ? 
1 1 1   44    1   36 o     29.8   13.0    0.0000   0.0000          ?        ?    -3.1926  14.6860          ?        ?       29.8       13.0       ?       ? 
1 1 1   44    1   37 o    306.0    2.9    0.0000   0.0000          ?        ?   936.7112  17.8786          ?        ?      306.0        2.9       ?       ? 
1 1 1   44    1   38 o     70.3   11.3    0.0000   0.0000          ?        ?    49.8047  15.9630          ?        ?       70.3       11.3       ?       ? 
1 1 1   44    1   39 o     17.9    9.0    0.0000   0.0000          ?        ?   -55.5514  15.9630          ?        ?       17.9        9.0       ?       ? 
1 1 1   44    1   40 f     59.4   12.7    0.0000   0.0000          ?        ?    37.0343  14.6860          ?        ?       59.4       12.7       ?       ? 
1 1 1   44    1   41 o    223.1    3.7    0.0000   0.0000          ?        ?   498.0469  16.6016          ?        ?      223.1        3.7       ?       ? 
1 1 1   44    1   42 o    117.8    6.8    0.0000   0.0000          ?        ?   139.1977  15.9630          ?        ?      117.8        6.8       ?       ? 
1 1 1   44    1   43 o    264.2    3.4    0.0000   0.0000          ?        ?   698.5427  17.8786          ?        ?      264.2        3.4       ?       ? 
1 1 1   44    1   44 o    300.9    3.1    0.0000   0.0000          ?        ?   906.0621  18.5171          ?        ?      300.9        3.1       ?       ? 
1 1 1   44    1   45 o     58.3   14.3    0.0000   0.0000          ?        ?    35.7572  16.6016          ?        ?       58.3       14.3       ?       ? 
1 1 1   44    1   46 o     25.6   12.2    0.0000   0.0000          ?        ?   -22.3483  17.2401          ?        ?       25.6       12.2       ?       ? 
1 1 1   44    1   47 o    324.1    3.2    0.0000   0.0000          ?        ?  1051.0066  20.4327          ?        ?      324.1        3.2       ?       ? 
1 1 1   44    1   48 o    252.9    3.7    0.0000   0.0000          ?        ?   640.4372  18.5171          ?        ?      252.9        3.7       ?       ? 
1 1 1   44    1   49 o    183.1    4.9    0.0000   0.0000          ?        ?   335.8624  17.8786          ?        ?      183.1        4.9       ?       ? 
1 1 1   44    1   50 o    183.9    5.0    0.0000   0.0000          ?        ?   339.0550  18.5171          ?        ?      183.9        5.0       ?       ? 
1 1 1   44    1   51 o    222.7    4.3    0.0000   0.0000          ?        ?   496.7698  19.1556          ?        ?      222.7        4.3       ?       ? 
1 1 1   44    1   52 o    190.7    4.9    0.0000   0.0000          ?        ?   364.5958  18.5171          ?        ?      190.7        4.9       ?       ? 
1 1 1   44    1   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    1   54 o     53.5   15.7    0.0000   0.0000          ?        ?    30.0105  17.8786          ?        ?       53.5       15.7       ?       ? 
1 1 1   44    1   55 o     24.8   12.1    0.0000   0.0000          ?        ?   -36.3957  19.7942          ?        ?       24.8       12.1       ?       ? 
1 1 1   44    1   56 o     40.9   15.8    0.0000   0.0000          ?        ?    11.4934  18.5171          ?        ?       40.9       15.8       ?       ? 
1 1 1   44    1   57 o     39.4   15.7    0.0000   0.0000          ?        ?     8.9393  18.5171          ?        ?       39.4       15.7       ?       ? 
1 1 1   44    1   58 o    164.6    6.2    0.0000   0.0000          ?        ?   272.6487  20.4327          ?        ?      164.6        6.2       ?       ? 
1 1 1   44    1   59 o    184.4    5.2    0.0000   0.0000          ?        ?   341.6091  19.1556          ?        ?      184.4        5.2       ?       ? 
1 1 1   44    1   60 o    196.4    5.0    0.0000   0.0000          ?        ?   387.5826  19.7942          ?        ?      196.4        5.0       ?       ? 
1 1 1   44    1   61 o     84.6   11.3    0.0000   0.0000          ?        ?    73.4300  19.1556          ?        ?       84.6       11.3       ?       ? 
1 1 1   44    2    0 o    283.2    3.7  802.6216  21.0712   802.6216  21.0712   802.6216  21.0712      283.2      3.7      283.2        3.7     0.0     0.0 
1 1 1   44    2    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    2    2 o    376.3    2.5    0.0000   0.0000          ?        ?  1416.2410  19.1556          ?        ?      376.3        2.5       ?       ? 
1 1 1   44    2    3 o    436.0    2.5    0.0000   0.0000          ?        ?  1901.5173  21.7097          ?        ?      436.0        2.5       ?       ? 
1 1 1   44    2    4 o    234.6    2.9    0.0000   0.0000          ?        ?   550.4056  13.4090          ?        ?      234.6        2.9       ?       ? 
1 1 1   44    2    5 o    848.7    3.4    0.0000   0.0000          ?        ?  7203.8008  57.4669          ?        ?      848.7        3.4       ?       ? 
1 1 1   44    2    6 o    349.9    2.5    0.0000   0.0000          ?        ?  1224.6844  17.2401          ?        ?      349.9        2.5       ?       ? 
1 1 1   44    2    7 o    509.9    2.6    0.0000   0.0000          ?        ?  2600.0601  26.1794          ?        ?      509.9        2.6       ?       ? 
1 1 1   44    2    8 o    475.4    2.6    0.0000   0.0000          ?        ?  2260.3665  24.2638          ?        ?      475.4        2.6       ?       ? 
1 1 1   44    2    9 o    179.2    3.4    0.0000   0.0000          ?        ?   321.1764  12.1319          ?        ?      179.2        3.4       ?       ? 
1 1 1   44    2   10 o    286.4    2.5    0.0000   0.0000          ?        ?   820.5003  14.0475          ?        ?      286.4        2.5       ?       ? 
1 1 1   44    2   11 o     74.9    7.2    0.0000   0.0000          ?        ?    56.1899  10.8549          ?        ?       74.9        7.2       ?       ? 
1 1 1   44    2   12 o    152.2    3.8    0.0000   0.0000          ?        ?   231.7833  11.4934          ?        ?      152.2        3.8       ?       ? 
1 1 1   44    2   13 o    619.6    2.9    0.0000   0.0000          ?        ?  3840.0693  35.7572          ?        ?      619.6        2.9       ?       ? 
1 1 1   44    2   14 o    140.2    4.3    0.0000   0.0000          ?        ?   196.6647  12.1319          ?        ?      140.2        4.3       ?       ? 
1 1 1   44    2   15 o    348.6    2.5    0.0000   0.0000          ?        ?  1215.7451  17.2401          ?        ?      348.6        2.5       ?       ? 
1 1 1   44    2   16 o    582.3    2.7    0.0000   0.0000          ?        ?  3391.8269  31.2876          ?        ?      582.3        2.7       ?       ? 
1 1 1   44    2   17 o    155.5    3.9    0.0000   0.0000          ?        ?   241.9997  12.1319          ?        ?      155.5        3.9       ?       ? 
1 1 1   44    2   18 o    546.7    2.6    0.0000   0.0000          ?        ?  2988.9197  28.7335          ?        ?      546.7        2.6       ?       ? 
1 1 1   44    2   19 o    590.5    2.6    0.0000   0.0000          ?        ?  3487.6052  31.2876          ?        ?      590.5        2.6       ?       ? 
1 1 1   44    2   20 o    406.7    2.4    0.0000   0.0000          ?        ?  1654.4095  19.1556          ?        ?      406.7        2.4       ?       ? 
1 1 1   44    2   21 o    287.2    2.8    0.0000   0.0000          ?        ?   824.9699  15.9630          ?        ?      287.2        2.8       ?       ? 
1 1 1   44    2   22 o     33.7   12.9    0.0000   0.0000          ?        ?     7.6623  12.1319          ?        ?       33.7       12.9       ?       ? 
1 1 1   44    2   23 o     23.2   10.9    0.0000   0.0000          ?        ?   -13.4090  12.7704          ?        ?       23.2       10.9       ?       ? 
1 1 1   44    2   24 f    561.4    2.6    0.0000   0.0000          ?        ?  3152.3813  28.7335          ?        ?      561.4        2.6       ?       ? 
1 1 1   44    2   25 o    861.0    3.4    0.0000   0.0000          ?        ?  7415.1519  58.1055          ?        ?      861.0        3.4       ?       ? 
1 1 1   44    2   26 o    479.4    2.6    0.0000   0.0000          ?        ?  2298.6777  24.9023          ?        ?      479.4        2.6       ?       ? 
1 1 1   44    2   27 o    468.2    2.6    0.0000   0.0000          ?        ?  2192.6831  24.2638          ?        ?      468.2        2.6       ?       ? 
1 1 1   44    2   28 o    260.7    2.8    0.0000   0.0000          ?        ?   680.0255  14.6860          ?        ?      260.7        2.8       ?       ? 
1 1 1   44    2   29 o    161.3    4.6    0.0000   0.0000          ?        ?   260.5168  14.6860          ?        ?      161.3        4.6       ?       ? 
1 1 1   44    2   30 o    287.5    2.9    0.0000   0.0000          ?        ?   826.8855  16.6016          ?        ?      287.5        2.9       ?       ? 
1 1 1   44    2   31 o    379.2    2.5    0.0000   0.0000          ?        ?  1437.9507  19.1556          ?        ?      379.2        2.5       ?       ? 
1 1 1   44    2   32 o    258.0    3.0    0.0000   0.0000          ?        ?   665.9781  15.3245          ?        ?      258.0        3.0       ?       ? 
1 1 1   44    2   33 o    133.9    5.7    0.0000   0.0000          ?        ?   179.4246  15.3245          ?        ?      133.9        5.7       ?       ? 
1 1 1   44    2   34 o    130.0    5.9    0.0000   0.0000          ?        ?   169.2082  15.3245          ?        ?      130.0        5.9       ?       ? 
1 1 1   44    2   35 o    254.1    3.1    0.0000   0.0000          ?        ?   646.1838  15.9630          ?        ?      254.1        3.1       ?       ? 
1 1 1   44    2   36 o    359.5    2.7    0.0000   0.0000          ?        ?  1293.0063  19.1556          ?        ?      359.5        2.7       ?       ? 
1 1 1   44    2   37 f    312.1    3.0    0.0000   0.0000          ?        ?   974.3840  18.5171          ?        ?      312.1        3.0       ?       ? 
1 1 1   44    2   38 o     89.5    8.6    0.0000   0.0000          ?        ?    80.4537  15.3245          ?        ?       89.5        8.6       ?       ? 
1 1 1   44    2   39 o    445.6    2.5    0.0000   0.0000          ?        ?  1986.4408  22.3483          ?        ?      445.6        2.5       ?       ? 
1 1 1   44    2   40 o     40.7   14.7    0.0000   0.0000          ?        ?    14.0475  15.3245          ?        ?       40.7       14.7       ?       ? 
1 1 1   44    2   41 o    245.3    3.5    0.0000   0.0000          ?        ?   602.1259  17.2401          ?        ?      245.3        3.5       ?       ? 
1 1 1   44    2   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    2   43 o    323.5    2.9    0.0000   0.0000          ?        ?  1047.1754  18.5171          ?        ?      323.5        2.9       ?       ? 
1 1 1   44    2   44 o    186.4    4.5    0.0000   0.0000          ?        ?   347.9943  16.6016          ?        ?      186.4        4.5       ?       ? 
1 1 1   44    2   45 o    234.6    3.8    0.0000   0.0000          ?        ?   551.0442  17.8786          ?        ?      234.6        3.8       ?       ? 
1 1 1   44    2   46 o    384.4    2.7    0.0000   0.0000          ?        ?  1478.1776  21.0712          ?        ?      384.4        2.7       ?       ? 
1 1 1   44    2   47 o    133.0    6.7    0.0000   0.0000          ?        ?   177.5090  17.8786          ?        ?      133.0        6.7       ?       ? 
1 1 1   44    2   48 o    194.8    4.6    0.0000   0.0000          ?        ?   379.9204  17.8786          ?        ?      194.8        4.6       ?       ? 
1 1 1   44    2   49 f    286.1    3.3    0.0000   0.0000          ?        ?   819.2233  19.1556          ?        ?      286.1        3.3       ?       ? 
1 1 1   44    2   50 o    184.1    4.9    0.0000   0.0000          ?        ?   339.6935  17.8786          ?        ?      184.1        4.9       ?       ? 
1 1 1   44    2   51 o     52.0   15.5    0.0000   0.0000          ?        ?    28.0950  17.2401          ?        ?       52.0       15.5       ?       ? 
1 1 1   44    2   52 o     30.1   13.7    0.0000   0.0000          ?        ?   -10.2163  17.8786          ?        ?       30.1       13.7       ?       ? 
1 1 1   44    2   53 o    164.1    5.6    0.0000   0.0000          ?        ?   270.0946  18.5171          ?        ?      164.1        5.6       ?       ? 
1 1 1   44    2   54 o    146.1    6.6    0.0000   0.0000          ?        ?   214.5433  19.1556          ?        ?      146.1        6.6       ?       ? 
1 1 1   44    2   55 o    142.3    6.5    0.0000   0.0000          ?        ?   203.6884  18.5171          ?        ?      142.3        6.5       ?       ? 
1 1 1   44    2   56 f    340.8    3.2    0.0000   0.0000          ?        ?  1163.3864  21.7097          ?        ?      340.8        3.2       ?       ? 
1 1 1   44    2   57 o    148.6    6.7    0.0000   0.0000          ?        ?   222.2055  19.7942          ?        ?      148.6        6.7       ?       ? 
1 1 1   44    2   58 o     99.7    9.6    0.0000   0.0000          ?        ?   100.8864  19.1556          ?        ?       99.7        9.6       ?       ? 
1 1 1   44    2   59 o    249.3    4.0    0.0000   0.0000          ?        ?   623.1971  19.7942          ?        ?      249.3        4.0       ?       ? 
1 1 1   44    2   60 o     30.8   14.0    0.0000   0.0000          ?        ?   -10.8549  19.1556          ?        ?       30.8       14.0       ?       ? 
1 1 1   44    3    0 o    301.9    3.6  911.8089  21.7097   911.8089  21.7097   911.8089  21.7097      301.9      3.6      301.9        3.6     0.0     0.0 
1 1 1   44    3    1 o    610.6    2.7    0.0000   0.0000          ?        ?  3728.3279  33.2031          ?        ?      610.6        2.7       ?       ? 
1 1 1   44    3    2 o    143.1    4.2    0.0000   0.0000          ?        ?   204.9654  12.1319          ?        ?      143.1        4.2       ?       ? 
1 1 1   44    3    3 o    656.7    2.9    0.0000   0.0000          ?        ?  4313.8521  38.3113          ?        ?      656.7        2.9       ?       ? 
1 1 1   44    3    4 o    517.5    2.6    0.0000   0.0000          ?        ?  2678.5981  26.8179          ?        ?      517.5        2.6       ?       ? 
1 1 1   44    3    5 o    379.2    2.4    0.0000   0.0000          ?        ?  1437.9507  18.5171          ?        ?      379.2        2.4       ?       ? 
1 1 1   44    3    6 o    750.8    3.1    0.0000   0.0000          ?        ?  5638.1460  46.6121          ?        ?      750.8        3.1       ?       ? 
1 1 1   44    3    7 o    418.4    2.4    0.0000   0.0000          ?        ?  1750.8264  20.4327          ?        ?      418.4        2.4       ?       ? 
1 1 1   44    3    8 o    379.1    2.4    0.0000   0.0000          ?        ?  1437.3123  17.8786          ?        ?      379.1        2.4       ?       ? 
1 1 1   44    3    9 o    280.0    2.5    0.0000   0.0000          ?        ?   784.1046  14.0475          ?        ?      280.0        2.5       ?       ? 
1 1 1   44    3   10 f    394.6    2.4    0.0000   0.0000          ?        ?  1557.3542  19.1556          ?        ?      394.6        2.4       ?       ? 
1 1 1   44    3   11 o    339.6    2.4    0.0000   0.0000          ?        ?  1153.1700  16.6016          ?        ?      339.6        2.4       ?       ? 
1 1 1   44    3   12 o    401.1    2.4    0.0000   0.0000          ?        ?  1609.0745  19.1556          ?        ?      401.1        2.4       ?       ? 
1 1 1   44    3   13 o    371.8    2.5    0.0000   0.0000          ?        ?  1382.3993  18.5171          ?        ?      371.8        2.5       ?       ? 
1 1 1   44    3   14 o    106.0    5.7    0.0000   0.0000          ?        ?   112.3798  12.1319          ?        ?      106.0        5.7       ?       ? 
1 1 1   44    3   15 o    163.1    4.1    0.0000   0.0000          ?        ?   266.2635  13.4090          ?        ?      163.1        4.1       ?       ? 
1 1 1   44    3   16 o    263.2    2.9    0.0000   0.0000          ?        ?   692.7960  15.3245          ?        ?      263.2        2.9       ?       ? 
1 1 1   44    3   17 o    105.7    6.0    0.0000   0.0000          ?        ?   111.7413  12.7704          ?        ?      105.7        6.0       ?       ? 
1 1 1   44    3   18 o    380.6    2.3    0.0000   0.0000          ?        ?  1448.8055  17.8786          ?        ?      380.6        2.3       ?       ? 
1 1 1   44    3   19 o     59.1   12.3    0.0000   0.0000          ?        ?    36.3957  14.0475          ?        ?       59.1       12.3       ?       ? 
1 1 1   44    3   20 o    226.3    3.1    0.0000   0.0000          ?        ?   512.0943  14.0475          ?        ?      226.3        3.1       ?       ? 
1 1 1   44    3   21 o    338.7    2.5    0.0000   0.0000          ?        ?  1147.4233  17.2401          ?        ?      338.7        2.5       ?       ? 
1 1 1   44    3   22 o    334.8    2.4    0.0000   0.0000          ?        ?  1121.2440  15.9630          ?        ?      334.8        2.4       ?       ? 
1 1 1   44    3   23 o    293.8    2.7    0.0000   0.0000          ?        ?   863.2812  15.9630          ?        ?      293.8        2.7       ?       ? 
1 1 1   44    3   24 o    249.9    2.8    0.0000   0.0000          ?        ?   624.4742  14.0475          ?        ?      249.9        2.8       ?       ? 
1 1 1   44    3   25 o    187.0    3.9    0.0000   0.0000          ?        ?   349.9099  14.6860          ?        ?      187.0        3.9       ?       ? 
1 1 1   44    3   26 o     22.1   10.5    0.0000   0.0000          ?        ?   -16.6016  12.7704          ?        ?       22.1       10.5       ?       ? 
1 1 1   44    3   27 o    408.0    2.5    0.0000   0.0000          ?        ?  1664.6260  20.4327          ?        ?      408.0        2.5       ?       ? 
1 1 1   44    3   28 o    139.9    5.2    0.0000   0.0000          ?        ?   196.0261  14.6860          ?        ?      139.9        5.2       ?       ? 
1 1 1   44    3   29 o     23.2   10.9    0.0000   0.0000          ?        ?   -13.4090  12.7704          ?        ?       23.2       10.9       ?       ? 
1 1 1   44    3   30 o     42.7   13.8    0.0000   0.0000          ?        ?    17.8786  13.4090          ?        ?       42.7       13.8       ?       ? 
1 1 1   44    3   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    3   32 o     92.7    7.9    0.0000   0.0000          ?        ?    86.2004  14.6860          ?        ?       92.7        7.9       ?       ? 
1 1 1   44    3   33 o    623.3    2.8    0.0000   0.0000          ?        ?  3886.6812  35.1187          ?        ?      623.3        2.8       ?       ? 
1 1 1   44    3   34 o    542.5    2.6    0.0000   0.0000          ?        ?  2943.5847  28.0950          ?        ?      542.5        2.6       ?       ? 
1 1 1   44    3   35 o    262.4    3.0    0.0000   0.0000          ?        ?   688.9648  15.9630          ?        ?      262.4        3.0       ?       ? 
1 1 1   44    3   36 o    272.2    3.3    0.0000   0.0000          ?        ?   741.3236  17.8786          ?        ?      272.2        3.3       ?       ? 
1 1 1   44    3   37 o    316.6    2.9    0.0000   0.0000          ?        ?  1003.1175  18.5171          ?        ?      316.6        2.9       ?       ? 
1 1 1   44    3   38 o    324.8    2.9    0.0000   0.0000          ?        ?  1055.4763  18.5171          ?        ?      324.8        2.9       ?       ? 
1 1 1   44    3   39 o    297.3    3.1    0.0000   0.0000          ?        ?   884.3525  18.5171          ?        ?      297.3        3.1       ?       ? 
1 1 1   44    3   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    3   41 o    244.4    3.4    0.0000   0.0000          ?        ?   597.6562  16.6016          ?        ?      244.4        3.4       ?       ? 
1 1 1   44    3   42 o    210.5    4.1    0.0000   0.0000          ?        ?   443.7725  17.2401          ?        ?      210.5        4.1       ?       ? 
1 1 1   44    3   43 o    142.1    6.1    0.0000   0.0000          ?        ?   202.4114  17.2401          ?        ?      142.1        6.1       ?       ? 
1 1 1   44    3   44 o    115.6    7.5    0.0000   0.0000          ?        ?   134.0895  17.2401          ?        ?      115.6        7.5       ?       ? 
1 1 1   44    3   45 o    378.2    2.8    0.0000   0.0000          ?        ?  1430.9270  21.0712          ?        ?      378.2        2.8       ?       ? 
1 1 1   44    3   46 o     92.6    9.0    0.0000   0.0000          ?        ?    86.2004  16.6016          ?        ?       92.6        9.0       ?       ? 
1 1 1   44    3   47 o    152.9    5.6    0.0000   0.0000          ?        ?   234.3374  17.2401          ?        ?      152.9        5.6       ?       ? 
1 1 1   44    3   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    3   49 o    177.9    5.0    0.0000   0.0000          ?        ?   317.3452  17.8786          ?        ?      177.9        5.0       ?       ? 
1 1 1   44    3   50 o    167.6    5.3    0.0000   0.0000          ?        ?   281.5880  17.8786          ?        ?      167.6        5.3       ?       ? 
1 1 1   44    3   51 o    140.4    6.6    0.0000   0.0000          ?        ?   197.9417  18.5171          ?        ?      140.4        6.6       ?       ? 
1 1 1   44    3   52 o     85.6   10.4    0.0000   0.0000          ?        ?    74.0685  17.8786          ?        ?       85.6       10.4       ?       ? 
1 1 1   44    3   53 o    175.1    5.3    0.0000   0.0000          ?        ?   307.7674  18.5171          ?        ?      175.1        5.3       ?       ? 
1 1 1   44    3   54 o     23.1   11.5    0.0000   0.0000          ?        ?   -45.3350  19.7942          ?        ?       23.1       11.5       ?       ? 
1 1 1   44    3   55 o    227.0    4.2    0.0000   0.0000          ?        ?   516.5640  19.1556          ?        ?      227.0        4.2       ?       ? 
1 1 1   44    3   56 o    137.3    6.7    0.0000   0.0000          ?        ?   189.6409  18.5171          ?        ?      137.3        6.7       ?       ? 
1 1 1   44    3   57 f     84.6   10.6    0.0000   0.0000          ?        ?    72.7915  17.8786          ?        ?       84.6       10.6       ?       ? 
1 1 1   44    3   58 o    152.4    6.1    0.0000   0.0000          ?        ?   233.6989  18.5171          ?        ?      152.4        6.1       ?       ? 
1 1 1   44    3   59 o     30.5   13.9    0.0000   0.0000          ?        ?   -10.2163  18.5171          ?        ?       30.5       13.9       ?       ? 
1 1 1   44    3   60 o    157.4    6.1    0.0000   0.0000          ?        ?   249.6619  19.1556          ?        ?      157.4        6.1       ?       ? 
1 1 1   44    4    0 o    506.0    3.8 2561.1104  38.9498  2561.1104  38.9498  2561.1104  38.9498      506.0      3.8      506.0        3.8     0.0     0.0 
1 1 1   44    4    1 o    303.7    2.6    0.0000   0.0000          ?        ?   922.6638  15.9630          ?        ?      303.7        2.6       ?       ? 
1 1 1   44    4    2 o    367.5    2.5    0.0000   0.0000          ?        ?  1351.1118  18.5171          ?        ?      367.5        2.5       ?       ? 
1 1 1   44    4    3 o    465.6    2.6    0.0000   0.0000          ?        ?  2168.4194  24.2638          ?        ?      465.6        2.6       ?       ? 
1 1 1   44    4    4 o    541.7    2.5    0.0000   0.0000          ?        ?  2935.2839  27.4564          ?        ?      541.7        2.5       ?       ? 
1 1 1   44    4    5 o    255.4    2.6    0.0000   0.0000          ?        ?   652.5691  13.4090          ?        ?      255.4        2.6       ?       ? 
1 1 1   44    4    6 f    287.1    2.7    0.0000   0.0000          ?        ?   824.3315  15.3245          ?        ?      287.1        2.7       ?       ? 
1 1 1   44    4    7 o    239.4    2.7    0.0000   0.0000          ?        ?   573.3925  12.7704          ?        ?      239.4        2.7       ?       ? 
1 1 1   44    4    8 o    227.1    3.0    0.0000   0.0000          ?        ?   515.9255  13.4090          ?        ?      227.1        3.0       ?       ? 
1 1 1   44    4    9 o    199.1    3.0    0.0000   0.0000          ?        ?   396.5219  12.1319          ?        ?      199.1        3.0       ?       ? 
1 1 1   44    4   10 o    284.7    2.6    0.0000   0.0000          ?        ?   810.9225  14.6860          ?        ?      284.7        2.6       ?       ? 
1 1 1   44    4   11 o    536.0    2.6    0.0000   0.0000          ?        ?  2873.3474  28.0950          ?        ?      536.0        2.6       ?       ? 
1 1 1   44    4   12 o    331.2    2.3    0.0000   0.0000          ?        ?  1096.9802  15.3245          ?        ?      331.2        2.3       ?       ? 
1 1 1   44    4   13 o    431.1    2.4    0.0000   0.0000          ?        ?  1858.7365  20.4327          ?        ?      431.1        2.4       ?       ? 
1 1 1   44    4   14 o    330.9    2.4    0.0000   0.0000          ?        ?  1095.0646  15.9630          ?        ?      330.9        2.4       ?       ? 
1 1 1   44    4   15 o    478.3    2.7    0.0000   0.0000          ?        ?  2288.4614  26.1794          ?        ?      478.3        2.7       ?       ? 
1 1 1   44    4   16 o    197.8    3.6    0.0000   0.0000          ?        ?   391.4138  14.0475          ?        ?      197.8        3.6       ?       ? 
1 1 1   44    4   17 o    240.9    2.9    0.0000   0.0000          ?        ?   580.4161  14.0475          ?        ?      240.9        2.9       ?       ? 
1 1 1   44    4   18 o    722.3    3.1    0.0000   0.0000          ?        ?  5218.6372  44.6965          ?        ?      722.3        3.1       ?       ? 
1 1 1   44    4   19 o    123.0    5.7    0.0000   0.0000          ?        ?   151.3296  14.0475          ?        ?      123.0        5.7       ?       ? 
1 1 1   44    4   20 f    761.7    3.3    0.0000   0.0000          ?        ?  5804.1616  49.8047          ?        ?      761.7        3.3       ?       ? 
1 1 1   44    4   21 o    359.2    2.6    0.0000   0.0000          ?        ?  1290.4523  18.5171          ?        ?      359.2        2.6       ?       ? 
1 1 1   44    4   22 o     99.7    6.4    0.0000   0.0000          ?        ?    99.6094  12.7704          ?        ?       99.7        6.4       ?       ? 
1 1 1   44    4   23 o    219.4    3.5    0.0000   0.0000          ?        ?   481.4453  15.3245          ?        ?      219.4        3.5       ?       ? 
1 1 1   44    4   24 o    661.1    2.8    0.0000   0.0000          ?        ?  4371.9575  36.3957          ?        ?      661.1        2.8       ?       ? 
1 1 1   44    4   25 o    268.1    2.9    0.0000   0.0000          ?        ?   718.9753  15.3245          ?        ?      268.1        2.9       ?       ? 
1 1 1   44    4   26 o    182.3    3.9    0.0000   0.0000          ?        ?   332.6698  14.0475          ?        ?      182.3        3.9       ?       ? 
1 1 1   44    4   27 o     16.2    8.2    0.0000   0.0000          ?        ?   -47.8891  13.4090          ?        ?       16.2        8.2       ?       ? 
1 1 1   44    4   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    4   29 o    214.4    3.3    0.0000   0.0000          ?        ?   459.7356  14.0475          ?        ?      214.4        3.3       ?       ? 
1 1 1   44    4   30 o    150.5    4.9    0.0000   0.0000          ?        ?   226.6752  14.6860          ?        ?      150.5        4.9       ?       ? 
1 1 1   44    4   31 o    233.7    3.4    0.0000   0.0000          ?        ?   546.5745  15.9630          ?        ?      233.7        3.4       ?       ? 
1 1 1   44    4   32 o    277.0    2.9    0.0000   0.0000          ?        ?   767.5030  15.9630          ?        ?      277.0        2.9       ?       ? 
1 1 1   44    4   33 o     71.3   10.3    0.0000   0.0000          ?        ?    51.0817  14.6860          ?        ?       71.3       10.3       ?       ? 
1 1 1   44    4   34 o    397.1    2.7    0.0000   0.0000          ?        ?  1577.7870  21.0712          ?        ?      397.1        2.7       ?       ? 
1 1 1   44    4   35 o    384.1    2.7    0.0000   0.0000          ?        ?  1475.6235  20.4327          ?        ?      384.1        2.7       ?       ? 
1 1 1   44    4   36 o     24.2   11.5    0.0000   0.0000          ?        ?   -19.7942  15.3245          ?        ?       24.2       11.5       ?       ? 
1 1 1   44    4   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    4   38 o    209.2    3.8    0.0000   0.0000          ?        ?   438.0258  15.9630          ?        ?      209.2        3.8       ?       ? 
1 1 1   44    4   39 f    366.7    2.7    0.0000   0.0000          ?        ?  1345.3650  19.7942          ?        ?      366.7        2.7       ?       ? 
1 1 1   44    4   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    4   41 o    135.2    6.4    0.0000   0.0000          ?        ?   183.2557  17.2401          ?        ?      135.2        6.4       ?       ? 
1 1 1   44    4   42 o    163.0    5.3    0.0000   0.0000          ?        ?   266.2635  17.2401          ?        ?      163.0        5.3       ?       ? 
1 1 1   44    4   43 o    642.1    2.8    0.0000   0.0000          ?        ?  4125.4883  36.3957          ?        ?      642.1        2.8       ?       ? 
1 1 1   44    4   44 o     27.4   12.8    0.0000   0.0000          ?        ?   -18.5171  17.8786          ?        ?       27.4       12.8       ?       ? 
1 1 1   44    4   45 o    213.7    4.3    0.0000   0.0000          ?        ?   457.1815  18.5171          ?        ?      213.7        4.3       ?       ? 
1 1 1   44    4   46 o     41.5   15.5    0.0000   0.0000          ?        ?    13.4090  17.2401          ?        ?       41.5       15.5       ?       ? 
1 1 1   44    4   47 o    186.5    4.8    0.0000   0.0000          ?        ?   348.6328  17.8786          ?        ?      186.5        4.8       ?       ? 
1 1 1   44    4   48 o    279.1    3.4    0.0000   0.0000          ?        ?   779.6349  19.1556          ?        ?      279.1        3.4       ?       ? 
1 1 1   44    4   49 o    245.6    3.9    0.0000   0.0000          ?        ?   604.0414  19.1556          ?        ?      245.6        3.9       ?       ? 
1 1 1   44    4   50 o    285.9    3.5    0.0000   0.0000          ?        ?   818.5847  19.7942          ?        ?      285.9        3.5       ?       ? 
1 1 1   44    4   51 f     93.8    9.5    0.0000   0.0000          ?        ?    88.7545  17.8786          ?        ?       93.8        9.5       ?       ? 
1 1 1   44    4   52 o    158.7    5.6    0.0000   0.0000          ?        ?   252.8546  17.8786          ?        ?      158.7        5.6       ?       ? 
1 1 1   44    4   53 o     29.3   13.5    0.0000   0.0000          ?        ?   -14.0475  18.5171          ?        ?       29.3       13.5       ?       ? 
1 1 1   44    4   54 o    256.5    3.9    0.0000   0.0000          ?        ?   658.9543  19.7942          ?        ?      256.5        3.9       ?       ? 
1 1 1   44    4   55 o    187.2    5.1    0.0000   0.0000          ?        ?   351.8254  19.1556          ?        ?      187.2        5.1       ?       ? 
1 1 1   44    4   56 o     93.4   10.6    0.0000   0.0000          ?        ?    88.7545  19.7942          ?        ?       93.4       10.6       ?       ? 
1 1 1   44    4   57 o     92.4   10.4    0.0000   0.0000          ?        ?    86.8389  19.1556          ?        ?       92.4       10.4       ?       ? 
1 1 1   44    4   58 o     76.4   12.5    0.0000   0.0000          ?        ?    60.0210  19.1556          ?        ?       76.4       12.5       ?       ? 
1 1 1   44    4   59 o     77.5   12.4    0.0000   0.0000          ?        ?    61.9366  19.1556          ?        ?       77.5       12.4       ?       ? 
1 1 1   44    5    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    5    1 o    169.3    3.6    0.0000   0.0000          ?        ?   286.6962  12.1319          ?        ?      169.3        3.6       ?       ? 
1 1 1   44    5    2 o    560.0    2.7    0.0000   0.0000          ?        ?  3137.0566  30.6490          ?        ?      560.0        2.7       ?       ? 
1 1 1   44    5    3 o    391.8    2.5    0.0000   0.0000          ?        ?  1535.6445  19.7942          ?        ?      391.8        2.5       ?       ? 
1 1 1   44    5    4 o     38.1   12.4    0.0000   0.0000          ?        ?    14.0475  10.8549          ?        ?       38.1       12.4       ?       ? 
1 1 1   44    5    5 o    383.0    2.5    0.0000   0.0000          ?        ?  1467.3228  19.1556          ?        ?      383.0        2.5       ?       ? 
1 1 1   44    5    6 o    509.3    2.6    0.0000   0.0000          ?        ?  2594.3132  26.1794          ?        ?      509.3        2.6       ?       ? 
1 1 1   44    5    7 o    429.6    2.4    0.0000   0.0000          ?        ?  1845.9661  20.4327          ?        ?      429.6        2.4       ?       ? 
1 1 1   44    5    8 o    299.7    2.5    0.0000   0.0000          ?        ?   898.3999  14.6860          ?        ?      299.7        2.5       ?       ? 
1 1 1   44    5    9 o    320.0    2.4    0.0000   0.0000          ?        ?  1024.1886  15.3245          ?        ?      320.0        2.4       ?       ? 
1 1 1   44    5   10 o    320.1    2.5    0.0000   0.0000          ?        ?  1024.8273  15.9630          ?        ?      320.1        2.5       ?       ? 
1 1 1   44    5   11 o    425.9    2.4    0.0000   0.0000          ?        ?  1814.0400  20.4327          ?        ?      425.9        2.4       ?       ? 
1 1 1   44    5   12 o    624.8    3.0    0.0000   0.0000          ?        ?  3905.1980  37.0343          ?        ?      624.8        3.0       ?       ? 
1 1 1   44    5   13 o    116.0    5.2    0.0000   0.0000          ?        ?   134.7281  12.1319          ?        ?      116.0        5.2       ?       ? 
1 1 1   44    5   14 o    303.0    2.5    0.0000   0.0000          ?        ?   918.1941  15.3245          ?        ?      303.0        2.5       ?       ? 
1 1 1   44    5   15 o    307.4    2.6    0.0000   0.0000          ?        ?   945.0120  15.9630          ?        ?      307.4        2.6       ?       ? 
1 1 1   44    5   16 f     19.6    9.5    0.0000   0.0000          ?        ?   -22.3483  12.1319          ?        ?       19.6        9.5       ?       ? 
1 1 1   44    5   17 o    251.5    3.3    0.0000   0.0000          ?        ?   632.7749  16.6016          ?        ?      251.5        3.3       ?       ? 
1 1 1   44    5   18 o    378.7    2.5    0.0000   0.0000          ?        ?  1434.7581  19.1556          ?        ?      378.7        2.5       ?       ? 
1 1 1   44    5   19 o    120.9    5.3    0.0000   0.0000          ?        ?   146.2215  12.7704          ?        ?      120.9        5.3       ?       ? 
1 1 1   44    5   20 o    337.4    2.5    0.0000   0.0000          ?        ?  1138.4841  16.6016          ?        ?      337.4        2.5       ?       ? 
1 1 1   44    5   21 o    303.5    2.6    0.0000   0.0000          ?        ?   921.3867  15.9630          ?        ?      303.5        2.6       ?       ? 
1 1 1   44    5   22 o    445.0    2.5    0.0000   0.0000          ?        ?  1980.6942  22.3483          ?        ?      445.0        2.5       ?       ? 
1 1 1   44    5   23 o    175.6    3.6    0.0000   0.0000          ?        ?   308.4059  12.7704          ?        ?      175.6        3.6       ?       ? 
1 1 1   44    5   24 o     62.3   11.7    0.0000   0.0000          ?        ?    40.2269  14.0475          ?        ?       62.3       11.7       ?       ? 
1 1 1   44    5   25 o     64.8   10.3    0.0000   0.0000          ?        ?    42.1424  13.4090          ?        ?       64.8       10.3       ?       ? 
1 1 1   44    5   26 o    101.0    6.6    0.0000   0.0000          ?        ?   102.1635  13.4090          ?        ?      101.0        6.6       ?       ? 
1 1 1   44    5   27 o    196.8    3.6    0.0000   0.0000          ?        ?   387.5826  14.0475          ?        ?      196.8        3.6       ?       ? 
1 1 1   44    5   28 o    228.2    3.2    0.0000   0.0000          ?        ?   521.0336  14.6860          ?        ?      228.2        3.2       ?       ? 
1 1 1   44    5   29 o    408.0    2.5    0.0000   0.0000          ?        ?  1665.2643  20.4327          ?        ?      408.0        2.5       ?       ? 
1 1 1   44    5   30 o    231.1    3.3    0.0000   0.0000          ?        ?   534.4426  15.3245          ?        ?      231.1        3.3       ?       ? 
1 1 1   44    5   31 o    114.0    6.2    0.0000   0.0000          ?        ?   130.2584  14.0475          ?        ?      114.0        6.2       ?       ? 
1 1 1   44    5   32 o     24.8   11.7    0.0000   0.0000          ?        ?   -17.8786  15.3245          ?        ?       24.8       11.7       ?       ? 
1 1 1   44    5   33 o    368.9    2.7    0.0000   0.0000          ?        ?  1361.3281  19.7942          ?        ?      368.9        2.7       ?       ? 
1 1 1   44    5   34 o    166.2    4.6    0.0000   0.0000          ?        ?   276.4799  15.3245          ?        ?      166.2        4.6       ?       ? 
1 1 1   44    5   35 f    213.7    3.9    0.0000   0.0000          ?        ?   457.1815  16.6016          ?        ?      213.7        3.9       ?       ? 
1 1 1   44    5   36 o    177.3    4.3    0.0000   0.0000          ?        ?   314.7912  15.3245          ?        ?      177.3        4.3       ?       ? 
1 1 1   44    5   37 f    262.0    3.3    0.0000   0.0000          ?        ?   687.0493  17.2401          ?        ?      262.0        3.3       ?       ? 
1 1 1   44    5   38 o    290.8    3.1    0.0000   0.0000          ?        ?   846.0411  17.8786          ?        ?      290.8        3.1       ?       ? 
1 1 1   44    5   39 o    210.9    3.9    0.0000   0.0000          ?        ?   445.0496  16.6016          ?        ?      210.9        3.9       ?       ? 
1 1 1   44    5   40 o    199.2    4.3    0.0000   0.0000          ?        ?   397.1605  17.2401          ?        ?      199.2        4.3       ?       ? 
1 1 1   44    5   41 o    304.1    3.0    0.0000   0.0000          ?        ?   925.2178  18.5171          ?        ?      304.1        3.0       ?       ? 
1 1 1   44    5   42 o    145.9    5.7    0.0000   0.0000          ?        ?   213.2662  16.6016          ?        ?      145.9        5.7       ?       ? 
1 1 1   44    5   43 o    299.2    3.2    0.0000   0.0000          ?        ?   895.8459  19.1556          ?        ?      299.2        3.2       ?       ? 
1 1 1   44    5   44 o    105.1    8.2    0.0000   0.0000          ?        ?   111.1028  17.2401          ?        ?      105.1        8.2       ?       ? 
1 1 1   44    5   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    5   46 o    139.1    6.2    0.0000   0.0000          ?        ?   194.1106  17.2401          ?        ?      139.1        6.2       ?       ? 
1 1 1   44    5   47 o    162.6    5.3    0.0000   0.0000          ?        ?   264.9865  17.2401          ?        ?      162.6        5.3       ?       ? 
1 1 1   44    5   48 o    309.4    3.1    0.0000   0.0000          ?        ?   958.4210  19.1556          ?        ?      309.4        3.1       ?       ? 
1 1 1   44    5   49 o    228.8    4.0    0.0000   0.0000          ?        ?   524.2263  18.5171          ?        ?      228.8        4.0       ?       ? 
1 1 1   44    5   50 o    123.2    7.3    0.0000   0.0000          ?        ?   152.6067  17.8786          ?        ?      123.2        7.3       ?       ? 
1 1 1   44    5   51 o    254.6    3.8    0.0000   0.0000          ?        ?   649.3765  19.1556          ?        ?      254.6        3.8       ?       ? 
1 1 1   44    5   52 o    228.7    4.2    0.0000   0.0000          ?        ?   524.2263  19.1556          ?        ?      228.7        4.2       ?       ? 
1 1 1   44    5   53 o    153.6    6.0    0.0000   0.0000          ?        ?   236.8915  18.5171          ?        ?      153.6        6.0       ?       ? 
1 1 1   44    5   54 o     91.2   10.2    0.0000   0.0000          ?        ?    84.2849  18.5171          ?        ?       91.2       10.2       ?       ? 
1 1 1   44    5   55 o     74.6   13.3    0.0000   0.0000          ?        ?    58.7440  19.1556          ?        ?       74.6       13.3       ?       ? 
1 1 1   44    5   56 f    139.7    6.9    0.0000   0.0000          ?        ?   196.6647  19.1556          ?        ?      139.7        6.9       ?       ? 
1 1 1   44    5   57 o    113.2    8.2    0.0000   0.0000          ?        ?   129.6199  18.5171          ?        ?      113.2        8.2       ?       ? 
1 1 1   44    5   58 o    246.8    4.1    0.0000   0.0000          ?        ?   611.0652  20.4327          ?        ?      246.8        4.1       ?       ? 
1 1 1   44    6    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    6    1 o    238.2    2.7    0.0000   0.0000          ?        ?   567.6458  12.7704          ?        ?      238.2        2.7       ?       ? 
1 1 1   44    6    2 o    392.6    2.5    0.0000   0.0000          ?        ?  1541.3911  19.7942          ?        ?      392.6        2.5       ?       ? 
1 1 1   44    6    3 o    167.0    3.2    0.0000   0.0000          ?        ?   279.0340  10.8549          ?        ?      167.0        3.2       ?       ? 
1 1 1   44    6    4 o    527.1    2.7    0.0000   0.0000          ?        ?  2778.8462  28.7335          ?        ?      527.1        2.7       ?       ? 
1 1 1   44    6    5 o    417.6    2.4    0.0000   0.0000          ?        ?  1744.4412  19.7942          ?        ?      417.6        2.4       ?       ? 
1 1 1   44    6    6 o    245.7    2.7    0.0000   0.0000          ?        ?   604.0414  13.4090          ?        ?      245.7        2.7       ?       ? 
1 1 1   44    6    7 o    393.2    2.4    0.0000   0.0000          ?        ?  1546.4994  19.1556          ?        ?      393.2        2.4       ?       ? 
1 1 1   44    6    8 o    600.9    2.8    0.0000   0.0000          ?        ?  3611.4783  33.8416          ?        ?      600.9        2.8       ?       ? 
1 1 1   44    6    9 o    248.1    2.8    0.0000   0.0000          ?        ?   615.5349  14.0475          ?        ?      248.1        2.8       ?       ? 
1 1 1   44    6   10 o    410.6    2.5    0.0000   0.0000          ?        ?  1686.3357  20.4327          ?        ?      410.6        2.5       ?       ? 
1 1 1   44    6   11 o    666.6    3.0    0.0000   0.0000          ?        ?  4444.1104  39.5883          ?        ?      666.6        3.0       ?       ? 
1 1 1   44    6   12 o    577.8    2.5    0.0000   0.0000          ?        ?  3338.8298  29.3720          ?        ?      577.8        2.5       ?       ? 
1 1 1   44    6   13 o    453.5    2.5    0.0000   0.0000          ?        ?  2057.3167  22.9868          ?        ?      453.5        2.5       ?       ? 
1 1 1   44    6   14 o    201.2    3.3    0.0000   0.0000          ?        ?   404.8227  13.4090          ?        ?      201.2        3.3       ?       ? 
1 1 1   44    6   15 f    249.5    2.9    0.0000   0.0000          ?        ?   622.5586  14.6860          ?        ?      249.5        2.9       ?       ? 
1 1 1   44    6   16 o    128.1    5.0    0.0000   0.0000          ?        ?   164.1001  12.7704          ?        ?      128.1        5.0       ?       ? 
1 1 1   44    6   17 o    669.8    3.0    0.0000   0.0000          ?        ?  4488.1685  40.2269          ?        ?      669.8        3.0       ?       ? 
1 1 1   44    6   18 o    732.6    3.1    0.0000   0.0000          ?        ?  5368.0513  45.9736          ?        ?      732.6        3.1       ?       ? 
1 1 1   44    6   19 o    382.6    2.4    0.0000   0.0000          ?        ?  1464.1301  18.5171          ?        ?      382.6        2.4       ?       ? 
1 1 1   44    6   20 o    254.4    2.8    0.0000   0.0000          ?        ?   647.4609  14.0475          ?        ?      254.4        2.8       ?       ? 
1 1 1   44    6   21 o    357.5    2.4    0.0000   0.0000          ?        ?  1278.3203  17.2401          ?        ?      357.5        2.4       ?       ? 
1 1 1   44    6   22 o    436.8    2.4    0.0000   0.0000          ?        ?  1907.9026  21.0712          ?        ?      436.8        2.4       ?       ? 
1 1 1   44    6   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    6   24 o    175.9    4.0    0.0000   0.0000          ?        ?   309.6830  14.0475          ?        ?      175.9        4.0       ?       ? 
1 1 1   44    6   25 o    849.9    3.3    0.0000   0.0000          ?        ?  7226.1489  56.8284          ?        ?      849.9        3.3       ?       ? 
1 1 1   44    6   26 o    333.8    2.6    0.0000   0.0000          ?        ?  1114.2202  17.2401          ?        ?      333.8        2.6       ?       ? 
1 1 1   44    6   27 o    129.0    5.7    0.0000   0.0000          ?        ?   166.6541  14.6860          ?        ?      129.0        5.7       ?       ? 
1 1 1   44    6   28 o    292.5    2.8    0.0000   0.0000          ?        ?   855.6190  16.6016          ?        ?      292.5        2.8       ?       ? 
1 1 1   44    6   29 f    390.2    2.5    0.0000   0.0000          ?        ?  1522.8740  19.1556          ?        ?      390.2        2.5       ?       ? 
1 1 1   44    6   30 o    335.7    2.7    0.0000   0.0000          ?        ?  1127.6293  17.8786          ?        ?      335.7        2.7       ?       ? 
1 1 1   44    6   31 o    272.3    3.0    0.0000   0.0000          ?        ?   741.9621  16.6016          ?        ?      272.3        3.0       ?       ? 
1 1 1   44    6   32 o     35.5   14.0    0.0000   0.0000          ?        ?     7.0237  14.6860          ?        ?       35.5       14.0       ?       ? 
1 1 1   44    6   33 o    210.6    3.5    0.0000   0.0000          ?        ?   443.7725  14.6860          ?        ?      210.6        3.5       ?       ? 
1 1 1   44    6   34 o    179.8    4.4    0.0000   0.0000          ?        ?   323.7305  15.9630          ?        ?      179.8        4.4       ?       ? 
1 1 1   44    6   35 o    316.0    2.8    0.0000   0.0000          ?        ?   999.2863  17.8786          ?        ?      316.0        2.8       ?       ? 
1 1 1   44    6   36 o    212.5    3.8    0.0000   0.0000          ?        ?   452.0733  15.9630          ?        ?      212.5        3.8       ?       ? 
1 1 1   44    6   37 f    224.1    3.6    0.0000   0.0000          ?        ?   502.5165  15.9630          ?        ?      224.1        3.6       ?       ? 
1 1 1   44    6   38 o    175.1    4.6    0.0000   0.0000          ?        ?   307.1289  15.9630          ?        ?      175.1        4.6       ?       ? 
1 1 1   44    6   39 o    170.3    5.1    0.0000   0.0000          ?        ?   290.5273  17.2401          ?        ?      170.3        5.1       ?       ? 
1 1 1   44    6   40 o    139.0    5.5    0.0000   0.0000          ?        ?   193.4720  15.3245          ?        ?      139.0        5.5       ?       ? 
1 1 1   44    6   41 o    114.8    7.0    0.0000   0.0000          ?        ?   132.1740  15.9630          ?        ?      114.8        7.0       ?       ? 
1 1 1   44    6   42 o     28.1   12.8    0.0000   0.0000          ?        ?   -10.2163  15.9630          ?        ?       28.1       12.8       ?       ? 
1 1 1   44    6   43 o    195.1    4.4    0.0000   0.0000          ?        ?   381.1974  17.2401          ?        ?      195.1        4.4       ?       ? 
1 1 1   44    6   44 o     60.3   13.6    0.0000   0.0000          ?        ?    38.3113  15.9630          ?        ?       60.3       13.6       ?       ? 
1 1 1   44    6   45 o     71.1   11.7    0.0000   0.0000          ?        ?    51.0817  16.6016          ?        ?       71.1       11.7       ?       ? 
1 1 1   44    6   46 o    192.4    4.6    0.0000   0.0000          ?        ?   370.9810  17.8786          ?        ?      192.4        4.6       ?       ? 
1 1 1   44    6   47 o     53.2   15.7    0.0000   0.0000          ?        ?    29.3720  17.8786          ?        ?       53.2       15.7       ?       ? 
1 1 1   44    6   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    6   49 o    210.4    4.4    0.0000   0.0000          ?        ?   443.7725  18.5171          ?        ?      210.4        4.4       ?       ? 
1 1 1   44    6   50 o    319.2    3.1    0.0000   0.0000          ?        ?  1019.7190  19.7942          ?        ?      319.2        3.1       ?       ? 
1 1 1   44    6   51 o    162.3    5.7    0.0000   0.0000          ?        ?   264.3480  18.5171          ?        ?      162.3        5.7       ?       ? 
1 1 1   44    6   52 o    186.1    5.0    0.0000   0.0000          ?        ?   347.3558  18.5171          ?        ?      186.1        5.0       ?       ? 
1 1 1   44    6   53 o     25.5   12.3    0.0000   0.0000          ?        ?   -27.4564  18.5171          ?        ?       25.5       12.3       ?       ? 
1 1 1   44    6   54 o     30.0   13.5    0.0000   0.0000          ?        ?    -8.3008  17.2401          ?        ?       30.0       13.5       ?       ? 
1 1 1   44    6   55 o     28.4   13.3    0.0000   0.0000          ?        ?   -16.6016  18.5171          ?        ?       28.4       13.3       ?       ? 
1 1 1   44    6   56 o    209.1    4.6    0.0000   0.0000          ?        ?   438.6643  19.1556          ?        ?      209.1        4.6       ?       ? 
1 1 1   44    6   57 o     85.9   10.4    0.0000   0.0000          ?        ?    75.3456  17.8786          ?        ?       85.9       10.4       ?       ? 
1 1 1   44    6   58 o     82.7   11.2    0.0000   0.0000          ?        ?    70.2374  18.5171          ?        ?       82.7       11.2       ?       ? 
1 1 1   44    7    0 o    239.7    4.0  575.3080  19.1556   575.3080  19.1556   575.3080  19.1556      239.7      4.0      239.7        4.0     0.0     0.0 
1 1 1   44    7    1 o    237.4    3.0    0.0000   0.0000          ?        ?   563.8146  14.0475          ?        ?      237.4        3.0       ?       ? 
1 1 1   44    7    2 o     21.1    9.9    0.0000   0.0000          ?        ?   -12.1319  10.8549          ?        ?       21.1        9.9       ?       ? 
1 1 1   44    7    3 o    329.2    2.5    0.0000   0.0000          ?        ?  1084.2097  16.6016          ?        ?      329.2        2.5       ?       ? 
1 1 1   44    7    4 o    417.9    2.6    0.0000   0.0000          ?        ?  1746.3567  21.7097          ?        ?      417.9        2.6       ?       ? 
1 1 1   44    7    5 o    643.2    3.0    0.0000   0.0000          ?        ?  4137.6201  38.9498          ?        ?      643.2        3.0       ?       ? 
1 1 1   44    7    6 o    737.0    3.2    0.0000   0.0000          ?        ?  5433.1807  47.2506          ?        ?      737.0        3.2       ?       ? 
1 1 1   44    7    7 o    710.8    3.1    0.0000   0.0000          ?        ?  5053.8984  43.4195          ?        ?      710.8        3.1       ?       ? 
1 1 1   44    7    8 o    336.5    2.6    0.0000   0.0000          ?        ?  1132.7373  17.2401          ?        ?      336.5        2.6       ?       ? 
1 1 1   44    7    9 o    118.5    4.9    0.0000   0.0000          ?        ?   140.4748  11.4934          ?        ?      118.5        4.9       ?       ? 
1 1 1   44    7   10 o    536.2    2.6    0.0000   0.0000          ?        ?  2875.9014  28.0950          ?        ?      536.2        2.6       ?       ? 
1 1 1   44    7   11 o    265.5    3.0    0.0000   0.0000          ?        ?   704.9279  15.9630          ?        ?      265.5        3.0       ?       ? 
1 1 1   44    7   12 o    600.5    2.9    0.0000   0.0000          ?        ?  3607.0088  34.4802          ?        ?      600.5        2.9       ?       ? 
1 1 1   44    7   13 o    216.9    3.1    0.0000   0.0000          ?        ?   470.5904  13.4090          ?        ?      216.9        3.1       ?       ? 
1 1 1   44    7   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    7   15 o    502.7    2.5    0.0000   0.0000          ?        ?  2527.9070  24.9023          ?        ?      502.7        2.5       ?       ? 
1 1 1   44    7   16 o     78.6    8.5    0.0000   0.0000          ?        ?    61.9366  13.4090          ?        ?       78.6        8.5       ?       ? 
1 1 1   44    7   17 o    712.4    3.3    0.0000   0.0000          ?        ?  5077.5239  46.6121          ?        ?      712.4        3.3       ?       ? 
1 1 1   44    7   18 o    105.9    6.0    0.0000   0.0000          ?        ?   112.3798  12.7704          ?        ?      105.9        6.0       ?       ? 
1 1 1   44    7   19 o     68.6   10.2    0.0000   0.0000          ?        ?    47.2506  14.0475          ?        ?       68.6       10.2       ?       ? 
1 1 1   44    7   20 f    170.6    3.7    0.0000   0.0000          ?        ?   291.1659  12.7704          ?        ?      170.6        3.7       ?       ? 
1 1 1   44    7   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    7   22 o     19.4    9.5    0.0000   0.0000          ?        ?   -26.1794  12.7704          ?        ?       19.4        9.5       ?       ? 
1 1 1   44    7   23 o    621.9    2.6    0.0000   0.0000          ?        ?  3868.8027  32.5646          ?        ?      621.9        2.6       ?       ? 
1 1 1   44    7   24 o    162.3    4.1    0.0000   0.0000          ?        ?   263.7094  13.4090          ?        ?      162.3        4.1       ?       ? 
1 1 1   44    7   25 o     79.0    8.9    0.0000   0.0000          ?        ?    62.5751  14.0475          ?        ?       79.0        8.9       ?       ? 
1 1 1   44    7   26 o    472.1    2.4    0.0000   0.0000          ?        ?  2229.7175  22.9868          ?        ?      472.1        2.4       ?       ? 
1 1 1   44    7   27 o    268.3    2.9    0.0000   0.0000          ?        ?   720.2524  15.3245          ?        ?      268.3        2.9       ?       ? 
1 1 1   44    7   28 o    289.4    2.8    0.0000   0.0000          ?        ?   837.7404  15.9630          ?        ?      289.4        2.8       ?       ? 
1 1 1   44    7   29 o    526.9    2.5    0.0000   0.0000          ?        ?  2776.9304  26.8179          ?        ?      526.9        2.5       ?       ? 
1 1 1   44    7   30 o    242.8    3.3    0.0000   0.0000          ?        ?   589.9940  15.9630          ?        ?      242.8        3.3       ?       ? 
1 1 1   44    7   31 o    530.4    2.6    0.0000   0.0000          ?        ?  2813.9648  28.0950          ?        ?      530.4        2.6       ?       ? 
1 1 1   44    7   32 o    254.5    3.1    0.0000   0.0000          ?        ?   648.0994  15.9630          ?        ?      254.5        3.1       ?       ? 
1 1 1   44    7   33 o    143.9    5.1    0.0000   0.0000          ?        ?   207.5195  14.6860          ?        ?      143.9        5.1       ?       ? 
1 1 1   44    7   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    7   35 o    219.0    3.6    0.0000   0.0000          ?        ?   480.1682  15.9630          ?        ?      219.0        3.6       ?       ? 
1 1 1   44    7   36 o    340.6    2.8    0.0000   0.0000          ?        ?  1160.8323  19.1556          ?        ?      340.6        2.8       ?       ? 
1 1 1   44    7   37 o    205.0    3.9    0.0000   0.0000          ?        ?   420.7858  15.9630          ?        ?      205.0        3.9       ?       ? 
1 1 1   44    7   38 o    135.9    5.9    0.0000   0.0000          ?        ?   185.1713  15.9630          ?        ?      135.9        5.9       ?       ? 
1 1 1   44    7   39 o    183.0    4.7    0.0000   0.0000          ?        ?   335.2238  17.2401          ?        ?      183.0        4.7       ?       ? 
1 1 1   44    7   40 o    336.6    2.8    0.0000   0.0000          ?        ?  1133.3759  19.1556          ?        ?      336.6        2.8       ?       ? 
1 1 1   44    7   41 o    233.9    3.8    0.0000   0.0000          ?        ?   547.8516  17.8786          ?        ?      233.9        3.8       ?       ? 
1 1 1   44    7   42 f    109.3    7.9    0.0000   0.0000          ?        ?   120.0421  17.2401          ?        ?      109.3        7.9       ?       ? 
1 1 1   44    7   43 o    193.9    4.4    0.0000   0.0000          ?        ?   376.7278  17.2401          ?        ?      193.9        4.4       ?       ? 
1 1 1   44    7   44 o    278.9    3.2    0.0000   0.0000          ?        ?   778.3578  17.8786          ?        ?      278.9        3.2       ?       ? 
1 1 1   44    7   45 o    161.2    5.1    0.0000   0.0000          ?        ?   260.5168  16.6016          ?        ?      161.2        5.1       ?       ? 
1 1 1   44    7   46 o     75.0   11.1    0.0000   0.0000          ?        ?    56.8284  16.6016          ?        ?       75.0       11.1       ?       ? 
1 1 1   44    7   47 o    147.5    6.3    0.0000   0.0000          ?        ?   218.3744  18.5171          ?        ?      147.5        6.3       ?       ? 
1 1 1   44    7   48 o    106.8    8.4    0.0000   0.0000          ?        ?   114.9339  17.8786          ?        ?      106.8        8.4       ?       ? 
1 1 1   44    7   49 o     44.2   16.1    0.0000   0.0000          ?        ?    16.6016  18.5171          ?        ?       44.2       16.1       ?       ? 
1 1 1   44    7   50 o    110.9    8.1    0.0000   0.0000          ?        ?   123.8732  17.8786          ?        ?      110.9        8.1       ?       ? 
1 1 1   44    7   51 o    142.2    6.1    0.0000   0.0000          ?        ?   203.0499  17.2401          ?        ?      142.2        6.1       ?       ? 
1 1 1   44    7   52 o    211.6    4.4    0.0000   0.0000          ?        ?   448.8807  18.5171          ?        ?      211.6        4.4       ?       ? 
1 1 1   44    7   53 o     89.4   10.0    0.0000   0.0000          ?        ?    81.0922  17.8786          ?        ?       89.4       10.0       ?       ? 
1 1 1   44    7   54 o    236.1    4.1    0.0000   0.0000          ?        ?   558.7064  19.1556          ?        ?      236.1        4.1       ?       ? 
1 1 1   44    7   55 o     94.5    9.5    0.0000   0.0000          ?        ?    90.6701  17.8786          ?        ?       94.5        9.5       ?       ? 
1 1 1   44    7   56 o    154.6    6.2    0.0000   0.0000          ?        ?   240.7227  19.1556          ?        ?      154.6        6.2       ?       ? 
1 1 1   44    7   57 o     81.6   11.3    0.0000   0.0000          ?        ?    68.3218  18.5171          ?        ?       81.6       11.3       ?       ? 
1 1 1   44    8    0 o    330.2    3.7 1091.2334  24.2638  1091.2334  24.2638  1091.2334  24.2638      330.2      3.7      330.2        3.7     0.0     0.0 
1 1 1   44    8    1 f    305.1    2.5    0.0000   0.0000          ?        ?   930.9645  15.3245          ?        ?      305.1        2.5       ?       ? 
1 1 1   44    8    2 o    129.6    4.2    0.0000   0.0000          ?        ?   167.9312  10.8549          ?        ?      129.6        4.2       ?       ? 
1 1 1   44    8    3 o    328.8    2.5    0.0000   0.0000          ?        ?  1081.0171  16.6016          ?        ?      328.8        2.5       ?       ? 
1 1 1   44    8    4 o    723.1    3.2    0.0000   0.0000          ?        ?  5230.7690  45.9736          ?        ?      723.1        3.2       ?       ? 
1 1 1   44    8    5 o    447.5    2.5    0.0000   0.0000          ?        ?  2003.0425  22.3483          ?        ?      447.5        2.5       ?       ? 
1 1 1   44    8    6 o    268.7    2.6    0.0000   0.0000          ?        ?   722.1680  14.0475          ?        ?      268.7        2.6       ?       ? 
1 1 1   44    8    7 o    198.9    3.0    0.0000   0.0000          ?        ?   395.8834  12.1319          ?        ?      198.9        3.0       ?       ? 
1 1 1   44    8    8 o    211.4    2.9    0.0000   0.0000          ?        ?   446.9651  12.1319          ?        ?      211.4        2.9       ?       ? 
1 1 1   44    8    9 o    310.9    2.7    0.0000   0.0000          ?        ?   966.7217  16.6016          ?        ?      310.9        2.7       ?       ? 
1 1 1   44    8   10 o    492.3    2.5    0.0000   0.0000          ?        ?  2423.8281  24.9023          ?        ?      492.3        2.5       ?       ? 
1 1 1   44    8   11 o    746.4    3.1    0.0000   0.0000          ?        ?  5573.0166  46.6121          ?        ?      746.4        3.1       ?       ? 
1 1 1   44    8   12 o    347.0    2.6    0.0000   0.0000          ?        ?  1204.2518  17.8786          ?        ?      347.0        2.6       ?       ? 
1 1 1   44    8   13 o    211.8    3.0    0.0000   0.0000          ?        ?   448.8807  12.7704          ?        ?      211.8        3.0       ?       ? 
1 1 1   44    8   14 o    446.1    2.7    0.0000   0.0000          ?        ?  1990.9104  24.2638          ?        ?      446.1        2.7       ?       ? 
1 1 1   44    8   15 o    531.0    2.6    0.0000   0.0000          ?        ?  2820.3501  28.0950          ?        ?      531.0        2.6       ?       ? 
1 1 1   44    8   16 f    345.8    2.5    0.0000   0.0000          ?        ?  1195.9510  17.2401          ?        ?      345.8        2.5       ?       ? 
1 1 1   44    8   17 o    256.7    2.9    0.0000   0.0000          ?        ?   658.9543  14.6860          ?        ?      256.7        2.9       ?       ? 
1 1 1   44    8   18 o    365.8    2.6    0.0000   0.0000          ?        ?  1338.3413  19.1556          ?        ?      365.8        2.6       ?       ? 
1 1 1   44    8   19 o    404.5    2.6    0.0000   0.0000          ?        ?  1636.5309  21.0712          ?        ?      404.5        2.6       ?       ? 
1 1 1   44    8   20 o    400.1    2.5    0.0000   0.0000          ?        ?  1600.7737  19.7942          ?        ?      400.1        2.5       ?       ? 
1 1 1   44    8   21 o    413.5    2.5    0.0000   0.0000          ?        ?  1710.5994  20.4327          ?        ?      413.5        2.5       ?       ? 
1 1 1   44    8   22 o    295.1    2.6    0.0000   0.0000          ?        ?   870.9435  15.3245          ?        ?      295.1        2.6       ?       ? 
1 1 1   44    8   23 o     22.9   10.9    0.0000   0.0000          ?        ?   -16.6016  13.4090          ?        ?       22.9       10.9       ?       ? 
1 1 1   44    8   24 o    263.8    2.8    0.0000   0.0000          ?        ?   695.9886  14.6860          ?        ?      263.8        2.8       ?       ? 
1 1 1   44    8   25 o    505.7    2.5    0.0000   0.0000          ?        ?  2557.9177  25.5409          ?        ?      505.7        2.5       ?       ? 
1 1 1   44    8   26 o    222.8    3.3    0.0000   0.0000          ?        ?   496.7698  14.6860          ?        ?      222.8        3.3       ?       ? 
1 1 1   44    8   27 o    159.7    4.4    0.0000   0.0000          ?        ?   255.4086  14.0475          ?        ?      159.7        4.4       ?       ? 
1 1 1   44    8   28 o    605.8    2.7    0.0000   0.0000          ?        ?  3671.4993  33.2031          ?        ?      605.8        2.7       ?       ? 
1 1 1   44    8   29 o    316.2    2.9    0.0000   0.0000          ?        ?  1000.5634  18.5171          ?        ?      316.2        2.9       ?       ? 
1 1 1   44    8   30 o    216.6    3.7    0.0000   0.0000          ?        ?   469.3134  15.9630          ?        ?      216.6        3.7       ?       ? 
1 1 1   44    8   31 o    108.3    6.5    0.0000   0.0000          ?        ?   117.4880  14.0475          ?        ?      108.3        6.5       ?       ? 
1 1 1   44    8   32 o    252.9    3.3    0.0000   0.0000          ?        ?   639.7986  16.6016          ?        ?      252.9        3.3       ?       ? 
1 1 1   44    8   33 o     20.7   10.2    0.0000   0.0000          ?        ?   -30.6490  14.6860          ?        ?       20.7       10.2       ?       ? 
1 1 1   44    8   34 o    189.7    4.0    0.0000   0.0000          ?        ?   360.1262  15.3245          ?        ?      189.7        4.0       ?       ? 
1 1 1   44    8   35 o     43.1   14.8    0.0000   0.0000          ?        ?    17.2401  15.3245          ?        ?       43.1       14.8       ?       ? 
1 1 1   44    8   36 o    242.9    3.4    0.0000   0.0000          ?        ?   590.6325  16.6016          ?        ?      242.9        3.4       ?       ? 
1 1 1   44    8   37 o    385.8    2.6    0.0000   0.0000          ?        ?  1489.0325  19.7942          ?        ?      385.8        2.6       ?       ? 
1 1 1   44    8   38 o     65.0   12.2    0.0000   0.0000          ?        ?    44.0580  15.3245          ?        ?       65.0       12.2       ?       ? 
1 1 1   44    8   39 o    136.4    5.9    0.0000   0.0000          ?        ?   186.4483  15.9630          ?        ?      136.4        5.9       ?       ? 
1 1 1   44    8   40 o    213.0    3.9    0.0000   0.0000          ?        ?   453.9889  16.6016          ?        ?      213.0        3.9       ?       ? 
1 1 1   44    8   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    8   42 f     68.2   12.7    0.0000   0.0000          ?        ?    48.5276  16.6016          ?        ?       68.2       12.7       ?       ? 
1 1 1   44    8   43 f    294.8    3.1    0.0000   0.0000          ?        ?   869.6664  18.5171          ?        ?      294.8        3.1       ?       ? 
1 1 1   44    8   44 o    284.8    3.5    0.0000   0.0000          ?        ?   812.1995  19.7942          ?        ?      284.8        3.5       ?       ? 
1 1 1   44    8   45 o    140.2    6.4    0.0000   0.0000          ?        ?   197.3032  17.8786          ?        ?      140.2        6.4       ?       ? 
1 1 1   44    8   46 o    236.2    3.9    0.0000   0.0000          ?        ?   558.7064  18.5171          ?        ?      236.2        3.9       ?       ? 
1 1 1   44    8   47 o    118.5    7.0    0.0000   0.0000          ?        ?   141.1133  16.6016          ?        ?      118.5        7.0       ?       ? 
1 1 1   44    8   48 o    190.9    4.7    0.0000   0.0000          ?        ?   365.2344  17.8786          ?        ?      190.9        4.7       ?       ? 
1 1 1   44    8   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    8   50 o    135.9    6.6    0.0000   0.0000          ?        ?   185.8098  17.8786          ?        ?      135.9        6.6       ?       ? 
1 1 1   44    8   51 o     32.1   14.3    0.0000   0.0000          ?        ?    -6.3852  18.5171          ?        ?       32.1       14.3       ?       ? 
1 1 1   44    8   52 o     27.8   13.0    0.0000   0.0000          ?        ?   -16.6016  17.8786          ?        ?       27.8       13.0       ?       ? 
1 1 1   44    8   53 o     21.6   10.7    0.0000   0.0000          ?        ?   -42.7809  17.8786          ?        ?       21.6       10.7       ?       ? 
1 1 1   44    8   54 o    151.2    5.7    0.0000   0.0000          ?        ?   229.8678  17.2401          ?        ?      151.2        5.7       ?       ? 
1 1 1   44    8   55 o     29.0   13.2    0.0000   0.0000          ?        ?   -10.8549  17.2401          ?        ?       29.0       13.2       ?       ? 
1 1 1   44    8   56 o     54.0   16.0    0.0000   0.0000          ?        ?    31.2876  18.5171          ?        ?       54.0       16.0       ?       ? 
1 1 1   44    9    0 o    332.8    3.3 1107.8350  21.7097  1107.8350  21.7097  1107.8350  21.7097      332.8      3.3      332.8        3.3     0.0     0.0 
1 1 1   44    9    1 o    289.6    2.5    0.0000   0.0000          ?        ?   839.0174  14.6860          ?        ?      289.6        2.5       ?       ? 
1 1 1   44    9    2 o    332.9    2.5    0.0000   0.0000          ?        ?  1108.4736  16.6016          ?        ?      332.9        2.5       ?       ? 
1 1 1   44    9    3 o    489.4    2.7    0.0000   0.0000          ?        ?  2395.7332  26.8179          ?        ?      489.4        2.7       ?       ? 
1 1 1   44    9    4 o    104.8    5.2    0.0000   0.0000          ?        ?   109.8257  10.8549          ?        ?      104.8        5.2       ?       ? 
1 1 1   44    9    5 o    264.3    2.7    0.0000   0.0000          ?        ?   698.5427  14.0475          ?        ?      264.3        2.7       ?       ? 
1 1 1   44    9    6 o    334.2    2.5    0.0000   0.0000          ?        ?  1117.4128  16.6016          ?        ?      334.2        2.5       ?       ? 
1 1 1   44    9    7 o    243.1    2.6    0.0000   0.0000          ?        ?   591.2710  12.7704          ?        ?      243.1        2.6       ?       ? 
1 1 1   44    9    8 o     17.1    8.5    0.0000   0.0000          ?        ?   -29.3720  11.4934          ?        ?       17.1        8.5       ?       ? 
1 1 1   44    9    9 o    296.9    2.7    0.0000   0.0000          ?        ?   881.7984  15.9630          ?        ?      296.9        2.7       ?       ? 
1 1 1   44    9   10 o    584.8    2.9    0.0000   0.0000          ?        ?  3420.5605  33.8416          ?        ?      584.8        2.9       ?       ? 
1 1 1   44    9   11 o    459.9    2.6    0.0000   0.0000          ?        ?  2115.4221  23.6253          ?        ?      459.9        2.6       ?       ? 
1 1 1   44    9   12 o    277.7    2.6    0.0000   0.0000          ?        ?   771.3342  14.6860          ?        ?      277.7        2.6       ?       ? 
1 1 1   44    9   13 o    131.5    4.6    0.0000   0.0000          ?        ?   173.0394  12.1319          ?        ?      131.5        4.6       ?       ? 
1 1 1   44    9   14 o    384.5    2.5    0.0000   0.0000          ?        ?  1478.8162  19.1556          ?        ?      384.5        2.5       ?       ? 
1 1 1   44    9   15 o    474.5    2.6    0.0000   0.0000          ?        ?  2252.0659  24.9023          ?        ?      474.5        2.6       ?       ? 
1 1 1   44    9   16 o    396.4    2.6    0.0000   0.0000          ?        ?  1572.0403  20.4327          ?        ?      396.4        2.6       ?       ? 
1 1 1   44    9   17 o    329.8    2.5    0.0000   0.0000          ?        ?  1088.0408  16.6016          ?        ?      329.8        2.5       ?       ? 
1 1 1   44    9   18 f    165.8    4.0    0.0000   0.0000          ?        ?   275.2028  13.4090          ?        ?      165.8        4.0       ?       ? 
1 1 1   44    9   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    9   20 o    532.7    2.8    0.0000   0.0000          ?        ?  2838.2285  29.3720          ?        ?      532.7        2.8       ?       ? 
1 1 1   44    9   21 o    441.4    2.5    0.0000   0.0000          ?        ?  1948.7681  22.3483          ?        ?      441.4        2.5       ?       ? 
1 1 1   44    9   22 o    242.1    2.9    0.0000   0.0000          ?        ?   586.1629  14.0475          ?        ?      242.1        2.9       ?       ? 
1 1 1   44    9   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44    9   24 o    216.6    3.2    0.0000   0.0000          ?        ?   469.3134  14.0475          ?        ?      216.6        3.2       ?       ? 
1 1 1   44    9   25 o    467.0    2.6    0.0000   0.0000          ?        ?  2181.1899  24.2638          ?        ?      467.0        2.6       ?       ? 
1 1 1   44    9   26 o    345.2    2.7    0.0000   0.0000          ?        ?  1192.1199  18.5171          ?        ?      345.2        2.7       ?       ? 
1 1 1   44    9   27 o    105.0    6.7    0.0000   0.0000          ?        ?   110.4642  14.0475          ?        ?      105.0        6.7       ?       ? 
1 1 1   44    9   28 o    295.4    2.9    0.0000   0.0000          ?        ?   872.8591  17.2401          ?        ?      295.4        2.9       ?       ? 
1 1 1   44    9   29 o    307.1    2.8    0.0000   0.0000          ?        ?   943.7350  17.2401          ?        ?      307.1        2.8       ?       ? 
1 1 1   44    9   30 o    298.4    2.7    0.0000   0.0000          ?        ?   890.7377  15.9630          ?        ?      298.4        2.7       ?       ? 
1 1 1   44    9   31 o    194.0    3.9    0.0000   0.0000          ?        ?   376.7278  15.3245          ?        ?      194.0        3.9       ?       ? 
1 1 1   44    9   32 o    115.9    6.3    0.0000   0.0000          ?        ?   134.7281  14.6860          ?        ?      115.9        6.3       ?       ? 
1 1 1   44    9   33 o    379.2    2.6    0.0000   0.0000          ?        ?  1438.5892  19.7942          ?        ?      379.2        2.6       ?       ? 
1 1 1   44    9   34 o     17.9    9.1    0.0000   0.0000          ?        ?   -54.9129  15.9630          ?        ?       17.9        9.1       ?       ? 
1 1 1   44    9   35 o    175.7    4.4    0.0000   0.0000          ?        ?   309.0445  15.3245          ?        ?      175.7        4.4       ?       ? 
1 1 1   44    9   36 o     55.6   13.3    0.0000   0.0000          ?        ?    32.5646  14.6860          ?        ?       55.6       13.3       ?       ? 
1 1 1   44    9   37 o    377.0    2.6    0.0000   0.0000          ?        ?  1421.9877  19.7942          ?        ?      377.0        2.6       ?       ? 
1 1 1   44    9   38 f    156.4    5.1    0.0000   0.0000          ?        ?   245.1923  15.9630          ?        ?      156.4        5.1       ?       ? 
1 1 1   44    9   39 o     78.8    9.7    0.0000   0.0000          ?        ?    62.5751  15.3245          ?        ?       78.8        9.7       ?       ? 
1 1 1   44    9   40 o    315.0    2.9    0.0000   0.0000          ?        ?   992.9011  18.5171          ?        ?      315.0        2.9       ?       ? 
1 1 1   44    9   41 o     25.7   12.0    0.0000   0.0000          ?        ?   -14.6860  15.3245          ?        ?       25.7       12.0       ?       ? 
1 1 1   44    9   42 o    299.5    3.1    0.0000   0.0000          ?        ?   897.7615  18.5171          ?        ?      299.5        3.1       ?       ? 
1 1 1   44    9   43 o     38.0   14.7    0.0000   0.0000          ?        ?     9.5778  15.9630          ?        ?       38.0       14.7       ?       ? 
1 1 1   44    9   44 o     74.1   11.6    0.0000   0.0000          ?        ?    55.5514  17.2401          ?        ?       74.1       11.6       ?       ? 
1 1 1   44    9   45 o    142.5    6.1    0.0000   0.0000          ?        ?   203.6884  17.2401          ?        ?      142.5        6.1       ?       ? 
1 1 1   44    9   46 o    217.0    4.1    0.0000   0.0000          ?        ?   471.8675  17.8786          ?        ?      217.0        4.1       ?       ? 
1 1 1   44    9   47 o     60.0   14.5    0.0000   0.0000          ?        ?    38.3113  17.2401          ?        ?       60.0       14.5       ?       ? 
1 1 1   44    9   48 o     70.2   12.7    0.0000   0.0000          ?        ?    51.7203  17.2401          ?        ?       70.2       12.7       ?       ? 
1 1 1   44    9   49 o    339.2    3.0    0.0000   0.0000          ?        ?  1151.8929  20.4327          ?        ?      339.2        3.0       ?       ? 
1 1 1   44    9   50 o    278.1    3.6    0.0000   0.0000          ?        ?   774.5267  19.7942          ?        ?      278.1        3.6       ?       ? 
1 1 1   44    9   51 o    252.9    3.8    0.0000   0.0000          ?        ?   641.0757  19.1556          ?        ?      252.9        3.8       ?       ? 
1 1 1   44    9   52 o     42.7   15.8    0.0000   0.0000          ?        ?    15.3245  17.8786          ?        ?       42.7       15.8       ?       ? 
1 1 1   44    9   53 o    254.7    3.6    0.0000   0.0000          ?        ?   650.0150  18.5171          ?        ?      254.7        3.6       ?       ? 
1 1 1   44    9   54 f     21.1   10.5    0.0000   0.0000          ?        ?   -45.9736  17.8786          ?        ?       21.1       10.5       ?       ? 
1 1 1   44    9   55 o     45.9   15.4    0.0000   0.0000          ?        ?    21.0712  16.6016          ?        ?       45.9       15.4       ?       ? 
1 1 1   44   10    0 o    115.6    6.1  134.7281  14.0475   134.7281  14.0475   134.7281  14.0475      115.6      6.1      115.6        6.1     0.0     0.0 
1 1 1   44   10    1 o    175.6    3.3    0.0000   0.0000          ?        ?   308.4059  11.4934          ?        ?      175.6        3.3       ?       ? 
1 1 1   44   10    2 o     80.6    6.3    0.0000   0.0000          ?        ?    65.1292  10.2163          ?        ?       80.6        6.3       ?       ? 
1 1 1   44   10    3 o    506.3    2.7    0.0000   0.0000          ?        ?  2564.3030  27.4564          ?        ?      506.3        2.7       ?       ? 
1 1 1   44   10    4 o    421.7    2.5    0.0000   0.0000          ?        ?  1778.9213  21.0712          ?        ?      421.7        2.5       ?       ? 
1 1 1   44   10    5 o     34.7   12.0    0.0000   0.0000          ?        ?    10.8549  10.2163          ?        ?       34.7       12.0       ?       ? 
1 1 1   44   10    6 o    250.0    2.7    0.0000   0.0000          ?        ?   625.1127  13.4090          ?        ?      250.0        2.7       ?       ? 
1 1 1   44   10    7 o    512.8    2.7    0.0000   0.0000          ?        ?  2630.0706  27.4564          ?        ?      512.8        2.7       ?       ? 
1 1 1   44   10    8 o    644.9    3.0    0.0000   0.0000          ?        ?  4160.6069  38.9498          ?        ?      644.9        3.0       ?       ? 
1 1 1   44   10    9 o    126.1    4.3    0.0000   0.0000          ?        ?   158.9919  10.8549          ?        ?      126.1        4.3       ?       ? 
1 1 1   44   10   10 o    132.0    4.4    0.0000   0.0000          ?        ?   174.3164  11.4934          ?        ?      132.0        4.4       ?       ? 
1 1 1   44   10   11 o    360.3    2.4    0.0000   0.0000          ?        ?  1298.1145  17.2401          ?        ?      360.3        2.4       ?       ? 
1 1 1   44   10   12 o     16.7    8.3    0.0000   0.0000          ?        ?   -31.2876  11.4934          ?        ?       16.7        8.3       ?       ? 
1 1 1   44   10   13 f    140.7    3.9    0.0000   0.0000          ?        ?   197.9417  10.8549          ?        ?      140.7        3.9       ?       ? 
1 1 1   44   10   14 o    234.0    2.9    0.0000   0.0000          ?        ?   547.8516  13.4090          ?        ?      234.0        2.9       ?       ? 
1 1 1   44   10   15 o    550.9    2.7    0.0000   0.0000          ?        ?  3036.1704  30.0105          ?        ?      550.9        2.7       ?       ? 
1 1 1   44   10   16 o     16.6    8.3    0.0000   0.0000          ?        ?   -40.8654  12.7704          ?        ?       16.6        8.3       ?       ? 
1 1 1   44   10   17 o    179.5    3.7    0.0000   0.0000          ?        ?   322.4534  13.4090          ?        ?      179.5        3.7       ?       ? 
1 1 1   44   10   18 o    163.1    3.9    0.0000   0.0000          ?        ?   266.2635  12.7704          ?        ?      163.1        3.9       ?       ? 
1 1 1   44   10   19 f    412.6    2.6    0.0000   0.0000          ?        ?  1702.9373  21.7097          ?        ?      412.6        2.6       ?       ? 
1 1 1   44   10   20 f     96.4    7.3    0.0000   0.0000          ?        ?    93.2242  14.0475          ?        ?       96.4        7.3       ?       ? 
1 1 1   44   10   21 o     72.2    8.8    0.0000   0.0000          ?        ?    52.3588  12.7704          ?        ?       72.2        8.8       ?       ? 
1 1 1   44   10   22 o     38.1   13.7    0.0000   0.0000          ?        ?    12.1319  13.4090          ?        ?       38.1       13.7       ?       ? 
1 1 1   44   10   23 o    363.2    2.6    0.0000   0.0000          ?        ?  1319.8242  19.1556          ?        ?      363.2        2.6       ?       ? 
1 1 1   44   10   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   10   25 o    128.0    5.2    0.0000   0.0000          ?        ?   164.1001  13.4090          ?        ?      128.0        5.2       ?       ? 
1 1 1   44   10   26 o    473.7    2.5    0.0000   0.0000          ?        ?  2244.4036  23.6253          ?        ?      473.7        2.5       ?       ? 
1 1 1   44   10   27 o    150.9    4.7    0.0000   0.0000          ?        ?   227.9522  14.0475          ?        ?      150.9        4.7       ?       ? 
1 1 1   44   10   28 f    385.8    2.6    0.0000   0.0000          ?        ?  1489.0325  19.7942          ?        ?      385.8        2.6       ?       ? 
1 1 1   44   10   29 o    245.2    3.1    0.0000   0.0000          ?        ?   601.4874  15.3245          ?        ?      245.2        3.1       ?       ? 
1 1 1   44   10   30 o    118.1    5.9    0.0000   0.0000          ?        ?   139.8362  14.0475          ?        ?      118.1        5.9       ?       ? 
1 1 1   44   10   31 o    184.2    4.2    0.0000   0.0000          ?        ?   339.6935  15.3245          ?        ?      184.2        4.2       ?       ? 
1 1 1   44   10   32 o    267.0    3.1    0.0000   0.0000          ?        ?   713.2286  16.6016          ?        ?      267.0        3.1       ?       ? 
1 1 1   44   10   33 o    292.0    2.8    0.0000   0.0000          ?        ?   853.0649  16.6016          ?        ?      292.0        2.8       ?       ? 
1 1 1   44   10   34 o    137.6    5.6    0.0000   0.0000          ?        ?   189.6409  15.3245          ?        ?      137.6        5.6       ?       ? 
1 1 1   44   10   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   10   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   10   37 o    329.4    2.8    0.0000   0.0000          ?        ?  1085.4868  18.5171          ?        ?      329.4        2.8       ?       ? 
1 1 1   44   10   38 o    305.6    3.0    0.0000   0.0000          ?        ?   934.7956  18.5171          ?        ?      305.6        3.0       ?       ? 
1 1 1   44   10   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   10   40 o    164.2    5.1    0.0000   0.0000          ?        ?   270.0946  16.6016          ?        ?      164.2        5.1       ?       ? 
1 1 1   44   10   41 o    158.0    5.1    0.0000   0.0000          ?        ?   250.3005  15.9630          ?        ?      158.0        5.1       ?       ? 
1 1 1   44   10   42 f     22.8   11.2    0.0000   0.0000          ?        ?   -33.8416  17.2401          ?        ?       22.8       11.2       ?       ? 
1 1 1   44   10   43 o     46.4   15.4    0.0000   0.0000          ?        ?    21.0712  16.6016          ?        ?       46.4       15.4       ?       ? 
1 1 1   44   10   44 o     25.4   12.1    0.0000   0.0000          ?        ?   -22.9868  17.2401          ?        ?       25.4       12.1       ?       ? 
1 1 1   44   10   45 o     28.5   13.2    0.0000   0.0000          ?        ?   -14.6860  17.8786          ?        ?       28.5       13.2       ?       ? 
1 1 1   44   10   46 o    144.8    6.4    0.0000   0.0000          ?        ?   210.7121  18.5171          ?        ?      144.8        6.4       ?       ? 
1 1 1   44   10   47 f     29.6   13.4    0.0000   0.0000          ?        ?    -9.5778  17.2401          ?        ?       29.6       13.4       ?       ? 
1 1 1   44   10   48 o    115.1    7.8    0.0000   0.0000          ?        ?   133.4510  17.8786          ?        ?      115.1        7.8       ?       ? 
1 1 1   44   10   49 o    186.1    5.0    0.0000   0.0000          ?        ?   347.3558  18.5171          ?        ?      186.1        5.0       ?       ? 
1 1 1   44   10   50 o     33.1   14.4    0.0000   0.0000          ?        ?    -2.5541  17.8786          ?        ?       33.1       14.4       ?       ? 
1 1 1   44   10   51 o    133.9    6.9    0.0000   0.0000          ?        ?   180.7016  18.5171          ?        ?      133.9        6.9       ?       ? 
1 1 1   44   10   52 o     74.8   12.4    0.0000   0.0000          ?        ?    57.4669  18.5171          ?        ?       74.8       12.4       ?       ? 
1 1 1   44   10   53 o     49.2   15.9    0.0000   0.0000          ?        ?    24.9023  17.8786          ?        ?       49.2       15.9       ?       ? 
1 1 1   44   10   54 o     23.5   11.5    0.0000   0.0000          ?        ?   -32.5646  17.8786          ?        ?       23.5       11.5       ?       ? 
1 1 1   44   11    0 o    939.3    5.8 8828.8379 108.5487  8828.8379 108.5487  8828.8379 108.5487      939.3      5.8      939.3        5.8     0.0     0.0 
1 1 1   44   11    1 o    344.2    2.6    0.0000   0.0000          ?        ?  1185.0962  17.8786          ?        ?      344.2        2.6       ?       ? 
1 1 1   44   11    2 f    437.3    2.5    0.0000   0.0000          ?        ?  1912.3723  21.7097          ?        ?      437.3        2.5       ?       ? 
1 1 1   44   11    3 o    219.2    2.6    0.0000   0.0000          ?        ?   480.8068  11.4934          ?        ?      219.2        2.6       ?       ? 
1 1 1   44   11    4 o    250.8    2.7    0.0000   0.0000          ?        ?   628.9438  13.4090          ?        ?      250.8        2.7       ?       ? 
1 1 1   44   11    5 o    291.1    2.4    0.0000   0.0000          ?        ?   847.3182  14.0475          ?        ?      291.1        2.4       ?       ? 
1 1 1   44   11    6 o    337.7    2.6    0.0000   0.0000          ?        ?  1140.3997  17.8786          ?        ?      337.7        2.6       ?       ? 
1 1 1   44   11    7 o    304.8    2.6    0.0000   0.0000          ?        ?   929.0490  15.9630          ?        ?      304.8        2.6       ?       ? 
1 1 1   44   11    8 o    374.2    2.4    0.0000   0.0000          ?        ?  1400.9164  17.8786          ?        ?      374.2        2.4       ?       ? 
1 1 1   44   11    9 o    123.8    4.1    0.0000   0.0000          ?        ?   153.2452  10.2163          ?        ?      123.8        4.1       ?       ? 
1 1 1   44   11   10 o    300.3    2.6    0.0000   0.0000          ?        ?   902.2311  15.3245          ?        ?      300.3        2.6       ?       ? 
1 1 1   44   11   11 o    441.0    2.5    0.0000   0.0000          ?        ?  1944.9369  21.7097          ?        ?      441.0        2.5       ?       ? 
1 1 1   44   11   12 o     92.8    6.2    0.0000   0.0000          ?        ?    86.2004  11.4934          ?        ?       92.8        6.2       ?       ? 
1 1 1   44   11   13 o    209.6    3.0    0.0000   0.0000          ?        ?   439.3029  12.7704          ?        ?      209.6        3.0       ?       ? 
1 1 1   44   11   14 o     21.6   10.1    0.0000   0.0000          ?        ?   -10.8549  10.8549          ?        ?       21.6       10.1       ?       ? 
1 1 1   44   11   15 o    273.6    2.8    0.0000   0.0000          ?        ?   748.9859  15.3245          ?        ?      273.6        2.8       ?       ? 
1 1 1   44   11   16 o    450.5    2.6    0.0000   0.0000          ?        ?  2029.8602  23.6253          ?        ?      450.5        2.6       ?       ? 
1 1 1   44   11   17 o    212.4    3.3    0.0000   0.0000          ?        ?   451.4348  14.0475          ?        ?      212.4        3.3       ?       ? 
1 1 1   44   11   18 o    414.2    2.6    0.0000   0.0000          ?        ?  1716.3461  21.7097          ?        ?      414.2        2.6       ?       ? 
1 1 1   44   11   19 o    425.5    2.6    0.0000   0.0000          ?        ?  1810.8474  21.7097          ?        ?      425.5        2.6       ?       ? 
1 1 1   44   11   20 o     19.6    9.6    0.0000   0.0000          ?        ?   -25.5409  12.7704          ?        ?       19.6        9.6       ?       ? 
1 1 1   44   11   21 o    124.7    5.4    0.0000   0.0000          ?        ?   155.7993  13.4090          ?        ?      124.7        5.4       ?       ? 
1 1 1   44   11   22 o    400.2    2.6    0.0000   0.0000          ?        ?  1602.0508  20.4327          ?        ?      400.2        2.6       ?       ? 
1 1 1   44   11   23 o    323.7    2.7    0.0000   0.0000          ?        ?  1048.4525  17.2401          ?        ?      323.7        2.7       ?       ? 
1 1 1   44   11   24 o    403.7    2.5    0.0000   0.0000          ?        ?  1630.1458  19.7942          ?        ?      403.7        2.5       ?       ? 
1 1 1   44   11   25 o    312.7    2.7    0.0000   0.0000          ?        ?   978.2151  16.6016          ?        ?      312.7        2.7       ?       ? 
1 1 1   44   11   26 o    225.0    3.3    0.0000   0.0000          ?        ?   506.3477  14.6860          ?        ?      225.0        3.3       ?       ? 
1 1 1   44   11   27 o    150.0    5.1    0.0000   0.0000          ?        ?   225.3981  15.3245          ?        ?      150.0        5.1       ?       ? 
1 1 1   44   11   28 o    310.9    2.6    0.0000   0.0000          ?        ?   966.7217  15.9630          ?        ?      310.9        2.6       ?       ? 
1 1 1   44   11   29 o     18.2    9.1    0.0000   0.0000          ?        ?   -44.0580  14.6860          ?        ?       18.2        9.1       ?       ? 
1 1 1   44   11   30 o    107.7    6.5    0.0000   0.0000          ?        ?   116.2109  14.0475          ?        ?      107.7        6.5       ?       ? 
1 1 1   44   11   31 o    148.1    4.7    0.0000   0.0000          ?        ?   219.6514  14.0475          ?        ?      148.1        4.7       ?       ? 
1 1 1   44   11   32 o     30.7   13.2    0.0000   0.0000          ?        ?    -1.2770  14.6860          ?        ?       30.7       13.2       ?       ? 
1 1 1   44   11   33 o    206.0    3.9    0.0000   0.0000          ?        ?   424.6169  15.9630          ?        ?      206.0        3.9       ?       ? 
1 1 1   44   11   34 o     82.4    9.3    0.0000   0.0000          ?        ?    68.3218  15.3245          ?        ?       82.4        9.3       ?       ? 
1 1 1   44   11   35 o    132.6    6.3    0.0000   0.0000          ?        ?   176.2320  16.6016          ?        ?      132.6        6.3       ?       ? 
1 1 1   44   11   36 f    388.7    2.7    0.0000   0.0000          ?        ?  1511.3806  21.0712          ?        ?      388.7        2.7       ?       ? 
1 1 1   44   11   37 o    279.7    3.3    0.0000   0.0000          ?        ?   782.8275  18.5171          ?        ?      279.7        3.3       ?       ? 
1 1 1   44   11   38 o     37.5   14.4    0.0000   0.0000          ?        ?     9.5778  15.3245          ?        ?       37.5       14.4       ?       ? 
1 1 1   44   11   39 o     17.6    8.9    0.0000   0.0000          ?        ?   -57.4669  15.9630          ?        ?       17.6        8.9       ?       ? 
1 1 1   44   11   40 o    350.0    2.8    0.0000   0.0000          ?        ?  1225.9615  19.7942          ?        ?      350.0        2.8       ?       ? 
1 1 1   44   11   41 o     25.2   12.1    0.0000   0.0000          ?        ?   -23.6253  17.2401          ?        ?       25.2       12.1       ?       ? 
1 1 1   44   11   42 o     89.7    9.3    0.0000   0.0000          ?        ?    81.0922  16.6016          ?        ?       89.7        9.3       ?       ? 
1 1 1   44   11   43 o     25.9   12.2    0.0000   0.0000          ?        ?   -18.5171  16.6016          ?        ?       25.9       12.2       ?       ? 
1 1 1   44   11   44 o    165.3    5.2    0.0000   0.0000          ?        ?   273.9258  17.2401          ?        ?      165.3        5.2       ?       ? 
1 1 1   44   11   45 o    176.1    5.3    0.0000   0.0000          ?        ?   310.9600  18.5171          ?        ?      176.1        5.3       ?       ? 
1 1 1   44   11   46 o     32.9   14.4    0.0000   0.0000          ?        ?    -3.1926  17.8786          ?        ?       32.9       14.4       ?       ? 
1 1 1   44   11   47 o     21.5   10.6    0.0000   0.0000          ?        ?   -40.2269  17.2401          ?        ?       21.5       10.6       ?       ? 
1 1 1   44   11   48 o    309.8    3.1    0.0000   0.0000          ?        ?   960.9750  19.1556          ?        ?      309.8        3.1       ?       ? 
1 1 1   44   11   49 o     96.3    9.3    0.0000   0.0000          ?        ?    93.8627  17.8786          ?        ?       96.3        9.3       ?       ? 
1 1 1   44   11   50 o     33.0   14.4    0.0000   0.0000          ?        ?    -2.5541  17.8786          ?        ?       33.0       14.4       ?       ? 
1 1 1   44   11   51 o    163.9    5.5    0.0000   0.0000          ?        ?   270.0946  17.8786          ?        ?      163.9        5.5       ?       ? 
1 1 1   44   11   52 o     59.0   15.1    0.0000   0.0000          ?        ?    37.6728  17.8786          ?        ?       59.0       15.1       ?       ? 
1 1 1   44   11   53 o    114.3    7.8    0.0000   0.0000          ?        ?   132.1740  17.8786          ?        ?      114.3        7.8       ?       ? 
1 1 1   44   11   54 o     22.3   11.0    0.0000   0.0000          ?        ?   -35.1187  17.2401          ?        ?       22.3       11.0       ?       ? 
1 1 1   44   12    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   12    1 o    179.7    2.8    0.0000   0.0000          ?        ?   323.0919  10.2163          ?        ?      179.7        2.8       ?       ? 
1 1 1   44   12    2 o    369.0    2.5    0.0000   0.0000          ?        ?  1361.9667  18.5171          ?        ?      369.0        2.5       ?       ? 
1 1 1   44   12    3 o    386.4    2.4    0.0000   0.0000          ?        ?  1493.5021  18.5171          ?        ?      386.4        2.4       ?       ? 
1 1 1   44   12    4 o    421.5    2.4    0.0000   0.0000          ?        ?  1777.0056  20.4327          ?        ?      421.5        2.4       ?       ? 
1 1 1   44   12    5 o    470.2    2.5    0.0000   0.0000          ?        ?  2211.2002  23.6253          ?        ?      470.2        2.5       ?       ? 
1 1 1   44   12    6 o    190.6    2.8    0.0000   0.0000          ?        ?   363.3188  10.8549          ?        ?      190.6        2.8       ?       ? 
1 1 1   44   12    7 o    305.1    2.5    0.0000   0.0000          ?        ?   930.9645  15.3245          ?        ?      305.1        2.5       ?       ? 
1 1 1   44   12    8 o    529.7    2.8    0.0000   0.0000          ?        ?  2806.9412  29.3720          ?        ?      529.7        2.8       ?       ? 
1 1 1   44   12    9 o    215.0    2.8    0.0000   0.0000          ?        ?   462.2897  12.1319          ?        ?      215.0        2.8       ?       ? 
1 1 1   44   12   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   12   11 o    441.8    2.6    0.0000   0.0000          ?        ?  1952.5990  22.9868          ?        ?      441.8        2.6       ?       ? 
1 1 1   44   12   12 o    216.2    3.0    0.0000   0.0000          ?        ?   467.3978  12.7704          ?        ?      216.2        3.0       ?       ? 
1 1 1   44   12   13 o    246.6    2.7    0.0000   0.0000          ?        ?   608.5111  13.4090          ?        ?      246.6        2.7       ?       ? 
1 1 1   44   12   14 o    437.0    2.6    0.0000   0.0000          ?        ?  1909.8182  22.9868          ?        ?      437.0        2.6       ?       ? 
1 1 1   44   12   15 o    410.2    2.6    0.0000   0.0000          ?        ?  1683.1431  21.0712          ?        ?      410.2        2.6       ?       ? 
1 1 1   44   12   16 o    437.9    2.6    0.0000   0.0000          ?        ?  1918.1189  22.3483          ?        ?      437.9        2.6       ?       ? 
1 1 1   44   12   17 o     38.2   13.1    0.0000   0.0000          ?        ?    13.4090  12.1319          ?        ?       38.2       13.1       ?       ? 
1 1 1   44   12   18 f    293.4    2.8    0.0000   0.0000          ?        ?   861.3657  16.6016          ?        ?      293.4        2.8       ?       ? 
1 1 1   44   12   19 o    142.7    4.3    0.0000   0.0000          ?        ?   203.6884  12.1319          ?        ?      142.7        4.3       ?       ? 
1 1 1   44   12   20 o    187.7    3.6    0.0000   0.0000          ?        ?   352.4639  13.4090          ?        ?      187.7        3.6       ?       ? 
1 1 1   44   12   21 o    326.8    2.6    0.0000   0.0000          ?        ?  1068.2467  17.2401          ?        ?      326.8        2.6       ?       ? 
1 1 1   44   12   22 o    299.0    2.8    0.0000   0.0000          ?        ?   894.5688  16.6016          ?        ?      299.0        2.8       ?       ? 
1 1 1   44   12   23 o    341.6    2.5    0.0000   0.0000          ?        ?  1167.2175  17.2401          ?        ?      341.6        2.5       ?       ? 
1 1 1   44   12   24 o     23.4   11.1    0.0000   0.0000          ?        ?   -17.2401  14.0475          ?        ?       23.4       11.1       ?       ? 
1 1 1   44   12   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   12   26 o    343.5    2.6    0.0000   0.0000          ?        ?  1180.6265  17.8786          ?        ?      343.5        2.6       ?       ? 
1 1 1   44   12   27 o    319.3    2.8    0.0000   0.0000          ?        ?  1019.7190  17.8786          ?        ?      319.3        2.8       ?       ? 
1 1 1   44   12   28 o    162.3    4.3    0.0000   0.0000          ?        ?   263.7094  14.0475          ?        ?      162.3        4.3       ?       ? 
1 1 1   44   12   29 o    314.6    2.6    0.0000   0.0000          ?        ?   990.3471  16.6016          ?        ?      314.6        2.6       ?       ? 
1 1 1   44   12   30 f    417.5    2.6    0.0000   0.0000          ?        ?  1743.8026  21.7097          ?        ?      417.5        2.6       ?       ? 
1 1 1   44   12   31 o    163.3    4.5    0.0000   0.0000          ?        ?   266.9020  14.6860          ?        ?      163.3        4.5       ?       ? 
1 1 1   44   12   32 o    255.5    3.2    0.0000   0.0000          ?        ?   653.2076  16.6016          ?        ?      255.5        3.2       ?       ? 
1 1 1   44   12   33 o     17.7    9.0    0.0000   0.0000          ?        ?   -51.7203  15.3245          ?        ?       17.7        9.0       ?       ? 
1 1 1   44   12   34 o     70.7   10.8    0.0000   0.0000          ?        ?    50.4432  15.3245          ?        ?       70.7       10.8       ?       ? 
1 1 1   44   12   35 o    231.4    3.4    0.0000   0.0000          ?        ?   535.7197  15.9630          ?        ?      231.4        3.4       ?       ? 
1 1 1   44   12   36 f    241.5    3.4    0.0000   0.0000          ?        ?   583.6088  16.6016          ?        ?      241.5        3.4       ?       ? 
1 1 1   44   12   37 o     71.6   10.7    0.0000   0.0000          ?        ?    51.7203  15.3245          ?        ?       71.6       10.7       ?       ? 
1 1 1   44   12   38 o    101.8    7.8    0.0000   0.0000          ?        ?   104.0790  15.9630          ?        ?      101.8        7.8       ?       ? 
1 1 1   44   12   39 o    102.0    8.1    0.0000   0.0000          ?        ?   104.7175  16.6016          ?        ?      102.0        8.1       ?       ? 
1 1 1   44   12   40 o    158.6    5.4    0.0000   0.0000          ?        ?   252.2160  17.2401          ?        ?      158.6        5.4       ?       ? 
1 1 1   44   12   41 o    238.0    3.8    0.0000   0.0000          ?        ?   567.0072  17.8786          ?        ?      238.0        3.8       ?       ? 
1 1 1   44   12   42 o    409.2    2.8    0.0000   0.0000          ?        ?  1676.1193  22.9868          ?        ?      409.2        2.8       ?       ? 
1 1 1   44   12   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   12   44 o     28.9   13.2    0.0000   0.0000          ?        ?   -11.4934  17.2401          ?        ?       28.9       13.2       ?       ? 
1 1 1   44   12   45 o    176.6    4.9    0.0000   0.0000          ?        ?   312.8756  17.2401          ?        ?      176.6        4.9       ?       ? 
1 1 1   44   12   46 o     67.4   13.3    0.0000   0.0000          ?        ?    47.8891  17.2401          ?        ?       67.4       13.3       ?       ? 
1 1 1   44   12   47 f     82.8   10.4    0.0000   0.0000          ?        ?    69.5989  17.2401          ?        ?       82.8       10.4       ?       ? 
1 1 1   44   12   48 o     61.8   14.7    0.0000   0.0000          ?        ?    40.8654  17.8786          ?        ?       61.8       14.7       ?       ? 
1 1 1   44   12   49 o     52.8   15.8    0.0000   0.0000          ?        ?    29.3720  17.8786          ?        ?       52.8       15.8       ?       ? 
1 1 1   44   12   50 o    222.8    4.3    0.0000   0.0000          ?        ?   498.0469  19.1556          ?        ?      222.8        4.3       ?       ? 
1 1 1   44   12   51 o    142.2    6.3    0.0000   0.0000          ?        ?   203.6884  17.8786          ?        ?      142.2        6.3       ?       ? 
1 1 1   44   12   52 o    294.1    3.4    0.0000   0.0000          ?        ?   867.1124  19.7942          ?        ?      294.1        3.4       ?       ? 
1 1 1   44   12   53 o     92.9    9.6    0.0000   0.0000          ?        ?    88.1160  17.8786          ?        ?       92.9        9.6       ?       ? 
1 1 1   44   13    0 o    317.8    3.2 1010.7797  20.4327  1010.7797  20.4327  1010.7797  20.4327      317.8      3.2      317.8        3.2     0.0     0.0 
1 1 1   44   13    1 o    116.6    3.8    0.0000   0.0000          ?        ?   136.0051   8.9393          ?        ?      116.6        3.8       ?       ? 
1 1 1   44   13    2 o    227.9    2.7    0.0000   0.0000          ?        ?   519.7566  12.1319          ?        ?      227.9        2.7       ?       ? 
1 1 1   44   13    3 o    157.8    3.2    0.0000   0.0000          ?        ?   249.0234  10.2163          ?        ?      157.8        3.2       ?       ? 
1 1 1   44   13    4 o    167.0    2.9    0.0000   0.0000          ?        ?   279.0340   9.5778          ?        ?      167.0        2.9       ?       ? 
1 1 1   44   13    5 o    335.9    2.4    0.0000   0.0000          ?        ?  1128.2677  15.9630          ?        ?      335.9        2.4       ?       ? 
1 1 1   44   13    6 o    467.6    2.5    0.0000   0.0000          ?        ?  2186.9365  23.6253          ?        ?      467.6        2.5       ?       ? 
1 1 1   44   13    7 o    439.2    2.6    0.0000   0.0000          ?        ?  1929.6124  22.9868          ?        ?      439.2        2.6       ?       ? 
1 1 1   44   13    8 o    381.7    2.5    0.0000   0.0000          ?        ?  1457.1063  19.1556          ?        ?      381.7        2.5       ?       ? 
1 1 1   44   13    9 o    647.3    3.0    0.0000   0.0000          ?        ?  4191.8945  38.9498          ?        ?      647.3        3.0       ?       ? 
1 1 1   44   13   10 o    224.3    2.7    0.0000   0.0000          ?        ?   503.1551  12.1319          ?        ?      224.3        2.7       ?       ? 
1 1 1   44   13   11 o    314.1    2.4    0.0000   0.0000          ?        ?   987.1545  15.3245          ?        ?      314.1        2.4       ?       ? 
1 1 1   44   13   12 o     37.5   12.4    0.0000   0.0000          ?        ?    13.4090  10.8549          ?        ?       37.5       12.4       ?       ? 
1 1 1   44   13   13 o     27.4   11.6    0.0000   0.0000          ?        ?     0.6385  10.8549          ?        ?       27.4       11.6       ?       ? 
1 1 1   44   13   14 o    235.8    2.8    0.0000   0.0000          ?        ?   556.1523  13.4090          ?        ?      235.8        2.8       ?       ? 
1 1 1   44   13   15 o    255.3    3.0    0.0000   0.0000          ?        ?   651.9305  15.3245          ?        ?      255.3        3.0       ?       ? 
1 1 1   44   13   16 o    303.2    2.7    0.0000   0.0000          ?        ?   919.4711  16.6016          ?        ?      303.2        2.7       ?       ? 
1 1 1   44   13   17 o    231.3    2.9    0.0000   0.0000          ?        ?   535.0811  13.4090          ?        ?      231.3        2.9       ?       ? 
1 1 1   44   13   18 o     58.1   11.4    0.0000   0.0000          ?        ?    35.1187  12.7704          ?        ?       58.1       11.4       ?       ? 
1 1 1   44   13   19 o     19.9    9.8    0.0000   0.0000          ?        ?   -30.6490  14.0475          ?        ?       19.9        9.8       ?       ? 
1 1 1   44   13   20 o    289.3    2.6    0.0000   0.0000          ?        ?   837.1019  15.3245          ?        ?      289.3        2.6       ?       ? 
1 1 1   44   13   21 o    334.7    2.7    0.0000   0.0000          ?        ?  1120.6055  17.8786          ?        ?      334.7        2.7       ?       ? 
1 1 1   44   13   22 o    291.5    3.0    0.0000   0.0000          ?        ?   849.8723  17.2401          ?        ?      291.5        3.0       ?       ? 
1 1 1   44   13   23 o    219.5    3.3    0.0000   0.0000          ?        ?   482.0838  14.6860          ?        ?      219.5        3.3       ?       ? 
1 1 1   44   13   24 o    262.5    2.9    0.0000   0.0000          ?        ?   689.6033  15.3245          ?        ?      262.5        2.9       ?       ? 
1 1 1   44   13   25 o    278.2    2.9    0.0000   0.0000          ?        ?   774.5267  15.9630          ?        ?      278.2        2.9       ?       ? 
1 1 1   44   13   26 o     82.5    8.1    0.0000   0.0000          ?        ?    68.3218  13.4090          ?        ?       82.5        8.1       ?       ? 
1 1 1   44   13   27 o    310.0    2.7    0.0000   0.0000          ?        ?   961.6136  16.6016          ?        ?      310.0        2.7       ?       ? 
1 1 1   44   13   28 o    255.4    3.3    0.0000   0.0000          ?        ?   652.5691  16.6016          ?        ?      255.4        3.3       ?       ? 
1 1 1   44   13   29 o    230.1    3.2    0.0000   0.0000          ?        ?   529.9730  14.6860          ?        ?      230.1        3.2       ?       ? 
1 1 1   44   13   30 o    202.8    3.9    0.0000   0.0000          ?        ?   411.8464  15.9630          ?        ?      202.8        3.9       ?       ? 
1 1 1   44   13   31 o    214.3    3.6    0.0000   0.0000          ?        ?   459.7356  15.3245          ?        ?      214.3        3.6       ?       ? 
1 1 1   44   13   32 o    312.4    2.9    0.0000   0.0000          ?        ?   976.2995  17.8786          ?        ?      312.4        2.9       ?       ? 
1 1 1   44   13   33 o    101.5    7.2    0.0000   0.0000          ?        ?   103.4405  14.6860          ?        ?      101.5        7.2       ?       ? 
1 1 1   44   13   34 o    107.6    7.4    0.0000   0.0000          ?        ?   116.2109  15.9630          ?        ?      107.6        7.4       ?       ? 
1 1 1   44   13   35 o    166.5    4.8    0.0000   0.0000          ?        ?   277.7569  15.9630          ?        ?      166.5        4.8       ?       ? 
1 1 1   44   13   36 o    132.5    6.3    0.0000   0.0000          ?        ?   176.2320  16.6016          ?        ?      132.5        6.3       ?       ? 
1 1 1   44   13   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   13   38 o     68.1   12.7    0.0000   0.0000          ?        ?    48.5276  16.6016          ?        ?       68.1       12.7       ?       ? 
1 1 1   44   13   39 o     23.8   11.5    0.0000   0.0000          ?        ?   -26.1794  16.6016          ?        ?       23.8       11.5       ?       ? 
1 1 1   44   13   40 o    194.2    4.6    0.0000   0.0000          ?        ?   378.0048  17.8786          ?        ?      194.2        4.6       ?       ? 
1 1 1   44   13   41 o     57.6   14.0    0.0000   0.0000          ?        ?    35.1187  15.9630          ?        ?       57.6       14.0       ?       ? 
1 1 1   44   13   42 o    302.3    3.1    0.0000   0.0000          ?        ?   915.0015  18.5171          ?        ?      302.3        3.1       ?       ? 
1 1 1   44   13   43 f    338.6    3.0    0.0000   0.0000          ?        ?  1147.4233  20.4327          ?        ?      338.6        3.0       ?       ? 
1 1 1   44   13   44 o     29.9   13.4    0.0000   0.0000          ?        ?    -7.0237  16.6016          ?        ?       29.9       13.4       ?       ? 
1 1 1   44   13   45 o    265.1    3.5    0.0000   0.0000          ?        ?   703.6508  18.5171          ?        ?      265.1        3.5       ?       ? 
1 1 1   44   13   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   13   47 o     64.7   14.2    0.0000   0.0000          ?        ?    44.6965  17.8786          ?        ?       64.7       14.2       ?       ? 
1 1 1   44   13   48 o    112.5    7.7    0.0000   0.0000          ?        ?   127.7043  17.2401          ?        ?      112.5        7.7       ?       ? 
1 1 1   44   13   49 o    194.1    4.4    0.0000   0.0000          ?        ?   378.0048  17.2401          ?        ?      194.1        4.4       ?       ? 
1 1 1   44   13   50 f    196.7    4.5    0.0000   0.0000          ?        ?   388.2211  17.8786          ?        ?      196.7        4.5       ?       ? 
1 1 1   44   13   51 o    115.1    7.8    0.0000   0.0000          ?        ?   134.0895  17.8786          ?        ?      115.1        7.8       ?       ? 
1 1 1   44   13   52 o     61.9   14.2    0.0000   0.0000          ?        ?    41.5039  17.2401          ?        ?       61.9       14.2       ?       ? 
1 1 1   44   14    0 o    158.3    6.9  252.2160  21.7097   252.2160  21.7097   252.2160  21.7097      158.3      6.9      158.3        6.9     0.0     0.0 
1 1 1   44   14    1 o    254.5    3.4    0.0000   0.0000          ?        ?   648.0994  17.2401          ?        ?      254.5        3.4       ?       ? 
1 1 1   44   14    2 o    314.2    2.7    0.0000   0.0000          ?        ?   987.7929  17.2401          ?        ?      314.2        2.7       ?       ? 
1 1 1   44   14    3 o    213.3    3.0    0.0000   0.0000          ?        ?   455.2659  12.7704          ?        ?      213.3        3.0       ?       ? 
1 1 1   44   14    4 o    229.6    2.8    0.0000   0.0000          ?        ?   527.4188  12.7704          ?        ?      229.6        2.8       ?       ? 
1 1 1   44   14    5 o    157.6    3.9    0.0000   0.0000          ?        ?   248.3849  12.1319          ?        ?      157.6        3.9       ?       ? 
1 1 1   44   14    6 o    247.8    3.0    0.0000   0.0000          ?        ?   614.2578  14.6860          ?        ?      247.8        3.0       ?       ? 
1 1 1   44   14    7 o    162.0    3.2    0.0000   0.0000          ?        ?   262.4324  10.2163          ?        ?      162.0        3.2       ?       ? 
1 1 1   44   14    8 o    159.6    3.2    0.0000   0.0000          ?        ?   254.7701  10.2163          ?        ?      159.6        3.2       ?       ? 
1 1 1   44   14    9 o    366.6    2.6    0.0000   0.0000          ?        ?  1344.7266  19.1556          ?        ?      366.6        2.6       ?       ? 
1 1 1   44   14   10 o    287.2    2.4    0.0000   0.0000          ?        ?   824.9699  14.0475          ?        ?      287.2        2.4       ?       ? 
1 1 1   44   14   11 o     33.0   11.6    0.0000   0.0000          ?        ?     9.5778   9.5778          ?        ?       33.0       11.6       ?       ? 
1 1 1   44   14   12 o    252.1    2.5    0.0000   0.0000          ?        ?   635.9675  12.7704          ?        ?      252.1        2.5       ?       ? 
1 1 1   44   14   13 o    420.4    2.6    0.0000   0.0000          ?        ?  1768.0663  21.7097          ?        ?      420.4        2.6       ?       ? 
1 1 1   44   14   14 o    352.6    2.6    0.0000   0.0000          ?        ?  1243.8401  18.5171          ?        ?      352.6        2.6       ?       ? 
1 1 1   44   14   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   14   16 o    220.7    3.2    0.0000   0.0000          ?        ?   487.1920  14.0475          ?        ?      220.7        3.2       ?       ? 
1 1 1   44   14   17 o    120.3    5.0    0.0000   0.0000          ?        ?   144.9444  12.1319          ?        ?      120.3        5.0       ?       ? 
1 1 1   44   14   18 o    503.6    2.7    0.0000   0.0000          ?        ?  2537.4849  27.4564          ?        ?      503.6        2.7       ?       ? 
1 1 1   44   14   19 o    245.2    2.9    0.0000   0.0000          ?        ?   601.4874  14.0475          ?        ?      245.2        2.9       ?       ? 
1 1 1   44   14   20 o    228.2    2.9    0.0000   0.0000          ?        ?   521.0336  13.4090          ?        ?      228.2        2.9       ?       ? 
1 1 1   44   14   21 o     32.1   13.3    0.0000   0.0000          ?        ?     2.5541  14.0475          ?        ?       32.1       13.3       ?       ? 
1 1 1   44   14   22 o    175.5    4.0    0.0000   0.0000          ?        ?   308.4059  14.0475          ?        ?      175.5        4.0       ?       ? 
1 1 1   44   14   23 o     50.6   13.1    0.0000   0.0000          ?        ?    26.8179  13.4090          ?        ?       50.6       13.1       ?       ? 
1 1 1   44   14   24 o    164.7    4.1    0.0000   0.0000          ?        ?   271.3717  13.4090          ?        ?      164.7        4.1       ?       ? 
1 1 1   44   14   25 o    200.8    3.5    0.0000   0.0000          ?        ?   403.5457  14.0475          ?        ?      200.8        3.5       ?       ? 
1 1 1   44   14   26 o    389.7    2.6    0.0000   0.0000          ?        ?  1519.0430  20.4327          ?        ?      389.7        2.6       ?       ? 
1 1 1   44   14   27 o     23.9   11.2    0.0000   0.0000          ?        ?   -13.4090  13.4090          ?        ?       23.9       11.2       ?       ? 
1 1 1   44   14   28 o     99.0    7.4    0.0000   0.0000          ?        ?    98.3323  14.6860          ?        ?       99.0        7.4       ?       ? 
1 1 1   44   14   29 o     31.3   13.3    0.0000   0.0000          ?        ?     0.0000  14.6860          ?        ?       31.3       13.3       ?       ? 
1 1 1   44   14   30 o    358.2    2.8    0.0000   0.0000          ?        ?  1283.4285  19.7942          ?        ?      358.2        2.8       ?       ? 
1 1 1   44   14   31 o     66.1   10.6    0.0000   0.0000          ?        ?    44.0580  14.0475          ?        ?       66.1       10.6       ?       ? 
1 1 1   44   14   32 o     26.9   12.3    0.0000   0.0000          ?        ?    -9.5778  14.6860          ?        ?       26.9       12.3       ?       ? 
1 1 1   44   14   33 o    199.2    4.0    0.0000   0.0000          ?        ?   397.1605  15.9630          ?        ?      199.2        4.0       ?       ? 
1 1 1   44   14   34 o     35.0   14.0    0.0000   0.0000          ?        ?     6.3852  14.6860          ?        ?       35.0       14.0       ?       ? 
1 1 1   44   14   35 o    197.2    4.2    0.0000   0.0000          ?        ?   389.4982  16.6016          ?        ?      197.2        4.2       ?       ? 
1 1 1   44   14   36 o    310.0    2.9    0.0000   0.0000          ?        ?   961.6136  17.8786          ?        ?      310.0        2.9       ?       ? 
1 1 1   44   14   37 o    159.2    5.0    0.0000   0.0000          ?        ?   254.1316  15.9630          ?        ?      159.2        5.0       ?       ? 
1 1 1   44   14   38 o     24.1   11.6    0.0000   0.0000          ?        ?   -22.3483  15.9630          ?        ?       24.1       11.6       ?       ? 
1 1 1   44   14   39 f    245.8    3.4    0.0000   0.0000          ?        ?   604.6799  16.6016          ?        ?      245.8        3.4       ?       ? 
1 1 1   44   14   40 o    137.2    6.0    0.0000   0.0000          ?        ?   189.0024  16.6016          ?        ?      137.2        6.0       ?       ? 
1 1 1   44   14   41 o    251.5    3.6    0.0000   0.0000          ?        ?   633.4135  17.8786          ?        ?      251.5        3.6       ?       ? 
1 1 1   44   14   42 o    173.9    4.8    0.0000   0.0000          ?        ?   303.2978  16.6016          ?        ?      173.9        4.8       ?       ? 
1 1 1   44   14   43 o     85.5   10.5    0.0000   0.0000          ?        ?    74.0685  17.8786          ?        ?       85.5       10.5       ?       ? 
1 1 1   44   14   44 o     44.7   15.6    0.0000   0.0000          ?        ?    18.5171  17.2401          ?        ?       44.7       15.6       ?       ? 
1 1 1   44   14   45 o    254.1    3.6    0.0000   0.0000          ?        ?   646.8224  18.5171          ?        ?      254.1        3.6       ?       ? 
1 1 1   44   14   46 o    229.0    4.0    0.0000   0.0000          ?        ?   525.5033  18.5171          ?        ?      229.0        4.0       ?       ? 
1 1 1   44   14   47 o     98.6    8.4    0.0000   0.0000          ?        ?    98.3323  16.6016          ?        ?       98.6        8.4       ?       ? 
1 1 1   44   14   48 o    136.8    6.3    0.0000   0.0000          ?        ?   188.3639  17.2401          ?        ?      136.8        6.3       ?       ? 
1 1 1   44   14   49 o     38.6   15.2    0.0000   0.0000          ?        ?     9.5778  17.2401          ?        ?       38.6       15.2       ?       ? 
1 1 1   44   14   50 o    225.2    4.0    0.0000   0.0000          ?        ?   508.9017  17.8786          ?        ?      225.2        4.0       ?       ? 
1 1 1   44   14   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   15    0 o    326.6    4.3 1067.6082  28.0950  1067.6082  28.0950  1067.6082  28.0950      326.6      4.3      326.6        4.3     0.0     0.0 
1 1 1   44   15    1 o     64.8    9.9    0.0000   0.0000          ?        ?    42.1424  12.7704          ?        ?       64.8        9.9       ?       ? 
1 1 1   44   15    2 o     32.6   13.2    0.0000   0.0000          ?        ?     4.4697  13.4090          ?        ?       32.6       13.2       ?       ? 
1 1 1   44   15    3 o     92.4    8.0    0.0000   0.0000          ?        ?    85.5619  14.6860          ?        ?       92.4        8.0       ?       ? 
1 1 1   44   15    4 o    309.0    3.4    0.0000   0.0000          ?        ?   955.2284  21.0712          ?        ?      309.0        3.4       ?       ? 
1 1 1   44   15    5 o    110.7    5.2    0.0000   0.0000          ?        ?   122.5962  11.4934          ?        ?      110.7        5.2       ?       ? 
1 1 1   44   15    6 o    300.3    2.7    0.0000   0.0000          ?        ?   902.2311  15.9630          ?        ?      300.3        2.7       ?       ? 
1 1 1   44   15    7 o    231.1    3.0    0.0000   0.0000          ?        ?   534.4426  14.0475          ?        ?      231.1        3.0       ?       ? 
1 1 1   44   15    8 o    102.6    5.9    0.0000   0.0000          ?        ?   105.3561  12.1319          ?        ?      102.6        5.9       ?       ? 
1 1 1   44   15    9 o     24.7   11.1    0.0000   0.0000          ?        ?    -5.7467  11.4934          ?        ?       24.7       11.1       ?       ? 
1 1 1   44   15   10 o    191.2    3.2    0.0000   0.0000          ?        ?   365.8729  12.1319          ?        ?      191.2        3.2       ?       ? 
1 1 1   44   15   11 o    317.6    2.7    0.0000   0.0000          ?        ?  1008.8642  17.2401          ?        ?      317.6        2.7       ?       ? 
1 1 1   44   15   12 o    330.7    2.5    0.0000   0.0000          ?        ?  1093.7876  16.6016          ?        ?      330.7        2.5       ?       ? 
1 1 1   44   15   13 o    338.0    2.5    0.0000   0.0000          ?        ?  1142.9537  16.6016          ?        ?      338.0        2.5       ?       ? 
1 1 1   44   15   14 o    357.7    2.7    0.0000   0.0000          ?        ?  1280.2358  19.1556          ?        ?      357.7        2.7       ?       ? 
1 1 1   44   15   15 o    346.9    2.7    0.0000   0.0000          ?        ?  1203.6133  18.5171          ?        ?      346.9        2.7       ?       ? 
1 1 1   44   15   16 o    556.0    2.9    0.0000   0.0000          ?        ?  3092.3601  32.5646          ?        ?      556.0        2.9       ?       ? 
1 1 1   44   15   17 o    449.0    2.7    0.0000   0.0000          ?        ?  2016.4512  24.2638          ?        ?      449.0        2.7       ?       ? 
1 1 1   44   15   18 o    178.6    3.8    0.0000   0.0000          ?        ?   319.2608  13.4090          ?        ?      178.6        3.8       ?       ? 
1 1 1   44   15   19 o    171.5    3.9    0.0000   0.0000          ?        ?   294.3585  13.4090          ?        ?      171.5        3.9       ?       ? 
1 1 1   44   15   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   15   21 o    247.5    3.0    0.0000   0.0000          ?        ?   612.9808  14.6860          ?        ?      247.5        3.0       ?       ? 
1 1 1   44   15   22 o    101.6    6.9    0.0000   0.0000          ?        ?   103.4405  14.0475          ?        ?      101.6        6.9       ?       ? 
1 1 1   44   15   23 o    198.9    3.5    0.0000   0.0000          ?        ?   395.8834  14.0475          ?        ?      198.9        3.5       ?       ? 
1 1 1   44   15   24 o     93.4    7.2    0.0000   0.0000          ?        ?    87.4775  13.4090          ?        ?       93.4        7.2       ?       ? 
1 1 1   44   15   25 o    248.2    3.1    0.0000   0.0000          ?        ?   616.1733  15.3245          ?        ?      248.2        3.1       ?       ? 
1 1 1   44   15   26 o    394.5    2.7    0.0000   0.0000          ?        ?  1557.3542  21.0712          ?        ?      394.5        2.7       ?       ? 
1 1 1   44   15   27 o    211.0    3.5    0.0000   0.0000          ?        ?   445.6881  14.6860          ?        ?      211.0        3.5       ?       ? 
1 1 1   44   15   28 o     22.6   10.8    0.0000   0.0000          ?        ?   -17.2401  13.4090          ?        ?       22.6       10.8       ?       ? 
1 1 1   44   15   29 o    211.8    3.6    0.0000   0.0000          ?        ?   448.8807  15.3245          ?        ?      211.8        3.6       ?       ? 
1 1 1   44   15   30 o    288.6    2.9    0.0000   0.0000          ?        ?   833.2708  16.6016          ?        ?      288.6        2.9       ?       ? 
1 1 1   44   15   31 o     85.1    8.6    0.0000   0.0000          ?        ?    72.7915  14.6860          ?        ?       85.1        8.6       ?       ? 
1 1 1   44   15   32 o    161.1    4.6    0.0000   0.0000          ?        ?   259.8783  14.6860          ?        ?      161.1        4.6       ?       ? 
1 1 1   44   15   33 o    203.9    3.8    0.0000   0.0000          ?        ?   416.3161  15.3245          ?        ?      203.9        3.8       ?       ? 
1 1 1   44   15   34 o    242.0    3.3    0.0000   0.0000          ?        ?   586.1629  15.9630          ?        ?      242.0        3.3       ?       ? 
1 1 1   44   15   35 f     98.6    8.1    0.0000   0.0000          ?        ?    97.6938  15.9630          ?        ?       98.6        8.1       ?       ? 
1 1 1   44   15   36 o    248.7    3.6    0.0000   0.0000          ?        ?   619.3660  17.8786          ?        ?      248.7        3.6       ?       ? 
1 1 1   44   15   37 o    250.8    3.6    0.0000   0.0000          ?        ?   629.5823  17.8786          ?        ?      250.8        3.6       ?       ? 
1 1 1   44   15   38 o     27.8   12.7    0.0000   0.0000          ?        ?   -10.8549  15.9630          ?        ?       27.8       12.7       ?       ? 
1 1 1   44   15   39 o    154.7    5.2    0.0000   0.0000          ?        ?   240.0841  15.9630          ?        ?      154.7        5.2       ?       ? 
1 1 1   44   15   40 o    346.3    2.9    0.0000   0.0000          ?        ?  1200.4207  19.7942          ?        ?      346.3        2.9       ?       ? 
1 1 1   44   15   41 o    229.6    3.9    0.0000   0.0000          ?        ?   528.0574  17.8786          ?        ?      229.6        3.9       ?       ? 
1 1 1   44   15   42 f    213.7    4.2    0.0000   0.0000          ?        ?   457.8200  17.8786          ?        ?      213.7        4.2       ?       ? 
1 1 1   44   15   43 o    186.3    4.6    0.0000   0.0000          ?        ?   347.9943  17.2401          ?        ?      186.3        4.6       ?       ? 
1 1 1   44   15   44 o    180.9    4.6    0.0000   0.0000          ?        ?   328.2001  16.6016          ?        ?      180.9        4.6       ?       ? 
1 1 1   44   15   45 o     23.2   11.4    0.0000   0.0000          ?        ?   -34.4802  17.8786          ?        ?       23.2       11.4       ?       ? 
1 1 1   44   15   46 o     46.8   15.7    0.0000   0.0000          ?        ?    21.7097  17.2401          ?        ?       46.8       15.7       ?       ? 
1 1 1   44   15   47 o    161.4    5.3    0.0000   0.0000          ?        ?   261.7939  17.2401          ?        ?      161.4        5.3       ?       ? 
1 1 1   44   15   48 o    165.4    5.4    0.0000   0.0000          ?        ?   275.2028  17.8786          ?        ?      165.4        5.4       ?       ? 
1 1 1   44   15   49 o     74.4   11.6    0.0000   0.0000          ?        ?    56.8284  17.2401          ?        ?       74.4       11.6       ?       ? 
1 1 1   44   16    0 o     40.3   19.7   24.2638  18.5171    24.2638  18.5171    24.2638  18.5171       40.3     19.7       40.3       19.7     0.0     0.0 
1 1 1   44   16    1 o    196.6    3.7    0.0000   0.0000          ?        ?   386.9441  14.6860          ?        ?      196.6        3.7       ?       ? 
1 1 1   44   16    2 o    174.4    4.2    0.0000   0.0000          ?        ?   304.5748  14.6860          ?        ?      174.4        4.2       ?       ? 
1 1 1   44   16    3 o    236.8    3.5    0.0000   0.0000          ?        ?   561.2605  16.6016          ?        ?      236.8        3.5       ?       ? 
1 1 1   44   16    4 o    208.1    3.7    0.0000   0.0000          ?        ?   433.5562  15.3245          ?        ?      208.1        3.7       ?       ? 
1 1 1   44   16    5 o    128.5    5.7    0.0000   0.0000          ?        ?   165.3771  14.6860          ?        ?      128.5        5.7       ?       ? 
1 1 1   44   16    6 o    251.1    3.1    0.0000   0.0000          ?        ?   630.8594  15.3245          ?        ?      251.1        3.1       ?       ? 
1 1 1   44   16    7 o    342.6    2.6    0.0000   0.0000          ?        ?  1174.2412  17.8786          ?        ?      342.6        2.6       ?       ? 
1 1 1   44   16    8 o    207.1    2.9    0.0000   0.0000          ?        ?   429.0865  12.1319          ?        ?      207.1        2.9       ?       ? 
1 1 1   44   16    9 o    119.0    4.8    0.0000   0.0000          ?        ?   141.7518  11.4934          ?        ?      119.0        4.8       ?       ? 
1 1 1   44   16   10 o    354.2    2.7    0.0000   0.0000          ?        ?  1255.3335  19.1556          ?        ?      354.2        2.7       ?       ? 
1 1 1   44   16   11 o    295.4    3.0    0.0000   0.0000          ?        ?   872.8591  17.8786          ?        ?      295.4        3.0       ?       ? 
1 1 1   44   16   12 o    289.4    2.8    0.0000   0.0000          ?        ?   837.7404  15.9630          ?        ?      289.4        2.8       ?       ? 
1 1 1   44   16   13 o    433.8    2.9    0.0000   0.0000          ?        ?  1883.0002  24.9023          ?        ?      433.8        2.9       ?       ? 
1 1 1   44   16   14 o    329.2    2.8    0.0000   0.0000          ?        ?  1084.2097  18.5171          ?        ?      329.2        2.8       ?       ? 
1 1 1   44   16   15 f    180.0    3.4    0.0000   0.0000          ?        ?   324.3690  12.1319          ?        ?      180.0        3.4       ?       ? 
1 1 1   44   16   16 o    331.9    2.6    0.0000   0.0000          ?        ?  1102.0884  17.2401          ?        ?      331.9        2.6       ?       ? 
1 1 1   44   16   17 o    121.9    5.0    0.0000   0.0000          ?        ?   148.7755  12.1319          ?        ?      121.9        5.0       ?       ? 
1 1 1   44   16   18 o    151.1    4.0    0.0000   0.0000          ?        ?   228.5907  12.1319          ?        ?      151.1        4.0       ?       ? 
1 1 1   44   16   19 o    236.6    3.2    0.0000   0.0000          ?        ?   559.9835  15.3245          ?        ?      236.6        3.2       ?       ? 
1 1 1   44   16   20 o    457.0    2.7    0.0000   0.0000          ?        ?  2089.2429  24.2638          ?        ?      457.0        2.7       ?       ? 
1 1 1   44   16   21 o    116.8    5.5    0.0000   0.0000          ?        ?   136.6436  12.7704          ?        ?      116.8        5.5       ?       ? 
1 1 1   44   16   22 o    298.9    2.7    0.0000   0.0000          ?        ?   893.9303  15.9630          ?        ?      298.9        2.7       ?       ? 
1 1 1   44   16   23 o    137.8    4.9    0.0000   0.0000          ?        ?   190.2794  13.4090          ?        ?      137.8        4.9       ?       ? 
1 1 1   44   16   24 o    139.7    4.8    0.0000   0.0000          ?        ?   195.3876  13.4090          ?        ?      139.7        4.8       ?       ? 
1 1 1   44   16   25 o    294.2    2.7    0.0000   0.0000          ?        ?   865.8354  15.9630          ?        ?      294.2        2.7       ?       ? 
1 1 1   44   16   26 o    428.8    2.5    0.0000   0.0000          ?        ?  1839.5808  21.7097          ?        ?      428.8        2.5       ?       ? 
1 1 1   44   16   27 o    376.4    2.6    0.0000   0.0000          ?        ?  1417.5181  19.7942          ?        ?      376.4        2.6       ?       ? 
1 1 1   44   16   28 o     62.6   11.7    0.0000   0.0000          ?        ?    40.8654  14.0475          ?        ?       62.6       11.7       ?       ? 
1 1 1   44   16   29 o    269.6    3.1    0.0000   0.0000          ?        ?   727.2761  16.6016          ?        ?      269.6        3.1       ?       ? 
1 1 1   44   16   30 o    154.0    4.8    0.0000   0.0000          ?        ?   237.5300  14.6860          ?        ?      154.0        4.8       ?       ? 
1 1 1   44   16   31 o    204.8    3.9    0.0000   0.0000          ?        ?   420.1472  15.9630          ?        ?      204.8        3.9       ?       ? 
1 1 1   44   16   32 o     26.6   12.1    0.0000   0.0000          ?        ?    -8.3008  14.0475          ?        ?       26.6       12.1       ?       ? 
1 1 1   44   16   33 o    175.5    4.4    0.0000   0.0000          ?        ?   308.4059  15.3245          ?        ?      175.5        4.4       ?       ? 
1 1 1   44   16   34 o    130.6    6.1    0.0000   0.0000          ?        ?   171.1238  15.9630          ?        ?      130.6        6.1       ?       ? 
1 1 1   44   16   35 o    262.7    3.3    0.0000   0.0000          ?        ?   690.8804  17.2401          ?        ?      262.7        3.3       ?       ? 
1 1 1   44   16   36 o    115.5    7.2    0.0000   0.0000          ?        ?   134.0895  16.6016          ?        ?      115.5        7.2       ?       ? 
1 1 1   44   16   37 o    171.2    4.8    0.0000   0.0000          ?        ?   293.7199  16.6016          ?        ?      171.2        4.8       ?       ? 
1 1 1   44   16   38 o    237.0    3.6    0.0000   0.0000          ?        ?   562.5375  17.2401          ?        ?      237.0        3.6       ?       ? 
1 1 1   44   16   39 o    126.0    6.6    0.0000   0.0000          ?        ?   159.6304  16.6016          ?        ?      126.0        6.6       ?       ? 
1 1 1   44   16   40 o     22.3   10.9    0.0000   0.0000          ?        ?   -32.5646  16.6016          ?        ?       22.3       10.9       ?       ? 
1 1 1   44   16   41 o    201.3    4.3    0.0000   0.0000          ?        ?   406.0997  17.2401          ?        ?      201.3        4.3       ?       ? 
1 1 1   44   16   42 o     19.8    9.9    0.0000   0.0000          ?        ?   -50.4432  17.2401          ?        ?       19.8        9.9       ?       ? 
1 1 1   44   16   43 o     82.8   10.0    0.0000   0.0000          ?        ?    69.5989  16.6016          ?        ?       82.8       10.0       ?       ? 
1 1 1   44   16   44 o    209.9    4.3    0.0000   0.0000          ?        ?   441.8569  17.8786          ?        ?      209.9        4.3       ?       ? 
1 1 1   44   16   45 o     46.3   15.7    0.0000   0.0000          ?        ?    21.0712  17.2401          ?        ?       46.3       15.7       ?       ? 
1 1 1   44   16   46 o    142.3    6.1    0.0000   0.0000          ?        ?   203.6884  17.2401          ?        ?      142.3        6.1       ?       ? 
1 1 1   44   16   47 o    157.6    5.3    0.0000   0.0000          ?        ?   249.6619  16.6016          ?        ?      157.6        5.3       ?       ? 
1 1 1   44   16   48 o    186.0    4.6    0.0000   0.0000          ?        ?   347.3558  17.2401          ?        ?      186.0        4.6       ?       ? 
1 1 1   44   17    0 o    177.2    6.1  315.4297  21.7097   315.4297  21.7097   315.4297  21.7097      177.2      6.1      177.2        6.1     0.0     0.0 
1 1 1   44   17    1 o     29.0   12.7    0.0000   0.0000          ?        ?    -3.1926  14.0475          ?        ?       29.0       12.7       ?       ? 
1 1 1   44   17    2 o    228.7    3.8    0.0000   0.0000          ?        ?   523.5877  17.2401          ?        ?      228.7        3.8       ?       ? 
1 1 1   44   17    3 o    102.5    7.2    0.0000   0.0000          ?        ?   105.3561  14.6860          ?        ?      102.5        7.2       ?       ? 
1 1 1   44   17    4 o     19.0    9.4    0.0000   0.0000          ?        ?   -31.2876  13.4090          ?        ?       19.0        9.4       ?       ? 
1 1 1   44   17    5 o     46.4   14.4    0.0000   0.0000          ?        ?    21.7097  14.6860          ?        ?       46.4       14.4       ?       ? 
1 1 1   44   17    6 o    179.3    4.1    0.0000   0.0000          ?        ?   321.8149  14.6860          ?        ?      179.3        4.1       ?       ? 
1 1 1   44   17    7 o    504.9    3.4    0.0000   0.0000          ?        ?  2550.8938  33.8416          ?        ?      504.9        3.4       ?       ? 
1 1 1   44   17    8 o    240.6    3.6    0.0000   0.0000          ?        ?   579.1391  17.2401          ?        ?      240.6        3.6       ?       ? 
1 1 1   44   17    9 o    353.5    2.7    0.0000   0.0000          ?        ?  1250.2253  19.1556          ?        ?      353.5        2.7       ?       ? 
1 1 1   44   17   10 o     96.8    5.9    0.0000   0.0000          ?        ?    93.8627  11.4934          ?        ?       96.8        5.9       ?       ? 
1 1 1   44   17   11 o    122.7    4.9    0.0000   0.0000          ?        ?   150.6911  12.1319          ?        ?      122.7        4.9       ?       ? 
1 1 1   44   17   12 o    411.4    2.9    0.0000   0.0000          ?        ?  1693.3594  24.2638          ?        ?      411.4        2.9       ?       ? 
1 1 1   44   17   13 o    124.2    5.7    0.0000   0.0000          ?        ?   154.5222  14.0475          ?        ?      124.2        5.7       ?       ? 
1 1 1   44   17   14 o     90.0    6.0    0.0000   0.0000          ?        ?    81.0922  10.8549          ?        ?       90.0        6.0       ?       ? 
1 1 1   44   17   15 o    298.9    2.9    0.0000   0.0000          ?        ?   893.9303  17.2401          ?        ?      298.9        2.9       ?       ? 
1 1 1   44   17   16 o    247.8    3.2    0.0000   0.0000          ?        ?   614.2578  15.9630          ?        ?      247.8        3.2       ?       ? 
1 1 1   44   17   17 f     38.5   13.7    0.0000   0.0000          ?        ?    12.7704  13.4090          ?        ?       38.5       13.7       ?       ? 
1 1 1   44   17   18 o     80.1    8.4    0.0000   0.0000          ?        ?    64.4907  13.4090          ?        ?       80.1        8.4       ?       ? 
1 1 1   44   17   19 o     95.1    6.4    0.0000   0.0000          ?        ?    90.6701  12.1319          ?        ?       95.1        6.4       ?       ? 
1 1 1   44   17   20 o    247.0    3.1    0.0000   0.0000          ?        ?   610.4266  15.3245          ?        ?      247.0        3.1       ?       ? 
1 1 1   44   17   21 o    262.0    2.9    0.0000   0.0000          ?        ?   687.0493  15.3245          ?        ?      262.0        2.9       ?       ? 
1 1 1   44   17   22 o     21.4   10.3    0.0000   0.0000          ?        ?   -18.5171  12.7704          ?        ?       21.4       10.3       ?       ? 
1 1 1   44   17   23 o    176.2    4.0    0.0000   0.0000          ?        ?   310.9600  14.0475          ?        ?      176.2        4.0       ?       ? 
1 1 1   44   17   24 o    235.2    3.1    0.0000   0.0000          ?        ?   553.5982  14.6860          ?        ?      235.2        3.1       ?       ? 
1 1 1   44   17   25 o    387.0    2.6    0.0000   0.0000          ?        ?  1498.6102  20.4327          ?        ?      387.0        2.6       ?       ? 
1 1 1   44   17   26 o    134.0    5.5    0.0000   0.0000          ?        ?   180.0631  14.6860          ?        ?      134.0        5.5       ?       ? 
1 1 1   44   17   27 o    355.1    2.6    0.0000   0.0000          ?        ?  1261.7188  18.5171          ?        ?      355.1        2.6       ?       ? 
1 1 1   44   17   28 o    358.2    2.8    0.0000   0.0000          ?        ?  1284.0670  19.7942          ?        ?      358.2        2.8       ?       ? 
1 1 1   44   17   29 o    289.5    3.1    0.0000   0.0000          ?        ?   839.0174  17.8786          ?        ?      289.5        3.1       ?       ? 
1 1 1   44   17   30 o    120.2    6.1    0.0000   0.0000          ?        ?   144.9444  14.6860          ?        ?      120.2        6.1       ?       ? 
1 1 1   44   17   31 o    122.8    6.2    0.0000   0.0000          ?        ?   151.3296  15.3245          ?        ?      122.8        6.2       ?       ? 
1 1 1   44   17   32 o    269.2    3.1    0.0000   0.0000          ?        ?   725.3605  16.6016          ?        ?      269.2        3.1       ?       ? 
1 1 1   44   17   33 o    130.8    5.9    0.0000   0.0000          ?        ?   171.7623  15.3245          ?        ?      130.8        5.9       ?       ? 
1 1 1   44   17   34 o    163.4    4.9    0.0000   0.0000          ?        ?   267.5406  15.9630          ?        ?      163.4        4.9       ?       ? 
1 1 1   44   17   35 o    147.1    5.4    0.0000   0.0000          ?        ?   217.0974  15.9630          ?        ?      147.1        5.4       ?       ? 
1 1 1   44   17   36 o    307.4    3.0    0.0000   0.0000          ?        ?   945.6506  18.5171          ?        ?      307.4        3.0       ?       ? 
1 1 1   44   17   37 o    146.2    5.5    0.0000   0.0000          ?        ?   214.5433  15.9630          ?        ?      146.2        5.5       ?       ? 
1 1 1   44   17   38 o    140.4    6.1    0.0000   0.0000          ?        ?   197.9417  17.2401          ?        ?      140.4        6.1       ?       ? 
1 1 1   44   17   39 f    107.4    7.7    0.0000   0.0000          ?        ?   116.2109  16.6016          ?        ?      107.4        7.7       ?       ? 
1 1 1   44   17   40 o     48.7   15.3    0.0000   0.0000          ?        ?    24.2638  16.6016          ?        ?       48.7       15.3       ?       ? 
1 1 1   44   17   41 o     22.3   10.9    0.0000   0.0000          ?        ?   -32.5646  16.6016          ?        ?       22.3       10.9       ?       ? 
1 1 1   44   17   42 o    171.3    5.0    0.0000   0.0000          ?        ?   294.3585  17.2401          ?        ?      171.3        5.0       ?       ? 
1 1 1   44   17   43 o    108.8    7.6    0.0000   0.0000          ?        ?   119.4035  16.6016          ?        ?      108.8        7.6       ?       ? 
1 1 1   44   17   44 o    170.9    4.9    0.0000   0.0000          ?        ?   293.0815  16.6016          ?        ?      170.9        4.9       ?       ? 
1 1 1   44   17   45 o     60.7   14.0    0.0000   0.0000          ?        ?    39.5883  16.6016          ?        ?       60.7       14.0       ?       ? 
1 1 1   44   17   46 o     97.2    8.5    0.0000   0.0000          ?        ?    95.7782  16.6016          ?        ?       97.2        8.5       ?       ? 
1 1 1   44   17   47 o     24.8   11.9    0.0000   0.0000          ?        ?   -21.7097  16.6016          ?        ?       24.8       11.9       ?       ? 
1 1 1   44   18    0 o    462.3    4.4 2139.0474  40.2269  2139.0474  40.2269  2139.0474  40.2269      462.3      4.4      462.3        4.4     0.0     0.0 
1 1 1   44   18    1 o    290.5    3.1    0.0000   0.0000          ?        ?   844.1255  17.8786          ?        ?      290.5        3.1       ?       ? 
1 1 1   44   18    2 o    353.2    3.3    0.0000   0.0000          ?        ?  1248.3098  23.6253          ?        ?      353.2        3.3       ?       ? 
1 1 1   44   18    3 o     24.7   11.5    0.0000   0.0000          ?        ?   -13.4090  14.0475          ?        ?       24.7       11.5       ?       ? 
1 1 1   44   18    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   18    5 o    199.2    4.2    0.0000   0.0000          ?        ?   397.1605  16.6016          ?        ?      199.2        4.2       ?       ? 
1 1 1   44   18    6 o    464.6    3.6    0.0000   0.0000          ?        ?  2160.1187  33.8416          ?        ?      464.6        3.6       ?       ? 
1 1 1   44   18    7 o    216.8    3.8    0.0000   0.0000          ?        ?   470.5904  16.6016          ?        ?      216.8        3.8       ?       ? 
1 1 1   44   18    8 o    208.0    4.1    0.0000   0.0000          ?        ?   432.9177  17.2401          ?        ?      208.0        4.1       ?       ? 
1 1 1   44   18    9 o    218.2    3.4    0.0000   0.0000          ?        ?   476.3371  14.6860          ?        ?      218.2        3.4       ?       ? 
1 1 1   44   18   10 o    282.8    2.9    0.0000   0.0000          ?        ?   800.0676  16.6016          ?        ?      282.8        2.9       ?       ? 
1 1 1   44   18   11 o    334.6    2.9    0.0000   0.0000          ?        ?  1119.9669  19.1556          ?        ?      334.6        2.9       ?       ? 
1 1 1   44   18   12 o    189.7    3.5    0.0000   0.0000          ?        ?   360.1262  13.4090          ?        ?      189.7        3.5       ?       ? 
1 1 1   44   18   13 o    183.2    4.0    0.0000   0.0000          ?        ?   335.8624  14.6860          ?        ?      183.2        4.0       ?       ? 
1 1 1   44   18   14 o    314.3    3.1    0.0000   0.0000          ?        ?   988.4315  19.7942          ?        ?      314.3        3.1       ?       ? 
1 1 1   44   18   15 o    392.6    2.5    0.0000   0.0000          ?        ?  1542.0298  19.7942          ?        ?      392.6        2.5       ?       ? 
1 1 1   44   18   16 o    208.9    3.1    0.0000   0.0000          ?        ?   436.7488  12.7704          ?        ?      208.9        3.1       ?       ? 
1 1 1   44   18   17 o     60.2    9.0    0.0000   0.0000          ?        ?    36.3957  10.8549          ?        ?       60.2        9.0       ?       ? 
1 1 1   44   18   18 o    243.9    3.1    0.0000   0.0000          ?        ?   595.1021  15.3245          ?        ?      243.9        3.1       ?       ? 
1 1 1   44   18   19 o    177.2    3.8    0.0000   0.0000          ?        ?   314.1526  13.4090          ?        ?      177.2        3.8       ?       ? 
1 1 1   44   18   20 o    504.2    2.9    0.0000   0.0000          ?        ?  2543.2314  29.3720          ?        ?      504.2        2.9       ?       ? 
1 1 1   44   18   21 o    167.7    4.2    0.0000   0.0000          ?        ?   281.5880  14.0475          ?        ?      167.7        4.2       ?       ? 
1 1 1   44   18   22 o    113.9    6.7    0.0000   0.0000          ?        ?   130.2584  15.3245          ?        ?      113.9        6.7       ?       ? 
1 1 1   44   18   23 o    298.7    2.8    0.0000   0.0000          ?        ?   892.6533  16.6016          ?        ?      298.7        2.8       ?       ? 
1 1 1   44   18   24 o    234.8    3.3    0.0000   0.0000          ?        ?   551.6827  15.3245          ?        ?      234.8        3.3       ?       ? 
1 1 1   44   18   25 o    197.1    3.9    0.0000   0.0000          ?        ?   388.8597  15.3245          ?        ?      197.1        3.9       ?       ? 
1 1 1   44   18   26 f    167.9    4.2    0.0000   0.0000          ?        ?   282.2266  14.0475          ?        ?      167.9        4.2       ?       ? 
1 1 1   44   18   27 o    491.9    2.6    0.0000   0.0000          ?        ?  2420.6355  25.5409          ?        ?      491.9        2.6       ?       ? 
1 1 1   44   18   28 o    104.9    6.7    0.0000   0.0000          ?        ?   110.4642  14.0475          ?        ?      104.9        6.7       ?       ? 
1 1 1   44   18   29 o     91.6    8.0    0.0000   0.0000          ?        ?    84.2849  14.6860          ?        ?       91.6        8.0       ?       ? 
1 1 1   44   18   30 o    131.1    5.6    0.0000   0.0000          ?        ?   172.4008  14.6860          ?        ?      131.1        5.6       ?       ? 
1 1 1   44   18   31 o    123.8    5.9    0.0000   0.0000          ?        ?   153.8837  14.6860          ?        ?      123.8        5.9       ?       ? 
1 1 1   44   18   32 o    129.4    5.9    0.0000   0.0000          ?        ?   167.9312  15.3245          ?        ?      129.4        5.9       ?       ? 
1 1 1   44   18   33 o    126.4    6.1    0.0000   0.0000          ?        ?   160.2689  15.3245          ?        ?      126.4        6.1       ?       ? 
1 1 1   44   18   34 o    169.7    4.5    0.0000   0.0000          ?        ?   288.6118  15.3245          ?        ?      169.7        4.5       ?       ? 
1 1 1   44   18   35 o     93.5    8.2    0.0000   0.0000          ?        ?    88.1160  15.3245          ?        ?       93.5        8.2       ?       ? 
1 1 1   44   18   36 o    153.5    5.2    0.0000   0.0000          ?        ?   236.2530  15.9630          ?        ?      153.5        5.2       ?       ? 
1 1 1   44   18   37 o     76.9   10.8    0.0000   0.0000          ?        ?    60.0210  16.6016          ?        ?       76.9       10.8       ?       ? 
1 1 1   44   18   38 o     20.5   10.2    0.0000   0.0000          ?        ?   -45.9736  17.2401          ?        ?       20.5       10.2       ?       ? 
1 1 1   44   18   39 o    106.8    7.5    0.0000   0.0000          ?        ?   114.9339  15.9630          ?        ?      106.8        7.5       ?       ? 
1 1 1   44   18   40 o    122.9    6.8    0.0000   0.0000          ?        ?   151.9681  16.6016          ?        ?      122.9        6.8       ?       ? 
1 1 1   44   18   41 o     87.7    9.1    0.0000   0.0000          ?        ?    77.8996  15.9630          ?        ?       87.7        9.1       ?       ? 
1 1 1   44   18   42 o    159.3    5.2    0.0000   0.0000          ?        ?   254.7701  16.6016          ?        ?      159.3        5.2       ?       ? 
1 1 1   44   18   43 o     58.2   14.3    0.0000   0.0000          ?        ?    36.3957  16.6016          ?        ?       58.2       14.3       ?       ? 
1 1 1   44   18   44 o    207.1    4.2    0.0000   0.0000          ?        ?   430.3636  17.2401          ?        ?      207.1        4.2       ?       ? 
1 1 1   44   18   45 o     24.0   11.6    0.0000   0.0000          ?        ?   -24.9023  16.6016          ?        ?       24.0       11.6       ?       ? 
1 1 1   44   18   46 o     67.5   12.8    0.0000   0.0000          ?        ?    48.5276  16.6016          ?        ?       67.5       12.8       ?       ? 
1 1 1   44   19    0 o    182.7    5.6  335.2238  20.4327   335.2238  20.4327   335.2238  20.4327      182.7      5.6      182.7        5.6     0.0     0.0 
1 1 1   44   19    1 o    316.3    3.6    0.0000   0.0000          ?        ?  1001.2019  22.9868          ?        ?      316.3        3.6       ?       ? 
1 1 1   44   19    2 o    396.9    3.2    0.0000   0.0000          ?        ?  1576.5099  25.5409          ?        ?      396.9        3.2       ?       ? 
1 1 1   44   19    3 o    718.7    3.7    0.0000   0.0000          ?        ?  5169.4707  52.9973          ?        ?      718.7        3.7       ?       ? 
1 1 1   44   19    4 o    471.2    3.7    0.0000   0.0000          ?        ?  2222.0552  35.1187          ?        ?      471.2        3.7       ?       ? 
1 1 1   44   19    5 o    446.2    3.7    0.0000   0.0000          ?        ?  1992.8260  33.2031          ?        ?      446.2        3.7       ?       ? 
1 1 1   44   19    6 o    384.9    3.1    0.0000   0.0000          ?        ?  1482.6472  23.6253          ?        ?      384.9        3.1       ?       ? 
1 1 1   44   19    7 o    372.8    3.2    0.0000   0.0000          ?        ?  1390.7001  23.6253          ?        ?      372.8        3.2       ?       ? 
1 1 1   44   19    8 o    140.3    5.9    0.0000   0.0000          ?        ?   197.3032  16.6016          ?        ?      140.3        5.9       ?       ? 
1 1 1   44   19    9 o    197.7    4.7    0.0000   0.0000          ?        ?   391.4138  18.5171          ?        ?      197.7        4.7       ?       ? 
1 1 1   44   19   10 o    446.0    3.1    0.0000   0.0000          ?        ?  1990.2720  28.0950          ?        ?      446.0        3.1       ?       ? 
1 1 1   44   19   11 o    112.9    5.1    0.0000   0.0000          ?        ?   127.7043  11.4934          ?        ?      112.9        5.1       ?       ? 
1 1 1   44   19   12 o    246.3    3.4    0.0000   0.0000          ?        ?   607.2341  16.6016          ?        ?      246.3        3.4       ?       ? 
1 1 1   44   19   13 o    100.9    6.6    0.0000   0.0000          ?        ?   102.1635  13.4090          ?        ?      100.9        6.6       ?       ? 
1 1 1   44   19   14 o    140.3    5.2    0.0000   0.0000          ?        ?   197.3032  14.6860          ?        ?      140.3        5.2       ?       ? 
1 1 1   44   19   15 o    243.3    3.4    0.0000   0.0000          ?        ?   592.5481  16.6016          ?        ?      243.3        3.4       ?       ? 
1 1 1   44   19   16 o    223.2    3.6    0.0000   0.0000          ?        ?   498.6854  15.9630          ?        ?      223.2        3.6       ?       ? 
1 1 1   44   19   17 f    380.1    2.7    0.0000   0.0000          ?        ?  1445.6129  20.4327          ?        ?      380.1        2.7       ?       ? 
1 1 1   44   19   18 o    323.2    2.9    0.0000   0.0000          ?        ?  1045.2599  18.5171          ?        ?      323.2        2.9       ?       ? 
1 1 1   44   19   19 o    195.3    3.3    0.0000   0.0000          ?        ?   381.8359  12.7704          ?        ?      195.3        3.3       ?       ? 
1 1 1   44   19   20 o    293.1    2.9    0.0000   0.0000          ?        ?   859.4501  17.2401          ?        ?      293.1        2.9       ?       ? 
1 1 1   44   19   21 o    503.4    2.8    0.0000   0.0000          ?        ?  2535.5693  28.0950          ?        ?      503.4        2.8       ?       ? 
1 1 1   44   19   22 o    248.4    3.3    0.0000   0.0000          ?        ?   617.4504  16.6016          ?        ?      248.4        3.3       ?       ? 
1 1 1   44   19   23 o    185.0    4.1    0.0000   0.0000          ?        ?   342.8861  15.3245          ?        ?      185.0        4.1       ?       ? 
1 1 1   44   19   24 o    213.4    3.6    0.0000   0.0000          ?        ?   455.9044  15.3245          ?        ?      213.4        3.6       ?       ? 
1 1 1   44   19   25 o    143.7    5.1    0.0000   0.0000          ?        ?   206.8810  14.6860          ?        ?      143.7        5.1       ?       ? 
1 1 1   44   19   26 o    295.1    3.0    0.0000   0.0000          ?        ?   871.5820  17.8786          ?        ?      295.1        3.0       ?       ? 
1 1 1   44   19   27 o    314.5    2.7    0.0000   0.0000          ?        ?   989.7085  17.2401          ?        ?      314.5        2.7       ?       ? 
1 1 1   44   19   28 o    239.3    3.2    0.0000   0.0000          ?        ?   573.3925  15.3245          ?        ?      239.3        3.2       ?       ? 
1 1 1   44   19   29 o    380.6    2.7    0.0000   0.0000          ?        ?  1449.4441  20.4327          ?        ?      380.6        2.7       ?       ? 
1 1 1   44   19   30 f    103.0    7.4    0.0000   0.0000          ?        ?   106.6331  15.3245          ?        ?      103.0        7.4       ?       ? 
1 1 1   44   19   31 o    225.7    3.5    0.0000   0.0000          ?        ?   510.1788  15.9630          ?        ?      225.7        3.5       ?       ? 
1 1 1   44   19   32 o     19.9    9.9    0.0000   0.0000          ?        ?   -45.9736  16.6016          ?        ?       19.9        9.9       ?       ? 
1 1 1   44   19   33 o    178.1    4.5    0.0000   0.0000          ?        ?   317.9838  15.9630          ?        ?      178.1        4.5       ?       ? 
1 1 1   44   19   34 o    237.7    3.5    0.0000   0.0000          ?        ?   565.7302  16.6016          ?        ?      237.7        3.5       ?       ? 
1 1 1   44   19   35 f    147.3    5.4    0.0000   0.0000          ?        ?   217.7359  15.9630          ?        ?      147.3        5.4       ?       ? 
1 1 1   44   19   36 o    107.1    7.5    0.0000   0.0000          ?        ?   115.5724  15.9630          ?        ?      107.1        7.5       ?       ? 
1 1 1   44   19   37 o    157.7    5.3    0.0000   0.0000          ?        ?   249.6619  16.6016          ?        ?      157.7        5.3       ?       ? 
1 1 1   44   19   38 o    268.5    3.4    0.0000   0.0000          ?        ?   722.1680  18.5171          ?        ?      268.5        3.4       ?       ? 
1 1 1   44   19   39 o     18.9    9.5    0.0000   0.0000          ?        ?   -52.3588  16.6016          ?        ?       18.9        9.5       ?       ? 
1 1 1   44   19   40 o    266.2    3.4    0.0000   0.0000          ?        ?   710.0360  17.8786          ?        ?      266.2        3.4       ?       ? 
1 1 1   44   19   41 o     75.8   11.4    0.0000   0.0000          ?        ?    58.7440  17.2401          ?        ?       75.8       11.4       ?       ? 
1 1 1   44   19   42 f     33.5   14.2    0.0000   0.0000          ?        ?     1.2770  16.6016          ?        ?       33.5       14.2       ?       ? 
1 1 1   44   19   43 f    221.8    3.9    0.0000   0.0000          ?        ?   493.5772  17.2401          ?        ?      221.8        3.9       ?       ? 
1 1 1   44   19   44 o    178.6    4.6    0.0000   0.0000          ?        ?   320.5379  16.6016          ?        ?      178.6        4.6       ?       ? 
1 1 1   44   20    0 o    302.7    4.4  917.5555  26.8179   917.5555  26.8179   917.5555  26.8179      302.7      4.4      302.7        4.4     0.0     0.0 
1 1 1   44   20    1 o    288.2    3.8    0.0000   0.0000          ?        ?   831.3552  21.7097          ?        ?      288.2        3.8       ?       ? 
1 1 1   44   20    2 o    148.3    5.6    0.0000   0.0000          ?        ?   220.2900  16.6016          ?        ?      148.3        5.6       ?       ? 
1 1 1   44   20    3 f    409.2    3.7    0.0000   0.0000          ?        ?  1675.4807  30.0105          ?        ?      409.2        3.7       ?       ? 
1 1 1   44   20    4 o    532.6    3.2    0.0000   0.0000          ?        ?  2838.2285  34.4802          ?        ?      532.6        3.2       ?       ? 
1 1 1   44   20    5 o    199.5    3.8    0.0000   0.0000          ?        ?   398.4375  15.3245          ?        ?      199.5        3.8       ?       ? 
1 1 1   44   20    6 o    159.5    5.0    0.0000   0.0000          ?        ?   254.7701  15.9630          ?        ?      159.5        5.0       ?       ? 
1 1 1   44   20    7 o    388.0    3.5    0.0000   0.0000          ?        ?  1506.9110  27.4564          ?        ?      388.0        3.5       ?       ? 
1 1 1   44   20    8 o    408.7    3.4    0.0000   0.0000          ?        ?  1671.6495  28.0950          ?        ?      408.7        3.4       ?       ? 
1 1 1   44   20    9 o    365.0    3.7    0.0000   0.0000          ?        ?  1333.2332  26.8179          ?        ?      365.0        3.7       ?       ? 
1 1 1   44   20   10 o    520.7    3.5    0.0000   0.0000          ?        ?  2713.0784  36.3957          ?        ?      520.7        3.5       ?       ? 
1 1 1   44   20   11 o    159.1    4.2    0.0000   0.0000          ?        ?   253.4931  13.4090          ?        ?      159.1        4.2       ?       ? 
1 1 1   44   20   12 o    409.8    3.3    0.0000   0.0000          ?        ?  1680.5890  26.8179          ?        ?      409.8        3.3       ?       ? 
1 1 1   44   20   13 o    150.0    4.7    0.0000   0.0000          ?        ?   225.3981  14.0475          ?        ?      150.0        4.7       ?       ? 
1 1 1   44   20   14 o    175.9    4.2    0.0000   0.0000          ?        ?   309.6830  14.6860          ?        ?      175.9        4.2       ?       ? 
1 1 1   44   20   15 o    195.6    3.9    0.0000   0.0000          ?        ?   383.1130  15.3245          ?        ?      195.6        3.9       ?       ? 
1 1 1   44   20   16 o    212.2    3.8    0.0000   0.0000          ?        ?   450.7963  15.9630          ?        ?      212.2        3.8       ?       ? 
1 1 1   44   20   17 o    260.1    3.3    0.0000   0.0000          ?        ?   676.8329  17.2401          ?        ?      260.1        3.3       ?       ? 
1 1 1   44   20   18 o    187.8    3.2    0.0000   0.0000          ?        ?   353.1024  12.1319          ?        ?      187.8        3.2       ?       ? 
1 1 1   44   20   19 o    221.7    3.0    0.0000   0.0000          ?        ?   491.6617  13.4090          ?        ?      221.7        3.0       ?       ? 
1 1 1   44   20   20 o    155.9    4.1    0.0000   0.0000          ?        ?   243.2767  12.7704          ?        ?      155.9        4.1       ?       ? 
1 1 1   44   20   21 o    332.2    2.6    0.0000   0.0000          ?        ?  1104.0039  17.2401          ?        ?      332.2        2.6       ?       ? 
1 1 1   44   20   22 o    128.2    5.0    0.0000   0.0000          ?        ?   164.7386  12.7704          ?        ?      128.2        5.0       ?       ? 
1 1 1   44   20   23 o    262.9    3.0    0.0000   0.0000          ?        ?   691.5189  15.9630          ?        ?      262.9        3.0       ?       ? 
1 1 1   44   20   24 o    444.7    2.7    0.0000   0.0000          ?        ?  1978.7784  23.6253          ?        ?      444.7        2.7       ?       ? 
1 1 1   44   20   25 o    232.2    3.4    0.0000   0.0000          ?        ?   539.5508  15.9630          ?        ?      232.2        3.4       ?       ? 
1 1 1   44   20   26 o    231.9    3.7    0.0000   0.0000          ?        ?   538.2737  17.2401          ?        ?      231.9        3.7       ?       ? 
1 1 1   44   20   27 o     26.6   12.2    0.0000   0.0000          ?        ?   -10.2163  14.6860          ?        ?       26.6       12.2       ?       ? 
1 1 1   44   20   28 o     56.0   13.8    0.0000   0.0000          ?        ?    33.2031  15.3245          ?        ?       56.0       13.8       ?       ? 
1 1 1   44   20   29 f    164.0    4.7    0.0000   0.0000          ?        ?   269.4561  15.3245          ?        ?      164.0        4.7       ?       ? 
1 1 1   44   20   30 o     94.8    8.8    0.0000   0.0000          ?        ?    90.6701  16.6016          ?        ?       94.8        8.8       ?       ? 
1 1 1   44   20   31 o    155.4    4.7    0.0000   0.0000          ?        ?   241.9997  14.6860          ?        ?      155.4        4.7       ?       ? 
1 1 1   44   20   32 o    156.6    5.1    0.0000   0.0000          ?        ?   245.8308  15.9630          ?        ?      156.6        5.1       ?       ? 
1 1 1   44   20   33 o    140.7    5.4    0.0000   0.0000          ?        ?   198.5802  15.3245          ?        ?      140.7        5.4       ?       ? 
1 1 1   44   20   34 o    217.2    3.5    0.0000   0.0000          ?        ?   472.5060  15.3245          ?        ?      217.2        3.5       ?       ? 
1 1 1   44   20   35 o    202.1    4.1    0.0000   0.0000          ?        ?   409.2924  16.6016          ?        ?      202.1        4.1       ?       ? 
1 1 1   44   20   36 o    252.1    3.5    0.0000   0.0000          ?        ?   636.6060  17.8786          ?        ?      252.1        3.5       ?       ? 
1 1 1   44   20   37 o     19.8    9.8    0.0000   0.0000          ?        ?   -38.3113  15.3245          ?        ?       19.8        9.8       ?       ? 
1 1 1   44   20   38 o     20.4   10.2    0.0000   0.0000          ?        ?   -42.1424  16.6016          ?        ?       20.4       10.2       ?       ? 
1 1 1   44   20   39 o    125.4    6.4    0.0000   0.0000          ?        ?   158.3534  15.9630          ?        ?      125.4        6.4       ?       ? 
1 1 1   44   20   40 o    178.3    4.7    0.0000   0.0000          ?        ?   319.2608  16.6016          ?        ?      178.3        4.7       ?       ? 
1 1 1   44   20   41 o     59.2   13.7    0.0000   0.0000          ?        ?    37.6728  15.9630          ?        ?       59.2       13.7       ?       ? 
1 1 1   44   20   42 o    204.3    4.1    0.0000   0.0000          ?        ?   418.8702  16.6016          ?        ?      204.3        4.1       ?       ? 
1 1 1   44   20   43 o     93.4    8.9    0.0000   0.0000          ?        ?    88.7545  16.6016          ?        ?       93.4        8.9       ?       ? 
1 1 1   44   21    0 o    118.8    7.6  143.0288  17.8786   143.0288  17.8786   143.0288  17.8786      118.8      7.6      118.8        7.6     0.0     0.0 
1 1 1   44   21    1 o    145.9    5.0    0.0000   0.0000          ?        ?   213.2662  14.6860          ?        ?      145.9        5.0       ?       ? 
1 1 1   44   21    2 o    121.3    5.5    0.0000   0.0000          ?        ?   147.4985  13.4090          ?        ?      121.3        5.5       ?       ? 
1 1 1   44   21    3 o    194.6    4.1    0.0000   0.0000          ?        ?   379.2819  15.9630          ?        ?      194.6        4.1       ?       ? 
1 1 1   44   21    4 o    354.6    3.5    0.0000   0.0000          ?        ?  1258.5261  24.9023          ?        ?      354.6        3.5       ?       ? 
1 1 1   44   21    5 o    514.9    3.9    0.0000   0.0000          ?        ?  2654.3345  40.2269          ?        ?      514.9        3.9       ?       ? 
1 1 1   44   21    6 o    457.8    3.3    0.0000   0.0000          ?        ?  2097.5435  30.0105          ?        ?      457.8        3.3       ?       ? 
1 1 1   44   21    7 o    380.9    3.8    0.0000   0.0000          ?        ?  1452.6367  28.7335          ?        ?      380.9        3.8       ?       ? 
1 1 1   44   21    8 o    140.3    6.6    0.0000   0.0000          ?        ?   197.3032  18.5171          ?        ?      140.3        6.6       ?       ? 
1 1 1   44   21    9 o    546.9    3.9    0.0000   0.0000          ?        ?  2994.6665  42.7809          ?        ?      546.9        3.9       ?       ? 
1 1 1   44   21   10 o    197.4    4.7    0.0000   0.0000          ?        ?   390.1367  18.5171          ?        ?      197.4        4.7       ?       ? 
1 1 1   44   21   11 o    214.5    5.1    0.0000   0.0000          ?        ?   461.0126  21.7097          ?        ?      214.5        5.1       ?       ? 
1 1 1   44   21   12 o    133.8    4.8    0.0000   0.0000          ?        ?   179.4246  12.7704          ?        ?      133.8        4.8       ?       ? 
1 1 1   44   21   13 o    120.5    5.0    0.0000   0.0000          ?        ?   145.5829  12.1319          ?        ?      120.5        5.0       ?       ? 
1 1 1   44   21   14 o    139.5    4.3    0.0000   0.0000          ?        ?   194.7491  12.1319          ?        ?      139.5        4.3       ?       ? 
1 1 1   44   21   15 o     98.7    6.8    0.0000   0.0000          ?        ?    97.6938  13.4090          ?        ?       98.7        6.8       ?       ? 
1 1 1   44   21   16 o    279.3    3.3    0.0000   0.0000          ?        ?   780.9120  18.5171          ?        ?      279.3        3.3       ?       ? 
1 1 1   44   21   17 o    451.6    3.2    0.0000   0.0000          ?        ?  2041.3538  28.7335          ?        ?      451.6        3.2       ?       ? 
1 1 1   44   21   18 o    227.0    3.7    0.0000   0.0000          ?        ?   515.9255  16.6016          ?        ?      227.0        3.7       ?       ? 
1 1 1   44   21   19 o    215.5    3.0    0.0000   0.0000          ?        ?   464.8438  12.7704          ?        ?      215.5        3.0       ?       ? 
1 1 1   44   21   20 f    555.2    2.8    0.0000   0.0000          ?        ?  3084.0596  31.2876          ?        ?      555.2        2.8       ?       ? 
1 1 1   44   21   21 o    309.8    2.7    0.0000   0.0000          ?        ?   960.3365  16.6016          ?        ?      309.8        2.7       ?       ? 
1 1 1   44   21   22 o    281.2    2.7    0.0000   0.0000          ?        ?   791.1283  15.3245          ?        ?      281.2        2.7       ?       ? 
1 1 1   44   21   23 o    459.0    2.6    0.0000   0.0000          ?        ?  2108.3984  24.2638          ?        ?      459.0        2.6       ?       ? 
1 1 1   44   21   24 o    236.0    3.2    0.0000   0.0000          ?        ?   557.4294  15.3245          ?        ?      236.0        3.2       ?       ? 
1 1 1   44   21   25 o    163.2    4.1    0.0000   0.0000          ?        ?   266.9020  13.4090          ?        ?      163.2        4.1       ?       ? 
1 1 1   44   21   26 o    385.4    2.7    0.0000   0.0000          ?        ?  1486.4784  20.4327          ?        ?      385.4        2.7       ?       ? 
1 1 1   44   21   27 o     96.6    6.9    0.0000   0.0000          ?        ?    93.8627  13.4090          ?        ?       96.6        6.9       ?       ? 
1 1 1   44   21   28 o    170.8    4.3    0.0000   0.0000          ?        ?   292.4429  14.6860          ?        ?      170.8        4.3       ?       ? 
1 1 1   44   21   29 o     99.2    7.1    0.0000   0.0000          ?        ?    98.9709  14.0475          ?        ?       99.2        7.1       ?       ? 
1 1 1   44   21   30 o    329.9    2.8    0.0000   0.0000          ?        ?  1089.3180  18.5171          ?        ?      329.9        2.8       ?       ? 
1 1 1   44   21   31 o    176.7    4.5    0.0000   0.0000          ?        ?   312.8756  15.9630          ?        ?      176.7        4.5       ?       ? 
1 1 1   44   21   32 o    280.8    3.2    0.0000   0.0000          ?        ?   789.2127  17.8786          ?        ?      280.8        3.2       ?       ? 
1 1 1   44   21   33 o    186.1    4.5    0.0000   0.0000          ?        ?   347.3558  16.6016          ?        ?      186.1        4.5       ?       ? 
1 1 1   44   21   34 o     78.6   10.2    0.0000   0.0000          ?        ?    62.5751  15.9630          ?        ?       78.6       10.2       ?       ? 
1 1 1   44   21   35 o     95.4    8.4    0.0000   0.0000          ?        ?    91.9471  15.9630          ?        ?       95.4        8.4       ?       ? 
1 1 1   44   21   36 o     96.7    8.3    0.0000   0.0000          ?        ?    94.5012  15.9630          ?        ?       96.7        8.3       ?       ? 
1 1 1   44   21   37 o     29.0   12.9    0.0000   0.0000          ?        ?    -5.7467  15.3245          ?        ?       29.0       12.9       ?       ? 
1 1 1   44   21   38 o     78.8   10.5    0.0000   0.0000          ?        ?    63.2136  16.6016          ?        ?       78.8       10.5       ?       ? 
1 1 1   44   21   39 o     21.2   10.4    0.0000   0.0000          ?        ?   -30.6490  15.3245          ?        ?       21.2       10.4       ?       ? 
1 1 1   44   21   40 o    110.2    7.2    0.0000   0.0000          ?        ?   122.5962  15.9630          ?        ?      110.2        7.2       ?       ? 
1 1 1   44   21   41 o    106.0    7.5    0.0000   0.0000          ?        ?   113.6568  15.9630          ?        ?      106.0        7.5       ?       ? 
1 1 1   44   22    0 o     88.2   10.0   81.0922  17.2401    81.0922  17.2401    81.0922  17.2401       88.2     10.0       88.2       10.0     0.0     0.0 
1 1 1   44   22    1 o    169.8    4.3    0.0000   0.0000          ?        ?   288.6118  14.6860          ?        ?      169.8        4.3       ?       ? 
1 1 1   44   22    2 o    135.7    5.6    0.0000   0.0000          ?        ?   184.5327  15.3245          ?        ?      135.7        5.6       ?       ? 
1 1 1   44   22    3 o    265.3    3.4    0.0000   0.0000          ?        ?   704.2894  17.8786          ?        ?      265.3        3.4       ?       ? 
1 1 1   44   22    4 o    295.5    3.3    0.0000   0.0000          ?        ?   874.1360  19.7942          ?        ?      295.5        3.3       ?       ? 
1 1 1   44   22    5 o    178.2    4.5    0.0000   0.0000          ?        ?   317.9838  15.9630          ?        ?      178.2        4.5       ?       ? 
1 1 1   44   22    6 o    227.9    4.6    0.0000   0.0000          ?        ?   520.3951  21.0712          ?        ?      227.9        4.6       ?       ? 
1 1 1   44   22    7 o    211.8    5.1    0.0000   0.0000          ?        ?   449.5192  21.7097          ?        ?      211.8        5.1       ?       ? 
1 1 1   44   22    8 o    306.4    4.1    0.0000   0.0000          ?        ?   939.9038  24.9023          ?        ?      306.4        4.1       ?       ? 
1 1 1   44   22    9 o    195.9    5.1    0.0000   0.0000          ?        ?   384.3900  19.7942          ?        ?      195.9        5.1       ?       ? 
1 1 1   44   22   10 o    112.8    6.5    0.0000   0.0000          ?        ?   127.7043  14.6860          ?        ?      112.8        6.5       ?       ? 
1 1 1   44   22   11 o    499.5    3.9    0.0000   0.0000          ?        ?  2497.8967  38.9498          ?        ?      499.5        3.9       ?       ? 
1 1 1   44   22   12 o    260.5    3.9    0.0000   0.0000          ?        ?   679.3870  20.4327          ?        ?      260.5        3.9       ?       ? 
1 1 1   44   22   13 o    257.1    3.1    0.0000   0.0000          ?        ?   661.5084  15.9630          ?        ?      257.1        3.1       ?       ? 
1 1 1   44   22   14 o    163.6    4.3    0.0000   0.0000          ?        ?   268.1791  14.0475          ?        ?      163.6        4.3       ?       ? 
1 1 1   44   22   15 o    330.9    3.1    0.0000   0.0000          ?        ?  1095.7031  20.4327          ?        ?      330.9        3.1       ?       ? 
1 1 1   44   22   16 o     69.8   10.1    0.0000   0.0000          ?        ?    49.1662  14.0475          ?        ?       69.8       10.1       ?       ? 
1 1 1   44   22   17 o    210.8    3.6    0.0000   0.0000          ?        ?   445.0496  15.3245          ?        ?      210.8        3.6       ?       ? 
1 1 1   44   22   18 o    188.6    4.2    0.0000   0.0000          ?        ?   356.2951  15.9630          ?        ?      188.6        4.2       ?       ? 
1 1 1   44   22   19 o     16.4    8.3    0.0000   0.0000          ?        ?   -51.7203  14.0475          ?        ?       16.4        8.3       ?       ? 
1 1 1   44   22   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   22   21 f    227.0    3.0    0.0000   0.0000          ?        ?   515.9255  13.4090          ?        ?      227.0        3.0       ?       ? 
1 1 1   44   22   22 o     86.6    7.0    0.0000   0.0000          ?        ?    75.3456  12.1319          ?        ?       86.6        7.0       ?       ? 
1 1 1   44   22   23 o    338.0    2.6    0.0000   0.0000          ?        ?  1142.9537  17.8786          ?        ?      338.0        2.6       ?       ? 
1 1 1   44   22   24 o    183.3    3.8    0.0000   0.0000          ?        ?   336.5009  14.0475          ?        ?      183.3        3.8       ?       ? 
1 1 1   44   22   25 o     68.4    9.3    0.0000   0.0000          ?        ?    47.2506  12.7704          ?        ?       68.4        9.3       ?       ? 
1 1 1   44   22   26 o    118.3    5.7    0.0000   0.0000          ?        ?   140.4748  13.4090          ?        ?      118.3        5.7       ?       ? 
1 1 1   44   22   27 o    189.1    3.9    0.0000   0.0000          ?        ?   358.2106  14.6860          ?        ?      189.1        3.9       ?       ? 
1 1 1   44   22   28 o    263.5    3.1    0.0000   0.0000          ?        ?   695.3500  16.6016          ?        ?      263.5        3.1       ?       ? 
1 1 1   44   22   29 o     33.8   13.6    0.0000   0.0000          ?        ?     5.7467  14.0475          ?        ?       33.8       13.6       ?       ? 
1 1 1   44   22   30 f    181.8    4.4    0.0000   0.0000          ?        ?   331.3927  15.9630          ?        ?      181.8        4.4       ?       ? 
1 1 1   44   22   31 o    268.8    3.3    0.0000   0.0000          ?        ?   723.4450  17.8786          ?        ?      268.8        3.3       ?       ? 
1 1 1   44   22   32 o    164.1    5.1    0.0000   0.0000          ?        ?   270.0946  16.6016          ?        ?      164.1        5.1       ?       ? 
1 1 1   44   22   33 o    284.1    3.1    0.0000   0.0000          ?        ?   808.3683  17.8786          ?        ?      284.1        3.1       ?       ? 
1 1 1   44   22   34 o     88.1    9.1    0.0000   0.0000          ?        ?    78.5382  15.9630          ?        ?       88.1        9.1       ?       ? 
1 1 1   44   22   35 o    183.1    4.7    0.0000   0.0000          ?        ?   336.5009  17.2401          ?        ?      183.1        4.7       ?       ? 
1 1 1   44   22   36 o    117.8    6.8    0.0000   0.0000          ?        ?   139.8362  15.9630          ?        ?      117.8        6.8       ?       ? 
1 1 1   44   22   37 o    184.5    4.7    0.0000   0.0000          ?        ?   341.6091  17.2401          ?        ?      184.5        4.7       ?       ? 
1 1 1   44   22   38 o    214.8    4.0    0.0000   0.0000          ?        ?   462.9282  17.2401          ?        ?      214.8        4.0       ?       ? 
1 1 1   44   22   39 o    152.6    5.4    0.0000   0.0000          ?        ?   234.3374  16.6016          ?        ?      152.6        5.4       ?       ? 
1 1 1   44   22   40 f     39.6   15.3    0.0000   0.0000          ?        ?    11.4934  17.2401          ?        ?       39.6       15.3       ?       ? 
1 1 1   44   23    0 o     59.6   18.4   44.6965  19.1556    44.6965  19.1556    44.6965  19.1556       59.6     18.4       59.6       18.4     0.0     0.0 
1 1 1   44   23    1 o     91.6    7.7    0.0000   0.0000          ?        ?    84.2849  14.0475          ?        ?       91.6        7.7       ?       ? 
1 1 1   44   23    2 o    254.1    3.5    0.0000   0.0000          ?        ?   646.1838  17.8786          ?        ?      254.1        3.5       ?       ? 
1 1 1   44   23    3 o    164.2    4.7    0.0000   0.0000          ?        ?   270.0946  15.3245          ?        ?      164.2        4.7       ?       ? 
1 1 1   44   23    4 f     20.0    9.9    0.0000   0.0000          ?        ?   -30.0105  14.0475          ?        ?       20.0        9.9       ?       ? 
1 1 1   44   23    5 o    145.2    5.5    0.0000   0.0000          ?        ?   211.3506  15.9630          ?        ?      145.2        5.5       ?       ? 
1 1 1   44   23    6 o    219.9    3.9    0.0000   0.0000          ?        ?   483.9994  17.2401          ?        ?      219.9        3.9       ?       ? 
1 1 1   44   23    7 o     44.5   14.8    0.0000   0.0000          ?        ?    19.1556  15.3245          ?        ?       44.5       14.8       ?       ? 
1 1 1   44   23    8 o    245.2    4.2    0.0000   0.0000          ?        ?   602.1259  20.4327          ?        ?      245.2        4.2       ?       ? 
1 1 1   44   23    9 o    553.2    3.9    0.0000   0.0000          ?        ?  3063.6267  43.4195          ?        ?      553.2        3.9       ?       ? 
1 1 1   44   23   10 f    181.5    5.1    0.0000   0.0000          ?        ?   330.1157  18.5171          ?        ?      181.5        5.1       ?       ? 
1 1 1   44   23   11 o    245.5    4.0    0.0000   0.0000          ?        ?   603.4030  19.7942          ?        ?      245.5        4.0       ?       ? 
1 1 1   44   23   12 o    242.5    4.1    0.0000   0.0000          ?        ?   588.7169  19.7942          ?        ?      242.5        4.1       ?       ? 
1 1 1   44   23   13 o    213.5    4.2    0.0000   0.0000          ?        ?   456.5430  17.8786          ?        ?      213.5        4.2       ?       ? 
1 1 1   44   23   14 o    181.1    3.7    0.0000   0.0000          ?        ?   328.2001  13.4090          ?        ?      181.1        3.7       ?       ? 
1 1 1   44   23   15 o    237.1    3.4    0.0000   0.0000          ?        ?   562.5375  15.9630          ?        ?      237.1        3.4       ?       ? 
1 1 1   44   23   16 o     55.0   12.5    0.0000   0.0000          ?        ?    31.9261  13.4090          ?        ?       55.0       12.5       ?       ? 
1 1 1   44   23   17 o    174.7    4.2    0.0000   0.0000          ?        ?   305.8519  14.6860          ?        ?      174.7        4.2       ?       ? 
1 1 1   44   23   18 o    225.4    3.7    0.0000   0.0000          ?        ?   508.9017  16.6016          ?        ?      225.4        3.7       ?       ? 
1 1 1   44   23   19 o    255.8    3.5    0.0000   0.0000          ?        ?   655.1232  17.8786          ?        ?      255.8        3.5       ?       ? 
1 1 1   44   23   20 o    334.3    3.2    0.0000   0.0000          ?        ?  1118.6898  21.0712          ?        ?      334.3        3.2       ?       ? 
1 1 1   44   23   21 o    226.6    2.8    0.0000   0.0000          ?        ?   514.0099  12.7704          ?        ?      226.6        2.8       ?       ? 
1 1 1   44   23   22 o    120.5    4.8    0.0000   0.0000          ?        ?   145.5829  11.4934          ?        ?      120.5        4.8       ?       ? 
1 1 1   44   23   23 o    288.0    2.7    0.0000   0.0000          ?        ?   830.0781  15.3245          ?        ?      288.0        2.7       ?       ? 
1 1 1   44   23   24 o    346.7    2.6    0.0000   0.0000          ?        ?  1202.9747  17.8786          ?        ?      346.7        2.6       ?       ? 
1 1 1   44   23   25 f     87.6    7.3    0.0000   0.0000          ?        ?    77.2611  12.7704          ?        ?       87.6        7.3       ?       ? 
1 1 1   44   23   26 o    113.9    5.6    0.0000   0.0000          ?        ?   130.2584  12.7704          ?        ?      113.9        5.6       ?       ? 
1 1 1   44   23   27 o     96.6    6.6    0.0000   0.0000          ?        ?    93.8627  12.7704          ?        ?       96.6        6.6       ?       ? 
1 1 1   44   23   28 o    106.0    6.6    0.0000   0.0000          ?        ?   113.0183  14.0475          ?        ?      106.0        6.6       ?       ? 
1 1 1   44   23   29 o     16.4    8.3    0.0000   0.0000          ?        ?   -51.0817  14.0475          ?        ?       16.4        8.3       ?       ? 
1 1 1   44   23   30 o     89.3    8.2    0.0000   0.0000          ?        ?    80.4537  14.6860          ?        ?       89.3        8.2       ?       ? 
1 1 1   44   23   31 o    295.0    3.0    0.0000   0.0000          ?        ?   871.5820  17.8786          ?        ?      295.0        3.0       ?       ? 
1 1 1   44   23   32 o    163.3    4.9    0.0000   0.0000          ?        ?   267.5406  15.9630          ?        ?      163.3        4.9       ?       ? 
1 1 1   44   23   33 o    262.1    3.3    0.0000   0.0000          ?        ?   688.3264  17.2401          ?        ?      262.1        3.3       ?       ? 
1 1 1   44   23   34 o     36.3   14.1    0.0000   0.0000          ?        ?     8.9393  14.6860          ?        ?       36.3       14.1       ?       ? 
1 1 1   44   23   35 o     25.3   11.8    0.0000   0.0000          ?        ?   -13.4090  14.6860          ?        ?       25.3       11.8       ?       ? 
1 1 1   44   23   36 o     18.9    9.4    0.0000   0.0000          ?        ?   -43.4195  15.3245          ?        ?       18.9        9.4       ?       ? 
1 1 1   44   23   37 o    185.0    4.1    0.0000   0.0000          ?        ?   343.5246  15.3245          ?        ?      185.0        4.1       ?       ? 
1 1 1   44   23   38 o     20.5   10.2    0.0000   0.0000          ?        ?   -37.6728  15.9630          ?        ?       20.5       10.2       ?       ? 
1 1 1   44   24    0 o     81.2   12.4   69.5989  19.1556    69.5989  19.1556    69.5989  19.1556       81.2     12.4       81.2       12.4     0.0     0.0 
1 1 1   44   24    1 o    319.0    3.4    0.0000   0.0000          ?        ?  1018.4420  21.7097          ?        ?      319.0        3.4       ?       ? 
1 1 1   44   24    2 o    351.6    3.9    0.0000   0.0000          ?        ?  1238.0934  27.4564          ?        ?      351.6        3.9       ?       ? 
1 1 1   44   24    3 o    409.4    3.7    0.0000   0.0000          ?        ?  1678.0348  30.6490          ?        ?      409.4        3.7       ?       ? 
1 1 1   44   24    4 f    333.5    3.7    0.0000   0.0000          ?        ?  1113.5817  24.9023          ?        ?      333.5        3.7       ?       ? 
1 1 1   44   24    5 o    207.1    4.6    0.0000   0.0000          ?        ?   429.7251  19.1556          ?        ?      207.1        4.6       ?       ? 
1 1 1   44   24    6 o    138.9    5.3    0.0000   0.0000          ?        ?   193.4720  14.6860          ?        ?      138.9        5.3       ?       ? 
1 1 1   44   24    7 o     30.9   13.1    0.0000   0.0000          ?        ?     0.6385  14.0475          ?        ?       30.9       13.1       ?       ? 
1 1 1   44   24    8 o    237.6    3.8    0.0000   0.0000          ?        ?   565.0916  17.8786          ?        ?      237.6        3.8       ?       ? 
1 1 1   44   24    9 o    224.6    4.0    0.0000   0.0000          ?        ?   505.0706  17.8786          ?        ?      224.6        4.0       ?       ? 
1 1 1   44   24   10 o    251.9    3.7    0.0000   0.0000          ?        ?   635.3290  18.5171          ?        ?      251.9        3.7       ?       ? 
1 1 1   44   24   11 o    295.0    3.5    0.0000   0.0000          ?        ?   870.9435  20.4327          ?        ?      295.0        3.5       ?       ? 
1 1 1   44   24   12 o    164.9    5.2    0.0000   0.0000          ?        ?   272.6487  17.2401          ?        ?      164.9        5.2       ?       ? 
1 1 1   44   24   13 o    271.4    3.9    0.0000   0.0000          ?        ?   737.4925  21.0712          ?        ?      271.4        3.9       ?       ? 
1 1 1   44   24   14 o    261.9    3.7    0.0000   0.0000          ?        ?   687.0493  19.1556          ?        ?      261.9        3.7       ?       ? 
1 1 1   44   24   15 o    367.5    3.2    0.0000   0.0000          ?        ?  1351.7502  23.6253          ?        ?      367.5        3.2       ?       ? 
1 1 1   44   24   16 o    274.8    3.4    0.0000   0.0000          ?        ?   756.0096  18.5171          ?        ?      274.8        3.4       ?       ? 
1 1 1   44   24   17 o    213.4    3.7    0.0000   0.0000          ?        ?   455.9044  15.9630          ?        ?      213.4        3.7       ?       ? 
1 1 1   44   24   18 o     79.2    8.9    0.0000   0.0000          ?        ?    63.2136  14.0475          ?        ?       79.2        8.9       ?       ? 
1 1 1   44   24   19 f    101.1    7.3    0.0000   0.0000          ?        ?   102.8020  14.6860          ?        ?      101.1        7.3       ?       ? 
1 1 1   44   24   20 o    263.3    3.5    0.0000   0.0000          ?        ?   694.0730  18.5171          ?        ?      263.3        3.5       ?       ? 
1 1 1   44   24   21 o    135.1    5.7    0.0000   0.0000          ?        ?   183.2557  15.3245          ?        ?      135.1        5.7       ?       ? 
1 1 1   44   24   22 o    174.2    3.5    0.0000   0.0000          ?        ?   303.9363  12.1319          ?        ?      174.2        3.5       ?       ? 
1 1 1   44   24   23 o     30.5   12.3    0.0000   0.0000          ?        ?     4.4697  11.4934          ?        ?       30.5       12.3       ?       ? 
1 1 1   44   24   24 o    220.0    3.2    0.0000   0.0000          ?        ?   484.6379  14.0475          ?        ?      220.0        3.2       ?       ? 
1 1 1   44   24   25 o    107.0    6.0    0.0000   0.0000          ?        ?   114.9339  12.7704          ?        ?      107.0        6.0       ?       ? 
1 1 1   44   24   26 o    170.3    3.9    0.0000   0.0000          ?        ?   290.5273  13.4090          ?        ?      170.3        3.9       ?       ? 
1 1 1   44   24   27 o    128.8    5.5    0.0000   0.0000          ?        ?   166.6541  14.0475          ?        ?      128.8        5.5       ?       ? 
1 1 1   44   24   28 o    150.3    4.9    0.0000   0.0000          ?        ?   226.6752  14.6860          ?        ?      150.3        4.9       ?       ? 
1 1 1   44   24   29 f    141.1    5.0    0.0000   0.0000          ?        ?   199.8573  14.0475          ?        ?      141.1        5.0       ?       ? 
1 1 1   44   24   30 o    347.4    2.7    0.0000   0.0000          ?        ?  1208.0829  18.5171          ?        ?      347.4        2.7       ?       ? 
1 1 1   44   24   31 o    133.8    5.7    0.0000   0.0000          ?        ?   180.0631  15.3245          ?        ?      133.8        5.7       ?       ? 
1 1 1   44   24   32 o    199.0    4.0    0.0000   0.0000          ?        ?   397.1605  15.9630          ?        ?      199.0        4.0       ?       ? 
1 1 1   44   24   33 o    115.9    6.6    0.0000   0.0000          ?        ?   135.3666  15.3245          ?        ?      115.9        6.6       ?       ? 
1 1 1   44   24   34 o    108.5    6.8    0.0000   0.0000          ?        ?   118.7650  14.6860          ?        ?      108.5        6.8       ?       ? 
1 1 1   44   24   35 o    141.2    5.2    0.0000   0.0000          ?        ?   200.4958  14.6860          ?        ?      141.2        5.2       ?       ? 
1 1 1   44   24   36 o     37.0   14.2    0.0000   0.0000          ?        ?    10.2163  14.6860          ?        ?       37.0       14.2       ?       ? 
1 1 1   44   25    0 o    265.3    4.3  704.9279  22.9868   704.9279  22.9868   704.9279  22.9868      265.3      4.3      265.3        4.3     0.0     0.0 
1 1 1   44   25    1 o    156.8    4.9    0.0000   0.0000          ?        ?   246.4693  15.3245          ?        ?      156.8        4.9       ?       ? 
1 1 1   44   25    2 o    198.2    4.2    0.0000   0.0000          ?        ?   393.3293  16.6016          ?        ?      198.2        4.2       ?       ? 
1 1 1   44   25    3 o    231.4    4.3    0.0000   0.0000          ?        ?   536.3582  19.7942          ?        ?      231.4        4.3       ?       ? 
1 1 1   44   25    4 o    239.7    3.6    0.0000   0.0000          ?        ?   575.3080  17.2401          ?        ?      239.7        3.6       ?       ? 
1 1 1   44   25    5 o    181.4    4.2    0.0000   0.0000          ?        ?   329.4771  15.3245          ?        ?      181.4        4.2       ?       ? 
1 1 1   44   25    6 o    208.8    4.0    0.0000   0.0000          ?        ?   436.7488  16.6016          ?        ?      208.8        4.0       ?       ? 
1 1 1   44   25    7 o    143.2    5.1    0.0000   0.0000          ?        ?   205.6040  14.6860          ?        ?      143.2        5.1       ?       ? 
1 1 1   44   25    8 f    152.7    4.8    0.0000   0.0000          ?        ?   233.6989  14.6860          ?        ?      152.7        4.8       ?       ? 
1 1 1   44   25    9 o    316.1    3.6    0.0000   0.0000          ?        ?  1000.5634  22.9868          ?        ?      316.1        3.6       ?       ? 
1 1 1   44   25   10 o    201.0    4.9    0.0000   0.0000          ?        ?   404.8227  19.7942          ?        ?      201.0        4.9       ?       ? 
1 1 1   44   25   11 o     23.7   11.4    0.0000   0.0000          ?        ?   -21.0712  15.3245          ?        ?       23.7       11.4       ?       ? 
1 1 1   44   25   12 o    138.9    5.7    0.0000   0.0000          ?        ?   193.4720  15.9630          ?        ?      138.9        5.7       ?       ? 
1 1 1   44   25   13 o    281.1    4.3    0.0000   0.0000          ?        ?   791.7668  24.2638          ?        ?      281.1        4.3       ?       ? 
1 1 1   44   25   14 o    242.1    4.6    0.0000   0.0000          ?        ?   587.4399  22.3483          ?        ?      242.1        4.6       ?       ? 
1 1 1   44   25   15 o    160.4    4.4    0.0000   0.0000          ?        ?   257.9627  14.0475          ?        ?      160.4        4.4       ?       ? 
1 1 1   44   25   16 o    203.6    3.6    0.0000   0.0000          ?        ?   415.0391  14.6860          ?        ?      203.6        3.6       ?       ? 
1 1 1   44   25   17 o    227.7    3.4    0.0000   0.0000          ?        ?   519.1181  15.3245          ?        ?      227.7        3.4       ?       ? 
1 1 1   44   25   18 o     91.5    7.3    0.0000   0.0000          ?        ?    84.2849  13.4090          ?        ?       91.5        7.3       ?       ? 
1 1 1   44   25   19 o     51.6   13.9    0.0000   0.0000          ?        ?    28.0950  14.6860          ?        ?       51.6       13.9       ?       ? 
1 1 1   44   25   20 o    136.1    5.2    0.0000   0.0000          ?        ?   185.8098  14.0475          ?        ?      136.1        5.2       ?       ? 
1 1 1   44   25   21 o    310.5    3.0    0.0000   0.0000          ?        ?   965.4447  18.5171          ?        ?      310.5        3.0       ?       ? 
1 1 1   44   25   22 o    137.4    3.5    0.0000   0.0000          ?        ?   189.0024   9.5778          ?        ?      137.4        3.5       ?       ? 
1 1 1   44   25   23 o    107.3    5.4    0.0000   0.0000          ?        ?   115.5724  11.4934          ?        ?      107.3        5.4       ?       ? 
1 1 1   44   25   24 o    159.6    4.0    0.0000   0.0000          ?        ?   255.4086  12.7704          ?        ?      159.6        4.0       ?       ? 
1 1 1   44   25   25 o     22.2   10.5    0.0000   0.0000          ?        ?   -13.4090  12.1319          ?        ?       22.2       10.5       ?       ? 
1 1 1   44   25   26 o     64.0   10.0    0.0000   0.0000          ?        ?    41.5039  12.7704          ?        ?       64.0       10.0       ?       ? 
1 1 1   44   25   27 f    234.6    3.3    0.0000   0.0000          ?        ?   551.0442  15.3245          ?        ?      234.6        3.3       ?       ? 
1 1 1   44   25   28 o    343.2    2.8    0.0000   0.0000          ?        ?  1179.3494  19.1556          ?        ?      343.2        2.8       ?       ? 
1 1 1   44   25   29 o     39.1   13.8    0.0000   0.0000          ?        ?    14.0475  13.4090          ?        ?       39.1       13.8       ?       ? 
1 1 1   44   25   30 o    112.9    6.2    0.0000   0.0000          ?        ?   128.3428  14.0475          ?        ?      112.9        6.2       ?       ? 
1 1 1   44   25   31 o    441.4    2.5    0.0000   0.0000          ?        ?  1950.0450  21.7097          ?        ?      441.4        2.5       ?       ? 
1 1 1   44   25   32 o     68.5   10.7    0.0000   0.0000          ?        ?    47.8891  14.6860          ?        ?       68.5       10.7       ?       ? 
1 1 1   44   25   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   25   34 o     73.0    9.6    0.0000   0.0000          ?        ?    54.2743  14.0475          ?        ?       73.0        9.6       ?       ? 
1 1 1   44   26    0 o    371.1    5.4 1379.8452  40.2269  1379.8452  40.2269  1379.8452  40.2269      371.1      5.4      371.1        5.4     0.0     0.0 
1 1 1   44   26    1 o     62.9   12.1    0.0000   0.0000          ?        ?    41.5039  14.6860          ?        ?       62.9       12.1       ?       ? 
1 1 1   44   26    2 o    114.3    5.0    0.0000   0.0000          ?        ?   130.8969  11.4934          ?        ?      114.3        5.0       ?       ? 
1 1 1   44   26    3 o    319.6    3.4    0.0000   0.0000          ?        ?  1022.9116  21.7097          ?        ?      319.6        3.4       ?       ? 
1 1 1   44   26    4 o    219.7    3.2    0.0000   0.0000          ?        ?   483.3608  14.0475          ?        ?      219.7        3.2       ?       ? 
1 1 1   44   26    5 o     16.5    8.2    0.0000   0.0000          ?        ?   -24.2638  10.2163          ?        ?       16.5        8.2       ?       ? 
1 1 1   44   26    6 o    145.3    4.0    0.0000   0.0000          ?        ?   211.3506  11.4934          ?        ?      145.3        4.0       ?       ? 
1 1 1   44   26    7 o     64.2    9.0    0.0000   0.0000          ?        ?    41.5039  11.4934          ?        ?       64.2        9.0       ?       ? 
1 1 1   44   26    8 o    246.4    3.2    0.0000   0.0000          ?        ?   607.8726  15.9630          ?        ?      246.4        3.2       ?       ? 
1 1 1   44   26    9 o    199.8    3.8    0.0000   0.0000          ?        ?   399.7145  15.3245          ?        ?      199.8        3.8       ?       ? 
1 1 1   44   26   10 o    337.2    3.6    0.0000   0.0000          ?        ?  1138.4841  24.2638          ?        ?      337.2        3.6       ?       ? 
1 1 1   44   26   11 o    289.4    3.4    0.0000   0.0000          ?        ?   838.3789  19.7942          ?        ?      289.4        3.4       ?       ? 
1 1 1   44   26   12 o    209.8    4.4    0.0000   0.0000          ?        ?   441.2184  18.5171          ?        ?      209.8        4.4       ?       ? 
1 1 1   44   26   13 o     60.4   12.1    0.0000   0.0000          ?        ?    38.3113  14.0475          ?        ?       60.4       12.1       ?       ? 
1 1 1   44   26   14 o    155.9    5.5    0.0000   0.0000          ?        ?   243.9153  17.2401          ?        ?      155.9        5.5       ?       ? 
1 1 1   44   26   15 o    169.2    5.3    0.0000   0.0000          ?        ?   287.3347  17.8786          ?        ?      169.2        5.3       ?       ? 
1 1 1   44   26   16 o    113.7    5.3    0.0000   0.0000          ?        ?   129.6199  12.1319          ?        ?      113.7        5.3       ?       ? 
1 1 1   44   26   17 o     67.9    9.4    0.0000   0.0000          ?        ?    46.6121  12.7704          ?        ?       67.9        9.4       ?       ? 
1 1 1   44   26   18 o    242.2    3.4    0.0000   0.0000          ?        ?   587.4399  16.6016          ?        ?      242.2        3.4       ?       ? 
1 1 1   44   26   19 o     65.4   10.7    0.0000   0.0000          ?        ?    43.4195  14.0475          ?        ?       65.4       10.7       ?       ? 
1 1 1   44   26   20 o     46.4   14.0    0.0000   0.0000          ?        ?    22.3483  14.0475          ?        ?       46.4       14.0       ?       ? 
1 1 1   44   26   21 o     40.6   14.1    0.0000   0.0000          ?        ?    15.3245  14.0475          ?        ?       40.6       14.1       ?       ? 
1 1 1   44   26   22 o    132.3    5.3    0.0000   0.0000          ?        ?   175.5934  14.0475          ?        ?      132.3        5.3       ?       ? 
1 1 1   44   26   23 o     32.2   11.6    0.0000   0.0000          ?        ?     8.9393   9.5778          ?        ?       32.2       11.6       ?       ? 
1 1 1   44   26   24 o    208.8    3.1    0.0000   0.0000          ?        ?   436.7488  12.7704          ?        ?      208.8        3.1       ?       ? 
1 1 1   44   26   25 o    103.3    5.9    0.0000   0.0000          ?        ?   107.2716  12.1319          ?        ?      103.3        5.9       ?       ? 
1 1 1   44   26   26 f    363.7    2.6    0.0000   0.0000          ?        ?  1324.2938  19.1556          ?        ?      363.7        2.6       ?       ? 
1 1 1   44   26   27 o    134.2    4.8    0.0000   0.0000          ?        ?   180.7016  12.7704          ?        ?      134.2        4.8       ?       ? 
1 1 1   44   26   28 o     22.5   10.7    0.0000   0.0000          ?        ?   -17.2401  13.4090          ?        ?       22.5       10.7       ?       ? 
1 1 1   44   26   29 o     30.0   12.9    0.0000   0.0000          ?        ?    -0.6385  14.0475          ?        ?       30.0       12.9       ?       ? 
1 1 1   44   26   30 o    251.7    3.0    0.0000   0.0000          ?        ?   634.6905  15.3245          ?        ?      251.7        3.0       ?       ? 
1 1 1   44   26   31 f    155.9    4.5    0.0000   0.0000          ?        ?   243.9153  14.0475          ?        ?      155.9        4.5       ?       ? 
1 1 1   44   26   32 o    115.1    6.1    0.0000   0.0000          ?        ?   133.4510  14.0475          ?        ?      115.1        6.1       ?       ? 
1 1 1   44   27    0 o     72.8   31.8   79.1767  47.8891    79.1767  47.8891    79.1767  47.8891       72.8     31.8       72.8       31.8     0.0     0.0 
1 1 1   44   27    1 o    245.2    6.2    0.0000   0.0000          ?        ?   604.0414  30.6490          ?        ?      245.2        6.2       ?       ? 
1 1 1   44   27    2 o    243.0    4.6    0.0000   0.0000          ?        ?   591.9095  22.3483          ?        ?      243.0        4.6       ?       ? 
1 1 1   44   27    3 o    212.2    5.0    0.0000   0.0000          ?        ?   451.4348  21.0712          ?        ?      212.2        5.0       ?       ? 
1 1 1   44   27    4 o    120.9    9.0    0.0000   0.0000          ?        ?   147.4985  21.7097          ?        ?      120.9        9.0       ?       ? 
1 1 1   44   27    5 o    157.4    7.1    0.0000   0.0000          ?        ?   249.0234  22.3483          ?        ?      157.4        7.1       ?       ? 
1 1 1   44   27    6 o    202.7    4.7    0.0000   0.0000          ?        ?   411.8464  19.1556          ?        ?      202.7        4.7       ?       ? 
1 1 1   44   27    7 o    133.4    6.2    0.0000   0.0000          ?        ?   178.7861  16.6016          ?        ?      133.4        6.2       ?       ? 
1 1 1   44   27    8 o    149.4    6.0    0.0000   0.0000          ?        ?   224.1211  17.8786          ?        ?      149.4        6.0       ?       ? 
1 1 1   44   27    9 o     65.4   14.1    0.0000   0.0000          ?        ?    45.3350  17.8786          ?        ?       65.4       14.1       ?       ? 
1 1 1   44   27   10 o    194.6    5.6    0.0000   0.0000          ?        ?   379.9204  21.7097          ?        ?      194.6        5.6       ?       ? 
1 1 1   44   27   11 o    315.6    3.3    0.0000   0.0000          ?        ?   997.3708  21.0712          ?        ?      315.6        3.3       ?       ? 
1 1 1   44   27   12 o    252.2    3.8    0.0000   0.0000          ?        ?   637.2446  19.1556          ?        ?      252.2        3.8       ?       ? 
1 1 1   44   27   13 o    196.5    4.2    0.0000   0.0000          ?        ?   386.9441  16.6016          ?        ?      196.5        4.2       ?       ? 
1 1 1   44   27   14 o    121.7    6.3    0.0000   0.0000          ?        ?   148.7755  15.3245          ?        ?      121.7        6.3       ?       ? 
1 1 1   44   27   15 o    214.8    4.3    0.0000   0.0000          ?        ?   462.2897  18.5171          ?        ?      214.8        4.3       ?       ? 
1 1 1   44   27   16 o    208.6    4.3    0.0000   0.0000          ?        ?   436.1103  17.8786          ?        ?      208.6        4.3       ?       ? 
1 1 1   44   27   17 o    322.6    3.1    0.0000   0.0000          ?        ?  1042.0673  19.7942          ?        ?      322.6        3.1       ?       ? 
1 1 1   44   27   18 o    249.9    3.4    0.0000   0.0000          ?        ?   625.7512  17.2401          ?        ?      249.9        3.4       ?       ? 
1 1 1   44   27   19 o     22.2   10.7    0.0000   0.0000          ?        ?   -21.0712  14.0475          ?        ?       22.2       10.7       ?       ? 
1 1 1   44   27   20 o     19.6    9.7    0.0000   0.0000          ?        ?   -28.0950  13.4090          ?        ?       19.6        9.7       ?       ? 
1 1 1   44   27   21 o    101.0    7.6    0.0000   0.0000          ?        ?   102.8020  15.3245          ?        ?      101.0        7.6       ?       ? 
1 1 1   44   27   22 o     85.2    8.2    0.0000   0.0000          ?        ?    73.4300  14.0475          ?        ?       85.2        8.2       ?       ? 
1 1 1   44   27   23 o     92.8    7.6    0.0000   0.0000          ?        ?    86.8389  14.0475          ?        ?       92.8        7.6       ?       ? 
1 1 1   44   27   24 o    168.4    3.2    0.0000   0.0000          ?        ?   284.1421  10.8549          ?        ?      168.4        3.2       ?       ? 
1 1 1   44   27   25 o    137.5    4.2    0.0000   0.0000          ?        ?   189.6409  11.4934          ?        ?      137.5        4.2       ?       ? 
1 1 1   44   27   26 o    125.3    4.8    0.0000   0.0000          ?        ?   157.7148  12.1319          ?        ?      125.3        4.8       ?       ? 
1 1 1   44   27   27 o    191.2    3.5    0.0000   0.0000          ?        ?   366.5114  13.4090          ?        ?      191.2        3.5       ?       ? 
1 1 1   44   27   28 o    266.2    2.9    0.0000   0.0000          ?        ?   710.0360  15.3245          ?        ?      266.2        2.9       ?       ? 
1 1 1   44   27   29 o    235.3    3.0    0.0000   0.0000          ?        ?   554.8753  14.0475          ?        ?      235.3        3.0       ?       ? 
1 1 1   44   28    0 o     90.9   35.9  120.0421  62.5751   120.0421  62.5751   120.0421  62.5751       90.9     35.9       90.9       35.9     0.0     0.0 
1 1 1   44   28    1 o    218.9   11.8    0.0000   0.0000          ?        ?   487.1920  51.7203          ?        ?      218.9       11.8       ?       ? 
1 1 1   44   28    2 o     51.0   23.4    0.0000   0.0000          ?        ?   -31.2876  54.2743          ?        ?       51.0       23.4       ?       ? 
1 1 1   44   28    3 o    125.6   22.4    0.0000   0.0000          ?        ?   171.7623  54.2743          ?        ?      125.6       22.4       ?       ? 
1 1 1   44   28    4 o     83.9   28.1    0.0000   0.0000          ?        ?    75.3456  55.5514          ?        ?       83.9       28.1       ?       ? 
1 1 1   44   28    5 o    188.9    5.7    0.0000   0.0000          ?        ?   358.2106  21.7097          ?        ?      188.9        5.7       ?       ? 
1 1 1   44   28    6 o    195.6    6.2    0.0000   0.0000          ?        ?   384.3900  24.2638          ?        ?      195.6        6.2       ?       ? 
1 1 1   44   28    7 o    225.5    6.8    0.0000   0.0000          ?        ?   511.4558  30.6490          ?        ?      225.5        6.8       ?       ? 
1 1 1   44   28    8 o    233.1    5.1    0.0000   0.0000          ?        ?   545.2975  23.6253          ?        ?      233.1        5.1       ?       ? 
1 1 1   44   28    9 o     33.9   15.1    0.0000   0.0000          ?        ?    -6.3852  20.4327          ?        ?       33.9       15.1       ?       ? 
1 1 1   44   28   10 o     52.8   16.7    0.0000   0.0000          ?        ?    28.7335  19.7942          ?        ?       52.8       16.7       ?       ? 
1 1 1   44   28   11 o     60.5   17.5    0.0000   0.0000          ?        ?    38.9498  22.3483          ?        ?       60.5       17.5       ?       ? 
1 1 1   44   28   12 f     62.7   15.8    0.0000   0.0000          ?        ?    42.1424  19.7942          ?        ?       62.7       15.8       ?       ? 
1 1 1   44   28   13 o     31.3   14.7    0.0000   0.0000          ?        ?   -21.7097  22.9868          ?        ?       31.3       14.7       ?       ? 
1 1 1   44   28   14 o     72.4    8.4    0.0000   0.0000          ?        ?    52.9973  12.1319          ?        ?       72.4        8.4       ?       ? 
1 1 1   44   28   15 o    183.0    4.4    0.0000   0.0000          ?        ?   335.8624  15.9630          ?        ?      183.0        4.4       ?       ? 
1 1 1   44   28   16 o    105.3    7.6    0.0000   0.0000          ?        ?   111.7413  15.9630          ?        ?      105.3        7.6       ?       ? 
1 1 1   44   28   17 o    132.3    5.1    0.0000   0.0000          ?        ?   175.5934  13.4090          ?        ?      132.3        5.1       ?       ? 
1 1 1   44   28   18 o     76.7    7.9    0.0000   0.0000          ?        ?    59.3825  12.1319          ?        ?       76.7        7.9       ?       ? 
1 1 1   44   28   19 o    201.5    3.6    0.0000   0.0000          ?        ?   406.7383  14.6860          ?        ?      201.5        3.6       ?       ? 
1 1 1   44   28   20 o    159.2    4.4    0.0000   0.0000          ?        ?   254.1316  14.0475          ?        ?      159.2        4.4       ?       ? 
1 1 1   44   28   21 o     48.4   13.4    0.0000   0.0000          ?        ?    24.9023  13.4090          ?        ?       48.4       13.4       ?       ? 
1 1 1   44   28   22 o    247.4    3.5    0.0000   0.0000          ?        ?   613.6193  17.2401          ?        ?      247.4        3.5       ?       ? 
1 1 1   44   28   23 o    215.3    3.7    0.0000   0.0000          ?        ?   464.8438  15.9630          ?        ?      215.3        3.7       ?       ? 
1 1 1   44   28   24 o    292.8    3.1    0.0000   0.0000          ?        ?   858.8116  17.8786          ?        ?      292.8        3.1       ?       ? 
1 1 1   44   28   25 o    208.5    2.9    0.0000   0.0000          ?        ?   435.4717  12.1319          ?        ?      208.5        2.9       ?       ? 
1 1 1   44   28   26 f     81.9    7.0    0.0000   0.0000          ?        ?    67.6833  11.4934          ?        ?       81.9        7.0       ?       ? 
1 1 1   44   28   27 o     63.8    9.5    0.0000   0.0000          ?        ?    41.5039  12.1319          ?        ?       63.8        9.5       ?       ? 
1 1 1   44   29    0 o     41.5   28.9  -56.1899  82.3693   -56.1899  82.3693   -56.1899  82.3693       41.5     28.9       41.5       28.9     0.0     0.0 
1 1 1   44   29    1 o    263.7   11.9    0.0000   0.0000          ?        ?   708.7590  62.5751          ?        ?      263.7       11.9       ?       ? 
1 1 1   44   29    2 o    354.9   10.0    0.0000   0.0000          ?        ?  1277.0432  70.8759          ?        ?      354.9       10.0       ?       ? 
1 1 1   44   29    3 o    103.6   17.3    0.0000   0.0000          ?        ?   111.7413  35.7572          ?        ?      103.6       17.3       ?       ? 
1 1 1   44   29    4 o    124.4   18.0    0.0000   0.0000          ?        ?   161.5460  44.6965          ?        ?      124.4       18.0       ?       ? 
1 1 1   44   29    5 o     80.1   31.7    0.0000   0.0000          ?        ?    53.6358  75.3456          ?        ?       80.1       31.7       ?       ? 
1 1 1   44   29    6 o    102.4   25.9    0.0000   0.0000          ?        ?   118.7650  52.9973          ?        ?      102.4       25.9       ?       ? 
1 1 1   44   29    7 o     61.9   14.2    0.0000   0.0000          ?        ?    40.8654  17.2401          ?        ?       61.9       14.2       ?       ? 
1 1 1   44   29    8 o    311.2    5.6    0.0000   0.0000          ?        ?   973.1069  35.1187          ?        ?      311.2        5.6       ?       ? 
1 1 1   44   29    9 o    227.3    7.2    0.0000   0.0000          ?        ?   520.3951  32.5646          ?        ?      227.3        7.2       ?       ? 
1 1 1   44   29   10 o    320.5    4.7    0.0000   0.0000          ?        ?  1030.5739  30.0105          ?        ?      320.5        4.7       ?       ? 
1 1 1   44   29   11 o    124.9    8.7    0.0000   0.0000          ?        ?   157.7148  21.7097          ?        ?      124.9        8.7       ?       ? 
1 1 1   44   29   12 o    248.6    5.4    0.0000   0.0000          ?        ?   620.6430  26.8179          ?        ?      248.6        5.4       ?       ? 
1 1 1   44   29   13 o    118.5    9.4    0.0000   0.0000          ?        ?   142.3903  22.3483          ?        ?      118.5        9.4       ?       ? 
1 1 1   44   29   14 o    105.8   10.0    0.0000   0.0000          ?        ?   113.6568  21.0712          ?        ?      105.8       10.0       ?       ? 
1 1 1   44   29   15 o     70.6   15.4    0.0000   0.0000          ?        ?    53.6358  21.0712          ?        ?       70.6       15.4       ?       ? 
1 1 1   44   29   16 o    203.5    3.8    0.0000   0.0000          ?        ?   415.0391  15.3245          ?        ?      203.5        3.8       ?       ? 
1 1 1   44   29   17 o    166.7    4.6    0.0000   0.0000          ?        ?   279.0340  15.3245          ?        ?      166.7        4.6       ?       ? 
1 1 1   44   29   18 o    428.9    3.2    0.0000   0.0000          ?        ?  1842.7734  27.4564          ?        ?      428.9        3.2       ?       ? 
1 1 1   44   29   19 o    123.2    5.2    0.0000   0.0000          ?        ?   152.6067  12.7704          ?        ?      123.2        5.2       ?       ? 
1 1 1   44   29   20 o    197.9    3.7    0.0000   0.0000          ?        ?   392.6908  14.6860          ?        ?      197.9        3.7       ?       ? 
1 1 1   44   29   21 o     57.3   12.6    0.0000   0.0000          ?        ?    35.1187  14.0475          ?        ?       57.3       12.6       ?       ? 
1 1 1   44   29   22 o    263.2    3.2    0.0000   0.0000          ?        ?   694.0730  16.6016          ?        ?      263.2        3.2       ?       ? 
1 1 1   44   29   23 o    196.7    3.7    0.0000   0.0000          ?        ?   388.2211  14.6860          ?        ?      196.7        3.7       ?       ? 
1 1 1   44   29   24 o     50.5   13.6    0.0000   0.0000          ?        ?    27.4564  14.0475          ?        ?       50.5       13.6       ?       ? 
1 1 1   44   30    0 o    218.7   17.3  498.0469  74.7070   498.0469  74.7070   498.0469  74.7070      218.7     17.3      218.7       17.3     0.0     0.0 
1 1 1   44   30    1 o    176.0   14.2    0.0000   0.0000          ?        ?   319.2608  49.8047          ?        ?      176.0       14.2       ?       ? 
1 1 1   44   30    2 o     99.8   20.2    0.0000   0.0000          ?        ?   109.1872  38.9498          ?        ?       99.8       20.2       ?       ? 
1 1 1   44   30    3 o    240.2   10.9    0.0000   0.0000          ?        ?   587.4399  52.3588          ?        ?      240.2       10.9       ?       ? 
1 1 1   44   30    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   30    5 f    136.1   19.7    0.0000   0.0000          ?        ?   196.6647  53.6358          ?        ?      136.1       19.7       ?       ? 
1 1 1   44   30    6 o    260.2   15.7    0.0000   0.0000          ?        ?   703.6508  81.7308          ?        ?      260.2       15.7       ?       ? 
1 1 1   44   30    7 o    227.7   16.4    0.0000   0.0000          ?        ?   540.8278  74.7070          ?        ?      227.7       16.4       ?       ? 
1 1 1   44   30    8 o    301.0    9.4    0.0000   0.0000          ?        ?   919.4711  56.8284          ?        ?      301.0        9.4       ?       ? 
1 1 1   44   30    9 o    146.0   21.0    0.0000   0.0000          ?        ?   228.5907  61.2981          ?        ?      146.0       21.0       ?       ? 
1 1 1   44   30   10 o    136.6    8.6    0.0000   0.0000          ?        ?   189.0024  23.6253          ?        ?      136.6        8.6       ?       ? 
1 1 1   44   30   11 o    260.5    4.3    0.0000   0.0000          ?        ?   680.6641  22.3483          ?        ?      260.5        4.3       ?       ? 
1 1 1   44   30   12 o     43.8   16.1    0.0000   0.0000          ?        ?    16.6016  18.5171          ?        ?       43.8       16.1       ?       ? 
1 1 1   44   30   13 o     84.5   12.9    0.0000   0.0000          ?        ?    73.4300  21.7097          ?        ?       84.5       12.9       ?       ? 
1 1 1   44   30   14 o    129.4    9.1    0.0000   0.0000          ?        ?   169.8468  23.6253          ?        ?      129.4        9.1       ?       ? 
1 1 1   44   30   15 o    169.0    7.6    0.0000   0.0000          ?        ?   288.6118  25.5409          ?        ?      169.0        7.6       ?       ? 
1 1 1   44   30   16 o     38.4   16.8    0.0000   0.0000          ?        ?    -2.5541  24.2638          ?        ?       38.4       16.8       ?       ? 
1 1 1   44   30   17 o    161.7    7.5    0.0000   0.0000          ?        ?   264.3480  24.2638          ?        ?      161.7        7.5       ?       ? 
1 1 1   44   30   18 o     54.0    9.8    0.0000   0.0000          ?        ?    30.6490  10.2163          ?        ?       54.0        9.8       ?       ? 
1 1 1   44   30   19 o    224.5    3.0    0.0000   0.0000          ?        ?   505.0706  13.4090          ?        ?      224.5        3.0       ?       ? 
1 1 1   44   30   20 o    192.7    3.5    0.0000   0.0000          ?        ?   372.2581  13.4090          ?        ?      192.7        3.5       ?       ? 
1 1 1   44   31    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   31    1 f    291.5   10.4    0.0000   0.0000          ?        ?   865.8354  60.6596          ?        ?      291.5       10.4       ?       ? 
1 1 1   44   31    2 o    132.2   18.4    0.0000   0.0000          ?        ?   185.1713  48.5276          ?        ?      132.2       18.4       ?       ? 
1 1 1   44   31    3 o    188.8   11.3    0.0000   0.0000          ?        ?   364.5958  42.7809          ?        ?      188.8       11.3       ?       ? 
1 1 1   44   31    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   31    5 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   31    6 o    188.9   17.6    0.0000   0.0000          ?        ?   376.7278  66.4062          ?        ?      188.9       17.6       ?       ? 
1 1 1   44   31    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   31    8 o    170.2   21.6    0.0000   0.0000          ?        ?   314.7912  73.4300          ?        ?      170.2       21.6       ?       ? 
1 1 1   44   31    9 o     48.7   22.6    0.0000   0.0000          ?        ?   -33.2031  52.3588          ?        ?       48.7       22.6       ?       ? 
1 1 1   44   31   10 o    162.9   23.1    0.0000   0.0000          ?        ?   292.4429  75.3456          ?        ?      162.9       23.1       ?       ? 
1 1 1   44   31   11 f     79.4   31.6    0.0000   0.0000          ?        ?    58.7440  75.3456          ?        ?       79.4       31.6       ?       ? 
1 1 1   44   31   12 o    107.6    6.8    0.0000   0.0000          ?        ?   116.8494  14.6860          ?        ?      107.6        6.8       ?       ? 
1 1 1   44   31   13 o     52.3   14.3    0.0000   0.0000          ?        ?    29.3720  15.3245          ?        ?       52.3       14.3       ?       ? 
1 1 1   44   31   14 o    226.8    5.4    0.0000   0.0000          ?        ?   517.2025  24.2638          ?        ?      226.8        5.4       ?       ? 
1 1 1   44   31   15 o    187.4    5.8    0.0000   0.0000          ?        ?   353.7410  21.7097          ?        ?      187.4        5.8       ?       ? 
1 1 1   44   31   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   32    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   32    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   32    2 o     91.5   27.1    0.0000   0.0000          ?        ?    98.9709  52.9973          ?        ?       91.5       27.1       ?       ? 
1 1 1   44   32    3 o    149.4   14.7    0.0000   0.0000          ?        ?   233.0604  44.0580          ?        ?      149.4       14.7       ?       ? 
1 1 1   44   32    4 o    237.7   11.0    0.0000   0.0000          ?        ?   579.1391  52.3588          ?        ?      237.7       11.0       ?       ? 
1 1 1   44   32    5 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   32    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   44   32    7 o    128.0   18.0    0.0000   0.0000          ?        ?   174.9549  45.9736          ?        ?      128.0       18.0       ?       ? 
1 1 1   44   32    8 o    172.9   14.4    0.0000   0.0000          ?        ?   312.2371  49.8047          ?        ?      172.9       14.4       ?       ? 
1 1 1   44   32    9 f     82.6   31.5    0.0000   0.0000          ?        ?    74.7070  72.1529          ?        ?       82.6       31.5       ?       ? 
1 1 1   45    0    0 o    709.7    6.5 5039.2129  92.5856  5039.2129  92.5856  5039.2129  92.5856      709.7      6.5      709.7        6.5     0.0     0.0 
1 1 1   45    0    1 o    171.4    5.8  294.9970  19.7942   294.9970  19.7942   294.9970  19.7942      171.4      5.8      171.4        5.8     0.0     0.0 
1 1 1   45    0    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    0    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    0    4 o    106.0    7.9  114.2954  16.6016   114.2954  16.6016   114.2954  16.6016      106.0      7.9      106.0        7.9     0.0     0.0 
1 1 1   45    0    5 o    712.5    4.3 5078.1626  61.9366  5078.1626  61.9366  5078.1626  61.9366      712.5      4.3      712.5        4.3     0.0     0.0 
1 1 1   45    0    6 o    513.0    3.7 2632.6245  38.3113  2632.6245  38.3113  2632.6245  38.3113      513.0      3.7      513.0        3.7     0.0     0.0 
1 1 1   45    0    7 o    230.4    3.9  531.2500  17.8786   531.2500  17.8786   531.2500  17.8786      230.4      3.9      230.4        3.9     0.0     0.0 
1 1 1   45    0    8 o    467.2    3.4 2183.1055  31.9261  2183.1055  31.9261  2183.1055  31.9261      467.2      3.4      467.2        3.4     0.0     0.0 
1 1 1   45    0    9 o    178.5    4.7  319.2608  16.6016   319.2608  16.6016   319.2608  16.6016      178.5      4.7      178.5        4.7     0.0     0.0 
1 1 1   45    0   10 o    515.6    3.7 2659.4426  37.6728  2659.4426  37.6728  2659.4426  37.6728      515.6      3.7      515.6        3.7     0.0     0.0 
1 1 1   45    0   11 o    378.9    3.5 1436.0352  26.1794  1436.0352  26.1794  1436.0352  26.1794      378.9      3.5      378.9        3.5     0.0     0.0 
1 1 1   45    0   12 o    278.2    3.8  774.5267  21.0712   774.5267  21.0712   774.5267  21.0712      278.2      3.8      278.2        3.8     0.0     0.0 
1 1 1   45    0   13 o    223.9    4.6  501.8780  20.4327   501.8780  20.4327   501.8780  20.4327      223.9      4.6      223.9        4.6     0.0     0.0 
1 1 1   45    0   14 o     86.1   10.3   77.2611  17.2401    77.2611  17.2401    77.2611  17.2401       86.1     10.3       86.1       10.3     0.0     0.0 
1 1 1   45    0   15 o    267.2    4.2  714.5057  22.3483   714.5057  22.3483   714.5057  22.3483      267.2      4.2      267.2        4.2     0.0     0.0 
1 1 1   45    0   16 o    357.6    3.4 1279.5973  24.2638  1279.5973  24.2638  1279.5973  24.2638      357.6      3.4      357.6        3.4     0.0     0.0 
1 1 1   45    0   17 o    546.3    3.5 2985.7271  38.3113  2985.7271  38.3113  2985.7271  38.3113      546.3      3.5      546.3        3.5     0.0     0.0 
1 1 1   45    0   18 o    101.7    8.9  105.9946  17.8786   105.9946  17.8786   105.9946  17.8786      101.7      8.9      101.7        8.9     0.0     0.0 
1 1 1   45    0   19 o    529.4    3.7 2803.1099  39.5883  2803.1099  39.5883  2803.1099  39.5883      529.4      3.7      529.4        3.7     0.0     0.0 
1 1 1   45    0   20 o     23.0   15.4   -4.4697  18.5171    -4.4697  18.5171    -4.4697  18.5171       23.0     15.4       23.0       15.4     0.0     0.0 
1 1 1   45    0   21 o    307.4    3.6  945.6506  22.3483   945.6506  22.3483   945.6506  22.3483      307.4      3.6      307.4        3.6     0.0     0.0 
1 1 1   45    0   22 o    470.0    3.4 2209.2849  31.9261  2209.2849  31.9261  2209.2849  31.9261      470.0      3.4      470.0        3.4     0.0     0.0 
1 1 1   45    0   23 o     17.8   12.7  -22.9868  18.5171   -22.9868  18.5171   -22.9868  18.5171       17.8     12.7       17.8       12.7     0.0     0.0 
1 1 1   45    0   24 o    596.8    4.0 3562.9507  47.2506  3562.9507  47.2506  3562.9507  47.2506      596.8      4.0      596.8        4.0     0.0     0.0 
1 1 1   45    0   25 o    878.1    4.9 7713.9795  85.5619  7713.9795  85.5619  7713.9795  85.5619      878.1      4.9      878.1        4.9     0.0     0.0 
1 1 1   45    0   26 o     61.6   17.9   46.6121  19.1556    46.6121  19.1556    46.6121  19.1556       61.6     17.9       61.6       17.9     0.0     0.0 
1 1 1   45    0   27 o    647.3    3.8 4191.8945  49.8047  4191.8945  49.8047  4191.8945  49.8047      647.3      3.8      647.3        3.8     0.0     0.0 
1 1 1   45    0   28 o     14.0   10.4  -58.7440  20.4327   -58.7440  20.4327   -58.7440  20.4327       14.0     10.4       14.0       10.4     0.0     0.0 
1 1 1   45    0   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    0   30 o    812.3    4.7 6601.0371  76.6226  6601.0371  76.6226  6601.0371  76.6226      812.3      4.7      812.3        4.7     0.0     0.0 
1 1 1   45    0   31 o    485.0    3.7 2352.9521  35.7572  2352.9521  35.7572  2352.9521  35.7572      485.0      3.7      485.0        3.7     0.0     0.0 
1 1 1   45    0   32 o    427.2    3.5 1825.5333  30.0105  1825.5333  30.0105  1825.5333  30.0105      427.2      3.5      427.2        3.5     0.0     0.0 
1 1 1   45    0   33 o    153.8    6.9  238.1686  21.0712   238.1686  21.0712   238.1686  21.0712      153.8      6.9      153.8        6.9     0.0     0.0 
1 1 1   45    0   34 o    150.2    6.8  227.3137  20.4327   227.3137  20.4327   227.3137  20.4327      150.2      6.8      150.2        6.8     0.0     0.0 
1 1 1   45    0   35 o    455.4    3.6 2074.5566  33.2031  2074.5566  33.2031  2074.5566  33.2031      455.4      3.6      455.4        3.6     0.0     0.0 
1 1 1   45    0   36 o    105.3   10.2  114.2954  21.0712   114.2954  21.0712   114.2954  21.0712      105.3     10.2      105.3       10.2     0.0     0.0 
1 1 1   45    0   37 o    127.4    8.6  164.7386  21.7097   164.7386  21.7097   164.7386  21.7097      127.4      8.6      127.4        8.6     0.0     0.0 
1 1 1   45    0   38 o     14.5   10.8  -88.7545  25.5409   -88.7545  25.5409   -88.7545  25.5409       14.5     10.8       14.5       10.8     0.0     0.0 
1 1 1   45    0   39 o    336.4    3.9 1132.7373  26.1794  1132.7373  26.1794  1132.7373  26.1794      336.4      3.9      336.4        3.9     0.0     0.0 
1 1 1   45    0   40 o     14.8   11.0  -62.5751  22.3483   -62.5751  22.3483   -62.5751  22.3483       14.8     11.0       14.8       11.0     0.0     0.0 
1 1 1   45    0   41 o     20.9   14.8  -22.9868  22.9868   -22.9868  22.9868   -22.9868  22.9868       20.9     14.8       20.9       14.8     0.0     0.0 
1 1 1   45    0   42 o     14.4   10.7  -80.4537  24.2638   -80.4537  24.2638   -80.4537  24.2638       14.4     10.7       14.4       10.7     0.0     0.0 
1 1 1   45    0   43 o     40.9   21.3   24.9023  22.3483    24.9023  22.3483    24.9023  22.3483       40.9     21.3       40.9       21.3     0.0     0.0 
1 1 1   45    0   44 o     18.2   13.2  -35.1187  22.3483   -35.1187  22.3483   -35.1187  22.3483       18.2     13.2       18.2       13.2     0.0     0.0 
1 1 1   45    0   45 o    125.7    9.2  160.9075  22.9868   160.9075  22.9868   160.9075  22.9868      125.7      9.2      125.7        9.2     0.0     0.0 
1 1 1   45    0   46 o    401.5    3.9 1613.5442  31.2876  1613.5442  31.2876  1613.5442  31.2876      401.5      3.9      401.5        3.9     0.0     0.0 
1 1 1   45    0   47 o    170.2    7.2  291.8044  24.2638   291.8044  24.2638   291.8044  24.2638      170.2      7.2      170.2        7.2     0.0     0.0 
1 1 1   45    0   48 o    338.6    4.3 1148.0619  29.3720  1148.0619  29.3720  1148.0619  29.3720      338.6      4.3      338.6        4.3     0.0     0.0 
1 1 1   45    0   49 o     13.9   10.4  -86.2004  24.2638   -86.2004  24.2638   -86.2004  24.2638       13.9     10.4       13.9       10.4     0.0     0.0 
1 1 1   45    0   50 o     22.0   15.5  -25.5409  25.5409   -25.5409  25.5409   -25.5409  25.5409       22.0     15.5       22.0       15.5     0.0     0.0 
1 1 1   45    0   51 o     20.5   14.7  -31.2876  24.9023   -31.2876  24.9023   -31.2876  24.9023       20.5     14.7       20.5       14.7     0.0     0.0 
1 1 1   45    0   52 o    293.1    4.9  860.7272  28.7335   860.7272  28.7335   860.7272  28.7335      293.1      4.9      293.1        4.9     0.0     0.0 
1 1 1   45    0   53 o     29.8   19.6   -1.2770  28.0950    -1.2770  28.0950    -1.2770  28.0950       29.8     19.6       29.8       19.6     0.0     0.0 
1 1 1   45    0   54 o     67.2   21.6   58.1055  25.5409    58.1055  25.5409    58.1055  25.5409       67.2     21.6       67.2       21.6     0.0     0.0 
1 1 1   45    0   55 o     44.0   23.2   29.3720  26.8179    29.3720  26.8179    29.3720  26.8179       44.0     23.2       44.0       23.2     0.0     0.0 
1 1 1   45    0   56 o    135.3    9.8  187.0868  26.1794   187.0868  26.1794   187.0868  26.1794      135.3      9.8      135.3        9.8     0.0     0.0 
1 1 1   45    0   57 f     71.2   22.9   65.7677  28.7335    65.7677  28.7335    65.7677  28.7335       71.2     22.9       71.2       22.9     0.0     0.0 
1 1 1   45    0   58 o     26.5   18.1  -12.1319  28.0950   -12.1319  28.0950   -12.1319  28.0950       26.5     18.1       26.5       18.1     0.0     0.0 
1 1 1   45    0   59 o     28.9   19.0   -1.2770  26.8179    -1.2770  26.8179    -1.2770  26.8179       28.9     19.0       28.9       19.0     0.0     0.0 
1 1 1   45    0   60 o    120.5   11.3  150.6911  26.8179   150.6911  26.8179   150.6911  26.8179      120.5     11.3      120.5       11.3     0.0     0.0 
1 1 1   45    0   61 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    1    0 o    202.8    4.4  411.8464  17.8786   411.8464  17.8786   411.8464  17.8786      202.8      4.4      202.8        4.4     0.0     0.0 
1 1 1   45    1    1 o    544.3    2.7    0.0000   0.0000          ?        ?  2962.7402  29.3720          ?        ?      544.3        2.7       ?       ? 
1 1 1   45    1    2 o    728.6    3.1    0.0000   0.0000          ?        ?  5309.3071  45.3350          ?        ?      728.6        3.1       ?       ? 
1 1 1   45    1    3 o    176.5    3.4    0.0000   0.0000          ?        ?   311.5985  12.1319          ?        ?      176.5        3.4       ?       ? 
1 1 1   45    1    4 o    307.5    2.5    0.0000   0.0000          ?        ?   945.6506  15.3245          ?        ?      307.5        2.5       ?       ? 
1 1 1   45    1    5 o     33.0   12.3    0.0000   0.0000          ?        ?     8.3008  10.8549          ?        ?       33.0       12.3       ?       ? 
1 1 1   45    1    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    1    7 o    191.8    3.3    0.0000   0.0000          ?        ?   367.7885  12.7704          ?        ?      191.8        3.3       ?       ? 
1 1 1   45    1    8 o    277.8    2.6    0.0000   0.0000          ?        ?   771.9727  14.6860          ?        ?      277.8        2.6       ?       ? 
1 1 1   45    1    9 o    449.7    2.5    0.0000   0.0000          ?        ?  2022.1981  22.3483          ?        ?      449.7        2.5       ?       ? 
1 1 1   45    1   10 o    327.3    2.5    0.0000   0.0000          ?        ?  1071.4393  16.6016          ?        ?      327.3        2.5       ?       ? 
1 1 1   45    1   11 o    334.8    2.6    0.0000   0.0000          ?        ?  1121.2440  17.2401          ?        ?      334.8        2.6       ?       ? 
1 1 1   45    1   12 o    609.0    2.9    0.0000   0.0000          ?        ?  3709.8105  35.7572          ?        ?      609.0        2.9       ?       ? 
1 1 1   45    1   13 o    449.8    2.5    0.0000   0.0000          ?        ?  2023.4750  22.3483          ?        ?      449.8        2.5       ?       ? 
1 1 1   45    1   14 o    356.6    2.4    0.0000   0.0000          ?        ?  1271.9351  17.2401          ?        ?      356.6        2.4       ?       ? 
1 1 1   45    1   15 o    409.8    2.4    0.0000   0.0000          ?        ?  1679.3119  19.7942          ?        ?      409.8        2.4       ?       ? 
1 1 1   45    1   16 o    266.1    2.8    0.0000   0.0000          ?        ?   708.1205  14.6860          ?        ?      266.1        2.8       ?       ? 
1 1 1   45    1   17 o    401.2    2.5    0.0000   0.0000          ?        ?  1609.7130  19.7942          ?        ?      401.2        2.5       ?       ? 
1 1 1   45    1   18 f    597.1    2.7    0.0000   0.0000          ?        ?  3565.5049  31.9261          ?        ?      597.1        2.7       ?       ? 
1 1 1   45    1   19 o    162.7    3.9    0.0000   0.0000          ?        ?   264.9865  12.7704          ?        ?      162.7        3.9       ?       ? 
1 1 1   45    1   20 o    241.0    2.9    0.0000   0.0000          ?        ?   581.0547  14.0475          ?        ?      241.0        2.9       ?       ? 
1 1 1   45    1   21 o    298.8    2.7    0.0000   0.0000          ?        ?   893.2917  15.9630          ?        ?      298.8        2.7       ?       ? 
1 1 1   45    1   22 o    717.8    2.9    0.0000   0.0000          ?        ?  5154.1465  42.1424          ?        ?      717.8        2.9       ?       ? 
1 1 1   45    1   23 o    462.3    2.5    0.0000   0.0000          ?        ?  2137.7703  22.9868          ?        ?      462.3        2.5       ?       ? 
1 1 1   45    1   24 f    265.2    2.9    0.0000   0.0000          ?        ?   703.6508  15.3245          ?        ?      265.2        2.9       ?       ? 
1 1 1   45    1   25 o    364.5    2.5    0.0000   0.0000          ?        ?  1328.7635  18.5171          ?        ?      364.5        2.5       ?       ? 
1 1 1   45    1   26 o    169.1    4.2    0.0000   0.0000          ?        ?   286.0577  14.0475          ?        ?      169.1        4.2       ?       ? 
1 1 1   45    1   27 o    359.7    2.7    0.0000   0.0000          ?        ?  1294.2833  19.1556          ?        ?      359.7        2.7       ?       ? 
1 1 1   45    1   28 o    279.1    2.9    0.0000   0.0000          ?        ?   778.9964  15.9630          ?        ?      279.1        2.9       ?       ? 
1 1 1   45    1   29 o    290.5    2.9    0.0000   0.0000          ?        ?   844.1255  16.6016          ?        ?      290.5        2.9       ?       ? 
1 1 1   45    1   30 o    207.9    3.4    0.0000   0.0000          ?        ?   432.2791  14.0475          ?        ?      207.9        3.4       ?       ? 
1 1 1   45    1   31 o    309.0    2.8    0.0000   0.0000          ?        ?   955.2284  17.2401          ?        ?      309.0        2.8       ?       ? 
1 1 1   45    1   32 o    215.0    3.6    0.0000   0.0000          ?        ?   462.2897  15.3245          ?        ?      215.0        3.6       ?       ? 
1 1 1   45    1   33 o    303.3    2.7    0.0000   0.0000          ?        ?   920.1097  16.6016          ?        ?      303.3        2.7       ?       ? 
1 1 1   45    1   34 o    235.9    3.2    0.0000   0.0000          ?        ?   556.7908  15.3245          ?        ?      235.9        3.2       ?       ? 
1 1 1   45    1   35 o    275.4    3.0    0.0000   0.0000          ?        ?   758.5637  16.6016          ?        ?      275.4        3.0       ?       ? 
1 1 1   45    1   36 o    183.5    4.2    0.0000   0.0000          ?        ?   337.1394  15.3245          ?        ?      183.5        4.2       ?       ? 
1 1 1   45    1   37 o    170.2    4.5    0.0000   0.0000          ?        ?   289.8888  15.3245          ?        ?      170.2        4.5       ?       ? 
1 1 1   45    1   38 o    507.0    2.6    0.0000   0.0000          ?        ?  2571.9651  26.1794          ?        ?      507.0        2.6       ?       ? 
1 1 1   45    1   39 o     70.3   10.9    0.0000   0.0000          ?        ?    49.8047  15.3245          ?        ?       70.3       10.9       ?       ? 
1 1 1   45    1   40 o    137.1    5.8    0.0000   0.0000          ?        ?   188.3639  15.9630          ?        ?      137.1        5.8       ?       ? 
1 1 1   45    1   41 o    407.1    2.7    0.0000   0.0000          ?        ?  1658.2407  22.3483          ?        ?      407.1        2.7       ?       ? 
1 1 1   45    1   42 o    196.3    4.4    0.0000   0.0000          ?        ?   385.6671  17.2401          ?        ?      196.3        4.4       ?       ? 
1 1 1   45    1   43 o     96.0    8.3    0.0000   0.0000          ?        ?    92.5856  15.9630          ?        ?       96.0        8.3       ?       ? 
1 1 1   45    1   44 o    289.2    3.2    0.0000   0.0000          ?        ?   837.1019  18.5171          ?        ?      289.2        3.2       ?       ? 
1 1 1   45    1   45 o    243.3    3.8    0.0000   0.0000          ?        ?   592.5481  18.5171          ?        ?      243.3        3.8       ?       ? 
1 1 1   45    1   46 f     28.8   13.3    0.0000   0.0000          ?        ?   -14.0475  17.8786          ?        ?       28.8       13.3       ?       ? 
1 1 1   45    1   47 o    146.3    5.7    0.0000   0.0000          ?        ?   214.5433  16.6016          ?        ?      146.3        5.7       ?       ? 
1 1 1   45    1   48 o    212.5    4.1    0.0000   0.0000          ?        ?   452.0733  17.2401          ?        ?      212.5        4.1       ?       ? 
1 1 1   45    1   49 o    268.6    3.6    0.0000   0.0000          ?        ?   722.1680  19.1556          ?        ?      268.6        3.6       ?       ? 
1 1 1   45    1   50 o    333.9    3.1    0.0000   0.0000          ?        ?  1116.1359  20.4327          ?        ?      333.9        3.1       ?       ? 
1 1 1   45    1   51 o    207.5    4.6    0.0000   0.0000          ?        ?   431.6406  19.1556          ?        ?      207.5        4.6       ?       ? 
1 1 1   45    1   52 o    103.7    8.9    0.0000   0.0000          ?        ?   108.5487  18.5171          ?        ?      103.7        8.9       ?       ? 
1 1 1   45    1   53 o    267.7    3.6    0.0000   0.0000          ?        ?   717.6983  19.1556          ?        ?      267.7        3.6       ?       ? 
1 1 1   45    1   54 o     58.4   15.2    0.0000   0.0000          ?        ?    36.3957  17.8786          ?        ?       58.4       15.2       ?       ? 
1 1 1   45    1   55 o     41.2   15.7    0.0000   0.0000          ?        ?    12.7704  17.8786          ?        ?       41.2       15.7       ?       ? 
1 1 1   45    1   56 o    263.8    3.8    0.0000   0.0000          ?        ?   697.2656  19.7942          ?        ?      263.8        3.8       ?       ? 
1 1 1   45    1   57 o    139.7    6.9    0.0000   0.0000          ?        ?   196.6647  19.1556          ?        ?      139.7        6.9       ?       ? 
1 1 1   45    1   58 o     69.7   13.8    0.0000   0.0000          ?        ?    51.7203  18.5171          ?        ?       69.7       13.8       ?       ? 
1 1 1   45    1   59 o    160.9    6.0    0.0000   0.0000          ?        ?   260.5168  19.1556          ?        ?      160.9        6.0       ?       ? 
1 1 1   45    1   60 o    122.9    7.3    0.0000   0.0000          ?        ?   152.6067  17.8786          ?        ?      122.9        7.3       ?       ? 
1 1 1   45    2    0 o    847.4    4.9 7182.7300  83.0078  7182.7300  83.0078  7182.7300  83.0078      847.4      4.9      847.4        4.9     0.0     0.0 
1 1 1   45    2    1 o    635.3    2.9    0.0000   0.0000          ?        ?  4037.3721  36.3957          ?        ?      635.3        2.9       ?       ? 
1 1 1   45    2    2 o    205.0    3.1    0.0000   0.0000          ?        ?   420.1472  12.7704          ?        ?      205.0        3.1       ?       ? 
1 1 1   45    2    3 o    621.8    2.9    0.0000   0.0000          ?        ?  3867.5256  35.7572          ?        ?      621.8        2.9       ?       ? 
1 1 1   45    2    4 o    437.6    2.6    0.0000   0.0000          ?        ?  1914.9263  22.3483          ?        ?      437.6        2.6       ?       ? 
1 1 1   45    2    5 o    643.8    2.9    0.0000   0.0000          ?        ?  4145.9209  37.6728          ?        ?      643.8        2.9       ?       ? 
1 1 1   45    2    6 o    210.3    2.9    0.0000   0.0000          ?        ?   442.4955  12.1319          ?        ?      210.3        2.9       ?       ? 
1 1 1   45    2    7 o    603.6    2.6    0.0000   0.0000          ?        ?  3643.4043  31.9261          ?        ?      603.6        2.6       ?       ? 
1 1 1   45    2    8 o    268.4    2.6    0.0000   0.0000          ?        ?   720.2524  14.0475          ?        ?      268.4        2.6       ?       ? 
1 1 1   45    2    9 o    550.7    2.6    0.0000   0.0000          ?        ?  3032.9778  28.7335          ?        ?      550.7        2.6       ?       ? 
1 1 1   45    2   10 o    603.5    2.7    0.0000   0.0000          ?        ?  3642.7659  32.5646          ?        ?      603.5        2.7       ?       ? 
1 1 1   45    2   11 o     98.8    6.1    0.0000   0.0000          ?        ?    97.6938  12.1319          ?        ?       98.8        6.1       ?       ? 
1 1 1   45    2   12 o    431.1    2.4    0.0000   0.0000          ?        ?  1858.7365  21.0712          ?        ?      431.1        2.4       ?       ? 
1 1 1   45    2   13 o    284.7    2.6    0.0000   0.0000          ?        ?   810.9225  14.6860          ?        ?      284.7        2.6       ?       ? 
1 1 1   45    2   14 o    364.5    2.5    0.0000   0.0000          ?        ?  1328.7635  17.8786          ?        ?      364.5        2.5       ?       ? 
1 1 1   45    2   15 o    191.9    3.3    0.0000   0.0000          ?        ?   368.4270  12.7704          ?        ?      191.9        3.3       ?       ? 
1 1 1   45    2   16 o    228.0    2.9    0.0000   0.0000          ?        ?   519.7566  13.4090          ?        ?      228.0        2.9       ?       ? 
1 1 1   45    2   17 o    316.8    2.6    0.0000   0.0000          ?        ?  1003.7560  16.6016          ?        ?      316.8        2.6       ?       ? 
1 1 1   45    2   18 o    130.0    4.9    0.0000   0.0000          ?        ?   169.2082  12.7704          ?        ?      130.0        4.9       ?       ? 
1 1 1   45    2   19 o    649.4    2.9    0.0000   0.0000          ?        ?  4218.0737  37.0343          ?        ?      649.4        2.9       ?       ? 
1 1 1   45    2   20 o    590.5    2.8    0.0000   0.0000          ?        ?  3487.6052  32.5646          ?        ?      590.5        2.8       ?       ? 
1 1 1   45    2   21 o    410.8    2.4    0.0000   0.0000          ?        ?  1688.2511  19.7942          ?        ?      410.8        2.4       ?       ? 
1 1 1   45    2   22 o    268.6    2.9    0.0000   0.0000          ?        ?   721.5294  15.3245          ?        ?      268.6        2.9       ?       ? 
1 1 1   45    2   23 o    399.8    2.3    0.0000   0.0000          ?        ?  1598.8582  18.5171          ?        ?      399.8        2.3       ?       ? 
1 1 1   45    2   24 o    407.7    2.4    0.0000   0.0000          ?        ?  1662.7103  19.7942          ?        ?      407.7        2.4       ?       ? 
1 1 1   45    2   25 o    212.9    3.3    0.0000   0.0000          ?        ?   453.3503  14.0475          ?        ?      212.9        3.3       ?       ? 
1 1 1   45    2   26 o    726.2    2.9    0.0000   0.0000          ?        ?  5274.8271  42.7809          ?        ?      726.2        2.9       ?       ? 
1 1 1   45    2   27 o    314.7    2.6    0.0000   0.0000          ?        ?   990.3471  16.6016          ?        ?      314.7        2.6       ?       ? 
1 1 1   45    2   28 o    105.6    6.7    0.0000   0.0000          ?        ?   111.7413  14.0475          ?        ?      105.6        6.7       ?       ? 
1 1 1   45    2   29 o    231.0    3.2    0.0000   0.0000          ?        ?   533.8041  14.6860          ?        ?      231.0        3.2       ?       ? 
1 1 1   45    2   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    2   31 o    177.7    4.5    0.0000   0.0000          ?        ?   316.0682  15.9630          ?        ?      177.7        4.5       ?       ? 
1 1 1   45    2   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    2   33 o    545.2    2.6    0.0000   0.0000          ?        ?  2972.9568  28.0950          ?        ?      545.2        2.6       ?       ? 
1 1 1   45    2   34 o    638.1    2.7    0.0000   0.0000          ?        ?  4073.1296  34.4802          ?        ?      638.1        2.7       ?       ? 
1 1 1   45    2   35 o    147.2    5.4    0.0000   0.0000          ?        ?   217.0974  15.9630          ?        ?      147.2        5.4       ?       ? 
1 1 1   45    2   36 o    206.0    3.9    0.0000   0.0000          ?        ?   424.6169  15.9630          ?        ?      206.0        3.9       ?       ? 
1 1 1   45    2   37 o    462.4    2.6    0.0000   0.0000          ?        ?  2139.0474  24.2638          ?        ?      462.4        2.6       ?       ? 
1 1 1   45    2   38 o     88.4    9.0    0.0000   0.0000          ?        ?    78.5382  15.9630          ?        ?       88.4        9.0       ?       ? 
1 1 1   45    2   39 o     21.7   10.6    0.0000   0.0000          ?        ?   -29.3720  15.3245          ?        ?       21.7       10.6       ?       ? 
1 1 1   45    2   40 o     39.4   14.9    0.0000   0.0000          ?        ?    11.4934  15.9630          ?        ?       39.4       14.9       ?       ? 
1 1 1   45    2   41 o    291.8    3.2    0.0000   0.0000          ?        ?   851.7878  18.5171          ?        ?      291.8        3.2       ?       ? 
1 1 1   45    2   42 o    379.9    2.9    0.0000   0.0000          ?        ?  1443.6974  21.7097          ?        ?      379.9        2.9       ?       ? 
1 1 1   45    2   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    2   44 o    196.7    4.5    0.0000   0.0000          ?        ?   387.5826  17.8786          ?        ?      196.7        4.5       ?       ? 
1 1 1   45    2   45 o    182.1    4.6    0.0000   0.0000          ?        ?   332.0312  16.6016          ?        ?      182.1        4.6       ?       ? 
1 1 1   45    2   46 o    251.0    3.6    0.0000   0.0000          ?        ?   630.8594  17.8786          ?        ?      251.0        3.6       ?       ? 
1 1 1   45    2   47 o     26.7   12.5    0.0000   0.0000          ?        ?   -18.5171  17.2401          ?        ?       26.7       12.5       ?       ? 
1 1 1   45    2   48 f    213.5    4.3    0.0000   0.0000          ?        ?   456.5430  18.5171          ?        ?      213.5        4.3       ?       ? 
1 1 1   45    2   49 o     71.5   13.4    0.0000   0.0000          ?        ?    53.6358  18.5171          ?        ?       71.5       13.4       ?       ? 
1 1 1   45    2   50 o    179.9    5.1    0.0000   0.0000          ?        ?   324.3690  18.5171          ?        ?      179.9        5.1       ?       ? 
1 1 1   45    2   51 o    229.5    4.0    0.0000   0.0000          ?        ?   527.4188  18.5171          ?        ?      229.5        4.0       ?       ? 
1 1 1   45    2   52 o    206.9    4.6    0.0000   0.0000          ?        ?   429.0865  19.1556          ?        ?      206.9        4.6       ?       ? 
1 1 1   45    2   53 o    191.0    5.2    0.0000   0.0000          ?        ?   365.8729  19.7942          ?        ?      191.0        5.2       ?       ? 
1 1 1   45    2   54 o    174.9    5.5    0.0000   0.0000          ?        ?   307.1289  19.1556          ?        ?      174.9        5.5       ?       ? 
1 1 1   45    2   55 o    115.5    8.3    0.0000   0.0000          ?        ?   134.7281  19.1556          ?        ?      115.5        8.3       ?       ? 
1 1 1   45    2   56 o     95.5    9.7    0.0000   0.0000          ?        ?    92.5856  18.5171          ?        ?       95.5        9.7       ?       ? 
1 1 1   45    2   57 o    226.0    4.2    0.0000   0.0000          ?        ?   512.0943  19.1556          ?        ?      226.0        4.2       ?       ? 
1 1 1   45    2   58 o    212.1    4.5    0.0000   0.0000          ?        ?   451.4348  19.1556          ?        ?      212.1        4.5       ?       ? 
1 1 1   45    2   59 o    125.9    7.4    0.0000   0.0000          ?        ?   160.2689  18.5171          ?        ?      125.9        7.4       ?       ? 
1 1 1   45    3    0 o    364.9    3.6 1331.9562  26.1794  1331.9562  26.1794  1331.9562  26.1794      364.9      3.6      364.9        3.6     0.0     0.0 
1 1 1   45    3    1 o    536.2    2.6    0.0000   0.0000          ?        ?  2875.9014  28.0950          ?        ?      536.2        2.6       ?       ? 
1 1 1   45    3    2 o    526.0    2.6    0.0000   0.0000          ?        ?  2766.7141  27.4564          ?        ?      526.0        2.6       ?       ? 
1 1 1   45    3    3 o    585.5    2.7    0.0000   0.0000          ?        ?  3428.2227  31.9261          ?        ?      585.5        2.7       ?       ? 
1 1 1   45    3    4 o    572.3    2.7    0.0000   0.0000          ?        ?  3275.6160  31.2876          ?        ?      572.3        2.7       ?       ? 
1 1 1   45    3    5 o    205.3    3.0    0.0000   0.0000          ?        ?   421.4243  12.1319          ?        ?      205.3        3.0       ?       ? 
1 1 1   45    3    6 o    335.3    2.4    0.0000   0.0000          ?        ?  1124.4366  15.9630          ?        ?      335.3        2.4       ?       ? 
1 1 1   45    3    7 o    379.8    2.4    0.0000   0.0000          ?        ?  1443.0588  18.5171          ?        ?      379.8        2.4       ?       ? 
1 1 1   45    3    8 o    275.7    2.7    0.0000   0.0000          ?        ?   760.4792  14.6860          ?        ?      275.7        2.7       ?       ? 
1 1 1   45    3    9 o    425.7    2.4    0.0000   0.0000          ?        ?  1812.7628  20.4327          ?        ?      425.7        2.4       ?       ? 
1 1 1   45    3   10 o    426.5    2.5    0.0000   0.0000          ?        ?  1819.1481  21.0712          ?        ?      426.5        2.5       ?       ? 
1 1 1   45    3   11 o     64.4    8.4    0.0000   0.0000          ?        ?    41.5039  10.8549          ?        ?       64.4        8.4       ?       ? 
1 1 1   45    3   12 o    168.7    3.8    0.0000   0.0000          ?        ?   284.7806  12.7704          ?        ?      168.7        3.8       ?       ? 
1 1 1   45    3   13 o    424.1    2.6    0.0000   0.0000          ?        ?  1798.7155  21.7097          ?        ?      424.1        2.6       ?       ? 
1 1 1   45    3   14 o    190.7    3.3    0.0000   0.0000          ?        ?   363.9573  12.7704          ?        ?      190.7        3.3       ?       ? 
1 1 1   45    3   15 o    234.3    2.9    0.0000   0.0000          ?        ?   549.1286  13.4090          ?        ?      234.3        2.9       ?       ? 
1 1 1   45    3   16 f    647.3    3.0    0.0000   0.0000          ?        ?  4191.2563  38.9498          ?        ?      647.3        3.0       ?       ? 
1 1 1   45    3   17 o    557.4    2.7    0.0000   0.0000          ?        ?  3107.6848  30.0105          ?        ?      557.4        2.7       ?       ? 
1 1 1   45    3   18 o    632.7    2.8    0.0000   0.0000          ?        ?  4004.1689  35.7572          ?        ?      632.7        2.8       ?       ? 
1 1 1   45    3   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    3   20 o    152.4    4.4    0.0000   0.0000          ?        ?   232.4219  13.4090          ?        ?      152.4        4.4       ?       ? 
1 1 1   45    3   21 o    206.5    3.2    0.0000   0.0000          ?        ?   426.5325  13.4090          ?        ?      206.5        3.2       ?       ? 
1 1 1   45    3   22 o    596.1    2.7    0.0000   0.0000          ?        ?  3554.0112  31.9261          ?        ?      596.1        2.7       ?       ? 
1 1 1   45    3   23 o     81.8    7.8    0.0000   0.0000          ?        ?    67.0448  12.7704          ?        ?       81.8        7.8       ?       ? 
1 1 1   45    3   24 o    585.0    2.7    0.0000   0.0000          ?        ?  3423.1143  31.9261          ?        ?      585.0        2.7       ?       ? 
1 1 1   45    3   25 o    458.3    2.5    0.0000   0.0000          ?        ?  2100.7361  22.9868          ?        ?      458.3        2.5       ?       ? 
1 1 1   45    3   26 o    159.4    4.4    0.0000   0.0000          ?        ?   254.1316  14.0475          ?        ?      159.4        4.4       ?       ? 
1 1 1   45    3   27 o    145.8    4.6    0.0000   0.0000          ?        ?   212.6277  13.4090          ?        ?      145.8        4.6       ?       ? 
1 1 1   45    3   28 o    238.7    3.2    0.0000   0.0000          ?        ?   570.1998  15.3245          ?        ?      238.7        3.2       ?       ? 
1 1 1   45    3   29 o    261.8    3.0    0.0000   0.0000          ?        ?   685.7722  15.9630          ?        ?      261.8        3.0       ?       ? 
1 1 1   45    3   30 o    138.1    5.5    0.0000   0.0000          ?        ?   190.9180  15.3245          ?        ?      138.1        5.5       ?       ? 
1 1 1   45    3   31 o    324.7    2.6    0.0000   0.0000          ?        ?  1054.8376  16.6016          ?        ?      324.7        2.6       ?       ? 
1 1 1   45    3   32 o    153.4    4.8    0.0000   0.0000          ?        ?   235.6145  14.6860          ?        ?      153.4        4.8       ?       ? 
1 1 1   45    3   33 o    142.6    5.1    0.0000   0.0000          ?        ?   203.6884  14.6860          ?        ?      142.6        5.1       ?       ? 
1 1 1   45    3   34 o    263.9    3.1    0.0000   0.0000          ?        ?   696.6271  16.6016          ?        ?      263.9        3.1       ?       ? 
1 1 1   45    3   35 o     18.3    9.2    0.0000   0.0000          ?        ?   -47.8891  15.3245          ?        ?       18.3        9.2       ?       ? 
1 1 1   45    3   36 o     32.3   13.7    0.0000   0.0000          ?        ?     0.6385  15.3245          ?        ?       32.3       13.7       ?       ? 
1 1 1   45    3   37 o    118.7    6.2    0.0000   0.0000          ?        ?   141.1133  14.6860          ?        ?      118.7        6.2       ?       ? 
1 1 1   45    3   38 o     99.9    7.7    0.0000   0.0000          ?        ?   100.2479  15.3245          ?        ?       99.9        7.7       ?       ? 
1 1 1   45    3   39 o     32.6   13.9    0.0000   0.0000          ?        ?     0.0000  15.9630          ?        ?       32.6       13.9       ?       ? 
1 1 1   45    3   40 o    213.0    3.9    0.0000   0.0000          ?        ?   453.9889  16.6016          ?        ?      213.0        3.9       ?       ? 
1 1 1   45    3   41 o    181.0    4.6    0.0000   0.0000          ?        ?   328.2001  16.6016          ?        ?      181.0        4.6       ?       ? 
1 1 1   45    3   42 o     25.9   12.3    0.0000   0.0000          ?        ?   -21.0712  17.2401          ?        ?       25.9       12.3       ?       ? 
1 1 1   45    3   43 f    691.2    2.9    0.0000   0.0000          ?        ?  4779.9727  40.2269          ?        ?      691.2        2.9       ?       ? 
1 1 1   45    3   44 o    102.4    8.4    0.0000   0.0000          ?        ?   105.3561  17.2401          ?        ?      102.4        8.4       ?       ? 
1 1 1   45    3   45 o    271.0    3.4    0.0000   0.0000          ?        ?   734.9384  18.5171          ?        ?      271.0        3.4       ?       ? 
1 1 1   45    3   46 o     35.2   14.5    0.0000   0.0000          ?        ?     3.8311  16.6016          ?        ?       35.2       14.5       ?       ? 
1 1 1   45    3   47 o    181.5    5.1    0.0000   0.0000          ?        ?   330.1157  18.5171          ?        ?      181.5        5.1       ?       ? 
1 1 1   45    3   48 o     38.2   15.2    0.0000   0.0000          ?        ?     8.3008  17.2401          ?        ?       38.2       15.2       ?       ? 
1 1 1   45    3   49 o    138.4    6.5    0.0000   0.0000          ?        ?   192.1950  17.8786          ?        ?      138.4        6.5       ?       ? 
1 1 1   45    3   50 o     41.8   15.7    0.0000   0.0000          ?        ?    13.4090  17.8786          ?        ?       41.8       15.7       ?       ? 
1 1 1   45    3   51 o    165.0    5.6    0.0000   0.0000          ?        ?   273.2873  18.5171          ?        ?      165.0        5.6       ?       ? 
1 1 1   45    3   52 o    119.4    8.0    0.0000   0.0000          ?        ?   143.6674  19.1556          ?        ?      119.4        8.0       ?       ? 
1 1 1   45    3   53 o    226.3    4.4    0.0000   0.0000          ?        ?   513.3714  19.7942          ?        ?      226.3        4.4       ?       ? 
1 1 1   45    3   54 o    163.7    6.0    0.0000   0.0000          ?        ?   269.4561  19.7942          ?        ?      163.7        6.0       ?       ? 
1 1 1   45    3   55 o    254.5    3.9    0.0000   0.0000          ?        ?   649.3765  19.7942          ?        ?      254.5        3.9       ?       ? 
1 1 1   45    3   56 o    214.8    4.6    0.0000   0.0000          ?        ?   462.9282  19.7942          ?        ?      214.8        4.6       ?       ? 
1 1 1   45    3   57 o    186.3    5.1    0.0000   0.0000          ?        ?   348.6328  19.1556          ?        ?      186.3        5.1       ?       ? 
1 1 1   45    3   58 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    3   59 o     22.6   11.2    0.0000   0.0000          ?        ?   -40.2269  18.5171          ?        ?       22.6       11.2       ?       ? 
1 1 1   45    4    0 f   1531.4    8.2 23473.3320 251.5775 23473.3320 251.5775 23473.3320 251.5775     1531.4      8.2     1531.4        8.2     0.0     0.0 
1 1 1   45    4    1 o    437.4    3.4    0.0000   0.0000          ?        ?  1913.6494  29.3720          ?        ?      437.4        3.4       ?       ? 
1 1 1   45    4    2 o    453.1    2.5    0.0000   0.0000          ?        ?  2053.4856  22.9868          ?        ?      453.1        2.5       ?       ? 
1 1 1   45    4    3 o    475.8    2.7    0.0000   0.0000          ?        ?  2264.1978  25.5409          ?        ?      475.8        2.7       ?       ? 
1 1 1   45    4    4 o    629.9    2.9    0.0000   0.0000          ?        ?  3969.0503  36.3957          ?        ?      629.9        2.9       ?       ? 
1 1 1   45    4    5 o    334.0    2.5    0.0000   0.0000          ?        ?  1115.4973  16.6016          ?        ?      334.0        2.5       ?       ? 
1 1 1   45    4    6 o    399.3    2.4    0.0000   0.0000          ?        ?  1595.0271  19.1556          ?        ?      399.3        2.4       ?       ? 
1 1 1   45    4    7 o    198.1    3.1    0.0000   0.0000          ?        ?   392.6908  12.1319          ?        ?      198.1        3.1       ?       ? 
1 1 1   45    4    8 o    540.0    2.6    0.0000   0.0000          ?        ?  2916.7666  28.0950          ?        ?      540.0        2.6       ?       ? 
1 1 1   45    4    9 o    335.0    2.6    0.0000   0.0000          ?        ?  1122.5210  17.2401          ?        ?      335.0        2.6       ?       ? 
1 1 1   45    4   10 o    595.1    2.7    0.0000   0.0000          ?        ?  3541.8796  32.5646          ?        ?      595.1        2.7       ?       ? 
1 1 1   45    4   11 o    257.2    2.9    0.0000   0.0000          ?        ?   661.5084  14.6860          ?        ?      257.2        2.9       ?       ? 
1 1 1   45    4   12 o    213.5    3.0    0.0000   0.0000          ?        ?   455.9044  12.7704          ?        ?      213.5        3.0       ?       ? 
1 1 1   45    4   13 o    121.9    5.0    0.0000   0.0000          ?        ?   148.7755  12.1319          ?        ?      121.9        5.0       ?       ? 
1 1 1   45    4   14 o    383.5    2.4    0.0000   0.0000          ?        ?  1471.1538  18.5171          ?        ?      383.5        2.4       ?       ? 
1 1 1   45    4   15 o    207.1    3.4    0.0000   0.0000          ?        ?   429.0865  14.0475          ?        ?      207.1        3.4       ?       ? 
1 1 1   45    4   16 o    120.6    5.3    0.0000   0.0000          ?        ?   145.5829  12.7704          ?        ?      120.6        5.3       ?       ? 
1 1 1   45    4   17 o    421.5    2.6    0.0000   0.0000          ?        ?  1777.0056  21.7097          ?        ?      421.5        2.6       ?       ? 
1 1 1   45    4   18 o    255.0    2.8    0.0000   0.0000          ?        ?   650.6536  14.0475          ?        ?      255.0        2.8       ?       ? 
1 1 1   45    4   19 o    440.3    2.5    0.0000   0.0000          ?        ?  1939.1903  22.3483          ?        ?      440.3        2.5       ?       ? 
1 1 1   45    4   20 o     87.1    7.7    0.0000   0.0000          ?        ?    75.9841  13.4090          ?        ?       87.1        7.7       ?       ? 
1 1 1   45    4   21 o    519.5    2.5    0.0000   0.0000          ?        ?  2699.6694  26.1794          ?        ?      519.5        2.5       ?       ? 
1 1 1   45    4   22 o    273.4    2.8    0.0000   0.0000          ?        ?   747.7088  15.3245          ?        ?      273.4        2.8       ?       ? 
1 1 1   45    4   23 o    368.1    2.6    0.0000   0.0000          ?        ?  1354.9429  19.1556          ?        ?      368.1        2.6       ?       ? 
1 1 1   45    4   24 o    229.6    3.2    0.0000   0.0000          ?        ?   527.4188  14.6860          ?        ?      229.6        3.2       ?       ? 
1 1 1   45    4   25 o    544.7    2.5    0.0000   0.0000          ?        ?  2967.2100  26.8179          ?        ?      544.7        2.5       ?       ? 
1 1 1   45    4   26 o    462.5    2.4    0.0000   0.0000          ?        ?  2139.6860  22.3483          ?        ?      462.5        2.4       ?       ? 
1 1 1   45    4   27 o    357.2    2.4    0.0000   0.0000          ?        ?  1276.4047  17.2401          ?        ?      357.2        2.4       ?       ? 
1 1 1   45    4   28 o    343.3    2.6    0.0000   0.0000          ?        ?  1178.7109  17.8786          ?        ?      343.3        2.6       ?       ? 
1 1 1   45    4   29 o    172.8    4.2    0.0000   0.0000          ?        ?   298.8281  14.6860          ?        ?      172.8        4.2       ?       ? 
1 1 1   45    4   30 o    236.9    3.1    0.0000   0.0000          ?        ?   561.2605  14.6860          ?        ?      236.9        3.1       ?       ? 
1 1 1   45    4   31 o    116.8    6.6    0.0000   0.0000          ?        ?   136.6436  15.3245          ?        ?      116.8        6.6       ?       ? 
1 1 1   45    4   32 o    223.0    3.6    0.0000   0.0000          ?        ?   497.4084  15.9630          ?        ?      223.0        3.6       ?       ? 
1 1 1   45    4   33 o    312.8    2.9    0.0000   0.0000          ?        ?   978.8537  17.8786          ?        ?      312.8        2.9       ?       ? 
1 1 1   45    4   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    4   35 o    162.9    4.7    0.0000   0.0000          ?        ?   265.6250  15.3245          ?        ?      162.9        4.7       ?       ? 
1 1 1   45    4   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    4   37 o    301.1    3.0    0.0000   0.0000          ?        ?   907.3393  17.8786          ?        ?      301.1        3.0       ?       ? 
1 1 1   45    4   38 o    388.6    2.7    0.0000   0.0000          ?        ?  1510.7422  21.0712          ?        ?      388.6        2.7       ?       ? 
1 1 1   45    4   39 o     93.0    8.9    0.0000   0.0000          ?        ?    86.8389  16.6016          ?        ?       93.0        8.9       ?       ? 
1 1 1   45    4   40 o    210.1    4.0    0.0000   0.0000          ?        ?   441.8569  16.6016          ?        ?      210.1        4.0       ?       ? 
1 1 1   45    4   41 o    261.5    3.5    0.0000   0.0000          ?        ?   684.4952  18.5171          ?        ?      261.5        3.5       ?       ? 
1 1 1   45    4   42 o    482.3    2.7    0.0000   0.0000          ?        ?  2327.4114  26.1794          ?        ?      482.3        2.7       ?       ? 
1 1 1   45    4   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    4   44 o    340.1    2.9    0.0000   0.0000          ?        ?  1157.6398  19.7942          ?        ?      340.1        2.9       ?       ? 
1 1 1   45    4   45 o    119.8    8.0    0.0000   0.0000          ?        ?   144.3059  19.1556          ?        ?      119.8        8.0       ?       ? 
1 1 1   45    4   46 o    262.0    3.7    0.0000   0.0000          ?        ?   687.0493  19.1556          ?        ?      262.0        3.7       ?       ? 
1 1 1   45    4   47 o    335.5    3.0    0.0000   0.0000          ?        ?  1126.3521  20.4327          ?        ?      335.5        3.0       ?       ? 
1 1 1   45    4   48 o    314.3    3.3    0.0000   0.0000          ?        ?   989.0699  20.4327          ?        ?      314.3        3.3       ?       ? 
1 1 1   45    4   49 o     26.2   12.5    0.0000   0.0000          ?        ?   -22.3483  17.8786          ?        ?       26.2       12.5       ?       ? 
1 1 1   45    4   50 o    169.0    5.5    0.0000   0.0000          ?        ?   286.6962  18.5171          ?        ?      169.0        5.5       ?       ? 
1 1 1   45    4   51 o    182.6    5.2    0.0000   0.0000          ?        ?   334.5853  19.1556          ?        ?      182.6        5.2       ?       ? 
1 1 1   45    4   52 o     59.4   15.4    0.0000   0.0000          ?        ?    37.6728  18.5171          ?        ?       59.4       15.4       ?       ? 
1 1 1   45    4   53 o    214.1    4.3    0.0000   0.0000          ?        ?   459.7356  18.5171          ?        ?      214.1        4.3       ?       ? 
1 1 1   45    4   54 o     41.6   15.7    0.0000   0.0000          ?        ?    13.4090  17.8786          ?        ?       41.6       15.7       ?       ? 
1 1 1   45    4   55 o    108.6    8.8    0.0000   0.0000          ?        ?   119.4035  19.1556          ?        ?      108.6        8.8       ?       ? 
1 1 1   45    4   56 o    215.4    4.6    0.0000   0.0000          ?        ?   465.4823  19.7942          ?        ?      215.4        4.6       ?       ? 
1 1 1   45    4   57 o    115.9    8.3    0.0000   0.0000          ?        ?   136.0051  19.1556          ?        ?      115.9        8.3       ?       ? 
1 1 1   45    4   58 o    298.9    3.4    0.0000   0.0000          ?        ?   895.8459  20.4327          ?        ?      298.9        3.4       ?       ? 
1 1 1   45    5    0 o    225.0    7.0  508.2632  31.2876   508.2632  31.2876   508.2632  31.2876      225.0      7.0      225.0        7.0     0.0     0.0 
1 1 1   45    5    1 o    844.4    3.4    0.0000   0.0000          ?        ?  7132.9248  58.1055          ?        ?      844.4        3.4       ?       ? 
1 1 1   45    5    2 o    337.1    2.6    0.0000   0.0000          ?        ?  1136.5685  17.2401          ?        ?      337.1        2.6       ?       ? 
1 1 1   45    5    3 o    506.8    2.6    0.0000   0.0000          ?        ?  2568.7725  26.1794          ?        ?      506.8        2.6       ?       ? 
1 1 1   45    5    4 o    292.6    2.5    0.0000   0.0000          ?        ?   856.2576  14.6860          ?        ?      292.6        2.5       ?       ? 
1 1 1   45    5    5 o    177.9    3.2    0.0000   0.0000          ?        ?   316.7067  11.4934          ?        ?      177.9        3.2       ?       ? 
1 1 1   45    5    6 o    324.6    2.6    0.0000   0.0000          ?        ?  1053.5607  16.6016          ?        ?      324.6        2.6       ?       ? 
1 1 1   45    5    7 f    157.8    3.8    0.0000   0.0000          ?        ?   249.0234  12.1319          ?        ?      157.8        3.8       ?       ? 
1 1 1   45    5    8 o    444.9    2.6    0.0000   0.0000          ?        ?  1980.0555  22.9868          ?        ?      444.9        2.6       ?       ? 
1 1 1   45    5    9 o    387.2    2.5    0.0000   0.0000          ?        ?  1499.2488  19.1556          ?        ?      387.2        2.5       ?       ? 
1 1 1   45    5   10 o    222.9    3.2    0.0000   0.0000          ?        ?   496.7698  14.0475          ?        ?      222.9        3.2       ?       ? 
1 1 1   45    5   11 f    732.6    3.2    0.0000   0.0000          ?        ?  5368.6899  46.6121          ?        ?      732.6        3.2       ?       ? 
1 1 1   45    5   12 o     65.8    9.2    0.0000   0.0000          ?        ?    43.4195  12.1319          ?        ?       65.8        9.2       ?       ? 
1 1 1   45    5   13 o    174.3    3.8    0.0000   0.0000          ?        ?   303.9363  13.4090          ?        ?      174.3        3.8       ?       ? 
1 1 1   45    5   14 o    232.5    2.9    0.0000   0.0000          ?        ?   540.8278  13.4090          ?        ?      232.5        2.9       ?       ? 
1 1 1   45    5   15 o    178.6    3.9    0.0000   0.0000          ?        ?   319.2608  14.0475          ?        ?      178.6        3.9       ?       ? 
1 1 1   45    5   16 o   1027.9    4.4    0.0000   0.0000          ?        ? 10572.0020  91.3086          ?        ?     1027.9        4.4       ?       ? 
1 1 1   45    5   17 o    170.6    4.5    0.0000   0.0000          ?        ?   291.1659  15.3245          ?        ?      170.6        4.5       ?       ? 
1 1 1   45    5   18 o    731.6    3.1    0.0000   0.0000          ?        ?  5354.0039  45.9736          ?        ?      731.6        3.1       ?       ? 
1 1 1   45    5   19 o     37.7   13.1    0.0000   0.0000          ?        ?    12.7704  12.1319          ?        ?       37.7       13.1       ?       ? 
1 1 1   45    5   20 o    365.4    2.4    0.0000   0.0000          ?        ?  1335.7872  17.8786          ?        ?      365.4        2.4       ?       ? 
1 1 1   45    5   21 o    400.1    2.5    0.0000   0.0000          ?        ?  1601.4122  19.7942          ?        ?      400.1        2.5       ?       ? 
1 1 1   45    5   22 o    189.6    3.5    0.0000   0.0000          ?        ?   359.4877  13.4090          ?        ?      189.6        3.5       ?       ? 
1 1 1   45    5   23 f    112.4    6.0    0.0000   0.0000          ?        ?   126.4273  13.4090          ?        ?      112.4        6.0       ?       ? 
1 1 1   45    5   24 o    199.2    3.7    0.0000   0.0000          ?        ?   397.1605  14.6860          ?        ?      199.2        3.7       ?       ? 
1 1 1   45    5   25 o    366.0    2.6    0.0000   0.0000          ?        ?  1339.6184  19.1556          ?        ?      366.0        2.6       ?       ? 
1 1 1   45    5   26 o    118.7    6.2    0.0000   0.0000          ?        ?   141.1133  14.6860          ?        ?      118.7        6.2       ?       ? 
1 1 1   45    5   27 o    521.1    2.5    0.0000   0.0000          ?        ?  2716.2710  26.1794          ?        ?      521.1        2.5       ?       ? 
1 1 1   45    5   28 o     90.3    7.8    0.0000   0.0000          ?        ?    81.7308  14.0475          ?        ?       90.3        7.8       ?       ? 
1 1 1   45    5   29 o    292.7    2.9    0.0000   0.0000          ?        ?   856.8960  17.2401          ?        ?      292.7        2.9       ?       ? 
1 1 1   45    5   30 o    230.1    3.3    0.0000   0.0000          ?        ?   529.9730  15.3245          ?        ?      230.1        3.3       ?       ? 
1 1 1   45    5   31 o    442.2    2.5    0.0000   0.0000          ?        ?  1955.7916  21.7097          ?        ?      442.2        2.5       ?       ? 
1 1 1   45    5   32 o    430.5    2.6    0.0000   0.0000          ?        ?  1854.2667  22.3483          ?        ?      430.5        2.6       ?       ? 
1 1 1   45    5   33 o    204.4    3.7    0.0000   0.0000          ?        ?   418.2317  15.3245          ?        ?      204.4        3.7       ?       ? 
1 1 1   45    5   34 o    128.2    6.2    0.0000   0.0000          ?        ?   164.7386  15.9630          ?        ?      128.2        6.2       ?       ? 
1 1 1   45    5   35 o    341.7    2.7    0.0000   0.0000          ?        ?  1167.8560  18.5171          ?        ?      341.7        2.7       ?       ? 
1 1 1   45    5   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    5   37 o    314.8    2.8    0.0000   0.0000          ?        ?   991.6241  17.8786          ?        ?      314.8        2.8       ?       ? 
1 1 1   45    5   38 o    304.1    3.0    0.0000   0.0000          ?        ?   925.2178  18.5171          ?        ?      304.1        3.0       ?       ? 
1 1 1   45    5   39 o    153.4    5.4    0.0000   0.0000          ?        ?   235.6145  16.6016          ?        ?      153.4        5.4       ?       ? 
1 1 1   45    5   40 o    117.0    6.8    0.0000   0.0000          ?        ?   137.2822  15.9630          ?        ?      117.0        6.8       ?       ? 
1 1 1   45    5   41 f    130.9    6.3    0.0000   0.0000          ?        ?   171.7623  16.6016          ?        ?      130.9        6.3       ?       ? 
1 1 1   45    5   42 o    182.1    4.9    0.0000   0.0000          ?        ?   332.0312  17.8786          ?        ?      182.1        4.9       ?       ? 
1 1 1   45    5   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    5   44 o    218.7    3.9    0.0000   0.0000          ?        ?   478.8912  17.2401          ?        ?      218.7        3.9       ?       ? 
1 1 1   45    5   45 o    131.8    6.8    0.0000   0.0000          ?        ?   174.3164  17.8786          ?        ?      131.8        6.8       ?       ? 
1 1 1   45    5   46 o    103.5    8.9    0.0000   0.0000          ?        ?   107.9102  18.5171          ?        ?      103.5        8.9       ?       ? 
1 1 1   45    5   47 o     49.5   15.6    0.0000   0.0000          ?        ?    24.9023  17.2401          ?        ?       49.5       15.6       ?       ? 
1 1 1   45    5   48 o     20.1   10.0    0.0000   0.0000          ?        ?   -44.6965  16.6016          ?        ?       20.1       10.0       ?       ? 
1 1 1   45    5   49 o    107.1    8.0    0.0000   0.0000          ?        ?   115.5724  17.2401          ?        ?      107.1        8.0       ?       ? 
1 1 1   45    5   50 o    247.6    3.9    0.0000   0.0000          ?        ?   614.2578  19.1556          ?        ?      247.6        3.9       ?       ? 
1 1 1   45    5   51 o    150.0    6.0    0.0000   0.0000          ?        ?   226.0367  17.8786          ?        ?      150.0        6.0       ?       ? 
1 1 1   45    5   52 o     52.4   15.8    0.0000   0.0000          ?        ?    28.7335  17.8786          ?        ?       52.4       15.8       ?       ? 
1 1 1   45    5   53 o    143.4    6.2    0.0000   0.0000          ?        ?   206.8810  17.8786          ?        ?      143.4        6.2       ?       ? 
1 1 1   45    5   54 o    250.2    3.8    0.0000   0.0000          ?        ?   627.6667  19.1556          ?        ?      250.2        3.8       ?       ? 
1 1 1   45    5   55 o    166.6    5.6    0.0000   0.0000          ?        ?   279.0340  18.5171          ?        ?      166.6        5.6       ?       ? 
1 1 1   45    5   56 o    283.4    3.5    0.0000   0.0000          ?        ?   805.1758  19.7942          ?        ?      283.4        3.5       ?       ? 
1 1 1   45    5   57 f    108.2    8.6    0.0000   0.0000          ?        ?   118.7650  18.5171          ?        ?      108.2        8.6       ?       ? 
1 1 1   45    6    0 o    889.6    5.1 7918.3066  90.0316  7918.3066  90.0316  7918.3066  90.0316      889.6      5.1      889.6        5.1     0.0     0.0 
1 1 1   45    6    1 o    334.9    2.5    0.0000   0.0000          ?        ?  1121.8824  16.6016          ?        ?      334.9        2.5       ?       ? 
1 1 1   45    6    2 o    268.2    2.7    0.0000   0.0000          ?        ?   719.6138  14.6860          ?        ?      268.2        2.7       ?       ? 
1 1 1   45    6    3 f    862.4    3.6    0.0000   0.0000          ?        ?  7440.6929  62.5751          ?        ?      862.4        3.6       ?       ? 
1 1 1   45    6    4 o    235.0    3.1    0.0000   0.0000          ?        ?   552.3212  14.6860          ?        ?      235.0        3.1       ?       ? 
1 1 1   45    6    5 o    682.4    3.0    0.0000   0.0000          ?        ?  4658.0151  41.5039          ?        ?      682.4        3.0       ?       ? 
1 1 1   45    6    6 o    221.0    2.9    0.0000   0.0000          ?        ?   488.4691  12.7704          ?        ?      221.0        2.9       ?       ? 
1 1 1   45    6    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    6    8 o     94.8    6.1    0.0000   0.0000          ?        ?    90.0316  11.4934          ?        ?       94.8        6.1       ?       ? 
1 1 1   45    6    9 o     15.8    7.9    0.0000   0.0000          ?        ?   -36.3957  11.4934          ?        ?       15.8        7.9       ?       ? 
1 1 1   45    6   10 o    372.1    2.6    0.0000   0.0000          ?        ?  1384.9534  19.1556          ?        ?      372.1        2.6       ?       ? 
1 1 1   45    6   11 o    296.7    2.9    0.0000   0.0000          ?        ?   880.5213  17.2401          ?        ?      296.7        2.9       ?       ? 
1 1 1   45    6   12 o    604.3    2.8    0.0000   0.0000          ?        ?  3652.3438  33.8416          ?        ?      604.3        2.8       ?       ? 
1 1 1   45    6   13 o    174.5    3.8    0.0000   0.0000          ?        ?   304.5748  13.4090          ?        ?      174.5        3.8       ?       ? 
1 1 1   45    6   14 o    691.5    3.1    0.0000   0.0000          ?        ?  4783.1655  43.4195          ?        ?      691.5        3.1       ?       ? 
1 1 1   45    6   15 o    162.5    3.9    0.0000   0.0000          ?        ?   264.3480  12.7704          ?        ?      162.5        3.9       ?       ? 
1 1 1   45    6   16 o    401.7    2.5    0.0000   0.0000          ?        ?  1614.1827  19.7942          ?        ?      401.7        2.5       ?       ? 
1 1 1   45    6   17 o    170.2    3.9    0.0000   0.0000          ?        ?   289.8888  13.4090          ?        ?      170.2        3.9       ?       ? 
1 1 1   45    6   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    6   19 f     72.7    8.8    0.0000   0.0000          ?        ?    52.9973  12.7704          ?        ?       72.7        8.8       ?       ? 
1 1 1   45    6   20 o    235.0    3.0    0.0000   0.0000          ?        ?   552.3212  14.0475          ?        ?      235.0        3.0       ?       ? 
1 1 1   45    6   21 o    278.0    2.8    0.0000   0.0000          ?        ?   773.2497  15.3245          ?        ?      278.0        2.8       ?       ? 
1 1 1   45    6   22 o    382.3    2.5    0.0000   0.0000          ?        ?  1461.5759  19.1556          ?        ?      382.3        2.5       ?       ? 
1 1 1   45    6   23 o     70.9    9.0    0.0000   0.0000          ?        ?    50.4432  12.7704          ?        ?       70.9        9.0       ?       ? 
1 1 1   45    6   24 o    381.2    2.5    0.0000   0.0000          ?        ?  1453.2753  19.1556          ?        ?      381.2        2.5       ?       ? 
1 1 1   45    6   25 o    237.1    3.2    0.0000   0.0000          ?        ?   562.5375  15.3245          ?        ?      237.1        3.2       ?       ? 
1 1 1   45    6   26 o    604.2    2.6    0.0000   0.0000          ?        ?  3651.7053  31.9261          ?        ?      604.2        2.6       ?       ? 
1 1 1   45    6   27 o    205.2    3.6    0.0000   0.0000          ?        ?   421.4243  14.6860          ?        ?      205.2        3.6       ?       ? 
1 1 1   45    6   28 o    385.2    2.4    0.0000   0.0000          ?        ?  1484.5627  18.5171          ?        ?      385.2        2.4       ?       ? 
1 1 1   45    6   29 o    131.7    5.3    0.0000   0.0000          ?        ?   173.6779  14.0475          ?        ?      131.7        5.3       ?       ? 
1 1 1   45    6   30 o     76.0    9.7    0.0000   0.0000          ?        ?    58.1055  14.6860          ?        ?       76.0        9.7       ?       ? 
1 1 1   45    6   31 o    130.2    5.6    0.0000   0.0000          ?        ?   169.8468  14.6860          ?        ?      130.2        5.6       ?       ? 
1 1 1   45    6   32 o    257.4    3.3    0.0000   0.0000          ?        ?   662.7855  17.2401          ?        ?      257.4        3.3       ?       ? 
1 1 1   45    6   33 o     98.0    7.2    0.0000   0.0000          ?        ?    96.4168  14.0475          ?        ?       98.0        7.2       ?       ? 
1 1 1   45    6   34 o    165.0    4.6    0.0000   0.0000          ?        ?   272.6487  15.3245          ?        ?      165.0        4.6       ?       ? 
1 1 1   45    6   35 o    294.6    2.9    0.0000   0.0000          ?        ?   868.3894  17.2401          ?        ?      294.6        2.9       ?       ? 
1 1 1   45    6   36 o     22.0   10.7    0.0000   0.0000          ?        ?   -28.0950  15.3245          ?        ?       22.0       10.7       ?       ? 
1 1 1   45    6   37 o    210.0    4.0    0.0000   0.0000          ?        ?   441.2184  16.6016          ?        ?      210.0        4.0       ?       ? 
1 1 1   45    6   38 o    336.2    2.8    0.0000   0.0000          ?        ?  1130.8219  18.5171          ?        ?      336.2        2.8       ?       ? 
1 1 1   45    6   39 o    281.7    3.1    0.0000   0.0000          ?        ?   794.3209  17.2401          ?        ?      281.7        3.1       ?       ? 
1 1 1   45    6   40 o    244.4    3.5    0.0000   0.0000          ?        ?   597.6562  17.2401          ?        ?      244.4        3.5       ?       ? 
1 1 1   45    6   41 o    269.7    3.2    0.0000   0.0000          ?        ?   727.9147  17.2401          ?        ?      269.7        3.2       ?       ? 
1 1 1   45    6   42 o     82.3   10.5    0.0000   0.0000          ?        ?    68.3218  17.2401          ?        ?       82.3       10.5       ?       ? 
1 1 1   45    6   43 o    258.5    3.6    0.0000   0.0000          ?        ?   669.1707  18.5171          ?        ?      258.5        3.6       ?       ? 
1 1 1   45    6   44 o     57.6   14.4    0.0000   0.0000          ?        ?    35.1187  16.6016          ?        ?       57.6       14.4       ?       ? 
1 1 1   45    6   45 o     83.8   10.3    0.0000   0.0000          ?        ?    70.8759  17.2401          ?        ?       83.8       10.3       ?       ? 
1 1 1   45    6   46 o    128.3    7.0    0.0000   0.0000          ?        ?   165.3771  17.8786          ?        ?      128.3        7.0       ?       ? 
1 1 1   45    6   47 o     19.6    9.9    0.0000   0.0000          ?        ?   -56.1899  17.8786          ?        ?       19.6        9.9       ?       ? 
1 1 1   45    6   48 o     94.1    9.5    0.0000   0.0000          ?        ?    89.3930  17.8786          ?        ?       94.1        9.5       ?       ? 
1 1 1   45    6   49 o    305.2    3.3    0.0000   0.0000          ?        ?   932.8801  20.4327          ?        ?      305.2        3.3       ?       ? 
1 1 1   45    6   50 o     42.9   15.8    0.0000   0.0000          ?        ?    15.3245  17.8786          ?        ?       42.9       15.8       ?       ? 
1 1 1   45    6   51 o    209.5    4.4    0.0000   0.0000          ?        ?   439.9414  18.5171          ?        ?      209.5        4.4       ?       ? 
1 1 1   45    6   52 o    116.4    8.0    0.0000   0.0000          ?        ?   136.6436  18.5171          ?        ?      116.4        8.0       ?       ? 
1 1 1   45    6   53 o     72.9   13.2    0.0000   0.0000          ?        ?    56.1899  18.5171          ?        ?       72.9       13.2       ?       ? 
1 1 1   45    6   54 o    249.3    3.8    0.0000   0.0000          ?        ?   623.1971  19.1556          ?        ?      249.3        3.8       ?       ? 
1 1 1   45    6   55 o    125.2    7.4    0.0000   0.0000          ?        ?   158.3534  18.5171          ?        ?      125.2        7.4       ?       ? 
1 1 1   45    6   56 o     22.6   11.1    0.0000   0.0000          ?        ?   -37.0343  17.8786          ?        ?       22.6       11.1       ?       ? 
1 1 1   45    7    0 o    320.7    3.5 1029.2969  22.3483  1029.2969  22.3483  1029.2969  22.3483      320.7      3.5      320.7        3.5     0.0     0.0 
1 1 1   45    7    1 o    549.9    2.6    0.0000   0.0000          ?        ?  3024.0386  28.7335          ?        ?      549.9        2.6       ?       ? 
1 1 1   45    7    2 o    718.4    3.2    0.0000   0.0000          ?        ?  5162.4473  45.3350          ?        ?      718.4        3.2       ?       ? 
1 1 1   45    7    3 o    530.9    2.8    0.0000   0.0000          ?        ?  2819.7114  29.3720          ?        ?      530.9        2.8       ?       ? 
1 1 1   45    7    4 o    354.6    2.8    0.0000   0.0000          ?        ?  1257.8876  19.7942          ?        ?      354.6        2.8       ?       ? 
1 1 1   45    7    5 o    467.7    2.7    0.0000   0.0000          ?        ?  2188.2136  25.5409          ?        ?      467.7        2.7       ?       ? 
1 1 1   45    7    6 o    610.6    2.8    0.0000   0.0000          ?        ?  3728.9663  33.8416          ?        ?      610.6        2.8       ?       ? 
1 1 1   45    7    7 o    674.7    3.1    0.0000   0.0000          ?        ?  4553.9365  42.1424          ?        ?      674.7        3.1       ?       ? 
1 1 1   45    7    8 o    362.7    2.6    0.0000   0.0000          ?        ?  1315.9932  19.1556          ?        ?      362.7        2.6       ?       ? 
1 1 1   45    7    9 o    266.0    2.6    0.0000   0.0000          ?        ?   707.4820  14.0475          ?        ?      266.0        2.6       ?       ? 
1 1 1   45    7   10 o    130.0    4.4    0.0000   0.0000          ?        ?   169.2082  11.4934          ?        ?      130.0        4.4       ?       ? 
1 1 1   45    7   11 f    475.5    2.6    0.0000   0.0000          ?        ?  2261.0051  24.2638          ?        ?      475.5        2.6       ?       ? 
1 1 1   45    7   12 o    185.3    3.4    0.0000   0.0000          ?        ?   343.5246  12.7704          ?        ?      185.3        3.4       ?       ? 
1 1 1   45    7   13 o    472.5    2.8    0.0000   0.0000          ?        ?  2233.5486  26.1794          ?        ?      472.5        2.8       ?       ? 
1 1 1   45    7   14 o    719.8    3.1    0.0000   0.0000          ?        ?  5182.8799  45.3350          ?        ?      719.8        3.1       ?       ? 
1 1 1   45    7   15 o    230.6    3.0    0.0000   0.0000          ?        ?   531.8885  14.0475          ?        ?      230.6        3.0       ?       ? 
1 1 1   45    7   16 o    493.2    2.8    0.0000   0.0000          ?        ?  2433.4060  28.0950          ?        ?      493.2        2.8       ?       ? 
1 1 1   45    7   17 o    309.3    2.7    0.0000   0.0000          ?        ?   957.1439  16.6016          ?        ?      309.3        2.7       ?       ? 
1 1 1   45    7   18 o    267.6    2.9    0.0000   0.0000          ?        ?   716.4213  15.3245          ?        ?      267.6        2.9       ?       ? 
1 1 1   45    7   19 o    501.6    2.4    0.0000   0.0000          ?        ?  2516.4138  24.2638          ?        ?      501.6        2.4       ?       ? 
1 1 1   45    7   20 o     79.0    7.3    0.0000   0.0000          ?        ?    62.5751  11.4934          ?        ?       79.0        7.3       ?       ? 
1 1 1   45    7   21 o    177.0    3.8    0.0000   0.0000          ?        ?   313.5141  13.4090          ?        ?      177.0        3.8       ?       ? 
1 1 1   45    7   22 o    352.0    2.4    0.0000   0.0000          ?        ?  1239.3705  17.2401          ?        ?      352.0        2.4       ?       ? 
1 1 1   45    7   23 o    597.4    2.8    0.0000   0.0000          ?        ?  3569.9744  33.8416          ?        ?      597.4        2.8       ?       ? 
1 1 1   45    7   24 o    124.2    5.1    0.0000   0.0000          ?        ?   154.5222  12.7704          ?        ?      124.2        5.1       ?       ? 
1 1 1   45    7   25 o    226.8    3.4    0.0000   0.0000          ?        ?   514.6484  15.3245          ?        ?      226.8        3.4       ?       ? 
1 1 1   45    7   26 o    383.7    2.6    0.0000   0.0000          ?        ?  1472.4309  19.7942          ?        ?      383.7        2.6       ?       ? 
1 1 1   45    7   27 o    160.9    4.6    0.0000   0.0000          ?        ?   259.2398  14.6860          ?        ?      160.9        4.6       ?       ? 
1 1 1   45    7   28 o    112.6    6.0    0.0000   0.0000          ?        ?   127.0658  13.4090          ?        ?      112.6        6.0       ?       ? 
1 1 1   45    7   29 o    147.7    5.0    0.0000   0.0000          ?        ?   218.3744  14.6860          ?        ?      147.7        5.0       ?       ? 
1 1 1   45    7   30 o    236.4    3.2    0.0000   0.0000          ?        ?   559.3449  15.3245          ?        ?      236.4        3.2       ?       ? 
1 1 1   45    7   31 o    399.8    2.7    0.0000   0.0000          ?        ?  1598.8582  21.7097          ?        ?      399.8        2.7       ?       ? 
1 1 1   45    7   32 o    276.4    3.2    0.0000   0.0000          ?        ?   764.3104  17.8786          ?        ?      276.4        3.2       ?       ? 
1 1 1   45    7   33 o    177.5    4.5    0.0000   0.0000          ?        ?   315.4297  15.9630          ?        ?      177.5        4.5       ?       ? 
1 1 1   45    7   34 o    410.6    2.6    0.0000   0.0000          ?        ?  1686.9742  21.0712          ?        ?      410.6        2.6       ?       ? 
1 1 1   45    7   35 o    247.5    3.5    0.0000   0.0000          ?        ?   612.9808  17.2401          ?        ?      247.5        3.5       ?       ? 
1 1 1   45    7   36 o    400.2    2.7    0.0000   0.0000          ?        ?  1602.6893  21.7097          ?        ?      400.2        2.7       ?       ? 
1 1 1   45    7   37 o     19.2    9.6    0.0000   0.0000          ?        ?   -45.9736  15.9630          ?        ?       19.2        9.6       ?       ? 
1 1 1   45    7   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    7   39 o    478.4    2.6    0.0000   0.0000          ?        ?  2289.7385  24.9023          ?        ?      478.4        2.6       ?       ? 
1 1 1   45    7   40 o    351.1    2.9    0.0000   0.0000          ?        ?  1233.6238  20.4327          ?        ?      351.1        2.9       ?       ? 
1 1 1   45    7   41 o    255.5    3.5    0.0000   0.0000          ?        ?   653.2076  17.8786          ?        ?      255.5        3.5       ?       ? 
1 1 1   45    7   42 o    225.3    3.7    0.0000   0.0000          ?        ?   508.2632  16.6016          ?        ?      225.3        3.7       ?       ? 
1 1 1   45    7   43 o    251.8    3.6    0.0000   0.0000          ?        ?   634.6905  17.8786          ?        ?      251.8        3.6       ?       ? 
1 1 1   45    7   44 o    129.0    7.2    0.0000   0.0000          ?        ?   167.2927  18.5171          ?        ?      129.0        7.2       ?       ? 
1 1 1   45    7   45 o    153.7    5.6    0.0000   0.0000          ?        ?   236.8915  17.2401          ?        ?      153.7        5.6       ?       ? 
1 1 1   45    7   46 o     40.9   15.4    0.0000   0.0000          ?        ?    12.7704  17.2401          ?        ?       40.9       15.4       ?       ? 
1 1 1   45    7   47 o     73.2   13.1    0.0000   0.0000          ?        ?    56.1899  18.5171          ?        ?       73.2       13.1       ?       ? 
1 1 1   45    7   48 o    374.0    3.1    0.0000   0.0000          ?        ?  1400.2780  22.9868          ?        ?      374.0        3.1       ?       ? 
1 1 1   45    7   49 o    252.7    3.7    0.0000   0.0000          ?        ?   639.7986  18.5171          ?        ?      252.7        3.7       ?       ? 
1 1 1   45    7   50 o    115.7    7.5    0.0000   0.0000          ?        ?   134.7281  17.2401          ?        ?      115.7        7.5       ?       ? 
1 1 1   45    7   51 o    128.4    6.7    0.0000   0.0000          ?        ?   166.0156  17.2401          ?        ?      128.4        6.7       ?       ? 
1 1 1   45    7   52 o    112.8    7.9    0.0000   0.0000          ?        ?   128.3428  17.8786          ?        ?      112.8        7.9       ?       ? 
1 1 1   45    7   53 o    141.6    6.3    0.0000   0.0000          ?        ?   201.7728  17.8786          ?        ?      141.6        6.3       ?       ? 
1 1 1   45    7   54 o    128.0    7.0    0.0000   0.0000          ?        ?   165.3771  17.8786          ?        ?      128.0        7.0       ?       ? 
1 1 1   45    7   55 o    163.2    5.9    0.0000   0.0000          ?        ?   268.1791  19.1556          ?        ?      163.2        5.9       ?       ? 
1 1 1   45    7   56 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    8    0 o    180.4    4.4  326.2845  15.9630   326.2845  15.9630   326.2845  15.9630      180.4      4.4      180.4        4.4     0.0     0.0 
1 1 1   45    8    1 f    282.7    2.5    0.0000   0.0000          ?        ?   799.4291  14.0475          ?        ?      282.7        2.5       ?       ? 
1 1 1   45    8    2 o    290.8    2.5    0.0000   0.0000          ?        ?   846.0411  14.6860          ?        ?      290.8        2.5       ?       ? 
1 1 1   45    8    3 o    263.8    2.5    0.0000   0.0000          ?        ?   695.9886  13.4090          ?        ?      263.8        2.5       ?       ? 
1 1 1   45    8    4 o    141.6    4.1    0.0000   0.0000          ?        ?   200.4958  11.4934          ?        ?      141.6        4.1       ?       ? 
1 1 1   45    8    5 o    125.0    4.6    0.0000   0.0000          ?        ?   156.4378  11.4934          ?        ?      125.0        4.6       ?       ? 
1 1 1   45    8    6 o    415.6    2.7    0.0000   0.0000          ?        ?  1727.8396  22.3483          ?        ?      415.6        2.7       ?       ? 
1 1 1   45    8    7 o    316.6    2.6    0.0000   0.0000          ?        ?  1002.4789  16.6016          ?        ?      316.6        2.6       ?       ? 
1 1 1   45    8    8 o    176.8    3.6    0.0000   0.0000          ?        ?   312.8756  12.7704          ?        ?      176.8        3.6       ?       ? 
1 1 1   45    8    9 o    424.7    2.6    0.0000   0.0000          ?        ?  1804.4622  21.7097          ?        ?      424.7        2.6       ?       ? 
1 1 1   45    8   10 o    458.0    2.6    0.0000   0.0000          ?        ?  2098.1821  23.6253          ?        ?      458.0        2.6       ?       ? 
1 1 1   45    8   11 f    358.4    2.6    0.0000   0.0000          ?        ?  1284.7054  18.5171          ?        ?      358.4        2.6       ?       ? 
1 1 1   45    8   12 o    339.3    2.5    0.0000   0.0000          ?        ?  1151.2545  17.2401          ?        ?      339.3        2.5       ?       ? 
1 1 1   45    8   13 o    297.6    2.7    0.0000   0.0000          ?        ?   885.6295  15.9630          ?        ?      297.6        2.7       ?       ? 
1 1 1   45    8   14 o    127.3    5.0    0.0000   0.0000          ?        ?   162.1845  12.7704          ?        ?      127.3        5.0       ?       ? 
1 1 1   45    8   15 o    319.9    2.6    0.0000   0.0000          ?        ?  1023.5502  16.6016          ?        ?      319.9        2.6       ?       ? 
1 1 1   45    8   16 o    394.3    2.6    0.0000   0.0000          ?        ?  1555.4387  20.4327          ?        ?      394.3        2.6       ?       ? 
1 1 1   45    8   17 o     19.4    9.5    0.0000   0.0000          ?        ?   -22.9868  12.1319          ?        ?       19.4        9.5       ?       ? 
1 1 1   45    8   18 o    450.7    2.7    0.0000   0.0000          ?        ?  2031.7759  24.2638          ?        ?      450.7        2.7       ?       ? 
1 1 1   45    8   19 o     97.8    6.9    0.0000   0.0000          ?        ?    95.7782  13.4090          ?        ?       97.8        6.9       ?       ? 
1 1 1   45    8   20 o    129.8    4.9    0.0000   0.0000          ?        ?   168.5697  12.7704          ?        ?      129.8        4.9       ?       ? 
1 1 1   45    8   21 o    224.4    3.3    0.0000   0.0000          ?        ?   503.7936  14.6860          ?        ?      224.4        3.3       ?       ? 
1 1 1   45    8   22 o     48.2   12.5    0.0000   0.0000          ?        ?    24.2638  12.1319          ?        ?       48.2       12.5       ?       ? 
1 1 1   45    8   23 o    361.2    2.6    0.0000   0.0000          ?        ?  1305.1382  18.5171          ?        ?      361.2        2.6       ?       ? 
1 1 1   45    8   24 o    537.2    2.6    0.0000   0.0000          ?        ?  2886.7563  28.0950          ?        ?      537.2        2.6       ?       ? 
1 1 1   45    8   25 o    258.6    3.0    0.0000   0.0000          ?        ?   669.1707  15.3245          ?        ?      258.6        3.0       ?       ? 
1 1 1   45    8   26 o    397.9    2.5    0.0000   0.0000          ?        ?  1583.5337  19.7942          ?        ?      397.9        2.5       ?       ? 
1 1 1   45    8   27 o    406.6    2.4    0.0000   0.0000          ?        ?  1653.7710  19.7942          ?        ?      406.6        2.4       ?       ? 
1 1 1   45    8   28 o    171.9    4.3    0.0000   0.0000          ?        ?   295.6355  14.6860          ?        ?      171.9        4.3       ?       ? 
1 1 1   45    8   29 o    215.2    3.6    0.0000   0.0000          ?        ?   463.5667  15.3245          ?        ?      215.2        3.6       ?       ? 
1 1 1   45    8   30 o    219.8    3.6    0.0000   0.0000          ?        ?   483.3608  15.9630          ?        ?      219.8        3.6       ?       ? 
1 1 1   45    8   31 o    590.9    2.7    0.0000   0.0000          ?        ?  3492.7134  31.9261          ?        ?      590.9        2.7       ?       ? 
1 1 1   45    8   32 o    126.2    5.6    0.0000   0.0000          ?        ?   159.6304  14.0475          ?        ?      126.2        5.6       ?       ? 
1 1 1   45    8   33 o    180.0    4.3    0.0000   0.0000          ?        ?   324.3690  15.3245          ?        ?      180.0        4.3       ?       ? 
1 1 1   45    8   34 o    574.7    2.7    0.0000   0.0000          ?        ?  3304.3494  30.6490          ?        ?      574.7        2.7       ?       ? 
1 1 1   45    8   35 o    390.7    2.7    0.0000   0.0000          ?        ?  1527.3438  21.0712          ?        ?      390.7        2.7       ?       ? 
1 1 1   45    8   36 o    250.2    3.3    0.0000   0.0000          ?        ?   626.3897  16.6016          ?        ?      250.2        3.3       ?       ? 
1 1 1   45    8   37 f    342.9    2.8    0.0000   0.0000          ?        ?  1176.1569  19.1556          ?        ?      342.9        2.8       ?       ? 
1 1 1   45    8   38 o    198.7    4.3    0.0000   0.0000          ?        ?   395.2449  17.2401          ?        ?      198.7        4.3       ?       ? 
1 1 1   45    8   39 o    127.9    6.0    0.0000   0.0000          ?        ?   164.1001  15.3245          ?        ?      127.9        6.0       ?       ? 
1 1 1   45    8   40 f    207.9    4.1    0.0000   0.0000          ?        ?   432.9177  17.2401          ?        ?      207.9        4.1       ?       ? 
1 1 1   45    8   41 o    350.7    2.9    0.0000   0.0000          ?        ?  1230.4312  20.4327          ?        ?      350.7        2.9       ?       ? 
1 1 1   45    8   42 o    144.3    5.8    0.0000   0.0000          ?        ?   208.7966  16.6016          ?        ?      144.3        5.8       ?       ? 
1 1 1   45    8   43 o    233.6    3.8    0.0000   0.0000          ?        ?   546.5745  17.8786          ?        ?      233.6        3.8       ?       ? 
1 1 1   45    8   44 o    124.5    7.2    0.0000   0.0000          ?        ?   155.7993  17.8786          ?        ?      124.5        7.2       ?       ? 
1 1 1   45    8   45 o    316.7    3.0    0.0000   0.0000          ?        ?  1003.7560  19.1556          ?        ?      316.7        3.0       ?       ? 
1 1 1   45    8   46 o     24.2   11.7    0.0000   0.0000          ?        ?   -27.4564  17.2401          ?        ?       24.2       11.7       ?       ? 
1 1 1   45    8   47 o    315.9    3.1    0.0000   0.0000          ?        ?   999.2863  19.7942          ?        ?      315.9        3.1       ?       ? 
1 1 1   45    8   48 f     30.5   13.8    0.0000   0.0000          ?        ?    -8.9393  17.8786          ?        ?       30.5       13.8       ?       ? 
1 1 1   45    8   49 o    194.3    4.9    0.0000   0.0000          ?        ?   378.6433  19.1556          ?        ?      194.3        4.9       ?       ? 
1 1 1   45    8   50 o    199.8    4.8    0.0000   0.0000          ?        ?   400.3531  19.1556          ?        ?      199.8        4.8       ?       ? 
1 1 1   45    8   51 o     28.4   13.2    0.0000   0.0000          ?        ?   -14.6860  17.8786          ?        ?       28.4       13.2       ?       ? 
1 1 1   45    8   52 o    160.0    5.6    0.0000   0.0000          ?        ?   257.3242  17.8786          ?        ?      160.0        5.6       ?       ? 
1 1 1   45    8   53 o    118.2    7.6    0.0000   0.0000          ?        ?   141.1133  17.8786          ?        ?      118.2        7.6       ?       ? 
1 1 1   45    8   54 o     19.8   10.0    0.0000   0.0000          ?        ?   -54.2743  17.8786          ?        ?       19.8       10.0       ?       ? 
1 1 1   45    8   55 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    9    0 o     23.5   15.0    1.9156  15.3245     1.9156  15.3245     1.9156  15.3245       23.5     15.0       23.5       15.0     0.0     0.0 
1 1 1   45    9    1 o    164.1    3.7    0.0000   0.0000          ?        ?   269.4561  12.1319          ?        ?      164.1        3.7       ?       ? 
1 1 1   45    9    2 o    177.2    3.4    0.0000   0.0000          ?        ?   314.1526  12.1319          ?        ?      177.2        3.4       ?       ? 
1 1 1   45    9    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45    9    4 o    106.3    5.1    0.0000   0.0000          ?        ?   113.0183  10.8549          ?        ?      106.3        5.1       ?       ? 
1 1 1   45    9    5 o    294.0    2.6    0.0000   0.0000          ?        ?   864.5582  15.3245          ?        ?      294.0        2.6       ?       ? 
1 1 1   45    9    6 o    266.3    2.6    0.0000   0.0000          ?        ?   709.3975  14.0475          ?        ?      266.3        2.6       ?       ? 
1 1 1   45    9    7 o    370.8    2.6    0.0000   0.0000          ?        ?  1375.3755  19.1556          ?        ?      370.8        2.6       ?       ? 
1 1 1   45    9    8 o    193.9    3.1    0.0000   0.0000          ?        ?   376.0892  12.1319          ?        ?      193.9        3.1       ?       ? 
1 1 1   45    9    9 o    623.9    2.8    0.0000   0.0000          ?        ?  3893.7048  34.4802          ?        ?      623.9        2.8       ?       ? 
1 1 1   45    9   10 o    342.8    2.6    0.0000   0.0000          ?        ?  1175.5183  17.8786          ?        ?      342.8        2.6       ?       ? 
1 1 1   45    9   11 o    123.0    4.7    0.0000   0.0000          ?        ?   151.3296  11.4934          ?        ?      123.0        4.7       ?       ? 
1 1 1   45    9   12 o    476.8    2.7    0.0000   0.0000          ?        ?  2274.4141  26.1794          ?        ?      476.8        2.7       ?       ? 
1 1 1   45    9   13 f    614.0    2.9    0.0000   0.0000          ?        ?  3771.1086  35.1187          ?        ?      614.0        2.9       ?       ? 
1 1 1   45    9   14 o    556.0    2.7    0.0000   0.0000          ?        ?  3091.7217  30.0105          ?        ?      556.0        2.7       ?       ? 
1 1 1   45    9   15 o    365.2    2.7    0.0000   0.0000          ?        ?  1333.8716  19.7942          ?        ?      365.2        2.7       ?       ? 
1 1 1   45    9   16 o    258.4    3.0    0.0000   0.0000          ?        ?   667.8936  15.3245          ?        ?      258.4        3.0       ?       ? 
1 1 1   45    9   17 o    222.8    3.2    0.0000   0.0000          ?        ?   496.7698  14.0475          ?        ?      222.8        3.2       ?       ? 
1 1 1   45    9   18 o    607.1    3.0    0.0000   0.0000          ?        ?  3686.8240  36.3957          ?        ?      607.1        3.0       ?       ? 
1 1 1   45    9   19 o    353.7    2.8    0.0000   0.0000          ?        ?  1251.5024  19.7942          ?        ?      353.7        2.8       ?       ? 
1 1 1   45    9   20 o    408.9    2.5    0.0000   0.0000          ?        ?  1672.2881  20.4327          ?        ?      408.9        2.5       ?       ? 
1 1 1   45    9   21 o    206.8    3.4    0.0000   0.0000          ?        ?   427.8095  14.0475          ?        ?      206.8        3.4       ?       ? 
1 1 1   45    9   22 o    108.6    5.9    0.0000   0.0000          ?        ?   118.1265  12.7704          ?        ?      108.6        5.9       ?       ? 
1 1 1   45    9   23 o    246.6    3.1    0.0000   0.0000          ?        ?   608.5111  15.3245          ?        ?      246.6        3.1       ?       ? 
1 1 1   45    9   24 o    459.4    2.5    0.0000   0.0000          ?        ?  2111.5911  22.9868          ?        ?      459.4        2.5       ?       ? 
1 1 1   45    9   25 o    488.8    2.7    0.0000   0.0000          ?        ?  2390.6250  26.1794          ?        ?      488.8        2.7       ?       ? 
1 1 1   45    9   26 o    341.4    2.7    0.0000   0.0000          ?        ?  1165.9406  18.5171          ?        ?      341.4        2.7       ?       ? 
1 1 1   45    9   27 o     81.7    7.8    0.0000   0.0000          ?        ?    67.0448  12.7704          ?        ?       81.7        7.8       ?       ? 
1 1 1   45    9   28 o    222.7    3.4    0.0000   0.0000          ?        ?   496.1313  15.3245          ?        ?      222.7        3.4       ?       ? 
1 1 1   45    9   29 o    140.6    5.5    0.0000   0.0000          ?        ?   197.9417  15.3245          ?        ?      140.6        5.5       ?       ? 
1 1 1   45    9   30 o    135.3    5.2    0.0000   0.0000          ?        ?   183.2557  14.0475          ?        ?      135.3        5.2       ?       ? 
1 1 1   45    9   31 o     64.6   11.8    0.0000   0.0000          ?        ?    43.4195  14.6860          ?        ?       64.6       11.8       ?       ? 
1 1 1   45    9   32 o    217.1    3.7    0.0000   0.0000          ?        ?   471.8675  15.9630          ?        ?      217.1        3.7       ?       ? 
1 1 1   45    9   33 o    425.5    2.6    0.0000   0.0000          ?        ?  1810.8474  21.7097          ?        ?      425.5        2.6       ?       ? 
1 1 1   45    9   34 o    220.6    3.8    0.0000   0.0000          ?        ?   487.1920  16.6016          ?        ?      220.6        3.8       ?       ? 
1 1 1   45    9   35 o    424.1    2.6    0.0000   0.0000          ?        ?  1799.3539  22.3483          ?        ?      424.1        2.6       ?       ? 
1 1 1   45    9   36 o    135.2    6.1    0.0000   0.0000          ?        ?   183.2557  16.6016          ?        ?      135.2        6.1       ?       ? 
1 1 1   45    9   37 o    149.3    5.3    0.0000   0.0000          ?        ?   223.4826  15.9630          ?        ?      149.3        5.3       ?       ? 
1 1 1   45    9   38 o    142.3    5.6    0.0000   0.0000          ?        ?   203.0499  15.9630          ?        ?      142.3        5.6       ?       ? 
1 1 1   45    9   39 o    105.2    7.6    0.0000   0.0000          ?        ?   111.1028  15.9630          ?        ?      105.2        7.6       ?       ? 
1 1 1   45    9   40 o    142.1    5.8    0.0000   0.0000          ?        ?   202.4114  16.6016          ?        ?      142.1        5.8       ?       ? 
1 1 1   45    9   41 o    124.6    6.9    0.0000   0.0000          ?        ?   155.7993  17.2401          ?        ?      124.6        6.9       ?       ? 
1 1 1   45    9   42 o     41.4   15.7    0.0000   0.0000          ?        ?    12.7704  17.8786          ?        ?       41.4       15.7       ?       ? 
1 1 1   45    9   43 o     92.8    9.3    0.0000   0.0000          ?        ?    86.8389  17.2401          ?        ?       92.8        9.3       ?       ? 
1 1 1   45    9   44 o    188.0    4.8    0.0000   0.0000          ?        ?   354.3795  17.8786          ?        ?      188.0        4.8       ?       ? 
1 1 1   45    9   45 o    102.6    8.1    0.0000   0.0000          ?        ?   105.9946  16.6016          ?        ?      102.6        8.1       ?       ? 
1 1 1   45    9   46 o     38.4   15.0    0.0000   0.0000          ?        ?     9.5778  16.6016          ?        ?       38.4       15.0       ?       ? 
1 1 1   45    9   47 o    106.4    8.7    0.0000   0.0000          ?        ?   114.2954  18.5171          ?        ?      106.4        8.7       ?       ? 
1 1 1   45    9   48 o     55.4   15.5    0.0000   0.0000          ?        ?    32.5646  17.8786          ?        ?       55.4       15.5       ?       ? 
1 1 1   45    9   49 o    132.3    6.8    0.0000   0.0000          ?        ?   176.2320  17.8786          ?        ?      132.3        6.8       ?       ? 
1 1 1   45    9   50 o    118.0    7.8    0.0000   0.0000          ?        ?   140.4748  18.5171          ?        ?      118.0        7.8       ?       ? 
1 1 1   45    9   51 o     26.1   12.5    0.0000   0.0000          ?        ?   -27.4564  19.1556          ?        ?       26.1       12.5       ?       ? 
1 1 1   45    9   52 o     65.4   14.5    0.0000   0.0000          ?        ?    45.9736  18.5171          ?        ?       65.4       14.5       ?       ? 
1 1 1   45    9   53 o     75.2   11.9    0.0000   0.0000          ?        ?    58.1055  17.8786          ?        ?       75.2       11.9       ?       ? 
1 1 1   45    9   54 o     49.7   16.2    0.0000   0.0000          ?        ?    25.5409  18.5171          ?        ?       49.7       16.2       ?       ? 
1 1 1   45   10    0 o    126.6    6.1  161.5460  15.3245   161.5460  15.3245   161.5460  15.3245      126.6      6.1      126.6        6.1     0.0     0.0 
1 1 1   45   10    1 o    329.8    2.4    0.0000   0.0000          ?        ?  1088.0408  15.9630          ?        ?      329.8        2.4       ?       ? 
1 1 1   45   10    2 o    127.3    4.0    0.0000   0.0000          ?        ?   162.1845  10.2163          ?        ?      127.3        4.0       ?       ? 
1 1 1   45   10    3 o    195.4    2.9    0.0000   0.0000          ?        ?   381.8359  11.4934          ?        ?      195.4        2.9       ?       ? 
1 1 1   45   10    4 o    228.2    2.9    0.0000   0.0000          ?        ?   521.0336  13.4090          ?        ?      228.2        2.9       ?       ? 
1 1 1   45   10    5 o    392.6    2.6    0.0000   0.0000          ?        ?  1541.3911  20.4327          ?        ?      392.6        2.6       ?       ? 
1 1 1   45   10    6 o    346.9    2.6    0.0000   0.0000          ?        ?  1203.6133  17.8786          ?        ?      346.9        2.6       ?       ? 
1 1 1   45   10    7 o    393.0    2.5    0.0000   0.0000          ?        ?  1544.5837  19.7942          ?        ?      393.0        2.5       ?       ? 
1 1 1   45   10    8 o    395.4    2.7    0.0000   0.0000          ?        ?  1563.7394  21.0712          ?        ?      395.4        2.7       ?       ? 
1 1 1   45   10    9 o     33.0   12.3    0.0000   0.0000          ?        ?     8.3008  10.8549          ?        ?       33.0       12.3       ?       ? 
1 1 1   45   10   10 o    387.8    2.6    0.0000   0.0000          ?        ?  1504.3569  19.7942          ?        ?      387.8        2.6       ?       ? 
1 1 1   45   10   11 o    387.5    2.5    0.0000   0.0000          ?        ?  1501.8029  19.1556          ?        ?      387.5        2.5       ?       ? 
1 1 1   45   10   12 o    464.7    2.7    0.0000   0.0000          ?        ?  2160.1187  25.5409          ?        ?      464.7        2.7       ?       ? 
1 1 1   45   10   13 o    110.4    5.8    0.0000   0.0000          ?        ?   121.9576  12.7704          ?        ?      110.4        5.8       ?       ? 
1 1 1   45   10   14 o    220.0    3.0    0.0000   0.0000          ?        ?   483.9994  13.4090          ?        ?      220.0        3.0       ?       ? 
1 1 1   45   10   15 o    473.9    2.6    0.0000   0.0000          ?        ?  2246.3191  24.2638          ?        ?      473.9        2.6       ?       ? 
1 1 1   45   10   16 o    345.6    2.7    0.0000   0.0000          ?        ?  1194.6740  18.5171          ?        ?      345.6        2.7       ?       ? 
1 1 1   45   10   17 o    356.9    2.6    0.0000   0.0000          ?        ?  1273.8506  18.5171          ?        ?      356.9        2.6       ?       ? 
1 1 1   45   10   18 o    149.4    4.3    0.0000   0.0000          ?        ?   223.4826  12.7704          ?        ?      149.4        4.3       ?       ? 
1 1 1   45   10   19 o    209.5    3.4    0.0000   0.0000          ?        ?   439.3029  14.0475          ?        ?      209.5        3.4       ?       ? 
1 1 1   45   10   20 o    310.4    2.6    0.0000   0.0000          ?        ?   963.5291  15.9630          ?        ?      310.4        2.6       ?       ? 
1 1 1   45   10   21 o    434.5    2.5    0.0000   0.0000          ?        ?  1888.1085  21.7097          ?        ?      434.5        2.5       ?       ? 
1 1 1   45   10   22 o    222.5    3.2    0.0000   0.0000          ?        ?   495.4928  14.0475          ?        ?      222.5        3.2       ?       ? 
1 1 1   45   10   23 o    192.0    3.7    0.0000   0.0000          ?        ?   369.0655  14.0475          ?        ?      192.0        3.7       ?       ? 
1 1 1   45   10   24 o    121.1    5.5    0.0000   0.0000          ?        ?   146.8600  13.4090          ?        ?      121.1        5.5       ?       ? 
1 1 1   45   10   25 o    112.6    6.0    0.0000   0.0000          ?        ?   127.0658  13.4090          ?        ?      112.6        6.0       ?       ? 
1 1 1   45   10   26 o    440.1    2.6    0.0000   0.0000          ?        ?  1937.9131  22.9868          ?        ?      440.1        2.6       ?       ? 
1 1 1   45   10   27 o    105.3    6.7    0.0000   0.0000          ?        ?   111.1028  14.0475          ?        ?      105.3        6.7       ?       ? 
1 1 1   45   10   28 o     63.2   11.5    0.0000   0.0000          ?        ?    41.5039  14.0475          ?        ?       63.2       11.5       ?       ? 
1 1 1   45   10   29 o    332.0    2.7    0.0000   0.0000          ?        ?  1102.7268  17.8786          ?        ?      332.0        2.7       ?       ? 
1 1 1   45   10   30 o     34.0   13.6    0.0000   0.0000          ?        ?     5.7467  14.0475          ?        ?       34.0       13.6       ?       ? 
1 1 1   45   10   31 o     58.4   12.9    0.0000   0.0000          ?        ?    35.7572  14.6860          ?        ?       58.4       12.9       ?       ? 
1 1 1   45   10   32 o    116.7    6.3    0.0000   0.0000          ?        ?   136.6436  14.6860          ?        ?      116.7        6.3       ?       ? 
1 1 1   45   10   33 o    160.3    4.8    0.0000   0.0000          ?        ?   257.3242  15.3245          ?        ?      160.3        4.8       ?       ? 
1 1 1   45   10   34 o    116.5    6.6    0.0000   0.0000          ?        ?   136.0051  15.3245          ?        ?      116.5        6.6       ?       ? 
1 1 1   45   10   35 f    344.4    2.7    0.0000   0.0000          ?        ?  1187.0117  18.5171          ?        ?      344.4        2.7       ?       ? 
1 1 1   45   10   36 o    456.2    2.7    0.0000   0.0000          ?        ?  2082.2190  24.2638          ?        ?      456.2        2.7       ?       ? 
1 1 1   45   10   37 o    312.9    2.9    0.0000   0.0000          ?        ?   979.4921  17.8786          ?        ?      312.9        2.9       ?       ? 
1 1 1   45   10   38 o     43.2   15.6    0.0000   0.0000          ?        ?    15.9630  17.2401          ?        ?       43.2       15.6       ?       ? 
1 1 1   45   10   39 o     25.8   12.1    0.0000   0.0000          ?        ?   -16.6016  15.9630          ?        ?       25.8       12.1       ?       ? 
1 1 1   45   10   40 o    229.8    3.6    0.0000   0.0000          ?        ?   528.6959  16.6016          ?        ?      229.8        3.6       ?       ? 
1 1 1   45   10   41 o    186.5    4.8    0.0000   0.0000          ?        ?   348.6328  17.8786          ?        ?      186.5        4.8       ?       ? 
1 1 1   45   10   42 o     73.6   11.7    0.0000   0.0000          ?        ?    54.9129  17.2401          ?        ?       73.6       11.7       ?       ? 
1 1 1   45   10   43 o    207.1    4.3    0.0000   0.0000          ?        ?   429.7251  17.8786          ?        ?      207.1        4.3       ?       ? 
1 1 1   45   10   44 o    227.0    3.8    0.0000   0.0000          ?        ?   515.9255  17.2401          ?        ?      227.0        3.8       ?       ? 
1 1 1   45   10   45 o    175.5    5.1    0.0000   0.0000          ?        ?   309.0445  17.8786          ?        ?      175.5        5.1       ?       ? 
1 1 1   45   10   46 o    125.5    6.9    0.0000   0.0000          ?        ?   158.3534  17.2401          ?        ?      125.5        6.9       ?       ? 
1 1 1   45   10   47 o    128.5    6.7    0.0000   0.0000          ?        ?   166.0156  17.2401          ?        ?      128.5        6.7       ?       ? 
1 1 1   45   10   48 o    112.6    7.7    0.0000   0.0000          ?        ?   127.7043  17.2401          ?        ?      112.6        7.7       ?       ? 
1 1 1   45   10   49 o    186.6    4.8    0.0000   0.0000          ?        ?   349.2713  17.8786          ?        ?      186.6        4.8       ?       ? 
1 1 1   45   10   50 o    148.6    6.0    0.0000   0.0000          ?        ?   222.2055  17.8786          ?        ?      148.6        6.0       ?       ? 
1 1 1   45   10   51 o    244.0    3.9    0.0000   0.0000          ?        ?   597.0177  19.1556          ?        ?      244.0        3.9       ?       ? 
1 1 1   45   10   52 o    174.9    5.5    0.0000   0.0000          ?        ?   307.7674  19.1556          ?        ?      174.9        5.5       ?       ? 
1 1 1   45   10   53 o    107.7    8.0    0.0000   0.0000          ?        ?   117.4880  17.2401          ?        ?      107.7        8.0       ?       ? 
1 1 1   45   11    0 o     15.1   10.8  -19.1556  14.0475   -19.1556  14.0475   -19.1556  14.0475       15.1     10.8       15.1       10.8     0.0     0.0 
1 1 1   45   11    1 o    369.9    2.4    0.0000   0.0000          ?        ?  1368.3518  17.8786          ?        ?      369.9        2.4       ?       ? 
1 1 1   45   11    2 o    263.9    2.5    0.0000   0.0000          ?        ?   696.6271  13.4090          ?        ?      263.9        2.5       ?       ? 
1 1 1   45   11    3 o    205.6    3.1    0.0000   0.0000          ?        ?   422.7013  12.7704          ?        ?      205.6        3.1       ?       ? 
1 1 1   45   11    4 o    252.5    2.8    0.0000   0.0000          ?        ?   637.8831  14.0475          ?        ?      252.5        2.8       ?       ? 
1 1 1   45   11    5 o     61.8    8.3    0.0000   0.0000          ?        ?    38.3113  10.2163          ?        ?       61.8        8.3       ?       ? 
1 1 1   45   11    6 o     80.6    6.3    0.0000   0.0000          ?        ?    65.1292  10.2163          ?        ?       80.6        6.3       ?       ? 
1 1 1   45   11    7 o    183.2    3.1    0.0000   0.0000          ?        ?   335.8624  11.4934          ?        ?      183.2        3.1       ?       ? 
1 1 1   45   11    8 o    434.8    2.7    0.0000   0.0000          ?        ?  1891.3011  23.6253          ?        ?      434.8        2.7       ?       ? 
1 1 1   45   11    9 o    220.0    3.0    0.0000   0.0000          ?        ?   483.9994  13.4090          ?        ?      220.0        3.0       ?       ? 
1 1 1   45   11   10 o    633.7    3.0    0.0000   0.0000          ?        ?  4016.9395  38.3113          ?        ?      633.7        3.0       ?       ? 
1 1 1   45   11   11 o    329.7    2.5    0.0000   0.0000          ?        ?  1087.4023  16.6016          ?        ?      329.7        2.5       ?       ? 
1 1 1   45   11   12 o    111.2    5.2    0.0000   0.0000          ?        ?   123.8732  11.4934          ?        ?      111.2        5.2       ?       ? 
1 1 1   45   11   13 o     18.2    9.0    0.0000   0.0000          ?        ?   -24.2638  11.4934          ?        ?       18.2        9.0       ?       ? 
1 1 1   45   11   14 o    366.0    2.6    0.0000   0.0000          ?        ?  1339.6184  19.1556          ?        ?      366.0        2.6       ?       ? 
1 1 1   45   11   15 o    223.6    3.0    0.0000   0.0000          ?        ?   499.9625  13.4090          ?        ?      223.6        3.0       ?       ? 
1 1 1   45   11   16 o    222.7    3.3    0.0000   0.0000          ?        ?   496.1313  14.6860          ?        ?      222.7        3.3       ?       ? 
1 1 1   45   11   17 f    274.8    2.8    0.0000   0.0000          ?        ?   755.3711  15.3245          ?        ?      274.8        2.8       ?       ? 
1 1 1   45   11   18 o    272.9    2.9    0.0000   0.0000          ?        ?   745.1547  15.9630          ?        ?      272.9        2.9       ?       ? 
1 1 1   45   11   19 o    423.1    2.7    0.0000   0.0000          ?        ?  1790.4146  22.9868          ?        ?      423.1        2.7       ?       ? 
1 1 1   45   11   20 o    267.7    3.0    0.0000   0.0000          ?        ?   717.0598  15.9630          ?        ?      267.7        3.0       ?       ? 
1 1 1   45   11   21 o    407.8    2.6    0.0000   0.0000          ?        ?  1663.3489  21.0712          ?        ?      407.8        2.6       ?       ? 
1 1 1   45   11   22 o    354.4    2.6    0.0000   0.0000          ?        ?  1256.6106  18.5171          ?        ?      354.4        2.6       ?       ? 
1 1 1   45   11   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45   11   24 o    295.9    2.7    0.0000   0.0000          ?        ?   876.0516  15.9630          ?        ?      295.9        2.7       ?       ? 
1 1 1   45   11   25 o    157.1    4.3    0.0000   0.0000          ?        ?   247.1079  13.4090          ?        ?      157.1        4.3       ?       ? 
1 1 1   45   11   26 o    198.7    3.7    0.0000   0.0000          ?        ?   395.2449  14.6860          ?        ?      198.7        3.7       ?       ? 
1 1 1   45   11   27 o    250.3    3.2    0.0000   0.0000          ?        ?   627.0282  15.9630          ?        ?      250.3        3.2       ?       ? 
1 1 1   45   11   28 o    129.7    5.7    0.0000   0.0000          ?        ?   168.5697  14.6860          ?        ?      129.7        5.7       ?       ? 
1 1 1   45   11   29 o    458.1    2.6    0.0000   0.0000          ?        ?  2099.4590  23.6253          ?        ?      458.1        2.6       ?       ? 
1 1 1   45   11   30 o    297.4    2.8    0.0000   0.0000          ?        ?   884.9910  16.6016          ?        ?      297.4        2.8       ?       ? 
1 1 1   45   11   31 o    369.1    2.6    0.0000   0.0000          ?        ?  1362.6051  19.1556          ?        ?      369.1        2.6       ?       ? 
1 1 1   45   11   32 o    191.8    4.0    0.0000   0.0000          ?        ?   368.4270  15.3245          ?        ?      191.8        4.0       ?       ? 
1 1 1   45   11   33 o     56.7   13.2    0.0000   0.0000          ?        ?    33.8416  14.6860          ?        ?       56.7       13.2       ?       ? 
1 1 1   45   11   34 o    179.1    4.3    0.0000   0.0000          ?        ?   321.1764  15.3245          ?        ?      179.1        4.3       ?       ? 
1 1 1   45   11   35 o     72.0   11.5    0.0000   0.0000          ?        ?    52.3588  16.6016          ?        ?       72.0       11.5       ?       ? 
1 1 1   45   11   36 o    235.6    3.8    0.0000   0.0000          ?        ?   555.5138  17.8786          ?        ?      235.6        3.8       ?       ? 
1 1 1   45   11   37 o     89.1    8.6    0.0000   0.0000          ?        ?    79.8152  15.3245          ?        ?       89.1        8.6       ?       ? 
1 1 1   45   11   38 o     37.2   14.6    0.0000   0.0000          ?        ?     8.3008  15.9630          ?        ?       37.2       14.6       ?       ? 
1 1 1   45   11   39 o    267.9    3.3    0.0000   0.0000          ?        ?   718.3369  17.8786          ?        ?      267.9        3.3       ?       ? 
1 1 1   45   11   40 o    218.7    3.9    0.0000   0.0000          ?        ?   478.8912  17.2401          ?        ?      218.7        3.9       ?       ? 
1 1 1   45   11   41 f    190.4    4.7    0.0000   0.0000          ?        ?   363.3188  17.8786          ?        ?      190.4        4.7       ?       ? 
1 1 1   45   11   42 o    187.2    4.6    0.0000   0.0000          ?        ?   351.1869  17.2401          ?        ?      187.2        4.6       ?       ? 
1 1 1   45   11   43 o    162.5    5.3    0.0000   0.0000          ?        ?   264.9865  17.2401          ?        ?      162.5        5.3       ?       ? 
1 1 1   45   11   44 f    227.2    4.1    0.0000   0.0000          ?        ?   517.2025  18.5171          ?        ?      227.2        4.1       ?       ? 
1 1 1   45   11   45 o     26.9   12.6    0.0000   0.0000          ?        ?   -15.3245  16.6016          ?        ?       26.9       12.6       ?       ? 
1 1 1   45   11   46 o    174.0    5.1    0.0000   0.0000          ?        ?   303.9363  17.8786          ?        ?      174.0        5.1       ?       ? 
1 1 1   45   11   47 o    137.3    6.3    0.0000   0.0000          ?        ?   189.6409  17.2401          ?        ?      137.3        6.3       ?       ? 
1 1 1   45   11   48 f    150.2    6.0    0.0000   0.0000          ?        ?   226.6752  17.8786          ?        ?      150.2        6.0       ?       ? 
1 1 1   45   11   49 o     64.7   13.7    0.0000   0.0000          ?        ?    44.6965  17.2401          ?        ?       64.7       13.7       ?       ? 
1 1 1   45   11   50 o    259.4    3.7    0.0000   0.0000          ?        ?   674.2788  19.1556          ?        ?      259.4        3.7       ?       ? 
1 1 1   45   11   51 o     92.1    9.4    0.0000   0.0000          ?        ?    86.2004  17.2401          ?        ?       92.1        9.4       ?       ? 
1 1 1   45   11   52 o     80.5   11.1    0.0000   0.0000          ?        ?    66.4062  17.8786          ?        ?       80.5       11.1       ?       ? 
1 1 1   45   12    0 f    408.1    3.4 1666.5415  27.4564  1666.5415  27.4564  1666.5415  27.4564      408.1      3.4      408.1        3.4     0.0     0.0 
1 1 1   45   12    1 o    386.5    2.5    0.0000   0.0000          ?        ?  1494.1406  19.1556          ?        ?      386.5        2.5       ?       ? 
1 1 1   45   12    2 o     76.6    5.8    0.0000   0.0000          ?        ?    58.7440   8.9393          ?        ?       76.6        5.8       ?       ? 
1 1 1   45   12    3 o    560.3    2.7    0.0000   0.0000          ?        ?  3140.8879  30.6490          ?        ?      560.3        2.7       ?       ? 
1 1 1   45   12    4 o     57.5    8.3    0.0000   0.0000          ?        ?    33.2031   9.5778          ?        ?       57.5        8.3       ?       ? 
1 1 1   45   12    5 o    126.8    4.0    0.0000   0.0000          ?        ?   160.9075  10.2163          ?        ?      126.8        4.0       ?       ? 
1 1 1   45   12    6 o    304.6    2.5    0.0000   0.0000          ?        ?   927.7720  15.3245          ?        ?      304.6        2.5       ?       ? 
1 1 1   45   12    7 o    439.1    2.5    0.0000   0.0000          ?        ?  1928.9739  22.3483          ?        ?      439.1        2.5       ?       ? 
1 1 1   45   12    8 o    435.0    2.6    0.0000   0.0000          ?        ?  1893.2167  22.3483          ?        ?      435.0        2.6       ?       ? 
1 1 1   45   12    9 o    313.3    2.5    0.0000   0.0000          ?        ?   982.0463  15.9630          ?        ?      313.3        2.5       ?       ? 
1 1 1   45   12   10 o    179.7    3.4    0.0000   0.0000          ?        ?   323.0919  12.1319          ?        ?      179.7        3.4       ?       ? 
1 1 1   45   12   11 o    174.5    3.3    0.0000   0.0000          ?        ?   304.5748  11.4934          ?        ?      174.5        3.3       ?       ? 
1 1 1   45   12   12 o    259.9    2.8    0.0000   0.0000          ?        ?   675.5559  14.6860          ?        ?      259.9        2.8       ?       ? 
1 1 1   45   12   13 o    323.7    2.7    0.0000   0.0000          ?        ?  1048.4525  17.2401          ?        ?      323.7        2.7       ?       ? 
1 1 1   45   12   14 f    117.1    4.9    0.0000   0.0000          ?        ?   137.2822  11.4934          ?        ?      117.1        4.9       ?       ? 
1 1 1   45   12   15 o    129.5    4.9    0.0000   0.0000          ?        ?   167.9312  12.7704          ?        ?      129.5        4.9       ?       ? 
1 1 1   45   12   16 o    230.0    3.3    0.0000   0.0000          ?        ?   529.3344  15.3245          ?        ?      230.0        3.3       ?       ? 
1 1 1   45   12   17 o    420.1    2.7    0.0000   0.0000          ?        ?  1765.5123  22.3483          ?        ?      420.1        2.7       ?       ? 
1 1 1   45   12   18 f    267.1    2.9    0.0000   0.0000          ?        ?   713.8672  15.3245          ?        ?      267.1        2.9       ?       ? 
1 1 1   45   12   19 o    325.5    2.6    0.0000   0.0000          ?        ?  1059.9459  17.2401          ?        ?      325.5        2.6       ?       ? 
1 1 1   45   12   20 o    306.7    2.5    0.0000   0.0000          ?        ?   941.1808  15.3245          ?        ?      306.7        2.5       ?       ? 
1 1 1   45   12   21 o    473.9    2.6    0.0000   0.0000          ?        ?  2246.9575  24.9023          ?        ?      473.9        2.6       ?       ? 
1 1 1   45   12   22 o    213.9    3.4    0.0000   0.0000          ?        ?   457.8200  14.6860          ?        ?      213.9        3.4       ?       ? 
1 1 1   45   12   23 o    376.9    2.5    0.0000   0.0000          ?        ?  1421.3491  19.1556          ?        ?      376.9        2.5       ?       ? 
1 1 1   45   12   24 o    122.9    5.5    0.0000   0.0000          ?        ?   151.3296  13.4090          ?        ?      122.9        5.5       ?       ? 
1 1 1   45   12   25 o    348.1    2.6    0.0000   0.0000          ?        ?  1212.5525  17.8786          ?        ?      348.1        2.6       ?       ? 
1 1 1   45   12   26 o    265.2    2.9    0.0000   0.0000          ?        ?   703.6508  15.3245          ?        ?      265.2        2.9       ?       ? 
1 1 1   45   12   27 o     20.4   10.0    0.0000   0.0000          ?        ?   -31.9261  14.6860          ?        ?       20.4       10.0       ?       ? 
1 1 1   45   12   28 o     27.8   12.4    0.0000   0.0000          ?        ?    -5.7467  14.0475          ?        ?       27.8       12.4       ?       ? 
1 1 1   45   12   29 o    146.8    5.0    0.0000   0.0000          ?        ?   215.8203  14.6860          ?        ?      146.8        5.0       ?       ? 
1 1 1   45   12   30 o    279.1    3.0    0.0000   0.0000          ?        ?   779.6349  16.6016          ?        ?      279.1        3.0       ?       ? 
1 1 1   45   12   31 o    122.3    6.5    0.0000   0.0000          ?        ?   150.0526  15.9630          ?        ?      122.3        6.5       ?       ? 
1 1 1   45   12   32 o    264.2    3.1    0.0000   0.0000          ?        ?   698.5427  16.6016          ?        ?      264.2        3.1       ?       ? 
1 1 1   45   12   33 o     76.4    9.6    0.0000   0.0000          ?        ?    58.7440  14.6860          ?        ?       76.4        9.6       ?       ? 
1 1 1   45   12   34 o     64.5   12.3    0.0000   0.0000          ?        ?    43.4195  15.3245          ?        ?       64.5       12.3       ?       ? 
1 1 1   45   12   35 o    131.4    6.1    0.0000   0.0000          ?        ?   173.0394  15.9630          ?        ?      131.4        6.1       ?       ? 
1 1 1   45   12   36 o    113.6    7.0    0.0000   0.0000          ?        ?   129.6199  15.9630          ?        ?      113.6        7.0       ?       ? 
1 1 1   45   12   37 o    341.6    2.8    0.0000   0.0000          ?        ?  1167.8560  19.1556          ?        ?      341.6        2.8       ?       ? 
1 1 1   45   12   38 o    168.0    4.9    0.0000   0.0000          ?        ?   282.8651  16.6016          ?        ?      168.0        4.9       ?       ? 
1 1 1   45   12   39 o    179.7    4.8    0.0000   0.0000          ?        ?   323.7305  17.2401          ?        ?      179.7        4.8       ?       ? 
1 1 1   45   12   40 o    175.2    4.9    0.0000   0.0000          ?        ?   307.7674  17.2401          ?        ?      175.2        4.9       ?       ? 
1 1 1   45   12   41 o    186.0    4.6    0.0000   0.0000          ?        ?   346.7172  17.2401          ?        ?      186.0        4.6       ?       ? 
1 1 1   45   12   42 o    137.6    6.3    0.0000   0.0000          ?        ?   190.2794  17.2401          ?        ?      137.6        6.3       ?       ? 
1 1 1   45   12   43 o    192.1    4.5    0.0000   0.0000          ?        ?   369.7040  17.2401          ?        ?      192.1        4.5       ?       ? 
1 1 1   45   12   44 f    230.1    3.9    0.0000   0.0000          ?        ?   530.6115  17.8786          ?        ?      230.1        3.9       ?       ? 
1 1 1   45   12   45 o    216.4    4.0    0.0000   0.0000          ?        ?   469.3134  17.2401          ?        ?      216.4        4.0       ?       ? 
1 1 1   45   12   46 o     62.4   13.7    0.0000   0.0000          ?        ?    41.5039  16.6016          ?        ?       62.4       13.7       ?       ? 
1 1 1   45   12   47 o     42.3   15.8    0.0000   0.0000          ?        ?    14.6860  17.8786          ?        ?       42.3       15.8       ?       ? 
1 1 1   45   12   48 o     82.3   10.9    0.0000   0.0000          ?        ?    68.9603  17.8786          ?        ?       82.3       10.9       ?       ? 
1 1 1   45   12   49 o     35.8   14.8    0.0000   0.0000          ?        ?     4.4697  17.2401          ?        ?       35.8       14.8       ?       ? 
1 1 1   45   12   50 o     52.9   15.0    0.0000   0.0000          ?        ?    30.0105  16.6016          ?        ?       52.9       15.0       ?       ? 
1 1 1   45   12   51 o    130.2    6.6    0.0000   0.0000          ?        ?   171.1238  17.2401          ?        ?      130.2        6.6       ?       ? 
1 1 1   45   13    0 o    182.1    3.9  332.0312  14.0475   332.0312  14.0475   332.0312  14.0475      182.1      3.9      182.1        3.9     0.0     0.0 
1 1 1   45   13    1 o    253.9    2.6    0.0000   0.0000          ?        ?   644.9069  13.4090          ?        ?      253.9        2.6       ?       ? 
1 1 1   45   13    2 o    333.5    2.4    0.0000   0.0000          ?        ?  1112.3047  15.9630          ?        ?      333.5        2.4       ?       ? 
1 1 1   45   13    3 o     95.5    4.7    0.0000   0.0000          ?        ?    91.3086   8.9393          ?        ?       95.5        4.7       ?       ? 
1 1 1   45   13    4 o    288.6    2.4    0.0000   0.0000          ?        ?   833.2708  14.0475          ?        ?      288.6        2.4       ?       ? 
1 1 1   45   13    5 o     22.0    9.7    0.0000   0.0000          ?        ?    -2.5541   8.3008          ?        ?       22.0        9.7       ?       ? 
1 1 1   45   13    6 o     35.5   11.7    0.0000   0.0000          ?        ?    12.1319   9.5778          ?        ?       35.5       11.7       ?       ? 
1 1 1   45   13    7 o    370.5    2.4    0.0000   0.0000          ?        ?  1372.8215  17.8786          ?        ?      370.5        2.4       ?       ? 
1 1 1   45   13    8 o    121.7    4.2    0.0000   0.0000          ?        ?   148.1370  10.2163          ?        ?      121.7        4.2       ?       ? 
1 1 1   45   13    9 o    376.9    2.5    0.0000   0.0000          ?        ?  1420.7106  19.1556          ?        ?      376.9        2.5       ?       ? 
1 1 1   45   13   10 o    194.4    3.1    0.0000   0.0000          ?        ?   378.0048  12.1319          ?        ?      194.4        3.1       ?       ? 
1 1 1   45   13   11 o    287.7    2.7    0.0000   0.0000          ?        ?   828.1625  15.3245          ?        ?      287.7        2.7       ?       ? 
1 1 1   45   13   12 o    392.9    2.7    0.0000   0.0000          ?        ?  1543.9453  21.0712          ?        ?      392.9        2.7       ?       ? 
1 1 1   45   13   13 o    168.5    3.6    0.0000   0.0000          ?        ?   284.1421  12.1319          ?        ?      168.5        3.6       ?       ? 
1 1 1   45   13   14 o    206.6    2.9    0.0000   0.0000          ?        ?   427.1710  12.1319          ?        ?      206.6        2.9       ?       ? 
1 1 1   45   13   15 o    283.9    2.6    0.0000   0.0000          ?        ?   806.4528  14.6860          ?        ?      283.9        2.6       ?       ? 
1 1 1   45   13   16 o    224.7    3.1    0.0000   0.0000          ?        ?   505.0706  14.0475          ?        ?      224.7        3.1       ?       ? 
1 1 1   45   13   17 o    215.4    3.1    0.0000   0.0000          ?        ?   464.2052  13.4090          ?        ?      215.4        3.1       ?       ? 
1 1 1   45   13   18 o    331.7    2.6    0.0000   0.0000          ?        ?  1100.8113  17.2401          ?        ?      331.7        2.6       ?       ? 
1 1 1   45   13   19 o    338.2    2.5    0.0000   0.0000          ?        ?  1144.2307  17.2401          ?        ?      338.2        2.5       ?       ? 
1 1 1   45   13   20 o     83.3    8.1    0.0000   0.0000          ?        ?    69.5989  13.4090          ?        ?       83.3        8.1       ?       ? 
1 1 1   45   13   21 o    396.1    2.6    0.0000   0.0000          ?        ?  1569.4862  20.4327          ?        ?      396.1        2.6       ?       ? 
1 1 1   45   13   22 o    251.5    3.2    0.0000   0.0000          ?        ?   632.7749  15.9630          ?        ?      251.5        3.2       ?       ? 
1 1 1   45   13   23 o    205.2    3.6    0.0000   0.0000          ?        ?   421.4243  14.6860          ?        ?      205.2        3.6       ?       ? 
1 1 1   45   13   24 o    161.9    4.5    0.0000   0.0000          ?        ?   262.4324  14.6860          ?        ?      161.9        4.5       ?       ? 
1 1 1   45   13   25 o     90.6    7.4    0.0000   0.0000          ?        ?    82.3693  13.4090          ?        ?       90.6        7.4       ?       ? 
1 1 1   45   13   26 o    111.7    6.0    0.0000   0.0000          ?        ?   125.1502  13.4090          ?        ?      111.7        6.0       ?       ? 
1 1 1   45   13   27 o    127.5    5.5    0.0000   0.0000          ?        ?   162.8230  14.0475          ?        ?      127.5        5.5       ?       ? 
1 1 1   45   13   28 o     23.3   11.0    0.0000   0.0000          ?        ?   -15.3245  13.4090          ?        ?       23.3       11.0       ?       ? 
1 1 1   45   13   29 o     85.1    8.6    0.0000   0.0000          ?        ?    72.7915  14.6860          ?        ?       85.1        8.6       ?       ? 
1 1 1   45   13   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45   13   31 o    143.5    5.3    0.0000   0.0000          ?        ?   206.2425  15.3245          ?        ?      143.5        5.3       ?       ? 
1 1 1   45   13   32 f    185.9    3.9    0.0000   0.0000          ?        ?   346.0787  14.6860          ?        ?      185.9        3.9       ?       ? 
1 1 1   45   13   33 o    126.7    6.0    0.0000   0.0000          ?        ?   160.9075  15.3245          ?        ?      126.7        6.0       ?       ? 
1 1 1   45   13   34 o    159.3    4.8    0.0000   0.0000          ?        ?   254.1316  15.3245          ?        ?      159.3        4.8       ?       ? 
1 1 1   45   13   35 o     31.3   13.6    0.0000   0.0000          ?        ?    -2.5541  15.9630          ?        ?       31.3       13.6       ?       ? 
1 1 1   45   13   36 o    453.7    2.6    0.0000   0.0000          ?        ?  2059.8708  23.6253          ?        ?      453.7        2.6       ?       ? 
1 1 1   45   13   37 o    194.6    4.3    0.0000   0.0000          ?        ?   379.2819  16.6016          ?        ?      194.6        4.3       ?       ? 
1 1 1   45   13   38 o    163.1    5.5    0.0000   0.0000          ?        ?   266.9020  17.8786          ?        ?      163.1        5.5       ?       ? 
1 1 1   45   13   39 o    298.5    3.0    0.0000   0.0000          ?        ?   892.0147  17.8786          ?        ?      298.5        3.0       ?       ? 
1 1 1   45   13   40 o    161.8    5.1    0.0000   0.0000          ?        ?   262.4324  16.6016          ?        ?      161.8        5.1       ?       ? 
1 1 1   45   13   41 o     67.1   12.8    0.0000   0.0000          ?        ?    47.2506  16.6016          ?        ?       67.1       12.8       ?       ? 
1 1 1   45   13   42 o    284.5    3.4    0.0000   0.0000          ?        ?   810.2839  19.1556          ?        ?      284.5        3.4       ?       ? 
1 1 1   45   13   43 o    202.5    4.4    0.0000   0.0000          ?        ?   411.2079  17.8786          ?        ?      202.5        4.4       ?       ? 
1 1 1   45   13   44 o     49.1   15.9    0.0000   0.0000          ?        ?    24.2638  17.8786          ?        ?       49.1       15.9       ?       ? 
1 1 1   45   13   45 o     23.6   11.5    0.0000   0.0000          ?        ?   -32.5646  17.8786          ?        ?       23.6       11.5       ?       ? 
1 1 1   45   13   46 o     72.0   12.0    0.0000   0.0000          ?        ?    52.9973  17.2401          ?        ?       72.0       12.0       ?       ? 
1 1 1   45   13   47 o    138.2    6.2    0.0000   0.0000          ?        ?   192.1950  17.2401          ?        ?      138.2        6.2       ?       ? 
1 1 1   45   13   48 f    144.5    6.0    0.0000   0.0000          ?        ?   210.0736  17.2401          ?        ?      144.5        6.0       ?       ? 
1 1 1   45   13   49 o     99.1    8.7    0.0000   0.0000          ?        ?    99.6094  17.2401          ?        ?       99.1        8.7       ?       ? 
1 1 1   45   13   50 o    139.4    6.4    0.0000   0.0000          ?        ?   196.0261  17.8786          ?        ?      139.4        6.4       ?       ? 
1 1 1   45   14    0 o    339.2    4.3 1151.8929  29.3720  1151.8929  29.3720  1151.8929  29.3720      339.2      4.3      339.2        4.3     0.0     0.0 
1 1 1   45   14    1 o    227.5    3.5    0.0000   0.0000          ?        ?   517.8410  15.9630          ?        ?      227.5        3.5       ?       ? 
1 1 1   45   14    2 o    155.7    3.9    0.0000   0.0000          ?        ?   242.6382  12.1319          ?        ?      155.7        3.9       ?       ? 
1 1 1   45   14    3 o     21.3   10.0    0.0000   0.0000          ?        ?   -11.4934  10.8549          ?        ?       21.3       10.0       ?       ? 
1 1 1   45   14    4 o    112.7    5.1    0.0000   0.0000          ?        ?   127.0658  11.4934          ?        ?      112.7        5.1       ?       ? 
1 1 1   45   14    5 o     15.5    7.8    0.0000   0.0000          ?        ?   -37.6728  11.4934          ?        ?       15.5        7.8       ?       ? 
1 1 1   45   14    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45   14    7 o    198.6    3.1    0.0000   0.0000          ?        ?   394.6064  12.1319          ?        ?      198.6        3.1       ?       ? 
1 1 1   45   14    8 o     63.3    8.1    0.0000   0.0000          ?        ?    40.2269  10.2163          ?        ?       63.3        8.1       ?       ? 
1 1 1   45   14    9 o    117.4    3.8    0.0000   0.0000          ?        ?   137.9207   8.9393          ?        ?      117.4        3.8       ?       ? 
1 1 1   45   14   10 o    354.8    2.5    0.0000   0.0000          ?        ?  1259.1647  17.8786          ?        ?      354.8        2.5       ?       ? 
1 1 1   45   14   11 o    261.7    2.6    0.0000   0.0000          ?        ?   685.1337  13.4090          ?        ?      261.7        2.6       ?       ? 
1 1 1   45   14   12 o    230.7    2.8    0.0000   0.0000          ?        ?   532.5270  12.7704          ?        ?      230.7        2.8       ?       ? 
1 1 1   45   14   13 o    330.0    2.6    0.0000   0.0000          ?        ?  1089.3180  17.2401          ?        ?      330.0        2.6       ?       ? 
1 1 1   45   14   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45   14   15 o    217.2    3.2    0.0000   0.0000          ?        ?   471.8675  14.0475          ?        ?      217.2        3.2       ?       ? 
1 1 1   45   14   16 o    323.5    2.7    0.0000   0.0000          ?        ?  1047.1754  17.2401          ?        ?      323.5        2.7       ?       ? 
1 1 1   45   14   17 o    388.4    2.6    0.0000   0.0000          ?        ?  1509.4651  20.4327          ?        ?      388.4        2.6       ?       ? 
1 1 1   45   14   18 o     97.8    6.2    0.0000   0.0000          ?        ?    95.7782  12.1319          ?        ?       97.8        6.2       ?       ? 
1 1 1   45   14   19 o    201.9    3.6    0.0000   0.0000          ?        ?   408.0153  14.6860          ?        ?      201.9        3.6       ?       ? 
1 1 1   45   14   20 o    498.7    2.8    0.0000   0.0000          ?        ?  2488.3188  28.0950          ?        ?      498.7        2.8       ?       ? 
1 1 1   45   14   21 o    528.3    2.8    0.0000   0.0000          ?        ?  2792.2549  30.0105          ?        ?      528.3        2.8       ?       ? 
1 1 1   45   14   22 o    229.3    3.5    0.0000   0.0000          ?        ?   526.1418  15.9630          ?        ?      229.3        3.5       ?       ? 
1 1 1   45   14   23 o    337.0    2.7    0.0000   0.0000          ?        ?  1135.9299  17.8786          ?        ?      337.0        2.7       ?       ? 
1 1 1   45   14   24 o    330.5    2.7    0.0000   0.0000          ?        ?  1092.5105  17.8786          ?        ?      330.5        2.7       ?       ? 
1 1 1   45   14   25 o    373.1    2.7    0.0000   0.0000          ?        ?  1392.6157  19.7942          ?        ?      373.1        2.7       ?       ? 
1 1 1   45   14   26 o    210.9    3.5    0.0000   0.0000          ?        ?   445.0496  14.6860          ?        ?      210.9        3.5       ?       ? 
1 1 1   45   14   27 o     21.3   10.3    0.0000   0.0000          ?        ?   -21.7097  13.4090          ?        ?       21.3       10.3       ?       ? 
1 1 1   45   14   28 o     17.3    8.8    0.0000   0.0000          ?        ?   -49.8047  14.6860          ?        ?       17.3        8.8       ?       ? 
1 1 1   45   14   29 o    290.7    2.9    0.0000   0.0000          ?        ?   845.4026  16.6016          ?        ?      290.7        2.9       ?       ? 
1 1 1   45   14   30 o     34.0   14.0    0.0000   0.0000          ?        ?     3.8311  15.3245          ?        ?       34.0       14.0       ?       ? 
1 1 1   45   14   31 f    129.9    5.7    0.0000   0.0000          ?        ?   169.2082  14.6860          ?        ?      129.9        5.7       ?       ? 
1 1 1   45   14   32 o    101.5    7.2    0.0000   0.0000          ?        ?   103.4405  14.6860          ?        ?      101.5        7.2       ?       ? 
1 1 1   45   14   33 o    115.0    6.4    0.0000   0.0000          ?        ?   132.8125  14.6860          ?        ?      115.0        6.4       ?       ? 
1 1 1   45   14   34 o     34.7   14.1    0.0000   0.0000          ?        ?     5.1082  15.3245          ?        ?       34.7       14.1       ?       ? 
1 1 1   45   14   35 f    355.4    2.9    0.0000   0.0000          ?        ?  1264.2728  20.4327          ?        ?      355.4        2.9       ?       ? 
1 1 1   45   14   36 o    215.0    3.9    0.0000   0.0000          ?        ?   462.9282  16.6016          ?        ?      215.0        3.9       ?       ? 
1 1 1   45   14   37 o    144.1    5.5    0.0000   0.0000          ?        ?   208.1580  15.9630          ?        ?      144.1        5.5       ?       ? 
1 1 1   45   14   38 o    218.5    3.8    0.0000   0.0000          ?        ?   478.2527  16.6016          ?        ?      218.5        3.8       ?       ? 
1 1 1   45   14   39 o    283.8    3.4    0.0000   0.0000          ?        ?   806.4528  19.1556          ?        ?      283.8        3.4       ?       ? 
1 1 1   45   14   40 o    135.3    6.1    0.0000   0.0000          ?        ?   183.8942  16.6016          ?        ?      135.3        6.1       ?       ? 
1 1 1   45   14   41 o     86.7    9.6    0.0000   0.0000          ?        ?    75.9841  16.6016          ?        ?       86.7        9.6       ?       ? 
1 1 1   45   14   42 o    205.8    4.0    0.0000   0.0000          ?        ?   424.6169  16.6016          ?        ?      205.8        4.0       ?       ? 
1 1 1   45   14   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45   14   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45   14   45 o    133.3    6.2    0.0000   0.0000          ?        ?   178.7861  16.6016          ?        ?      133.3        6.2       ?       ? 
1 1 1   45   14   46 o    321.5    3.2    0.0000   0.0000          ?        ?  1035.6820  20.4327          ?        ?      321.5        3.2       ?       ? 
1 1 1   45   14   47 o    162.7    5.5    0.0000   0.0000          ?        ?   266.2635  17.8786          ?        ?      162.7        5.5       ?       ? 
1 1 1   45   14   48 o     78.6   11.0    0.0000   0.0000          ?        ?    63.2136  17.2401          ?        ?       78.6       11.0       ?       ? 
1 1 1   45   14   49 o    227.0    4.2    0.0000   0.0000          ?        ?   517.2025  19.1556          ?        ?      227.0        4.2       ?       ? 
1 1 1   45   15    0 o     77.2   14.2   65.1292  19.7942    65.1292  19.7942    65.1292  19.7942       77.2     14.2       77.2       14.2     0.0     0.0 
1 1 1   45   15    1 o    264.1    3.5    0.0000   0.0000          ?        ?   697.9042  18.5171          ?        ?      264.1        3.5       ?       ? 
1 1 1   45   15    2 o    173.0    4.1    0.0000   0.0000          ?        ?   299.4666  14.0475          ?        ?      173.0        4.1       ?       ? 
1 1 1   45   15    3 o    376.1    3.1    0.0000   0.0000          ?        ?  1415.6024  23.6253          ?        ?      376.1        3.1       ?       ? 
1 1 1   45   15    4 o    287.3    3.2    0.0000   0.0000          ?        ?   825.6085  18.5171          ?        ?      287.3        3.2       ?       ? 
1 1 1   45   15    5 o    498.4    3.3    0.0000   0.0000          ?        ?  2485.1262  33.2031          ?        ?      498.4        3.3       ?       ? 
1 1 1   45   15    6 o    404.0    2.8    0.0000   0.0000          ?        ?  1632.6998  22.3483          ?        ?      404.0        2.8       ?       ? 
1 1 1   45   15    7 o    174.6    3.8    0.0000   0.0000          ?        ?   305.2133  13.4090          ?        ?      174.6        3.8       ?       ? 
1 1 1   45   15    8 o    103.2    5.6    0.0000   0.0000          ?        ?   106.6331  11.4934          ?        ?      103.2        5.6       ?       ? 
1 1 1   45   15    9 o     16.6    8.3    0.0000   0.0000          ?        ?   -31.9261  11.4934          ?        ?       16.6        8.3       ?       ? 
1 1 1   45   15   10 o    218.1    2.9    0.0000   0.0000          ?        ?   475.6986  12.7704          ?        ?      218.1        2.9       ?       ? 
1 1 1   45   15   11 o    165.6    3.5    0.0000   0.0000          ?        ?   274.5643  11.4934          ?        ?      165.6        3.5       ?       ? 
1 1 1   45   15   12 o     66.3    7.2    0.0000   0.0000          ?        ?    44.0580   9.5778          ?        ?       66.3        7.2       ?       ? 
1 1 1   45   15   13 o    299.0    2.7    0.0000   0.0000          ?        ?   894.5688  15.9630          ?        ?      299.0        2.7       ?       ? 
1 1 1   45   15   14 o    353.2    2.6    0.0000   0.0000          ?        ?  1248.3098  18.5171          ?        ?      353.2        2.6       ?       ? 
1 1 1   45   15   15 f    418.3    2.7    0.0000   0.0000          ?        ?  1750.1879  22.9868          ?        ?      418.3        2.7       ?       ? 
1 1 1   45   15   16 o    275.0    2.9    0.0000   0.0000          ?        ?   756.6481  15.9630          ?        ?      275.0        2.9       ?       ? 
1 1 1   45   15   17 o    454.1    2.5    0.0000   0.0000          ?        ?  2062.4248  22.9868          ?        ?      454.1        2.5       ?       ? 
1 1 1   45   15   18 o    322.9    2.9    0.0000   0.0000          ?        ?  1043.3442  18.5171          ?        ?      322.9        2.9       ?       ? 
1 1 1   45   15   19 o    610.2    3.1    0.0000   0.0000          ?        ?  3725.1353  37.6728          ?        ?      610.2        3.1       ?       ? 
1 1 1   45   15   20 o    170.5    4.1    0.0000   0.0000          ?        ?   291.1659  14.0475          ?        ?      170.5        4.1       ?       ? 
1 1 1   45   15   21 o    170.2    4.3    0.0000   0.0000          ?        ?   289.8888  14.6860          ?        ?      170.2        4.3       ?       ? 
1 1 1   45   15   22 o    102.8    6.8    0.0000   0.0000          ?        ?   105.9946  14.0475          ?        ?      102.8        6.8       ?       ? 
1 1 1   45   15   23 o    365.3    2.7    0.0000   0.0000          ?        ?  1335.1488  19.7942          ?        ?      365.3        2.7       ?       ? 
1 1 1   45   15   24 o    321.8    2.8    0.0000   0.0000          ?        ?  1036.3207  17.8786          ?        ?      321.8        2.8       ?       ? 
1 1 1   45   15   25 o    223.4    3.1    0.0000   0.0000          ?        ?   499.3239  14.0475          ?        ?      223.4        3.1       ?       ? 
1 1 1   45   15   26 o    392.8    2.6    0.0000   0.0000          ?        ?  1543.9453  20.4327          ?        ?      392.8        2.6       ?       ? 
1 1 1   45   15   27 o     72.1    9.3    0.0000   0.0000          ?        ?    52.3588  13.4090          ?        ?       72.1        9.3       ?       ? 
1 1 1   45   15   28 o    211.7    3.9    0.0000   0.0000          ?        ?   448.8807  16.6016          ?        ?      211.7        3.9       ?       ? 
1 1 1   45   15   29 o    306.4    2.9    0.0000   0.0000          ?        ?   939.2654  17.8786          ?        ?      306.4        2.9       ?       ? 
1 1 1   45   15   30 o    215.5    3.6    0.0000   0.0000          ?        ?   464.8438  15.3245          ?        ?      215.5        3.6       ?       ? 
1 1 1   45   15   31 f    293.5    2.9    0.0000   0.0000          ?        ?   862.0042  17.2401          ?        ?      293.5        2.9       ?       ? 
1 1 1   45   15   32 o     31.3   13.3    0.0000   0.0000          ?        ?     0.0000  14.6860          ?        ?       31.3       13.3       ?       ? 
1 1 1   45   15   33 o    282.9    3.0    0.0000   0.0000          ?        ?   800.7061  17.2401          ?        ?      282.9        3.0       ?       ? 
1 1 1   45   15   34 o    433.9    2.6    0.0000   0.0000          ?        ?  1883.6388  22.3483          ?        ?      433.9        2.6       ?       ? 
1 1 1   45   15   35 o     44.7   15.1    0.0000   0.0000          ?        ?    19.1556  15.9630          ?        ?       44.7       15.1       ?       ? 
1 1 1   45   15   36 o     99.2    7.7    0.0000   0.0000          ?        ?    98.9709  15.3245          ?        ?       99.2        7.7       ?       ? 
1 1 1   45   15   37 o    296.9    3.1    0.0000   0.0000          ?        ?   882.4369  18.5171          ?        ?      296.9        3.1       ?       ? 
1 1 1   45   15   38 o    207.6    4.0    0.0000   0.0000          ?        ?   431.6406  16.6016          ?        ?      207.6        4.0       ?       ? 
1 1 1   45   15   39 o     23.7   11.4    0.0000   0.0000          ?        ?   -23.6253  15.9630          ?        ?       23.7       11.4       ?       ? 
1 1 1   45   15   40 o    194.8    4.4    0.0000   0.0000          ?        ?   380.5589  17.2401          ?        ?      194.8        4.4       ?       ? 
1 1 1   45   15   41 o     60.5   14.0    0.0000   0.0000          ?        ?    38.9498  16.6016          ?        ?       60.5       14.0       ?       ? 
1 1 1   45   15   42 o    110.6    7.2    0.0000   0.0000          ?        ?   123.2347  15.9630          ?        ?      110.6        7.2       ?       ? 
1 1 1   45   15   43 o     50.7   15.5    0.0000   0.0000          ?        ?    26.8179  17.2401          ?        ?       50.7       15.5       ?       ? 
1 1 1   45   15   44 o     93.9    9.2    0.0000   0.0000          ?        ?    89.3930  17.2401          ?        ?       93.9        9.2       ?       ? 
1 1 1   45   15   45 o    194.7    4.6    0.0000   0.0000          ?        ?   380.5589  17.8786          ?        ?      194.7        4.6       ?       ? 
1 1 1   45   15   46 o     29.2   13.3    0.0000   0.0000          ?        ?   -10.2163  17.2401          ?        ?       29.2       13.3       ?       ? 
1 1 1   45   15   47 o     30.4   13.6    0.0000   0.0000          ?        ?    -7.0237  17.2401          ?        ?       30.4       13.6       ?       ? 
1 1 1   45   15   48 o     27.1   12.7    0.0000   0.0000          ?        ?   -15.9630  17.2401          ?        ?       27.1       12.7       ?       ? 
1 1 1   45   16    0 o    140.8    7.8  200.4958  21.7097   200.4958  21.7097   200.4958  21.7097      140.8      7.8      140.8        7.8     0.0     0.0 
1 1 1   45   16    1 o     25.3   11.8    0.0000   0.0000          ?        ?   -14.0475  14.6860          ?        ?       25.3       11.8       ?       ? 
1 1 1   45   16    2 o    125.2    5.9    0.0000   0.0000          ?        ?   157.0763  14.6860          ?        ?      125.2        5.9       ?       ? 
1 1 1   45   16    3 o    120.8    6.1    0.0000   0.0000          ?        ?   146.2215  14.6860          ?        ?      120.8        6.1       ?       ? 
1 1 1   45   16    4 o     60.6   12.0    0.0000   0.0000          ?        ?    38.3113  14.0475          ?        ?       60.6       12.0       ?       ? 
1 1 1   45   16    5 f     22.5   10.8    0.0000   0.0000          ?        ?   -20.4327  14.0475          ?        ?       22.5       10.8       ?       ? 
1 1 1   45   16    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45   16    7 o     86.3    6.3    0.0000   0.0000          ?        ?    74.7070  10.8549          ?        ?       86.3        6.3       ?       ? 
1 1 1   45   16    8 o    423.0    2.9    0.0000   0.0000          ?        ?  1789.7760  24.2638          ?        ?      423.0        2.9       ?       ? 
1 1 1   45   16    9 o    255.9    2.9    0.0000   0.0000          ?        ?   655.1232  14.6860          ?        ?      255.9        2.9       ?       ? 
1 1 1   45   16   10 o     94.8    6.1    0.0000   0.0000          ?        ?    90.0316  11.4934          ?        ?       94.8        6.1       ?       ? 
1 1 1   45   16   11 o    156.9    4.7    0.0000   0.0000          ?        ?   246.4693  14.6860          ?        ?      156.9        4.7       ?       ? 
1 1 1   45   16   12 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45   16   13 o    314.4    2.9    0.0000   0.0000          ?        ?   989.0699  18.5171          ?        ?      314.4        2.9       ?       ? 
1 1 1   45   16   14 o    266.8    2.9    0.0000   0.0000          ?        ?   711.9516  15.3245          ?        ?      266.8        2.9       ?       ? 
1 1 1   45   16   15 o    233.7    2.9    0.0000   0.0000          ?        ?   546.5745  13.4090          ?        ?      233.7        2.9       ?       ? 
1 1 1   45   16   16 o    318.0    3.0    0.0000   0.0000          ?        ?  1012.0568  19.1556          ?        ?      318.0        3.0       ?       ? 
1 1 1   45   16   17 o    344.2    2.6    0.0000   0.0000          ?        ?  1185.0962  17.8786          ?        ?      344.2        2.6       ?       ? 
1 1 1   45   16   18 o    298.7    2.8    0.0000   0.0000          ?        ?   892.6533  16.6016          ?        ?      298.7        2.8       ?       ? 
1 1 1   45   16   19 o     91.0    6.7    0.0000   0.0000          ?        ?    83.0078  12.1319          ?        ?       91.0        6.7       ?       ? 
1 1 1   45   16   20 o    296.6    2.8    0.0000   0.0000          ?        ?   879.8828  16.6016          ?        ?      296.6        2.8       ?       ? 
1 1 1   45   16   21 o     60.7   11.5    0.0000   0.0000          ?        ?    38.3113  13.4090          ?        ?       60.7       11.5       ?       ? 
1 1 1   45   16   22 o    325.5    2.7    0.0000   0.0000          ?        ?  1059.9459  17.8786          ?        ?      325.5        2.7       ?       ? 
1 1 1   45   16   23 o     73.0    9.2    0.0000   0.0000          ?        ?    53.6358  13.4090          ?        ?       73.0        9.2       ?       ? 
1 1 1   45   16   24 o    292.6    2.9    0.0000   0.0000          ?        ?   856.8960  17.2401          ?        ?      292.6        2.9       ?       ? 
1 1 1   45   16   25 o     30.3   13.0    0.0000   0.0000          ?        ?    -0.6385  14.0475          ?        ?       30.3       13.0       ?       ? 
1 1 1   45   16   26 o    132.4    5.3    0.0000   0.0000          ?        ?   175.5934  14.0475          ?        ?      132.4        5.3       ?       ? 
1 1 1   45   16   27 o    125.2    5.9    0.0000   0.0000          ?        ?   157.0763  14.6860          ?        ?      125.2        5.9       ?       ? 
1 1 1   45   16   28 o    161.9    4.5    0.0000   0.0000          ?        ?   262.4324  14.6860          ?        ?      161.9        4.5       ?       ? 
1 1 1   45   16   29 o    290.0    3.0    0.0000   0.0000          ?        ?   841.5715  17.2401          ?        ?      290.0        3.0       ?       ? 
1 1 1   45   16   30 o    143.9    5.3    0.0000   0.0000          ?        ?   207.5195  15.3245          ?        ?      143.9        5.3       ?       ? 
1 1 1   45   16   31 o    304.6    2.9    0.0000   0.0000          ?        ?   928.4104  17.8786          ?        ?      304.6        2.9       ?       ? 
1 1 1   45   16   32 o    178.7    4.3    0.0000   0.0000          ?        ?   319.8993  15.3245          ?        ?      178.7        4.3       ?       ? 
1 1 1   45   16   33 o    291.4    3.0    0.0000   0.0000          ?        ?   849.8723  17.2401          ?        ?      291.4        3.0       ?       ? 
1 1 1   45   16   34 o    115.8    6.9    0.0000   0.0000          ?        ?   134.7281  15.9630          ?        ?      115.8        6.9       ?       ? 
1 1 1   45   16   35 o    343.2    2.8    0.0000   0.0000          ?        ?  1178.7109  19.1556          ?        ?      343.2        2.8       ?       ? 
1 1 1   45   16   36 o     61.7   13.3    0.0000   0.0000          ?        ?    40.2269  15.9630          ?        ?       61.7       13.3       ?       ? 
1 1 1   45   16   37 o     75.7   11.0    0.0000   0.0000          ?        ?    58.1055  16.6016          ?        ?       75.7       11.0       ?       ? 
1 1 1   45   16   38 o    122.4    6.5    0.0000   0.0000          ?        ?   150.6911  15.9630          ?        ?      122.4        6.5       ?       ? 
1 1 1   45   16   39 o    267.7    3.3    0.0000   0.0000          ?        ?   717.6983  17.8786          ?        ?      267.7        3.3       ?       ? 
1 1 1   45   16   40 o    258.8    3.6    0.0000   0.0000          ?        ?   671.0862  18.5171          ?        ?      258.8        3.6       ?       ? 
1 1 1   45   16   41 o     87.3    9.5    0.0000   0.0000          ?        ?    77.2611  16.6016          ?        ?       87.3        9.5       ?       ? 
1 1 1   45   16   42 o    183.8    4.7    0.0000   0.0000          ?        ?   339.0550  17.2401          ?        ?      183.8        4.7       ?       ? 
1 1 1   45   16   43 o    205.4    4.4    0.0000   0.0000          ?        ?   423.3398  17.8786          ?        ?      205.4        4.4       ?       ? 
1 1 1   45   16   44 o    247.8    3.6    0.0000   0.0000          ?        ?   615.5349  17.8786          ?        ?      247.8        3.6       ?       ? 
1 1 1   45   16   45 o    194.7    4.4    0.0000   0.0000          ?        ?   380.5589  17.2401          ?        ?      194.7        4.4       ?       ? 
1 1 1   45   16   46 o     72.3   11.5    0.0000   0.0000          ?        ?    53.6358  16.6016          ?        ?       72.3       11.5       ?       ? 
1 1 1   45   16   47 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45   17    0 o     38.3   21.1   21.0712  22.9868    21.0712  22.9868    21.0712  22.9868       38.3     21.1       38.3       21.1     0.0     0.0 
1 1 1   45   17    1 o    377.5    3.3    0.0000   0.0000          ?        ?  1425.8188  24.9023          ?        ?      377.5        3.3       ?       ? 
1 1 1   45   17    2 o    159.5    5.0    0.0000   0.0000          ?        ?   254.7701  15.9630          ?        ?      159.5        5.0       ?       ? 
1 1 1   45   17    3 o    373.1    3.3    0.0000   0.0000          ?        ?  1393.2542  24.2638          ?        ?      373.1        3.3       ?       ? 
1 1 1   45   17    4 o    286.5    3.3    0.0000   0.0000          ?        ?   821.1389  19.1556          ?        ?      286.5        3.3       ?       ? 
1 1 1   45   17    5 o    110.9    6.6    0.0000   0.0000          ?        ?   123.2347  14.6860          ?        ?      110.9        6.6       ?       ? 
1 1 1   45   17    6 f    300.9    3.4    0.0000   0.0000          ?        ?   906.0621  20.4327          ?        ?      300.9        3.4       ?       ? 
1 1 1   45   17    7 o    288.7    3.3    0.0000   0.0000          ?        ?   833.9093  19.1556          ?        ?      288.7        3.3       ?       ? 
1 1 1   45   17    8 o    259.3    3.2    0.0000   0.0000          ?        ?   673.0018  16.6016          ?        ?      259.3        3.2       ?       ? 
1 1 1   45   17    9 o    302.4    2.9    0.0000   0.0000          ?        ?   915.0015  17.2401          ?        ?      302.4        2.9       ?       ? 
1 1 1   45   17   10 o    231.8    3.3    0.0000   0.0000          ?        ?   537.6352  15.3245          ?        ?      231.8        3.3       ?       ? 
1 1 1   45   17   11 o     88.1    6.9    0.0000   0.0000          ?        ?    77.8996  12.1319          ?        ?       88.1        6.9       ?       ? 
1 1 1   45   17   12 o    211.0    3.6    0.0000   0.0000          ?        ?   445.6881  15.3245          ?        ?      211.0        3.6       ?       ? 
1 1 1   45   17   13 o    209.2    4.1    0.0000   0.0000          ?        ?   438.0258  17.2401          ?        ?      209.2        4.1       ?       ? 
1 1 1   45   17   14 o    132.2    3.6    0.0000   0.0000          ?        ?   174.9549   9.5778          ?        ?      132.2        3.6       ?       ? 
1 1 1   45   17   15 o    198.4    3.4    0.0000   0.0000          ?        ?   393.9678  13.4090          ?        ?      198.4        3.4       ?       ? 
1 1 1   45   17   16 o    284.7    3.0    0.0000   0.0000          ?        ?   810.9225  17.2401          ?        ?      284.7        3.0       ?       ? 
1 1 1   45   17   17 o    153.8    4.6    0.0000   0.0000          ?        ?   236.8915  14.0475          ?        ?      153.8        4.6       ?       ? 
1 1 1   45   17   18 o    390.0    2.9    0.0000   0.0000          ?        ?  1521.5970  22.3483          ?        ?      390.0        2.9       ?       ? 
1 1 1   45   17   19 o    330.6    2.6    0.0000   0.0000          ?        ?  1093.7876  17.2401          ?        ?      330.6        2.6       ?       ? 
1 1 1   45   17   20 o    169.6    3.8    0.0000   0.0000          ?        ?   287.9732  12.7704          ?        ?      169.6        3.8       ?       ? 
1 1 1   45   17   21 o    131.7    4.8    0.0000   0.0000          ?        ?   173.6779  12.7704          ?        ?      131.7        4.8       ?       ? 
1 1 1   45   17   22 o    236.2    3.1    0.0000   0.0000          ?        ?   558.0679  14.6860          ?        ?      236.2        3.1       ?       ? 
1 1 1   45   17   23 o    132.9    5.0    0.0000   0.0000          ?        ?   176.8705  13.4090          ?        ?      132.9        5.0       ?       ? 
1 1 1   45   17   24 o     18.6    9.3    0.0000   0.0000          ?        ?   -33.2031  13.4090          ?        ?       18.6        9.3       ?       ? 
1 1 1   45   17   25 f    191.7    3.7    0.0000   0.0000          ?        ?   367.7885  14.0475          ?        ?      191.7        3.7       ?       ? 
1 1 1   45   17   26 o    173.7    4.2    0.0000   0.0000          ?        ?   302.0207  14.6860          ?        ?      173.7        4.2       ?       ? 
1 1 1   45   17   27 o    187.5    3.9    0.0000   0.0000          ?        ?   351.8254  14.6860          ?        ?      187.5        3.9       ?       ? 
1 1 1   45   17   28 f    346.0    2.6    0.0000   0.0000          ?        ?  1197.8666  17.8786          ?        ?      346.0        2.6       ?       ? 
1 1 1   45   17   29 o    163.0    4.7    0.0000   0.0000          ?        ?   266.2635  15.3245          ?        ?      163.0        4.7       ?       ? 
1 1 1   45   17   30 o    166.7    4.4    0.0000   0.0000          ?        ?   278.3954  14.6860          ?        ?      166.7        4.4       ?       ? 
1 1 1   45   17   31 f     52.2   13.8    0.0000   0.0000          ?        ?    28.7335  14.6860          ?        ?       52.2       13.8       ?       ? 
1 1 1   45   17   32 f    344.7    2.7    0.0000   0.0000          ?        ?  1188.9272  18.5171          ?        ?      344.7        2.7       ?       ? 
1 1 1   45   17   33 o    246.5    3.4    0.0000   0.0000          ?        ?   608.5111  16.6016          ?        ?      246.5        3.4       ?       ? 
1 1 1   45   17   34 f     64.8   12.3    0.0000   0.0000          ?        ?    44.0580  15.3245          ?        ?       64.8       12.3       ?       ? 
1 1 1   45   17   35 o     53.3   15.0    0.0000   0.0000          ?        ?    30.0105  16.6016          ?        ?       53.3       15.0       ?       ? 
1 1 1   45   17   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45   17   37 o     91.4    8.7    0.0000   0.0000          ?        ?    84.2849  15.9630          ?        ?       91.4        8.7       ?       ? 
1 1 1   45   17   38 o    168.6    5.3    0.0000   0.0000          ?        ?   285.4192  17.8786          ?        ?      168.6        5.3       ?       ? 
1 1 1   45   17   39 o     25.1   11.9    0.0000   0.0000          ?        ?   -18.5171  15.9630          ?        ?       25.1       11.9       ?       ? 
1 1 1   45   17   40 o    109.1    7.3    0.0000   0.0000          ?        ?   120.0421  15.9630          ?        ?      109.1        7.3       ?       ? 
1 1 1   45   17   41 o    317.6    3.0    0.0000   0.0000          ?        ?  1010.1412  19.1556          ?        ?      317.6        3.0       ?       ? 
1 1 1   45   17   42 o    182.8    4.5    0.0000   0.0000          ?        ?   335.2238  16.6016          ?        ?      182.8        4.5       ?       ? 
1 1 1   45   17   43 o    136.8    6.3    0.0000   0.0000          ?        ?   188.3639  17.2401          ?        ?      136.8        6.3       ?       ? 
1 1 1   45   17   44 o    168.3    5.1    0.0000   0.0000          ?        ?   284.7806  17.2401          ?        ?      168.3        5.1       ?       ? 
1 1 1   45   17   45 o    118.4    7.3    0.0000   0.0000          ?        ?   141.7518  17.2401          ?        ?      118.4        7.3       ?       ? 
1 1 1   45   18    0 o     70.4   16.7   57.4669  20.4327    57.4669  20.4327    57.4669  20.4327       70.4     16.7       70.4       16.7     0.0     0.0 
1 1 1   45   18    1 o    247.5    3.7    0.0000   0.0000          ?        ?   612.9808  18.5171          ?        ?      247.5        3.7       ?       ? 
1 1 1   45   18    2 o    376.2    3.6    0.0000   0.0000          ?        ?  1416.2410  26.8179          ?        ?      376.2        3.6       ?       ? 
1 1 1   45   18    3 o     87.7    7.6    0.0000   0.0000          ?        ?    77.2611  13.4090          ?        ?       87.7        7.6       ?       ? 
1 1 1   45   18    4 o    316.3    3.7    0.0000   0.0000          ?        ?  1001.2019  23.6253          ?        ?      316.3        3.7       ?       ? 
1 1 1   45   18    5 o    198.9    4.3    0.0000   0.0000          ?        ?   395.8834  17.2401          ?        ?      198.9        4.3       ?       ? 
1 1 1   45   18    6 o    124.7    5.9    0.0000   0.0000          ?        ?   155.7993  14.6860          ?        ?      124.7        5.9       ?       ? 
1 1 1   45   18    7 o    159.5    5.0    0.0000   0.0000          ?        ?   254.7701  15.9630          ?        ?      159.5        5.0       ?       ? 
1 1 1   45   18    8 o    235.4    4.1    0.0000   0.0000          ?        ?   554.8753  19.1556          ?        ?      235.4        4.1       ?       ? 
1 1 1   45   18    9 o    401.2    2.9    0.0000   0.0000          ?        ?  1610.3516  22.9868          ?        ?      401.2        2.9       ?       ? 
1 1 1   45   18   10 o    141.1    4.3    0.0000   0.0000          ?        ?   199.2188  12.1319          ?        ?      141.1        4.3       ?       ? 
1 1 1   45   18   11 o    469.8    3.1    0.0000   0.0000          ?        ?  2208.0078  28.7335          ?        ?      469.8        3.1       ?       ? 
1 1 1   45   18   12 o    434.3    2.9    0.0000   0.0000          ?        ?  1887.4700  24.9023          ?        ?      434.3        2.9       ?       ? 
1 1 1   45   18   13 o     21.8   10.4    0.0000   0.0000          ?        ?   -17.2401  12.7704          ?        ?       21.8       10.4       ?       ? 
1 1 1   45   18   14 o    384.5    3.4    0.0000   0.0000          ?        ?  1479.4546  26.1794          ?        ?      384.5        3.4       ?       ? 
1 1 1   45   18   15 o    364.4    3.0    0.0000   0.0000          ?        ?  1328.7635  21.7097          ?        ?      364.4        3.0       ?       ? 
1 1 1   45   18   16 f    142.0    3.6    0.0000   0.0000          ?        ?   201.7728  10.2163          ?        ?      142.0        3.6       ?       ? 
1 1 1   45   18   17 o    200.3    3.2    0.0000   0.0000          ?        ?   401.6301  12.7704          ?        ?      200.3        3.2       ?       ? 
1 1 1   45   18   18 o    171.1    4.3    0.0000   0.0000          ?        ?   293.0815  14.6860          ?        ?      171.1        4.3       ?       ? 
1 1 1   45   18   19 o    226.6    3.5    0.0000   0.0000          ?        ?   514.0099  15.9630          ?        ?      226.6        3.5       ?       ? 
1 1 1   45   18   20 o    545.6    2.9    0.0000   0.0000          ?        ?  2978.7034  31.9261          ?        ?      545.6        2.9       ?       ? 
1 1 1   45   18   21 o    203.5    3.8    0.0000   0.0000          ?        ?   414.4005  15.3245          ?        ?      203.5        3.8       ?       ? 
1 1 1   45   18   22 o    325.8    2.8    0.0000   0.0000          ?        ?  1061.8615  18.5171          ?        ?      325.8        2.8       ?       ? 
1 1 1   45   18   23 o    400.6    2.6    0.0000   0.0000          ?        ?  1605.2433  20.4327          ?        ?      400.6        2.6       ?       ? 
1 1 1   45   18   24 o    226.9    3.2    0.0000   0.0000          ?        ?   515.2869  14.6860          ?        ?      226.9        3.2       ?       ? 
1 1 1   45   18   25 o    283.0    3.0    0.0000   0.0000          ?        ?   801.3447  17.2401          ?        ?      283.0        3.0       ?       ? 
1 1 1   45   18   26 o    312.4    2.8    0.0000   0.0000          ?        ?   976.2995  17.2401          ?        ?      312.4        2.8       ?       ? 
1 1 1   45   18   27 o    229.6    3.2    0.0000   0.0000          ?        ?   527.4188  14.6860          ?        ?      229.6        3.2       ?       ? 
1 1 1   45   18   28 o    313.0    2.9    0.0000   0.0000          ?        ?   980.1307  17.8786          ?        ?      313.0        2.9       ?       ? 
1 1 1   45   18   29 o    306.1    2.7    0.0000   0.0000          ?        ?   937.3498  16.6016          ?        ?      306.1        2.7       ?       ? 
1 1 1   45   18   30 o    207.0    3.9    0.0000   0.0000          ?        ?   429.0865  15.9630          ?        ?      207.0        3.9       ?       ? 
1 1 1   45   18   31 f    149.3    5.1    0.0000   0.0000          ?        ?   223.4826  15.3245          ?        ?      149.3        5.1       ?       ? 
1 1 1   45   18   32 o    258.0    3.2    0.0000   0.0000          ?        ?   666.6166  16.6016          ?        ?      258.0        3.2       ?       ? 
1 1 1   45   18   33 o     19.1    9.6    0.0000   0.0000          ?        ?   -42.1424  15.3245          ?        ?       19.1        9.6       ?       ? 
1 1 1   45   18   34 o    144.0    5.5    0.0000   0.0000          ?        ?   208.1580  15.9630          ?        ?      144.0        5.5       ?       ? 
1 1 1   45   18   35 o    132.9    6.0    0.0000   0.0000          ?        ?   177.5090  15.9630          ?        ?      132.9        6.0       ?       ? 
1 1 1   45   18   36 f     54.8   14.4    0.0000   0.0000          ?        ?    31.9261  15.9630          ?        ?       54.8       14.4       ?       ? 
1 1 1   45   18   37 o    182.7    4.5    0.0000   0.0000          ?        ?   334.5853  16.6016          ?        ?      182.7        4.5       ?       ? 
1 1 1   45   18   38 f    226.1    3.7    0.0000   0.0000          ?        ?   512.0943  16.6016          ?        ?      226.1        3.7       ?       ? 
1 1 1   45   18   39 o     71.6   11.6    0.0000   0.0000          ?        ?    52.3588  16.6016          ?        ?       71.6       11.6       ?       ? 
1 1 1   45   18   40 o    169.0    5.1    0.0000   0.0000          ?        ?   286.6962  17.2401          ?        ?      169.0        5.1       ?       ? 
1 1 1   45   18   41 o     43.2   15.3    0.0000   0.0000          ?        ?    17.2401  16.6016          ?        ?       43.2       15.3       ?       ? 
1 1 1   45   18   42 o     52.9   15.0    0.0000   0.0000          ?        ?    30.0105  16.6016          ?        ?       52.9       15.0       ?       ? 
1 1 1   45   18   43 o    109.6    7.3    0.0000   0.0000          ?        ?   121.3191  15.9630          ?        ?      109.6        7.3       ?       ? 
1 1 1   45   18   44 o    104.7    7.9    0.0000   0.0000          ?        ?   111.1028  16.6016          ?        ?      104.7        7.9       ?       ? 
1 1 1   45   19    0 o    492.2    5.0 2425.7437  49.1662  2425.7437  49.1662  2425.7437  49.1662      492.2      5.0      492.2        5.0     0.0     0.0 
1 1 1   45   19    1 o    150.4    5.1    0.0000   0.0000          ?        ?   226.6752  15.3245          ?        ?      150.4        5.1       ?       ? 
1 1 1   45   19    2 o    311.9    3.9    0.0000   0.0000          ?        ?   973.7455  24.2638          ?        ?      311.9        3.9       ?       ? 
1 1 1   45   19    3 o    217.7    4.1    0.0000   0.0000          ?        ?   474.4216  17.8786          ?        ?      217.7        4.1       ?       ? 
1 1 1   45   19    4 o    175.2    4.2    0.0000   0.0000          ?        ?   307.1289  14.6860          ?        ?      175.2        4.2       ?       ? 
1 1 1   45   19    5 o    125.7    6.1    0.0000   0.0000          ?        ?   158.3534  15.3245          ?        ?      125.7        6.1       ?       ? 
1 1 1   45   19    6 o    376.7    3.8    0.0000   0.0000          ?        ?  1420.7106  28.7335          ?        ?      376.7        3.8       ?       ? 
1 1 1   45   19    7 o    311.0    3.7    0.0000   0.0000          ?        ?   967.9988  22.9868          ?        ?      311.0        3.7       ?       ? 
1 1 1   45   19    8 o    158.0    5.7    0.0000   0.0000          ?        ?   250.3005  17.8786          ?        ?      158.0        5.7       ?       ? 
1 1 1   45   19    9 o    331.9    3.8    0.0000   0.0000          ?        ?  1102.7268  24.9023          ?        ?      331.9        3.8       ?       ? 
1 1 1   45   19   10 o    315.3    3.1    0.0000   0.0000          ?        ?   994.8167  19.7942          ?        ?      315.3        3.1       ?       ? 
1 1 1   45   19   11 o     92.4    6.6    0.0000   0.0000          ?        ?    85.5619  12.1319          ?        ?       92.4        6.6       ?       ? 
1 1 1   45   19   12 o    284.8    3.0    0.0000   0.0000          ?        ?   811.5610  17.2401          ?        ?      284.8        3.0       ?       ? 
1 1 1   45   19   13 o    618.8    3.4    0.0000   0.0000          ?        ?  3831.7681  42.1424          ?        ?      618.8        3.4       ?       ? 
1 1 1   45   19   14 o     47.6   14.7    0.0000   0.0000          ?        ?    22.9868  15.3245          ?        ?       47.6       14.7       ?       ? 
1 1 1   45   19   15 o    227.0    3.9    0.0000   0.0000          ?        ?   515.9255  17.8786          ?        ?      227.0        3.9       ?       ? 
1 1 1   45   19   16 o     85.5    7.8    0.0000   0.0000          ?        ?    73.4300  13.4090          ?        ?       85.5        7.8       ?       ? 
1 1 1   45   19   17 o    353.4    2.6    0.0000   0.0000          ?        ?  1249.5868  18.5171          ?        ?      353.4        2.6       ?       ? 
1 1 1   45   19   18 o    241.8    2.9    0.0000   0.0000          ?        ?   584.8858  14.0475          ?        ?      241.8        2.9       ?       ? 
1 1 1   45   19   19 o    195.6    3.4    0.0000   0.0000          ?        ?   383.1130  13.4090          ?        ?      195.6        3.4       ?       ? 
1 1 1   45   19   20 o    242.9    3.0    0.0000   0.0000          ?        ?   590.6325  14.6860          ?        ?      242.9        3.0       ?       ? 
1 1 1   45   19   21 o    160.3    4.0    0.0000   0.0000          ?        ?   257.3242  12.7704          ?        ?      160.3        4.0       ?       ? 
1 1 1   45   19   22 o    291.0    3.0    0.0000   0.0000          ?        ?   847.3182  17.2401          ?        ?      291.0        3.0       ?       ? 
1 1 1   45   19   23 o    192.0    3.7    0.0000   0.0000          ?        ?   369.0655  14.0475          ?        ?      192.0        3.7       ?       ? 
1 1 1   45   19   24 o    223.5    3.4    0.0000   0.0000          ?        ?   499.9625  15.3245          ?        ?      223.5        3.4       ?       ? 
1 1 1   45   19   25 o     18.2    9.2    0.0000   0.0000          ?        ?   -43.4195  14.6860          ?        ?       18.2        9.2       ?       ? 
1 1 1   45   19   26 o    212.9    3.6    0.0000   0.0000          ?        ?   453.9889  15.3245          ?        ?      212.9        3.6       ?       ? 
1 1 1   45   19   27 o    114.2    6.2    0.0000   0.0000          ?        ?   130.8969  14.0475          ?        ?      114.2        6.2       ?       ? 
1 1 1   45   19   28 o    123.6    5.7    0.0000   0.0000          ?        ?   153.2452  14.0475          ?        ?      123.6        5.7       ?       ? 
1 1 1   45   19   29 o     62.4   12.2    0.0000   0.0000          ?        ?    40.8654  14.6860          ?        ?       62.4       12.2       ?       ? 
1 1 1   45   19   30 o     34.7   13.7    0.0000   0.0000          ?        ?     7.0237  14.0475          ?        ?       34.7       13.7       ?       ? 
1 1 1   45   19   31 o     20.3    9.9    0.0000   0.0000          ?        ?   -25.5409  13.4090          ?        ?       20.3        9.9       ?       ? 
1 1 1   45   19   32 o    163.3    4.9    0.0000   0.0000          ?        ?   267.5406  15.9630          ?        ?      163.3        4.9       ?       ? 
1 1 1   45   19   33 o    262.0    3.2    0.0000   0.0000          ?        ?   687.0493  16.6016          ?        ?      262.0        3.2       ?       ? 
1 1 1   45   19   34 o     27.8   12.6    0.0000   0.0000          ?        ?    -8.9393  15.3245          ?        ?       27.8       12.6       ?       ? 
1 1 1   45   19   35 o     26.3   12.2    0.0000   0.0000          ?        ?   -12.7704  15.3245          ?        ?       26.3       12.2       ?       ? 
1 1 1   45   19   36 o    187.8    4.4    0.0000   0.0000          ?        ?   353.7410  16.6016          ?        ?      187.8        4.4       ?       ? 
1 1 1   45   19   37 o    348.5    2.9    0.0000   0.0000          ?        ?  1215.7451  20.4327          ?        ?      348.5        2.9       ?       ? 
1 1 1   45   19   38 o     97.0    8.6    0.0000   0.0000          ?        ?    95.1397  16.6016          ?        ?       97.0        8.6       ?       ? 
1 1 1   45   19   39 o    182.4    4.7    0.0000   0.0000          ?        ?   333.9468  17.2401          ?        ?      182.4        4.7       ?       ? 
1 1 1   45   19   40 o     22.2   10.9    0.0000   0.0000          ?        ?   -29.3720  15.9630          ?        ?       22.2       10.9       ?       ? 
1 1 1   45   19   41 o     57.6   14.0    0.0000   0.0000          ?        ?    35.7572  15.9630          ?        ?       57.6       14.0       ?       ? 
1 1 1   45   19   42 o    154.1    5.4    0.0000   0.0000          ?        ?   238.8071  16.6016          ?        ?      154.1        5.4       ?       ? 
1 1 1   45   20    0 o     65.8   17.5   51.7203  19.7942    51.7203  19.7942    51.7203  19.7942       65.8     17.5       65.8       17.5     0.0     0.0 
1 1 1   45   20    1 o     69.0   10.2    0.0000   0.0000          ?        ?    47.8891  14.0475          ?        ?       69.0       10.2       ?       ? 
1 1 1   45   20    2 o    138.3    5.1    0.0000   0.0000          ?        ?   191.5565  14.0475          ?        ?      138.3        5.1       ?       ? 
1 1 1   45   20    3 o    240.9    3.8    0.0000   0.0000          ?        ?   581.0547  18.5171          ?        ?      240.9        3.8       ?       ? 
1 1 1   45   20    4 o    284.6    3.8    0.0000   0.0000          ?        ?   810.9225  21.7097          ?        ?      284.6        3.8       ?       ? 
1 1 1   45   20    5 o    174.0    4.6    0.0000   0.0000          ?        ?   303.2978  15.9630          ?        ?      174.0        4.6       ?       ? 
1 1 1   45   20    6 f    100.9    7.6    0.0000   0.0000          ?        ?   102.1635  15.3245          ?        ?      100.9        7.6       ?       ? 
1 1 1   45   20    7 o    231.6    4.1    0.0000   0.0000          ?        ?   536.9967  19.1556          ?        ?      231.6        4.1       ?       ? 
1 1 1   45   20    8 o    245.5    4.0    0.0000   0.0000          ?        ?   603.4030  19.7942          ?        ?      245.5        4.0       ?       ? 
1 1 1   45   20    9 o    395.1    3.9    0.0000   0.0000          ?        ?  1563.1010  30.6490          ?        ?      395.1        3.9       ?       ? 
1 1 1   45   20   10 o     71.5   14.4    0.0000   0.0000          ?        ?    53.6358  19.7942          ?        ?       71.5       14.4       ?       ? 
1 1 1   45   20   11 o    373.4    3.4    0.0000   0.0000          ?        ?  1395.1698  25.5409          ?        ?      373.4        3.4       ?       ? 
1 1 1   45   20   12 o    208.3    3.7    0.0000   0.0000          ?        ?   434.1947  15.3245          ?        ?      208.3        3.7       ?       ? 
1 1 1   45   20   13 o    180.0    4.1    0.0000   0.0000          ?        ?   324.3690  14.6860          ?        ?      180.0        4.1       ?       ? 
1 1 1   45   20   14 o    191.2    3.8    0.0000   0.0000          ?        ?   365.8729  14.6860          ?        ?      191.2        3.8       ?       ? 
1 1 1   45   20   15 o    316.8    3.1    0.0000   0.0000          ?        ?  1004.3945  19.7942          ?        ?      316.8        3.1       ?       ? 
1 1 1   45   20   16 o     88.4    8.3    0.0000   0.0000          ?        ?    78.5382  14.6860          ?        ?       88.4        8.3       ?       ? 
1 1 1   45   20   17 o    263.2    3.5    0.0000   0.0000          ?        ?   693.4344  18.5171          ?        ?      263.2        3.5       ?       ? 
1 1 1   45   20   18 o    149.2    3.6    0.0000   0.0000          ?        ?   222.8441  10.8549          ?        ?      149.2        3.6       ?       ? 
1 1 1   45   20   19 o    401.0    2.5    0.0000   0.0000          ?        ?  1609.0745  19.7942          ?        ?      401.0        2.5       ?       ? 
1 1 1   45   20   20 o    247.8    2.8    0.0000   0.0000          ?        ?   614.2578  14.0475          ?        ?      247.8        2.8       ?       ? 
1 1 1   45   20   21 o     95.7    6.0    0.0000   0.0000          ?        ?    91.9471  11.4934          ?        ?       95.7        6.0       ?       ? 
1 1 1   45   20   22 o    123.6    5.2    0.0000   0.0000          ?        ?   153.2452  12.7704          ?        ?      123.6        5.2       ?       ? 
1 1 1   45   20   23 f     21.4   10.4    0.0000   0.0000          ?        ?   -21.0712  13.4090          ?        ?       21.4       10.4       ?       ? 
1 1 1   45   20   24 o     83.2    8.1    0.0000   0.0000          ?        ?    69.5989  13.4090          ?        ?       83.2        8.1       ?       ? 
1 1 1   45   20   25 o    161.4    4.5    0.0000   0.0000          ?        ?   261.1554  14.6860          ?        ?      161.4        4.5       ?       ? 
1 1 1   45   20   26 o    113.6    6.7    0.0000   0.0000          ?        ?   129.6199  15.3245          ?        ?      113.6        6.7       ?       ? 
1 1 1   45   20   27 o    101.4    6.9    0.0000   0.0000          ?        ?   103.4405  14.0475          ?        ?      101.4        6.9       ?       ? 
1 1 1   45   20   28 o    218.7    3.5    0.0000   0.0000          ?        ?   478.8912  15.3245          ?        ?      218.7        3.5       ?       ? 
1 1 1   45   20   29 o     27.7   12.4    0.0000   0.0000          ?        ?    -5.7467  14.0475          ?        ?       27.7       12.4       ?       ? 
1 1 1   45   20   30 o     56.4   14.6    0.0000   0.0000          ?        ?    33.8416  16.6016          ?        ?       56.4       14.6       ?       ? 
1 1 1   45   20   31 o     65.7   12.1    0.0000   0.0000          ?        ?    45.3350  15.3245          ?        ?       65.7       12.1       ?       ? 
1 1 1   45   20   32 o    146.4    5.7    0.0000   0.0000          ?        ?   215.1818  16.6016          ?        ?      146.4        5.7       ?       ? 
1 1 1   45   20   33 o    346.5    2.9    0.0000   0.0000          ?        ?  1201.6976  19.7942          ?        ?      346.5        2.9       ?       ? 
1 1 1   45   20   34 f    398.7    2.6    0.0000   0.0000          ?        ?  1591.1959  21.0712          ?        ?      398.7        2.6       ?       ? 
1 1 1   45   20   35 o     70.9   10.8    0.0000   0.0000          ?        ?    51.0817  15.3245          ?        ?       70.9       10.8       ?       ? 
1 1 1   45   20   36 o     47.3   15.0    0.0000   0.0000          ?        ?    22.9868  15.9630          ?        ?       47.3       15.0       ?       ? 
1 1 1   45   20   37 o    168.8    4.5    0.0000   0.0000          ?        ?   286.0577  15.3245          ?        ?      168.8        4.5       ?       ? 
1 1 1   45   20   38 o     22.4   10.9    0.0000   0.0000          ?        ?   -28.7335  15.9630          ?        ?       22.4       10.9       ?       ? 
1 1 1   45   20   39 o    150.1    5.5    0.0000   0.0000          ?        ?   226.6752  16.6016          ?        ?      150.1        5.5       ?       ? 
1 1 1   45   20   40 f    175.6    4.5    0.0000   0.0000          ?        ?   309.6830  15.9630          ?        ?      175.6        4.5       ?       ? 
1 1 1   45   20   41 o    163.7    4.9    0.0000   0.0000          ?        ?   269.4561  15.9630          ?        ?      163.7        4.9       ?       ? 
1 1 1   45   21    0 o    111.7    9.3  127.7043  20.4327   127.7043  20.4327   127.7043  20.4327      111.7      9.3      111.7        9.3     0.0     0.0 
1 1 1   45   21    1 o    186.1    4.3    0.0000   0.0000          ?        ?   346.7172  15.9630          ?        ?      186.1        4.3       ?       ? 
1 1 1   45   21    2 o    248.1    4.4    0.0000   0.0000          ?        ?   616.1733  21.7097          ?        ?      248.1        4.4       ?       ? 
1 1 1   45   21    3 o    285.3    3.7    0.0000   0.0000          ?        ?   814.7536  21.0712          ?        ?      285.3        3.7       ?       ? 
1 1 1   45   21    4 f    255.7    4.0    0.0000   0.0000          ?        ?   654.4847  20.4327          ?        ?      255.7        4.0       ?       ? 
1 1 1   45   21    5 o    229.8    4.4    0.0000   0.0000          ?        ?   528.6959  20.4327          ?        ?      229.8        4.4       ?       ? 
1 1 1   45   21    6 o    150.6    5.5    0.0000   0.0000          ?        ?   227.3137  16.6016          ?        ?      150.6        5.5       ?       ? 
1 1 1   45   21    7 f    235.9    4.2    0.0000   0.0000          ?        ?   557.4294  19.7942          ?        ?      235.9        4.2       ?       ? 
1 1 1   45   21    8 o     99.2    8.4    0.0000   0.0000          ?        ?    98.9709  16.6016          ?        ?       99.2        8.4       ?       ? 
1 1 1   45   21    9 o    301.9    3.8    0.0000   0.0000          ?        ?   912.4474  22.9868          ?        ?      301.9        3.8       ?       ? 
1 1 1   45   21   10 o    283.3    3.8    0.0000   0.0000          ?        ?   803.2603  21.7097          ?        ?      283.3        3.8       ?       ? 
1 1 1   45   21   11 o    250.0    4.3    0.0000   0.0000          ?        ?   625.7512  21.7097          ?        ?      250.0        4.3       ?       ? 
1 1 1   45   21   12 o    189.2    3.7    0.0000   0.0000          ?        ?   358.2106  14.0475          ?        ?      189.2        3.7       ?       ? 
1 1 1   45   21   13 o    264.9    3.0    0.0000   0.0000          ?        ?   702.3738  15.9630          ?        ?      264.9        3.0       ?       ? 
1 1 1   45   21   14 o    439.5    3.1    0.0000   0.0000          ?        ?  1932.8051  27.4564          ?        ?      439.5        3.1       ?       ? 
1 1 1   45   21   15 o    109.4    6.7    0.0000   0.0000          ?        ?   120.0421  14.6860          ?        ?      109.4        6.7       ?       ? 
1 1 1   45   21   16 o    215.6    3.8    0.0000   0.0000          ?        ?   465.4823  16.6016          ?        ?      215.6        3.8       ?       ? 
1 1 1   45   21   17 o    295.8    3.5    0.0000   0.0000          ?        ?   876.0516  20.4327          ?        ?      295.8        3.5       ?       ? 
1 1 1   45   21   18 o    141.4    5.2    0.0000   0.0000          ?        ?   200.4958  14.6860          ?        ?      141.4        5.2       ?       ? 
1 1 1   45   21   19 o    207.4    2.9    0.0000   0.0000          ?        ?   430.3636  12.1319          ?        ?      207.4        2.9       ?       ? 
1 1 1   45   21   20 o    102.5    5.6    0.0000   0.0000          ?        ?   105.3561  11.4934          ?        ?      102.5        5.6       ?       ? 
1 1 1   45   21   21 o    160.3    3.8    0.0000   0.0000          ?        ?   257.3242  12.1319          ?        ?      160.3        3.8       ?       ? 
1 1 1   45   21   22 o    114.0    5.6    0.0000   0.0000          ?        ?   130.2584  12.7704          ?        ?      114.0        5.6       ?       ? 
1 1 1   45   21   23 o    262.5    3.0    0.0000   0.0000          ?        ?   689.6033  15.9630          ?        ?      262.5        3.0       ?       ? 
1 1 1   45   21   24 o    184.2    3.6    0.0000   0.0000          ?        ?   339.6935  13.4090          ?        ?      184.2        3.6       ?       ? 
1 1 1   45   21   25 o    238.8    3.1    0.0000   0.0000          ?        ?   570.8383  14.6860          ?        ?      238.8        3.1       ?       ? 
1 1 1   45   21   26 o     46.0   14.0    0.0000   0.0000          ?        ?    21.7097  14.0475          ?        ?       46.0       14.0       ?       ? 
1 1 1   45   21   27 o    121.5    5.8    0.0000   0.0000          ?        ?   148.1370  14.0475          ?        ?      121.5        5.8       ?       ? 
1 1 1   45   21   28 o    174.7    4.2    0.0000   0.0000          ?        ?   305.8519  14.6860          ?        ?      174.7        4.2       ?       ? 
1 1 1   45   21   29 o    201.0    3.8    0.0000   0.0000          ?        ?   404.8227  15.3245          ?        ?      201.0        3.8       ?       ? 
1 1 1   45   21   30 o    228.9    3.9    0.0000   0.0000          ?        ?   524.8647  17.8786          ?        ?      228.9        3.9       ?       ? 
1 1 1   45   21   31 o     93.1    8.6    0.0000   0.0000          ?        ?    87.4775  15.9630          ?        ?       93.1        8.6       ?       ? 
1 1 1   45   21   32 o     18.5    9.3    0.0000   0.0000          ?        ?   -50.4432  15.9630          ?        ?       18.5        9.3       ?       ? 
1 1 1   45   21   33 f     21.3   10.6    0.0000   0.0000          ?        ?   -40.8654  17.2401          ?        ?       21.3       10.6       ?       ? 
1 1 1   45   21   34 o    104.3    7.7    0.0000   0.0000          ?        ?   109.8257  15.9630          ?        ?      104.3        7.7       ?       ? 
1 1 1   45   21   35 o    143.4    5.8    0.0000   0.0000          ?        ?   206.8810  16.6016          ?        ?      143.4        5.8       ?       ? 
1 1 1   45   21   36 o    252.3    3.4    0.0000   0.0000          ?        ?   637.8831  17.2401          ?        ?      252.3        3.4       ?       ? 
1 1 1   45   21   37 o    100.9    7.6    0.0000   0.0000          ?        ?   102.8020  15.3245          ?        ?      100.9        7.6       ?       ? 
1 1 1   45   21   38 o     30.1   13.3    0.0000   0.0000          ?        ?    -4.4697  15.9630          ?        ?       30.1       13.3       ?       ? 
1 1 1   45   21   39 o     84.2    9.5    0.0000   0.0000          ?        ?    72.1529  15.9630          ?        ?       84.2        9.5       ?       ? 
1 1 1   45   22    0 o     93.2   11.6   91.3086  21.0712    91.3086  21.0712    91.3086  21.0712       93.2     11.6       93.2       11.6     0.0     0.0 
1 1 1   45   22    1 o    172.2    4.6    0.0000   0.0000          ?        ?   296.9126  15.9630          ?        ?      172.2        4.6       ?       ? 
1 1 1   45   22    2 o    332.8    3.8    0.0000   0.0000          ?        ?  1109.1121  25.5409          ?        ?      332.8        3.8       ?       ? 
1 1 1   45   22    3 o    266.2    4.0    0.0000   0.0000          ?        ?   709.3975  21.0712          ?        ?      266.2        4.0       ?       ? 
1 1 1   45   22    4 o     98.6    7.4    0.0000   0.0000          ?        ?    97.6938  14.6860          ?        ?       98.6        7.4       ?       ? 
1 1 1   45   22    5 o    338.1    3.5    0.0000   0.0000          ?        ?  1144.2307  23.6253          ?        ?      338.1        3.5       ?       ? 
1 1 1   45   22    6 o    169.3    4.9    0.0000   0.0000          ?        ?   287.3347  16.6016          ?        ?      169.3        4.9       ?       ? 
1 1 1   45   22    7 o    397.8    4.0    0.0000   0.0000          ?        ?  1584.8107  31.9261          ?        ?      397.8        4.0       ?       ? 
1 1 1   45   22    8 o    277.1    4.0    0.0000   0.0000          ?        ?   768.7800  22.3483          ?        ?      277.1        4.0       ?       ? 
1 1 1   45   22    9 o    276.5    4.2    0.0000   0.0000          ?        ?   765.5875  22.9868          ?        ?      276.5        4.2       ?       ? 
1 1 1   45   22   10 o    321.6    3.9    0.0000   0.0000          ?        ?  1035.6820  24.9023          ?        ?      321.6        3.9       ?       ? 
1 1 1   45   22   11 o    118.5    7.3    0.0000   0.0000          ?        ?   141.1133  17.2401          ?        ?      118.5        7.3       ?       ? 
1 1 1   45   22   12 o    230.3    4.3    0.0000   0.0000          ?        ?   531.2500  19.7942          ?        ?      230.3        4.3       ?       ? 
1 1 1   45   22   13 o    103.1    6.5    0.0000   0.0000          ?        ?   106.6331  13.4090          ?        ?      103.1        6.5       ?       ? 
1 1 1   45   22   14 o    171.5    3.9    0.0000   0.0000          ?        ?   294.3585  13.4090          ?        ?      171.5        3.9       ?       ? 
1 1 1   45   22   15 o    109.7    6.4    0.0000   0.0000          ?        ?   120.6806  14.0475          ?        ?      109.7        6.4       ?       ? 
1 1 1   45   22   16 o    441.6    3.2    0.0000   0.0000          ?        ?  1951.9607  28.0950          ?        ?      441.6        3.2       ?       ? 
1 1 1   45   22   17 o    182.2    4.4    0.0000   0.0000          ?        ?   332.6698  15.9630          ?        ?      182.2        4.4       ?       ? 
1 1 1   45   22   18 o    106.3    7.2    0.0000   0.0000          ?        ?   113.6568  15.3245          ?        ?      106.3        7.2       ?       ? 
1 1 1   45   22   19 o    342.9    3.0    0.0000   0.0000          ?        ?  1176.7954  20.4327          ?        ?      342.9        3.0       ?       ? 
1 1 1   45   22   20 o    286.5    2.5    0.0000   0.0000          ?        ?   821.1389  14.0475          ?        ?      286.5        2.5       ?       ? 
1 1 1   45   22   21 o    212.4    3.2    0.0000   0.0000          ?        ?   451.4348  13.4090          ?        ?      212.4        3.2       ?       ? 
1 1 1   45   22   22 o    170.1    3.8    0.0000   0.0000          ?        ?   289.8888  12.7704          ?        ?      170.1        3.8       ?       ? 
1 1 1   45   22   23 o    238.7    3.1    0.0000   0.0000          ?        ?   570.1998  14.6860          ?        ?      238.7        3.1       ?       ? 
1 1 1   45   22   24 o     24.3   11.2    0.0000   0.0000          ?        ?   -10.2163  12.7704          ?        ?       24.3       11.2       ?       ? 
1 1 1   45   22   25 o    143.2    4.7    0.0000   0.0000          ?        ?   205.6040  13.4090          ?        ?      143.2        4.7       ?       ? 
1 1 1   45   22   26 f     89.4    7.5    0.0000   0.0000          ?        ?    80.4537  13.4090          ?        ?       89.4        7.5       ?       ? 
1 1 1   45   22   27 o    279.4    3.1    0.0000   0.0000          ?        ?   781.5505  17.2401          ?        ?      279.4        3.1       ?       ? 
1 1 1   45   22   28 o    143.1    5.1    0.0000   0.0000          ?        ?   205.6040  14.6860          ?        ?      143.1        5.1       ?       ? 
1 1 1   45   22   29 o    156.4    4.7    0.0000   0.0000          ?        ?   245.1923  14.6860          ?        ?      156.4        4.7       ?       ? 
1 1 1   45   22   30 o     96.5    7.3    0.0000   0.0000          ?        ?    93.8627  14.0475          ?        ?       96.5        7.3       ?       ? 
1 1 1   45   22   31 o    130.4    6.4    0.0000   0.0000          ?        ?   171.1238  16.6016          ?        ?      130.4        6.4       ?       ? 
1 1 1   45   22   32 o    167.2    4.4    0.0000   0.0000          ?        ?   280.3110  14.6860          ?        ?      167.2        4.4       ?       ? 
1 1 1   45   22   33 o    273.6    3.2    0.0000   0.0000          ?        ?   749.6244  17.2401          ?        ?      273.6        3.2       ?       ? 
1 1 1   45   22   34 o    229.0    3.6    0.0000   0.0000          ?        ?   525.5033  16.6016          ?        ?      229.0        3.6       ?       ? 
1 1 1   45   22   35 f    149.1    5.4    0.0000   0.0000          ?        ?   223.4826  15.9630          ?        ?      149.1        5.4       ?       ? 
1 1 1   45   22   36 o     45.5   14.8    0.0000   0.0000          ?        ?    21.0712  15.3245          ?        ?       45.5       14.8       ?       ? 
1 1 1   45   22   37 o     89.3    9.3    0.0000   0.0000          ?        ?    81.0922  16.6016          ?        ?       89.3        9.3       ?       ? 
1 1 1   45   23    0 o     40.8   19.4   24.9023  17.8786    24.9023  17.8786    24.9023  17.8786       40.8     19.4       40.8       19.4     0.0     0.0 
1 1 1   45   23    1 o    220.5    3.6    0.0000   0.0000          ?        ?   486.5535  15.9630          ?        ?      220.5        3.6       ?       ? 
1 1 1   45   23    2 o    161.2    5.0    0.0000   0.0000          ?        ?   260.5168  15.9630          ?        ?      161.2        5.0       ?       ? 
1 1 1   45   23    3 o     88.3    8.7    0.0000   0.0000          ?        ?    78.5382  15.3245          ?        ?       88.3        8.7       ?       ? 
1 1 1   45   23    4 o    167.2    5.2    0.0000   0.0000          ?        ?   280.3110  17.2401          ?        ?      167.2        5.2       ?       ? 
1 1 1   45   23    5 o    123.5    7.8    0.0000   0.0000          ?        ?   153.2452  19.1556          ?        ?      123.5        7.8       ?       ? 
1 1 1   45   23    6 f    222.2    4.6    0.0000   0.0000          ?        ?   494.8542  20.4327          ?        ?      222.2        4.6       ?       ? 
1 1 1   45   23    7 o    185.3    5.0    0.0000   0.0000          ?        ?   344.1632  18.5171          ?        ?      185.3        5.0       ?       ? 
1 1 1   45   23    8 o    218.5    3.9    0.0000   0.0000          ?        ?   478.2527  17.2401          ?        ?      218.5        3.9       ?       ? 
1 1 1   45   23    9 o     62.6   15.0    0.0000   0.0000          ?        ?    41.5039  18.5171          ?        ?       62.6       15.0       ?       ? 
1 1 1   45   23   10 o    180.9    5.5    0.0000   0.0000          ?        ?   328.2001  19.7942          ?        ?      180.9        5.5       ?       ? 
1 1 1   45   23   11 o    274.0    4.3    0.0000   0.0000          ?        ?   752.1785  23.6253          ?        ?      274.0        4.3       ?       ? 
1 1 1   45   23   12 o    140.9    6.1    0.0000   0.0000          ?        ?   199.2188  17.2401          ?        ?      140.9        6.1       ?       ? 
1 1 1   45   23   13 o    152.2    5.5    0.0000   0.0000          ?        ?   232.4219  16.6016          ?        ?      152.2        5.5       ?       ? 
1 1 1   45   23   14 o    223.2    3.6    0.0000   0.0000          ?        ?   498.6854  15.9630          ?        ?      223.2        3.6       ?       ? 
1 1 1   45   23   15 o    254.9    3.3    0.0000   0.0000          ?        ?   650.6536  16.6016          ?        ?      254.9        3.3       ?       ? 
1 1 1   45   23   16 o    412.4    3.2    0.0000   0.0000          ?        ?  1702.2987  26.1794          ?        ?      412.4        3.2       ?       ? 
1 1 1   45   23   17 o     82.0    8.2    0.0000   0.0000          ?        ?    67.6833  13.4090          ?        ?       82.0        8.2       ?       ? 
1 1 1   45   23   18 o    270.9    3.3    0.0000   0.0000          ?        ?   734.9384  17.8786          ?        ?      270.9        3.3       ?       ? 
1 1 1   45   23   19 o    197.8    4.2    0.0000   0.0000          ?        ?   392.0523  16.6016          ?        ?      197.8        4.2       ?       ? 
1 1 1   45   23   20 o    331.9    3.0    0.0000   0.0000          ?        ?  1102.7268  19.7942          ?        ?      331.9        3.0       ?       ? 
1 1 1   45   23   21 o     48.6   10.8    0.0000   0.0000          ?        ?    24.9023  10.2163          ?        ?       48.6       10.8       ?       ? 
1 1 1   45   23   22 o    221.3    2.9    0.0000   0.0000          ?        ?   490.3846  12.7704          ?        ?      221.3        2.9       ?       ? 
1 1 1   45   23   23 o     34.4   13.0    0.0000   0.0000          ?        ?     8.9393  12.1319          ?        ?       34.4       13.0       ?       ? 
1 1 1   45   23   24 o     31.2   12.6    0.0000   0.0000          ?        ?     4.4697  12.1319          ?        ?       31.2       12.6       ?       ? 
1 1 1   45   23   25 o    282.8    2.8    0.0000   0.0000          ?        ?   800.7061  15.9630          ?        ?      282.8        2.8       ?       ? 
1 1 1   45   23   26 o    192.1    3.7    0.0000   0.0000          ?        ?   369.7040  14.0475          ?        ?      192.1        3.7       ?       ? 
1 1 1   45   23   27 o     84.2    8.3    0.0000   0.0000          ?        ?    71.5144  14.0475          ?        ?       84.2        8.3       ?       ? 
1 1 1   45   23   28 o    217.3    3.5    0.0000   0.0000          ?        ?   473.1445  15.3245          ?        ?      217.3        3.5       ?       ? 
1 1 1   45   23   29 f    457.4    2.5    0.0000   0.0000          ?        ?  2093.7124  22.9868          ?        ?      457.4        2.5       ?       ? 
1 1 1   45   23   30 o     46.3   14.0    0.0000   0.0000          ?        ?    22.3483  14.0475          ?        ?       46.3       14.0       ?       ? 
1 1 1   45   23   31 o    191.2    4.0    0.0000   0.0000          ?        ?   366.5114  15.3245          ?        ?      191.2        4.0       ?       ? 
1 1 1   45   23   32 o    129.2    5.9    0.0000   0.0000          ?        ?   167.9312  15.3245          ?        ?      129.2        5.9       ?       ? 
1 1 1   45   23   33 o     46.3   14.4    0.0000   0.0000          ?        ?    22.3483  14.6860          ?        ?       46.3       14.4       ?       ? 
1 1 1   45   23   34 o     94.7    7.4    0.0000   0.0000          ?        ?    90.6701  14.0475          ?        ?       94.7        7.4       ?       ? 
1 1 1   45   23   35 o     93.0    7.6    0.0000   0.0000          ?        ?    87.4775  14.0475          ?        ?       93.0        7.6       ?       ? 
1 1 1   45   23   36 o    150.1    5.1    0.0000   0.0000          ?        ?   226.6752  15.3245          ?        ?      150.1        5.1       ?       ? 
1 1 1   45   24    0 o    194.4    5.6  379.2819  21.7097   379.2819  21.7097   379.2819  21.7097      194.4      5.6      194.4        5.6     0.0     0.0 
1 1 1   45   24    1 o    231.5    3.6    0.0000   0.0000          ?        ?   536.3582  16.6016          ?        ?      231.5        3.6       ?       ? 
1 1 1   45   24    2 o    298.8    3.4    0.0000   0.0000          ?        ?   893.9303  20.4327          ?        ?      298.8        3.4       ?       ? 
1 1 1   45   24    3 o    239.5    4.4    0.0000   0.0000          ?        ?   574.6694  21.0712          ?        ?      239.5        4.4       ?       ? 
1 1 1   45   24    4 o    113.3    7.6    0.0000   0.0000          ?        ?   128.9814  17.2401          ?        ?      113.3        7.6       ?       ? 
1 1 1   45   24    5 o     79.9   10.4    0.0000   0.0000          ?        ?    64.4907  16.6016          ?        ?       79.9       10.4       ?       ? 
1 1 1   45   24    6 o    226.0    4.1    0.0000   0.0000          ?        ?   511.4558  18.5171          ?        ?      226.0        4.1       ?       ? 
1 1 1   45   24    7 o     37.4   14.2    0.0000   0.0000          ?        ?    10.2163  14.6860          ?        ?       37.4       14.2       ?       ? 
1 1 1   45   24    8 o     97.2    7.9    0.0000   0.0000          ?        ?    95.1397  15.3245          ?        ?       97.2        7.9       ?       ? 
1 1 1   45   24    9 o    407.2    3.8    0.0000   0.0000          ?        ?  1660.1562  30.6490          ?        ?      407.2        3.8       ?       ? 
1 1 1   45   24   10 o    451.2    3.5    0.0000   0.0000          ?        ?  2038.1611  31.2876          ?        ?      451.2        3.5       ?       ? 
1 1 1   45   24   11 o    274.0    3.6    0.0000   0.0000          ?        ?   751.5399  19.7942          ?        ?      274.0        3.6       ?       ? 
1 1 1   45   24   12 o    373.9    4.1    0.0000   0.0000          ?        ?  1400.2780  30.6490          ?        ?      373.9        4.1       ?       ? 
1 1 1   45   24   13 o    120.5    7.9    0.0000   0.0000          ?        ?   146.2215  19.1556          ?        ?      120.5        7.9       ?       ? 
1 1 1   45   24   14 o    295.1    3.8    0.0000   0.0000          ?        ?   872.2206  22.3483          ?        ?      295.1        3.8       ?       ? 
1 1 1   45   24   15 o    249.2    3.2    0.0000   0.0000          ?        ?   621.9200  15.9630          ?        ?      249.2        3.2       ?       ? 
1 1 1   45   24   16 o    138.0    4.9    0.0000   0.0000          ?        ?   190.9180  13.4090          ?        ?      138.0        4.9       ?       ? 
1 1 1   45   24   17 o    364.4    3.1    0.0000   0.0000          ?        ?  1329.4020  22.3483          ?        ?      364.4        3.1       ?       ? 
1 1 1   45   24   18 o    137.7    5.3    0.0000   0.0000          ?        ?   190.2794  14.6860          ?        ?      137.7        5.3       ?       ? 
1 1 1   45   24   19 o    180.4    4.4    0.0000   0.0000          ?        ?   326.2845  15.9630          ?        ?      180.4        4.4       ?       ? 
1 1 1   45   24   20 o    258.4    3.5    0.0000   0.0000          ?        ?   668.5321  17.8786          ?        ?      258.4        3.5       ?       ? 
1 1 1   45   24   21 o     19.0    9.4    0.0000   0.0000          ?        ?   -35.1187  14.0475          ?        ?       19.0        9.4       ?       ? 
1 1 1   45   24   22 o     29.6   11.7    0.0000   0.0000          ?        ?     5.1082  10.2163          ?        ?       29.6       11.7       ?       ? 
1 1 1   45   24   23 o     88.4    6.5    0.0000   0.0000          ?        ?    78.5382  11.4934          ?        ?       88.4        6.5       ?       ? 
1 1 1   45   24   24 o    139.8    4.3    0.0000   0.0000          ?        ?   196.0261  12.1319          ?        ?      139.8        4.3       ?       ? 
1 1 1   45   24   25 o    120.9    5.5    0.0000   0.0000          ?        ?   146.8600  13.4090          ?        ?      120.9        5.5       ?       ? 
1 1 1   45   24   26 o    152.4    4.4    0.0000   0.0000          ?        ?   233.0604  13.4090          ?        ?      152.4        4.4       ?       ? 
1 1 1   45   24   27 o    120.3    5.8    0.0000   0.0000          ?        ?   145.5829  14.0475          ?        ?      120.3        5.8       ?       ? 
1 1 1   45   24   28 o    153.2    4.8    0.0000   0.0000          ?        ?   235.6145  14.6860          ?        ?      153.2        4.8       ?       ? 
1 1 1   45   24   29 o    198.3    3.7    0.0000   0.0000          ?        ?   393.9678  14.6860          ?        ?      198.3        3.7       ?       ? 
1 1 1   45   24   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45   24   31 o     79.3    8.9    0.0000   0.0000          ?        ?    63.8522  14.0475          ?        ?       79.3        8.9       ?       ? 
1 1 1   45   24   32 o    235.7    3.4    0.0000   0.0000          ?        ?   556.7908  15.9630          ?        ?      235.7        3.4       ?       ? 
1 1 1   45   24   33 o    120.1    6.6    0.0000   0.0000          ?        ?   145.5829  15.9630          ?        ?      120.1        6.6       ?       ? 
1 1 1   45   24   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45   25    0 o     68.6   14.9   53.6358  17.8786    53.6358  17.8786    53.6358  17.8786       68.6     14.9       68.6       14.9     0.0     0.0 
1 1 1   45   25    1 o    236.8    4.0    0.0000   0.0000          ?        ?   561.8990  19.1556          ?        ?      236.8        4.0       ?       ? 
1 1 1   45   25    2 o    193.7    4.3    0.0000   0.0000          ?        ?   376.0892  16.6016          ?        ?      193.7        4.3       ?       ? 
1 1 1   45   25    3 o    177.2    4.5    0.0000   0.0000          ?        ?   314.7912  15.9630          ?        ?      177.2        4.5       ?       ? 
1 1 1   45   25    4 o     98.3    6.8    0.0000   0.0000          ?        ?    97.0553  13.4090          ?        ?       98.3        6.8       ?       ? 
1 1 1   45   25    5 o    179.2    4.1    0.0000   0.0000          ?        ?   321.8149  14.6860          ?        ?      179.2        4.1       ?       ? 
1 1 1   45   25    6 o     62.0   11.8    0.0000   0.0000          ?        ?    40.2269  14.0475          ?        ?       62.0       11.8       ?       ? 
1 1 1   45   25    7 o    117.5    6.3    0.0000   0.0000          ?        ?   138.5592  14.6860          ?        ?      117.5        6.3       ?       ? 
1 1 1   45   25    8 o     89.0    7.9    0.0000   0.0000          ?        ?    79.8152  14.0475          ?        ?       89.0        7.9       ?       ? 
1 1 1   45   25    9 o    130.3    6.1    0.0000   0.0000          ?        ?   170.4853  15.9630          ?        ?      130.3        6.1       ?       ? 
1 1 1   45   25   10 o    145.5    5.9    0.0000   0.0000          ?        ?   212.6277  17.2401          ?        ?      145.5        5.9       ?       ? 
1 1 1   45   25   11 o    183.2    4.9    0.0000   0.0000          ?        ?   336.5009  17.8786          ?        ?      183.2        4.9       ?       ? 
1 1 1   45   25   12 o    110.1    7.0    0.0000   0.0000          ?        ?   121.9576  15.3245          ?        ?      110.1        7.0       ?       ? 
1 1 1   45   25   13 f     51.3   15.1    0.0000   0.0000          ?        ?    27.4564  16.6016          ?        ?       51.3       15.1       ?       ? 
1 1 1   45   25   14 o    184.7    5.2    0.0000   0.0000          ?        ?   342.2476  19.1556          ?        ?      184.7        5.2       ?       ? 
1 1 1   45   25   15 o    158.6    6.2    0.0000   0.0000          ?        ?   252.8546  19.7942          ?        ?      158.6        6.2       ?       ? 
1 1 1   45   25   16 o     78.8    8.1    0.0000   0.0000          ?        ?    62.5751  12.7704          ?        ?       78.8        8.1       ?       ? 
1 1 1   45   25   17 o     54.4   12.6    0.0000   0.0000          ?        ?    31.2876  13.4090          ?        ?       54.4       12.6       ?       ? 
1 1 1   45   25   18 o    232.6    3.6    0.0000   0.0000          ?        ?   542.1049  16.6016          ?        ?      232.6        3.6       ?       ? 
1 1 1   45   25   19 o    110.4    6.7    0.0000   0.0000          ?        ?   122.5962  14.6860          ?        ?      110.4        6.7       ?       ? 
1 1 1   45   25   20 o     65.4   10.2    0.0000   0.0000          ?        ?    43.4195  13.4090          ?        ?       65.4       10.2       ?       ? 
1 1 1   45   25   21 o    143.6    5.3    0.0000   0.0000          ?        ?   206.8810  15.3245          ?        ?      143.6        5.3       ?       ? 
1 1 1   45   25   22 o     81.8    8.6    0.0000   0.0000          ?        ?    67.6833  14.0475          ?        ?       81.8        8.6       ?       ? 
1 1 1   45   25   23 o    204.7    3.0    0.0000   0.0000          ?        ?   419.5087  12.1319          ?        ?      204.7        3.0       ?       ? 
1 1 1   45   25   24 f     65.5    8.8    0.0000   0.0000          ?        ?    43.4195  11.4934          ?        ?       65.5        8.8       ?       ? 
1 1 1   45   25   25 o    271.4    2.8    0.0000   0.0000          ?        ?   737.4925  15.3245          ?        ?      271.4        2.8       ?       ? 
1 1 1   45   25   26 o    156.8    4.3    0.0000   0.0000          ?        ?   246.4693  13.4090          ?        ?      156.8        4.3       ?       ? 
1 1 1   45   25   27 o    127.0    5.3    0.0000   0.0000          ?        ?   162.1845  13.4090          ?        ?      127.0        5.3       ?       ? 
1 1 1   45   25   28 o    215.8    3.4    0.0000   0.0000          ?        ?   466.7593  14.6860          ?        ?      215.8        3.4       ?       ? 
1 1 1   45   25   29 o    159.7    4.4    0.0000   0.0000          ?        ?   256.0471  14.0475          ?        ?      159.7        4.4       ?       ? 
1 1 1   45   25   30 o    274.9    3.0    0.0000   0.0000          ?        ?   757.2866  16.6016          ?        ?      274.9        3.0       ?       ? 
1 1 1   45   25   31 o    166.4    4.2    0.0000   0.0000          ?        ?   277.7569  14.0475          ?        ?      166.4        4.2       ?       ? 
1 1 1   45   26    0 o    115.8   10.1  137.9207  22.9868   137.9207  22.9868   137.9207  22.9868      115.8     10.1      115.8       10.1     0.0     0.0 
1 1 1   45   26    1 o     69.6   11.5    0.0000   0.0000          ?        ?    49.1662  15.9630          ?        ?       69.6       11.5       ?       ? 
1 1 1   45   26    2 o    170.1    4.1    0.0000   0.0000          ?        ?   289.8888  14.0475          ?        ?      170.1        4.1       ?       ? 
1 1 1   45   26    3 f    124.7    4.4    0.0000   0.0000          ?        ?   155.7993  10.8549          ?        ?      124.7        4.4       ?       ? 
1 1 1   45   26    4 o    285.8    3.6    0.0000   0.0000          ?        ?   817.9462  20.4327          ?        ?      285.8        3.6       ?       ? 
1 1 1   45   26    5 o    101.8    5.6    0.0000   0.0000          ?        ?   104.0790  11.4934          ?        ?      101.8        5.6       ?       ? 
1 1 1   45   26    6 o     54.0   11.0    0.0000   0.0000          ?        ?    30.6490  11.4934          ?        ?       54.0       11.0       ?       ? 
1 1 1   45   26    7 o    110.2    5.8    0.0000   0.0000          ?        ?   121.9576  12.7704          ?        ?      110.2        5.8       ?       ? 
1 1 1   45   26    8 o    162.8    4.1    0.0000   0.0000          ?        ?   265.6250  13.4090          ?        ?      162.8        4.1       ?       ? 
1 1 1   45   26    9 o     30.6   12.7    0.0000   0.0000          ?        ?     2.5541  12.7704          ?        ?       30.6       12.7       ?       ? 
1 1 1   45   26   10 f    131.3    5.8    0.0000   0.0000          ?        ?   173.0394  15.3245          ?        ?      131.3        5.8       ?       ? 
1 1 1   45   26   11 o    109.2    7.3    0.0000   0.0000          ?        ?   120.0421  15.9630          ?        ?      109.2        7.3       ?       ? 
1 1 1   45   26   12 o    159.1    5.2    0.0000   0.0000          ?        ?   254.1316  16.6016          ?        ?      159.1        5.2       ?       ? 
1 1 1   45   26   13 o     73.2   10.0    0.0000   0.0000          ?        ?    54.2743  14.6860          ?        ?       73.2       10.0       ?       ? 
1 1 1   45   26   14 o     85.9    9.7    0.0000   0.0000          ?        ?    74.7070  16.6016          ?        ?       85.9        9.7       ?       ? 
1 1 1   45   26   15 o     67.9   12.7    0.0000   0.0000          ?        ?    48.5276  16.6016          ?        ?       67.9       12.7       ?       ? 
1 1 1   45   26   16 o    323.3    3.2    0.0000   0.0000          ?        ?  1046.5369  20.4327          ?        ?      323.3        3.2       ?       ? 
1 1 1   45   26   17 o     74.6    8.1    0.0000   0.0000          ?        ?    56.1899  12.1319          ?        ?       74.6        8.1       ?       ? 
1 1 1   45   26   18 o     97.2    6.9    0.0000   0.0000          ?        ?    95.1397  13.4090          ?        ?       97.2        6.9       ?       ? 
1 1 1   45   26   19 o    152.4    4.8    0.0000   0.0000          ?        ?   233.0604  14.6860          ?        ?      152.4        4.8       ?       ? 
1 1 1   45   26   20 o    176.3    4.5    0.0000   0.0000          ?        ?   311.5985  15.9630          ?        ?      176.3        4.5       ?       ? 
1 1 1   45   26   21 o     88.9    7.9    0.0000   0.0000          ?        ?    79.8152  14.0475          ?        ?       88.9        7.9       ?       ? 
1 1 1   45   26   22 o    109.8    6.7    0.0000   0.0000          ?        ?   121.3191  14.6860          ?        ?      109.8        6.7       ?       ? 
1 1 1   45   26   23 o    165.2    4.6    0.0000   0.0000          ?        ?   273.9258  15.3245          ?        ?      165.2        4.6       ?       ? 
1 1 1   45   26   24 o     64.5    8.4    0.0000   0.0000          ?        ?    42.1424  10.8549          ?        ?       64.5        8.4       ?       ? 
1 1 1   45   26   25 o    255.8    2.7    0.0000   0.0000          ?        ?   655.1232  14.0475          ?        ?      255.8        2.7       ?       ? 
1 1 1   45   26   26 o     89.3    7.2    0.0000   0.0000          ?        ?    80.4537  12.7704          ?        ?       89.3        7.2       ?       ? 
1 1 1   45   26   27 o     53.6   12.2    0.0000   0.0000          ?        ?    30.6490  12.7704          ?        ?       53.6       12.2       ?       ? 
1 1 1   45   26   28 o     67.7    9.4    0.0000   0.0000          ?        ?    46.6121  12.7704          ?        ?       67.7        9.4       ?       ? 
1 1 1   45   26   29 o    281.7    2.9    0.0000   0.0000          ?        ?   794.9594  16.6016          ?        ?      281.7        2.9       ?       ? 
1 1 1   45   27    0 o     30.6   20.9  -16.6016  37.6728   -16.6016  37.6728   -16.6016  37.6728       30.6     20.9       30.6       20.9     0.0     0.0 
1 1 1   45   27    1 f     32.7   15.7    0.0000   0.0000          ?        ?   -39.5883  29.3720          ?        ?       32.7       15.7       ?       ? 
1 1 1   45   27    2 o    147.7    6.1    0.0000   0.0000          ?        ?   219.0129  17.8786          ?        ?      147.7        6.1       ?       ? 
1 1 1   45   27    3 o     71.1   14.4    0.0000   0.0000          ?        ?    53.6358  19.7942          ?        ?       71.1       14.4       ?       ? 
1 1 1   45   27    4 o    106.7    8.7    0.0000   0.0000          ?        ?   114.9339  18.5171          ?        ?      106.7        8.7       ?       ? 
1 1 1   45   27    5 o    164.7    6.6    0.0000   0.0000          ?        ?   272.6487  21.7097          ?        ?      164.7        6.6       ?       ? 
1 1 1   45   27    6 o     34.1   14.2    0.0000   0.0000          ?        ?     3.1926  15.9630          ?        ?       34.1       14.2       ?       ? 
1 1 1   45   27    7 o    225.3    4.8    0.0000   0.0000          ?        ?   508.9017  21.7097          ?        ?      225.3        4.8       ?       ? 
1 1 1   45   27    8 o    115.5    8.6    0.0000   0.0000          ?        ?   134.7281  19.7942          ?        ?      115.5        8.6       ?       ? 
1 1 1   45   27    9 o    104.7   10.1    0.0000   0.0000          ?        ?   111.1028  21.0712          ?        ?      104.7       10.1       ?       ? 
1 1 1   45   27   10 o    259.2    3.2    0.0000   0.0000          ?        ?   673.0018  16.6016          ?        ?      259.2        3.2       ?       ? 
1 1 1   45   27   11 o     62.5    9.7    0.0000   0.0000          ?        ?    39.5883  12.1319          ?        ?       62.5        9.7       ?       ? 
1 1 1   45   27   12 o    192.9    4.1    0.0000   0.0000          ?        ?   372.8966  15.9630          ?        ?      192.9        4.1       ?       ? 
1 1 1   45   27   13 o     90.7    8.1    0.0000   0.0000          ?        ?    83.0078  14.6860          ?        ?       90.7        8.1       ?       ? 
1 1 1   45   27   14 o    207.0    4.5    0.0000   0.0000          ?        ?   429.7251  18.5171          ?        ?      207.0        4.5       ?       ? 
1 1 1   45   27   15 o    228.4    4.3    0.0000   0.0000          ?        ?   522.9492  19.7942          ?        ?      228.4        4.3       ?       ? 
1 1 1   45   27   16 o    264.9    4.0    0.0000   0.0000          ?        ?   703.6508  21.0712          ?        ?      264.9        4.0       ?       ? 
1 1 1   45   27   17 o    158.4    3.8    0.0000   0.0000          ?        ?   251.5775  12.1319          ?        ?      158.4        3.8       ?       ? 
1 1 1   45   27   18 o     56.0   11.8    0.0000   0.0000          ?        ?    33.2031  12.7704          ?        ?       56.0       11.8       ?       ? 
1 1 1   45   27   19 o    331.8    3.3    0.0000   0.0000          ?        ?  1102.7268  21.7097          ?        ?      331.8        3.3       ?       ? 
1 1 1   45   27   20 o    172.8    4.2    0.0000   0.0000          ?        ?   299.4666  14.6860          ?        ?      172.8        4.2       ?       ? 
1 1 1   45   27   21 o    241.1    3.4    0.0000   0.0000          ?        ?   582.3317  16.6016          ?        ?      241.1        3.4       ?       ? 
1 1 1   45   27   22 o    168.1    4.4    0.0000   0.0000          ?        ?   283.5036  14.6860          ?        ?      168.1        4.4       ?       ? 
1 1 1   45   27   23 o    129.9    5.7    0.0000   0.0000          ?        ?   169.8468  14.6860          ?        ?      129.9        5.7       ?       ? 
1 1 1   45   27   24 o     22.5   10.9    0.0000   0.0000          ?        ?   -22.3483  14.6860          ?        ?       22.5       10.9       ?       ? 
1 1 1   45   27   25 o     27.1   11.5    0.0000   0.0000          ?        ?     0.6385  10.8549          ?        ?       27.1       11.5       ?       ? 
1 1 1   45   27   26 o     72.3    7.9    0.0000   0.0000          ?        ?    52.9973  11.4934          ?        ?       72.3        7.9       ?       ? 
1 1 1   45   28    0 o    189.9   13.2  370.3425  49.8047   370.3425  49.8047   370.3425  49.8047      189.9     13.2      189.9       13.2     0.0     0.0 
1 1 1   45   28    1 o    214.0    8.2    0.0000   0.0000          ?        ?   462.2897  35.1187          ?        ?      214.0        8.2       ?       ? 
1 1 1   45   28    2 o     67.1   21.9    0.0000   0.0000          ?        ?    47.2506  33.8416          ?        ?       67.1       21.9       ?       ? 
1 1 1   45   28    3 o     51.9   21.4    0.0000   0.0000          ?        ?    12.1319  35.7572          ?        ?       51.9       21.4       ?       ? 
1 1 1   45   28    4 o    116.3   30.0    0.0000   0.0000          ?        ?   157.7148  70.2374          ?        ?      116.3       30.0       ?       ? 
1 1 1   45   28    5 o    234.2    5.6    0.0000   0.0000          ?        ?   551.0442  26.1794          ?        ?      234.2        5.6       ?       ? 
1 1 1   45   28    6 o    222.3    5.9    0.0000   0.0000          ?        ?   496.7698  26.1794          ?        ?      222.3        5.9       ?       ? 
1 1 1   45   28    7 o    172.1    8.7    0.0000   0.0000          ?        ?   299.4666  30.0105          ?        ?      172.1        8.7       ?       ? 
1 1 1   45   28    8 o    139.8    6.4    0.0000   0.0000          ?        ?   196.6647  17.8786          ?        ?      139.8        6.4       ?       ? 
1 1 1   45   28    9 o    154.1    6.2    0.0000   0.0000          ?        ?   238.8071  19.1556          ?        ?      154.1        6.2       ?       ? 
1 1 1   45   28   10 o     92.0   10.8    0.0000   0.0000          ?        ?    86.2004  19.7942          ?        ?       92.0       10.8       ?       ? 
1 1 1   45   28   11 o    192.1    5.8    0.0000   0.0000          ?        ?   370.9810  22.3483          ?        ?      192.1        5.8       ?       ? 
1 1 1   45   28   12 o    106.9    8.7    0.0000   0.0000          ?        ?   115.5724  18.5171          ?        ?      106.9        8.7       ?       ? 
1 1 1   45   28   13 f    216.6    3.2    0.0000   0.0000          ?        ?   469.9519  14.0475          ?        ?      216.6        3.2       ?       ? 
1 1 1   45   28   14 o    233.1    3.6    0.0000   0.0000          ?        ?   544.6590  16.6016          ?        ?      233.1        3.6       ?       ? 
1 1 1   45   28   15 o     66.7   10.5    0.0000   0.0000          ?        ?    45.3350  14.0475          ?        ?       66.7       10.5       ?       ? 
1 1 1   45   28   16 o     24.8   11.6    0.0000   0.0000          ?        ?   -14.6860  14.6860          ?        ?       24.8       11.6       ?       ? 
1 1 1   45   28   17 o     64.9   12.8    0.0000   0.0000          ?        ?    44.6965  15.9630          ?        ?       64.9       12.8       ?       ? 
1 1 1   45   28   18 o     25.3   11.1    0.0000   0.0000          ?        ?    -2.5541  10.8549          ?        ?       25.3       11.1       ?       ? 
1 1 1   45   28   19 o    269.2    3.2    0.0000   0.0000          ?        ?   725.9991  17.2401          ?        ?      269.2        3.2       ?       ? 
1 1 1   45   28   20 o     44.9   13.7    0.0000   0.0000          ?        ?    21.0712  13.4090          ?        ?       44.9       13.7       ?       ? 
1 1 1   45   28   21 o    238.7    3.2    0.0000   0.0000          ?        ?   570.8383  15.3245          ?        ?      238.7        3.2       ?       ? 
1 1 1   45   28   22 o    205.3    3.6    0.0000   0.0000          ?        ?   422.7013  14.6860          ?        ?      205.3        3.6       ?       ? 
1 1 1   45   28   23 o    169.6    4.1    0.0000   0.0000          ?        ?   288.6118  14.0475          ?        ?      169.6        4.1       ?       ? 
1 1 1   45   29    0 o    232.5   17.5  562.5375  80.4537   562.5375  80.4537   562.5375  80.4537      232.5     17.5      232.5       17.5     0.0     0.0 
1 1 1   45   29    1 o    168.9   16.1    0.0000   0.0000          ?        ?   296.9126  54.2743          ?        ?      168.9       16.1       ?       ? 
1 1 1   45   29    2 o     66.7   24.8    0.0000   0.0000          ?        ?    41.5039  44.0580          ?        ?       66.7       24.8       ?       ? 
1 1 1   45   29    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45   29    4 o    103.6   32.1    0.0000   0.0000          ?        ?   128.3428  73.4300          ?        ?      103.6       32.1       ?       ? 
1 1 1   45   29    5 o    148.7   15.7    0.0000   0.0000          ?        ?   229.8678  46.6121          ?        ?      148.7       15.7       ?       ? 
1 1 1   45   29    6 o    213.6   11.8    0.0000   0.0000          ?        ?   466.7593  50.4432          ?        ?      213.6       11.8       ?       ? 
1 1 1   45   29    7 o    160.5    6.4    0.0000   0.0000          ?        ?   259.2398  20.4327          ?        ?      160.5        6.4       ?       ? 
1 1 1   45   29    8 o     71.3   14.4    0.0000   0.0000          ?        ?    54.2743  19.7942          ?        ?       71.3       14.4       ?       ? 
1 1 1   45   29    9 o    262.6    6.2    0.0000   0.0000          ?        ?   694.0730  32.5646          ?        ?      262.6        6.2       ?       ? 
1 1 1   45   29   10 o    138.0    7.4    0.0000   0.0000          ?        ?   192.1950  20.4327          ?        ?      138.0        7.4       ?       ? 
1 1 1   45   29   11 o    158.5    7.0    0.0000   0.0000          ?        ?   253.4931  22.3483          ?        ?      158.5        7.0       ?       ? 
1 1 1   45   29   12 o    190.9    6.7    0.0000   0.0000          ?        ?   367.1499  25.5409          ?        ?      190.9        6.7       ?       ? 
1 1 1   45   29   13 o    268.6    5.8    0.0000   0.0000          ?        ?   725.9991  31.2876          ?        ?      268.6        5.8       ?       ? 
1 1 1   45   29   14 o    186.5    6.5    0.0000   0.0000          ?        ?   350.5484  24.2638          ?        ?      186.5        6.5       ?       ? 
1 1 1   45   29   15 o    245.3    6.0    0.0000   0.0000          ?        ?   605.9570  29.3720          ?        ?      245.3        6.0       ?       ? 
1 1 1   45   29   16 o    277.7    3.7    0.0000   0.0000          ?        ?   773.2497  20.4327          ?        ?      277.7        3.7       ?       ? 
1 1 1   45   29   17 o    103.4    7.1    0.0000   0.0000          ?        ?   107.9102  14.6860          ?        ?      103.4        7.1       ?       ? 
1 1 1   45   29   18 o     72.7    8.3    0.0000   0.0000          ?        ?    53.6358  12.1319          ?        ?       72.7        8.3       ?       ? 
1 1 1   45   29   19 o    142.4    4.3    0.0000   0.0000          ?        ?   203.6884  12.1319          ?        ?      142.4        4.3       ?       ? 
1 1 1   45   30    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45   30    1 o     55.7   25.1    0.0000   0.0000          ?        ?   -16.6016  59.3825          ?        ?       55.7       25.1       ?       ? 
1 1 1   45   30    2 o     35.9   17.4    0.0000   0.0000          ?        ?   -62.5751  39.5883          ?        ?       35.9       17.4       ?       ? 
1 1 1   45   30    3 o    156.6   27.9    0.0000   0.0000          ?        ?   284.7806  84.2849          ?        ?      156.6       27.9       ?       ? 
1 1 1   45   30    4 o    188.8   17.8    0.0000   0.0000          ?        ?   376.7278  67.0448          ?        ?      188.8       17.8       ?       ? 
1 1 1   45   30    5 o    132.8   19.7    0.0000   0.0000          ?        ?   189.0024  52.3588          ?        ?      132.8       19.7       ?       ? 
1 1 1   45   30    6 o    223.2   11.0    0.0000   0.0000          ?        ?   509.5403  49.1662          ?        ?      223.2       11.0       ?       ? 
1 1 1   45   30    7 o    132.3   19.3    0.0000   0.0000          ?        ?   187.0868  51.0817          ?        ?      132.3       19.3       ?       ? 
1 1 1   45   30    8 o     48.2   22.2    0.0000   0.0000          ?        ?   -26.8179  49.1662          ?        ?       48.2       22.2       ?       ? 
1 1 1   45   30    9 o     82.6   31.7    0.0000   0.0000          ?        ?    70.8759  73.4300          ?        ?       82.6       31.7       ?       ? 
1 1 1   45   30   10 o    190.6    6.7    0.0000   0.0000          ?        ?   366.5114  25.5409          ?        ?      190.6        6.7       ?       ? 
1 1 1   45   30   11 o    121.1    7.4    0.0000   0.0000          ?        ?   148.1370  17.8786          ?        ?      121.1        7.4       ?       ? 
1 1 1   45   30   12 o     75.9   12.6    0.0000   0.0000          ?        ?    59.3825  19.1556          ?        ?       75.9       12.6       ?       ? 
1 1 1   45   30   13 o     72.7   14.6    0.0000   0.0000          ?        ?    56.8284  20.4327          ?        ?       72.7       14.6       ?       ? 
1 1 1   45   30   14 o     67.3   16.7    0.0000   0.0000          ?        ?    49.8047  22.3483          ?        ?       67.3       16.7       ?       ? 
1 1 1   45   30   15 o    106.1   11.1    0.0000   0.0000          ?        ?   115.5724  23.6253          ?        ?      106.1       11.1       ?       ? 
1 1 1   45   31    0 o    202.0   19.1  433.5562  75.9841   433.5562  75.9841   433.5562  75.9841      202.0     19.1      202.0       19.1     0.0     0.0 
1 1 1   45   31    1 o    209.6   13.2    0.0000   0.0000          ?        ?   455.2659  55.5514          ?        ?      209.6       13.2       ?       ? 
1 1 1   45   31    2 o    221.7   13.1    0.0000   0.0000          ?        ?   508.9017  58.1055          ?        ?      221.7       13.1       ?       ? 
1 1 1   45   31    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45   31    4 o    132.8   30.7    0.0000   0.0000          ?        ?   216.4588  79.8152          ?        ?      132.8       30.7       ?       ? 
1 1 1   45   31    5 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   45   31    6 o    226.6   13.1    0.0000   0.0000          ?        ?   531.8885  59.3825          ?        ?      226.6       13.1       ?       ? 
1 1 1   45   31    7 o    108.8   19.5    0.0000   0.0000          ?        ?   130.8969  40.8654          ?        ?      108.8       19.5       ?       ? 
1 1 1   45   31    8 o    101.9   30.9    0.0000   0.0000          ?        ?   129.6199  68.3218          ?        ?      101.9       30.9       ?       ? 
1 1 1   46    0    0 o     19.7   14.1  -29.3720  22.9868   -29.3720  22.9868   -29.3720  22.9868       19.7     14.1       19.7       14.1     0.0     0.0 
1 1 1   46    0    1 o     16.2   11.5  -16.6016  14.6860   -16.6016  14.6860   -16.6016  14.6860       16.2     11.5       16.2       11.5     0.0     0.0 
1 1 1   46    0    2 o    542.4    3.6 2942.9460  39.5883  2942.9460  39.5883  2942.9460  39.5883      542.4      3.6      542.4        3.6     0.0     0.0 
1 1 1   46    0    3 o    230.9    3.7  533.8041  17.2401   533.8041  17.2401   533.8041  17.2401      230.9      3.7      230.9        3.7     0.0     0.0 
1 1 1   46    0    4 o     73.9   10.7   56.8284  15.3245    56.8284  15.3245    56.8284  15.3245       73.9     10.7       73.9       10.7     0.0     0.0 
1 1 1   46    0    5 o    467.4    3.6 2185.6594  33.2031  2185.6594  33.2031  2185.6594  33.2031      467.4      3.6      467.4        3.6     0.0     0.0 
1 1 1   46    0    6 o    319.5    3.4 1020.9960  21.7097  1020.9960  21.7097  1020.9960  21.7097      319.5      3.4      319.5        3.4     0.0     0.0 
1 1 1   46    0    7 o     23.1   14.7    1.9156  14.6860     1.9156  14.6860     1.9156  14.6860       23.1     14.7       23.1       14.7     0.0     0.0 
1 1 1   46    0    8 o    243.3    3.9  592.5481  19.1556   592.5481  19.1556   592.5481  19.1556      243.3      3.9      243.3        3.9     0.0     0.0 
1 1 1   46    0    9 o    665.3    4.4 4427.5093  58.1055  4427.5093  58.1055  4427.5093  58.1055      665.3      4.4      665.3        4.4     0.0     0.0 
1 1 1   46    0   10 o     61.1   15.8   44.0580  16.6016    44.0580  16.6016    44.0580  16.6016       61.1     15.8       61.1       15.8     0.0     0.0 
1 1 1   46    0   11 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46    0   12 o    162.1    5.5  263.7094  17.8786   263.7094  17.8786   263.7094  17.8786      162.1      5.5      162.1        5.5     0.0     0.0 
1 1 1   46    0   13 o    497.6    3.6 2476.8254  35.7572  2476.8254  35.7572  2476.8254  35.7572      497.6      3.6      497.6        3.6     0.0     0.0 
1 1 1   46    0   14 o    622.8    4.3 3879.6572  52.9973  3879.6572  52.9973  3879.6572  52.9973      622.8      4.3      622.8        4.3     0.0     0.0 
1 1 1   46    0   15 o    949.5    5.2 9019.7559  99.6094  9019.7559  99.6094  9019.7559  99.6094      949.5      5.2      949.5        5.2     0.0     0.0 
1 1 1   46    0   16 o    121.0    7.4  148.1370  17.8786   148.1370  17.8786   148.1370  17.8786      121.0      7.4      121.0        7.4     0.0     0.0 
1 1 1   46    0   17 o    158.3    5.5  251.5775  17.2401   251.5775  17.2401   251.5775  17.2401      158.3      5.5      158.3        5.5     0.0     0.0 
1 1 1   46    0   18 o     12.8    9.5  -54.2743  17.8786   -54.2743  17.8786   -54.2743  17.8786       12.8      9.5       12.8        9.5     0.0     0.0 
1 1 1   46    0   19 o     13.4    9.9  -40.8654  16.6016   -40.8654  16.6016   -40.8654  16.6016       13.4      9.9       13.4        9.9     0.0     0.0 
1 1 1   46    0   20 o    449.2    4.0 2019.0055  35.7572  2019.0055  35.7572  2019.0055  35.7572      449.2      4.0      449.2        4.0     0.0     0.0 
1 1 1   46    0   21 o    286.7    3.6  822.4159  20.4327   822.4159  20.4327   822.4159  20.4327      286.7      3.6      286.7        3.6     0.0     0.0 
1 1 1   46    0   22 o    400.0    3.7 1600.7737  29.3720  1600.7737  29.3720  1600.7737  29.3720      400.0      3.7      400.0        3.7     0.0     0.0 
1 1 1   46    0   23 o    147.1    6.5  217.7359  19.1556   217.7359  19.1556   217.7359  19.1556      147.1      6.5      147.1        6.5     0.0     0.0 
1 1 1   46    0   24 o    329.8    3.5 1088.0408  22.9868  1088.0408  22.9868  1088.0408  22.9868      329.8      3.5      329.8        3.5     0.0     0.0 
1 1 1   46    0   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46    0   26 o    175.1    5.8  307.7674  20.4327   307.7674  20.4327   307.7674  20.4327      175.1      5.8      175.1        5.8     0.0     0.0 
1 1 1   46    0   27 o    371.6    3.8 1381.7607  28.0950  1381.7607  28.0950  1381.7607  28.0950      371.6      3.8      371.6        3.8     0.0     0.0 
1 1 1   46    0   28 o    143.6    7.8  208.1580  22.3483   208.1580  22.3483   208.1580  22.3483      143.6      7.8      143.6        7.8     0.0     0.0 
1 1 1   46    0   29 o    717.9    4.2 5156.0620  60.6596  5156.0620  60.6596  5156.0620  60.6596      717.9      4.2      717.9        4.2     0.0     0.0 
1 1 1   46    0   30 o    309.4    4.4  958.4210  27.4564   958.4210  27.4564   958.4210  27.4564      309.4      4.4      309.4        4.4     0.0     0.0 
1 1 1   46    0   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46    0   32 o     15.7   11.5  -47.2506  21.0712   -47.2506  21.0712   -47.2506  21.0712       15.7     11.5       15.7       11.5     0.0     0.0 
1 1 1   46    0   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46    0   34 o    199.5    5.3  399.0760  21.0712   399.0760  21.0712   399.0760  21.0712      199.5      5.3      199.5        5.3     0.0     0.0 
1 1 1   46    0   35 o    295.6    4.2  874.7747  24.9023   874.7747  24.9023   874.7747  24.9023      295.6      4.2      295.6        4.2     0.0     0.0 
1 1 1   46    0   36 o     19.2   13.8  -29.3720  22.3483   -29.3720  22.3483   -29.3720  22.3483       19.2     13.8       19.2       13.8     0.0     0.0 
1 1 1   46    0   37 o    109.1    9.5  121.9576  20.4327   121.9576  20.4327   121.9576  20.4327      109.1      9.5      109.1        9.5     0.0     0.0 
1 1 1   46    0   38 o     20.5   14.5  -22.9868  22.3483   -22.9868  22.3483   -22.9868  22.3483       20.5     14.5       20.5       14.5     0.0     0.0 
1 1 1   46    0   39 o     68.1   19.5   56.8284  22.9868    56.8284  22.9868    56.8284  22.9868       68.1     19.5       68.1       19.5     0.0     0.0 
1 1 1   46    0   40 o    412.9    3.9 1706.1299  31.9261  1706.1299  31.9261  1706.1299  31.9261      412.9      3.9      412.9        3.9     0.0     0.0 
1 1 1   46    0   41 o    314.0    4.2  987.1545  26.1794   987.1545  26.1794   987.1545  26.1794      314.0      4.2      314.0        4.2     0.0     0.0 
1 1 1   46    0   42 o    121.1    8.8  149.4141  21.0712   149.4141  21.0712   149.4141  21.0712      121.1      8.8      121.1        8.8     0.0     0.0 
1 1 1   46    0   43 o    352.2    4.2 1241.9246  29.3720  1241.9246  29.3720  1241.9246  29.3720      352.2      4.2      352.2        4.2     0.0     0.0 
1 1 1   46    0   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46    0   45 o    141.6    8.4  203.0499  23.6253   203.0499  23.6253   203.0499  23.6253      141.6      8.4      141.6        8.4     0.0     0.0 
1 1 1   46    0   46 o    381.1    4.0 1453.9137  30.6490  1453.9137  30.6490  1453.9137  30.6490      381.1      4.0      381.1        4.0     0.0     0.0 
1 1 1   46    0   47 o    160.3    7.6  259.2398  24.2638   259.2398  24.2638   259.2398  24.2638      160.3      7.6      160.3        7.6     0.0     0.0 
1 1 1   46    0   48 o     15.6   11.6  -70.2374  24.9023   -70.2374  24.9023   -70.2374  24.9023       15.6     11.6       15.6       11.6     0.0     0.0 
1 1 1   46    0   49 o    284.1    5.2  809.0069  29.3720   809.0069  29.3720   809.0069  29.3720      284.1      5.2      284.1        5.2     0.0     0.0 
1 1 1   46    0   50 o    386.1    4.1 1492.2250  31.2876  1492.2250  31.2876  1492.2250  31.2876      386.1      4.1      386.1        4.1     0.0     0.0 
1 1 1   46    0   51 o     18.3   13.4  -47.8891  25.5409   -47.8891  25.5409   -47.8891  25.5409       18.3     13.4       18.3       13.4     0.0     0.0 
1 1 1   46    0   52 o    237.8    5.9  567.6458  28.0950   567.6458  28.0950   567.6458  28.0950      237.8      5.9      237.8        5.9     0.0     0.0 
1 1 1   46    0   53 o     18.8   13.8  -52.3588  27.4564   -52.3588  27.4564   -52.3588  27.4564       18.8     13.8       18.8       13.8     0.0     0.0 
1 1 1   46    0   54 f    294.0    5.1  866.4738  30.0105   866.4738  30.0105   866.4738  30.0105      294.0      5.1      294.0        5.1     0.0     0.0 
1 1 1   46    0   55 o    298.1    4.8  890.7377  28.7335   890.7377  28.7335   890.7377  28.7335      298.1      4.8      298.1        4.8     0.0     0.0 
1 1 1   46    0   56 o     73.9   20.5   67.0448  26.1794    67.0448  26.1794    67.0448  26.1794       73.9     20.5       73.9       20.5     0.0     0.0 
1 1 1   46    0   57 o    136.3    9.9  190.2794  26.8179   190.2794  26.8179   190.2794  26.8179      136.3      9.9      136.3        9.9     0.0     0.0 
1 1 1   46    0   58 o     31.4   20.3    3.1926  28.7335     3.1926  28.7335     3.1926  28.7335       31.4     20.3       31.4       20.3     0.0     0.0 
1 1 1   46    0   59 o     81.9   19.3   79.1767  27.4564    79.1767  27.4564    79.1767  27.4564       81.9     19.3       81.9       19.3     0.0     0.0 
1 1 1   46    1    0 o     93.2    9.1   89.3930  16.6016    89.3930  16.6016    89.3930  16.6016       93.2      9.1       93.2        9.1     0.0     0.0 
1 1 1   46    1    1 o    397.6    2.7    0.0000   0.0000          ?        ?  1580.9796  21.7097          ?        ?      397.6        2.7       ?       ? 
1 1 1   46    1    2 o    181.3    3.5    0.0000   0.0000          ?        ?   328.8386  12.7704          ?        ?      181.3        3.5       ?       ? 
1 1 1   46    1    3 o    100.4    6.0    0.0000   0.0000          ?        ?   100.8864  12.1319          ?        ?      100.4        6.0       ?       ? 
1 1 1   46    1    4 o    186.4    3.3    0.0000   0.0000          ?        ?   347.3558  12.1319          ?        ?      186.4        3.3       ?       ? 
1 1 1   46    1    5 o    339.0    2.5    0.0000   0.0000          ?        ?  1149.3389  17.2401          ?        ?      339.0        2.5       ?       ? 
1 1 1   46    1    6 o    386.8    2.5    0.0000   0.0000          ?        ?  1496.0562  19.1556          ?        ?      386.8        2.5       ?       ? 
1 1 1   46    1    7 f    313.1    2.4    0.0000   0.0000          ?        ?   980.7693  15.3245          ?        ?      313.1        2.4       ?       ? 
1 1 1   46    1    8 o    310.7    2.6    0.0000   0.0000          ?        ?   965.4447  15.9630          ?        ?      310.7        2.6       ?       ? 
1 1 1   46    1    9 o    217.8    3.4    0.0000   0.0000          ?        ?   474.4216  14.6860          ?        ?      217.8        3.4       ?       ? 
1 1 1   46    1   10 o    202.9    3.3    0.0000   0.0000          ?        ?   411.8464  13.4090          ?        ?      202.9        3.3       ?       ? 
1 1 1   46    1   11 o    691.4    2.9    0.0000   0.0000          ?        ?  4781.8887  40.2269          ?        ?      691.4        2.9       ?       ? 
1 1 1   46    1   12 o    151.8    4.0    0.0000   0.0000          ?        ?   230.5063  12.1319          ?        ?      151.8        4.0       ?       ? 
1 1 1   46    1   13 o    100.4    6.0    0.0000   0.0000          ?        ?   100.8864  12.1319          ?        ?      100.4        6.0       ?       ? 
1 1 1   46    1   14 o    406.4    2.4    0.0000   0.0000          ?        ?  1651.8555  19.7942          ?        ?      406.4        2.4       ?       ? 
1 1 1   46    1   15 o    108.6    5.6    0.0000   0.0000          ?        ?   118.1265  12.1319          ?        ?      108.6        5.6       ?       ? 
1 1 1   46    1   16 o     70.0    9.1    0.0000   0.0000          ?        ?    49.1662  12.7704          ?        ?       70.0        9.1       ?       ? 
1 1 1   46    1   17 o    373.1    2.4    0.0000   0.0000          ?        ?  1391.9772  17.8786          ?        ?      373.1        2.4       ?       ? 
1 1 1   46    1   18 o    416.2    2.5    0.0000   0.0000          ?        ?  1732.9476  21.0712          ?        ?      416.2        2.5       ?       ? 
1 1 1   46    1   19 o    153.0    4.0    0.0000   0.0000          ?        ?   234.3374  12.1319          ?        ?      153.0        4.0       ?       ? 
1 1 1   46    1   20 o    156.3    4.3    0.0000   0.0000          ?        ?   244.5538  13.4090          ?        ?      156.3        4.3       ?       ? 
1 1 1   46    1   21 o    365.2    2.4    0.0000   0.0000          ?        ?  1333.8716  17.2401          ?        ?      365.2        2.4       ?       ? 
1 1 1   46    1   22 o    260.1    2.8    0.0000   0.0000          ?        ?   676.8329  14.6860          ?        ?      260.1        2.8       ?       ? 
1 1 1   46    1   23 o    291.9    2.7    0.0000   0.0000          ?        ?   852.4264  15.9630          ?        ?      291.9        2.7       ?       ? 
1 1 1   46    1   24 o    162.5    3.9    0.0000   0.0000          ?        ?   264.3480  12.7704          ?        ?      162.5        3.9       ?       ? 
1 1 1   46    1   25 o    409.0    2.5    0.0000   0.0000          ?        ?  1673.5652  20.4327          ?        ?      409.0        2.5       ?       ? 
1 1 1   46    1   26 o    262.9    3.2    0.0000   0.0000          ?        ?   691.5189  16.6016          ?        ?      262.9        3.2       ?       ? 
1 1 1   46    1   27 o    348.8    2.7    0.0000   0.0000          ?        ?  1217.0222  18.5171          ?        ?      348.8        2.7       ?       ? 
1 1 1   46    1   28 o    536.6    2.6    0.0000   0.0000          ?        ?  2880.3711  27.4564          ?        ?      536.6        2.6       ?       ? 
1 1 1   46    1   29 o    530.9    2.5    0.0000   0.0000          ?        ?  2819.7114  26.8179          ?        ?      530.9        2.5       ?       ? 
1 1 1   46    1   30 o    264.2    3.0    0.0000   0.0000          ?        ?   698.5427  15.9630          ?        ?      264.2        3.0       ?       ? 
1 1 1   46    1   31 o    648.7    2.8    0.0000   0.0000          ?        ?  4209.1348  35.7572          ?        ?      648.7        2.8       ?       ? 
1 1 1   46    1   32 o    419.1    2.6    0.0000   0.0000          ?        ?  1757.2115  21.7097          ?        ?      419.1        2.6       ?       ? 
1 1 1   46    1   33 o    561.8    2.6    0.0000   0.0000          ?        ?  3157.4895  28.7335          ?        ?      561.8        2.6       ?       ? 
1 1 1   46    1   34 o    218.5    3.7    0.0000   0.0000          ?        ?   477.6142  15.9630          ?        ?      218.5        3.7       ?       ? 
1 1 1   46    1   35 o    255.6    3.1    0.0000   0.0000          ?        ?   653.8461  15.9630          ?        ?      255.6        3.1       ?       ? 
1 1 1   46    1   36 o     55.1   13.9    0.0000   0.0000          ?        ?    31.9261  15.3245          ?        ?       55.1       13.9       ?       ? 
1 1 1   46    1   37 o    207.1    3.9    0.0000   0.0000          ?        ?   429.0865  15.9630          ?        ?      207.1        3.9       ?       ? 
1 1 1   46    1   38 o     21.0   10.4    0.0000   0.0000          ?        ?   -39.5883  16.6016          ?        ?       21.0       10.4       ?       ? 
1 1 1   46    1   39 o    384.6    2.7    0.0000   0.0000          ?        ?  1480.0931  20.4327          ?        ?      384.6        2.7       ?       ? 
1 1 1   46    1   40 o    166.9    5.2    0.0000   0.0000          ?        ?   279.0340  17.2401          ?        ?      166.9        5.2       ?       ? 
1 1 1   46    1   41 o     46.9   15.7    0.0000   0.0000          ?        ?    21.0712  17.2401          ?        ?       46.9       15.7       ?       ? 
1 1 1   46    1   42 o    226.3    4.1    0.0000   0.0000          ?        ?   512.7329  18.5171          ?        ?      226.3        4.1       ?       ? 
1 1 1   46    1   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46    1   44 o    160.9    5.2    0.0000   0.0000          ?        ?   259.2398  16.6016          ?        ?      160.9        5.2       ?       ? 
1 1 1   46    1   45 o    132.3    6.8    0.0000   0.0000          ?        ?   175.5934  17.8786          ?        ?      132.3        6.8       ?       ? 
1 1 1   46    1   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46    1   47 o     85.3   10.5    0.0000   0.0000          ?        ?    73.4300  17.8786          ?        ?       85.3       10.5       ?       ? 
1 1 1   46    1   48 o    182.6    4.7    0.0000   0.0000          ?        ?   333.9468  17.2401          ?        ?      182.6        4.7       ?       ? 
1 1 1   46    1   49 o     66.7   12.9    0.0000   0.0000          ?        ?    46.6121  16.6016          ?        ?       66.7       12.9       ?       ? 
1 1 1   46    1   50 o     19.6    9.9    0.0000   0.0000          ?        ?   -56.8284  17.8786          ?        ?       19.6        9.9       ?       ? 
1 1 1   46    1   51 o    247.6    4.0    0.0000   0.0000          ?        ?   614.2578  19.7942          ?        ?      247.6        4.0       ?       ? 
1 1 1   46    1   52 o     51.0   16.5    0.0000   0.0000          ?        ?    26.1794  19.1556          ?        ?       51.0       16.5       ?       ? 
1 1 1   46    1   53 o     29.5   13.6    0.0000   0.0000          ?        ?   -13.4090  18.5171          ?        ?       29.5       13.6       ?       ? 
1 1 1   46    1   54 o     89.8   10.3    0.0000   0.0000          ?        ?    81.7308  18.5171          ?        ?       89.8       10.3       ?       ? 
1 1 1   46    1   55 o    200.5    4.9    0.0000   0.0000          ?        ?   403.5457  19.7942          ?        ?      200.5        4.9       ?       ? 
1 1 1   46    1   56 o    182.0    5.3    0.0000   0.0000          ?        ?   332.6698  19.1556          ?        ?      182.0        5.3       ?       ? 
1 1 1   46    1   57 o     28.4   13.2    0.0000   0.0000          ?        ?   -16.6016  18.5171          ?        ?       28.4       13.2       ?       ? 
1 1 1   46    1   58 o     48.2   15.9    0.0000   0.0000          ?        ?    23.6253  17.8786          ?        ?       48.2       15.9       ?       ? 
1 1 1   46    1   59 f    164.9    5.8    0.0000   0.0000          ?        ?   273.9258  19.1556          ?        ?      164.9        5.8       ?       ? 
1 1 1   46    2    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46    2    1 o    312.0    2.6    0.0000   0.0000          ?        ?   973.7455  15.9630          ?        ?      312.0        2.6       ?       ? 
1 1 1   46    2    2 o    268.3    2.7    0.0000   0.0000          ?        ?   720.2524  14.6860          ?        ?      268.3        2.7       ?       ? 
1 1 1   46    2    3 o    834.8    3.3    0.0000   0.0000          ?        ?  6970.7402  55.5514          ?        ?      834.8        3.3       ?       ? 
1 1 1   46    2    4 o    378.3    2.6    0.0000   0.0000          ?        ?  1431.5654  19.7942          ?        ?      378.3        2.6       ?       ? 
1 1 1   46    2    5 o    243.7    2.8    0.0000   0.0000          ?        ?   593.8251  13.4090          ?        ?      243.7        2.8       ?       ? 
1 1 1   46    2    6 o    168.9    3.8    0.0000   0.0000          ?        ?   285.4192  12.7704          ?        ?      168.9        3.8       ?       ? 
1 1 1   46    2    7 o    407.7    2.7    0.0000   0.0000          ?        ?  1662.7103  21.7097          ?        ?      407.7        2.7       ?       ? 
1 1 1   46    2    8 o    461.2    2.6    0.0000   0.0000          ?        ?  2127.5542  24.2638          ?        ?      461.2        2.6       ?       ? 
1 1 1   46    2    9 f    480.2    2.7    0.0000   0.0000          ?        ?  2306.3401  26.1794          ?        ?      480.2        2.7       ?       ? 
1 1 1   46    2   10 o    421.0    2.5    0.0000   0.0000          ?        ?  1772.5361  21.0712          ?        ?      421.0        2.5       ?       ? 
1 1 1   46    2   11 o    465.4    2.5    0.0000   0.0000          ?        ?  2166.5039  23.6253          ?        ?      465.4        2.5       ?       ? 
1 1 1   46    2   12 o    568.3    2.6    0.0000   0.0000          ?        ?  3230.2808  30.0105          ?        ?      568.3        2.6       ?       ? 
1 1 1   46    2   13 o    284.7    2.6    0.0000   0.0000          ?        ?   810.9225  14.6860          ?        ?      284.7        2.6       ?       ? 
1 1 1   46    2   14 o    510.9    2.7    0.0000   0.0000          ?        ?  2610.9148  28.0950          ?        ?      510.9        2.7       ?       ? 
1 1 1   46    2   15 o    488.7    2.4    0.0000   0.0000          ?        ?  2388.7095  23.6253          ?        ?      488.7        2.4       ?       ? 
1 1 1   46    2   16 f    230.0    3.2    0.0000   0.0000          ?        ?   529.3344  14.6860          ?        ?      230.0        3.2       ?       ? 
1 1 1   46    2   17 o    144.9    4.6    0.0000   0.0000          ?        ?   210.0736  13.4090          ?        ?      144.9        4.6       ?       ? 
1 1 1   46    2   18 o    158.6    4.2    0.0000   0.0000          ?        ?   251.5775  13.4090          ?        ?      158.6        4.2       ?       ? 
1 1 1   46    2   19 o    290.4    2.6    0.0000   0.0000          ?        ?   843.4871  15.3245          ?        ?      290.4        2.6       ?       ? 
1 1 1   46    2   20 o    202.1    3.3    0.0000   0.0000          ?        ?   408.6538  13.4090          ?        ?      202.1        3.3       ?       ? 
1 1 1   46    2   21 o    282.4    2.8    0.0000   0.0000          ?        ?   797.5135  15.9630          ?        ?      282.4        2.8       ?       ? 
1 1 1   46    2   22 o    268.8    3.1    0.0000   0.0000          ?        ?   722.8065  16.6016          ?        ?      268.8        3.1       ?       ? 
1 1 1   46    2   23 o    147.7    4.3    0.0000   0.0000          ?        ?   218.3744  12.7704          ?        ?      147.7        4.3       ?       ? 
1 1 1   46    2   24 o    580.8    2.6    0.0000   0.0000          ?        ?  3373.9485  30.6490          ?        ?      580.8        2.6       ?       ? 
1 1 1   46    2   25 o    272.3    2.9    0.0000   0.0000          ?        ?   741.9621  15.9630          ?        ?      272.3        2.9       ?       ? 
1 1 1   46    2   26 o    338.0    2.6    0.0000   0.0000          ?        ?  1142.9537  17.8786          ?        ?      338.0        2.6       ?       ? 
1 1 1   46    2   27 o    469.4    2.6    0.0000   0.0000          ?        ?  2203.5381  24.2638          ?        ?      469.4        2.6       ?       ? 
1 1 1   46    2   28 o    532.6    2.5    0.0000   0.0000          ?        ?  2836.9514  26.8179          ?        ?      532.6        2.5       ?       ? 
1 1 1   46    2   29 o    485.5    2.6    0.0000   0.0000          ?        ?  2357.4219  24.9023          ?        ?      485.5        2.6       ?       ? 
1 1 1   46    2   30 o    197.0    3.7    0.0000   0.0000          ?        ?   388.2211  14.6860          ?        ?      197.0        3.7       ?       ? 
1 1 1   46    2   31 o    625.0    2.8    0.0000   0.0000          ?        ?  3907.1140  34.4802          ?        ?      625.0        2.8       ?       ? 
1 1 1   46    2   32 o    608.0    2.7    0.0000   0.0000          ?        ?  3698.3174  33.2031          ?        ?      608.0        2.7       ?       ? 
1 1 1   46    2   33 o    146.2    5.0    0.0000   0.0000          ?        ?   213.9047  14.6860          ?        ?      146.2        5.0       ?       ? 
1 1 1   46    2   34 o    105.3    7.3    0.0000   0.0000          ?        ?   111.1028  15.3245          ?        ?      105.3        7.3       ?       ? 
1 1 1   46    2   35 o    115.4    6.4    0.0000   0.0000          ?        ?   133.4510  14.6860          ?        ?      115.4        6.4       ?       ? 
1 1 1   46    2   36 o    201.1    4.0    0.0000   0.0000          ?        ?   404.8227  15.9630          ?        ?      201.1        4.0       ?       ? 
1 1 1   46    2   37 o    139.6    5.7    0.0000   0.0000          ?        ?   195.3876  15.9630          ?        ?      139.6        5.7       ?       ? 
1 1 1   46    2   38 o    330.1    2.9    0.0000   0.0000          ?        ?  1089.9564  19.1556          ?        ?      330.1        2.9       ?       ? 
1 1 1   46    2   39 o     72.5   11.0    0.0000   0.0000          ?        ?    52.9973  15.9630          ?        ?       72.5       11.0       ?       ? 
1 1 1   46    2   40 o    186.9    4.4    0.0000   0.0000          ?        ?   349.9099  16.6016          ?        ?      186.9        4.4       ?       ? 
1 1 1   46    2   41 o     22.7   11.1    0.0000   0.0000          ?        ?   -31.2876  16.6016          ?        ?       22.7       11.1       ?       ? 
1 1 1   46    2   42 o     36.4   15.1    0.0000   0.0000          ?        ?     3.8311  17.8786          ?        ?       36.4       15.1       ?       ? 
1 1 1   46    2   43 o    143.9    6.0    0.0000   0.0000          ?        ?   207.5195  17.2401          ?        ?      143.9        6.0       ?       ? 
1 1 1   46    2   44 o    215.2    4.3    0.0000   0.0000          ?        ?   463.5667  18.5171          ?        ?      215.2        4.3       ?       ? 
1 1 1   46    2   45 o    255.9    3.7    0.0000   0.0000          ?        ?   655.7617  19.1556          ?        ?      255.9        3.7       ?       ? 
1 1 1   46    2   46 o     85.3   10.1    0.0000   0.0000          ?        ?    73.4300  17.2401          ?        ?       85.3       10.1       ?       ? 
1 1 1   46    2   47 o    235.0    3.9    0.0000   0.0000          ?        ?   552.9597  18.5171          ?        ?      235.0        3.9       ?       ? 
1 1 1   46    2   48 o    288.3    3.3    0.0000   0.0000          ?        ?   831.9937  19.1556          ?        ?      288.3        3.3       ?       ? 
1 1 1   46    2   49 o    128.3    7.2    0.0000   0.0000          ?        ?   165.3771  18.5171          ?        ?      128.3        7.2       ?       ? 
1 1 1   46    2   50 o    180.6    5.1    0.0000   0.0000          ?        ?   326.9231  18.5171          ?        ?      180.6        5.1       ?       ? 
1 1 1   46    2   51 o     33.2   14.6    0.0000   0.0000          ?        ?    -3.8311  18.5171          ?        ?       33.2       14.6       ?       ? 
1 1 1   46    2   52 f    105.2    8.8    0.0000   0.0000          ?        ?   111.7413  18.5171          ?        ?      105.2        8.8       ?       ? 
1 1 1   46    2   53 o     78.0   11.9    0.0000   0.0000          ?        ?    61.9366  18.5171          ?        ?       78.0       11.9       ?       ? 
1 1 1   46    2   54 o    309.5    3.4    0.0000   0.0000          ?        ?   959.6980  21.0712          ?        ?      309.5        3.4       ?       ? 
1 1 1   46    2   55 f     22.2   11.0    0.0000   0.0000          ?        ?   -51.0817  19.7942          ?        ?       22.2       11.0       ?       ? 
1 1 1   46    2   56 o    143.5    6.4    0.0000   0.0000          ?        ?   207.5195  18.5171          ?        ?      143.5        6.4       ?       ? 
1 1 1   46    2   57 o    147.0    6.3    0.0000   0.0000          ?        ?   217.7359  18.5171          ?        ?      147.0        6.3       ?       ? 
1 1 1   46    2   58 o     31.0   13.9    0.0000   0.0000          ?        ?    -7.0237  17.8786          ?        ?       31.0       13.9       ?       ? 
1 1 1   46    3    0 o    442.8    4.0 1961.5386  35.1187  1961.5386  35.1187  1961.5386  35.1187      442.8      4.0      442.8        4.0     0.0     0.0 
1 1 1   46    3    1 o    140.9    4.3    0.0000   0.0000          ?        ?   198.5802  12.1319          ?        ?      140.9        4.3       ?       ? 
1 1 1   46    3    2 o    528.9    2.6    0.0000   0.0000          ?        ?  2797.3633  27.4564          ?        ?      528.9        2.6       ?       ? 
1 1 1   46    3    3 o    107.2    5.4    0.0000   0.0000          ?        ?   114.9339  11.4934          ?        ?      107.2        5.4       ?       ? 
1 1 1   46    3    4 o    533.2    2.7    0.0000   0.0000          ?        ?  2843.9753  28.7335          ?        ?      533.2        2.7       ?       ? 
1 1 1   46    3    5 o    179.9    3.5    0.0000   0.0000          ?        ?   323.7305  12.7704          ?        ?      179.9        3.5       ?       ? 
1 1 1   46    3    6 o    685.4    3.1    0.0000   0.0000          ?        ?  4698.8809  42.1424          ?        ?      685.4        3.1       ?       ? 
1 1 1   46    3    7 o    204.5    3.1    0.0000   0.0000          ?        ?   418.2317  12.7704          ?        ?      204.5        3.1       ?       ? 
1 1 1   46    3    8 o    516.3    2.7    0.0000   0.0000          ?        ?  2665.8279  28.0950          ?        ?      516.3        2.7       ?       ? 
1 1 1   46    3    9 o    557.9    2.7    0.0000   0.0000          ?        ?  3113.4314  30.0105          ?        ?      557.9        2.7       ?       ? 
1 1 1   46    3   10 o    398.9    2.6    0.0000   0.0000          ?        ?  1591.8345  20.4327          ?        ?      398.9        2.6       ?       ? 
1 1 1   46    3   11 o    247.8    2.8    0.0000   0.0000          ?        ?   614.2578  14.0475          ?        ?      247.8        2.8       ?       ? 
1 1 1   46    3   12 o    444.6    2.5    0.0000   0.0000          ?        ?  1976.8630  22.3483          ?        ?      444.6        2.5       ?       ? 
1 1 1   46    3   13 o    316.4    2.6    0.0000   0.0000          ?        ?  1001.2019  16.6016          ?        ?      316.4        2.6       ?       ? 
1 1 1   46    3   14 o    760.3    3.2    0.0000   0.0000          ?        ?  5781.8135  49.1662          ?        ?      760.3        3.2       ?       ? 
1 1 1   46    3   15 o    281.8    2.7    0.0000   0.0000          ?        ?   794.3209  15.3245          ?        ?      281.8        2.7       ?       ? 
1 1 1   46    3   16 o    324.1    2.8    0.0000   0.0000          ?        ?  1050.3680  17.8786          ?        ?      324.1        2.8       ?       ? 
1 1 1   46    3   17 o    584.8    3.1    0.0000   0.0000          ?        ?  3420.5605  35.7572          ?        ?      584.8        3.1       ?       ? 
1 1 1   46    3   18 f    190.9    3.7    0.0000   0.0000          ?        ?   364.5958  14.0475          ?        ?      190.9        3.7       ?       ? 
1 1 1   46    3   19 o    514.7    2.4    0.0000   0.0000          ?        ?  2649.8647  24.9023          ?        ?      514.7        2.4       ?       ? 
1 1 1   46    3   20 o    320.9    2.6    0.0000   0.0000          ?        ?  1029.9354  16.6016          ?        ?      320.9        2.6       ?       ? 
1 1 1   46    3   21 o    217.0    3.2    0.0000   0.0000          ?        ?   471.2290  14.0475          ?        ?      217.0        3.2       ?       ? 
1 1 1   46    3   22 o    396.2    2.5    0.0000   0.0000          ?        ?  1570.1246  19.7942          ?        ?      396.2        2.5       ?       ? 
1 1 1   46    3   23 o    262.6    2.9    0.0000   0.0000          ?        ?   689.6033  15.3245          ?        ?      262.6        2.9       ?       ? 
1 1 1   46    3   24 o    359.2    2.6    0.0000   0.0000          ?        ?  1290.4523  18.5171          ?        ?      359.2        2.6       ?       ? 
1 1 1   46    3   25 o     28.3   12.6    0.0000   0.0000          ?        ?    -6.3852  14.6860          ?        ?       28.3       12.6       ?       ? 
1 1 1   46    3   26 o    142.2    5.2    0.0000   0.0000          ?        ?   202.4114  14.6860          ?        ?      142.2        5.2       ?       ? 
1 1 1   46    3   27 o    167.7    4.2    0.0000   0.0000          ?        ?   281.5880  14.0475          ?        ?      167.7        4.2       ?       ? 
1 1 1   46    3   28 o    239.1    3.2    0.0000   0.0000          ?        ?   572.1154  15.3245          ?        ?      239.1        3.2       ?       ? 
1 1 1   46    3   29 o    156.9    4.5    0.0000   0.0000          ?        ?   246.4693  14.0475          ?        ?      156.9        4.5       ?       ? 
1 1 1   46    3   30 o    298.8    3.0    0.0000   0.0000          ?        ?   893.2917  17.8786          ?        ?      298.8        3.0       ?       ? 
1 1 1   46    3   31 o    154.4    4.8    0.0000   0.0000          ?        ?   238.8071  14.6860          ?        ?      154.4        4.8       ?       ? 
1 1 1   46    3   32 o    299.5    2.9    0.0000   0.0000          ?        ?   897.1229  17.2401          ?        ?      299.5        2.9       ?       ? 
1 1 1   46    3   33 o    235.7    3.5    0.0000   0.0000          ?        ?   556.1523  16.6016          ?        ?      235.7        3.5       ?       ? 
1 1 1   46    3   34 o     68.5   10.7    0.0000   0.0000          ?        ?    47.2506  14.6860          ?        ?       68.5       10.7       ?       ? 
1 1 1   46    3   35 o     24.2   11.4    0.0000   0.0000          ?        ?   -17.2401  14.6860          ?        ?       24.2       11.4       ?       ? 
1 1 1   46    3   36 o     88.4    8.3    0.0000   0.0000          ?        ?    78.5382  14.6860          ?        ?       88.4        8.3       ?       ? 
1 1 1   46    3   37 o    337.3    2.9    0.0000   0.0000          ?        ?  1138.4841  19.7942          ?        ?      337.3        2.9       ?       ? 
1 1 1   46    3   38 o    290.8    3.1    0.0000   0.0000          ?        ?   846.0411  17.8786          ?        ?      290.8        3.1       ?       ? 
1 1 1   46    3   39 o    312.3    3.2    0.0000   0.0000          ?        ?   975.6611  19.7942          ?        ?      312.3        3.2       ?       ? 
1 1 1   46    3   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46    3   41 o    248.8    3.5    0.0000   0.0000          ?        ?   619.3660  17.2401          ?        ?      248.8        3.5       ?       ? 
1 1 1   46    3   42 o    149.7    6.0    0.0000   0.0000          ?        ?   224.7596  17.8786          ?        ?      149.7        6.0       ?       ? 
1 1 1   46    3   43 o    269.8    3.7    0.0000   0.0000          ?        ?   728.5532  19.7942          ?        ?      269.8        3.7       ?       ? 
1 1 1   46    3   44 o    223.7    4.1    0.0000   0.0000          ?        ?   501.2395  18.5171          ?        ?      223.7        4.1       ?       ? 
1 1 1   46    3   45 o    522.5    2.7    0.0000   0.0000          ?        ?  2731.5955  28.7335          ?        ?      522.5        2.7       ?       ? 
1 1 1   46    3   46 o    208.4    4.3    0.0000   0.0000          ?        ?   434.8332  17.8786          ?        ?      208.4        4.3       ?       ? 
1 1 1   46    3   47 o     19.7    9.9    0.0000   0.0000          ?        ?   -55.5514  17.8786          ?        ?       19.7        9.9       ?       ? 
1 1 1   46    3   48 f    209.5    4.4    0.0000   0.0000          ?        ?   439.9414  18.5171          ?        ?      209.5        4.4       ?       ? 
1 1 1   46    3   49 o    254.3    3.8    0.0000   0.0000          ?        ?   647.4609  19.1556          ?        ?      254.3        3.8       ?       ? 
1 1 1   46    3   50 o    132.4    6.8    0.0000   0.0000          ?        ?   176.2320  17.8786          ?        ?      132.4        6.8       ?       ? 
1 1 1   46    3   51 o     75.6   11.8    0.0000   0.0000          ?        ?    58.1055  17.8786          ?        ?       75.6       11.8       ?       ? 
1 1 1   46    3   52 o     29.1   13.5    0.0000   0.0000          ?        ?   -14.6860  18.5171          ?        ?       29.1       13.5       ?       ? 
1 1 1   46    3   53 o    206.7    4.6    0.0000   0.0000          ?        ?   428.4480  19.1556          ?        ?      206.7        4.6       ?       ? 
1 1 1   46    3   54 o    124.0    7.5    0.0000   0.0000          ?        ?   155.1608  18.5171          ?        ?      124.0        7.5       ?       ? 
1 1 1   46    3   55 o     18.7    9.5    0.0000   0.0000          ?        ?   -68.3218  18.5171          ?        ?       18.7        9.5       ?       ? 
1 1 1   46    3   56 o    154.0    6.2    0.0000   0.0000          ?        ?   238.8071  19.1556          ?        ?      154.0        6.2       ?       ? 
1 1 1   46    3   57 o    152.1    6.1    0.0000   0.0000          ?        ?   233.0604  18.5171          ?        ?      152.1        6.1       ?       ? 
1 1 1   46    4    0 o    928.7    5.4 8629.6201  99.6094  8629.6201  99.6094  8629.6201  99.6094      928.7      5.4      928.7        5.4     0.0     0.0 
1 1 1   46    4    1 f    438.3    2.7    0.0000   0.0000          ?        ?  1921.3115  23.6253          ?        ?      438.3        2.7       ?       ? 
1 1 1   46    4    2 o    164.1    3.7    0.0000   0.0000          ?        ?   269.4561  12.1319          ?        ?      164.1        3.7       ?       ? 
1 1 1   46    4    3 o    134.4    4.5    0.0000   0.0000          ?        ?   180.7016  12.1319          ?        ?      134.4        4.5       ?       ? 
1 1 1   46    4    4 o    300.4    2.6    0.0000   0.0000          ?        ?   902.8696  15.3245          ?        ?      300.4        2.6       ?       ? 
1 1 1   46    4    5 o    432.2    2.7    0.0000   0.0000          ?        ?  1868.3143  22.9868          ?        ?      432.2        2.7       ?       ? 
1 1 1   46    4    6 o    634.2    3.1    0.0000   0.0000          ?        ?  4022.6863  39.5883          ?        ?      634.2        3.1       ?       ? 
1 1 1   46    4    7 o    227.7    3.1    0.0000   0.0000          ?        ?   518.4796  14.0475          ?        ?      227.7        3.1       ?       ? 
1 1 1   46    4    8 f    866.2    3.5    0.0000   0.0000          ?        ?  7506.4600  61.2981          ?        ?      866.2        3.5       ?       ? 
1 1 1   46    4    9 o    322.4    2.6    0.0000   0.0000          ?        ?  1039.5132  16.6016          ?        ?      322.4        2.6       ?       ? 
1 1 1   46    4   10 o    146.0    4.2    0.0000   0.0000          ?        ?   213.2662  12.1319          ?        ?      146.0        4.2       ?       ? 
1 1 1   46    4   11 o    322.5    2.6    0.0000   0.0000          ?        ?  1040.1517  16.6016          ?        ?      322.5        2.6       ?       ? 
1 1 1   46    4   12 o    635.2    3.0    0.0000   0.0000          ?        ?  4036.0950  38.3113          ?        ?      635.2        3.0       ?       ? 
1 1 1   46    4   13 o    466.5    2.7    0.0000   0.0000          ?        ?  2176.7202  25.5409          ?        ?      466.5        2.7       ?       ? 
1 1 1   46    4   14 o    270.1    2.7    0.0000   0.0000          ?        ?   729.8303  14.6860          ?        ?      270.1        2.7       ?       ? 
1 1 1   46    4   15 o    224.6    3.0    0.0000   0.0000          ?        ?   504.4321  13.4090          ?        ?      224.6        3.0       ?       ? 
1 1 1   46    4   16 o    142.4    4.5    0.0000   0.0000          ?        ?   203.0499  12.7704          ?        ?      142.4        4.5       ?       ? 
1 1 1   46    4   17 o    333.1    2.7    0.0000   0.0000          ?        ?  1109.7506  17.8786          ?        ?      333.1        2.7       ?       ? 
1 1 1   46    4   18 o    306.9    2.6    0.0000   0.0000          ?        ?   941.8194  15.9630          ?        ?      306.9        2.6       ?       ? 
1 1 1   46    4   19 o    212.4    3.5    0.0000   0.0000          ?        ?   451.4348  14.6860          ?        ?      212.4        3.5       ?       ? 
1 1 1   46    4   20 f    111.5    5.4    0.0000   0.0000          ?        ?   124.5117  12.1319          ?        ?      111.5        5.4       ?       ? 
1 1 1   46    4   21 o    173.6    3.9    0.0000   0.0000          ?        ?   301.3822  13.4090          ?        ?      173.6        3.9       ?       ? 
1 1 1   46    4   22 o    200.7    3.3    0.0000   0.0000          ?        ?   402.9071  13.4090          ?        ?      200.7        3.3       ?       ? 
1 1 1   46    4   23 o    238.6    3.1    0.0000   0.0000          ?        ?   569.5613  14.6860          ?        ?      238.6        3.1       ?       ? 
1 1 1   46    4   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46    4   25 o    374.1    2.6    0.0000   0.0000          ?        ?  1400.2780  19.7942          ?        ?      374.1        2.6       ?       ? 
1 1 1   46    4   26 o    152.8    4.6    0.0000   0.0000          ?        ?   233.6989  14.0475          ?        ?      152.8        4.6       ?       ? 
1 1 1   46    4   27 o    130.2    5.4    0.0000   0.0000          ?        ?   169.8468  14.0475          ?        ?      130.2        5.4       ?       ? 
1 1 1   46    4   28 o     18.0    9.0    0.0000   0.0000          ?        ?   -40.8654  14.0475          ?        ?       18.0        9.0       ?       ? 
1 1 1   46    4   29 o    141.3    5.0    0.0000   0.0000          ?        ?   199.8573  14.0475          ?        ?      141.3        5.0       ?       ? 
1 1 1   46    4   30 o    616.7    2.7    0.0000   0.0000          ?        ?  3804.9504  33.2031          ?        ?      616.7        2.7       ?       ? 
1 1 1   46    4   31 o    252.9    3.3    0.0000   0.0000          ?        ?   639.7986  16.6016          ?        ?      252.9        3.3       ?       ? 
1 1 1   46    4   32 o    293.3    2.9    0.0000   0.0000          ?        ?   860.7272  17.2401          ?        ?      293.3        2.9       ?       ? 
1 1 1   46    4   33 f    165.2    4.6    0.0000   0.0000          ?        ?   273.2873  15.3245          ?        ?      165.2        4.6       ?       ? 
1 1 1   46    4   34 f    236.4    3.5    0.0000   0.0000          ?        ?   559.3449  16.6016          ?        ?      236.4        3.5       ?       ? 
1 1 1   46    4   35 o    231.6    3.4    0.0000   0.0000          ?        ?   536.9967  15.9630          ?        ?      231.6        3.4       ?       ? 
1 1 1   46    4   36 o    342.5    2.7    0.0000   0.0000          ?        ?  1173.6028  18.5171          ?        ?      342.5        2.7       ?       ? 
1 1 1   46    4   37 o     18.2    9.2    0.0000   0.0000          ?        ?   -52.9973  15.9630          ?        ?       18.2        9.2       ?       ? 
1 1 1   46    4   38 o    282.9    3.0    0.0000   0.0000          ?        ?   800.7061  17.2401          ?        ?      282.9        3.0       ?       ? 
1 1 1   46    4   39 o    365.7    2.8    0.0000   0.0000          ?        ?  1338.3413  20.4327          ?        ?      365.7        2.8       ?       ? 
1 1 1   46    4   40 o    185.0    4.7    0.0000   0.0000          ?        ?   342.8861  17.2401          ?        ?      185.0        4.7       ?       ? 
1 1 1   46    4   41 o    252.7    3.7    0.0000   0.0000          ?        ?   639.1602  18.5171          ?        ?      252.7        3.7       ?       ? 
1 1 1   46    4   42 o    304.9    3.2    0.0000   0.0000          ?        ?   930.3260  19.7942          ?        ?      304.9        3.2       ?       ? 
1 1 1   46    4   43 o    361.0    3.0    0.0000   0.0000          ?        ?  1304.4998  21.7097          ?        ?      361.0        3.0       ?       ? 
1 1 1   46    4   44 f    154.7    6.0    0.0000   0.0000          ?        ?   240.0841  18.5171          ?        ?      154.7        6.0       ?       ? 
1 1 1   46    4   45 o    102.3    8.7    0.0000   0.0000          ?        ?   105.3561  17.8786          ?        ?      102.3        8.7       ?       ? 
1 1 1   46    4   46 o     53.9   16.3    0.0000   0.0000          ?        ?    30.0105  19.1556          ?        ?       53.9       16.3       ?       ? 
1 1 1   46    4   47 o    242.3    4.0    0.0000   0.0000          ?        ?   588.0784  19.1556          ?        ?      242.3        4.0       ?       ? 
1 1 1   46    4   48 o    108.3    8.3    0.0000   0.0000          ?        ?   118.1265  17.8786          ?        ?      108.3        8.3       ?       ? 
1 1 1   46    4   49 o     21.2   10.5    0.0000   0.0000          ?        ?   -45.9736  17.8786          ?        ?       21.2       10.5       ?       ? 
1 1 1   46    4   50 f     62.4   14.6    0.0000   0.0000          ?        ?    41.5039  17.8786          ?        ?       62.4       14.6       ?       ? 
1 1 1   46    4   51 f    178.0    5.0    0.0000   0.0000          ?        ?   317.9838  17.8786          ?        ?      178.0        5.0       ?       ? 
1 1 1   46    4   52 o     30.2   13.8    0.0000   0.0000          ?        ?   -13.4090  19.1556          ?        ?       30.2       13.8       ?       ? 
1 1 1   46    4   53 o    237.0    4.2    0.0000   0.0000          ?        ?   563.1760  19.7942          ?        ?      237.0        4.2       ?       ? 
1 1 1   46    4   54 o    138.4    6.5    0.0000   0.0000          ?        ?   192.8335  17.8786          ?        ?      138.4        6.5       ?       ? 
1 1 1   46    4   55 o    135.3    6.8    0.0000   0.0000          ?        ?   184.5327  18.5171          ?        ?      135.3        6.8       ?       ? 
1 1 1   46    4   56 o     86.6   10.7    0.0000   0.0000          ?        ?    76.6226  18.5171          ?        ?       86.6       10.7       ?       ? 
1 1 1   46    4   57 o     23.2   11.4    0.0000   0.0000          ?        ?   -37.0343  18.5171          ?        ?       23.2       11.4       ?       ? 
1 1 1   46    5    0 o    214.4    4.8  460.3741  20.4327   460.3741  20.4327   460.3741  20.4327      214.4      4.8      214.4        4.8     0.0     0.0 
1 1 1   46    5    1 o    789.7    3.4    0.0000   0.0000          ?        ?  6237.7178  52.9973          ?        ?      789.7        3.4       ?       ? 
1 1 1   46    5    2 o    528.2    2.7    0.0000   0.0000          ?        ?  2790.9780  28.7335          ?        ?      528.2        2.7       ?       ? 
1 1 1   46    5    3 o    119.3    4.5    0.0000   0.0000          ?        ?   142.3903  10.8549          ?        ?      119.3        4.5       ?       ? 
1 1 1   46    5    4 o     67.7    8.0    0.0000   0.0000          ?        ?    45.9736  10.8549          ?        ?       67.7        8.0       ?       ? 
1 1 1   46    5    5 f    429.4    2.5    0.0000   0.0000          ?        ?  1844.0504  21.0712          ?        ?      429.4        2.5       ?       ? 
1 1 1   46    5    6 o    162.2    3.5    0.0000   0.0000          ?        ?   263.0709  11.4934          ?        ?      162.2        3.5       ?       ? 
1 1 1   46    5    7 o    646.0    2.8    0.0000   0.0000          ?        ?  4174.6543  36.3957          ?        ?      646.0        2.8       ?       ? 
1 1 1   46    5    8 o    195.5    3.3    0.0000   0.0000          ?        ?   382.4745  12.7704          ?        ?      195.5        3.3       ?       ? 
1 1 1   46    5    9 o    121.4    5.0    0.0000   0.0000          ?        ?   147.4985  12.1319          ?        ?      121.4        5.0       ?       ? 
1 1 1   46    5   10 o    153.7    3.9    0.0000   0.0000          ?        ?   236.2530  12.1319          ?        ?      153.7        3.9       ?       ? 
1 1 1   46    5   11 o    272.5    2.7    0.0000   0.0000          ?        ?   742.6006  14.6860          ?        ?      272.5        2.7       ?       ? 
1 1 1   46    5   12 o    471.7    2.6    0.0000   0.0000          ?        ?  2225.2478  24.2638          ?        ?      471.7        2.6       ?       ? 
1 1 1   46    5   13 o    422.8    2.6    0.0000   0.0000          ?        ?  1787.8606  21.7097          ?        ?      422.8        2.6       ?       ? 
1 1 1   46    5   14 o    162.5    4.1    0.0000   0.0000          ?        ?   264.3480  13.4090          ?        ?      162.5        4.1       ?       ? 
1 1 1   46    5   15 o    643.5    3.3    0.0000   0.0000          ?        ?  4142.0898  42.1424          ?        ?      643.5        3.3       ?       ? 
1 1 1   46    5   16 o    171.3    3.7    0.0000   0.0000          ?        ?   293.7199  12.7704          ?        ?      171.3        3.7       ?       ? 
1 1 1   46    5   17 f    145.8    4.8    0.0000   0.0000          ?        ?   212.6277  14.0475          ?        ?      145.8        4.8       ?       ? 
1 1 1   46    5   18 o    203.2    3.3    0.0000   0.0000          ?        ?   413.1235  13.4090          ?        ?      203.2        3.3       ?       ? 
1 1 1   46    5   19 o    289.4    2.6    0.0000   0.0000          ?        ?   837.7404  15.3245          ?        ?      289.4        2.6       ?       ? 
1 1 1   46    5   20 o    173.4    3.7    0.0000   0.0000          ?        ?   300.7437  12.7704          ?        ?      173.4        3.7       ?       ? 
1 1 1   46    5   21 o    132.5    4.8    0.0000   0.0000          ?        ?   175.5934  12.7704          ?        ?      132.5        4.8       ?       ? 
1 1 1   46    5   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46    5   23 o    168.1    3.8    0.0000   0.0000          ?        ?   282.8651  12.7704          ?        ?      168.1        3.8       ?       ? 
1 1 1   46    5   24 o    576.8    2.6    0.0000   0.0000          ?        ?  3327.9749  30.0105          ?        ?      576.8        2.6       ?       ? 
1 1 1   46    5   25 o    215.5    3.4    0.0000   0.0000          ?        ?   464.8438  14.6860          ?        ?      215.5        3.4       ?       ? 
1 1 1   46    5   26 o    727.6    3.0    0.0000   0.0000          ?        ?  5296.5371  43.4195          ?        ?      727.6        3.0       ?       ? 
1 1 1   46    5   27 o    452.5    2.5    0.0000   0.0000          ?        ?  2048.3772  22.3483          ?        ?      452.5        2.5       ?       ? 
1 1 1   46    5   28 o    290.2    2.8    0.0000   0.0000          ?        ?   842.2100  15.9630          ?        ?      290.2        2.8       ?       ? 
1 1 1   46    5   29 o    309.8    2.8    0.0000   0.0000          ?        ?   960.3365  17.2401          ?        ?      309.8        2.8       ?       ? 
1 1 1   46    5   30 o    200.0    3.7    0.0000   0.0000          ?        ?   400.3531  14.6860          ?        ?      200.0        3.7       ?       ? 
1 1 1   46    5   31 o    391.5    2.7    0.0000   0.0000          ?        ?  1533.7289  21.0712          ?        ?      391.5        2.7       ?       ? 
1 1 1   46    5   32 o    215.8    3.6    0.0000   0.0000          ?        ?   466.1208  15.3245          ?        ?      215.8        3.6       ?       ? 
1 1 1   46    5   33 o    239.9    3.5    0.0000   0.0000          ?        ?   575.9465  16.6016          ?        ?      239.9        3.5       ?       ? 
1 1 1   46    5   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46    5   35 o    344.5    2.8    0.0000   0.0000          ?        ?  1187.6503  19.1556          ?        ?      344.5        2.8       ?       ? 
1 1 1   46    5   36 f    459.3    2.6    0.0000   0.0000          ?        ?  2110.3140  23.6253          ?        ?      459.3        2.6       ?       ? 
1 1 1   46    5   37 o    378.0    2.8    0.0000   0.0000          ?        ?  1429.6499  21.0712          ?        ?      378.0        2.8       ?       ? 
1 1 1   46    5   38 o     33.6   14.1    0.0000   0.0000          ?        ?     1.9156  15.9630          ?        ?       33.6       14.1       ?       ? 
1 1 1   46    5   39 o    124.4    6.4    0.0000   0.0000          ?        ?   155.1608  15.9630          ?        ?      124.4        6.4       ?       ? 
1 1 1   46    5   40 o    363.1    2.8    0.0000   0.0000          ?        ?  1319.1857  20.4327          ?        ?      363.1        2.8       ?       ? 
1 1 1   46    5   41 o    308.8    3.2    0.0000   0.0000          ?        ?   954.5898  19.7942          ?        ?      308.8        3.2       ?       ? 
1 1 1   46    5   42 o    392.2    2.8    0.0000   0.0000          ?        ?  1538.8372  21.7097          ?        ?      392.2        2.8       ?       ? 
1 1 1   46    5   43 o    176.9    4.9    0.0000   0.0000          ?        ?   313.5141  17.2401          ?        ?      176.9        4.9       ?       ? 
1 1 1   46    5   44 o    133.9    6.7    0.0000   0.0000          ?        ?   180.0631  17.8786          ?        ?      133.9        6.7       ?       ? 
1 1 1   46    5   45 o    176.8    5.2    0.0000   0.0000          ?        ?   313.5141  18.5171          ?        ?      176.8        5.2       ?       ? 
1 1 1   46    5   46 o    380.6    2.9    0.0000   0.0000          ?        ?  1449.4441  22.3483          ?        ?      380.6        2.9       ?       ? 
1 1 1   46    5   47 o    319.8    3.1    0.0000   0.0000          ?        ?  1023.5502  19.7942          ?        ?      319.8        3.1       ?       ? 
1 1 1   46    5   48 o    200.0    4.8    0.0000   0.0000          ?        ?   400.9916  19.1556          ?        ?      200.0        4.8       ?       ? 
1 1 1   46    5   49 o     29.6   13.5    0.0000   0.0000          ?        ?   -11.4934  17.8786          ?        ?       29.6       13.5       ?       ? 
1 1 1   46    5   50 o    203.0    4.4    0.0000   0.0000          ?        ?   413.1235  17.8786          ?        ?      203.0        4.4       ?       ? 
1 1 1   46    5   51 o    192.2    4.7    0.0000   0.0000          ?        ?   370.3425  17.8786          ?        ?      192.2        4.7       ?       ? 
1 1 1   46    5   52 o    198.8    4.7    0.0000   0.0000          ?        ?   396.5219  18.5171          ?        ?      198.8        4.7       ?       ? 
1 1 1   46    5   53 o     46.9   16.2    0.0000   0.0000          ?        ?    21.0712  18.5171          ?        ?       46.9       16.2       ?       ? 
1 1 1   46    5   54 o    139.9    6.6    0.0000   0.0000          ?        ?   197.3032  18.5171          ?        ?      139.9        6.6       ?       ? 
1 1 1   46    5   55 f    174.2    5.3    0.0000   0.0000          ?        ?   305.2133  18.5171          ?        ?      174.2        5.3       ?       ? 
1 1 1   46    5   56 o    128.1    7.5    0.0000   0.0000          ?        ?   166.0156  19.1556          ?        ?      128.1        7.5       ?       ? 
1 1 1   46    6    0 o    515.8    3.8 2661.3582  39.5883  2661.3582  39.5883  2661.3582  39.5883      515.8      3.8      515.8        3.8     0.0     0.0 
1 1 1   46    6    1 o    262.7    2.7    0.0000   0.0000          ?        ?   690.2419  14.0475          ?        ?      262.7        2.7       ?       ? 
1 1 1   46    6    2 o    296.7    2.6    0.0000   0.0000          ?        ?   880.5213  15.3245          ?        ?      296.7        2.6       ?       ? 
1 1 1   46    6    3 o    379.5    2.4    0.0000   0.0000          ?        ?  1440.5049  18.5171          ?        ?      379.5        2.4       ?       ? 
1 1 1   46    6    4 o    355.5    2.5    0.0000   0.0000          ?        ?  1264.2728  17.8786          ?        ?      355.5        2.5       ?       ? 
1 1 1   46    6    5 o    211.8    3.0    0.0000   0.0000          ?        ?   448.8807  12.7704          ?        ?      211.8        3.0       ?       ? 
1 1 1   46    6    6 o    481.4    2.9    0.0000   0.0000          ?        ?  2318.4722  27.4564          ?        ?      481.4        2.9       ?       ? 
1 1 1   46    6    7 o    170.6    3.6    0.0000   0.0000          ?        ?   291.1659  12.1319          ?        ?      170.6        3.6       ?       ? 
1 1 1   46    6    8 o    117.4    4.9    0.0000   0.0000          ?        ?   137.9207  11.4934          ?        ?      117.4        4.9       ?       ? 
1 1 1   46    6    9 o     27.8   11.6    0.0000   0.0000          ?        ?     1.2770  10.8549          ?        ?       27.8       11.6       ?       ? 
1 1 1   46    6   10 o    153.7    3.9    0.0000   0.0000          ?        ?   236.2530  12.1319          ?        ?      153.7        3.9       ?       ? 
1 1 1   46    6   11 o    109.8    5.8    0.0000   0.0000          ?        ?   120.6806  12.7704          ?        ?      109.8        5.8       ?       ? 
1 1 1   46    6   12 o    403.5    2.7    0.0000   0.0000          ?        ?  1628.2301  21.7097          ?        ?      403.5        2.7       ?       ? 
1 1 1   46    6   13 o     16.5    8.2    0.0000   0.0000          ?        ?   -32.5646  11.4934          ?        ?       16.5        8.2       ?       ? 
1 1 1   46    6   14 o    305.3    2.6    0.0000   0.0000          ?        ?   932.2416  15.9630          ?        ?      305.3        2.6       ?       ? 
1 1 1   46    6   15 o    487.5    2.8    0.0000   0.0000          ?        ?  2377.2158  27.4564          ?        ?      487.5        2.8       ?       ? 
1 1 1   46    6   16 o    257.4    3.0    0.0000   0.0000          ?        ?   662.7855  15.3245          ?        ?      257.4        3.0       ?       ? 
1 1 1   46    6   17 o    434.5    2.6    0.0000   0.0000          ?        ?  1888.1085  22.3483          ?        ?      434.5        2.6       ?       ? 
1 1 1   46    6   18 o    331.1    2.5    0.0000   0.0000          ?        ?  1096.3416  16.6016          ?        ?      331.1        2.5       ?       ? 
1 1 1   46    6   19 o    166.2    4.2    0.0000   0.0000          ?        ?   276.4799  14.0475          ?        ?      166.2        4.2       ?       ? 
1 1 1   46    6   20 o    312.5    2.6    0.0000   0.0000          ?        ?   976.9381  15.9630          ?        ?      312.5        2.6       ?       ? 
1 1 1   46    6   21 o    101.6    6.3    0.0000   0.0000          ?        ?   103.4405  12.7704          ?        ?      101.6        6.3       ?       ? 
1 1 1   46    6   22 o    190.9    3.5    0.0000   0.0000          ?        ?   364.5958  13.4090          ?        ?      190.9        3.5       ?       ? 
1 1 1   46    6   23 o    339.3    2.4    0.0000   0.0000          ?        ?  1151.2545  16.6016          ?        ?      339.3        2.4       ?       ? 
1 1 1   46    6   24 f    187.3    3.9    0.0000   0.0000          ?        ?   351.1869  14.6860          ?        ?      187.3        3.9       ?       ? 
1 1 1   46    6   25 o    458.3    2.4    0.0000   0.0000          ?        ?  2101.3748  22.3483          ?        ?      458.3        2.4       ?       ? 
1 1 1   46    6   26 o    393.4    2.6    0.0000   0.0000          ?        ?  1547.7764  20.4327          ?        ?      393.4        2.6       ?       ? 
1 1 1   46    6   27 o    382.8    2.4    0.0000   0.0000          ?        ?  1466.0457  18.5171          ?        ?      382.8        2.4       ?       ? 
1 1 1   46    6   28 o    211.2    3.5    0.0000   0.0000          ?        ?   446.3266  14.6860          ?        ?      211.2        3.5       ?       ? 
1 1 1   46    6   29 o    406.1    2.6    0.0000   0.0000          ?        ?  1649.9398  21.0712          ?        ?      406.1        2.6       ?       ? 
1 1 1   46    6   30 o    118.4    6.5    0.0000   0.0000          ?        ?   140.4748  15.3245          ?        ?      118.4        6.5       ?       ? 
1 1 1   46    6   31 o    168.5    4.5    0.0000   0.0000          ?        ?   284.1421  15.3245          ?        ?      168.5        4.5       ?       ? 
1 1 1   46    6   32 o     40.3   14.7    0.0000   0.0000          ?        ?    13.4090  15.3245          ?        ?       40.3       14.7       ?       ? 
1 1 1   46    6   33 o    142.1    5.4    0.0000   0.0000          ?        ?   202.4114  15.3245          ?        ?      142.1        5.4       ?       ? 
1 1 1   46    6   34 f     22.7   10.9    0.0000   0.0000          ?        ?   -22.3483  14.6860          ?        ?       22.7       10.9       ?       ? 
1 1 1   46    6   35 o     96.7    8.3    0.0000   0.0000          ?        ?    93.8627  15.9630          ?        ?       96.7        8.3       ?       ? 
1 1 1   46    6   36 o    412.3    2.7    0.0000   0.0000          ?        ?  1700.3831  22.3483          ?        ?      412.3        2.7       ?       ? 
1 1 1   46    6   37 o    253.6    3.4    0.0000   0.0000          ?        ?   643.6298  17.2401          ?        ?      253.6        3.4       ?       ? 
1 1 1   46    6   38 o    137.3    5.8    0.0000   0.0000          ?        ?   189.0024  15.9630          ?        ?      137.3        5.8       ?       ? 
1 1 1   46    6   39 o    323.8    2.9    0.0000   0.0000          ?        ?  1049.0911  18.5171          ?        ?      323.8        2.9       ?       ? 
1 1 1   46    6   40 o    119.3    7.5    0.0000   0.0000          ?        ?   143.0288  17.8786          ?        ?      119.3        7.5       ?       ? 
1 1 1   46    6   41 o    409.6    2.8    0.0000   0.0000          ?        ?  1678.6733  22.9868          ?        ?      409.6        2.8       ?       ? 
1 1 1   46    6   42 o    300.6    3.2    0.0000   0.0000          ?        ?   904.1467  19.1556          ?        ?      300.6        3.2       ?       ? 
1 1 1   46    6   43 o    321.5    3.0    0.0000   0.0000          ?        ?  1034.4050  19.1556          ?        ?      321.5        3.0       ?       ? 
1 1 1   46    6   44 o    170.4    5.1    0.0000   0.0000          ?        ?   291.1659  17.2401          ?        ?      170.4        5.1       ?       ? 
1 1 1   46    6   45 o     19.0    9.6    0.0000   0.0000          ?        ?   -61.2981  17.8786          ?        ?       19.0        9.6       ?       ? 
1 1 1   46    6   46 o     98.4    9.4    0.0000   0.0000          ?        ?    97.6938  18.5171          ?        ?       98.4        9.4       ?       ? 
1 1 1   46    6   47 o    226.8    4.2    0.0000   0.0000          ?        ?   515.2869  19.1556          ?        ?      226.8        4.2       ?       ? 
1 1 1   46    6   48 o    255.7    3.9    0.0000   0.0000          ?        ?   655.1232  19.7942          ?        ?      255.7        3.9       ?       ? 
1 1 1   46    6   49 o    218.0    4.2    0.0000   0.0000          ?        ?   476.3371  18.5171          ?        ?      218.0        4.2       ?       ? 
1 1 1   46    6   50 o     82.0   10.9    0.0000   0.0000          ?        ?    68.3218  17.8786          ?        ?       82.0       10.9       ?       ? 
1 1 1   46    6   51 o     43.7   15.6    0.0000   0.0000          ?        ?    17.2401  17.2401          ?        ?       43.7       15.6       ?       ? 
1 1 1   46    6   52 o    167.8    5.3    0.0000   0.0000          ?        ?   282.8651  17.8786          ?        ?      167.8        5.3       ?       ? 
1 1 1   46    6   53 o    136.5    6.5    0.0000   0.0000          ?        ?   187.7254  17.8786          ?        ?      136.5        6.5       ?       ? 
1 1 1   46    6   54 o    205.5    4.5    0.0000   0.0000          ?        ?   423.9784  18.5171          ?        ?      205.5        4.5       ?       ? 
1 1 1   46    6   55 o    166.9    5.5    0.0000   0.0000          ?        ?   280.3110  18.5171          ?        ?      166.9        5.5       ?       ? 
1 1 1   46    7    0 o     51.7   17.4   34.4802  15.9630    34.4802  15.9630    34.4802  15.9630       51.7     17.4       51.7       17.4     0.0     0.0 
1 1 1   46    7    1 o    257.7    2.8    0.0000   0.0000          ?        ?   664.0625  14.6860          ?        ?      257.7        2.8       ?       ? 
1 1 1   46    7    2 o    289.5    2.9    0.0000   0.0000          ?        ?   838.3789  16.6016          ?        ?      289.5        2.9       ?       ? 
1 1 1   46    7    3 o    233.1    3.0    0.0000   0.0000          ?        ?   543.3819  14.0475          ?        ?      233.1        3.0       ?       ? 
1 1 1   46    7    4 f    389.1    2.8    0.0000   0.0000          ?        ?  1514.5732  21.7097          ?        ?      389.1        2.8       ?       ? 
1 1 1   46    7    5 o    560.6    2.8    0.0000   0.0000          ?        ?  3143.4419  31.2876          ?        ?      560.6        2.8       ?       ? 
1 1 1   46    7    6 o    495.0    2.7    0.0000   0.0000          ?        ?  2450.6460  26.8179          ?        ?      495.0        2.7       ?       ? 
1 1 1   46    7    7 o    113.8    5.0    0.0000   0.0000          ?        ?   129.6199  11.4934          ?        ?      113.8        5.0       ?       ? 
1 1 1   46    7    8 o    538.7    2.9    0.0000   0.0000          ?        ?  2903.3579  31.2876          ?        ?      538.7        2.9       ?       ? 
1 1 1   46    7    9 o    483.9    2.8    0.0000   0.0000          ?        ?  2342.0972  26.8179          ?        ?      483.9        2.8       ?       ? 
1 1 1   46    7   10 o    133.9    4.5    0.0000   0.0000          ?        ?   179.4246  12.1319          ?        ?      133.9        4.5       ?       ? 
1 1 1   46    7   11 o    369.4    2.5    0.0000   0.0000          ?        ?  1365.1593  18.5171          ?        ?      369.4        2.5       ?       ? 
1 1 1   46    7   12 o    363.3    2.5    0.0000   0.0000          ?        ?  1319.8242  18.5171          ?        ?      363.3        2.5       ?       ? 
1 1 1   46    7   13 o    422.3    2.6    0.0000   0.0000          ?        ?  1783.3909  21.7097          ?        ?      422.3        2.6       ?       ? 
1 1 1   46    7   14 o    392.0    2.8    0.0000   0.0000          ?        ?  1536.9215  21.7097          ?        ?      392.0        2.8       ?       ? 
1 1 1   46    7   15 f    149.7    4.1    0.0000   0.0000          ?        ?   224.1211  12.1319          ?        ?      149.7        4.1       ?       ? 
1 1 1   46    7   16 o    450.8    2.8    0.0000   0.0000          ?        ?  2033.0529  25.5409          ?        ?      450.8        2.8       ?       ? 
1 1 1   46    7   17 o    471.5    2.8    0.0000   0.0000          ?        ?  2223.9707  26.1794          ?        ?      471.5        2.8       ?       ? 
1 1 1   46    7   18 o    326.8    2.5    0.0000   0.0000          ?        ?  1068.2467  16.6016          ?        ?      326.8        2.5       ?       ? 
1 1 1   46    7   19 o    394.5    2.5    0.0000   0.0000          ?        ?  1556.7157  19.7942          ?        ?      394.5        2.5       ?       ? 
1 1 1   46    7   20 o    243.0    2.9    0.0000   0.0000          ?        ?   590.6325  14.0475          ?        ?      243.0        2.9       ?       ? 
1 1 1   46    7   21 o     77.4    7.8    0.0000   0.0000          ?        ?    60.0210  12.1319          ?        ?       77.4        7.8       ?       ? 
1 1 1   46    7   22 o    117.6    5.7    0.0000   0.0000          ?        ?   138.5592  13.4090          ?        ?      117.6        5.7       ?       ? 
1 1 1   46    7   23 o    321.3    2.6    0.0000   0.0000          ?        ?  1032.4895  16.6016          ?        ?      321.3        2.6       ?       ? 
1 1 1   46    7   24 o    445.1    2.5    0.0000   0.0000          ?        ?  1981.3325  22.3483          ?        ?      445.1        2.5       ?       ? 
1 1 1   46    7   25 o    260.3    2.9    0.0000   0.0000          ?        ?   678.1099  15.3245          ?        ?      260.3        2.9       ?       ? 
1 1 1   46    7   26 o    176.8    4.0    0.0000   0.0000          ?        ?   312.8756  14.0475          ?        ?      176.8        4.0       ?       ? 
1 1 1   46    7   27 o    183.2    4.0    0.0000   0.0000          ?        ?   335.8624  14.6860          ?        ?      183.2        4.0       ?       ? 
1 1 1   46    7   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46    7   29 o    253.1    3.2    0.0000   0.0000          ?        ?   641.0757  15.9630          ?        ?      253.1        3.2       ?       ? 
1 1 1   46    7   30 o    106.5    6.9    0.0000   0.0000          ?        ?   113.6568  14.6860          ?        ?      106.5        6.9       ?       ? 
1 1 1   46    7   31 o    673.6    2.9    0.0000   0.0000          ?        ?  4539.2505  38.9498          ?        ?      673.6        2.9       ?       ? 
1 1 1   46    7   32 o    510.6    2.6    0.0000   0.0000          ?        ?  2608.3608  26.8179          ?        ?      510.6        2.6       ?       ? 
1 1 1   46    7   33 o    138.7    5.8    0.0000   0.0000          ?        ?   192.8335  15.9630          ?        ?      138.7        5.8       ?       ? 
1 1 1   46    7   34 o    148.7    5.2    0.0000   0.0000          ?        ?   221.5670  15.3245          ?        ?      148.7        5.2       ?       ? 
1 1 1   46    7   35 o    323.5    2.8    0.0000   0.0000          ?        ?  1047.1754  17.8786          ?        ?      323.5        2.8       ?       ? 
1 1 1   46    7   36 o    357.4    2.8    0.0000   0.0000          ?        ?  1278.3203  19.7942          ?        ?      357.4        2.8       ?       ? 
1 1 1   46    7   37 o    185.0    4.7    0.0000   0.0000          ?        ?   342.8861  17.2401          ?        ?      185.0        4.7       ?       ? 
1 1 1   46    7   38 o    286.3    3.1    0.0000   0.0000          ?        ?   820.5003  17.8786          ?        ?      286.3        3.1       ?       ? 
1 1 1   46    7   39 o    215.0    4.0    0.0000   0.0000          ?        ?   462.9282  17.2401          ?        ?      215.0        4.0       ?       ? 
1 1 1   46    7   40 o    282.6    3.3    0.0000   0.0000          ?        ?   799.4291  18.5171          ?        ?      282.6        3.3       ?       ? 
1 1 1   46    7   41 o    203.3    4.2    0.0000   0.0000          ?        ?   413.7620  17.2401          ?        ?      203.3        4.2       ?       ? 
1 1 1   46    7   42 o     55.5   14.7    0.0000   0.0000          ?        ?    32.5646  16.6016          ?        ?       55.5       14.7       ?       ? 
1 1 1   46    7   43 f    230.2    4.0    0.0000   0.0000          ?        ?   530.6115  18.5171          ?        ?      230.2        4.0       ?       ? 
1 1 1   46    7   44 o    178.1    5.0    0.0000   0.0000          ?        ?   317.9838  17.8786          ?        ?      178.1        5.0       ?       ? 
1 1 1   46    7   45 o     28.5   13.2    0.0000   0.0000          ?        ?   -14.6860  17.8786          ?        ?       28.5       13.2       ?       ? 
1 1 1   46    7   46 o    296.3    3.2    0.0000   0.0000          ?        ?   879.2443  19.1556          ?        ?      296.3        3.2       ?       ? 
1 1 1   46    7   47 o    115.4    7.7    0.0000   0.0000          ?        ?   134.0895  17.8786          ?        ?      115.4        7.7       ?       ? 
1 1 1   46    7   48 o    211.6    4.2    0.0000   0.0000          ?        ?   448.8807  17.8786          ?        ?      211.6        4.2       ?       ? 
1 1 1   46    7   49 f    101.8    8.5    0.0000   0.0000          ?        ?   104.7175  17.2401          ?        ?      101.8        8.5       ?       ? 
1 1 1   46    7   50 o     63.7   14.4    0.0000   0.0000          ?        ?    43.4195  17.8786          ?        ?       63.7       14.4       ?       ? 
1 1 1   46    7   51 o     28.5   13.3    0.0000   0.0000          ?        ?   -18.5171  19.1556          ?        ?       28.5       13.3       ?       ? 
1 1 1   46    7   52 o     24.5   11.9    0.0000   0.0000          ?        ?   -31.2876  18.5171          ?        ?       24.5       11.9       ?       ? 
1 1 1   46    7   53 o     62.5   14.6    0.0000   0.0000          ?        ?    42.1424  17.8786          ?        ?       62.5       14.6       ?       ? 
1 1 1   46    7   54 o     29.3   13.5    0.0000   0.0000          ?        ?   -13.4090  18.5171          ?        ?       29.3       13.5       ?       ? 
1 1 1   46    8    0 o    157.2    5.7  248.3849  17.8786   248.3849  17.8786   248.3849  17.8786      157.2      5.7      157.2        5.7     0.0     0.0 
1 1 1   46    8    1 o    210.6    3.0    0.0000   0.0000          ?        ?   443.7725  12.7704          ?        ?      210.6        3.0       ?       ? 
1 1 1   46    8    2 o    244.3    2.6    0.0000   0.0000          ?        ?   597.0177  12.7704          ?        ?      244.3        2.6       ?       ? 
1 1 1   46    8    3 o    431.5    2.4    0.0000   0.0000          ?        ?  1862.5676  21.0712          ?        ?      431.5        2.4       ?       ? 
1 1 1   46    8    4 o    166.6    3.3    0.0000   0.0000          ?        ?   277.7569  10.8549          ?        ?      166.6        3.3       ?       ? 
1 1 1   46    8    5 f    317.4    2.6    0.0000   0.0000          ?        ?  1007.5872  16.6016          ?        ?      317.4        2.6       ?       ? 
1 1 1   46    8    6 o    417.4    2.6    0.0000   0.0000          ?        ?  1742.5255  21.7097          ?        ?      417.4        2.6       ?       ? 
1 1 1   46    8    7 o    105.4    5.2    0.0000   0.0000          ?        ?   111.1028  10.8549          ?        ?      105.4        5.2       ?       ? 
1 1 1   46    8    8 o    438.7    2.6    0.0000   0.0000          ?        ?  1925.1427  22.9868          ?        ?      438.7        2.6       ?       ? 
1 1 1   46    8    9 o    391.7    2.6    0.0000   0.0000          ?        ?  1534.3674  20.4327          ?        ?      391.7        2.6       ?       ? 
1 1 1   46    8   10 o    751.4    3.4    0.0000   0.0000          ?        ?  5648.3623  51.0817          ?        ?      751.4        3.4       ?       ? 
1 1 1   46    8   11 o    273.7    2.9    0.0000   0.0000          ?        ?   749.6244  15.9630          ?        ?      273.7        2.9       ?       ? 
1 1 1   46    8   12 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46    8   13 o    132.0    4.8    0.0000   0.0000          ?        ?   174.3164  12.7704          ?        ?      132.0        4.8       ?       ? 
1 1 1   46    8   14 o    707.1    3.3    0.0000   0.0000          ?        ?  5001.5400  46.6121          ?        ?      707.1        3.3       ?       ? 
1 1 1   46    8   15 o    190.2    3.5    0.0000   0.0000          ?        ?   362.0418  13.4090          ?        ?      190.2        3.5       ?       ? 
1 1 1   46    8   16 o    150.3    4.2    0.0000   0.0000          ?        ?   226.0367  12.7704          ?        ?      150.3        4.2       ?       ? 
1 1 1   46    8   17 o    369.5    2.7    0.0000   0.0000          ?        ?  1365.7977  19.7942          ?        ?      369.5        2.7       ?       ? 
1 1 1   46    8   18 o    467.9    2.7    0.0000   0.0000          ?        ?  2190.1292  24.9023          ?        ?      467.9        2.7       ?       ? 
1 1 1   46    8   19 o     24.4   11.2    0.0000   0.0000          ?        ?   -10.2163  12.7704          ?        ?       24.4       11.2       ?       ? 
1 1 1   46    8   20 o    343.5    2.6    0.0000   0.0000          ?        ?  1180.6265  17.8786          ?        ?      343.5        2.6       ?       ? 
1 1 1   46    8   21 o    200.8    3.3    0.0000   0.0000          ?        ?   403.5457  13.4090          ?        ?      200.8        3.3       ?       ? 
1 1 1   46    8   22 o     30.8   12.7    0.0000   0.0000          ?        ?     2.5541  12.7704          ?        ?       30.8       12.7       ?       ? 
1 1 1   46    8   23 o    439.5    2.6    0.0000   0.0000          ?        ?  1932.1665  22.9868          ?        ?      439.5        2.6       ?       ? 
1 1 1   46    8   24 o     83.3    8.1    0.0000   0.0000          ?        ?    69.5989  13.4090          ?        ?       83.3        8.1       ?       ? 
1 1 1   46    8   25 o    239.9    3.2    0.0000   0.0000          ?        ?   575.9465  15.3245          ?        ?      239.9        3.2       ?       ? 
1 1 1   46    8   26 o    351.6    2.5    0.0000   0.0000          ?        ?  1236.8164  17.8786          ?        ?      351.6        2.5       ?       ? 
1 1 1   46    8   27 o    106.5    6.6    0.0000   0.0000          ?        ?   113.6568  14.0475          ?        ?      106.5        6.6       ?       ? 
1 1 1   46    8   28 o    133.1    5.3    0.0000   0.0000          ?        ?   177.5090  14.0475          ?        ?      133.1        5.3       ?       ? 
1 1 1   46    8   29 o    310.4    2.7    0.0000   0.0000          ?        ?   964.1677  16.6016          ?        ?      310.4        2.7       ?       ? 
1 1 1   46    8   30 o    303.1    2.9    0.0000   0.0000          ?        ?   919.4711  17.8786          ?        ?      303.1        2.9       ?       ? 
1 1 1   46    8   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46    8   32 o    335.1    2.8    0.0000   0.0000          ?        ?  1123.1595  18.5171          ?        ?      335.1        2.8       ?       ? 
1 1 1   46    8   33 o    164.4    4.7    0.0000   0.0000          ?        ?   270.7332  15.3245          ?        ?      164.4        4.7       ?       ? 
1 1 1   46    8   34 f     32.0   13.6    0.0000   0.0000          ?        ?     0.0000  15.3245          ?        ?       32.0       13.6       ?       ? 
1 1 1   46    8   35 o    239.4    3.5    0.0000   0.0000          ?        ?   573.3925  16.6016          ?        ?      239.4        3.5       ?       ? 
1 1 1   46    8   36 o    248.5    3.3    0.0000   0.0000          ?        ?   618.0889  16.6016          ?        ?      248.5        3.3       ?       ? 
1 1 1   46    8   37 o    331.2    2.8    0.0000   0.0000          ?        ?  1097.6187  18.5171          ?        ?      331.2        2.8       ?       ? 
1 1 1   46    8   38 o     86.2    8.9    0.0000   0.0000          ?        ?    74.7070  15.3245          ?        ?       86.2        8.9       ?       ? 
1 1 1   46    8   39 f     19.5    9.8    0.0000   0.0000          ?        ?   -48.5276  16.6016          ?        ?       19.5        9.8       ?       ? 
1 1 1   46    8   40 o    255.5    3.4    0.0000   0.0000          ?        ?   653.2076  17.2401          ?        ?      255.5        3.4       ?       ? 
1 1 1   46    8   41 o     37.7   14.9    0.0000   0.0000          ?        ?     8.3008  16.6016          ?        ?       37.7       14.9       ?       ? 
1 1 1   46    8   42 o     74.1   11.2    0.0000   0.0000          ?        ?    55.5514  16.6016          ?        ?       74.1       11.2       ?       ? 
1 1 1   46    8   43 o    259.4    3.7    0.0000   0.0000          ?        ?   673.6403  19.1556          ?        ?      259.4        3.7       ?       ? 
1 1 1   46    8   44 o    155.7    5.7    0.0000   0.0000          ?        ?   243.2767  17.8786          ?        ?      155.7        5.7       ?       ? 
1 1 1   46    8   45 o    235.4    3.8    0.0000   0.0000          ?        ?   554.8753  17.8786          ?        ?      235.4        3.8       ?       ? 
1 1 1   46    8   46 f     41.7   15.5    0.0000   0.0000          ?        ?    14.0475  17.2401          ?        ?       41.7       15.5       ?       ? 
1 1 1   46    8   47 o    217.3    4.3    0.0000   0.0000          ?        ?   473.1445  18.5171          ?        ?      217.3        4.3       ?       ? 
1 1 1   46    8   48 f     95.0    9.1    0.0000   0.0000          ?        ?    91.3086  17.2401          ?        ?       95.0        9.1       ?       ? 
1 1 1   46    8   49 f    166.5    5.4    0.0000   0.0000          ?        ?   278.3954  17.8786          ?        ?      166.5        5.4       ?       ? 
1 1 1   46    8   50 o    160.2    5.6    0.0000   0.0000          ?        ?   257.9627  17.8786          ?        ?      160.2        5.6       ?       ? 
1 1 1   46    8   51 o     59.6   15.4    0.0000   0.0000          ?        ?    38.3113  18.5171          ?        ?       59.6       15.4       ?       ? 
1 1 1   46    8   52 o    152.4    5.9    0.0000   0.0000          ?        ?   233.6989  17.8786          ?        ?      152.4        5.9       ?       ? 
1 1 1   46    8   53 o     73.9   12.1    0.0000   0.0000          ?        ?    56.1899  17.8786          ?        ?       73.9       12.1       ?       ? 
1 1 1   46    9    0 o    277.9    3.6  772.6111  19.7942   772.6111  19.7942   772.6111  19.7942      277.9      3.6      277.9        3.6     0.0     0.0 
1 1 1   46    9    1 o    309.9    2.5    0.0000   0.0000          ?        ?   960.3365  15.3245          ?        ?      309.9        2.5       ?       ? 
1 1 1   46    9    2 o    444.6    2.6    0.0000   0.0000          ?        ?  1977.5016  22.9868          ?        ?      444.6        2.6       ?       ? 
1 1 1   46    9    3 o    549.5    2.9    0.0000   0.0000          ?        ?  3020.8459  31.9261          ?        ?      549.5        2.9       ?       ? 
1 1 1   46    9    4 o    754.1    3.4    0.0000   0.0000          ?        ?  5689.8662  51.7203          ?        ?      754.1        3.4       ?       ? 
1 1 1   46    9    5 o    458.2    2.7    0.0000   0.0000          ?        ?  2100.0977  24.9023          ?        ?      458.2        2.7       ?       ? 
1 1 1   46    9    6 o    465.2    2.5    0.0000   0.0000          ?        ?  2164.5884  22.9868          ?        ?      465.2        2.5       ?       ? 
1 1 1   46    9    7 o    361.0    2.7    0.0000   0.0000          ?        ?  1303.8611  19.1556          ?        ?      361.0        2.7       ?       ? 
1 1 1   46    9    8 o    353.6    2.6    0.0000   0.0000          ?        ?  1250.8638  18.5171          ?        ?      353.6        2.6       ?       ? 
1 1 1   46    9    9 o    453.1    2.7    0.0000   0.0000          ?        ?  2053.4856  24.2638          ?        ?      453.1        2.7       ?       ? 
1 1 1   46    9   10 o    252.5    2.9    0.0000   0.0000          ?        ?   637.8831  14.6860          ?        ?      252.5        2.9       ?       ? 
1 1 1   46    9   11 o    500.0    2.9    0.0000   0.0000          ?        ?  2501.0894  28.7335          ?        ?      500.0        2.9       ?       ? 
1 1 1   46    9   12 o    624.2    3.0    0.0000   0.0000          ?        ?  3897.5361  37.6728          ?        ?      624.2        3.0       ?       ? 
1 1 1   46    9   13 o    479.8    2.7    0.0000   0.0000          ?        ?  2303.1477  26.1794          ?        ?      479.8        2.7       ?       ? 
1 1 1   46    9   14 o    283.6    2.8    0.0000   0.0000          ?        ?   804.5372  15.9630          ?        ?      283.6        2.8       ?       ? 
1 1 1   46    9   15 o     92.4    6.2    0.0000   0.0000          ?        ?    85.5619  11.4934          ?        ?       92.4        6.2       ?       ? 
1 1 1   46    9   16 o    409.0    2.7    0.0000   0.0000          ?        ?  1673.5652  22.3483          ?        ?      409.0        2.7       ?       ? 
1 1 1   46    9   17 o    290.3    2.7    0.0000   0.0000          ?        ?   842.8486  15.9630          ?        ?      290.3        2.7       ?       ? 
1 1 1   46    9   18 f    226.7    3.2    0.0000   0.0000          ?        ?   514.0099  14.6860          ?        ?      226.7        3.2       ?       ? 
1 1 1   46    9   19 o     53.0   12.3    0.0000   0.0000          ?        ?    29.3720  12.7704          ?        ?       53.0       12.3       ?       ? 
1 1 1   46    9   20 o    384.8    2.5    0.0000   0.0000          ?        ?  1481.3701  19.1556          ?        ?      384.8        2.5       ?       ? 
1 1 1   46    9   21 o    107.1    6.3    0.0000   0.0000          ?        ?   114.9339  13.4090          ?        ?      107.1        6.3       ?       ? 
1 1 1   46    9   22 o    187.2    3.8    0.0000   0.0000          ?        ?   350.5484  14.0475          ?        ?      187.2        3.8       ?       ? 
1 1 1   46    9   23 o    638.7    2.7    0.0000   0.0000          ?        ?  4081.4304  34.4802          ?        ?      638.7        2.7       ?       ? 
1 1 1   46    9   24 o    162.7    4.3    0.0000   0.0000          ?        ?   264.9865  14.0475          ?        ?      162.7        4.3       ?       ? 
1 1 1   46    9   25 o    474.2    2.6    0.0000   0.0000          ?        ?  2249.5117  24.2638          ?        ?      474.2        2.6       ?       ? 
1 1 1   46    9   26 o    191.0    3.7    0.0000   0.0000          ?        ?   365.2344  14.0475          ?        ?      191.0        3.7       ?       ? 
1 1 1   46    9   27 o    112.6    6.2    0.0000   0.0000          ?        ?   127.0658  14.0475          ?        ?      112.6        6.2       ?       ? 
1 1 1   46    9   28 o    167.1    4.6    0.0000   0.0000          ?        ?   279.6725  15.3245          ?        ?      167.1        4.6       ?       ? 
1 1 1   46    9   29 o    171.8    4.3    0.0000   0.0000          ?        ?   295.6355  14.6860          ?        ?      171.8        4.3       ?       ? 
1 1 1   46    9   30 o    327.5    2.8    0.0000   0.0000          ?        ?  1073.3549  18.5171          ?        ?      327.5        2.8       ?       ? 
1 1 1   46    9   31 o    404.5    2.6    0.0000   0.0000          ?        ?  1636.5309  21.0712          ?        ?      404.5        2.6       ?       ? 
1 1 1   46    9   32 o    273.9    3.1    0.0000   0.0000          ?        ?   750.9014  17.2401          ?        ?      273.9        3.1       ?       ? 
1 1 1   46    9   33 o    218.7    3.6    0.0000   0.0000          ?        ?   478.8912  15.9630          ?        ?      218.7        3.6       ?       ? 
1 1 1   46    9   34 o    238.6    3.5    0.0000   0.0000          ?        ?   569.5613  16.6016          ?        ?      238.6        3.5       ?       ? 
1 1 1   46    9   35 o    147.0    5.4    0.0000   0.0000          ?        ?   216.4588  15.9630          ?        ?      147.0        5.4       ?       ? 
1 1 1   46    9   36 o    166.7    4.8    0.0000   0.0000          ?        ?   278.3954  15.9630          ?        ?      166.7        4.8       ?       ? 
1 1 1   46    9   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46    9   38 o    228.4    3.8    0.0000   0.0000          ?        ?   522.3107  17.2401          ?        ?      228.4        3.8       ?       ? 
1 1 1   46    9   39 o    258.8    3.5    0.0000   0.0000          ?        ?   670.4477  17.8786          ?        ?      258.8        3.5       ?       ? 
1 1 1   46    9   40 o     43.2   15.3    0.0000   0.0000          ?        ?    16.6016  16.6016          ?        ?       43.2       15.3       ?       ? 
1 1 1   46    9   41 o    248.2    3.7    0.0000   0.0000          ?        ?   616.8119  18.5171          ?        ?      248.2        3.7       ?       ? 
1 1 1   46    9   42 o     35.6   14.4    0.0000   0.0000          ?        ?     5.7467  15.9630          ?        ?       35.6       14.4       ?       ? 
1 1 1   46    9   43 o    264.0    3.6    0.0000   0.0000          ?        ?   697.9042  19.1556          ?        ?      264.0        3.6       ?       ? 
1 1 1   46    9   44 o     21.9   10.8    0.0000   0.0000          ?        ?   -38.3113  17.2401          ?        ?       21.9       10.8       ?       ? 
1 1 1   46    9   45 o    389.3    2.8    0.0000   0.0000          ?        ?  1517.1274  21.7097          ?        ?      389.3        2.8       ?       ? 
1 1 1   46    9   46 f     36.3   14.9    0.0000   0.0000          ?        ?     5.1082  17.2401          ?        ?       36.3       14.9       ?       ? 
1 1 1   46    9   47 o     22.5   11.1    0.0000   0.0000          ?        ?   -38.3113  17.8786          ?        ?       22.5       11.1       ?       ? 
1 1 1   46    9   48 o     47.4   15.7    0.0000   0.0000          ?        ?    22.3483  17.2401          ?        ?       47.4       15.7       ?       ? 
1 1 1   46    9   49 o    281.4    3.4    0.0000   0.0000          ?        ?   793.0438  19.1556          ?        ?      281.4        3.4       ?       ? 
1 1 1   46    9   50 o    242.2    3.7    0.0000   0.0000          ?        ?   588.0784  17.8786          ?        ?      242.2        3.7       ?       ? 
1 1 1   46    9   51 o     94.1    9.5    0.0000   0.0000          ?        ?    90.0316  17.8786          ?        ?       94.1        9.5       ?       ? 
1 1 1   46    9   52 o     21.9   10.8    0.0000   0.0000          ?        ?   -37.6728  17.2401          ?        ?       21.9       10.8       ?       ? 
1 1 1   46    9   53 o     28.6   13.2    0.0000   0.0000          ?        ?   -13.4090  17.8786          ?        ?       28.6       13.2       ?       ? 
1 1 1   46   10    0 o     86.7    8.2   77.2611  14.0475    77.2611  14.0475    77.2611  14.0475       86.7      8.2       86.7        8.2     0.0     0.0 
1 1 1   46   10    1 o    179.5    3.2    0.0000   0.0000          ?        ?   322.4534  11.4934          ?        ?      179.5        3.2       ?       ? 
1 1 1   46   10    2 o     92.1    6.2    0.0000   0.0000          ?        ?    84.9234  11.4934          ?        ?       92.1        6.2       ?       ? 
1 1 1   46   10    3 o    430.3    2.5    0.0000   0.0000          ?        ?  1851.7128  21.7097          ?        ?      430.3        2.5       ?       ? 
1 1 1   46   10    4 o    656.9    3.0    0.0000   0.0000          ?        ?  4317.0444  38.9498          ?        ?      656.9        3.0       ?       ? 
1 1 1   46   10    5 o    400.8    2.5    0.0000   0.0000          ?        ?  1607.1589  20.4327          ?        ?      400.8        2.5       ?       ? 
1 1 1   46   10    6 o    244.6    2.7    0.0000   0.0000          ?        ?   598.2947  13.4090          ?        ?      244.6        2.7       ?       ? 
1 1 1   46   10    7 o    159.4    3.8    0.0000   0.0000          ?        ?   254.1316  12.1319          ?        ?      159.4        3.8       ?       ? 
1 1 1   46   10    8 o    392.9    2.6    0.0000   0.0000          ?        ?  1543.9453  20.4327          ?        ?      392.9        2.6       ?       ? 
1 1 1   46   10    9 o    244.9    2.9    0.0000   0.0000          ?        ?   600.2103  14.0475          ?        ?      244.9        2.9       ?       ? 
1 1 1   46   10   10 o     57.7   10.3    0.0000   0.0000          ?        ?    34.4802  11.4934          ?        ?       57.7       10.3       ?       ? 
1 1 1   46   10   11 o    215.3    2.8    0.0000   0.0000          ?        ?   463.5667  12.1319          ?        ?      215.3        2.8       ?       ? 
1 1 1   46   10   12 o    345.3    2.6    0.0000   0.0000          ?        ?  1192.7584  17.8786          ?        ?      345.3        2.6       ?       ? 
1 1 1   46   10   13 o    215.7    3.3    0.0000   0.0000          ?        ?   465.4823  14.0475          ?        ?      215.7        3.3       ?       ? 
1 1 1   46   10   14 o     73.6    8.2    0.0000   0.0000          ?        ?    54.2743  12.1319          ?        ?       73.6        8.2       ?       ? 
1 1 1   46   10   15 o    135.3    4.7    0.0000   0.0000          ?        ?   183.2557  12.7704          ?        ?      135.3        4.7       ?       ? 
1 1 1   46   10   16 o     86.7    7.0    0.0000   0.0000          ?        ?    75.3456  12.1319          ?        ?       86.7        7.0       ?       ? 
1 1 1   46   10   17 o    435.5    2.9    0.0000   0.0000          ?        ?  1897.0479  24.9023          ?        ?      435.5        2.9       ?       ? 
1 1 1   46   10   18 f    114.0    5.9    0.0000   0.0000          ?        ?   130.2584  13.4090          ?        ?      114.0        5.9       ?       ? 
1 1 1   46   10   19 o    189.2    3.5    0.0000   0.0000          ?        ?   358.2106  13.4090          ?        ?      189.2        3.5       ?       ? 
1 1 1   46   10   20 o    213.8    3.4    0.0000   0.0000          ?        ?   457.1815  14.6860          ?        ?      213.8        3.4       ?       ? 
1 1 1   46   10   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46   10   22 o    283.4    2.8    0.0000   0.0000          ?        ?   803.2603  15.9630          ?        ?      283.4        2.8       ?       ? 
1 1 1   46   10   23 o    199.7    3.4    0.0000   0.0000          ?        ?   399.0760  13.4090          ?        ?      199.7        3.4       ?       ? 
1 1 1   46   10   24 o    158.7    4.2    0.0000   0.0000          ?        ?   252.2160  13.4090          ?        ?      158.7        4.2       ?       ? 
1 1 1   46   10   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46   10   26 o    306.5    2.7    0.0000   0.0000          ?        ?   939.9038  16.6016          ?        ?      306.5        2.7       ?       ? 
1 1 1   46   10   27 o     30.0   13.1    0.0000   0.0000          ?        ?    -2.5541  14.6860          ?        ?       30.0       13.1       ?       ? 
1 1 1   46   10   28 o    110.9    6.3    0.0000   0.0000          ?        ?   123.2347  14.0475          ?        ?      110.9        6.3       ?       ? 
1 1 1   46   10   29 o    432.6    2.6    0.0000   0.0000          ?        ?  1872.1455  22.3483          ?        ?      432.6        2.6       ?       ? 
1 1 1   46   10   30 o    147.4    5.0    0.0000   0.0000          ?        ?   217.7359  14.6860          ?        ?      147.4        5.0       ?       ? 
1 1 1   46   10   31 o    375.0    2.6    0.0000   0.0000          ?        ?  1406.6632  19.7942          ?        ?      375.0        2.6       ?       ? 
1 1 1   46   10   32 o    163.1    4.7    0.0000   0.0000          ?        ?   266.2635  15.3245          ?        ?      163.1        4.7       ?       ? 
1 1 1   46   10   33 o    542.4    2.6    0.0000   0.0000          ?        ?  2943.5847  28.0950          ?        ?      542.4        2.6       ?       ? 
1 1 1   46   10   34 o     17.0    8.6    0.0000   0.0000          ?        ?   -51.7203  14.6860          ?        ?       17.0        8.6       ?       ? 
1 1 1   46   10   35 o    199.3    4.0    0.0000   0.0000          ?        ?   397.7990  15.9630          ?        ?      199.3        4.0       ?       ? 
1 1 1   46   10   36 o    142.1    5.6    0.0000   0.0000          ?        ?   202.4114  15.9630          ?        ?      142.1        5.6       ?       ? 
1 1 1   46   10   37 o     18.6    9.4    0.0000   0.0000          ?        ?   -50.4432  15.9630          ?        ?       18.6        9.4       ?       ? 
1 1 1   46   10   38 o    504.7    2.7    0.0000   0.0000          ?        ?  2548.9785  26.8179          ?        ?      504.7        2.7       ?       ? 
1 1 1   46   10   39 o     46.7   15.1    0.0000   0.0000          ?        ?    21.7097  15.9630          ?        ?       46.7       15.1       ?       ? 
1 1 1   46   10   40 o    120.1    6.9    0.0000   0.0000          ?        ?   144.9444  16.6016          ?        ?      120.1        6.9       ?       ? 
1 1 1   46   10   41 o     99.8    8.3    0.0000   0.0000          ?        ?   100.2479  16.6016          ?        ?       99.8        8.3       ?       ? 
1 1 1   46   10   42 o    408.7    2.7    0.0000   0.0000          ?        ?  1671.6495  22.3483          ?        ?      408.7        2.7       ?       ? 
1 1 1   46   10   43 o    263.8    3.5    0.0000   0.0000          ?        ?   696.6271  18.5171          ?        ?      263.8        3.5       ?       ? 
1 1 1   46   10   44 o    184.4    4.7    0.0000   0.0000          ?        ?   340.9706  17.2401          ?        ?      184.4        4.7       ?       ? 
1 1 1   46   10   45 o     99.7    8.3    0.0000   0.0000          ?        ?   100.2479  16.6016          ?        ?       99.7        8.3       ?       ? 
1 1 1   46   10   46 o    215.5    4.3    0.0000   0.0000          ?        ?   465.4823  18.5171          ?        ?      215.5        4.3       ?       ? 
1 1 1   46   10   47 o    250.0    3.8    0.0000   0.0000          ?        ?   626.3897  19.1556          ?        ?      250.0        3.8       ?       ? 
1 1 1   46   10   48 o    297.9    3.3    0.0000   0.0000          ?        ?   888.8221  19.7942          ?        ?      297.9        3.3       ?       ? 
1 1 1   46   10   49 o    301.5    3.3    0.0000   0.0000          ?        ?   910.5319  19.7942          ?        ?      301.5        3.3       ?       ? 
1 1 1   46   10   50 o     19.1    9.7    0.0000   0.0000          ?        ?   -59.3825  17.8786          ?        ?       19.1        9.7       ?       ? 
1 1 1   46   10   51 o     83.6   11.1    0.0000   0.0000          ?        ?    71.5144  18.5171          ?        ?       83.6       11.1       ?       ? 
1 1 1   46   10   52 o     19.6    9.9    0.0000   0.0000          ?        ?   -55.5514  17.8786          ?        ?       19.6        9.9       ?       ? 
1 1 1   46   11    0 o     31.1   16.7   14.0475  14.0475    14.0475  14.0475    14.0475  14.0475       31.1     16.7       31.1       16.7     0.0     0.0 
1 1 1   46   11    1 o    320.2    2.4    0.0000   0.0000          ?        ?  1025.4658  15.3245          ?        ?      320.2        2.4       ?       ? 
1 1 1   46   11    2 o    457.6    2.5    0.0000   0.0000          ?        ?  2094.9895  22.9868          ?        ?      457.6        2.5       ?       ? 
1 1 1   46   11    3 o    496.4    2.7    0.0000   0.0000          ?        ?  2464.6934  26.8179          ?        ?      496.4        2.7       ?       ? 
1 1 1   46   11    4 o    219.1    2.9    0.0000   0.0000          ?        ?   480.1682  12.7704          ?        ?      219.1        2.9       ?       ? 
1 1 1   46   11    5 o    146.9    3.7    0.0000   0.0000          ?        ?   215.8203  10.8549          ?        ?      146.9        3.7       ?       ? 
1 1 1   46   11    6 o    641.1    3.0    0.0000   0.0000          ?        ?  4111.4409  38.9498          ?        ?      641.1        3.0       ?       ? 
1 1 1   46   11    7 o    411.4    2.5    0.0000   0.0000          ?        ?  1692.7208  20.4327          ?        ?      411.4        2.5       ?       ? 
1 1 1   46   11    8 o    290.9    2.6    0.0000   0.0000          ?        ?   846.6797  15.3245          ?        ?      290.9        2.6       ?       ? 
1 1 1   46   11    9 o    201.8    3.3    0.0000   0.0000          ?        ?   407.3768  13.4090          ?        ?      201.8        3.3       ?       ? 
1 1 1   46   11   10 o    281.8    2.6    0.0000   0.0000          ?        ?   794.3209  14.6860          ?        ?      281.8        2.6       ?       ? 
1 1 1   46   11   11 o    258.9    2.7    0.0000   0.0000          ?        ?   670.4477  14.0475          ?        ?      258.9        2.7       ?       ? 
1 1 1   46   11   12 o    261.7    2.8    0.0000   0.0000          ?        ?   685.1337  14.6860          ?        ?      261.7        2.8       ?       ? 
1 1 1   46   11   13 o    356.2    2.7    0.0000   0.0000          ?        ?  1269.3810  19.1556          ?        ?      356.2        2.7       ?       ? 
1 1 1   46   11   14 o    310.5    2.7    0.0000   0.0000          ?        ?   964.1677  16.6016          ?        ?      310.5        2.7       ?       ? 
1 1 1   46   11   15 o    110.6    5.5    0.0000   0.0000          ?        ?   122.5962  12.1319          ?        ?      110.6        5.5       ?       ? 
1 1 1   46   11   16 o    119.5    5.6    0.0000   0.0000          ?        ?   143.0288  13.4090          ?        ?      119.5        5.6       ?       ? 
1 1 1   46   11   17 o    192.7    3.3    0.0000   0.0000          ?        ?   371.6196  12.7704          ?        ?      192.7        3.3       ?       ? 
1 1 1   46   11   18 o    153.8    4.4    0.0000   0.0000          ?        ?   236.8915  13.4090          ?        ?      153.8        4.4       ?       ? 
1 1 1   46   11   19 o     23.6   11.0    0.0000   0.0000          ?        ?   -12.1319  12.7704          ?        ?       23.6       11.0       ?       ? 
1 1 1   46   11   20 o    222.0    3.3    0.0000   0.0000          ?        ?   492.9387  14.6860          ?        ?      222.0        3.3       ?       ? 
1 1 1   46   11   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46   11   22 o    464.9    2.6    0.0000   0.0000          ?        ?  2162.0342  24.2638          ?        ?      464.9        2.6       ?       ? 
1 1 1   46   11   23 o    273.7    2.9    0.0000   0.0000          ?        ?   749.6244  15.9630          ?        ?      273.7        2.9       ?       ? 
1 1 1   46   11   24 o    185.1    3.6    0.0000   0.0000          ?        ?   342.8861  13.4090          ?        ?      185.1        3.6       ?       ? 
1 1 1   46   11   25 o    341.5    2.5    0.0000   0.0000          ?        ?  1166.5790  17.2401          ?        ?      341.5        2.5       ?       ? 
1 1 1   46   11   26 f    137.8    5.1    0.0000   0.0000          ?        ?   190.2794  14.0475          ?        ?      137.8        5.1       ?       ? 
1 1 1   46   11   27 o    257.6    3.1    0.0000   0.0000          ?        ?   664.0625  15.9630          ?        ?      257.6        3.1       ?       ? 
1 1 1   46   11   28 o     74.3    9.5    0.0000   0.0000          ?        ?    55.5514  14.0475          ?        ?       74.3        9.5       ?       ? 
1 1 1   46   11   29 o    396.3    2.7    0.0000   0.0000          ?        ?  1571.4017  21.0712          ?        ?      396.3        2.7       ?       ? 
1 1 1   46   11   30 o    205.7    3.7    0.0000   0.0000          ?        ?   423.3398  15.3245          ?        ?      205.7        3.7       ?       ? 
1 1 1   46   11   31 o    145.2    5.3    0.0000   0.0000          ?        ?   211.3506  15.3245          ?        ?      145.2        5.3       ?       ? 
1 1 1   46   11   32 o    356.8    2.7    0.0000   0.0000          ?        ?  1273.8506  19.1556          ?        ?      356.8        2.7       ?       ? 
1 1 1   46   11   33 o    118.0    6.8    0.0000   0.0000          ?        ?   139.8362  15.9630          ?        ?      118.0        6.8       ?       ? 
1 1 1   46   11   34 o     53.9   14.1    0.0000   0.0000          ?        ?    30.6490  15.3245          ?        ?       53.9       14.1       ?       ? 
1 1 1   46   11   35 o    251.7    3.6    0.0000   0.0000          ?        ?   634.0520  17.8786          ?        ?      251.7        3.6       ?       ? 
1 1 1   46   11   36 o    264.3    3.3    0.0000   0.0000          ?        ?   699.1812  17.2401          ?        ?      264.3        3.3       ?       ? 
1 1 1   46   11   37 o     90.8    8.8    0.0000   0.0000          ?        ?    83.0078  15.9630          ?        ?       90.8        8.8       ?       ? 
1 1 1   46   11   38 o     82.3   10.1    0.0000   0.0000          ?        ?    68.3218  16.6016          ?        ?       82.3       10.1       ?       ? 
1 1 1   46   11   39 f    227.5    3.9    0.0000   0.0000          ?        ?   518.4796  17.8786          ?        ?      227.5        3.9       ?       ? 
1 1 1   46   11   40 o    252.8    3.5    0.0000   0.0000          ?        ?   639.7986  17.8786          ?        ?      252.8        3.5       ?       ? 
1 1 1   46   11   41 o     26.9   12.6    0.0000   0.0000          ?        ?   -15.3245  16.6016          ?        ?       26.9       12.6       ?       ? 
1 1 1   46   11   42 o    341.8    3.0    0.0000   0.0000          ?        ?  1169.1332  20.4327          ?        ?      341.8        3.0       ?       ? 
1 1 1   46   11   43 o    262.4    3.5    0.0000   0.0000          ?        ?   689.6033  18.5171          ?        ?      262.4        3.5       ?       ? 
1 1 1   46   11   44 o     87.7    9.8    0.0000   0.0000          ?        ?    77.8996  17.2401          ?        ?       87.7        9.8       ?       ? 
1 1 1   46   11   45 o    221.5    4.0    0.0000   0.0000          ?        ?   491.6617  17.8786          ?        ?      221.5        4.0       ?       ? 
1 1 1   46   11   46 o    134.7    6.6    0.0000   0.0000          ?        ?   182.6172  17.8786          ?        ?      134.7        6.6       ?       ? 
1 1 1   46   11   47 o    150.4    5.9    0.0000   0.0000          ?        ?   227.3137  17.8786          ?        ?      150.4        5.9       ?       ? 
1 1 1   46   11   48 o     33.0   14.4    0.0000   0.0000          ?        ?    -2.5541  17.8786          ?        ?       33.0       14.4       ?       ? 
1 1 1   46   11   49 o     91.7    9.7    0.0000   0.0000          ?        ?    85.5619  17.8786          ?        ?       91.7        9.7       ?       ? 
1 1 1   46   11   50 o     57.5   14.9    0.0000   0.0000          ?        ?    35.7572  17.2401          ?        ?       57.5       14.9       ?       ? 
1 1 1   46   11   51 o     91.3    9.1    0.0000   0.0000          ?        ?    84.9234  16.6016          ?        ?       91.3        9.1       ?       ? 
1 1 1   46   12    0 o    241.9    3.7  585.5243  17.8786   585.5243  17.8786   585.5243  17.8786      241.9      3.7      241.9        3.7     0.0     0.0 
1 1 1   46   12    1 o    295.4    2.5    0.0000   0.0000          ?        ?   872.8591  14.6860          ?        ?      295.4        2.5       ?       ? 
1 1 1   46   12    2 o     47.6    9.7    0.0000   0.0000          ?        ?    23.6253   8.9393          ?        ?       47.6        9.7       ?       ? 
1 1 1   46   12    3 o    418.7    2.4    0.0000   0.0000          ?        ?  1753.3804  20.4327          ?        ?      418.7        2.4       ?       ? 
1 1 1   46   12    4 o    151.3    4.4    0.0000   0.0000          ?        ?   229.2293  13.4090          ?        ?      151.3        4.4       ?       ? 
1 1 1   46   12    5 o    520.6    2.9    0.0000   0.0000          ?        ?  2711.1628  30.0105          ?        ?      520.6        2.9       ?       ? 
1 1 1   46   12    6 o    320.1    2.6    0.0000   0.0000          ?        ?  1024.8273  16.6016          ?        ?      320.1        2.6       ?       ? 
1 1 1   46   12    7 o    227.0    2.8    0.0000   0.0000          ?        ?   515.2869  12.7704          ?        ?      227.0        2.8       ?       ? 
1 1 1   46   12    8 o    374.7    2.6    0.0000   0.0000          ?        ?  1404.1090  19.1556          ?        ?      374.7        2.6       ?       ? 
1 1 1   46   12    9 o    124.8    4.6    0.0000   0.0000          ?        ?   155.7993  11.4934          ?        ?      124.8        4.6       ?       ? 
1 1 1   46   12   10 o    133.4    4.3    0.0000   0.0000          ?        ?   178.1475  11.4934          ?        ?      133.4        4.3       ?       ? 
1 1 1   46   12   11 o    130.5    4.4    0.0000   0.0000          ?        ?   170.4853  11.4934          ?        ?      130.5        4.4       ?       ? 
1 1 1   46   12   12 o    175.4    4.0    0.0000   0.0000          ?        ?   307.7674  14.0475          ?        ?      175.4        4.0       ?       ? 
1 1 1   46   12   13 o    106.5    5.7    0.0000   0.0000          ?        ?   113.6568  12.1319          ?        ?      106.5        5.7       ?       ? 
1 1 1   46   12   14 o    158.5    4.0    0.0000   0.0000          ?        ?   251.5775  12.7704          ?        ?      158.5        4.0       ?       ? 
1 1 1   46   12   15 o    153.0    4.0    0.0000   0.0000          ?        ?   234.3374  12.1319          ?        ?      153.0        4.0       ?       ? 
1 1 1   46   12   16 o    475.1    2.8    0.0000   0.0000          ?        ?  2257.8125  26.8179          ?        ?      475.1        2.8       ?       ? 
1 1 1   46   12   17 o    275.0    2.9    0.0000   0.0000          ?        ?   756.6481  15.9630          ?        ?      275.0        2.9       ?       ? 
1 1 1   46   12   18 o    234.1    3.0    0.0000   0.0000          ?        ?   548.4901  14.0475          ?        ?      234.1        3.0       ?       ? 
1 1 1   46   12   19 o    415.1    2.6    0.0000   0.0000          ?        ?  1724.0084  21.7097          ?        ?      415.1        2.6       ?       ? 
1 1 1   46   12   20 f    228.9    3.2    0.0000   0.0000          ?        ?   524.2263  14.6860          ?        ?      228.9        3.2       ?       ? 
1 1 1   46   12   21 o    402.5    2.6    0.0000   0.0000          ?        ?  1620.5679  21.0712          ?        ?      402.5        2.6       ?       ? 
1 1 1   46   12   22 o     71.3    9.9    0.0000   0.0000          ?        ?    51.0817  14.0475          ?        ?       71.3        9.9       ?       ? 
1 1 1   46   12   23 o    216.8    3.5    0.0000   0.0000          ?        ?   470.5904  15.3245          ?        ?      216.8        3.5       ?       ? 
1 1 1   46   12   24 o    198.4    3.7    0.0000   0.0000          ?        ?   393.9678  14.6860          ?        ?      198.4        3.7       ?       ? 
1 1 1   46   12   25 o    171.3    4.1    0.0000   0.0000          ?        ?   293.7199  14.0475          ?        ?      171.3        4.1       ?       ? 
1 1 1   46   12   26 o    305.8    2.7    0.0000   0.0000          ?        ?   935.4342  16.6016          ?        ?      305.8        2.7       ?       ? 
1 1 1   46   12   27 o     47.4   14.3    0.0000   0.0000          ?        ?    22.9868  14.6860          ?        ?       47.4       14.3       ?       ? 
1 1 1   46   12   28 o    154.4    4.8    0.0000   0.0000          ?        ?   238.8071  14.6860          ?        ?      154.4        4.8       ?       ? 
1 1 1   46   12   29 o    178.0    4.3    0.0000   0.0000          ?        ?   317.3452  15.3245          ?        ?      178.0        4.3       ?       ? 
1 1 1   46   12   30 o    254.6    3.1    0.0000   0.0000          ?        ?   648.7380  15.9630          ?        ?      254.6        3.1       ?       ? 
1 1 1   46   12   31 o     19.3    9.6    0.0000   0.0000          ?        ?   -41.5039  15.3245          ?        ?       19.3        9.6       ?       ? 
1 1 1   46   12   32 f    279.3    3.1    0.0000   0.0000          ?        ?   780.9120  17.2401          ?        ?      279.3        3.1       ?       ? 
1 1 1   46   12   33 o    307.5    2.9    0.0000   0.0000          ?        ?   946.2890  17.8786          ?        ?      307.5        2.9       ?       ? 
1 1 1   46   12   34 o    122.8    6.2    0.0000   0.0000          ?        ?   151.3296  15.3245          ?        ?      122.8        6.2       ?       ? 
1 1 1   46   12   35 o     61.9   12.8    0.0000   0.0000          ?        ?    40.2269  15.3245          ?        ?       61.9       12.8       ?       ? 
1 1 1   46   12   36 o    215.3    4.0    0.0000   0.0000          ?        ?   464.2052  17.2401          ?        ?      215.3        4.0       ?       ? 
1 1 1   46   12   37 o    337.3    2.8    0.0000   0.0000          ?        ?  1138.4841  19.1556          ?        ?      337.3        2.8       ?       ? 
1 1 1   46   12   38 o     25.9   12.2    0.0000   0.0000          ?        ?   -18.5171  16.6016          ?        ?       25.9       12.2       ?       ? 
1 1 1   46   12   39 o    102.0    7.8    0.0000   0.0000          ?        ?   104.7175  15.9630          ?        ?      102.0        7.8       ?       ? 
1 1 1   46   12   40 o    217.5    4.1    0.0000   0.0000          ?        ?   473.7830  17.8786          ?        ?      217.5        4.1       ?       ? 
1 1 1   46   12   41 o    157.1    5.7    0.0000   0.0000          ?        ?   247.7464  17.8786          ?        ?      157.1        5.7       ?       ? 
1 1 1   46   12   42 o    154.9    5.6    0.0000   0.0000          ?        ?   240.7227  17.2401          ?        ?      154.9        5.6       ?       ? 
1 1 1   46   12   43 o     72.2   11.5    0.0000   0.0000          ?        ?    52.9973  16.6016          ?        ?       72.2       11.5       ?       ? 
1 1 1   46   12   44 o    159.1    5.6    0.0000   0.0000          ?        ?   254.1316  17.8786          ?        ?      159.1        5.6       ?       ? 
1 1 1   46   12   45 o     45.9   15.7    0.0000   0.0000          ?        ?    20.4327  17.2401          ?        ?       45.9       15.7       ?       ? 
1 1 1   46   12   46 o    133.7    6.4    0.0000   0.0000          ?        ?   180.0631  17.2401          ?        ?      133.7        6.4       ?       ? 
1 1 1   46   12   47 o     30.2   13.6    0.0000   0.0000          ?        ?    -7.6623  17.2401          ?        ?       30.2       13.6       ?       ? 
1 1 1   46   12   48 o    132.9    6.7    0.0000   0.0000          ?        ?   178.1475  17.8786          ?        ?      132.9        6.7       ?       ? 
1 1 1   46   12   49 o    144.8    6.2    0.0000   0.0000          ?        ?   211.3506  17.8786          ?        ?      144.8        6.2       ?       ? 
1 1 1   46   12   50 o     33.7   14.3    0.0000   0.0000          ?        ?     1.9156  16.6016          ?        ?       33.7       14.3       ?       ? 
1 1 1   46   13    0 o    566.7    3.9 3213.0410  44.6965  3213.0410  44.6965  3213.0410  44.6965      566.7      3.9      566.7        3.9     0.0     0.0 
1 1 1   46   13    1 o    253.0    3.4    0.0000   0.0000          ?        ?   640.4372  17.2401          ?        ?      253.0        3.4       ?       ? 
1 1 1   46   13    2 o    466.4    3.0    0.0000   0.0000          ?        ?  2176.0815  28.0950          ?        ?      466.4        3.0       ?       ? 
1 1 1   46   13    3 o    292.9    2.7    0.0000   0.0000          ?        ?   858.1730  15.9630          ?        ?      292.9        2.7       ?       ? 
1 1 1   46   13    4 o    218.7    2.5    0.0000   0.0000          ?        ?   478.2527  10.8549          ?        ?      218.7        2.5       ?       ? 
1 1 1   46   13    5 o    347.1    2.4    0.0000   0.0000          ?        ?  1204.8903  16.6016          ?        ?      347.1        2.4       ?       ? 
1 1 1   46   13    6 o    516.3    3.0    0.0000   0.0000          ?        ?  2666.4663  30.6490          ?        ?      516.3        3.0       ?       ? 
1 1 1   46   13    7 o    394.6    2.6    0.0000   0.0000          ?        ?  1557.9928  20.4327          ?        ?      394.6        2.6       ?       ? 
1 1 1   46   13    8 o    233.3    2.7    0.0000   0.0000          ?        ?   544.6590  12.7704          ?        ?      233.3        2.7       ?       ? 
1 1 1   46   13    9 o    261.7    2.7    0.0000   0.0000          ?        ?   685.1337  14.0475          ?        ?      261.7        2.7       ?       ? 
1 1 1   46   13   10 o     96.8    5.3    0.0000   0.0000          ?        ?    93.8627  10.2163          ?        ?       96.8        5.3       ?       ? 
1 1 1   46   13   11 o     36.8   12.4    0.0000   0.0000          ?        ?    12.7704  10.8549          ?        ?       36.8       12.4       ?       ? 
1 1 1   46   13   12 o    145.3    4.2    0.0000   0.0000          ?        ?   211.3506  12.1319          ?        ?      145.3        4.2       ?       ? 
1 1 1   46   13   13 o    377.7    2.7    0.0000   0.0000          ?        ?  1427.0958  20.4327          ?        ?      377.7        2.7       ?       ? 
1 1 1   46   13   14 o    212.1    3.2    0.0000   0.0000          ?        ?   450.1577  13.4090          ?        ?      212.1        3.2       ?       ? 
1 1 1   46   13   15 o    315.3    2.5    0.0000   0.0000          ?        ?   994.8167  15.9630          ?        ?      315.3        2.5       ?       ? 
1 1 1   46   13   16 o    255.3    3.0    0.0000   0.0000          ?        ?   651.9305  15.3245          ?        ?      255.3        3.0       ?       ? 
1 1 1   46   13   17 f    546.8    3.0    0.0000   0.0000          ?        ?  2991.4739  33.2031          ?        ?      546.8        3.0       ?       ? 
1 1 1   46   13   18 o    194.4    3.4    0.0000   0.0000          ?        ?   378.0048  13.4090          ?        ?      194.4        3.4       ?       ? 
1 1 1   46   13   19 o    165.2    3.9    0.0000   0.0000          ?        ?   273.2873  12.7704          ?        ?      165.2        3.9       ?       ? 
1 1 1   46   13   20 o     89.5    7.8    0.0000   0.0000          ?        ?    80.4537  14.0475          ?        ?       89.5        7.8       ?       ? 
1 1 1   46   13   21 o     89.9    7.5    0.0000   0.0000          ?        ?    81.0922  13.4090          ?        ?       89.9        7.5       ?       ? 
1 1 1   46   13   22 o    421.5    2.7    0.0000   0.0000          ?        ?  1777.0056  22.3483          ?        ?      421.5        2.7       ?       ? 
1 1 1   46   13   23 o    225.2    3.7    0.0000   0.0000          ?        ?   507.6247  16.6016          ?        ?      225.2        3.7       ?       ? 
1 1 1   46   13   24 o    201.3    4.0    0.0000   0.0000          ?        ?   405.4612  15.9630          ?        ?      201.3        4.0       ?       ? 
1 1 1   46   13   25 o    132.9    5.3    0.0000   0.0000          ?        ?   176.8705  14.0475          ?        ?      132.9        5.3       ?       ? 
1 1 1   46   13   26 o    252.9    3.2    0.0000   0.0000          ?        ?   639.7986  15.9630          ?        ?      252.9        3.2       ?       ? 
1 1 1   46   13   27 o    241.1    3.2    0.0000   0.0000          ?        ?   581.6932  15.3245          ?        ?      241.1        3.2       ?       ? 
1 1 1   46   13   28 o    186.6    3.9    0.0000   0.0000          ?        ?   348.6328  14.6860          ?        ?      186.6        3.9       ?       ? 
1 1 1   46   13   29 f    300.5    2.8    0.0000   0.0000          ?        ?   903.5081  16.6016          ?        ?      300.5        2.8       ?       ? 
1 1 1   46   13   30 o    122.1    6.0    0.0000   0.0000          ?        ?   149.4141  14.6860          ?        ?      122.1        6.0       ?       ? 
1 1 1   46   13   31 o    232.3    3.3    0.0000   0.0000          ?        ?   540.1893  15.3245          ?        ?      232.3        3.3       ?       ? 
1 1 1   46   13   32 o    356.3    2.7    0.0000   0.0000          ?        ?  1270.0195  19.1556          ?        ?      356.3        2.7       ?       ? 
1 1 1   46   13   33 o     54.5   14.0    0.0000   0.0000          ?        ?    31.2876  15.3245          ?        ?       54.5       14.0       ?       ? 
1 1 1   46   13   34 o    365.7    2.8    0.0000   0.0000          ?        ?  1338.3413  20.4327          ?        ?      365.7        2.8       ?       ? 
1 1 1   46   13   35 f     55.5   14.3    0.0000   0.0000          ?        ?    32.5646  15.9630          ?        ?       55.5       14.3       ?       ? 
1 1 1   46   13   36 o    334.2    3.1    0.0000   0.0000          ?        ?  1118.0514  20.4327          ?        ?      334.2        3.1       ?       ? 
1 1 1   46   13   37 o    398.2    2.7    0.0000   0.0000          ?        ?  1586.7262  21.7097          ?        ?      398.2        2.7       ?       ? 
1 1 1   46   13   38 o    510.8    2.8    0.0000   0.0000          ?        ?  2610.9148  28.0950          ?        ?      510.8        2.8       ?       ? 
1 1 1   46   13   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46   13   40 o     79.4   10.5    0.0000   0.0000          ?        ?    63.8522  16.6016          ?        ?       79.4       10.5       ?       ? 
1 1 1   46   13   41 o    128.5    6.5    0.0000   0.0000          ?        ?   166.0156  16.6016          ?        ?      128.5        6.5       ?       ? 
1 1 1   46   13   42 o     89.1    9.7    0.0000   0.0000          ?        ?    80.4537  17.2401          ?        ?       89.1        9.7       ?       ? 
1 1 1   46   13   43 o     24.9   12.0    0.0000   0.0000          ?        ?   -24.2638  17.2401          ?        ?       24.9       12.0       ?       ? 
1 1 1   46   13   44 o     35.9   14.8    0.0000   0.0000          ?        ?     4.4697  17.2401          ?        ?       35.9       14.8       ?       ? 
1 1 1   46   13   45 o    158.8    5.6    0.0000   0.0000          ?        ?   253.4931  17.8786          ?        ?      158.8        5.6       ?       ? 
1 1 1   46   13   46 o     84.6   10.2    0.0000   0.0000          ?        ?    72.7915  17.2401          ?        ?       84.6       10.2       ?       ? 
1 1 1   46   13   47 o    206.2    4.3    0.0000   0.0000          ?        ?   426.5325  17.8786          ?        ?      206.2        4.3       ?       ? 
1 1 1   46   13   48 o     53.5   15.7    0.0000   0.0000          ?        ?    30.6490  17.8786          ?        ?       53.5       15.7       ?       ? 
1 1 1   46   14    0 o    167.9    7.4  284.1421  24.9023   284.1421  24.9023   284.1421  24.9023      167.9      7.4      167.9        7.4     0.0     0.0 
1 1 1   46   14    1 o    381.9    3.2    0.0000   0.0000          ?        ?  1459.6605  24.2638          ?        ?      381.9        3.2       ?       ? 
1 1 1   46   14    2 o    227.8    3.4    0.0000   0.0000          ?        ?   519.1181  15.3245          ?        ?      227.8        3.4       ?       ? 
1 1 1   46   14    3 f    343.4    2.8    0.0000   0.0000          ?        ?  1179.9880  19.1556          ?        ?      343.4        2.8       ?       ? 
1 1 1   46   14    4 o    349.2    2.9    0.0000   0.0000          ?        ?  1220.2148  20.4327          ?        ?      349.2        2.9       ?       ? 
1 1 1   46   14    5 o    441.7    3.3    0.0000   0.0000          ?        ?  1951.9607  28.7335          ?        ?      441.7        3.3       ?       ? 
1 1 1   46   14    6 o    287.8    2.9    0.0000   0.0000          ?        ?   828.8011  16.6016          ?        ?      287.8        2.9       ?       ? 
1 1 1   46   14    7 o    467.2    2.9    0.0000   0.0000          ?        ?  2183.7439  27.4564          ?        ?      467.2        2.9       ?       ? 
1 1 1   46   14    8 o    209.7    3.2    0.0000   0.0000          ?        ?   439.9414  13.4090          ?        ?      209.7        3.2       ?       ? 
1 1 1   46   14    9 o    438.4    3.1    0.0000   0.0000          ?        ?  1922.5886  26.8179          ?        ?      438.4        3.1       ?       ? 
1 1 1   46   14   10 f     92.1    5.2    0.0000   0.0000          ?        ?    84.9234   9.5778          ?        ?       92.1        5.2       ?       ? 
1 1 1   46   14   11 f    389.2    2.5    0.0000   0.0000          ?        ?  1515.2118  19.7942          ?        ?      389.2        2.5       ?       ? 
1 1 1   46   14   12 o    147.7    3.9    0.0000   0.0000          ?        ?   218.3744  11.4934          ?        ?      147.7        3.9       ?       ? 
1 1 1   46   14   13 o    395.1    2.7    0.0000   0.0000          ?        ?  1561.8240  21.0712          ?        ?      395.1        2.7       ?       ? 
1 1 1   46   14   14 o    309.9    2.8    0.0000   0.0000          ?        ?   960.9750  17.2401          ?        ?      309.9        2.8       ?       ? 
1 1 1   46   14   15 o    147.5    3.9    0.0000   0.0000          ?        ?   217.7359  11.4934          ?        ?      147.5        3.9       ?       ? 
1 1 1   46   14   16 o    219.4    3.1    0.0000   0.0000          ?        ?   481.4453  13.4090          ?        ?      219.4        3.1       ?       ? 
1 1 1   46   14   17 o    245.7    3.1    0.0000   0.0000          ?        ?   604.0414  15.3245          ?        ?      245.7        3.1       ?       ? 
1 1 1   46   14   18 o     19.2    9.5    0.0000   0.0000          ?        ?   -26.8179  12.7704          ?        ?       19.2        9.5       ?       ? 
1 1 1   46   14   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46   14   20 o    167.7    4.0    0.0000   0.0000          ?        ?   281.5880  13.4090          ?        ?      167.7        4.0       ?       ? 
1 1 1   46   14   21 o    166.6    4.4    0.0000   0.0000          ?        ?   277.7569  14.6860          ?        ?      166.6        4.4       ?       ? 
1 1 1   46   14   22 o    269.0    3.2    0.0000   0.0000          ?        ?   724.0836  17.2401          ?        ?      269.0        3.2       ?       ? 
1 1 1   46   14   23 o    411.6    2.8    0.0000   0.0000          ?        ?  1695.2749  22.9868          ?        ?      411.6        2.8       ?       ? 
1 1 1   46   14   24 o     48.9   13.8    0.0000   0.0000          ?        ?    24.9023  14.0475          ?        ?       48.9       13.8       ?       ? 
1 1 1   46   14   25 o    371.0    2.7    0.0000   0.0000          ?        ?  1377.2911  19.7942          ?        ?      371.0        2.7       ?       ? 
1 1 1   46   14   26 o    179.3    4.1    0.0000   0.0000          ?        ?   321.8149  14.6860          ?        ?      179.3        4.1       ?       ? 
1 1 1   46   14   27 o    191.5    3.8    0.0000   0.0000          ?        ?   367.1499  14.6860          ?        ?      191.5        3.8       ?       ? 
1 1 1   46   14   28 o     66.6   10.6    0.0000   0.0000          ?        ?    44.6965  14.0475          ?        ?       66.6       10.6       ?       ? 
1 1 1   46   14   29 o    234.8    3.4    0.0000   0.0000          ?        ?   551.6827  15.9630          ?        ?      234.8        3.4       ?       ? 
1 1 1   46   14   30 o    321.4    2.9    0.0000   0.0000          ?        ?  1033.7665  18.5171          ?        ?      321.4        2.9       ?       ? 
1 1 1   46   14   31 o     98.6    7.4    0.0000   0.0000          ?        ?    97.6938  14.6860          ?        ?       98.6        7.4       ?       ? 
1 1 1   46   14   32 o    141.4    5.4    0.0000   0.0000          ?        ?   200.4958  15.3245          ?        ?      141.4        5.4       ?       ? 
1 1 1   46   14   33 o    376.9    2.6    0.0000   0.0000          ?        ?  1421.3491  19.7942          ?        ?      376.9        2.6       ?       ? 
1 1 1   46   14   34 o    151.8    5.5    0.0000   0.0000          ?        ?   231.1448  16.6016          ?        ?      151.8        5.5       ?       ? 
1 1 1   46   14   35 f    118.7    7.3    0.0000   0.0000          ?        ?   141.7518  17.2401          ?        ?      118.7        7.3       ?       ? 
1 1 1   46   14   36 o    295.6    3.0    0.0000   0.0000          ?        ?   874.7747  17.8786          ?        ?      295.6        3.0       ?       ? 
1 1 1   46   14   37 o    216.7    4.0    0.0000   0.0000          ?        ?   470.5904  17.2401          ?        ?      216.7        4.0       ?       ? 
1 1 1   46   14   38 o     18.5    9.3    0.0000   0.0000          ?        ?   -50.4432  15.9630          ?        ?       18.5        9.3       ?       ? 
1 1 1   46   14   39 o    294.4    3.1    0.0000   0.0000          ?        ?   867.7509  18.5171          ?        ?      294.4        3.1       ?       ? 
1 1 1   46   14   40 o    171.1    4.9    0.0000   0.0000          ?        ?   293.7199  16.6016          ?        ?      171.1        4.9       ?       ? 
1 1 1   46   14   41 o     71.7   11.6    0.0000   0.0000          ?        ?    52.3588  16.6016          ?        ?       71.7       11.6       ?       ? 
1 1 1   46   14   42 o    148.9    5.8    0.0000   0.0000          ?        ?   222.8441  17.2401          ?        ?      148.9        5.8       ?       ? 
1 1 1   46   14   43 o    209.3    4.3    0.0000   0.0000          ?        ?   439.3029  17.8786          ?        ?      209.3        4.3       ?       ? 
1 1 1   46   14   44 o    200.9    4.6    0.0000   0.0000          ?        ?   404.8227  18.5171          ?        ?      200.9        4.6       ?       ? 
1 1 1   46   14   45 o    203.8    4.4    0.0000   0.0000          ?        ?   416.9547  17.8786          ?        ?      203.8        4.4       ?       ? 
1 1 1   46   14   46 o    135.3    6.6    0.0000   0.0000          ?        ?   184.5327  17.8786          ?        ?      135.3        6.6       ?       ? 
1 1 1   46   14   47 o    278.8    3.4    0.0000   0.0000          ?        ?   778.9964  19.1556          ?        ?      278.8        3.4       ?       ? 
1 1 1   46   15    0 o    232.3    5.4  540.8278  24.9023   540.8278  24.9023   540.8278  24.9023      232.3      5.4      232.3        5.4     0.0     0.0 
1 1 1   46   15    1 o    300.8    3.3    0.0000   0.0000          ?        ?   905.4237  19.7942          ?        ?      300.8        3.3       ?       ? 
1 1 1   46   15    2 o    127.0    6.0    0.0000   0.0000          ?        ?   161.5460  15.3245          ?        ?      127.0        6.0       ?       ? 
1 1 1   46   15    3 o    301.9    3.3    0.0000   0.0000          ?        ?   911.8089  19.7942          ?        ?      301.9        3.3       ?       ? 
1 1 1   46   15    4 o    235.7    3.5    0.0000   0.0000          ?        ?   556.1523  16.6016          ?        ?      235.7        3.5       ?       ? 
1 1 1   46   15    5 o    346.7    3.0    0.0000   0.0000          ?        ?  1202.9747  21.0712          ?        ?      346.7        3.0       ?       ? 
1 1 1   46   15    6 o    232.9    3.4    0.0000   0.0000          ?        ?   542.7434  15.9630          ?        ?      232.9        3.4       ?       ? 
1 1 1   46   15    7 o    335.2    3.0    0.0000   0.0000          ?        ?  1124.4366  20.4327          ?        ?      335.2        3.0       ?       ? 
1 1 1   46   15    8 o    648.7    3.2    0.0000   0.0000          ?        ?  4211.0503  41.5039          ?        ?      648.7        3.2       ?       ? 
1 1 1   46   15    9 o    201.9    3.3    0.0000   0.0000          ?        ?   408.0153  13.4090          ?        ?      201.9        3.3       ?       ? 
1 1 1   46   15   10 o    358.4    2.7    0.0000   0.0000          ?        ?  1284.7054  19.1556          ?        ?      358.4        2.7       ?       ? 
1 1 1   46   15   11 o    197.5    3.2    0.0000   0.0000          ?        ?   390.1367  12.7704          ?        ?      197.5        3.2       ?       ? 
1 1 1   46   15   12 o    142.0    3.6    0.0000   0.0000          ?        ?   201.7728  10.2163          ?        ?      142.0        3.6       ?       ? 
1 1 1   46   15   13 o    331.2    2.6    0.0000   0.0000          ?        ?  1097.6187  17.2401          ?        ?      331.2        2.6       ?       ? 
1 1 1   46   15   14 o     43.0   12.1    0.0000   0.0000          ?        ?    19.1556  10.8549          ?        ?       43.0       12.1       ?       ? 
1 1 1   46   15   15 o    154.1    3.7    0.0000   0.0000          ?        ?   237.5300  11.4934          ?        ?      154.1        3.7       ?       ? 
1 1 1   46   15   16 o    258.7    2.8    0.0000   0.0000          ?        ?   669.8092  14.6860          ?        ?      258.7        2.8       ?       ? 
1 1 1   46   15   17 o    240.6    3.3    0.0000   0.0000          ?        ?   579.1391  15.9630          ?        ?      240.6        3.3       ?       ? 
1 1 1   46   15   18 o     69.5    8.7    0.0000   0.0000          ?        ?    48.5276  12.1319          ?        ?       69.5        8.7       ?       ? 
1 1 1   46   15   19 o     32.1   13.3    0.0000   0.0000          ?        ?     2.5541  14.0475          ?        ?       32.1       13.3       ?       ? 
1 1 1   46   15   20 o    277.6    3.1    0.0000   0.0000          ?        ?   771.3342  17.2401          ?        ?      277.6        3.1       ?       ? 
1 1 1   46   15   21 o    341.7    2.6    0.0000   0.0000          ?        ?  1167.8560  17.8786          ?        ?      341.7        2.6       ?       ? 
1 1 1   46   15   22 o    479.8    2.7    0.0000   0.0000          ?        ?  2303.1477  26.1794          ?        ?      479.8        2.7       ?       ? 
1 1 1   46   15   23 o    578.3    2.9    0.0000   0.0000          ?        ?  3345.8533  33.2031          ?        ?      578.3        2.9       ?       ? 
1 1 1   46   15   24 o    475.1    2.6    0.0000   0.0000          ?        ?  2258.4512  24.9023          ?        ?      475.1        2.6       ?       ? 
1 1 1   46   15   25 o    122.1    6.0    0.0000   0.0000          ?        ?   149.4141  14.6860          ?        ?      122.1        6.0       ?       ? 
1 1 1   46   15   26 o    308.7    2.8    0.0000   0.0000          ?        ?   953.3128  17.2401          ?        ?      308.7        2.8       ?       ? 
1 1 1   46   15   27 o    213.0    3.6    0.0000   0.0000          ?        ?   453.9889  15.3245          ?        ?      213.0        3.6       ?       ? 
1 1 1   46   15   28 o    253.6    3.3    0.0000   0.0000          ?        ?   643.6298  16.6016          ?        ?      253.6        3.3       ?       ? 
1 1 1   46   15   29 o    179.1    4.1    0.0000   0.0000          ?        ?   321.1764  14.6860          ?        ?      179.1        4.1       ?       ? 
1 1 1   46   15   30 o    143.4    5.3    0.0000   0.0000          ?        ?   206.2425  15.3245          ?        ?      143.4        5.3       ?       ? 
1 1 1   46   15   31 o    180.8    4.2    0.0000   0.0000          ?        ?   327.5616  15.3245          ?        ?      180.8        4.2       ?       ? 
1 1 1   46   15   32 o    206.7    3.9    0.0000   0.0000          ?        ?   427.8095  15.9630          ?        ?      206.7        3.9       ?       ? 
1 1 1   46   15   33 o    127.6    6.0    0.0000   0.0000          ?        ?   163.4615  15.3245          ?        ?      127.6        6.0       ?       ? 
1 1 1   46   15   34 o    276.0    3.1    0.0000   0.0000          ?        ?   762.3948  17.2401          ?        ?      276.0        3.1       ?       ? 
1 1 1   46   15   35 f     79.5    9.6    0.0000   0.0000          ?        ?    63.8522  15.3245          ?        ?       79.5        9.6       ?       ? 
1 1 1   46   15   36 o    233.5    3.6    0.0000   0.0000          ?        ?   545.9360  16.6016          ?        ?      233.5        3.6       ?       ? 
1 1 1   46   15   37 o    124.7    6.7    0.0000   0.0000          ?        ?   156.4378  16.6016          ?        ?      124.7        6.7       ?       ? 
1 1 1   46   15   38 o     39.1   14.8    0.0000   0.0000          ?        ?    11.4934  15.9630          ?        ?       39.1       14.8       ?       ? 
1 1 1   46   15   39 o    120.8    6.9    0.0000   0.0000          ?        ?   146.8600  16.6016          ?        ?      120.8        6.9       ?       ? 
1 1 1   46   15   40 o    118.9    7.0    0.0000   0.0000          ?        ?   142.3903  16.6016          ?        ?      118.9        7.0       ?       ? 
1 1 1   46   15   41 o     41.6   15.2    0.0000   0.0000          ?        ?    14.6860  16.6016          ?        ?       41.6       15.2       ?       ? 
1 1 1   46   15   42 o    170.1    5.3    0.0000   0.0000          ?        ?   290.5273  17.8786          ?        ?      170.1        5.3       ?       ? 
1 1 1   46   15   43 o    230.9    3.7    0.0000   0.0000          ?        ?   534.4426  17.2401          ?        ?      230.9        3.7       ?       ? 
1 1 1   46   15   44 o     58.6   14.7    0.0000   0.0000          ?        ?    37.0343  17.2401          ?        ?       58.6       14.7       ?       ? 
1 1 1   46   15   45 o     99.5    8.3    0.0000   0.0000          ?        ?   100.2479  16.6016          ?        ?       99.5        8.3       ?       ? 
1 1 1   46   15   46 o     32.2   14.1    0.0000   0.0000          ?        ?    -2.5541  17.2401          ?        ?       32.2       14.1       ?       ? 
1 1 1   46   16    0 o    461.8    5.0 2135.2163  45.9736  2135.2163  45.9736  2135.2163  45.9736      461.8      5.0      461.8        5.0     0.0     0.0 
1 1 1   46   16    1 o    228.3    3.8    0.0000   0.0000          ?        ?   521.6721  17.2401          ?        ?      228.3        3.8       ?       ? 
1 1 1   46   16    2 o    214.9    3.9    0.0000   0.0000          ?        ?   462.2897  16.6016          ?        ?      214.9        3.9       ?       ? 
1 1 1   46   16    3 o    203.9    3.9    0.0000   0.0000          ?        ?   416.3161  15.9630          ?        ?      203.9        3.9       ?       ? 
1 1 1   46   16    4 o    191.5    4.5    0.0000   0.0000          ?        ?   367.1499  17.2401          ?        ?      191.5        4.5       ?       ? 
1 1 1   46   16    5 o    357.0    3.5    0.0000   0.0000          ?        ?  1275.7662  24.9023          ?        ?      357.0        3.5       ?       ? 
1 1 1   46   16    6 o    238.3    3.6    0.0000   0.0000          ?        ?   568.2842  17.2401          ?        ?      238.3        3.6       ?       ? 
1 1 1   46   16    7 o    339.8    2.8    0.0000   0.0000          ?        ?  1155.0856  19.1556          ?        ?      339.8        2.8       ?       ? 
1 1 1   46   16    8 o     88.5    7.2    0.0000   0.0000          ?        ?    78.5382  12.7704          ?        ?       88.5        7.2       ?       ? 
1 1 1   46   16    9 o    384.2    3.0    0.0000   0.0000          ?        ?  1476.9005  22.9868          ?        ?      384.2        3.0       ?       ? 
1 1 1   46   16   10 o    262.7    3.0    0.0000   0.0000          ?        ?   690.2419  15.9630          ?        ?      262.7        3.0       ?       ? 
1 1 1   46   16   11 o    370.1    2.9    0.0000   0.0000          ?        ?  1370.2675  21.7097          ?        ?      370.1        2.9       ?       ? 
1 1 1   46   16   12 o     93.5    5.1    0.0000   0.0000          ?        ?    87.4775   9.5778          ?        ?       93.5        5.1       ?       ? 
1 1 1   46   16   13 o    379.7    2.9    0.0000   0.0000          ?        ?  1442.4203  21.7097          ?        ?      379.7        2.9       ?       ? 
1 1 1   46   16   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46   16   15 o    192.7    3.6    0.0000   0.0000          ?        ?   371.6196  14.0475          ?        ?      192.7        3.6       ?       ? 
1 1 1   46   16   16 o    253.6    3.0    0.0000   0.0000          ?        ?   643.6298  15.3245          ?        ?      253.6        3.0       ?       ? 
1 1 1   46   16   17 o     96.8    6.3    0.0000   0.0000          ?        ?    93.8627  12.1319          ?        ?       96.8        6.3       ?       ? 
1 1 1   46   16   18 o    259.3    3.0    0.0000   0.0000          ?        ?   673.0018  15.3245          ?        ?      259.3        3.0       ?       ? 
1 1 1   46   16   19 o     24.2   11.4    0.0000   0.0000          ?        ?   -14.6860  14.0475          ?        ?       24.2       11.4       ?       ? 
1 1 1   46   16   20 o    191.9    3.7    0.0000   0.0000          ?        ?   368.4270  14.0475          ?        ?      191.9        3.7       ?       ? 
1 1 1   46   16   21 o    325.0    2.6    0.0000   0.0000          ?        ?  1056.7533  16.6016          ?        ?      325.0        2.6       ?       ? 
1 1 1   46   16   22 o    266.3    2.9    0.0000   0.0000          ?        ?   709.3975  15.3245          ?        ?      266.3        2.9       ?       ? 
1 1 1   46   16   23 o    287.0    2.9    0.0000   0.0000          ?        ?   824.3315  16.6016          ?        ?      287.0        2.9       ?       ? 
1 1 1   46   16   24 o    407.7    2.5    0.0000   0.0000          ?        ?  1663.3489  20.4327          ?        ?      407.7        2.5       ?       ? 
1 1 1   46   16   25 o     82.0    8.6    0.0000   0.0000          ?        ?    67.6833  14.0475          ?        ?       82.0        8.6       ?       ? 
1 1 1   46   16   26 o    179.1    4.3    0.0000   0.0000          ?        ?   321.1764  15.3245          ?        ?      179.1        4.3       ?       ? 
1 1 1   46   16   27 o     59.4   12.2    0.0000   0.0000          ?        ?    37.0343  14.0475          ?        ?       59.4       12.2       ?       ? 
1 1 1   46   16   28 o    457.3    2.5    0.0000   0.0000          ?        ?  2092.4355  22.9868          ?        ?      457.3        2.5       ?       ? 
1 1 1   46   16   29 o    324.0    2.9    0.0000   0.0000          ?        ?  1050.3680  18.5171          ?        ?      324.0        2.9       ?       ? 
1 1 1   46   16   30 o    122.0    6.0    0.0000   0.0000          ?        ?   149.4141  14.6860          ?        ?      122.0        6.0       ?       ? 
1 1 1   46   16   31 o    336.9    2.7    0.0000   0.0000          ?        ?  1135.9299  18.5171          ?        ?      336.9        2.7       ?       ? 
1 1 1   46   16   32 o    119.1    6.4    0.0000   0.0000          ?        ?   142.3903  15.3245          ?        ?      119.1        6.4       ?       ? 
1 1 1   46   16   33 o     94.9    8.1    0.0000   0.0000          ?        ?    90.6701  15.3245          ?        ?       94.9        8.1       ?       ? 
1 1 1   46   16   34 o    261.3    3.4    0.0000   0.0000          ?        ?   683.8566  17.8786          ?        ?      261.3        3.4       ?       ? 
1 1 1   46   16   35 o    123.0    6.5    0.0000   0.0000          ?        ?   151.9681  15.9630          ?        ?      123.0        6.5       ?       ? 
1 1 1   46   16   36 f    249.1    3.6    0.0000   0.0000          ?        ?   621.2816  17.8786          ?        ?      249.1        3.6       ?       ? 
1 1 1   46   16   37 o    182.7    4.7    0.0000   0.0000          ?        ?   334.5853  17.2401          ?        ?      182.7        4.7       ?       ? 
1 1 1   46   16   38 o    142.6    5.8    0.0000   0.0000          ?        ?   204.3269  16.6016          ?        ?      142.6        5.8       ?       ? 
1 1 1   46   16   39 o    141.0    5.9    0.0000   0.0000          ?        ?   199.8573  16.6016          ?        ?      141.0        5.9       ?       ? 
1 1 1   46   16   40 f     41.1   15.2    0.0000   0.0000          ?        ?    14.0475  16.6016          ?        ?       41.1       15.2       ?       ? 
1 1 1   46   16   41 o     50.5   15.2    0.0000   0.0000          ?        ?    26.8179  16.6016          ?        ?       50.5       15.2       ?       ? 
1 1 1   46   16   42 o    265.8    3.4    0.0000   0.0000          ?        ?   708.1205  17.8786          ?        ?      265.8        3.4       ?       ? 
1 1 1   46   16   43 o     72.0   11.1    0.0000   0.0000          ?        ?    52.9973  15.9630          ?        ?       72.0       11.1       ?       ? 
1 1 1   46   16   44 o    154.1    5.4    0.0000   0.0000          ?        ?   238.8071  16.6016          ?        ?      154.1        5.4       ?       ? 
1 1 1   46   16   45 o     22.6   11.0    0.0000   0.0000          ?        ?   -27.4564  15.9630          ?        ?       22.6       11.0       ?       ? 
1 1 1   46   17    0 o     15.1   11.2  -51.7203  21.0712   -51.7203  21.0712   -51.7203  21.0712       15.1     11.2       15.1       11.2     0.0     0.0 
1 1 1   46   17    1 o    126.7    6.3    0.0000   0.0000          ?        ?   160.9075  15.9630          ?        ?      126.7        6.3       ?       ? 
1 1 1   46   17    2 o     41.1   15.2    0.0000   0.0000          ?        ?    13.4090  16.6016          ?        ?       41.1       15.2       ?       ? 
1 1 1   46   17    3 o    132.1    5.8    0.0000   0.0000          ?        ?   174.9549  15.3245          ?        ?      132.1        5.8       ?       ? 
1 1 1   46   17    4 o    292.1    3.6    0.0000   0.0000          ?        ?   853.7034  21.0712          ?        ?      292.1        3.6       ?       ? 
1 1 1   46   17    5 o    273.1    3.9    0.0000   0.0000          ?        ?   746.4318  21.0712          ?        ?      273.1        3.9       ?       ? 
1 1 1   46   17    6 o    273.4    3.6    0.0000   0.0000          ?        ?   748.3474  19.7942          ?        ?      273.4        3.6       ?       ? 
1 1 1   46   17    7 f    170.7    5.2    0.0000   0.0000          ?        ?   291.8044  17.8786          ?        ?      170.7        5.2       ?       ? 
1 1 1   46   17    8 o    513.8    3.4    0.0000   0.0000          ?        ?  2641.5640  35.1187          ?        ?      513.8        3.4       ?       ? 
1 1 1   46   17    9 o    342.8    3.0    0.0000   0.0000          ?        ?  1175.5183  20.4327          ?        ?      342.8        3.0       ?       ? 
1 1 1   46   17   10 o    415.5    3.0    0.0000   0.0000          ?        ?  1727.2010  24.9023          ?        ?      415.5        3.0       ?       ? 
1 1 1   46   17   11 o    216.1    3.5    0.0000   0.0000          ?        ?   467.3978  15.3245          ?        ?      216.1        3.5       ?       ? 
1 1 1   46   17   12 o     38.0   13.7    0.0000   0.0000          ?        ?    12.1319  13.4090          ?        ?       38.0       13.7       ?       ? 
1 1 1   46   17   13 o    136.6    5.4    0.0000   0.0000          ?        ?   187.0868  14.6860          ?        ?      136.6        5.4       ?       ? 
1 1 1   46   17   14 o    222.4    2.7    0.0000   0.0000          ?        ?   494.8542  12.1319          ?        ?      222.4        2.7       ?       ? 
1 1 1   46   17   15 o    405.5    2.7    0.0000   0.0000          ?        ?  1644.8318  21.7097          ?        ?      405.5        2.7       ?       ? 
1 1 1   46   17   16 f    210.9    3.5    0.0000   0.0000          ?        ?   445.0496  14.6860          ?        ?      210.9        3.5       ?       ? 
1 1 1   46   17   17 o    168.1    4.4    0.0000   0.0000          ?        ?   282.8651  14.6860          ?        ?      168.1        4.4       ?       ? 
1 1 1   46   17   18 o    305.4    2.9    0.0000   0.0000          ?        ?   933.5186  17.8786          ?        ?      305.4        2.9       ?       ? 
1 1 1   46   17   19 o    127.0    5.0    0.0000   0.0000          ?        ?   161.5460  12.7704          ?        ?      127.0        5.0       ?       ? 
1 1 1   46   17   20 o    244.1    3.1    0.0000   0.0000          ?        ?   596.3792  15.3245          ?        ?      244.1        3.1       ?       ? 
1 1 1   46   17   21 o    532.6    2.7    0.0000   0.0000          ?        ?  2838.2285  28.7335          ?        ?      532.6        2.7       ?       ? 
1 1 1   46   17   22 o    155.2    4.3    0.0000   0.0000          ?        ?   241.3612  13.4090          ?        ?      155.2        4.3       ?       ? 
1 1 1   46   17   23 o    218.7    3.4    0.0000   0.0000          ?        ?   478.8912  14.6860          ?        ?      218.7        3.4       ?       ? 
1 1 1   46   17   24 o    176.7    4.3    0.0000   0.0000          ?        ?   312.8756  15.3245          ?        ?      176.7        4.3       ?       ? 
1 1 1   46   17   25 o    164.8    4.3    0.0000   0.0000          ?        ?   272.0102  14.0475          ?        ?      164.8        4.3       ?       ? 
1 1 1   46   17   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46   17   27 o    294.9    3.0    0.0000   0.0000          ?        ?   870.3050  17.8786          ?        ?      294.9        3.0       ?       ? 
1 1 1   46   17   28 o    128.2    5.7    0.0000   0.0000          ?        ?   164.7386  14.6860          ?        ?      128.2        5.7       ?       ? 
1 1 1   46   17   29 o    165.5    4.8    0.0000   0.0000          ?        ?   274.5643  15.9630          ?        ?      165.5        4.8       ?       ? 
1 1 1   46   17   30 o    303.3    2.9    0.0000   0.0000          ?        ?   920.7482  17.8786          ?        ?      303.3        2.9       ?       ? 
1 1 1   46   17   31 o    127.6    6.0    0.0000   0.0000          ?        ?   163.4615  15.3245          ?        ?      127.6        6.0       ?       ? 
1 1 1   46   17   32 f     36.6   14.4    0.0000   0.0000          ?        ?     8.3008  15.3245          ?        ?       36.6       14.4       ?       ? 
1 1 1   46   17   33 o    302.9    3.0    0.0000   0.0000          ?        ?   918.1941  17.8786          ?        ?      302.9        3.0       ?       ? 
1 1 1   46   17   34 o    256.9    3.2    0.0000   0.0000          ?        ?   660.8699  16.6016          ?        ?      256.9        3.2       ?       ? 
1 1 1   46   17   35 o     98.4    8.1    0.0000   0.0000          ?        ?    97.6938  15.9630          ?        ?       98.4        8.1       ?       ? 
1 1 1   46   17   36 o    248.3    3.5    0.0000   0.0000          ?        ?   617.4504  17.2401          ?        ?      248.3        3.5       ?       ? 
1 1 1   46   17   37 o    267.9    3.3    0.0000   0.0000          ?        ?   718.9753  17.8786          ?        ?      267.9        3.3       ?       ? 
1 1 1   46   17   38 o    230.7    3.7    0.0000   0.0000          ?        ?   533.1656  17.2401          ?        ?      230.7        3.7       ?       ? 
1 1 1   46   17   39 o     87.6    9.5    0.0000   0.0000          ?        ?    77.8996  16.6016          ?        ?       87.6        9.5       ?       ? 
1 1 1   46   17   40 o     78.4   10.2    0.0000   0.0000          ?        ?    62.5751  15.9630          ?        ?       78.4       10.2       ?       ? 
1 1 1   46   17   41 o    243.3    3.5    0.0000   0.0000          ?        ?   593.1866  17.2401          ?        ?      243.3        3.5       ?       ? 
1 1 1   46   17   42 o     95.5    8.7    0.0000   0.0000          ?        ?    92.5856  16.6016          ?        ?       95.5        8.7       ?       ? 
1 1 1   46   17   43 o    231.7    3.6    0.0000   0.0000          ?        ?   538.2737  16.6016          ?        ?      231.7        3.6       ?       ? 
1 1 1   46   18    0 o    127.5    9.9  166.0156  24.9023   166.0156  24.9023   166.0156  24.9023      127.5      9.9      127.5        9.9     0.0     0.0 
1 1 1   46   18    1 o    382.3    3.4    0.0000   0.0000          ?        ?  1462.8530  26.1794          ?        ?      382.3        3.4       ?       ? 
1 1 1   46   18    2 f    127.9    7.0    0.0000   0.0000          ?        ?   164.1001  17.8786          ?        ?      127.9        7.0       ?       ? 
1 1 1   46   18    3 o    367.2    3.6    0.0000   0.0000          ?        ?  1349.8347  26.1794          ?        ?      367.2        3.6       ?       ? 
1 1 1   46   18    4 o    184.4    4.3    0.0000   0.0000          ?        ?   340.3320  15.9630          ?        ?      184.4        4.3       ?       ? 
1 1 1   46   18    5 f    186.9    4.8    0.0000   0.0000          ?        ?   349.9099  17.8786          ?        ?      186.9        4.8       ?       ? 
1 1 1   46   18    6 o     81.6    9.8    0.0000   0.0000          ?        ?    67.0448  15.9630          ?        ?       81.6        9.8       ?       ? 
1 1 1   46   18    7 o     17.8    9.0    0.0000   0.0000          ?        ?   -46.6121  14.6860          ?        ?       17.8        9.0       ?       ? 
1 1 1   46   18    8 o    253.8    3.8    0.0000   0.0000          ?        ?   644.9069  19.1556          ?        ?      253.8        3.8       ?       ? 
1 1 1   46   18    9 o    121.3    6.8    0.0000   0.0000          ?        ?   147.4985  16.6016          ?        ?      121.3        6.8       ?       ? 
1 1 1   46   18   10 o     99.7    6.4    0.0000   0.0000          ?        ?    99.6094  12.7704          ?        ?       99.7        6.4       ?       ? 
1 1 1   46   18   11 o    296.2    3.2    0.0000   0.0000          ?        ?   877.9672  19.1556          ?        ?      296.2        3.2       ?       ? 
1 1 1   46   18   12 o    193.2    3.8    0.0000   0.0000          ?        ?   373.5352  14.6860          ?        ?      193.2        3.8       ?       ? 
1 1 1   46   18   13 o    251.8    3.5    0.0000   0.0000          ?        ?   634.6905  17.8786          ?        ?      251.8        3.5       ?       ? 
1 1 1   46   18   14 o    342.0    3.5    0.0000   0.0000          ?        ?  1170.4102  24.2638          ?        ?      342.0        3.5       ?       ? 
1 1 1   46   18   15 o    250.9    4.1    0.0000   0.0000          ?        ?   630.2208  20.4327          ?        ?      250.9        4.1       ?       ? 
1 1 1   46   18   16 o    223.1    3.0    0.0000   0.0000          ?        ?   498.0469  13.4090          ?        ?      223.1        3.0       ?       ? 
1 1 1   46   18   17 o     41.3   12.7    0.0000   0.0000          ?        ?    17.2401  11.4934          ?        ?       41.3       12.7       ?       ? 
1 1 1   46   18   18 f    306.8    3.0    0.0000   0.0000          ?        ?   941.8194  18.5171          ?        ?      306.8        3.0       ?       ? 
1 1 1   46   18   19 o    274.7    3.0    0.0000   0.0000          ?        ?   755.3711  16.6016          ?        ?      274.7        3.0       ?       ? 
1 1 1   46   18   20 o    382.3    2.9    0.0000   0.0000          ?        ?  1462.2145  22.3483          ?        ?      382.3        2.9       ?       ? 
1 1 1   46   18   21 o    324.8    3.1    0.0000   0.0000          ?        ?  1056.1147  20.4327          ?        ?      324.8        3.1       ?       ? 
1 1 1   46   18   22 o    238.0    3.4    0.0000   0.0000          ?        ?   567.0072  15.9630          ?        ?      238.0        3.4       ?       ? 
1 1 1   46   18   23 o    182.3    3.9    0.0000   0.0000          ?        ?   332.6698  14.0475          ?        ?      182.3        3.9       ?       ? 
1 1 1   46   18   24 o    398.9    2.6    0.0000   0.0000          ?        ?  1591.8345  21.0712          ?        ?      398.9        2.6       ?       ? 
1 1 1   46   18   25 o    111.4    6.3    0.0000   0.0000          ?        ?   124.5117  14.0475          ?        ?      111.4        6.3       ?       ? 
1 1 1   46   18   26 f     16.7    8.4    0.0000   0.0000          ?        ?   -44.0580  13.4090          ?        ?       16.7        8.4       ?       ? 
1 1 1   46   18   27 o    309.5    2.8    0.0000   0.0000          ?        ?   958.4210  17.2401          ?        ?      309.5        2.8       ?       ? 
1 1 1   46   18   28 o    319.6    2.9    0.0000   0.0000          ?        ?  1022.2732  18.5171          ?        ?      319.6        2.9       ?       ? 
1 1 1   46   18   29 o    232.6    3.3    0.0000   0.0000          ?        ?   541.4664  15.3245          ?        ?      232.6        3.3       ?       ? 
1 1 1   46   18   30 o    120.1    6.1    0.0000   0.0000          ?        ?   144.9444  14.6860          ?        ?      120.1        6.1       ?       ? 
1 1 1   46   18   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46   18   32 o    218.4    3.7    0.0000   0.0000          ?        ?   477.6142  15.9630          ?        ?      218.4        3.7       ?       ? 
1 1 1   46   18   33 o     40.4   14.7    0.0000   0.0000          ?        ?    14.0475  15.3245          ?        ?       40.4       14.7       ?       ? 
1 1 1   46   18   34 o    105.6    7.6    0.0000   0.0000          ?        ?   112.3798  15.9630          ?        ?      105.6        7.6       ?       ? 
1 1 1   46   18   35 o     18.7    9.4    0.0000   0.0000          ?        ?   -44.6965  15.3245          ?        ?       18.7        9.4       ?       ? 
1 1 1   46   18   36 o    191.8    4.3    0.0000   0.0000          ?        ?   369.0655  16.6016          ?        ?      191.8        4.3       ?       ? 
1 1 1   46   18   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46   18   38 o     18.6    9.4    0.0000   0.0000          ?        ?   -54.2743  16.6016          ?        ?       18.6        9.4       ?       ? 
1 1 1   46   18   39 o     67.8   12.2    0.0000   0.0000          ?        ?    48.5276  15.9630          ?        ?       67.8       12.2       ?       ? 
1 1 1   46   18   40 o    137.9    6.0    0.0000   0.0000          ?        ?   191.5565  16.6016          ?        ?      137.9        6.0       ?       ? 
1 1 1   46   18   41 o    204.0    3.9    0.0000   0.0000          ?        ?   417.5931  15.9630          ?        ?      204.0        3.9       ?       ? 
1 1 1   46   18   42 o    245.1    3.5    0.0000   0.0000          ?        ?   602.1259  17.2401          ?        ?      245.1        3.5       ?       ? 
1 1 1   46   19    0 o    257.0    6.6  662.7855  33.8416   662.7855  33.8416   662.7855  33.8416      257.0      6.6      257.0        6.6     0.0     0.0 
1 1 1   46   19    1 o    226.0    4.4    0.0000   0.0000          ?        ?   511.4558  19.7942          ?        ?      226.0        4.4       ?       ? 
1 1 1   46   19    2 o    307.3    3.8    0.0000   0.0000          ?        ?   945.0120  23.6253          ?        ?      307.3        3.8       ?       ? 
1 1 1   46   19    3 f    122.8    7.0    0.0000   0.0000          ?        ?   151.3296  17.2401          ?        ?      122.8        7.0       ?       ? 
1 1 1   46   19    4 o    236.3    4.3    0.0000   0.0000          ?        ?   559.3449  20.4327          ?        ?      236.3        4.3       ?       ? 
1 1 1   46   19    5 o    150.2    6.0    0.0000   0.0000          ?        ?   226.0367  17.8786          ?        ?      150.2        6.0       ?       ? 
1 1 1   46   19    6 o    128.6    6.7    0.0000   0.0000          ?        ?   166.0156  17.2401          ?        ?      128.6        6.7       ?       ? 
1 1 1   46   19    7 o     38.6   15.0    0.0000   0.0000          ?        ?     9.5778  16.6016          ?        ?       38.6       15.0       ?       ? 
1 1 1   46   19    8 o    153.1    5.6    0.0000   0.0000          ?        ?   234.9760  17.2401          ?        ?      153.1        5.6       ?       ? 
1 1 1   46   19    9 o     91.5    9.1    0.0000   0.0000          ?        ?    84.2849  16.6016          ?        ?       91.5        9.1       ?       ? 
1 1 1   46   19   10 o    396.7    3.8    0.0000   0.0000          ?        ?  1575.2328  30.0105          ?        ?      396.7        3.8       ?       ? 
1 1 1   46   19   11 o    177.5    3.6    0.0000   0.0000          ?        ?   315.4297  12.7704          ?        ?      177.5        3.6       ?       ? 
1 1 1   46   19   12 o    482.7    3.1    0.0000   0.0000          ?        ?  2331.2424  30.0105          ?        ?      482.7        3.1       ?       ? 
1 1 1   46   19   13 o    148.1    4.7    0.0000   0.0000          ?        ?   219.6514  14.0475          ?        ?      148.1        4.7       ?       ? 
1 1 1   46   19   14 o    453.0    3.2    0.0000   0.0000          ?        ?  2054.1243  29.3720          ?        ?      453.0        3.2       ?       ? 
1 1 1   46   19   15 o    259.7    4.1    0.0000   0.0000          ?        ?   675.5559  21.0712          ?        ?      259.7        4.1       ?       ? 
1 1 1   46   19   16 o    412.6    3.2    0.0000   0.0000          ?        ?  1704.2142  26.8179          ?        ?      412.6        3.2       ?       ? 
1 1 1   46   19   17 o     93.8    5.1    0.0000   0.0000          ?        ?    88.1160   9.5778          ?        ?       93.8        5.1       ?       ? 
1 1 1   46   19   18 o     22.1   10.2    0.0000   0.0000          ?        ?    -9.5778  10.8549          ?        ?       22.1       10.2       ?       ? 
1 1 1   46   19   19 o    244.0    2.9    0.0000   0.0000          ?        ?   595.7407  14.0475          ?        ?      244.0        2.9       ?       ? 
1 1 1   46   19   20 o    144.4    4.2    0.0000   0.0000          ?        ?   208.7966  12.1319          ?        ?      144.4        4.2       ?       ? 
1 1 1   46   19   21 o    149.6    4.7    0.0000   0.0000          ?        ?   224.1211  14.0475          ?        ?      149.6        4.7       ?       ? 
1 1 1   46   19   22 o    312.4    3.0    0.0000   0.0000          ?        ?   976.9381  18.5171          ?        ?      312.4        3.0       ?       ? 
1 1 1   46   19   23 o     85.8    8.6    0.0000   0.0000          ?        ?    74.0685  14.6860          ?        ?       85.8        8.6       ?       ? 
1 1 1   46   19   24 o    342.3    2.9    0.0000   0.0000          ?        ?  1172.3258  19.7942          ?        ?      342.3        2.9       ?       ? 
1 1 1   46   19   25 o    333.9    3.1    0.0000   0.0000          ?        ?  1116.1359  20.4327          ?        ?      333.9        3.1       ?       ? 
1 1 1   46   19   26 o    329.4    2.9    0.0000   0.0000          ?        ?  1086.1254  19.1556          ?        ?      329.4        2.9       ?       ? 
1 1 1   46   19   27 o    170.3    4.3    0.0000   0.0000          ?        ?   290.5273  14.6860          ?        ?      170.3        4.3       ?       ? 
1 1 1   46   19   28 o    116.6    6.3    0.0000   0.0000          ?        ?   136.6436  14.6860          ?        ?      116.6        6.3       ?       ? 
1 1 1   46   19   29 o    134.4    5.5    0.0000   0.0000          ?        ?   181.3401  14.6860          ?        ?      134.4        5.5       ?       ? 
1 1 1   46   19   30 o    242.1    3.3    0.0000   0.0000          ?        ?   586.8014  15.9630          ?        ?      242.1        3.3       ?       ? 
1 1 1   46   19   31 o    328.3    2.8    0.0000   0.0000          ?        ?  1079.1016  18.5171          ?        ?      328.3        2.8       ?       ? 
1 1 1   46   19   32 o    173.5    4.8    0.0000   0.0000          ?        ?   302.0207  16.6016          ?        ?      173.5        4.8       ?       ? 
1 1 1   46   19   33 o     29.6   13.1    0.0000   0.0000          ?        ?    -4.4697  15.3245          ?        ?       29.6       13.1       ?       ? 
1 1 1   46   19   34 o    232.5    3.6    0.0000   0.0000          ?        ?   541.4664  16.6016          ?        ?      232.5        3.6       ?       ? 
1 1 1   46   19   35 o    254.9    3.4    0.0000   0.0000          ?        ?   650.6536  17.2401          ?        ?      254.9        3.4       ?       ? 
1 1 1   46   19   36 o    135.5    5.9    0.0000   0.0000          ?        ?   184.5327  15.9630          ?        ?      135.5        5.9       ?       ? 
1 1 1   46   19   37 o    178.0    4.7    0.0000   0.0000          ?        ?   317.9838  16.6016          ?        ?      178.0        4.7       ?       ? 
1 1 1   46   19   38 o    237.9    3.5    0.0000   0.0000          ?        ?   567.0072  16.6016          ?        ?      237.9        3.5       ?       ? 
1 1 1   46   19   39 o    214.7    4.2    0.0000   0.0000          ?        ?   462.2897  17.8786          ?        ?      214.7        4.2       ?       ? 
1 1 1   46   19   40 o    151.1    5.5    0.0000   0.0000          ?        ?   229.8678  16.6016          ?        ?      151.1        5.5       ?       ? 
1 1 1   46   20    0 o    151.0    7.9  230.5063  23.6253   230.5063  23.6253   230.5063  23.6253      151.0      7.9      151.0        7.9     0.0     0.0 
1 1 1   46   20    1 o    318.4    3.6    0.0000   0.0000          ?        ?  1014.6108  22.9868          ?        ?      318.4        3.6       ?       ? 
1 1 1   46   20    2 o    228.1    4.2    0.0000   0.0000          ?        ?   521.0336  19.1556          ?        ?      228.1        4.2       ?       ? 
1 1 1   46   20    3 o    331.6    3.6    0.0000   0.0000          ?        ?  1100.8113  23.6253          ?        ?      331.6        3.6       ?       ? 
1 1 1   46   20    4 o    145.2    5.3    0.0000   0.0000          ?        ?   211.3506  15.3245          ?        ?      145.2        5.3       ?       ? 
1 1 1   46   20    5 o    468.8    4.2    0.0000   0.0000          ?        ?  2200.3455  39.5883          ?        ?      468.8        4.2       ?       ? 
1 1 1   46   20    6 o    267.5    4.1    0.0000   0.0000          ?        ?   716.4213  21.7097          ?        ?      267.5        4.1       ?       ? 
1 1 1   46   20    7 o     86.6    8.5    0.0000   0.0000          ?        ?    75.3456  14.6860          ?        ?       86.6        8.5       ?       ? 
1 1 1   46   20    8 o    187.1    4.3    0.0000   0.0000          ?        ?   350.5484  15.9630          ?        ?      187.1        4.3       ?       ? 
1 1 1   46   20    9 o    284.3    3.7    0.0000   0.0000          ?        ?   809.0069  21.0712          ?        ?      284.3        3.7       ?       ? 
1 1 1   46   20   10 o    358.7    3.5    0.0000   0.0000          ?        ?  1287.8981  24.9023          ?        ?      358.7        3.5       ?       ? 
1 1 1   46   20   11 o    334.2    3.8    0.0000   0.0000          ?        ?  1118.0514  25.5409          ?        ?      334.2        3.8       ?       ? 
1 1 1   46   20   12 o    309.4    3.1    0.0000   0.0000          ?        ?   957.7824  19.1556          ?        ?      309.4        3.1       ?       ? 
1 1 1   46   20   13 o    222.2    3.9    0.0000   0.0000          ?        ?   494.2158  17.2401          ?        ?      222.2        3.9       ?       ? 
1 1 1   46   20   14 o     16.7    8.4    0.0000   0.0000          ?        ?   -49.1662  14.0475          ?        ?       16.7        8.4       ?       ? 
1 1 1   46   20   15 o    215.5    3.7    0.0000   0.0000          ?        ?   464.8438  15.9630          ?        ?      215.5        3.7       ?       ? 
1 1 1   46   20   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46   20   17 o     23.6   11.3    0.0000   0.0000          ?        ?   -21.7097  15.3245          ?        ?       23.6       11.3       ?       ? 
1 1 1   46   20   18 o    122.4    3.9    0.0000   0.0000          ?        ?   150.0526   9.5778          ?        ?      122.4        3.9       ?       ? 
1 1 1   46   20   19 o    438.7    2.8    0.0000   0.0000          ?        ?  1925.7812  24.2638          ?        ?      438.7        2.8       ?       ? 
1 1 1   46   20   20 o    137.1    4.4    0.0000   0.0000          ?        ?   188.3639  12.1319          ?        ?      137.1        4.4       ?       ? 
1 1 1   46   20   21 f    438.8    2.6    0.0000   0.0000          ?        ?  1927.0582  22.9868          ?        ?      438.8        2.6       ?       ? 
1 1 1   46   20   22 o     82.0    8.2    0.0000   0.0000          ?        ?    67.6833  13.4090          ?        ?       82.0        8.2       ?       ? 
1 1 1   46   20   23 o     52.7   12.8    0.0000   0.0000          ?        ?    29.3720  13.4090          ?        ?       52.7       12.8       ?       ? 
1 1 1   46   20   24 o    333.1    2.8    0.0000   0.0000          ?        ?  1110.3890  18.5171          ?        ?      333.1        2.8       ?       ? 
1 1 1   46   20   25 o     24.6   11.5    0.0000   0.0000          ?        ?   -13.4090  14.0475          ?        ?       24.6       11.5       ?       ? 
1 1 1   46   20   26 o    215.7    3.7    0.0000   0.0000          ?        ?   466.1208  15.9630          ?        ?      215.7        3.7       ?       ? 
1 1 1   46   20   27 o    325.2    2.8    0.0000   0.0000          ?        ?  1058.6688  18.5171          ?        ?      325.2        2.8       ?       ? 
1 1 1   46   20   28 o    251.1    3.4    0.0000   0.0000          ?        ?   631.4979  17.2401          ?        ?      251.1        3.4       ?       ? 
1 1 1   46   20   29 o    277.9    3.2    0.0000   0.0000          ?        ?   773.2497  17.8786          ?        ?      277.9        3.2       ?       ? 
1 1 1   46   20   30 o     85.9    9.3    0.0000   0.0000          ?        ?    74.7070  15.9630          ?        ?       85.9        9.3       ?       ? 
1 1 1   46   20   31 o     59.0   13.3    0.0000   0.0000          ?        ?    37.0343  15.3245          ?        ?       59.0       13.3       ?       ? 
1 1 1   46   20   32 f    210.7    3.9    0.0000   0.0000          ?        ?   445.0496  16.6016          ?        ?      210.7        3.9       ?       ? 
1 1 1   46   20   33 o     32.4   13.7    0.0000   0.0000          ?        ?     1.2770  15.3245          ?        ?       32.4       13.7       ?       ? 
1 1 1   46   20   34 o    192.4    4.0    0.0000   0.0000          ?        ?   370.9810  15.3245          ?        ?      192.4        4.0       ?       ? 
1 1 1   46   20   35 o    136.4    5.6    0.0000   0.0000          ?        ?   187.0868  15.3245          ?        ?      136.4        5.6       ?       ? 
1 1 1   46   20   36 o    124.6    6.4    0.0000   0.0000          ?        ?   156.4378  15.9630          ?        ?      124.6        6.4       ?       ? 
1 1 1   46   20   37 o     20.5   10.1    0.0000   0.0000          ?        ?   -30.6490  14.6860          ?        ?       20.5       10.1       ?       ? 
1 1 1   46   20   38 o    170.0    4.9    0.0000   0.0000          ?        ?   290.5273  16.6016          ?        ?      170.0        4.9       ?       ? 
1 1 1   46   20   39 o     69.3   10.6    0.0000   0.0000          ?        ?    49.1662  14.6860          ?        ?       69.3       10.6       ?       ? 
1 1 1   46   21    0 o    301.8    5.7  913.0859  34.4802   913.0859  34.4802   913.0859  34.4802      301.8      5.7      301.8        5.7     0.0     0.0 
1 1 1   46   21    1 o    376.5    3.5    0.0000   0.0000          ?        ?  1418.7950  26.1794          ?        ?      376.5        3.5       ?       ? 
1 1 1   46   21    2 o    118.0    7.0    0.0000   0.0000          ?        ?   139.8362  16.6016          ?        ?      118.0        7.0       ?       ? 
1 1 1   46   21    3 o    304.3    4.2    0.0000   0.0000          ?        ?   927.1334  25.5409          ?        ?      304.3        4.2       ?       ? 
1 1 1   46   21    4 o    201.1    4.3    0.0000   0.0000          ?        ?   404.8227  17.2401          ?        ?      201.1        4.3       ?       ? 
1 1 1   46   21    5 o    172.1    5.0    0.0000   0.0000          ?        ?   296.9126  17.2401          ?        ?      172.1        5.0       ?       ? 
1 1 1   46   21    6 o     96.6    8.6    0.0000   0.0000          ?        ?    93.8627  16.6016          ?        ?       96.6        8.6       ?       ? 
1 1 1   46   21    7 o    245.3    4.0    0.0000   0.0000          ?        ?   602.7644  19.7942          ?        ?      245.3        4.0       ?       ? 
1 1 1   46   21    8 o    338.9    3.5    0.0000   0.0000          ?        ?  1149.9775  23.6253          ?        ?      338.9        3.5       ?       ? 
1 1 1   46   21    9 o    128.8    7.4    0.0000   0.0000          ?        ?   166.6541  19.1556          ?        ?      128.8        7.4       ?       ? 
1 1 1   46   21   10 o    140.4    6.8    0.0000   0.0000          ?        ?   197.9417  19.1556          ?        ?      140.4        6.8       ?       ? 
1 1 1   46   21   11 o     89.6   10.3    0.0000   0.0000          ?        ?    81.0922  18.5171          ?        ?       89.6       10.3       ?       ? 
1 1 1   46   21   12 o    199.0    5.3    0.0000   0.0000          ?        ?   397.1605  21.0712          ?        ?      199.0        5.3       ?       ? 
1 1 1   46   21   13 o    140.1    4.3    0.0000   0.0000          ?        ?   196.6647  12.1319          ?        ?      140.1        4.3       ?       ? 
1 1 1   46   21   14 o     41.2   13.5    0.0000   0.0000          ?        ?    16.6016  12.7704          ?        ?       41.2       13.5       ?       ? 
1 1 1   46   21   15 f     63.6   11.5    0.0000   0.0000          ?        ?    42.1424  14.0475          ?        ?       63.6       11.5       ?       ? 
1 1 1   46   21   16 o    223.0    3.6    0.0000   0.0000          ?        ?   498.0469  15.9630          ?        ?      223.0        3.6       ?       ? 
1 1 1   46   21   17 o    417.3    3.5    0.0000   0.0000          ?        ?  1743.8026  29.3720          ?        ?      417.3        3.5       ?       ? 
1 1 1   46   21   18 o    208.2    3.8    0.0000   0.0000          ?        ?   434.1947  15.9630          ?        ?      208.2        3.8       ?       ? 
1 1 1   46   21   19 f     86.1    8.5    0.0000   0.0000          ?        ?    74.7070  14.6860          ?        ?       86.1        8.5       ?       ? 
1 1 1   46   21   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46   21   21 o    132.1    4.6    0.0000   0.0000          ?        ?   174.9549  12.1319          ?        ?      132.1        4.6       ?       ? 
1 1 1   46   21   22 f    366.9    2.7    0.0000   0.0000          ?        ?  1347.2806  19.7942          ?        ?      366.9        2.7       ?       ? 
1 1 1   46   21   23 o    159.6    4.4    0.0000   0.0000          ?        ?   255.4086  14.0475          ?        ?      159.6        4.4       ?       ? 
1 1 1   46   21   24 o     17.8    8.9    0.0000   0.0000          ?        ?   -37.6728  13.4090          ?        ?       17.8        8.9       ?       ? 
1 1 1   46   21   25 o    166.3    4.2    0.0000   0.0000          ?        ?   277.1184  14.0475          ?        ?      166.3        4.2       ?       ? 
1 1 1   46   21   26 o     58.2   12.4    0.0000   0.0000          ?        ?    35.7572  14.0475          ?        ?       58.2       12.4       ?       ? 
1 1 1   46   21   27 o     19.3    9.6    0.0000   0.0000          ?        ?   -37.0343  14.6860          ?        ?       19.3        9.6       ?       ? 
1 1 1   46   21   28 o     78.7    8.5    0.0000   0.0000          ?        ?    62.5751  13.4090          ?        ?       78.7        8.5       ?       ? 
1 1 1   46   21   29 o    207.0    3.5    0.0000   0.0000          ?        ?   429.0865  14.6860          ?        ?      207.0        3.5       ?       ? 
1 1 1   46   21   30 o    212.4    3.8    0.0000   0.0000          ?        ?   452.0733  15.9630          ?        ?      212.4        3.8       ?       ? 
1 1 1   46   21   31 f    368.3    2.8    0.0000   0.0000          ?        ?  1358.1355  20.4327          ?        ?      368.3        2.8       ?       ? 
1 1 1   46   21   32 o    126.4    6.3    0.0000   0.0000          ?        ?   160.9075  15.9630          ?        ?      126.4        6.3       ?       ? 
1 1 1   46   21   33 f    149.6    5.3    0.0000   0.0000          ?        ?   224.7596  15.9630          ?        ?      149.6        5.3       ?       ? 
1 1 1   46   21   34 o    351.2    2.9    0.0000   0.0000          ?        ?  1235.5393  20.4327          ?        ?      351.2        2.9       ?       ? 
1 1 1   46   21   35 o    103.0    7.4    0.0000   0.0000          ?        ?   107.2716  15.3245          ?        ?      103.0        7.4       ?       ? 
1 1 1   46   21   36 o     18.3    9.2    0.0000   0.0000          ?        ?   -46.6121  15.3245          ?        ?       18.3        9.2       ?       ? 
1 1 1   46   21   37 f     19.0    9.5    0.0000   0.0000          ?        ?   -42.1424  15.3245          ?        ?       19.0        9.5       ?       ? 
1 1 1   46   22    0 o     23.8   16.1   -8.3008  21.7097    -8.3008  21.7097    -8.3008  21.7097       23.8     16.1       23.8       16.1     0.0     0.0 
1 1 1   46   22    1 o    176.5    4.7    0.0000   0.0000          ?        ?   312.2371  16.6016          ?        ?      176.5        4.7       ?       ? 
1 1 1   46   22    2 o    147.6    5.8    0.0000   0.0000          ?        ?   218.3744  17.2401          ?        ?      147.6        5.8       ?       ? 
1 1 1   46   22    3 o    214.5    4.2    0.0000   0.0000          ?        ?   461.0126  17.8786          ?        ?      214.5        4.2       ?       ? 
1 1 1   46   22    4 o    159.5    4.8    0.0000   0.0000          ?        ?   254.7701  15.3245          ?        ?      159.5        4.8       ?       ? 
1 1 1   46   22    5 o    112.2    6.8    0.0000   0.0000          ?        ?   126.4273  15.3245          ?        ?      112.2        6.8       ?       ? 
1 1 1   46   22    6 o    209.3    4.3    0.0000   0.0000          ?        ?   438.6643  17.8786          ?        ?      209.3        4.3       ?       ? 
1 1 1   46   22    7 o    231.2    4.7    0.0000   0.0000          ?        ?   535.7197  21.7097          ?        ?      231.2        4.7       ?       ? 
1 1 1   46   22    8 o    233.7    4.9    0.0000   0.0000          ?        ?   547.2130  22.9868          ?        ?      233.7        4.9       ?       ? 
1 1 1   46   22    9 o    124.2    8.0    0.0000   0.0000          ?        ?   155.1608  19.7942          ?        ?      124.2        8.0       ?       ? 
1 1 1   46   22   10 o    192.0    5.7    0.0000   0.0000          ?        ?   369.7040  21.7097          ?        ?      192.0        5.7       ?       ? 
1 1 1   46   22   11 o     97.5    8.8    0.0000   0.0000          ?        ?    95.7782  17.2401          ?        ?       97.5        8.8       ?       ? 
1 1 1   46   22   12 o    222.1    4.3    0.0000   0.0000          ?        ?   494.2158  19.1556          ?        ?      222.1        4.3       ?       ? 
1 1 1   46   22   13 o    389.0    3.4    0.0000   0.0000          ?        ?  1515.2118  26.8179          ?        ?      389.0        3.4       ?       ? 
1 1 1   46   22   14 o    263.1    3.0    0.0000   0.0000          ?        ?   692.7960  15.9630          ?        ?      263.1        3.0       ?       ? 
1 1 1   46   22   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46   22   16 o     25.9   12.1    0.0000   0.0000          ?        ?   -14.0475  15.3245          ?        ?       25.9       12.1       ?       ? 
1 1 1   46   22   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46   22   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46   22   19 o     59.6   13.7    0.0000   0.0000          ?        ?    37.6728  15.9630          ?        ?       59.6       13.7       ?       ? 
1 1 1   46   22   20 o    209.7    4.0    0.0000   0.0000          ?        ?   440.5799  16.6016          ?        ?      209.7        4.0       ?       ? 
1 1 1   46   22   21 o    276.1    2.8    0.0000   0.0000          ?        ?   763.0333  15.3245          ?        ?      276.1        2.8       ?       ? 
1 1 1   46   22   22 o    249.0    2.8    0.0000   0.0000          ?        ?   620.6430  14.0475          ?        ?      249.0        2.8       ?       ? 
1 1 1   46   22   23 o    178.2    3.9    0.0000   0.0000          ?        ?   317.9838  14.0475          ?        ?      178.2        3.9       ?       ? 
1 1 1   46   22   24 o    277.8    2.9    0.0000   0.0000          ?        ?   772.6111  15.9630          ?        ?      277.8        2.9       ?       ? 
1 1 1   46   22   25 o    121.5    5.3    0.0000   0.0000          ?        ?   148.1370  12.7704          ?        ?      121.5        5.3       ?       ? 
1 1 1   46   22   26 o    143.2    4.9    0.0000   0.0000          ?        ?   205.6040  14.0475          ?        ?      143.2        4.9       ?       ? 
1 1 1   46   22   27 o    228.1    3.4    0.0000   0.0000          ?        ?   521.0336  15.3245          ?        ?      228.1        3.4       ?       ? 
1 1 1   46   22   28 o    252.5    3.2    0.0000   0.0000          ?        ?   638.5216  15.9630          ?        ?      252.5        3.2       ?       ? 
1 1 1   46   22   29 o     40.5   14.1    0.0000   0.0000          ?        ?    15.3245  14.0475          ?        ?       40.5       14.1       ?       ? 
1 1 1   46   22   30 o     39.0   14.1    0.0000   0.0000          ?        ?    13.4090  14.0475          ?        ?       39.0       14.1       ?       ? 
1 1 1   46   22   31 o     59.4   13.2    0.0000   0.0000          ?        ?    37.6728  15.3245          ?        ?       59.4       13.2       ?       ? 
1 1 1   46   22   32 o    120.3    6.1    0.0000   0.0000          ?        ?   145.5829  14.6860          ?        ?      120.3        6.1       ?       ? 
1 1 1   46   22   33 o    206.4    3.7    0.0000   0.0000          ?        ?   427.1710  15.3245          ?        ?      206.4        3.7       ?       ? 
1 1 1   46   22   34 o     40.6   14.7    0.0000   0.0000          ?        ?    14.6860  15.3245          ?        ?       40.6       14.7       ?       ? 
1 1 1   46   22   35 o     19.5    9.7    0.0000   0.0000          ?        ?   -39.5883  15.3245          ?        ?       19.5        9.7       ?       ? 
1 1 1   46   23    0 o    332.4    5.8 1107.8350  38.3113  1107.8350  38.3113  1107.8350  38.3113      332.4      5.8      332.4        5.8     0.0     0.0 
1 1 1   46   23    1 o    115.0    6.7    0.0000   0.0000          ?        ?   132.8125  15.3245          ?        ?      115.0        6.7       ?       ? 
1 1 1   46   23    2 o    278.3    4.2    0.0000   0.0000          ?        ?   775.8038  23.6253          ?        ?      278.3        4.2       ?       ? 
1 1 1   46   23    3 o     98.2    7.8    0.0000   0.0000          ?        ?    97.0553  15.3245          ?        ?       98.2        7.8       ?       ? 
1 1 1   46   23    4 o     60.8   13.0    0.0000   0.0000          ?        ?    38.9498  15.3245          ?        ?       60.8       13.0       ?       ? 
1 1 1   46   23    5 o     40.1   14.9    0.0000   0.0000          ?        ?    12.7704  15.9630          ?        ?       40.1       14.9       ?       ? 
1 1 1   46   23    6 o     66.4   14.4    0.0000   0.0000          ?        ?    46.6121  18.5171          ?        ?       66.4       14.4       ?       ? 
1 1 1   46   23    7 o    180.9    5.6    0.0000   0.0000          ?        ?   328.2001  20.4327          ?        ?      180.9        5.6       ?       ? 
1 1 1   46   23    8 o    136.9    7.2    0.0000   0.0000          ?        ?   188.3639  19.7942          ?        ?      136.9        7.2       ?       ? 
1 1 1   46   23    9 o    493.6    4.3    0.0000   0.0000          ?        ?  2440.4297  42.1424          ?        ?      493.6        4.3       ?       ? 
1 1 1   46   23   10 o    358.2    3.7    0.0000   0.0000          ?        ?  1284.7054  26.1794          ?        ?      358.2        3.7       ?       ? 
1 1 1   46   23   11 o    142.0    5.8    0.0000   0.0000          ?        ?   202.4114  16.6016          ?        ?      142.0        5.8       ?       ? 
1 1 1   46   23   12 o     79.8   10.8    0.0000   0.0000          ?        ?    64.4907  17.2401          ?        ?       79.8       10.8       ?       ? 
1 1 1   46   23   13 o     94.1    9.5    0.0000   0.0000          ?        ?    89.3930  17.8786          ?        ?       94.1        9.5       ?       ? 
1 1 1   46   23   14 o    107.9    5.9    0.0000   0.0000          ?        ?   116.8494  12.7704          ?        ?      107.9        5.9       ?       ? 
1 1 1   46   23   15 o     36.9   13.4    0.0000   0.0000          ?        ?    11.4934  12.7704          ?        ?       36.9       13.4       ?       ? 
1 1 1   46   23   16 o    371.5    3.2    0.0000   0.0000          ?        ?  1381.7607  23.6253          ?        ?      371.5        3.2       ?       ? 
1 1 1   46   23   17 o    122.5    5.7    0.0000   0.0000          ?        ?   150.6911  14.0475          ?        ?      122.5        5.7       ?       ? 
1 1 1   46   23   18 o     30.5   13.2    0.0000   0.0000          ?        ?    -1.2770  14.6860          ?        ?       30.5       13.2       ?       ? 
1 1 1   46   23   19 o    246.6    3.5    0.0000   0.0000          ?        ?   609.1497  17.2401          ?        ?      246.6        3.5       ?       ? 
1 1 1   46   23   20 o    155.7    5.3    0.0000   0.0000          ?        ?   243.2767  16.6016          ?        ?      155.7        5.3       ?       ? 
1 1 1   46   23   21 o    154.9    5.2    0.0000   0.0000          ?        ?   240.7227  15.9630          ?        ?      154.9        5.2       ?       ? 
1 1 1   46   23   22 f    121.8    4.5    0.0000   0.0000          ?        ?   148.7755  10.8549          ?        ?      121.8        4.5       ?       ? 
1 1 1   46   23   23 o    188.3    3.4    0.0000   0.0000          ?        ?   355.0180  12.7704          ?        ?      188.3        3.4       ?       ? 
1 1 1   46   23   24 o     58.9   11.2    0.0000   0.0000          ?        ?    36.3957  12.7704          ?        ?       58.9       11.2       ?       ? 
1 1 1   46   23   25 o    134.9    4.7    0.0000   0.0000          ?        ?   182.6172  12.7704          ?        ?      134.9        4.7       ?       ? 
1 1 1   46   23   26 o    181.8    3.9    0.0000   0.0000          ?        ?   331.3927  14.0475          ?        ?      181.8        3.9       ?       ? 
1 1 1   46   23   27 o    329.6    2.8    0.0000   0.0000          ?        ?  1088.0408  18.5171          ?        ?      329.6        2.8       ?       ? 
1 1 1   46   23   28 o    163.3    4.3    0.0000   0.0000          ?        ?   267.5406  14.0475          ?        ?      163.3        4.3       ?       ? 
1 1 1   46   23   29 o     33.1   13.3    0.0000   0.0000          ?        ?     5.7467  13.4090          ?        ?       33.1       13.3       ?       ? 
1 1 1   46   23   30 o    188.8    3.9    0.0000   0.0000          ?        ?   357.5721  14.6860          ?        ?      188.8        3.9       ?       ? 
1 1 1   46   23   31 o     77.7    9.0    0.0000   0.0000          ?        ?    61.2981  14.0475          ?        ?       77.7        9.0       ?       ? 
1 1 1   46   23   32 o    216.4    3.5    0.0000   0.0000          ?        ?   469.3134  15.3245          ?        ?      216.4        3.5       ?       ? 
1 1 1   46   23   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46   24    0 o    359.4    4.8 1294.2833  34.4802  1294.2833  34.4802  1294.2833  34.4802      359.4      4.8      359.4        4.8     0.0     0.0 
1 1 1   46   24    1 o     85.7    8.6    0.0000   0.0000          ?        ?    74.0685  14.6860          ?        ?       85.7        8.6       ?       ? 
1 1 1   46   24    2 o    290.1    3.5    0.0000   0.0000          ?        ?   842.8486  20.4327          ?        ?      290.1        3.5       ?       ? 
1 1 1   46   24    3 o    139.7    6.9    0.0000   0.0000          ?        ?   196.0261  19.1556          ?        ?      139.7        6.9       ?       ? 
1 1 1   46   24    4 o    120.6    6.9    0.0000   0.0000          ?        ?   146.2215  16.6016          ?        ?      120.6        6.9       ?       ? 
1 1 1   46   24    5 o     68.5   12.6    0.0000   0.0000          ?        ?    49.1662  16.6016          ?        ?       68.5       12.6       ?       ? 
1 1 1   46   24    6 o    287.9    3.9    0.0000   0.0000          ?        ?   830.0781  22.3483          ?        ?      287.9        3.9       ?       ? 
1 1 1   46   24    7 o    312.7    3.5    0.0000   0.0000          ?        ?   978.8537  21.7097          ?        ?      312.7        3.5       ?       ? 
1 1 1   46   24    8 o    130.3    6.1    0.0000   0.0000          ?        ?   170.4853  15.9630          ?        ?      130.3        6.1       ?       ? 
1 1 1   46   24    9 o     28.3   12.9    0.0000   0.0000          ?        ?    -9.5778  15.9630          ?        ?       28.3       12.9       ?       ? 
1 1 1   46   24   10 o     35.8   14.6    0.0000   0.0000          ?        ?     5.1082  16.6016          ?        ?       35.8       14.6       ?       ? 
1 1 1   46   24   11 o    231.8    4.1    0.0000   0.0000          ?        ?   538.2737  19.1556          ?        ?      231.8        4.1       ?       ? 
1 1 1   46   24   12 o    118.7    7.0    0.0000   0.0000          ?        ?   141.7518  16.6016          ?        ?      118.7        7.0       ?       ? 
1 1 1   46   24   13 o    196.3    4.7    0.0000   0.0000          ?        ?   386.3056  18.5171          ?        ?      196.3        4.7       ?       ? 
1 1 1   46   24   14 o    140.4    6.4    0.0000   0.0000          ?        ?   197.9417  17.8786          ?        ?      140.4        6.4       ?       ? 
1 1 1   46   24   15 o    269.7    3.4    0.0000   0.0000          ?        ?   728.5532  18.5171          ?        ?      269.7        3.4       ?       ? 
1 1 1   46   24   16 o    194.3    3.6    0.0000   0.0000          ?        ?   378.0048  14.0475          ?        ?      194.3        3.6       ?       ? 
1 1 1   46   24   17 f    312.0    3.1    0.0000   0.0000          ?        ?   974.3840  19.1556          ?        ?      312.0        3.1       ?       ? 
1 1 1   46   24   18 o    107.8    6.8    0.0000   0.0000          ?        ?   116.8494  14.6860          ?        ?      107.8        6.8       ?       ? 
1 1 1   46   24   19 o    122.4    6.3    0.0000   0.0000          ?        ?   150.6911  15.3245          ?        ?      122.4        6.3       ?       ? 
1 1 1   46   24   20 o     86.0    8.9    0.0000   0.0000          ?        ?    74.7070  15.3245          ?        ?       86.0        8.9       ?       ? 
1 1 1   46   24   21 o    131.2    6.3    0.0000   0.0000          ?        ?   173.0394  16.6016          ?        ?      131.2        6.3       ?       ? 
1 1 1   46   24   22 o    225.1    3.7    0.0000   0.0000          ?        ?   507.6247  16.6016          ?        ?      225.1        3.7       ?       ? 
1 1 1   46   24   23 o     30.7   12.1    0.0000   0.0000          ?        ?     5.7467  10.8549          ?        ?       30.7       12.1       ?       ? 
1 1 1   46   24   24 o    367.1    2.7    0.0000   0.0000          ?        ?  1349.1962  19.7942          ?        ?      367.1        2.7       ?       ? 
1 1 1   46   24   25 o    214.7    3.1    0.0000   0.0000          ?        ?   461.6512  13.4090          ?        ?      214.7        3.1       ?       ? 
1 1 1   46   24   26 o    198.8    3.5    0.0000   0.0000          ?        ?   395.8834  14.0475          ?        ?      198.8        3.5       ?       ? 
1 1 1   46   24   27 o    153.8    4.6    0.0000   0.0000          ?        ?   237.5300  14.0475          ?        ?      153.8        4.6       ?       ? 
1 1 1   46   24   28 o    109.5    5.8    0.0000   0.0000          ?        ?   120.6806  12.7704          ?        ?      109.5        5.8       ?       ? 
1 1 1   46   24   29 o     21.4   10.4    0.0000   0.0000          ?        ?   -23.6253  14.0475          ?        ?       21.4       10.4       ?       ? 
1 1 1   46   24   30 o    213.9    3.4    0.0000   0.0000          ?        ?   458.4586  14.6860          ?        ?      213.9        3.4       ?       ? 
1 1 1   46   24   31 o     39.8   14.1    0.0000   0.0000          ?        ?    14.6860  14.0475          ?        ?       39.8       14.1       ?       ? 
1 1 1   46   25    0 o     24.4   16.0   -0.6385  18.5171    -0.6385  18.5171    -0.6385  18.5171       24.4     16.0       24.4       16.0     0.0     0.0 
1 1 1   46   25    1 o    309.2    3.7    0.0000   0.0000          ?        ?   957.7824  22.9868          ?        ?      309.2        3.7       ?       ? 
1 1 1   46   25    2 o    280.4    4.2    0.0000   0.0000          ?        ?   787.9357  23.6253          ?        ?      280.4        4.2       ?       ? 
1 1 1   46   25    3 o    342.9    4.3    0.0000   0.0000          ?        ?  1178.0724  29.3720          ?        ?      342.9        4.3       ?       ? 
1 1 1   46   25    4 o    212.5    4.4    0.0000   0.0000          ?        ?   452.7119  18.5171          ?        ?      212.5        4.4       ?       ? 
1 1 1   46   25    5 o    145.0    4.8    0.0000   0.0000          ?        ?   210.7121  14.0475          ?        ?      145.0        4.8       ?       ? 
1 1 1   46   25    6 o    174.0    4.2    0.0000   0.0000          ?        ?   303.2978  14.6860          ?        ?      174.0        4.2       ?       ? 
1 1 1   46   25    7 f    179.7    4.4    0.0000   0.0000          ?        ?   323.7305  15.9630          ?        ?      179.7        4.4       ?       ? 
1 1 1   46   25    8 o    304.4    4.0    0.0000   0.0000          ?        ?   928.4104  24.2638          ?        ?      304.4        4.0       ?       ? 
1 1 1   46   25    9 o    513.0    3.8    0.0000   0.0000          ?        ?  2636.4558  38.9498          ?        ?      513.0        3.8       ?       ? 
1 1 1   46   25   10 o    262.8    4.4    0.0000   0.0000          ?        ?   692.1575  22.9868          ?        ?      262.8        4.4       ?       ? 
1 1 1   46   25   11 o    135.1    6.1    0.0000   0.0000          ?        ?   183.2557  16.6016          ?        ?      135.1        6.1       ?       ? 
1 1 1   46   25   12 o    357.9    4.1    0.0000   0.0000          ?        ?  1283.4285  29.3720          ?        ?      357.9        4.1       ?       ? 
1 1 1   46   25   13 o    240.5    5.2    0.0000   0.0000          ?        ?   580.4161  24.9023          ?        ?      240.5        5.2       ?       ? 
1 1 1   46   25   14 o    318.8    4.9    0.0000   0.0000          ?        ?  1019.7190  31.2876          ?        ?      318.8        4.9       ?       ? 
1 1 1   46   25   15 o     65.8   13.6    0.0000   0.0000          ?        ?    45.9736  17.2401          ?        ?       65.8       13.6       ?       ? 
1 1 1   46   25   16 o    307.2    3.0    0.0000   0.0000          ?        ?   945.0120  18.5171          ?        ?      307.2        3.0       ?       ? 
1 1 1   46   25   17 f    255.4    3.3    0.0000   0.0000          ?        ?   653.2076  16.6016          ?        ?      255.4        3.3       ?       ? 
1 1 1   46   25   18 o    241.0    3.6    0.0000   0.0000          ?        ?   581.6932  17.2401          ?        ?      241.0        3.6       ?       ? 
1 1 1   46   25   19 o     89.9    8.5    0.0000   0.0000          ?        ?    81.7308  15.3245          ?        ?       89.9        8.5       ?       ? 
1 1 1   46   25   20 o    292.1    3.4    0.0000   0.0000          ?        ?   854.9804  19.7942          ?        ?      292.1        3.4       ?       ? 
1 1 1   46   25   21 o    313.3    3.1    0.0000   0.0000          ?        ?   983.3233  19.1556          ?        ?      313.3        3.1       ?       ? 
1 1 1   46   25   22 o    123.7    6.2    0.0000   0.0000          ?        ?   153.8837  15.3245          ?        ?      123.7        6.2       ?       ? 
1 1 1   46   25   23 f    184.2    4.5    0.0000   0.0000          ?        ?   340.3320  16.6016          ?        ?      184.2        4.5       ?       ? 
1 1 1   46   25   24 o     83.5    6.5    0.0000   0.0000          ?        ?    70.2374  10.8549          ?        ?       83.5        6.5       ?       ? 
1 1 1   46   25   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46   25   26 o     20.5    9.9    0.0000   0.0000          ?        ?   -18.5171  12.1319          ?        ?       20.5        9.9       ?       ? 
1 1 1   46   25   27 o    135.8    4.7    0.0000   0.0000          ?        ?   185.1713  12.7704          ?        ?      135.8        4.7       ?       ? 
1 1 1   46   25   28 o    163.5    4.1    0.0000   0.0000          ?        ?   268.1791  13.4090          ?        ?      163.5        4.1       ?       ? 
1 1 1   46   26    0 o    497.3    6.5 2481.2952  64.4907  2481.2952  64.4907  2481.2952  64.4907      497.3      6.5      497.3        6.5     0.0     0.0 
1 1 1   46   26    1 o    290.0    4.2    0.0000   0.0000          ?        ?   842.8486  24.2638          ?        ?      290.0        4.2       ?       ? 
1 1 1   46   26    2 o    183.6    5.2    0.0000   0.0000          ?        ?   338.4165  19.1556          ?        ?      183.6        5.2       ?       ? 
1 1 1   46   26    3 o    150.2    4.0    0.0000   0.0000          ?        ?   226.0367  12.1319          ?        ?      150.2        4.0       ?       ? 
1 1 1   46   26    4 o     20.7    9.9    0.0000   0.0000          ?        ?   -15.3245  11.4934          ?        ?       20.7        9.9       ?       ? 
1 1 1   46   26    5 o     37.4   13.1    0.0000   0.0000          ?        ?    12.7704  12.1319          ?        ?       37.4       13.1       ?       ? 
1 1 1   46   26    6 o     26.3   11.6    0.0000   0.0000          ?        ?    -3.8311  12.1319          ?        ?       26.3       11.6       ?       ? 
1 1 1   46   26    7 o    195.4    3.8    0.0000   0.0000          ?        ?   382.4745  14.6860          ?        ?      195.4        3.8       ?       ? 
1 1 1   46   26    8 o    186.3    4.1    0.0000   0.0000          ?        ?   347.9943  15.3245          ?        ?      186.3        4.1       ?       ? 
1 1 1   46   26    9 o    279.2    3.8    0.0000   0.0000          ?        ?   780.9120  21.0712          ?        ?      279.2        3.8       ?       ? 
1 1 1   46   26   10 o    186.5    4.5    0.0000   0.0000          ?        ?   348.6328  16.6016          ?        ?      186.5        4.5       ?       ? 
1 1 1   46   26   11 o    183.5    4.7    0.0000   0.0000          ?        ?   337.7780  17.2401          ?        ?      183.5        4.7       ?       ? 
1 1 1   46   26   12 o     33.5   13.9    0.0000   0.0000          ?        ?     3.1926  15.3245          ?        ?       33.5       13.9       ?       ? 
1 1 1   46   26   13 o     90.6    8.8    0.0000   0.0000          ?        ?    83.0078  15.9630          ?        ?       90.6        8.8       ?       ? 
1 1 1   46   26   14 o    188.4    4.7    0.0000   0.0000          ?        ?   356.2951  17.8786          ?        ?      188.4        4.7       ?       ? 
1 1 1   46   26   15 o    150.8    6.1    0.0000   0.0000          ?        ?   228.5907  18.5171          ?        ?      150.8        6.1       ?       ? 
1 1 1   46   26   16 o     94.3    8.8    0.0000   0.0000          ?        ?    90.0316  16.6016          ?        ?       94.3        8.8       ?       ? 
1 1 1   46   26   17 o     29.4   12.3    0.0000   0.0000          ?        ?     1.9156  12.1319          ?        ?       29.4       12.3       ?       ? 
1 1 1   46   26   18 o    126.1    5.3    0.0000   0.0000          ?        ?   159.6304  13.4090          ?        ?      126.1        5.3       ?       ? 
1 1 1   46   26   19 o    204.2    3.9    0.0000   0.0000          ?        ?   418.2317  15.9630          ?        ?      204.2        3.9       ?       ? 
1 1 1   46   26   20 o    161.5    4.5    0.0000   0.0000          ?        ?   261.7939  14.6860          ?        ?      161.5        4.5       ?       ? 
1 1 1   46   26   21 o     28.7   12.6    0.0000   0.0000          ?        ?    -3.1926  14.0475          ?        ?       28.7       12.6       ?       ? 
1 1 1   46   26   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46   26   23 o    201.7    3.8    0.0000   0.0000          ?        ?   408.0153  15.3245          ?        ?      201.7        3.8       ?       ? 
1 1 1   46   26   24 o    357.0    2.4    0.0000   0.0000          ?        ?  1275.7662  17.2401          ?        ?      357.0        2.4       ?       ? 
1 1 1   46   26   25 o    137.7    4.2    0.0000   0.0000          ?        ?   190.2794  11.4934          ?        ?      137.7        4.2       ?       ? 
1 1 1   46   26   26 o    200.2    3.3    0.0000   0.0000          ?        ?   401.6301  13.4090          ?        ?      200.2        3.3       ?       ? 
1 1 1   46   27    0 o    207.0   11.8  436.7488  48.5276   436.7488  48.5276   436.7488  48.5276      207.0     11.8      207.0       11.8     0.0     0.0 
1 1 1   46   27    1 o    217.2    4.9    0.0000   0.0000          ?        ?   473.1445  21.0712          ?        ?      217.2        4.9       ?       ? 
1 1 1   46   27    2 o    213.7    5.4    0.0000   0.0000          ?        ?   458.4586  22.9868          ?        ?      213.7        5.4       ?       ? 
1 1 1   46   27    3 o    107.6   10.1    0.0000   0.0000          ?        ?   117.4880  21.7097          ?        ?      107.6       10.1       ?       ? 
1 1 1   46   27    4 o    245.0    6.0    0.0000   0.0000          ?        ?   603.4030  29.3720          ?        ?      245.0        6.0       ?       ? 
1 1 1   46   27    5 o     74.4   17.4    0.0000   0.0000          ?        ?    60.0210  25.5409          ?        ?       74.4       17.4       ?       ? 
1 1 1   46   27    6 o     64.4   13.3    0.0000   0.0000          ?        ?    44.0580  16.6016          ?        ?       64.4       13.3       ?       ? 
1 1 1   46   27    7 o    225.8    5.2    0.0000   0.0000          ?        ?   512.0943  23.6253          ?        ?      225.8        5.2       ?       ? 
1 1 1   46   27    8 o     93.4   10.9    0.0000   0.0000          ?        ?    88.7545  20.4327          ?        ?       93.4       10.9       ?       ? 
1 1 1   46   27    9 o    112.3    9.1    0.0000   0.0000          ?        ?   127.7043  20.4327          ?        ?      112.3        9.1       ?       ? 
1 1 1   46   27   10 f     17.8    8.8    0.0000   0.0000          ?        ?   -22.3483  10.8549          ?        ?       17.8        8.8       ?       ? 
1 1 1   46   27   11 o    145.4    4.6    0.0000   0.0000          ?        ?   211.9892  13.4090          ?        ?      145.4        4.6       ?       ? 
1 1 1   46   27   12 o     38.1   14.0    0.0000   0.0000          ?        ?    12.1319  14.0475          ?        ?       38.1       14.0       ?       ? 
1 1 1   46   27   13 o     61.6   12.3    0.0000   0.0000          ?        ?    40.2269  14.6860          ?        ?       61.6       12.3       ?       ? 
1 1 1   46   27   14 o    184.7    4.5    0.0000   0.0000          ?        ?   342.2476  16.6016          ?        ?      184.7        4.5       ?       ? 
1 1 1   46   27   15 o     98.3    8.1    0.0000   0.0000          ?        ?    97.6938  15.9630          ?        ?       98.3        8.1       ?       ? 
1 1 1   46   27   16 o    114.4    7.5    0.0000   0.0000          ?        ?   132.1740  17.2401          ?        ?      114.4        7.5       ?       ? 
1 1 1   46   27   17 o     89.6   10.0    0.0000   0.0000          ?        ?    81.7308  17.8786          ?        ?       89.6       10.0       ?       ? 
1 1 1   46   27   18 o     33.7   12.9    0.0000   0.0000          ?        ?     8.3008  12.1319          ?        ?       33.7       12.9       ?       ? 
1 1 1   46   27   19 o    163.7    4.3    0.0000   0.0000          ?        ?   268.8176  14.0475          ?        ?      163.7        4.3       ?       ? 
1 1 1   46   27   20 f    124.2    5.4    0.0000   0.0000          ?        ?   155.1608  13.4090          ?        ?      124.2        5.4       ?       ? 
1 1 1   46   27   21 o     73.0    9.6    0.0000   0.0000          ?        ?    54.2743  14.0475          ?        ?       73.0        9.6       ?       ? 
1 1 1   46   27   22 o    267.1    3.2    0.0000   0.0000          ?        ?   715.1442  17.2401          ?        ?      267.1        3.2       ?       ? 
1 1 1   46   28    0 o    204.0   13.3  427.1710  53.6358   427.1710  53.6358   427.1710  53.6358      204.0     13.3      204.0       13.3     0.0     0.0 
1 1 1   46   28    1 o    209.7    8.1    0.0000   0.0000          ?        ?   444.4110  33.8416          ?        ?      209.7        8.1       ?       ? 
1 1 1   46   28    2 o    101.7   21.1    0.0000   0.0000          ?        ?   114.2954  41.5039          ?        ?      101.7       21.1       ?       ? 
1 1 1   46   28    3 o    125.7   20.3    0.0000   0.0000          ?        ?   168.5697  51.0817          ?        ?      125.7       20.3       ?       ? 
1 1 1   46   28    4 o    295.8    4.9    0.0000   0.0000          ?        ?   878.6058  28.7335          ?        ?      295.8        4.9       ?       ? 
1 1 1   46   28    5 o    222.5    5.6    0.0000   0.0000          ?        ?   497.4084  24.9023          ?        ?      222.5        5.6       ?       ? 
1 1 1   46   28    6 o    180.6    7.1    0.0000   0.0000          ?        ?   328.8386  25.5409          ?        ?      180.6        7.1       ?       ? 
1 1 1   46   28    7 o    261.4    5.6    0.0000   0.0000          ?        ?   687.0493  29.3720          ?        ?      261.4        5.6       ?       ? 
1 1 1   46   28    8 o     92.1   10.1    0.0000   0.0000          ?        ?    86.2004  18.5171          ?        ?       92.1       10.1       ?       ? 
1 1 1   46   28    9 o    113.0    9.3    0.0000   0.0000          ?        ?   129.6199  21.0712          ?        ?      113.0        9.3       ?       ? 
1 1 1   46   28   10 o    185.8    5.8    0.0000   0.0000          ?        ?   347.3558  21.7097          ?        ?      185.8        5.8       ?       ? 
1 1 1   46   28   11 o    157.9    8.1    0.0000   0.0000          ?        ?   252.2160  25.5409          ?        ?      157.9        8.1       ?       ? 
1 1 1   46   28   12 o    345.2    6.4    0.0000   0.0000          ?        ?  1200.4207  44.0580          ?        ?      345.2        6.4       ?       ? 
1 1 1   46   28   13 f    134.4    4.3    0.0000   0.0000          ?        ?   181.3401  11.4934          ?        ?      134.4        4.3       ?       ? 
1 1 1   46   28   14 o    153.0    4.8    0.0000   0.0000          ?        ?   234.9760  14.6860          ?        ?      153.0        4.8       ?       ? 
1 1 1   46   28   15 f    113.1    6.5    0.0000   0.0000          ?        ?   128.9814  14.6860          ?        ?      113.1        6.5       ?       ? 
1 1 1   46   28   16 o    150.5    5.5    0.0000   0.0000          ?        ?   227.9522  16.6016          ?        ?      150.5        5.5       ?       ? 
1 1 1   46   28   17 o    202.7    4.4    0.0000   0.0000          ?        ?   412.4850  17.8786          ?        ?      202.7        4.4       ?       ? 
1 1 1   46   28   18 o    159.3    4.4    0.0000   0.0000          ?        ?   254.7701  14.0475          ?        ?      159.3        4.4       ?       ? 
1 1 1   46   28   19 o     64.8    9.4    0.0000   0.0000          ?        ?    42.7809  12.1319          ?        ?       64.8        9.4       ?       ? 
1 1 1   46   29    0 o    172.3   13.9  307.7674  47.2506   307.7674  47.2506   307.7674  47.2506      172.3     13.9      172.3       13.9     0.0     0.0 
1 1 1   46   29    1 o     97.1   19.1    0.0000   0.0000          ?        ?   103.4405  35.7572          ?        ?       97.1       19.1       ?       ? 
1 1 1   46   29    2 o    288.0   14.7    0.0000   0.0000          ?        ?   862.6428  84.9234          ?        ?      288.0       14.7       ?       ? 
1 1 1   46   29    3 o    130.7   29.7    0.0000   0.0000          ?        ?   204.3269  75.9841          ?        ?      130.7       29.7       ?       ? 
1 1 1   46   29    4 o    274.6   16.4    0.0000   0.0000          ?        ?   791.7668  90.0316          ?        ?      274.6       16.4       ?       ? 
1 1 1   46   29    5 o     62.9   28.7    0.0000   0.0000          ?        ?   -24.9023  80.4537          ?        ?       62.9       28.7       ?       ? 
1 1 1   46   29    6 o     44.1   21.0    0.0000   0.0000          ?        ?   -52.9973  50.4432          ?        ?       44.1       21.0       ?       ? 
1 1 1   46   29    7 o     83.4   12.3    0.0000   0.0000          ?        ?    71.5144  20.4327          ?        ?       83.4       12.3       ?       ? 
1 1 1   46   29    8 o    261.5    5.5    0.0000   0.0000          ?        ?   687.6877  28.7335          ?        ?      261.5        5.5       ?       ? 
1 1 1   46   29    9 o    104.3   12.9    0.0000   0.0000          ?        ?   112.3798  26.8179          ?        ?      104.3       12.9       ?       ? 
1 1 1   46   29   10 o    184.4    5.5    0.0000   0.0000          ?        ?   342.2476  20.4327          ?        ?      184.4        5.5       ?       ? 
1 1 1   46   29   11 o     75.2   14.5    0.0000   0.0000          ?        ?    60.6596  21.0712          ?        ?       75.2       14.5       ?       ? 
1 1 1   46   29   12 o    195.2    5.9    0.0000   0.0000          ?        ?   383.7515  22.9868          ?        ?      195.2        5.9       ?       ? 
1 1 1   46   29   13 f     91.7   12.5    0.0000   0.0000          ?        ?    86.8389  22.9868          ?        ?       91.7       12.5       ?       ? 
1 1 1   46   29   14 o     34.4   15.3    0.0000   0.0000          ?        ?    -5.7467  21.0712          ?        ?       34.4       15.3       ?       ? 
1 1 1   46   30    0 o    214.2   20.8  491.6617  87.4775   491.6617  87.4775   491.6617  87.4775      214.2     20.8      214.2       20.8     0.0     0.0 
1 1 1   46   30    1 o     91.6   31.3    0.0000   0.0000          ?        ?   101.5249  68.9603          ?        ?       91.6       31.3       ?       ? 
1 1 1   46   30    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   46   30    3 o     57.2   26.0    0.0000   0.0000          ?        ?   -19.1556  65.1292          ?        ?       57.2       26.0       ?       ? 
1 1 1   46   30    4 o    132.8   13.0    0.0000   0.0000          ?        ?   182.6172  34.4802          ?        ?      132.8       13.0       ?       ? 
1 1 1   46   30    5 o    129.4   20.2    0.0000   0.0000          ?        ?   181.9787  52.3588          ?        ?      129.4       20.2       ?       ? 
1 1 1   46   30    6 o    199.0   10.6    0.0000   0.0000          ?        ?   405.4612  42.1424          ?        ?      199.0       10.6       ?       ? 
1 1 1   47    0    0 o    332.9    4.9 1109.1121  32.5646  1109.1121  32.5646  1109.1121  32.5646      332.9      4.9      332.9        4.9     0.0     0.0 
1 1 1   47    0    1 o    341.5    3.6 1166.5790  24.2638  1166.5790  24.2638  1166.5790  24.2638      341.5      3.6      341.5        3.6     0.0     0.0 
1 1 1   47    0    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47    0    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47    0    4 o    184.6    4.7  341.6091  17.2401   341.6091  17.2401   341.6091  17.2401      184.6      4.7      184.6        4.7     0.0     0.0 
1 1 1   47    0    5 o     16.3   11.6  -18.5171  15.3245   -18.5171  15.3245   -18.5171  15.3245       16.3     11.6       16.3       11.6     0.0     0.0 
1 1 1   47    0    6 o    143.7    6.9  208.1580  19.7942   208.1580  19.7942   208.1580  19.7942      143.7      6.9      143.7        6.9     0.0     0.0 
1 1 1   47    0    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47    0    8 o    391.5    3.7 1533.0905  28.7335  1533.0905  28.7335  1533.0905  28.7335      391.5      3.7      391.5        3.7     0.0     0.0 
1 1 1   47    0    9 o    270.8    3.8  733.6614  20.4327   733.6614  20.4327   733.6614  20.4327      270.8      3.8      270.8        3.8     0.0     0.0 
1 1 1   47    0   10 o     11.9    8.9  -54.9129  16.6016   -54.9129  16.6016   -54.9129  16.6016       11.9      8.9       11.9        8.9     0.0     0.0 
1 1 1   47    0   11 o     61.5   15.0   44.0580  15.9630    44.0580  15.9630    44.0580  15.9630       61.5     15.0       61.5       15.0     0.0     0.0 
1 1 1   47    0   12 f    461.1    3.7 2126.9155  34.4802  2126.9155  34.4802  2126.9155  34.4802      461.1      3.7      461.1        3.7     0.0     0.0 
1 1 1   47    0   13 o    485.7    3.7 2359.9761  36.3957  2359.9761  36.3957  2359.9761  36.3957      485.7      3.7      485.7        3.7     0.0     0.0 
1 1 1   47    0   14 o    289.9    4.1  840.9330  23.6253   840.9330  23.6253   840.9330  23.6253      289.9      4.1      289.9        4.1     0.0     0.0 
1 1 1   47    0   15 o    476.0    3.5 2266.1133  33.2031  2266.1133  33.2031  2266.1133  33.2031      476.0      3.5      476.0        3.5     0.0     0.0 
1 1 1   47    0   16 o    409.6    3.4 1678.0348  28.0950  1678.0348  28.0950  1678.0348  28.0950      409.6      3.4      409.6        3.4     0.0     0.0 
1 1 1   47    0   17 o    707.1    4.2 5002.1787  59.3825  5002.1787  59.3825  5002.1787  59.3825      707.1      4.2      707.1        4.2     0.0     0.0 
1 1 1   47    0   18 o    267.9    4.1  718.3369  21.7097   718.3369  21.7097   718.3369  21.7097      267.9      4.1      267.9        4.1     0.0     0.0 
1 1 1   47    0   19 o    622.8    3.9 3879.6572  49.1662  3879.6572  49.1662  3879.6572  49.1662      622.8      3.9      622.8        3.9     0.0     0.0 
1 1 1   47    0   20 o    326.2    3.5 1064.4155  22.9868  1064.4155  22.9868  1064.4155  22.9868      326.2      3.5      326.2        3.5     0.0     0.0 
1 1 1   47    0   21 o     14.4   10.7  -67.0448  22.3483   -67.0448  22.3483   -67.0448  22.3483       14.4     10.7       14.4       10.7     0.0     0.0 
1 1 1   47    0   22 o    493.3    3.9 2434.0444  38.3113  2434.0444  38.3113  2434.0444  38.3113      493.3      3.9      493.3        3.9     0.0     0.0 
1 1 1   47    0   23 o    144.2    6.9  209.4351  19.7942   209.4351  19.7942   209.4351  19.7942      144.2      6.9      144.2        6.9     0.0     0.0 
1 1 1   47    0   24 o    195.5    4.9  383.1130  19.1556   383.1130  19.1556   383.1130  19.1556      195.5      4.9      195.5        4.9     0.0     0.0 
1 1 1   47    0   25 o    208.3    4.9  434.8332  20.4327   434.8332  20.4327   434.8332  20.4327      208.3      4.9      208.3        4.9     0.0     0.0 
1 1 1   47    0   26 o     16.7   12.1  -31.2876  19.1556   -31.2876  19.1556   -31.2876  19.1556       16.7     12.1       16.7       12.1     0.0     0.0 
1 1 1   47    0   27 o    451.5    4.0 2039.4380  35.7572  2039.4380  35.7572  2039.4380  35.7572      451.5      4.0      451.5        4.0     0.0     0.0 
1 1 1   47    0   28 o    253.6    4.0  643.6298  20.4327   643.6298  20.4327   643.6298  20.4327      253.6      4.0      253.6        4.0     0.0     0.0 
1 1 1   47    0   29 f    181.4    5.3  330.1157  19.1556   330.1157  19.1556   330.1157  19.1556      181.4      5.3      181.4        5.3     0.0     0.0 
1 1 1   47    0   30 o    478.5    3.5 2291.0156  33.8416  2291.0156  33.8416  2291.0156  33.8416      478.5      3.5      478.5        3.5     0.0     0.0 
1 1 1   47    0   31 o    221.5    4.8  491.6617  21.0712   491.6617  21.0712   491.6617  21.0712      221.5      4.8      221.5        4.8     0.0     0.0 
1 1 1   47    0   32 o    225.9    5.0  511.4558  22.3483   511.4558  22.3483   511.4558  22.3483      225.9      5.0      225.9        5.0     0.0     0.0 
1 1 1   47    0   33 o    341.5    4.0 1167.2175  27.4564  1167.2175  27.4564  1167.2175  27.4564      341.5      4.0      341.5        4.0     0.0     0.0 
1 1 1   47    0   34 o    138.3    7.9  193.4720  21.7097   193.4720  21.7097   193.4720  21.7097      138.3      7.9      138.3        7.9     0.0     0.0 
1 1 1   47    0   35 o    103.0   10.7  109.8257  21.7097   109.8257  21.7097   109.8257  21.7097      103.0     10.7      103.0       10.7     0.0     0.0 
1 1 1   47    0   36 o    336.3    4.2 1132.0989  28.0950  1132.0989  28.0950  1132.0989  28.0950      336.3      4.2      336.3        4.2     0.0     0.0 
1 1 1   47    0   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47    0   38 o    315.7    3.9  997.3708  24.9023   997.3708  24.9023   997.3708  24.9023      315.7      3.9      315.7        3.9     0.0     0.0 
1 1 1   47    0   39 o    168.5    7.2  286.0577  24.2638   286.0577  24.2638   286.0577  24.2638      168.5      7.2      168.5        7.2     0.0     0.0 
1 1 1   47    0   40 o    110.6   11.2  126.4273  24.2638   126.4273  24.2638   126.4273  24.2638      110.6     11.2      110.6       11.2     0.0     0.0 
1 1 1   47    0   41 o    165.7    6.8  276.4799  22.3483   276.4799  22.3483   276.4799  22.3483      165.7      6.8      165.7        6.8     0.0     0.0 
1 1 1   47    0   42 o     30.8   18.8    8.9393  21.7097     8.9393  21.7097     8.9393  21.7097       30.8     18.8       30.8       18.8     0.0     0.0 
1 1 1   47    0   43 o     18.2   13.2  -37.6728  22.9868   -37.6728  22.9868   -37.6728  22.9868       18.2     13.2       18.2       13.2     0.0     0.0 
1 1 1   47    0   44 o     97.3   12.4   96.4168  24.2638    96.4168  24.2638    96.4168  24.2638       97.3     12.4       97.3       12.4     0.0     0.0 
1 1 1   47    0   45 o    172.3    6.9  298.8281  23.6253   298.8281  23.6253   298.8281  23.6253      172.3      6.9      172.3        6.9     0.0     0.0 
1 1 1   47    0   46 o    291.3    4.7  849.8723  27.4564   849.8723  27.4564   849.8723  27.4564      291.3      4.7      291.3        4.7     0.0     0.0 
1 1 1   47    0   47 o    188.5    7.0  357.5721  26.1794   357.5721  26.1794   357.5721  26.1794      188.5      7.0      188.5        7.0     0.0     0.0 
1 1 1   47    0   48 o     21.3   15.2  -31.2876  26.1794   -31.2876  26.1794   -31.2876  26.1794       21.3     15.2       21.3       15.2     0.0     0.0 
1 1 1   47    0   49 o    535.3    3.9 2868.2393  42.1424  2868.2393  42.1424  2868.2393  42.1424      535.3      3.9      535.3        3.9     0.0     0.0 
1 1 1   47    0   50 o    175.6    7.3  310.9600  25.5409   310.9600  25.5409   310.9600  25.5409      175.6      7.3      175.6        7.3     0.0     0.0 
1 1 1   47    0   51 o     67.7   21.5   58.7440  25.5409    58.7440  25.5409    58.7440  25.5409       67.7     21.5       67.7       21.5     0.0     0.0 
1 1 1   47    0   52 o     16.9   12.5  -60.0210  25.5409   -60.0210  25.5409   -60.0210  25.5409       16.9     12.5       16.9       12.5     0.0     0.0 
1 1 1   47    0   53 o     44.8   23.1   30.6490  26.1794    30.6490  26.1794    30.6490  26.1794       44.8     23.1       44.8       23.1     0.0     0.0 
1 1 1   47    0   54 o    219.4    6.6  483.9994  28.7335   483.9994  28.7335   483.9994  28.7335      219.4      6.6      219.4        6.6     0.0     0.0 
1 1 1   47    0   55 o     27.2   18.2   -7.0237  26.8179    -7.0237  26.8179    -7.0237  26.8179       27.2     18.2       27.2       18.2     0.0     0.0 
1 1 1   47    0   56 o     15.8   11.7  -63.2136  24.2638   -63.2136  24.2638   -63.2136  24.2638       15.8     11.7       15.8       11.7     0.0     0.0 
1 1 1   47    0   57 o     17.7   13.0  -49.1662  24.9023   -49.1662  24.9023   -49.1662  24.9023       17.7     13.0       17.7       13.0     0.0     0.0 
1 1 1   47    0   58 o     17.8   13.0  -45.3350  24.2638   -45.3350  24.2638   -45.3350  24.2638       17.8     13.0       17.8       13.0     0.0     0.0 
1 1 1   47    1    0 o    340.3    3.5 1158.9167  23.6253  1158.9167  23.6253  1158.9167  23.6253      340.3      3.5      340.3        3.5     0.0     0.0 
1 1 1   47    1    1 o    615.1    2.9    0.0000   0.0000          ?        ?  3783.8789  35.7572          ?        ?      615.1        2.9       ?       ? 
1 1 1   47    1    2 o    462.9    2.6    0.0000   0.0000          ?        ?  2142.8787  24.2638          ?        ?      462.9        2.6       ?       ? 
1 1 1   47    1    3 o    168.9    3.8    0.0000   0.0000          ?        ?   285.4192  12.7704          ?        ?      168.9        3.8       ?       ? 
1 1 1   47    1    4 o    175.8    3.6    0.0000   0.0000          ?        ?   309.0445  12.7704          ?        ?      175.8        3.6       ?       ? 
1 1 1   47    1    5 o     59.7    9.6    0.0000   0.0000          ?        ?    35.7572  11.4934          ?        ?       59.7        9.6       ?       ? 
1 1 1   47    1    6 o    448.4    2.5    0.0000   0.0000          ?        ?  2011.3431  22.3483          ?        ?      448.4        2.5       ?       ? 
1 1 1   47    1    7 o    446.6    2.7    0.0000   0.0000          ?        ?  1994.7416  24.2638          ?        ?      446.6        2.7       ?       ? 
1 1 1   47    1    8 o    775.7    3.3    0.0000   0.0000          ?        ?  6019.3433  51.0817          ?        ?      775.7        3.3       ?       ? 
1 1 1   47    1    9 o    655.8    2.9    0.0000   0.0000          ?        ?  4302.3584  38.3113          ?        ?      655.8        2.9       ?       ? 
1 1 1   47    1   10 o    539.7    2.6    0.0000   0.0000          ?        ?  2913.5742  28.0950          ?        ?      539.7        2.6       ?       ? 
1 1 1   47    1   11 o     87.8    6.5    0.0000   0.0000          ?        ?    77.2611  11.4934          ?        ?       87.8        6.5       ?       ? 
1 1 1   47    1   12 o    152.2    4.0    0.0000   0.0000          ?        ?   231.7833  12.1319          ?        ?      152.2        4.0       ?       ? 
1 1 1   47    1   13 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47    1   14 o    258.4    2.8    0.0000   0.0000          ?        ?   667.8936  14.6860          ?        ?      258.4        2.8       ?       ? 
1 1 1   47    1   15 o     80.6    7.5    0.0000   0.0000          ?        ?    65.1292  12.1319          ?        ?       80.6        7.5       ?       ? 
1 1 1   47    1   16 o    383.6    2.5    0.0000   0.0000          ?        ?  1471.7924  19.1556          ?        ?      383.6        2.5       ?       ? 
1 1 1   47    1   17 o    282.4    2.7    0.0000   0.0000          ?        ?   797.5135  15.3245          ?        ?      282.4        2.7       ?       ? 
1 1 1   47    1   18 o    268.9    2.7    0.0000   0.0000          ?        ?   723.4450  14.6860          ?        ?      268.9        2.7       ?       ? 
1 1 1   47    1   19 o    363.3    2.5    0.0000   0.0000          ?        ?  1320.4628  17.8786          ?        ?      363.3        2.5       ?       ? 
1 1 1   47    1   20 o    417.5    2.5    0.0000   0.0000          ?        ?  1743.8026  21.0712          ?        ?      417.5        2.5       ?       ? 
1 1 1   47    1   21 o    289.1    2.7    0.0000   0.0000          ?        ?   835.8248  15.3245          ?        ?      289.1        2.7       ?       ? 
1 1 1   47    1   22 o    197.6    3.4    0.0000   0.0000          ?        ?   390.7752  13.4090          ?        ?      197.6        3.4       ?       ? 
1 1 1   47    1   23 o    521.7    2.6    0.0000   0.0000          ?        ?  2722.6562  27.4564          ?        ?      521.7        2.6       ?       ? 
1 1 1   47    1   24 f    222.7    3.0    0.0000   0.0000          ?        ?   496.1313  13.4090          ?        ?      222.7        3.0       ?       ? 
1 1 1   47    1   25 o    293.4    2.7    0.0000   0.0000          ?        ?   861.3657  15.9630          ?        ?      293.4        2.7       ?       ? 
1 1 1   47    1   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47    1   27 f    158.4    4.2    0.0000   0.0000          ?        ?   250.9390  13.4090          ?        ?      158.4        4.2       ?       ? 
1 1 1   47    1   28 o     54.6   13.0    0.0000   0.0000          ?        ?    31.2876  14.0475          ?        ?       54.6       13.0       ?       ? 
1 1 1   47    1   29 o     60.7   12.0    0.0000   0.0000          ?        ?    38.3113  14.0475          ?        ?       60.7       12.0       ?       ? 
1 1 1   47    1   30 o    148.8    4.9    0.0000   0.0000          ?        ?   221.5670  14.6860          ?        ?      148.8        4.9       ?       ? 
1 1 1   47    1   31 o    159.5    4.6    0.0000   0.0000          ?        ?   254.7701  14.6860          ?        ?      159.5        4.6       ?       ? 
1 1 1   47    1   32 o    103.8    6.8    0.0000   0.0000          ?        ?   107.9102  14.0475          ?        ?      103.8        6.8       ?       ? 
1 1 1   47    1   33 o    355.2    2.6    0.0000   0.0000          ?        ?  1262.3572  18.5171          ?        ?      355.2        2.6       ?       ? 
1 1 1   47    1   34 o     27.4   12.4    0.0000   0.0000          ?        ?    -8.3008  14.6860          ?        ?       27.4       12.4       ?       ? 
1 1 1   47    1   35 o    177.9    4.3    0.0000   0.0000          ?        ?   316.7067  15.3245          ?        ?      177.9        4.3       ?       ? 
1 1 1   47    1   36 o    140.1    5.5    0.0000   0.0000          ?        ?   196.6647  15.3245          ?        ?      140.1        5.5       ?       ? 
1 1 1   47    1   37 o    224.7    3.4    0.0000   0.0000          ?        ?   505.0706  15.3245          ?        ?      224.7        3.4       ?       ? 
1 1 1   47    1   38 o     93.6    8.9    0.0000   0.0000          ?        ?    88.1160  16.6016          ?        ?       93.6        8.9       ?       ? 
1 1 1   47    1   39 o     42.0   15.0    0.0000   0.0000          ?        ?    15.3245  15.9630          ?        ?       42.0       15.0       ?       ? 
1 1 1   47    1   40 o    246.7    3.6    0.0000   0.0000          ?        ?   609.1497  17.8786          ?        ?      246.7        3.6       ?       ? 
1 1 1   47    1   41 o    268.0    3.3    0.0000   0.0000          ?        ?   718.9753  17.8786          ?        ?      268.0        3.3       ?       ? 
1 1 1   47    1   42 o    314.9    3.0    0.0000   0.0000          ?        ?   992.2626  19.1556          ?        ?      314.9        3.0       ?       ? 
1 1 1   47    1   43 o    344.2    2.9    0.0000   0.0000          ?        ?  1185.7346  19.7942          ?        ?      344.2        2.9       ?       ? 
1 1 1   47    1   44 o    217.2    4.0    0.0000   0.0000          ?        ?   472.5060  17.2401          ?        ?      217.2        4.0       ?       ? 
1 1 1   47    1   45 o     22.3   11.0    0.0000   0.0000          ?        ?   -36.3957  17.2401          ?        ?       22.3       11.0       ?       ? 
1 1 1   47    1   46 o    186.2    5.0    0.0000   0.0000          ?        ?   347.3558  18.5171          ?        ?      186.2        5.0       ?       ? 
1 1 1   47    1   47 o    281.9    3.5    0.0000   0.0000          ?        ?   795.5980  19.7942          ?        ?      281.9        3.5       ?       ? 
1 1 1   47    1   48 o    188.4    4.7    0.0000   0.0000          ?        ?   355.6566  17.8786          ?        ?      188.4        4.7       ?       ? 
1 1 1   47    1   49 o    224.1    4.3    0.0000   0.0000          ?        ?   503.1551  19.1556          ?        ?      224.1        4.3       ?       ? 
1 1 1   47    1   50 o    232.6    4.0    0.0000   0.0000          ?        ?   542.1049  18.5171          ?        ?      232.6        4.0       ?       ? 
1 1 1   47    1   51 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47    1   52 o    233.6    4.0    0.0000   0.0000          ?        ?   546.5745  18.5171          ?        ?      233.6        4.0       ?       ? 
1 1 1   47    1   53 o    107.2    8.6    0.0000   0.0000          ?        ?   116.2109  18.5171          ?        ?      107.2        8.6       ?       ? 
1 1 1   47    1   54 o    170.4    5.6    0.0000   0.0000          ?        ?   291.8044  19.1556          ?        ?      170.4        5.6       ?       ? 
1 1 1   47    1   55 o    172.3    5.4    0.0000   0.0000          ?        ?   298.1896  18.5171          ?        ?      172.3        5.4       ?       ? 
1 1 1   47    1   56 o    210.1    4.7    0.0000   0.0000          ?        ?   443.1340  19.7942          ?        ?      210.1        4.7       ?       ? 
1 1 1   47    1   57 o    157.1    5.9    0.0000   0.0000          ?        ?   248.3849  18.5171          ?        ?      157.1        5.9       ?       ? 
1 1 1   47    2    0 o     84.6   10.0   74.7070  16.6016    74.7070  16.6016    74.7070  16.6016       84.6     10.0       84.6       10.0     0.0     0.0 
1 1 1   47    2    1 o    274.8    2.7    0.0000   0.0000          ?        ?   755.3711  14.6860          ?        ?      274.8        2.7       ?       ? 
1 1 1   47    2    2 o    542.4    2.7    0.0000   0.0000          ?        ?  2942.9460  29.3720          ?        ?      542.4        2.7       ?       ? 
1 1 1   47    2    3 o    180.4    3.4    0.0000   0.0000          ?        ?   325.6460  12.1319          ?        ?      180.4        3.4       ?       ? 
1 1 1   47    2    4 o    455.5    2.5    0.0000   0.0000          ?        ?  2075.1953  22.9868          ?        ?      455.5        2.5       ?       ? 
1 1 1   47    2    5 o    312.6    2.5    0.0000   0.0000          ?        ?   977.5767  15.3245          ?        ?      312.6        2.5       ?       ? 
1 1 1   47    2    6 o    279.5    2.5    0.0000   0.0000          ?        ?   781.5505  14.0475          ?        ?      279.5        2.5       ?       ? 
1 1 1   47    2    7 o    601.0    2.9    0.0000   0.0000          ?        ?  3613.3940  35.1187          ?        ?      601.0        2.9       ?       ? 
1 1 1   47    2    8 o     25.8   11.5    0.0000   0.0000          ?        ?    -5.1082  12.1319          ?        ?       25.8       11.5       ?       ? 
1 1 1   47    2    9 o    335.4    2.8    0.0000   0.0000          ?        ?  1125.0751  18.5171          ?        ?      335.4        2.8       ?       ? 
1 1 1   47    2   10 o    231.1    3.0    0.0000   0.0000          ?        ?   534.4426  14.0475          ?        ?      231.1        3.0       ?       ? 
1 1 1   47    2   11 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47    2   12 o    178.3    3.4    0.0000   0.0000          ?        ?   317.9838  12.1319          ?        ?      178.3        3.4       ?       ? 
1 1 1   47    2   13 o    310.5    2.6    0.0000   0.0000          ?        ?   964.1677  15.9630          ?        ?      310.5        2.6       ?       ? 
1 1 1   47    2   14 o    440.8    2.6    0.0000   0.0000          ?        ?  1943.6598  22.9868          ?        ?      440.8        2.6       ?       ? 
1 1 1   47    2   15 o    233.3    3.0    0.0000   0.0000          ?        ?   544.6590  14.0475          ?        ?      233.3        3.0       ?       ? 
1 1 1   47    2   16 o    454.7    2.6    0.0000   0.0000          ?        ?  2067.5330  23.6253          ?        ?      454.7        2.6       ?       ? 
1 1 1   47    2   17 o    475.9    2.7    0.0000   0.0000          ?        ?  2265.4746  25.5409          ?        ?      475.9        2.7       ?       ? 
1 1 1   47    2   18 o    491.0    2.7    0.0000   0.0000          ?        ?  2411.0576  26.1794          ?        ?      491.0        2.7       ?       ? 
1 1 1   47    2   19 o    249.6    2.8    0.0000   0.0000          ?        ?   623.1971  14.0475          ?        ?      249.6        2.8       ?       ? 
1 1 1   47    2   20 o    218.4    3.2    0.0000   0.0000          ?        ?   476.9756  14.0475          ?        ?      218.4        3.2       ?       ? 
1 1 1   47    2   21 o    237.9    3.0    0.0000   0.0000          ?        ?   566.3687  14.0475          ?        ?      237.9        3.0       ?       ? 
1 1 1   47    2   22 o    227.1    3.4    0.0000   0.0000          ?        ?   515.9255  15.3245          ?        ?      227.1        3.4       ?       ? 
1 1 1   47    2   23 o    107.7    5.9    0.0000   0.0000          ?        ?   116.2109  12.7704          ?        ?      107.7        5.9       ?       ? 
1 1 1   47    2   24 o    371.2    2.4    0.0000   0.0000          ?        ?  1377.9297  17.8786          ?        ?      371.2        2.4       ?       ? 
1 1 1   47    2   25 o    117.1    6.0    0.0000   0.0000          ?        ?   137.2822  14.0475          ?        ?      117.1        6.0       ?       ? 
1 1 1   47    2   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47    2   27 o    216.3    3.4    0.0000   0.0000          ?        ?   468.0364  14.6860          ?        ?      216.3        3.4       ?       ? 
1 1 1   47    2   28 o    197.1    3.6    0.0000   0.0000          ?        ?   388.8597  14.0475          ?        ?      197.1        3.6       ?       ? 
1 1 1   47    2   29 o    121.1    6.1    0.0000   0.0000          ?        ?   146.8600  14.6860          ?        ?      121.1        6.1       ?       ? 
1 1 1   47    2   30 o    444.6    2.5    0.0000   0.0000          ?        ?  1977.5016  22.3483          ?        ?      444.6        2.5       ?       ? 
1 1 1   47    2   31 o    309.6    2.8    0.0000   0.0000          ?        ?   959.0594  17.2401          ?        ?      309.6        2.8       ?       ? 
1 1 1   47    2   32 o    504.2    2.5    0.0000   0.0000          ?        ?  2542.5933  25.5409          ?        ?      504.2        2.5       ?       ? 
1 1 1   47    2   33 o    145.9    5.3    0.0000   0.0000          ?        ?   213.2662  15.3245          ?        ?      145.9        5.3       ?       ? 
1 1 1   47    2   34 o    221.4    3.5    0.0000   0.0000          ?        ?   490.3846  15.3245          ?        ?      221.4        3.5       ?       ? 
1 1 1   47    2   35 o     96.7    7.9    0.0000   0.0000          ?        ?    93.8627  15.3245          ?        ?       96.7        7.9       ?       ? 
1 1 1   47    2   36 o    288.5    3.2    0.0000   0.0000          ?        ?   832.6321  18.5171          ?        ?      288.5        3.2       ?       ? 
1 1 1   47    2   37 o    260.9    3.3    0.0000   0.0000          ?        ?   681.3026  17.2401          ?        ?      260.9        3.3       ?       ? 
1 1 1   47    2   38 o    131.4    6.1    0.0000   0.0000          ?        ?   173.0394  15.9630          ?        ?      131.4        6.1       ?       ? 
1 1 1   47    2   39 o    140.1    5.9    0.0000   0.0000          ?        ?   196.6647  16.6016          ?        ?      140.1        5.9       ?       ? 
1 1 1   47    2   40 o    301.7    3.1    0.0000   0.0000          ?        ?   910.5319  18.5171          ?        ?      301.7        3.1       ?       ? 
1 1 1   47    2   41 o    199.0    4.2    0.0000   0.0000          ?        ?   396.5219  16.6016          ?        ?      199.0        4.2       ?       ? 
1 1 1   47    2   42 o    468.4    2.7    0.0000   0.0000          ?        ?  2195.2373  25.5409          ?        ?      468.4        2.7       ?       ? 
1 1 1   47    2   43 o     32.8   14.5    0.0000   0.0000          ?        ?    -5.1082  18.5171          ?        ?       32.8       14.5       ?       ? 
1 1 1   47    2   44 o    396.6    3.0    0.0000   0.0000          ?        ?  1573.9558  23.6253          ?        ?      396.6        3.0       ?       ? 
1 1 1   47    2   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47    2   46 o    290.5    3.5    0.0000   0.0000          ?        ?   844.7642  20.4327          ?        ?      290.5        3.5       ?       ? 
1 1 1   47    2   47 o    463.2    2.7    0.0000   0.0000          ?        ?  2147.3481  24.9023          ?        ?      463.2        2.7       ?       ? 
1 1 1   47    2   48 o    196.8    4.7    0.0000   0.0000          ?        ?   388.2211  18.5171          ?        ?      196.8        4.7       ?       ? 
1 1 1   47    2   49 o    136.0    6.8    0.0000   0.0000          ?        ?   185.8098  18.5171          ?        ?      136.0        6.8       ?       ? 
1 1 1   47    2   50 o    377.5    3.0    0.0000   0.0000          ?        ?  1426.4573  22.3483          ?        ?      377.5        3.0       ?       ? 
1 1 1   47    2   51 o    210.1    4.6    0.0000   0.0000          ?        ?   442.4955  19.1556          ?        ?      210.1        4.6       ?       ? 
1 1 1   47    2   52 o     88.7   10.1    0.0000   0.0000          ?        ?    79.8152  17.8786          ?        ?       88.7       10.1       ?       ? 
1 1 1   47    2   53 o    175.3    5.3    0.0000   0.0000          ?        ?   308.4059  18.5171          ?        ?      175.3        5.3       ?       ? 
1 1 1   47    2   54 o    137.2    6.5    0.0000   0.0000          ?        ?   189.6409  17.8786          ?        ?      137.2        6.5       ?       ? 
1 1 1   47    2   55 o     25.7   12.4    0.0000   0.0000          ?        ?   -28.7335  19.1556          ?        ?       25.7       12.4       ?       ? 
1 1 1   47    2   56 o     20.9   10.4    0.0000   0.0000          ?        ?   -51.0817  18.5171          ?        ?       20.9       10.4       ?       ? 
1 1 1   47    2   57 o    148.1    6.0    0.0000   0.0000          ?        ?   220.9285  17.8786          ?        ?      148.1        6.0       ?       ? 
1 1 1   47    3    0 o    326.2    3.8 1064.4155  24.9023  1064.4155  24.9023  1064.4155  24.9023      326.2      3.8      326.2        3.8     0.0     0.0 
1 1 1   47    3    1 o    738.6    3.3    0.0000   0.0000          ?        ?  5456.8057  48.5276          ?        ?      738.6        3.3       ?       ? 
1 1 1   47    3    2 o    153.0    4.2    0.0000   0.0000          ?        ?   234.3374  12.7704          ?        ?      153.0        4.2       ?       ? 
1 1 1   47    3    3 o    459.3    2.7    0.0000   0.0000          ?        ?  2109.6753  24.9023          ?        ?      459.3        2.7       ?       ? 
1 1 1   47    3    4 o    496.1    2.9    0.0000   0.0000          ?        ?  2462.1394  28.7335          ?        ?      496.1        2.9       ?       ? 
1 1 1   47    3    5 o    401.8    2.5    0.0000   0.0000          ?        ?  1614.8212  20.4327          ?        ?      401.8        2.5       ?       ? 
1 1 1   47    3    6 o    161.6    3.8    0.0000   0.0000          ?        ?   261.1554  12.1319          ?        ?      161.6        3.8       ?       ? 
1 1 1   47    3    7 o     54.3   11.0    0.0000   0.0000          ?        ?    30.6490  11.4934          ?        ?       54.3       11.0       ?       ? 
1 1 1   47    3    8 o    205.4    3.4    0.0000   0.0000          ?        ?   422.0628  14.0475          ?        ?      205.4        3.4       ?       ? 
1 1 1   47    3    9 o    387.0    2.4    0.0000   0.0000          ?        ?  1497.9718  18.5171          ?        ?      387.0        2.4       ?       ? 
1 1 1   47    3   10 o    540.1    2.6    0.0000   0.0000          ?        ?  2918.0439  28.0950          ?        ?      540.1        2.6       ?       ? 
1 1 1   47    3   11 o    343.0    2.5    0.0000   0.0000          ?        ?  1176.7954  17.2401          ?        ?      343.0        2.5       ?       ? 
1 1 1   47    3   12 o    479.8    2.6    0.0000   0.0000          ?        ?  2302.5090  24.9023          ?        ?      479.8        2.6       ?       ? 
1 1 1   47    3   13 o    753.1    3.3    0.0000   0.0000          ?        ?  5673.9028  49.1662          ?        ?      753.1        3.3       ?       ? 
1 1 1   47    3   14 o    300.3    2.8    0.0000   0.0000          ?        ?   902.2311  16.6016          ?        ?      300.3        2.8       ?       ? 
1 1 1   47    3   15 o    580.1    2.8    0.0000   0.0000          ?        ?  3366.2861  32.5646          ?        ?      580.1        2.8       ?       ? 
1 1 1   47    3   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47    3   17 o    205.6    3.4    0.0000   0.0000          ?        ?   422.7013  14.0475          ?        ?      205.6        3.4       ?       ? 
1 1 1   47    3   18 o    377.9    2.5    0.0000   0.0000          ?        ?  1428.3728  19.1556          ?        ?      377.9        2.5       ?       ? 
1 1 1   47    3   19 o    690.2    3.0    0.0000   0.0000          ?        ?  4765.9258  40.8654          ?        ?      690.2        3.0       ?       ? 
1 1 1   47    3   20 o     66.8    9.1    0.0000   0.0000          ?        ?    44.6965  12.1319          ?        ?       66.8        9.1       ?       ? 
1 1 1   47    3   21 o    300.9    2.7    0.0000   0.0000          ?        ?   905.4237  15.9630          ?        ?      300.9        2.7       ?       ? 
1 1 1   47    3   22 o    199.2    3.5    0.0000   0.0000          ?        ?   397.1605  14.0475          ?        ?      199.2        3.5       ?       ? 
1 1 1   47    3   23 o    305.3    2.7    0.0000   0.0000          ?        ?   932.2416  16.6016          ?        ?      305.3        2.7       ?       ? 
1 1 1   47    3   24 o     99.1    6.8    0.0000   0.0000          ?        ?    98.3323  13.4090          ?        ?       99.1        6.8       ?       ? 
1 1 1   47    3   25 o    707.4    2.9    0.0000   0.0000          ?        ?  5006.6479  40.8654          ?        ?      707.4        2.9       ?       ? 
1 1 1   47    3   26 o    177.5    4.0    0.0000   0.0000          ?        ?   315.4297  14.0475          ?        ?      177.5        4.0       ?       ? 
1 1 1   47    3   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47    3   28 o    132.4    5.1    0.0000   0.0000          ?        ?   175.5934  13.4090          ?        ?      132.4        5.1       ?       ? 
1 1 1   47    3   29 o    242.2    3.0    0.0000   0.0000          ?        ?   586.8014  14.6860          ?        ?      242.2        3.0       ?       ? 
1 1 1   47    3   30 o    215.5    3.7    0.0000   0.0000          ?        ?   464.8438  15.9630          ?        ?      215.5        3.7       ?       ? 
1 1 1   47    3   31 o    430.9    2.6    0.0000   0.0000          ?        ?  1857.4594  22.3483          ?        ?      430.9        2.6       ?       ? 
1 1 1   47    3   32 o    405.3    2.5    0.0000   0.0000          ?        ?  1642.9160  20.4327          ?        ?      405.3        2.5       ?       ? 
1 1 1   47    3   33 o    179.7    4.3    0.0000   0.0000          ?        ?   323.0919  15.3245          ?        ?      179.7        4.3       ?       ? 
1 1 1   47    3   34 o    410.4    2.6    0.0000   0.0000          ?        ?  1685.0586  21.0712          ?        ?      410.4        2.6       ?       ? 
1 1 1   47    3   35 o    266.6    3.1    0.0000   0.0000          ?        ?   711.3131  16.6016          ?        ?      266.6        3.1       ?       ? 
1 1 1   47    3   36 o    240.3    3.6    0.0000   0.0000          ?        ?   577.8621  17.2401          ?        ?      240.3        3.6       ?       ? 
1 1 1   47    3   37 o    169.0    4.7    0.0000   0.0000          ?        ?   286.0577  15.9630          ?        ?      169.0        4.7       ?       ? 
1 1 1   47    3   38 o    342.0    3.0    0.0000   0.0000          ?        ?  1170.4102  20.4327          ?        ?      342.0        3.0       ?       ? 
1 1 1   47    3   39 o    136.6    5.8    0.0000   0.0000          ?        ?   187.0868  15.9630          ?        ?      136.6        5.8       ?       ? 
1 1 1   47    3   40 o    457.5    2.7    0.0000   0.0000          ?        ?  2094.3508  24.2638          ?        ?      457.5        2.7       ?       ? 
1 1 1   47    3   41 o    435.5    2.6    0.0000   0.0000          ?        ?  1897.6864  22.9868          ?        ?      435.5        2.6       ?       ? 
1 1 1   47    3   42 o     94.2    9.5    0.0000   0.0000          ?        ?    89.3930  17.8786          ?        ?       94.2        9.5       ?       ? 
1 1 1   47    3   43 o    554.8    2.8    0.0000   0.0000          ?        ?  3080.2283  30.6490          ?        ?      554.8        2.8       ?       ? 
1 1 1   47    3   44 f    208.4    4.3    0.0000   0.0000          ?        ?   434.8332  17.8786          ?        ?      208.4        4.3       ?       ? 
1 1 1   47    3   45 o     32.7   14.3    0.0000   0.0000          ?        ?    -3.8311  17.8786          ?        ?       32.7       14.3       ?       ? 
1 1 1   47    3   46 o    483.1    2.8    0.0000   0.0000          ?        ?  2335.7119  26.8179          ?        ?      483.1        2.8       ?       ? 
1 1 1   47    3   47 o     86.4   10.0    0.0000   0.0000          ?        ?    75.3456  17.2401          ?        ?       86.4       10.0       ?       ? 
1 1 1   47    3   48 o    344.8    3.1    0.0000   0.0000          ?        ?  1190.2042  21.0712          ?        ?      344.8        3.1       ?       ? 
1 1 1   47    3   49 o     22.6   11.1    0.0000   0.0000          ?        ?   -34.4802  17.2401          ?        ?       22.6       11.1       ?       ? 
1 1 1   47    3   50 o    146.6    6.1    0.0000   0.0000          ?        ?   215.8203  17.8786          ?        ?      146.6        6.1       ?       ? 
1 1 1   47    3   51 o    265.9    3.7    0.0000   0.0000          ?        ?   708.1205  19.7942          ?        ?      265.9        3.7       ?       ? 
1 1 1   47    3   52 o    207.9    4.5    0.0000   0.0000          ?        ?   433.5562  18.5171          ?        ?      207.9        4.5       ?       ? 
1 1 1   47    3   53 o    210.6    4.5    0.0000   0.0000          ?        ?   445.0496  19.1556          ?        ?      210.6        4.5       ?       ? 
1 1 1   47    3   54 o     98.5    9.1    0.0000   0.0000          ?        ?    98.3323  17.8786          ?        ?       98.5        9.1       ?       ? 
1 1 1   47    3   55 o    127.0    7.0    0.0000   0.0000          ?        ?   162.8230  17.8786          ?        ?      127.0        7.0       ?       ? 
1 1 1   47    3   56 o    212.4    4.4    0.0000   0.0000          ?        ?   452.7119  18.5171          ?        ?      212.4        4.4       ?       ? 
1 1 1   47    4    0 o    155.0    6.0  241.3612  18.5171   241.3612  18.5171   241.3612  18.5171      155.0      6.0      155.0        6.0     0.0     0.0 
1 1 1   47    4    1 o    442.6    2.7    0.0000   0.0000          ?        ?  1958.9843  24.2638          ?        ?      442.6        2.7       ?       ? 
1 1 1   47    4    2 o    339.5    2.5    0.0000   0.0000          ?        ?  1153.1700  17.2401          ?        ?      339.5        2.5       ?       ? 
1 1 1   47    4    3 o    122.7    4.7    0.0000   0.0000          ?        ?   150.6911  11.4934          ?        ?      122.7        4.7       ?       ? 
1 1 1   47    4    4 o    367.5    2.6    0.0000   0.0000          ?        ?  1351.1118  19.1556          ?        ?      367.5        2.6       ?       ? 
1 1 1   47    4    5 o    119.3    4.5    0.0000   0.0000          ?        ?   142.3903  10.8549          ?        ?      119.3        4.5       ?       ? 
1 1 1   47    4    6 o    282.1    2.8    0.0000   0.0000          ?        ?   796.2365  15.9630          ?        ?      282.1        2.8       ?       ? 
1 1 1   47    4    7 o    102.3    5.6    0.0000   0.0000          ?        ?   104.7175  11.4934          ?        ?      102.3        5.6       ?       ? 
1 1 1   47    4    8 o    177.7    3.4    0.0000   0.0000          ?        ?   316.0682  12.1319          ?        ?      177.7        3.4       ?       ? 
1 1 1   47    4    9 o    435.9    2.5    0.0000   0.0000          ?        ?  1900.2404  21.7097          ?        ?      435.9        2.5       ?       ? 
1 1 1   47    4   10 o    314.3    2.6    0.0000   0.0000          ?        ?   987.7929  16.6016          ?        ?      314.3        2.6       ?       ? 
1 1 1   47    4   11 o     49.5   12.8    0.0000   0.0000          ?        ?    25.5409  12.7704          ?        ?       49.5       12.8       ?       ? 
1 1 1   47    4   12 o    296.6    2.9    0.0000   0.0000          ?        ?   879.8828  17.2401          ?        ?      296.6        2.9       ?       ? 
1 1 1   47    4   13 o    554.6    2.6    0.0000   0.0000          ?        ?  3077.0356  29.3720          ?        ?      554.6        2.6       ?       ? 
1 1 1   47    4   14 o    390.9    2.5    0.0000   0.0000          ?        ?  1527.9823  19.7942          ?        ?      390.9        2.5       ?       ? 
1 1 1   47    4   15 o    126.0    5.1    0.0000   0.0000          ?        ?   158.9919  12.7704          ?        ?      126.0        5.1       ?       ? 
1 1 1   47    4   16 o    701.2    3.5    0.0000   0.0000          ?        ?  4918.5322  49.1662          ?        ?      701.2        3.5       ?       ? 
1 1 1   47    4   17 o    219.7    3.6    0.0000   0.0000          ?        ?   482.7224  15.9630          ?        ?      219.7        3.6       ?       ? 
1 1 1   47    4   18 o    384.8    2.6    0.0000   0.0000          ?        ?  1481.3701  19.7942          ?        ?      384.8        2.6       ?       ? 
1 1 1   47    4   19 o    404.3    2.4    0.0000   0.0000          ?        ?  1635.2539  19.1556          ?        ?      404.3        2.4       ?       ? 
1 1 1   47    4   20 o     46.4   12.7    0.0000   0.0000          ?        ?    22.3483  12.1319          ?        ?       46.4       12.7       ?       ? 
1 1 1   47    4   21 o    257.2    3.0    0.0000   0.0000          ?        ?   661.5084  15.3245          ?        ?      257.2        3.0       ?       ? 
1 1 1   47    4   22 o    228.6    3.2    0.0000   0.0000          ?        ?   522.9492  14.6860          ?        ?      228.6        3.2       ?       ? 
1 1 1   47    4   23 o    254.9    2.9    0.0000   0.0000          ?        ?   650.0150  14.6860          ?        ?      254.9        2.9       ?       ? 
1 1 1   47    4   24 o    163.7    4.3    0.0000   0.0000          ?        ?   268.1791  14.0475          ?        ?      163.7        4.3       ?       ? 
1 1 1   47    4   25 o    286.6    2.8    0.0000   0.0000          ?        ?   821.7773  15.9630          ?        ?      286.6        2.8       ?       ? 
1 1 1   47    4   26 o    349.8    2.6    0.0000   0.0000          ?        ?  1224.0459  18.5171          ?        ?      349.8        2.6       ?       ? 
1 1 1   47    4   27 o    316.6    2.7    0.0000   0.0000          ?        ?  1002.4789  17.2401          ?        ?      316.6        2.7       ?       ? 
1 1 1   47    4   28 o    335.5    2.7    0.0000   0.0000          ?        ?  1125.7136  17.8786          ?        ?      335.5        2.7       ?       ? 
1 1 1   47    4   29 o    219.9    3.3    0.0000   0.0000          ?        ?   483.9994  14.6860          ?        ?      219.9        3.3       ?       ? 
1 1 1   47    4   30 o     73.0    9.6    0.0000   0.0000          ?        ?    53.6358  14.0475          ?        ?       73.0        9.6       ?       ? 
1 1 1   47    4   31 o    419.5    2.5    0.0000   0.0000          ?        ?  1760.4042  21.0712          ?        ?      419.5        2.5       ?       ? 
1 1 1   47    4   32 o    138.0    5.6    0.0000   0.0000          ?        ?   190.9180  15.3245          ?        ?      138.0        5.6       ?       ? 
1 1 1   47    4   33 o    263.5    3.2    0.0000   0.0000          ?        ?   694.7115  16.6016          ?        ?      263.5        3.2       ?       ? 
1 1 1   47    4   34 o    238.0    3.5    0.0000   0.0000          ?        ?   567.0072  16.6016          ?        ?      238.0        3.5       ?       ? 
1 1 1   47    4   35 o    207.4    3.8    0.0000   0.0000          ?        ?   430.3636  15.9630          ?        ?      207.4        3.8       ?       ? 
1 1 1   47    4   36 o    363.6    2.8    0.0000   0.0000          ?        ?  1323.0168  20.4327          ?        ?      363.6        2.8       ?       ? 
1 1 1   47    4   37 o    286.7    3.1    0.0000   0.0000          ?        ?   822.4159  17.8786          ?        ?      286.7        3.1       ?       ? 
1 1 1   47    4   38 o    161.9    4.9    0.0000   0.0000          ?        ?   262.4324  15.9630          ?        ?      161.9        4.9       ?       ? 
1 1 1   47    4   39 o    216.2    3.8    0.0000   0.0000          ?        ?   468.0364  16.6016          ?        ?      216.2        3.8       ?       ? 
1 1 1   47    4   40 o    342.4    3.0    0.0000   0.0000          ?        ?  1172.9642  20.4327          ?        ?      342.4        3.0       ?       ? 
1 1 1   47    4   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47    4   42 o    386.6    2.8    0.0000   0.0000          ?        ?  1495.4176  21.7097          ?        ?      386.6        2.8       ?       ? 
1 1 1   47    4   43 o    358.3    2.9    0.0000   0.0000          ?        ?  1284.7054  21.0712          ?        ?      358.3        2.9       ?       ? 
1 1 1   47    4   44 o    372.0    2.8    0.0000   0.0000          ?        ?  1384.9534  21.0712          ?        ?      372.0        2.8       ?       ? 
1 1 1   47    4   45 o    127.5    7.0    0.0000   0.0000          ?        ?   163.4615  17.8786          ?        ?      127.5        7.0       ?       ? 
1 1 1   47    4   46 o     20.1   10.1    0.0000   0.0000          ?        ?   -52.9973  17.8786          ?        ?       20.1       10.1       ?       ? 
1 1 1   47    4   47 o    210.4    4.4    0.0000   0.0000          ?        ?   443.7725  18.5171          ?        ?      210.4        4.4       ?       ? 
1 1 1   47    4   48 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47    4   49 o    123.1    7.3    0.0000   0.0000          ?        ?   152.6067  17.8786          ?        ?      123.1        7.3       ?       ? 
1 1 1   47    4   50 o     51.8   15.5    0.0000   0.0000          ?        ?    28.0950  17.2401          ?        ?       51.8       15.5       ?       ? 
1 1 1   47    4   51 o    181.9    4.9    0.0000   0.0000          ?        ?   332.0312  17.8786          ?        ?      181.9        4.9       ?       ? 
1 1 1   47    4   52 o    111.1    7.8    0.0000   0.0000          ?        ?   124.5117  17.2401          ?        ?      111.1        7.8       ?       ? 
1 1 1   47    4   53 o    316.9    3.1    0.0000   0.0000          ?        ?  1005.6716  19.7942          ?        ?      316.9        3.1       ?       ? 
1 1 1   47    4   54 o     29.7   13.5    0.0000   0.0000          ?        ?    -8.9393  17.2401          ?        ?       29.7       13.5       ?       ? 
1 1 1   47    4   55 o    147.2    6.3    0.0000   0.0000          ?        ?   218.3744  18.5171          ?        ?      147.2        6.3       ?       ? 
1 1 1   47    5    0 o    325.9    4.1 1063.1385  26.8179  1063.1385  26.8179  1063.1385  26.8179      325.9      4.1      325.9        4.1     0.0     0.0 
1 1 1   47    5    1 o    427.3    2.7    0.0000   0.0000          ?        ?  1826.1719  22.9868          ?        ?      427.3        2.7       ?       ? 
1 1 1   47    5    2 o     23.5   10.8    0.0000   0.0000          ?        ?    -8.3008  11.4934          ?        ?       23.5       10.8       ?       ? 
1 1 1   47    5    3 o    209.6    3.0    0.0000   0.0000          ?        ?   439.3029  12.7704          ?        ?      209.6        3.0       ?       ? 
1 1 1   47    5    4 o     42.6   12.6    0.0000   0.0000          ?        ?    18.5171  11.4934          ?        ?       42.6       12.6       ?       ? 
1 1 1   47    5    5 o    249.5    2.9    0.0000   0.0000          ?        ?   622.5586  14.6860          ?        ?      249.5        2.9       ?       ? 
1 1 1   47    5    6 o     27.5   11.9    0.0000   0.0000          ?        ?    -1.9156  12.1319          ?        ?       27.5       11.9       ?       ? 
1 1 1   47    5    7 o    258.2    2.8    0.0000   0.0000          ?        ?   666.6166  14.6860          ?        ?      258.2        2.8       ?       ? 
1 1 1   47    5    8 o    110.1    5.5    0.0000   0.0000          ?        ?   121.3191  12.1319          ?        ?      110.1        5.5       ?       ? 
1 1 1   47    5    9 o     84.1    6.8    0.0000   0.0000          ?        ?    70.8759  11.4934          ?        ?       84.1        6.8       ?       ? 
1 1 1   47    5   10 o     72.7    7.9    0.0000   0.0000          ?        ?    52.9973  11.4934          ?        ?       72.7        7.9       ?       ? 
1 1 1   47    5   11 o    525.6    2.7    0.0000   0.0000          ?        ?  2763.5215  28.7335          ?        ?      525.6        2.7       ?       ? 
1 1 1   47    5   12 o    550.8    2.7    0.0000   0.0000          ?        ?  3034.8933  30.0105          ?        ?      550.8        2.7       ?       ? 
1 1 1   47    5   13 f    229.2    3.1    0.0000   0.0000          ?        ?   525.5033  14.0475          ?        ?      229.2        3.1       ?       ? 
1 1 1   47    5   14 o    251.3    2.9    0.0000   0.0000          ?        ?   631.4979  14.6860          ?        ?      251.3        2.9       ?       ? 
1 1 1   47    5   15 o    442.9    2.5    0.0000   0.0000          ?        ?  1962.1769  22.3483          ?        ?      442.9        2.5       ?       ? 
1 1 1   47    5   16 o    136.3    4.7    0.0000   0.0000          ?        ?   185.8098  12.7704          ?        ?      136.3        4.7       ?       ? 
1 1 1   47    5   17 o    117.1    5.5    0.0000   0.0000          ?        ?   137.2822  12.7704          ?        ?      117.1        5.5       ?       ? 
1 1 1   47    5   18 f    116.6    5.5    0.0000   0.0000          ?        ?   136.0051  12.7704          ?        ?      116.6        5.5       ?       ? 
1 1 1   47    5   19 o    250.5    3.2    0.0000   0.0000          ?        ?   627.6667  15.9630          ?        ?      250.5        3.2       ?       ? 
1 1 1   47    5   20 o    357.0    2.5    0.0000   0.0000          ?        ?  1275.1277  17.8786          ?        ?      357.0        2.5       ?       ? 
1 1 1   47    5   21 o    232.9    3.2    0.0000   0.0000          ?        ?   542.7434  14.6860          ?        ?      232.9        3.2       ?       ? 
1 1 1   47    5   22 o    256.8    2.9    0.0000   0.0000          ?        ?   659.5928  14.6860          ?        ?      256.8        2.9       ?       ? 
1 1 1   47    5   23 o    234.3    3.0    0.0000   0.0000          ?        ?   549.1286  14.0475          ?        ?      234.3        3.0       ?       ? 
1 1 1   47    5   24 o    430.2    2.5    0.0000   0.0000          ?        ?  1851.7128  21.7097          ?        ?      430.2        2.5       ?       ? 
1 1 1   47    5   25 o    271.2    2.8    0.0000   0.0000          ?        ?   735.5769  15.3245          ?        ?      271.2        2.8       ?       ? 
1 1 1   47    5   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47    5   27 o    155.3    4.7    0.0000   0.0000          ?        ?   241.3612  14.6860          ?        ?      155.3        4.7       ?       ? 
1 1 1   47    5   28 o    243.6    3.1    0.0000   0.0000          ?        ?   593.8251  15.3245          ?        ?      243.6        3.1       ?       ? 
1 1 1   47    5   29 o    322.8    2.8    0.0000   0.0000          ?        ?  1042.7058  17.8786          ?        ?      322.8        2.8       ?       ? 
1 1 1   47    5   30 o     63.0   12.6    0.0000   0.0000          ?        ?    41.5039  15.3245          ?        ?       63.0       12.6       ?       ? 
1 1 1   47    5   31 o     19.6    9.8    0.0000   0.0000          ?        ?   -39.5883  15.3245          ?        ?       19.6        9.8       ?       ? 
1 1 1   47    5   32 o     82.8    8.9    0.0000   0.0000          ?        ?    68.9603  14.6860          ?        ?       82.8        8.9       ?       ? 
1 1 1   47    5   33 o    107.1    6.6    0.0000   0.0000          ?        ?   114.9339  14.0475          ?        ?      107.1        6.6       ?       ? 
1 1 1   47    5   34 o     86.9    9.2    0.0000   0.0000          ?        ?    75.9841  15.9630          ?        ?       86.9        9.2       ?       ? 
1 1 1   47    5   35 o    373.2    2.8    0.0000   0.0000          ?        ?  1393.2542  21.0712          ?        ?      373.2        2.8       ?       ? 
1 1 1   47    5   36 o    266.5    3.2    0.0000   0.0000          ?        ?   710.6746  17.2401          ?        ?      266.5        3.2       ?       ? 
1 1 1   47    5   37 o    205.0    4.2    0.0000   0.0000          ?        ?   420.7858  17.2401          ?        ?      205.0        4.2       ?       ? 
1 1 1   47    5   38 o    112.0    6.8    0.0000   0.0000          ?        ?   125.7888  15.3245          ?        ?      112.0        6.8       ?       ? 
1 1 1   47    5   39 o    383.4    2.8    0.0000   0.0000          ?        ?  1471.1538  21.7097          ?        ?      383.4        2.8       ?       ? 
1 1 1   47    5   40 o    307.7    3.1    0.0000   0.0000          ?        ?   947.5660  19.1556          ?        ?      307.7        3.1       ?       ? 
1 1 1   47    5   41 o    399.2    2.8    0.0000   0.0000          ?        ?  1594.3884  22.3483          ?        ?      399.2        2.8       ?       ? 
1 1 1   47    5   42 o    181.2    4.8    0.0000   0.0000          ?        ?   328.8386  17.2401          ?        ?      181.2        4.8       ?       ? 
1 1 1   47    5   43 o    393.6    2.8    0.0000   0.0000          ?        ?  1550.3306  22.3483          ?        ?      393.6        2.8       ?       ? 
1 1 1   47    5   44 o    187.9    4.9    0.0000   0.0000          ?        ?   353.7410  18.5171          ?        ?      187.9        4.9       ?       ? 
1 1 1   47    5   45 o    134.3    6.9    0.0000   0.0000          ?        ?   181.3401  18.5171          ?        ?      134.3        6.9       ?       ? 
1 1 1   47    5   46 o    204.9    4.7    0.0000   0.0000          ?        ?   420.7858  19.1556          ?        ?      204.9        4.7       ?       ? 
1 1 1   47    5   47 o    410.6    3.0    0.0000   0.0000          ?        ?  1687.6125  24.2638          ?        ?      410.6        3.0       ?       ? 
1 1 1   47    5   48 o    121.0    7.4    0.0000   0.0000          ?        ?   147.4985  17.8786          ?        ?      121.0        7.4       ?       ? 
1 1 1   47    5   49 o     42.5   15.5    0.0000   0.0000          ?        ?    15.3245  17.2401          ?        ?       42.5       15.5       ?       ? 
1 1 1   47    5   50 o    107.9    8.3    0.0000   0.0000          ?        ?   117.4880  17.8786          ?        ?      107.9        8.3       ?       ? 
1 1 1   47    5   51 o     24.9   12.0    0.0000   0.0000          ?        ?   -26.8179  17.8786          ?        ?       24.9       12.0       ?       ? 
1 1 1   47    5   52 o    194.7    4.8    0.0000   0.0000          ?        ?   380.5589  18.5171          ?        ?      194.7        4.8       ?       ? 
1 1 1   47    5   53 o    105.6    8.8    0.0000   0.0000          ?        ?   113.0183  18.5171          ?        ?      105.6        8.8       ?       ? 
1 1 1   47    5   54 o     97.4    8.8    0.0000   0.0000          ?        ?    96.4168  17.2401          ?        ?       97.4        8.8       ?       ? 
1 1 1   47    5   55 o     23.2   11.4    0.0000   0.0000          ?        ?   -37.0343  18.5171          ?        ?       23.2       11.4       ?       ? 
1 1 1   47    6    0 o    790.0    4.7 6244.7417  74.0685  6244.7417  74.0685  6244.7417  74.0685      790.0      4.7      790.0        4.7     0.0     0.0 
1 1 1   47    6    1 o    287.7    2.8    0.0000   0.0000          ?        ?   828.1625  15.9630          ?        ?      287.7        2.8       ?       ? 
1 1 1   47    6    2 o    652.2    3.2    0.0000   0.0000          ?        ?  4255.7466  41.5039          ?        ?      652.2        3.2       ?       ? 
1 1 1   47    6    3 o    190.1    3.4    0.0000   0.0000          ?        ?   361.4032  12.7704          ?        ?      190.1        3.4       ?       ? 
1 1 1   47    6    4 o    426.3    2.8    0.0000   0.0000          ?        ?  1817.8711  23.6253          ?        ?      426.3        2.8       ?       ? 
1 1 1   47    6    5 o    369.0    2.6    0.0000   0.0000          ?        ?  1361.9667  19.1556          ?        ?      369.0        2.6       ?       ? 
1 1 1   47    6    6 o    405.4    2.5    0.0000   0.0000          ?        ?  1644.1932  20.4327          ?        ?      405.4        2.5       ?       ? 
1 1 1   47    6    7 o    329.4    2.7    0.0000   0.0000          ?        ?  1085.4868  17.8786          ?        ?      329.4        2.7       ?       ? 
1 1 1   47    6    8 o    326.7    2.7    0.0000   0.0000          ?        ?  1067.6082  17.8786          ?        ?      326.7        2.7       ?       ? 
1 1 1   47    6    9 o    255.5    2.9    0.0000   0.0000          ?        ?   653.2076  14.6860          ?        ?      255.5        2.9       ?       ? 
1 1 1   47    6   10 f    163.9    3.5    0.0000   0.0000          ?        ?   268.8176  11.4934          ?        ?      163.9        3.5       ?       ? 
1 1 1   47    6   11 o    270.5    2.7    0.0000   0.0000          ?        ?   731.7458  14.6860          ?        ?      270.5        2.7       ?       ? 
1 1 1   47    6   12 o     75.3    8.5    0.0000   0.0000          ?        ?    56.8284  12.7704          ?        ?       75.3        8.5       ?       ? 
1 1 1   47    6   13 o    197.3    3.4    0.0000   0.0000          ?        ?   389.4982  13.4090          ?        ?      197.3        3.4       ?       ? 
1 1 1   47    6   14 o    262.9    3.0    0.0000   0.0000          ?        ?   691.5189  15.9630          ?        ?      262.9        3.0       ?       ? 
1 1 1   47    6   15 o    168.7    4.0    0.0000   0.0000          ?        ?   284.7806  13.4090          ?        ?      168.7        4.0       ?       ? 
1 1 1   47    6   16 o    452.0    2.8    0.0000   0.0000          ?        ?  2043.9077  24.9023          ?        ?      452.0        2.8       ?       ? 
1 1 1   47    6   17 o    361.7    2.6    0.0000   0.0000          ?        ?  1308.3308  18.5171          ?        ?      361.7        2.6       ?       ? 
1 1 1   47    6   18 o    242.1    3.0    0.0000   0.0000          ?        ?   586.1629  14.6860          ?        ?      242.1        3.0       ?       ? 
1 1 1   47    6   19 o    518.5    2.7    0.0000   0.0000          ?        ?  2689.4531  28.0950          ?        ?      518.5        2.7       ?       ? 
1 1 1   47    6   20 f    262.9    2.9    0.0000   0.0000          ?        ?   691.5189  15.3245          ?        ?      262.9        2.9       ?       ? 
1 1 1   47    6   21 o    206.3    3.2    0.0000   0.0000          ?        ?   425.8939  13.4090          ?        ?      206.3        3.2       ?       ? 
1 1 1   47    6   22 o    343.6    2.4    0.0000   0.0000          ?        ?  1181.2650  16.6016          ?        ?      343.6        2.4       ?       ? 
1 1 1   47    6   23 o    339.9    2.5    0.0000   0.0000          ?        ?  1155.7241  17.2401          ?        ?      339.9        2.5       ?       ? 
1 1 1   47    6   24 o    292.1    2.6    0.0000   0.0000          ?        ?   853.7034  15.3245          ?        ?      292.1        2.6       ?       ? 
1 1 1   47    6   25 o     81.3    8.2    0.0000   0.0000          ?        ?    66.4062  13.4090          ?        ?       81.3        8.2       ?       ? 
1 1 1   47    6   26 o    176.4    4.2    0.0000   0.0000          ?        ?   311.5985  14.6860          ?        ?      176.4        4.2       ?       ? 
1 1 1   47    6   27 o    268.2    2.9    0.0000   0.0000          ?        ?   719.6138  15.3245          ?        ?      268.2        2.9       ?       ? 
1 1 1   47    6   28 o    294.1    2.8    0.0000   0.0000          ?        ?   865.1968  16.6016          ?        ?      294.1        2.8       ?       ? 
1 1 1   47    6   29 o    383.3    2.5    0.0000   0.0000          ?        ?  1469.8767  19.1556          ?        ?      383.3        2.5       ?       ? 
1 1 1   47    6   30 o    367.8    2.7    0.0000   0.0000          ?        ?  1353.6659  19.7942          ?        ?      367.8        2.7       ?       ? 
1 1 1   47    6   31 o     34.9   13.7    0.0000   0.0000          ?        ?     7.0237  14.0475          ?        ?       34.9       13.7       ?       ? 
1 1 1   47    6   32 o     69.4   11.0    0.0000   0.0000          ?        ?    48.5276  15.3245          ?        ?       69.4       11.0       ?       ? 
1 1 1   47    6   33 o     96.7    7.9    0.0000   0.0000          ?        ?    93.8627  15.3245          ?        ?       96.7        7.9       ?       ? 
1 1 1   47    6   34 o    238.3    3.6    0.0000   0.0000          ?        ?   568.2842  17.2401          ?        ?      238.3        3.6       ?       ? 
1 1 1   47    6   35 o    189.0    4.1    0.0000   0.0000          ?        ?   357.5721  15.3245          ?        ?      189.0        4.1       ?       ? 
1 1 1   47    6   36 o     18.0    9.1    0.0000   0.0000          ?        ?   -54.2743  15.9630          ?        ?       18.0        9.1       ?       ? 
1 1 1   47    6   37 o    336.2    2.8    0.0000   0.0000          ?        ?  1130.8219  19.1556          ?        ?      336.2        2.8       ?       ? 
1 1 1   47    6   38 o     55.6   13.8    0.0000   0.0000          ?        ?    32.5646  15.3245          ?        ?       55.6       13.8       ?       ? 
1 1 1   47    6   39 o    163.8    4.9    0.0000   0.0000          ?        ?   268.8176  15.9630          ?        ?      163.8        4.9       ?       ? 
1 1 1   47    6   40 o    111.3    7.5    0.0000   0.0000          ?        ?   124.5117  16.6016          ?        ?      111.3        7.5       ?       ? 
1 1 1   47    6   41 o    170.8    4.9    0.0000   0.0000          ?        ?   292.4429  16.6016          ?        ?      170.8        4.9       ?       ? 
1 1 1   47    6   42 o    282.7    3.2    0.0000   0.0000          ?        ?   800.0676  17.8786          ?        ?      282.7        3.2       ?       ? 
1 1 1   47    6   43 o     32.9   14.2    0.0000   0.0000          ?        ?    -1.9156  17.2401          ?        ?       32.9       14.2       ?       ? 
1 1 1   47    6   44 o     20.0   10.0    0.0000   0.0000          ?        ?   -53.6358  17.8786          ?        ?       20.0       10.0       ?       ? 
1 1 1   47    6   45 o    398.7    2.9    0.0000   0.0000          ?        ?  1591.1959  22.9868          ?        ?      398.7        2.9       ?       ? 
1 1 1   47    6   46 o    116.8    7.4    0.0000   0.0000          ?        ?   137.2822  17.2401          ?        ?      116.8        7.4       ?       ? 
1 1 1   47    6   47 o    134.7    6.9    0.0000   0.0000          ?        ?   182.6172  18.5171          ?        ?      134.7        6.9       ?       ? 
1 1 1   47    6   48 o    138.3    6.5    0.0000   0.0000          ?        ?   192.1950  17.8786          ?        ?      138.3        6.5       ?       ? 
1 1 1   47    6   49 o     86.9   10.3    0.0000   0.0000          ?        ?    76.6226  17.8786          ?        ?       86.9       10.3       ?       ? 
1 1 1   47    6   50 o     49.9   15.9    0.0000   0.0000          ?        ?    25.5409  17.8786          ?        ?       49.9       15.9       ?       ? 
1 1 1   47    6   51 o     86.0   10.4    0.0000   0.0000          ?        ?    75.3456  17.8786          ?        ?       86.0       10.4       ?       ? 
1 1 1   47    6   52 o     36.1   14.8    0.0000   0.0000          ?        ?     5.1082  17.2401          ?        ?       36.1       14.8       ?       ? 
1 1 1   47    6   53 o    102.8    8.7    0.0000   0.0000          ?        ?   107.2716  17.8786          ?        ?      102.8        8.7       ?       ? 
1 1 1   47    6   54 o     19.5    9.8    0.0000   0.0000          ?        ?   -61.2981  18.5171          ?        ?       19.5        9.8       ?       ? 
1 1 1   47    7    0 o    722.1    5.0 5217.9990  72.1529  5217.9990  72.1529  5217.9990  72.1529      722.1      5.0      722.1        5.0     0.0     0.0 
1 1 1   47    7    1 o    290.4    2.6    0.0000   0.0000          ?        ?   843.4871  15.3245          ?        ?      290.4        2.6       ?       ? 
1 1 1   47    7    2 o    246.8    2.8    0.0000   0.0000          ?        ?   609.1497  14.0475          ?        ?      246.8        2.8       ?       ? 
1 1 1   47    7    3 o    435.5    2.6    0.0000   0.0000          ?        ?  1897.0479  22.9868          ?        ?      435.5        2.6       ?       ? 
1 1 1   47    7    4 o    723.1    3.3    0.0000   0.0000          ?        ?  5230.1304  47.2506          ?        ?      723.1        3.3       ?       ? 
1 1 1   47    7    5 o    286.1    2.8    0.0000   0.0000          ?        ?   818.5847  15.9630          ?        ?      286.1        2.8       ?       ? 
1 1 1   47    7    6 o    285.1    2.7    0.0000   0.0000          ?        ?   812.8381  15.3245          ?        ?      285.1        2.7       ?       ? 
1 1 1   47    7    7 f    218.8    3.2    0.0000   0.0000          ?        ?   478.8912  14.0475          ?        ?      218.8        3.2       ?       ? 
1 1 1   47    7    8 o    318.7    2.8    0.0000   0.0000          ?        ?  1015.8879  17.8786          ?        ?      318.7        2.8       ?       ? 
1 1 1   47    7    9 o    133.4    4.5    0.0000   0.0000          ?        ?   178.1475  12.1319          ?        ?      133.4        4.5       ?       ? 
1 1 1   47    7   10 o    297.4    2.7    0.0000   0.0000          ?        ?   884.9910  15.9630          ?        ?      297.4        2.7       ?       ? 
1 1 1   47    7   11 o    450.9    2.5    0.0000   0.0000          ?        ?  2033.6914  22.9868          ?        ?      450.9        2.5       ?       ? 
1 1 1   47    7   12 o    225.0    3.0    0.0000   0.0000          ?        ?   506.3477  13.4090          ?        ?      225.0        3.0       ?       ? 
1 1 1   47    7   13 o    375.7    2.7    0.0000   0.0000          ?        ?  1411.7714  20.4327          ?        ?      375.7        2.7       ?       ? 
1 1 1   47    7   14 o    168.7    4.2    0.0000   0.0000          ?        ?   284.7806  14.0475          ?        ?      168.7        4.2       ?       ? 
1 1 1   47    7   15 o    659.6    3.2    0.0000   0.0000          ?        ?  4352.8022  42.1424          ?        ?      659.6        3.2       ?       ? 
1 1 1   47    7   16 o    369.5    2.8    0.0000   0.0000          ?        ?  1365.7977  20.4327          ?        ?      369.5        2.8       ?       ? 
1 1 1   47    7   17 o    501.6    2.7    0.0000   0.0000          ?        ?  2516.4138  27.4564          ?        ?      501.6        2.7       ?       ? 
1 1 1   47    7   18 o    626.5    2.8    0.0000   0.0000          ?        ?  3926.2695  35.1187          ?        ?      626.5        2.8       ?       ? 
1 1 1   47    7   19 o    472.3    2.6    0.0000   0.0000          ?        ?  2230.9946  24.9023          ?        ?      472.3        2.6       ?       ? 
1 1 1   47    7   20 o    200.2    3.3    0.0000   0.0000          ?        ?   400.9916  13.4090          ?        ?      200.2        3.3       ?       ? 
1 1 1   47    7   21 o     56.9   12.1    0.0000   0.0000          ?        ?    33.8416  13.4090          ?        ?       56.9       12.1       ?       ? 
1 1 1   47    7   22 o     80.2    8.0    0.0000   0.0000          ?        ?    64.4907  12.7704          ?        ?       80.2        8.0       ?       ? 
1 1 1   47    7   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47    7   24 f    207.2    3.5    0.0000   0.0000          ?        ?   429.7251  14.6860          ?        ?      207.2        3.5       ?       ? 
1 1 1   47    7   25 o     33.7   13.1    0.0000   0.0000          ?        ?     7.0237  12.7704          ?        ?       33.7       13.1       ?       ? 
1 1 1   47    7   26 o    197.4    3.7    0.0000   0.0000          ?        ?   390.1367  14.6860          ?        ?      197.4        3.7       ?       ? 
1 1 1   47    7   27 o    154.2    4.6    0.0000   0.0000          ?        ?   238.1686  14.0475          ?        ?      154.2        4.6       ?       ? 
1 1 1   47    7   28 o    356.1    2.6    0.0000   0.0000          ?        ?  1268.7424  18.5171          ?        ?      356.1        2.6       ?       ? 
1 1 1   47    7   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47    7   30 o    222.1    3.5    0.0000   0.0000          ?        ?   493.5772  15.3245          ?        ?      222.1        3.5       ?       ? 
1 1 1   47    7   31 o     26.2   12.1    0.0000   0.0000          ?        ?   -11.4934  14.6860          ?        ?       26.2       12.1       ?       ? 
1 1 1   47    7   32 o    258.1    3.3    0.0000   0.0000          ?        ?   666.6166  17.2401          ?        ?      258.1        3.3       ?       ? 
1 1 1   47    7   33 o    144.8    5.3    0.0000   0.0000          ?        ?   210.0736  15.3245          ?        ?      144.8        5.3       ?       ? 
1 1 1   47    7   34 o    313.2    2.8    0.0000   0.0000          ?        ?   981.4077  17.2401          ?        ?      313.2        2.8       ?       ? 
1 1 1   47    7   35 o     36.1   14.5    0.0000   0.0000          ?        ?     6.3852  15.9630          ?        ?       36.1       14.5       ?       ? 
1 1 1   47    7   36 o    262.3    3.3    0.0000   0.0000          ?        ?   688.3264  17.2401          ?        ?      262.3        3.3       ?       ? 
1 1 1   47    7   37 o    420.0    2.6    0.0000   0.0000          ?        ?  1764.8738  21.7097          ?        ?      420.0        2.6       ?       ? 
1 1 1   47    7   38 o    374.8    2.7    0.0000   0.0000          ?        ?  1405.3861  20.4327          ?        ?      374.8        2.7       ?       ? 
1 1 1   47    7   39 o     18.9    9.5    0.0000   0.0000          ?        ?   -47.8891  15.9630          ?        ?       18.9        9.5       ?       ? 
1 1 1   47    7   40 o     62.7   13.6    0.0000   0.0000          ?        ?    41.5039  16.6016          ?        ?       62.7       13.6       ?       ? 
1 1 1   47    7   41 o    274.8    3.4    0.0000   0.0000          ?        ?   756.0096  18.5171          ?        ?      274.8        3.4       ?       ? 
1 1 1   47    7   42 o     18.6    9.4    0.0000   0.0000          ?        ?   -54.2743  16.6016          ?        ?       18.6        9.4       ?       ? 
1 1 1   47    7   43 o    126.0    6.8    0.0000   0.0000          ?        ?   159.6304  17.2401          ?        ?      126.0        6.8       ?       ? 
1 1 1   47    7   44 o    162.5    5.5    0.0000   0.0000          ?        ?   264.9865  17.8786          ?        ?      162.5        5.5       ?       ? 
1 1 1   47    7   45 o     47.3   15.9    0.0000   0.0000          ?        ?    21.7097  17.8786          ?        ?       47.3       15.9       ?       ? 
1 1 1   47    7   46 o     76.5   11.3    0.0000   0.0000          ?        ?    59.3825  17.2401          ?        ?       76.5       11.3       ?       ? 
1 1 1   47    7   47 o     31.6   14.2    0.0000   0.0000          ?        ?    -7.6623  18.5171          ?        ?       31.6       14.2       ?       ? 
1 1 1   47    7   48 o    208.7    4.7    0.0000   0.0000          ?        ?   436.7488  19.7942          ?        ?      208.7        4.7       ?       ? 
1 1 1   47    7   49 o     67.6   13.7    0.0000   0.0000          ?        ?    48.5276  17.8786          ?        ?       67.6       13.7       ?       ? 
1 1 1   47    7   50 o     19.3    9.7    0.0000   0.0000          ?        ?   -58.1055  17.8786          ?        ?       19.3        9.7       ?       ? 
1 1 1   47    7   51 o    169.3    5.3    0.0000   0.0000          ?        ?   287.9732  17.8786          ?        ?      169.3        5.3       ?       ? 
1 1 1   47    7   52 o    202.4    4.6    0.0000   0.0000          ?        ?   411.2079  18.5171          ?        ?      202.4        4.6       ?       ? 
1 1 1   47    7   53 o     90.2    9.9    0.0000   0.0000          ?        ?    83.0078  17.8786          ?        ?       90.2        9.9       ?       ? 
1 1 1   47    8    0 o    231.6    4.1  536.9967  19.1556   536.9967  19.1556   536.9967  19.1556      231.6      4.1      231.6        4.1     0.0     0.0 
1 1 1   47    8    1 o    577.9    3.0    0.0000   0.0000          ?        ?  3340.7451  34.4802          ?        ?      577.9        3.0       ?       ? 
1 1 1   47    8    2 f    208.0    3.2    0.0000   0.0000          ?        ?   432.9177  13.4090          ?        ?      208.0        3.2       ?       ? 
1 1 1   47    8    3 o    368.9    2.9    0.0000   0.0000          ?        ?  1361.3281  21.0712          ?        ?      368.9        2.9       ?       ? 
1 1 1   47    8    4 o    470.6    3.1    0.0000   0.0000          ?        ?  2215.0315  29.3720          ?        ?      470.6        3.1       ?       ? 
1 1 1   47    8    5 o    475.0    2.7    0.0000   0.0000          ?        ?  2256.5354  25.5409          ?        ?      475.0        2.7       ?       ? 
1 1 1   47    8    6 o    374.8    2.6    0.0000   0.0000          ?        ?  1405.3861  19.1556          ?        ?      374.8        2.6       ?       ? 
1 1 1   47    8    7 o     32.1   12.5    0.0000   0.0000          ?        ?     6.3852  11.4934          ?        ?       32.1       12.5       ?       ? 
1 1 1   47    8    8 o     53.1   11.2    0.0000   0.0000          ?        ?    29.3720  11.4934          ?        ?       53.1       11.2       ?       ? 
1 1 1   47    8    9 o    200.4    3.3    0.0000   0.0000          ?        ?   401.6301  13.4090          ?        ?      200.4        3.3       ?       ? 
1 1 1   47    8   10 o    270.6    2.7    0.0000   0.0000          ?        ?   732.3843  14.6860          ?        ?      270.6        2.7       ?       ? 
1 1 1   47    8   11 o    460.0    2.8    0.0000   0.0000          ?        ?  2116.6992  25.5409          ?        ?      460.0        2.8       ?       ? 
1 1 1   47    8   12 o    732.1    3.2    0.0000   0.0000          ?        ?  5362.3047  47.2506          ?        ?      732.1        3.2       ?       ? 
1 1 1   47    8   13 o    471.8    2.7    0.0000   0.0000          ?        ?  2226.5249  25.5409          ?        ?      471.8        2.7       ?       ? 
1 1 1   47    8   14 o    391.1    2.6    0.0000   0.0000          ?        ?  1529.8978  20.4327          ?        ?      391.1        2.6       ?       ? 
1 1 1   47    8   15 o     56.5   11.1    0.0000   0.0000          ?        ?    33.2031  12.1319          ?        ?       56.5       11.1       ?       ? 
1 1 1   47    8   16 o    424.0    2.7    0.0000   0.0000          ?        ?  1798.0769  22.9868          ?        ?      424.0        2.7       ?       ? 
1 1 1   47    8   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47    8   18 o    272.0    2.9    0.0000   0.0000          ?        ?   740.0466  15.9630          ?        ?      272.0        2.9       ?       ? 
1 1 1   47    8   19 o    151.5    4.4    0.0000   0.0000          ?        ?   229.8678  13.4090          ?        ?      151.5        4.4       ?       ? 
1 1 1   47    8   20 o    340.9    2.6    0.0000   0.0000          ?        ?  1162.7479  17.8786          ?        ?      340.9        2.6       ?       ? 
1 1 1   47    8   21 o    415.5    2.4    0.0000   0.0000          ?        ?  1726.5625  19.7942          ?        ?      415.5        2.4       ?       ? 
1 1 1   47    8   22 o    210.7    3.6    0.0000   0.0000          ?        ?   444.4110  15.3245          ?        ?      210.7        3.6       ?       ? 
1 1 1   47    8   23 o    250.6    3.1    0.0000   0.0000          ?        ?   628.3053  15.3245          ?        ?      250.6        3.1       ?       ? 
1 1 1   47    8   24 o    252.7    3.0    0.0000   0.0000          ?        ?   639.1602  15.3245          ?        ?      252.7        3.0       ?       ? 
1 1 1   47    8   25 o    261.4    3.1    0.0000   0.0000          ?        ?   683.8566  15.9630          ?        ?      261.4        3.1       ?       ? 
1 1 1   47    8   26 o     20.2    9.9    0.0000   0.0000          ?        ?   -26.1794  13.4090          ?        ?       20.2        9.9       ?       ? 
1 1 1   47    8   27 o    194.8    3.9    0.0000   0.0000          ?        ?   379.9204  15.3245          ?        ?      194.8        3.9       ?       ? 
1 1 1   47    8   28 o    166.0    4.6    0.0000   0.0000          ?        ?   275.8413  15.3245          ?        ?      166.0        4.6       ?       ? 
1 1 1   47    8   29 o     19.9    9.8    0.0000   0.0000          ?        ?   -30.6490  14.0475          ?        ?       19.9        9.8       ?       ? 
1 1 1   47    8   30 o    191.2    4.2    0.0000   0.0000          ?        ?   365.8729  15.9630          ?        ?      191.2        4.2       ?       ? 
1 1 1   47    8   31 o    251.7    3.3    0.0000   0.0000          ?        ?   634.0520  16.6016          ?        ?      251.7        3.3       ?       ? 
1 1 1   47    8   32 f    106.4    6.9    0.0000   0.0000          ?        ?   113.6568  14.6860          ?        ?      106.4        6.9       ?       ? 
1 1 1   47    8   33 o    203.8    4.1    0.0000   0.0000          ?        ?   415.6776  16.6016          ?        ?      203.8        4.1       ?       ? 
1 1 1   47    8   34 o    112.2    6.8    0.0000   0.0000          ?        ?   126.4273  15.3245          ?        ?      112.2        6.8       ?       ? 
1 1 1   47    8   35 o    387.0    2.7    0.0000   0.0000          ?        ?  1498.6102  21.0712          ?        ?      387.0        2.7       ?       ? 
1 1 1   47    8   36 o    384.2    2.7    0.0000   0.0000          ?        ?  1476.9005  21.0712          ?        ?      384.2        2.7       ?       ? 
1 1 1   47    8   37 o    225.9    3.8    0.0000   0.0000          ?        ?   510.8173  17.2401          ?        ?      225.9        3.8       ?       ? 
1 1 1   47    8   38 o    145.6    5.5    0.0000   0.0000          ?        ?   212.6277  15.9630          ?        ?      145.6        5.5       ?       ? 
1 1 1   47    8   39 o    107.8    8.0    0.0000   0.0000          ?        ?   116.8494  17.2401          ?        ?      107.8        8.0       ?       ? 
1 1 1   47    8   40 o     27.7   13.0    0.0000   0.0000          ?        ?   -17.2401  17.8786          ?        ?       27.7       13.0       ?       ? 
1 1 1   47    8   41 o    207.1    4.2    0.0000   0.0000          ?        ?   429.7251  17.2401          ?        ?      207.1        4.2       ?       ? 
1 1 1   47    8   42 o    441.1    2.7    0.0000   0.0000          ?        ?  1946.8524  23.6253          ?        ?      441.1        2.7       ?       ? 
1 1 1   47    8   43 o    173.6    5.0    0.0000   0.0000          ?        ?   302.0207  17.2401          ?        ?      173.6        5.0       ?       ? 
1 1 1   47    8   44 f    157.9    5.7    0.0000   0.0000          ?        ?   250.3005  17.8786          ?        ?      157.9        5.7       ?       ? 
1 1 1   47    8   45 o     89.2    9.7    0.0000   0.0000          ?        ?    80.4537  17.2401          ?        ?       89.2        9.7       ?       ? 
1 1 1   47    8   46 o     46.3   15.9    0.0000   0.0000          ?        ?    20.4327  17.8786          ?        ?       46.3       15.9       ?       ? 
1 1 1   47    8   47 o    183.1    4.9    0.0000   0.0000          ?        ?   336.5009  17.8786          ?        ?      183.1        4.9       ?       ? 
1 1 1   47    8   48 o     22.7   11.1    0.0000   0.0000          ?        ?   -33.8416  17.2401          ?        ?       22.7       11.1       ?       ? 
1 1 1   47    8   49 o     91.5    9.4    0.0000   0.0000          ?        ?    84.9234  17.2401          ?        ?       91.5        9.4       ?       ? 
1 1 1   47    8   50 o    127.5    7.0    0.0000   0.0000          ?        ?   164.1001  17.8786          ?        ?      127.5        7.0       ?       ? 
1 1 1   47    8   51 o    145.9    6.1    0.0000   0.0000          ?        ?   214.5433  17.8786          ?        ?      145.9        6.1       ?       ? 
1 1 1   47    8   52 o    115.1    7.5    0.0000   0.0000          ?        ?   134.0895  17.2401          ?        ?      115.1        7.5       ?       ? 
1 1 1   47    9    0 o     78.4   10.2   62.5751  15.9630    62.5751  15.9630    62.5751  15.9630       78.4     10.2       78.4       10.2     0.0     0.0 
1 1 1   47    9    1 o    440.9    2.8    0.0000   0.0000          ?        ?  1944.2983  24.2638          ?        ?      440.9        2.8       ?       ? 
1 1 1   47    9    2 o    352.6    2.5    0.0000   0.0000          ?        ?  1243.8401  17.8786          ?        ?      352.6        2.5       ?       ? 
1 1 1   47    9    3 o    568.9    2.9    0.0000   0.0000          ?        ?  3237.3047  32.5646          ?        ?      568.9        2.9       ?       ? 
1 1 1   47    9    4 o    252.1    3.0    0.0000   0.0000          ?        ?   635.9675  15.3245          ?        ?      252.1        3.0       ?       ? 
1 1 1   47    9    5 o    802.8    3.5    0.0000   0.0000          ?        ?  6448.4302  56.8284          ?        ?      802.8        3.5       ?       ? 
1 1 1   47    9    6 o    454.2    2.7    0.0000   0.0000          ?        ?  2063.7019  24.9023          ?        ?      454.2        2.7       ?       ? 
1 1 1   47    9    7 o    731.0    3.1    0.0000   0.0000          ?        ?  5345.7031  44.6965          ?        ?      731.0        3.1       ?       ? 
1 1 1   47    9    8 o    377.0    2.5    0.0000   0.0000          ?        ?  1421.9877  19.1556          ?        ?      377.0        2.5       ?       ? 
1 1 1   47    9    9 o    409.3    2.7    0.0000   0.0000          ?        ?  1676.1193  21.7097          ?        ?      409.3        2.7       ?       ? 
1 1 1   47    9   10 o    195.4    3.3    0.0000   0.0000          ?        ?   381.8359  12.7704          ?        ?      195.4        3.3       ?       ? 
1 1 1   47    9   11 o    324.2    2.9    0.0000   0.0000          ?        ?  1051.6451  18.5171          ?        ?      324.2        2.9       ?       ? 
1 1 1   47    9   12 o    276.3    2.9    0.0000   0.0000          ?        ?   763.6719  15.9630          ?        ?      276.3        2.9       ?       ? 
1 1 1   47    9   13 o    391.0    2.6    0.0000   0.0000          ?        ?  1529.2593  20.4327          ?        ?      391.0        2.6       ?       ? 
1 1 1   47    9   14 o     17.8    8.8    0.0000   0.0000          ?        ?   -30.0105  12.1319          ?        ?       17.8        8.8       ?       ? 
1 1 1   47    9   15 o    268.3    2.9    0.0000   0.0000          ?        ?   720.2524  15.3245          ?        ?      268.3        2.9       ?       ? 
1 1 1   47    9   16 f    180.2    3.7    0.0000   0.0000          ?        ?   325.0075  13.4090          ?        ?      180.2        3.7       ?       ? 
1 1 1   47    9   17 o    371.9    2.8    0.0000   0.0000          ?        ?  1383.6764  21.0712          ?        ?      371.9        2.8       ?       ? 
1 1 1   47    9   18 o    157.3    4.5    0.0000   0.0000          ?        ?   247.7464  14.0475          ?        ?      157.3        4.5       ?       ? 
1 1 1   47    9   19 o    101.6    6.6    0.0000   0.0000          ?        ?   103.4405  13.4090          ?        ?      101.6        6.6       ?       ? 
1 1 1   47    9   20 o    183.2    3.7    0.0000   0.0000          ?        ?   335.8624  13.4090          ?        ?      183.2        3.7       ?       ? 
1 1 1   47    9   21 o    339.2    2.5    0.0000   0.0000          ?        ?  1151.2545  17.2401          ?        ?      339.2        2.5       ?       ? 
1 1 1   47    9   22 o    190.9    3.5    0.0000   0.0000          ?        ?   364.5958  13.4090          ?        ?      190.9        3.5       ?       ? 
1 1 1   47    9   23 o    412.3    2.5    0.0000   0.0000          ?        ?  1700.3831  20.4327          ?        ?      412.3        2.5       ?       ? 
1 1 1   47    9   24 o     20.8   10.1    0.0000   0.0000          ?        ?   -23.6253  13.4090          ?        ?       20.8       10.1       ?       ? 
1 1 1   47    9   25 o    210.3    3.6    0.0000   0.0000          ?        ?   442.4955  15.3245          ?        ?      210.3        3.6       ?       ? 
1 1 1   47    9   26 o    274.0    2.9    0.0000   0.0000          ?        ?   750.9014  15.9630          ?        ?      274.0        2.9       ?       ? 
1 1 1   47    9   27 o    152.4    4.6    0.0000   0.0000          ?        ?   232.4219  14.0475          ?        ?      152.4        4.6       ?       ? 
1 1 1   47    9   28 o    337.5    2.6    0.0000   0.0000          ?        ?  1139.7611  17.8786          ?        ?      337.5        2.6       ?       ? 
1 1 1   47    9   29 o     96.7    7.3    0.0000   0.0000          ?        ?    93.8627  14.0475          ?        ?       96.7        7.3       ?       ? 
1 1 1   47    9   30 o    358.8    2.7    0.0000   0.0000          ?        ?  1287.8981  19.1556          ?        ?      358.8        2.7       ?       ? 
1 1 1   47    9   31 o    190.0    4.2    0.0000   0.0000          ?        ?   361.4032  15.9630          ?        ?      190.0        4.2       ?       ? 
1 1 1   47    9   32 o    154.2    5.2    0.0000   0.0000          ?        ?   238.1686  15.9630          ?        ?      154.2        5.2       ?       ? 
1 1 1   47    9   33 f    263.1    3.3    0.0000   0.0000          ?        ?   692.7960  17.2401          ?        ?      263.1        3.3       ?       ? 
1 1 1   47    9   34 o    194.6    4.1    0.0000   0.0000          ?        ?   379.2819  15.9630          ?        ?      194.6        4.1       ?       ? 
1 1 1   47    9   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47    9   36 o    307.0    2.9    0.0000   0.0000          ?        ?   943.0964  17.8786          ?        ?      307.0        2.9       ?       ? 
1 1 1   47    9   37 o     79.6   10.0    0.0000   0.0000          ?        ?    63.8522  15.9630          ?        ?       79.6       10.0       ?       ? 
1 1 1   47    9   38 o    171.6    4.7    0.0000   0.0000          ?        ?   294.9970  15.9630          ?        ?      171.6        4.7       ?       ? 
1 1 1   47    9   39 o    152.4    5.7    0.0000   0.0000          ?        ?   233.0604  17.2401          ?        ?      152.4        5.7       ?       ? 
1 1 1   47    9   40 o    154.3    5.4    0.0000   0.0000          ?        ?   238.8071  16.6016          ?        ?      154.3        5.4       ?       ? 
1 1 1   47    9   41 o     20.9   10.4    0.0000   0.0000          ?        ?   -39.5883  16.6016          ?        ?       20.9       10.4       ?       ? 
1 1 1   47    9   42 o     70.9   11.7    0.0000   0.0000          ?        ?    51.0817  16.6016          ?        ?       70.9       11.7       ?       ? 
1 1 1   47    9   43 f    320.8    3.1    0.0000   0.0000          ?        ?  1030.5739  19.7942          ?        ?      320.8        3.1       ?       ? 
1 1 1   47    9   44 o    259.3    3.6    0.0000   0.0000          ?        ?   673.6403  18.5171          ?        ?      259.3        3.6       ?       ? 
1 1 1   47    9   45 o     46.2   15.4    0.0000   0.0000          ?        ?    21.0712  16.6016          ?        ?       46.2       15.4       ?       ? 
1 1 1   47    9   46 o    117.2    7.6    0.0000   0.0000          ?        ?   138.5592  17.8786          ?        ?      117.2        7.6       ?       ? 
1 1 1   47    9   47 o    220.0    4.2    0.0000   0.0000          ?        ?   485.2764  18.5171          ?        ?      220.0        4.2       ?       ? 
1 1 1   47    9   48 o     58.7   14.7    0.0000   0.0000          ?        ?    37.0343  17.2401          ?        ?       58.7       14.7       ?       ? 
1 1 1   47    9   49 o    187.0    4.8    0.0000   0.0000          ?        ?   351.1869  17.8786          ?        ?      187.0        4.8       ?       ? 
1 1 1   47    9   50 o    239.4    3.9    0.0000   0.0000          ?        ?   574.6694  18.5171          ?        ?      239.4        3.9       ?       ? 
1 1 1   47    9   51 o    181.1    4.9    0.0000   0.0000          ?        ?   329.4771  17.8786          ?        ?      181.1        4.9       ?       ? 
1 1 1   47   10    0 o     97.9    7.6   97.6938  14.6860    97.6938  14.6860    97.6938  14.6860       97.9      7.6       97.9        7.6     0.0     0.0 
1 1 1   47   10    1 o    410.8    2.6    0.0000   0.0000          ?        ?  1688.2511  21.7097          ?        ?      410.8        2.6       ?       ? 
1 1 1   47   10    2 o    570.6    2.7    0.0000   0.0000          ?        ?  3257.0989  30.6490          ?        ?      570.6        2.7       ?       ? 
1 1 1   47   10    3 o    218.8    3.4    0.0000   0.0000          ?        ?   478.8912  14.6860          ?        ?      218.8        3.4       ?       ? 
1 1 1   47   10    4 o    571.9    3.1    0.0000   0.0000          ?        ?  3271.7849  35.1187          ?        ?      571.9        3.1       ?       ? 
1 1 1   47   10    5 o     75.7    7.2    0.0000   0.0000          ?        ?    57.4669  10.8549          ?        ?       75.7        7.2       ?       ? 
1 1 1   47   10    6 o    218.1    2.9    0.0000   0.0000          ?        ?   475.6986  12.7704          ?        ?      218.1        2.9       ?       ? 
1 1 1   47   10    7 o    424.6    2.5    0.0000   0.0000          ?        ?  1803.1851  21.0712          ?        ?      424.6        2.5       ?       ? 
1 1 1   47   10    8 o    194.0    3.3    0.0000   0.0000          ?        ?   376.7278  12.7704          ?        ?      194.0        3.3       ?       ? 
1 1 1   47   10    9 o    332.1    2.6    0.0000   0.0000          ?        ?  1103.3654  17.2401          ?        ?      332.1        2.6       ?       ? 
1 1 1   47   10   10 o    175.9    3.6    0.0000   0.0000          ?        ?   309.6830  12.7704          ?        ?      175.9        3.6       ?       ? 
1 1 1   47   10   11 o    412.1    2.6    0.0000   0.0000          ?        ?  1698.4675  21.7097          ?        ?      412.1        2.6       ?       ? 
1 1 1   47   10   12 o    227.1    3.0    0.0000   0.0000          ?        ?   515.9255  13.4090          ?        ?      227.1        3.0       ?       ? 
1 1 1   47   10   13 o    455.6    2.9    0.0000   0.0000          ?        ?  2076.4724  26.8179          ?        ?      455.6        2.9       ?       ? 
1 1 1   47   10   14 o    227.5    3.1    0.0000   0.0000          ?        ?   517.8410  14.0475          ?        ?      227.5        3.1       ?       ? 
1 1 1   47   10   15 o    383.7    2.5    0.0000   0.0000          ?        ?  1473.0693  19.1556          ?        ?      383.7        2.5       ?       ? 
1 1 1   47   10   16 o     74.0    8.2    0.0000   0.0000          ?        ?    54.9129  12.1319          ?        ?       74.0        8.2       ?       ? 
1 1 1   47   10   17 o    197.9    3.4    0.0000   0.0000          ?        ?   392.0523  13.4090          ?        ?      197.9        3.4       ?       ? 
1 1 1   47   10   18 o    178.8    3.8    0.0000   0.0000          ?        ?   319.8993  13.4090          ?        ?      178.8        3.8       ?       ? 
1 1 1   47   10   19 o    285.0    2.9    0.0000   0.0000          ?        ?   812.8381  16.6016          ?        ?      285.0        2.9       ?       ? 
1 1 1   47   10   20 o    345.6    2.6    0.0000   0.0000          ?        ?  1194.6740  17.8786          ?        ?      345.6        2.6       ?       ? 
1 1 1   47   10   21 o    290.4    2.7    0.0000   0.0000          ?        ?   843.4871  15.9630          ?        ?      290.4        2.7       ?       ? 
1 1 1   47   10   22 o    122.1    5.5    0.0000   0.0000          ?        ?   149.4141  13.4090          ?        ?      122.1        5.5       ?       ? 
1 1 1   47   10   23 o    450.4    2.6    0.0000   0.0000          ?        ?  2029.8602  23.6253          ?        ?      450.4        2.6       ?       ? 
1 1 1   47   10   24 o    284.5    2.9    0.0000   0.0000          ?        ?   809.6454  16.6016          ?        ?      284.5        2.9       ?       ? 
1 1 1   47   10   25 o    324.3    2.8    0.0000   0.0000          ?        ?  1052.2837  17.8786          ?        ?      324.3        2.8       ?       ? 
1 1 1   47   10   26 f     17.6    8.8    0.0000   0.0000          ?        ?   -43.4195  14.0475          ?        ?       17.6        8.8       ?       ? 
1 1 1   47   10   27 o    219.9    3.6    0.0000   0.0000          ?        ?   483.9994  15.9630          ?        ?      219.9        3.6       ?       ? 
1 1 1   47   10   28 o    254.1    3.3    0.0000   0.0000          ?        ?   646.1838  16.6016          ?        ?      254.1        3.3       ?       ? 
1 1 1   47   10   29 o    351.0    2.7    0.0000   0.0000          ?        ?  1232.3467  19.1556          ?        ?      351.0        2.7       ?       ? 
1 1 1   47   10   30 o    184.2    4.2    0.0000   0.0000          ?        ?   339.6935  15.3245          ?        ?      184.2        4.2       ?       ? 
1 1 1   47   10   31 f     37.0   13.9    0.0000   0.0000          ?        ?    10.2163  14.0475          ?        ?       37.0       13.9       ?       ? 
1 1 1   47   10   32 o    240.0    3.5    0.0000   0.0000          ?        ?   576.5850  16.6016          ?        ?      240.0        3.5       ?       ? 
1 1 1   47   10   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47   10   34 o    100.2    7.3    0.0000   0.0000          ?        ?   100.8864  14.6860          ?        ?      100.2        7.3       ?       ? 
1 1 1   47   10   35 o    242.9    3.4    0.0000   0.0000          ?        ?   590.6325  16.6016          ?        ?      242.9        3.4       ?       ? 
1 1 1   47   10   36 o     31.9   13.6    0.0000   0.0000          ?        ?     0.0000  15.3245          ?        ?       31.9       13.6       ?       ? 
1 1 1   47   10   37 o     23.1   11.2    0.0000   0.0000          ?        ?   -29.3720  16.6016          ?        ?       23.1       11.2       ?       ? 
1 1 1   47   10   38 o     88.6    9.0    0.0000   0.0000          ?        ?    79.1767  15.9630          ?        ?       88.6        9.0       ?       ? 
1 1 1   47   10   39 o    300.4    3.2    0.0000   0.0000          ?        ?   903.5081  19.1556          ?        ?      300.4        3.2       ?       ? 
1 1 1   47   10   40 o    104.7    7.9    0.0000   0.0000          ?        ?   110.4642  16.6016          ?        ?      104.7        7.9       ?       ? 
1 1 1   47   10   41 o     23.0   11.2    0.0000   0.0000          ?        ?   -32.5646  17.2401          ?        ?       23.0       11.2       ?       ? 
1 1 1   47   10   42 o    186.8    4.6    0.0000   0.0000          ?        ?   349.9099  17.2401          ?        ?      186.8        4.6       ?       ? 
1 1 1   47   10   43 o    132.9    6.2    0.0000   0.0000          ?        ?   177.5090  16.6016          ?        ?      132.9        6.2       ?       ? 
1 1 1   47   10   44 o    252.4    3.5    0.0000   0.0000          ?        ?   637.8831  17.8786          ?        ?      252.4        3.5       ?       ? 
1 1 1   47   10   45 o    189.2    4.6    0.0000   0.0000          ?        ?   358.8492  17.2401          ?        ?      189.2        4.6       ?       ? 
1 1 1   47   10   46 o     60.3   14.5    0.0000   0.0000          ?        ?    38.9498  17.2401          ?        ?       60.3       14.5       ?       ? 
1 1 1   47   10   47 o     64.5   14.7    0.0000   0.0000          ?        ?    44.6965  18.5171          ?        ?       64.5       14.7       ?       ? 
1 1 1   47   10   48 o     44.0   15.6    0.0000   0.0000          ?        ?    17.8786  17.2401          ?        ?       44.0       15.6       ?       ? 
1 1 1   47   10   49 o    101.9    8.8    0.0000   0.0000          ?        ?   105.3561  17.8786          ?        ?      101.9        8.8       ?       ? 
1 1 1   47   10   50 o     41.7   15.5    0.0000   0.0000          ?        ?    14.6860  17.2401          ?        ?       41.7       15.5       ?       ? 
1 1 1   47   11    0 o    323.2    3.5 1045.2599  22.3483  1045.2599  22.3483  1045.2599  22.3483      323.2      3.5      323.2        3.5     0.0     0.0 
1 1 1   47   11    1 o     80.6    5.9    0.0000   0.0000          ?        ?    65.1292   9.5778          ?        ?       80.6        5.9       ?       ? 
1 1 1   47   11    2 o    323.0    2.7    0.0000   0.0000          ?        ?  1043.3442  17.2401          ?        ?      323.0        2.7       ?       ? 
1 1 1   47   11    3 o    113.2    4.8    0.0000   0.0000          ?        ?   128.3428  10.8549          ?        ?      113.2        4.8       ?       ? 
1 1 1   47   11    4 f     52.5   10.7    0.0000   0.0000          ?        ?    28.7335  10.8549          ?        ?       52.5       10.7       ?       ? 
1 1 1   47   11    5 o    148.4    3.9    0.0000   0.0000          ?        ?   220.2900  11.4934          ?        ?      148.4        3.9       ?       ? 
1 1 1   47   11    6 o    205.1    3.1    0.0000   0.0000          ?        ?   420.7858  12.7704          ?        ?      205.1        3.1       ?       ? 
1 1 1   47   11    7 o     82.6    6.2    0.0000   0.0000          ?        ?    68.3218  10.2163          ?        ?       82.6        6.2       ?       ? 
1 1 1   47   11    8 o    268.7    2.9    0.0000   0.0000          ?        ?   722.1680  15.3245          ?        ?      268.7        2.9       ?       ? 
1 1 1   47   11    9 o    285.7    2.8    0.0000   0.0000          ?        ?   816.6692  15.9630          ?        ?      285.7        2.8       ?       ? 
1 1 1   47   11   10 o    300.4    2.6    0.0000   0.0000          ?        ?   902.8696  15.3245          ?        ?      300.4        2.6       ?       ? 
1 1 1   47   11   11 o    352.3    2.5    0.0000   0.0000          ?        ?  1241.2860  17.8786          ?        ?      352.3        2.5       ?       ? 
1 1 1   47   11   12 o    194.5    3.6    0.0000   0.0000          ?        ?   378.6433  14.0475          ?        ?      194.5        3.6       ?       ? 
1 1 1   47   11   13 o    225.1    3.4    0.0000   0.0000          ?        ?   506.9862  15.3245          ?        ?      225.1        3.4       ?       ? 
1 1 1   47   11   14 f    224.1    3.1    0.0000   0.0000          ?        ?   502.5165  14.0475          ?        ?      224.1        3.1       ?       ? 
1 1 1   47   11   15 o    467.3    2.7    0.0000   0.0000          ?        ?  2184.3826  24.9023          ?        ?      467.3        2.7       ?       ? 
1 1 1   47   11   16 o    445.4    2.9    0.0000   0.0000          ?        ?  1985.1637  25.5409          ?        ?      445.4        2.9       ?       ? 
1 1 1   47   11   17 o    175.7    4.0    0.0000   0.0000          ?        ?   309.0445  14.0475          ?        ?      175.7        4.0       ?       ? 
1 1 1   47   11   18 o    235.9    3.0    0.0000   0.0000          ?        ?   556.7908  14.0475          ?        ?      235.9        3.0       ?       ? 
1 1 1   47   11   19 o    179.3    3.9    0.0000   0.0000          ?        ?   321.8149  14.0475          ?        ?      179.3        3.9       ?       ? 
1 1 1   47   11   20 f    335.8    2.6    0.0000   0.0000          ?        ?  1128.2677  17.2401          ?        ?      335.8        2.6       ?       ? 
1 1 1   47   11   21 o    155.3    4.5    0.0000   0.0000          ?        ?   241.3612  14.0475          ?        ?      155.3        4.5       ?       ? 
1 1 1   47   11   22 o    325.3    2.7    0.0000   0.0000          ?        ?  1058.6688  17.8786          ?        ?      325.3        2.7       ?       ? 
1 1 1   47   11   23 o    153.0    4.4    0.0000   0.0000          ?        ?   234.3374  13.4090          ?        ?      153.0        4.4       ?       ? 
1 1 1   47   11   24 o    145.3    4.8    0.0000   0.0000          ?        ?   211.3506  14.0475          ?        ?      145.3        4.8       ?       ? 
1 1 1   47   11   25 o    141.5    5.0    0.0000   0.0000          ?        ?   200.4958  14.0475          ?        ?      141.5        5.0       ?       ? 
1 1 1   47   11   26 o    174.4    4.6    0.0000   0.0000          ?        ?   304.5748  15.9630          ?        ?      174.4        4.6       ?       ? 
1 1 1   47   11   27 o     21.4   10.4    0.0000   0.0000          ?        ?   -27.4564  14.6860          ?        ?       21.4       10.4       ?       ? 
1 1 1   47   11   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47   11   29 o    204.2    3.8    0.0000   0.0000          ?        ?   417.5931  15.3245          ?        ?      204.2        3.8       ?       ? 
1 1 1   47   11   30 o    356.3    2.7    0.0000   0.0000          ?        ?  1270.0195  19.1556          ?        ?      356.3        2.7       ?       ? 
1 1 1   47   11   31 o    368.5    2.7    0.0000   0.0000          ?        ?  1358.7740  19.7942          ?        ?      368.5        2.7       ?       ? 
1 1 1   47   11   32 o    131.4    5.8    0.0000   0.0000          ?        ?   173.0394  15.3245          ?        ?      131.4        5.8       ?       ? 
1 1 1   47   11   33 f    224.2    3.7    0.0000   0.0000          ?        ?   503.1551  16.6016          ?        ?      224.2        3.7       ?       ? 
1 1 1   47   11   34 o    145.9    5.3    0.0000   0.0000          ?        ?   213.2662  15.3245          ?        ?      145.9        5.3       ?       ? 
1 1 1   47   11   35 o    216.6    4.1    0.0000   0.0000          ?        ?   469.9519  17.8786          ?        ?      216.6        4.1       ?       ? 
1 1 1   47   11   36 o    253.4    3.5    0.0000   0.0000          ?        ?   642.9913  17.8786          ?        ?      253.4        3.5       ?       ? 
1 1 1   47   11   37 o     23.1   11.2    0.0000   0.0000          ?        ?   -26.1794  15.9630          ?        ?       23.1       11.2       ?       ? 
1 1 1   47   11   38 o     49.3   15.3    0.0000   0.0000          ?        ?    24.9023  16.6016          ?        ?       49.3       15.3       ?       ? 
1 1 1   47   11   39 o    297.9    3.0    0.0000   0.0000          ?        ?   888.1836  17.8786          ?        ?      297.9        3.0       ?       ? 
1 1 1   47   11   40 o     22.6   11.0    0.0000   0.0000          ?        ?   -28.0950  15.9630          ?        ?       22.6       11.0       ?       ? 
1 1 1   47   11   41 o     31.8   14.1    0.0000   0.0000          ?        ?    -5.7467  17.8786          ?        ?       31.8       14.1       ?       ? 
1 1 1   47   11   42 o     50.8   15.5    0.0000   0.0000          ?        ?    26.8179  17.2401          ?        ?       50.8       15.5       ?       ? 
1 1 1   47   11   43 o    180.4    4.8    0.0000   0.0000          ?        ?   326.2845  17.2401          ?        ?      180.4        4.8       ?       ? 
1 1 1   47   11   44 o    170.7    5.0    0.0000   0.0000          ?        ?   292.4429  17.2401          ?        ?      170.7        5.0       ?       ? 
1 1 1   47   11   45 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47   11   46 f     30.2   13.6    0.0000   0.0000          ?        ?    -7.6623  17.2401          ?        ?       30.2       13.6       ?       ? 
1 1 1   47   11   47 o     80.3   10.3    0.0000   0.0000          ?        ?    65.7677  16.6016          ?        ?       80.3       10.3       ?       ? 
1 1 1   47   11   48 o    229.7    4.2    0.0000   0.0000          ?        ?   529.3344  19.1556          ?        ?      229.7        4.2       ?       ? 
1 1 1   47   11   49 o    149.8    5.8    0.0000   0.0000          ?        ?   226.0367  17.2401          ?        ?      149.8        5.8       ?       ? 
1 1 1   47   12    0 o     98.3    7.2   98.3323  14.0475    98.3323  14.0475    98.3323  14.0475       98.3      7.2       98.3        7.2     0.0     0.0 
1 1 1   47   12    1 o    189.9    2.9    0.0000   0.0000          ?        ?   360.7647  10.8549          ?        ?      189.9        2.9       ?       ? 
1 1 1   47   12    2 o    274.1    2.6    0.0000   0.0000          ?        ?   751.5399  14.0475          ?        ?      274.1        2.6       ?       ? 
1 1 1   47   12    3 o    473.3    2.7    0.0000   0.0000          ?        ?  2240.5723  25.5409          ?        ?      473.3        2.7       ?       ? 
1 1 1   47   12    4 o    202.3    2.8    0.0000   0.0000          ?        ?   409.2924  11.4934          ?        ?      202.3        2.8       ?       ? 
1 1 1   47   12    5 o    446.8    2.7    0.0000   0.0000          ?        ?  1997.2955  24.2638          ?        ?      446.8        2.7       ?       ? 
1 1 1   47   12    6 o    289.6    2.5    0.0000   0.0000          ?        ?   839.0174  14.6860          ?        ?      289.6        2.5       ?       ? 
1 1 1   47   12    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47   12    8 o    137.2    4.0    0.0000   0.0000          ?        ?   188.3639  10.8549          ?        ?      137.2        4.0       ?       ? 
1 1 1   47   12    9 o    162.9    3.7    0.0000   0.0000          ?        ?   265.6250  12.1319          ?        ?      162.9        3.7       ?       ? 
1 1 1   47   12   10 o    575.1    3.2    0.0000   0.0000          ?        ?  3309.4575  37.0343          ?        ?      575.1        3.2       ?       ? 
1 1 1   47   12   11 o    487.9    3.3    0.0000   0.0000          ?        ?  2381.6855  32.5646          ?        ?      487.9        3.3       ?       ? 
1 1 1   47   12   12 o   1089.0    4.6    0.0000   0.0000          ?        ? 11874.5859  99.6094          ?        ?     1089.0        4.6       ?       ? 
1 1 1   47   12   13 o    295.0    3.4    0.0000   0.0000          ?        ?   870.9435  19.7942          ?        ?      295.0        3.4       ?       ? 
1 1 1   47   12   14 o     65.3    8.8    0.0000   0.0000          ?        ?    42.7809  11.4934          ?        ?       65.3        8.8       ?       ? 
1 1 1   47   12   15 o    157.9    4.0    0.0000   0.0000          ?        ?   249.6619  12.7704          ?        ?      157.9        4.0       ?       ? 
1 1 1   47   12   16 o    163.7    4.1    0.0000   0.0000          ?        ?   268.1791  13.4090          ?        ?      163.7        4.1       ?       ? 
1 1 1   47   12   17 o    246.0    3.0    0.0000   0.0000          ?        ?   605.3185  14.6860          ?        ?      246.0        3.0       ?       ? 
1 1 1   47   12   18 o    161.5    4.2    0.0000   0.0000          ?        ?   261.1554  13.4090          ?        ?      161.5        4.2       ?       ? 
1 1 1   47   12   19 o    408.8    2.7    0.0000   0.0000          ?        ?  1672.2881  21.7097          ?        ?      408.8        2.7       ?       ? 
1 1 1   47   12   20 o     89.9    7.1    0.0000   0.0000          ?        ?    81.0922  12.7704          ?        ?       89.9        7.1       ?       ? 
1 1 1   47   12   21 o    322.7    2.7    0.0000   0.0000          ?        ?  1042.0673  17.2401          ?        ?      322.7        2.7       ?       ? 
1 1 1   47   12   22 o    158.5    4.6    0.0000   0.0000          ?        ?   251.5775  14.6860          ?        ?      158.5        4.6       ?       ? 
1 1 1   47   12   23 o     17.8    8.9    0.0000   0.0000          ?        ?   -33.8416  12.7704          ?        ?       17.8        8.9       ?       ? 
1 1 1   47   12   24 o    214.5    3.4    0.0000   0.0000          ?        ?   460.3741  14.6860          ?        ?      214.5        3.4       ?       ? 
1 1 1   47   12   25 o    151.9    4.8    0.0000   0.0000          ?        ?   231.1448  14.6860          ?        ?      151.9        4.8       ?       ? 
1 1 1   47   12   26 o    248.1    3.2    0.0000   0.0000          ?        ?   616.1733  15.9630          ?        ?      248.1        3.2       ?       ? 
1 1 1   47   12   27 o    250.3    3.3    0.0000   0.0000          ?        ?   627.0282  16.6016          ?        ?      250.3        3.3       ?       ? 
1 1 1   47   12   28 o    219.9    3.5    0.0000   0.0000          ?        ?   483.9994  15.3245          ?        ?      219.9        3.5       ?       ? 
1 1 1   47   12   29 o     63.1   12.1    0.0000   0.0000          ?        ?    41.5039  14.6860          ?        ?       63.1       12.1       ?       ? 
1 1 1   47   12   30 o    108.5    6.8    0.0000   0.0000          ?        ?   118.1265  14.6860          ?        ?      108.5        6.8       ?       ? 
1 1 1   47   12   31 o     47.4   14.3    0.0000   0.0000          ?        ?    22.9868  14.6860          ?        ?       47.4       14.3       ?       ? 
1 1 1   47   12   32 o    274.2    3.0    0.0000   0.0000          ?        ?   752.1785  16.6016          ?        ?      274.2        3.0       ?       ? 
1 1 1   47   12   33 o     45.7   15.1    0.0000   0.0000          ?        ?    20.4327  15.9630          ?        ?       45.7       15.1       ?       ? 
1 1 1   47   12   34 o    271.9    3.3    0.0000   0.0000          ?        ?   740.0466  17.8786          ?        ?      271.9        3.3       ?       ? 
1 1 1   47   12   35 o    157.4    5.1    0.0000   0.0000          ?        ?   248.3849  15.9630          ?        ?      157.4        5.1       ?       ? 
1 1 1   47   12   36 o    105.7    7.6    0.0000   0.0000          ?        ?   112.3798  15.9630          ?        ?      105.7        7.6       ?       ? 
1 1 1   47   12   37 o     76.6   10.8    0.0000   0.0000          ?        ?    59.3825  16.6016          ?        ?       76.6       10.8       ?       ? 
1 1 1   47   12   38 o    161.0    5.0    0.0000   0.0000          ?        ?   259.8783  15.9630          ?        ?      161.0        5.0       ?       ? 
1 1 1   47   12   39 o    113.5    7.3    0.0000   0.0000          ?        ?   129.6199  16.6016          ?        ?      113.5        7.3       ?       ? 
1 1 1   47   12   40 o    118.7    7.0    0.0000   0.0000          ?        ?   141.7518  16.6016          ?        ?      118.7        7.0       ?       ? 
1 1 1   47   12   41 o    213.0    4.0    0.0000   0.0000          ?        ?   454.6274  17.2401          ?        ?      213.0        4.0       ?       ? 
1 1 1   47   12   42 o     99.3    8.4    0.0000   0.0000          ?        ?    99.6094  16.6016          ?        ?       99.3        8.4       ?       ? 
1 1 1   47   12   43 o     76.8   11.2    0.0000   0.0000          ?        ?    60.0210  17.2401          ?        ?       76.8       11.2       ?       ? 
1 1 1   47   12   44 o     53.7   15.3    0.0000   0.0000          ?        ?    30.6490  17.2401          ?        ?       53.7       15.3       ?       ? 
1 1 1   47   12   45 o    131.6    6.3    0.0000   0.0000          ?        ?   174.3164  16.6016          ?        ?      131.6        6.3       ?       ? 
1 1 1   47   12   46 f     89.0    9.3    0.0000   0.0000          ?        ?    80.4537  16.6016          ?        ?       89.0        9.3       ?       ? 
1 1 1   47   12   47 o    186.5    4.6    0.0000   0.0000          ?        ?   349.2713  17.2401          ?        ?      186.5        4.6       ?       ? 
1 1 1   47   12   48 o    117.3    7.6    0.0000   0.0000          ?        ?   139.1977  17.8786          ?        ?      117.3        7.6       ?       ? 
1 1 1   47   13    0 o    156.6    4.5  245.8308  14.0475   245.8308  14.0475   245.8308  14.0475      156.6      4.5      156.6        4.5     0.0     0.0 
1 1 1   47   13    1 o     51.8   11.9    0.0000   0.0000          ?        ?    28.0950  12.1319          ?        ?       51.8       11.9       ?       ? 
1 1 1   47   13    2 o    364.1    2.5    0.0000   0.0000          ?        ?  1326.2094  17.8786          ?        ?      364.1        2.5       ?       ? 
1 1 1   47   13    3 o    255.9    3.1    0.0000   0.0000          ?        ?   655.1232  15.9630          ?        ?      255.9        3.1       ?       ? 
1 1 1   47   13    4 o    297.7    2.7    0.0000   0.0000          ?        ?   886.9065  15.9630          ?        ?      297.7        2.7       ?       ? 
1 1 1   47   13    5 o    315.0    2.5    0.0000   0.0000          ?        ?   992.9011  15.9630          ?        ?      315.0        2.5       ?       ? 
1 1 1   47   13    6 o    188.9    3.0    0.0000   0.0000          ?        ?   356.9336  11.4934          ?        ?      188.9        3.0       ?       ? 
1 1 1   47   13    7 o     46.8   11.1    0.0000   0.0000          ?        ?    22.9868  10.2163          ?        ?       46.8       11.1       ?       ? 
1 1 1   47   13    8 o    207.9    3.1    0.0000   0.0000          ?        ?   432.2791  12.7704          ?        ?      207.9        3.1       ?       ? 
1 1 1   47   13    9 o    144.2    3.8    0.0000   0.0000          ?        ?   208.1580  10.8549          ?        ?      144.2        3.8       ?       ? 
1 1 1   47   13   10 o    361.1    2.8    0.0000   0.0000          ?        ?  1304.4998  20.4327          ?        ?      361.1        2.8       ?       ? 
1 1 1   47   13   11 o    155.7    3.7    0.0000   0.0000          ?        ?   242.6382  11.4934          ?        ?      155.7        3.7       ?       ? 
1 1 1   47   13   12 o    384.9    2.7    0.0000   0.0000          ?        ?  1482.0088  21.0712          ?        ?      384.9        2.7       ?       ? 
1 1 1   47   13   13 o    335.7    2.8    0.0000   0.0000          ?        ?  1127.6293  18.5171          ?        ?      335.7        2.8       ?       ? 
1 1 1   47   13   14 o    299.8    2.9    0.0000   0.0000          ?        ?   899.0385  17.2401          ?        ?      299.8        2.9       ?       ? 
1 1 1   47   13   15 o    148.1    4.1    0.0000   0.0000          ?        ?   219.6514  12.1319          ?        ?      148.1        4.1       ?       ? 
1 1 1   47   13   16 o    224.9    3.3    0.0000   0.0000          ?        ?   506.3477  14.6860          ?        ?      224.9        3.3       ?       ? 
1 1 1   47   13   17 o     90.6    6.7    0.0000   0.0000          ?        ?    82.3693  12.1319          ?        ?       90.6        6.7       ?       ? 
1 1 1   47   13   18 o    522.6    2.7    0.0000   0.0000          ?        ?  2732.2339  28.7335          ?        ?      522.6        2.7       ?       ? 
1 1 1   47   13   19 o    242.6    3.0    0.0000   0.0000          ?        ?   588.7169  14.6860          ?        ?      242.6        3.0       ?       ? 
1 1 1   47   13   20 o    113.1    6.5    0.0000   0.0000          ?        ?   128.3428  14.6860          ?        ?      113.1        6.5       ?       ? 
1 1 1   47   13   21 o    201.6    3.6    0.0000   0.0000          ?        ?   406.7383  14.6860          ?        ?      201.6        3.6       ?       ? 
1 1 1   47   13   22 o    587.5    2.9    0.0000   0.0000          ?        ?  3453.1250  33.8416          ?        ?      587.5        2.9       ?       ? 
1 1 1   47   13   23 o    131.6    5.6    0.0000   0.0000          ?        ?   173.6779  14.6860          ?        ?      131.6        5.6       ?       ? 
1 1 1   47   13   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47   13   25 o     16.6    8.4    0.0000   0.0000          ?        ?   -49.8047  14.0475          ?        ?       16.6        8.4       ?       ? 
1 1 1   47   13   26 o     34.4   13.7    0.0000   0.0000          ?        ?     6.3852  14.0475          ?        ?       34.4       13.7       ?       ? 
1 1 1   47   13   27 o    218.3    3.7    0.0000   0.0000          ?        ?   476.9756  15.9630          ?        ?      218.3        3.7       ?       ? 
1 1 1   47   13   28 o    256.6    3.1    0.0000   0.0000          ?        ?   658.9543  15.9630          ?        ?      256.6        3.1       ?       ? 
1 1 1   47   13   29 o    155.6    4.7    0.0000   0.0000          ?        ?   242.6382  14.6860          ?        ?      155.6        4.7       ?       ? 
1 1 1   47   13   30 o    250.5    3.3    0.0000   0.0000          ?        ?   628.3053  16.6016          ?        ?      250.5        3.3       ?       ? 
1 1 1   47   13   31 o    393.6    2.6    0.0000   0.0000          ?        ?  1550.3306  20.4327          ?        ?      393.6        2.6       ?       ? 
1 1 1   47   13   32 o    115.0    6.7    0.0000   0.0000          ?        ?   132.8125  15.3245          ?        ?      115.0        6.7       ?       ? 
1 1 1   47   13   33 o    144.1    5.5    0.0000   0.0000          ?        ?   208.1580  15.9630          ?        ?      144.1        5.5       ?       ? 
1 1 1   47   13   34 o    329.8    2.9    0.0000   0.0000          ?        ?  1088.6793  19.1556          ?        ?      329.8        2.9       ?       ? 
1 1 1   47   13   35 o    237.8    3.6    0.0000   0.0000          ?        ?   566.3687  17.2401          ?        ?      237.8        3.6       ?       ? 
1 1 1   47   13   36 o    232.6    3.8    0.0000   0.0000          ?        ?   542.1049  17.8786          ?        ?      232.6        3.8       ?       ? 
1 1 1   47   13   37 o     33.7   14.3    0.0000   0.0000          ?        ?     1.2770  16.6016          ?        ?       33.7       14.3       ?       ? 
1 1 1   47   13   38 o    209.8    4.1    0.0000   0.0000          ?        ?   441.2184  17.2401          ?        ?      209.8        4.1       ?       ? 
1 1 1   47   13   39 o     45.5   15.1    0.0000   0.0000          ?        ?    20.4327  15.9630          ?        ?       45.5       15.1       ?       ? 
1 1 1   47   13   40 o    165.2    5.0    0.0000   0.0000          ?        ?   273.9258  16.6016          ?        ?      165.2        5.0       ?       ? 
1 1 1   47   13   41 o    196.1    4.2    0.0000   0.0000          ?        ?   385.6671  16.6016          ?        ?      196.1        4.2       ?       ? 
1 1 1   47   13   42 o    129.4    6.4    0.0000   0.0000          ?        ?   168.5697  16.6016          ?        ?      129.4        6.4       ?       ? 
1 1 1   47   13   43 o    119.9    6.9    0.0000   0.0000          ?        ?   144.9444  16.6016          ?        ?      119.9        6.9       ?       ? 
1 1 1   47   13   44 o    234.9    3.7    0.0000   0.0000          ?        ?   552.9597  17.2401          ?        ?      234.9        3.7       ?       ? 
1 1 1   47   13   45 o     93.1    9.3    0.0000   0.0000          ?        ?    88.1160  17.2401          ?        ?       93.1        9.3       ?       ? 
1 1 1   47   13   46 o    237.5    3.8    0.0000   0.0000          ?        ?   565.7302  17.8786          ?        ?      237.5        3.8       ?       ? 
1 1 1   47   13   47 o     79.5   10.0    0.0000   0.0000          ?        ?    64.4907  15.9630          ?        ?       79.5       10.0       ?       ? 
1 1 1   47   14    0 o     16.1   11.9  -46.6121  21.7097   -46.6121  21.7097   -46.6121  21.7097       16.1     11.9       16.1       11.9     0.0     0.0 
1 1 1   47   14    1 o    166.7    4.8    0.0000   0.0000          ?        ?   278.3954  15.9630          ?        ?      166.7        4.8       ?       ? 
1 1 1   47   14    2 o     15.2    7.7    0.0000   0.0000          ?        ?   -35.1187  10.8549          ?        ?       15.2        7.7       ?       ? 
1 1 1   47   14    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47   14    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47   14    5 o    138.8    4.6    0.0000   0.0000          ?        ?   192.8335  12.7704          ?        ?      138.8        4.6       ?       ? 
1 1 1   47   14    6 o    565.0    3.6    0.0000   0.0000          ?        ?  3194.5237  40.8654          ?        ?      565.0        3.6       ?       ? 
1 1 1   47   14    7 o    504.3    3.0    0.0000   0.0000          ?        ?  2544.5088  30.0105          ?        ?      504.3        3.0       ?       ? 
1 1 1   47   14    8 o    346.4    2.9    0.0000   0.0000          ?        ?  1200.4207  20.4327          ?        ?      346.4        2.9       ?       ? 
1 1 1   47   14    9 o    468.4    3.0    0.0000   0.0000          ?        ?  2195.2373  28.0950          ?        ?      468.4        3.0       ?       ? 
1 1 1   47   14   10 o    419.9    2.7    0.0000   0.0000          ?        ?  1763.5968  22.9868          ?        ?      419.9        2.7       ?       ? 
1 1 1   47   14   11 o    115.4    4.7    0.0000   0.0000          ?        ?   133.4510  10.8549          ?        ?      115.4        4.7       ?       ? 
1 1 1   47   14   12 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47   14   13 o    120.8    4.8    0.0000   0.0000          ?        ?   146.2215  11.4934          ?        ?      120.8        4.8       ?       ? 
1 1 1   47   14   14 o     79.8    6.8    0.0000   0.0000          ?        ?    63.8522  10.8549          ?        ?       79.8        6.8       ?       ? 
1 1 1   47   14   15 o     17.0    8.5    0.0000   0.0000          ?        ?   -33.8416  12.1319          ?        ?       17.0        8.5       ?       ? 
1 1 1   47   14   16 o     27.2   12.0    0.0000   0.0000          ?        ?    -3.8311  12.7704          ?        ?       27.2       12.0       ?       ? 
1 1 1   47   14   17 o    112.9    5.7    0.0000   0.0000          ?        ?   127.7043  12.7704          ?        ?      112.9        5.7       ?       ? 
1 1 1   47   14   18 o     31.5   12.8    0.0000   0.0000          ?        ?     3.8311  12.7704          ?        ?       31.5       12.8       ?       ? 
1 1 1   47   14   19 o     50.5   12.7    0.0000   0.0000          ?        ?    26.8179  12.7704          ?        ?       50.5       12.7       ?       ? 
1 1 1   47   14   20 o     59.7   11.1    0.0000   0.0000          ?        ?    37.0343  12.7704          ?        ?       59.7       11.1       ?       ? 
1 1 1   47   14   21 f    360.4    2.7    0.0000   0.0000          ?        ?  1299.3915  19.7942          ?        ?      360.4        2.7       ?       ? 
1 1 1   47   14   22 o    188.3    3.9    0.0000   0.0000          ?        ?   355.0180  14.6860          ?        ?      188.3        3.9       ?       ? 
1 1 1   47   14   23 o    210.4    3.5    0.0000   0.0000          ?        ?   443.1340  14.6860          ?        ?      210.4        3.5       ?       ? 
1 1 1   47   14   24 o    243.7    3.3    0.0000   0.0000          ?        ?   594.4636  15.9630          ?        ?      243.7        3.3       ?       ? 
1 1 1   47   14   25 o    259.7    3.2    0.0000   0.0000          ?        ?   674.9174  16.6016          ?        ?      259.7        3.2       ?       ? 
1 1 1   47   14   26 o    306.1    2.8    0.0000   0.0000          ?        ?   937.3498  17.2401          ?        ?      306.1        2.8       ?       ? 
1 1 1   47   14   27 o    152.1    5.0    0.0000   0.0000          ?        ?   231.7833  15.3245          ?        ?      152.1        5.0       ?       ? 
1 1 1   47   14   28 o     37.1   14.4    0.0000   0.0000          ?        ?     8.9393  15.3245          ?        ?       37.1       14.4       ?       ? 
1 1 1   47   14   29 o    181.9    4.2    0.0000   0.0000          ?        ?   331.3927  15.3245          ?        ?      181.9        4.2       ?       ? 
1 1 1   47   14   30 o    207.2    3.9    0.0000   0.0000          ?        ?   429.7251  15.9630          ?        ?      207.2        3.9       ?       ? 
1 1 1   47   14   31 f    146.9    5.2    0.0000   0.0000          ?        ?   216.4588  15.3245          ?        ?      146.9        5.2       ?       ? 
1 1 1   47   14   32 o    276.6    3.1    0.0000   0.0000          ?        ?   765.5875  17.2401          ?        ?      276.6        3.1       ?       ? 
1 1 1   47   14   33 o    112.5    6.8    0.0000   0.0000          ?        ?   127.0658  15.3245          ?        ?      112.5        6.8       ?       ? 
1 1 1   47   14   34 o    265.1    3.3    0.0000   0.0000          ?        ?   703.6508  17.2401          ?        ?      265.1        3.3       ?       ? 
1 1 1   47   14   35 o    185.7    4.5    0.0000   0.0000          ?        ?   345.4402  16.6016          ?        ?      185.7        4.5       ?       ? 
1 1 1   47   14   36 o    162.8    4.9    0.0000   0.0000          ?        ?   265.6250  15.9630          ?        ?      162.8        4.9       ?       ? 
1 1 1   47   14   37 o     35.5   14.4    0.0000   0.0000          ?        ?     5.7467  15.9630          ?        ?       35.5       14.4       ?       ? 
1 1 1   47   14   38 o     49.5   14.9    0.0000   0.0000          ?        ?    25.5409  15.9630          ?        ?       49.5       14.9       ?       ? 
1 1 1   47   14   39 o    348.0    2.8    0.0000   0.0000          ?        ?  1212.5525  19.7942          ?        ?      348.0        2.8       ?       ? 
1 1 1   47   14   40 o     81.3   10.2    0.0000   0.0000          ?        ?    67.0448  16.6016          ?        ?       81.3       10.2       ?       ? 
1 1 1   47   14   41 o     28.8   13.1    0.0000   0.0000          ?        ?    -9.5778  16.6016          ?        ?       28.8       13.1       ?       ? 
1 1 1   47   14   42 o    149.1    5.8    0.0000   0.0000          ?        ?   223.4826  17.2401          ?        ?      149.1        5.8       ?       ? 
1 1 1   47   14   43 o    100.8    8.2    0.0000   0.0000          ?        ?   102.8020  16.6016          ?        ?      100.8        8.2       ?       ? 
1 1 1   47   14   44 o     34.8   14.5    0.0000   0.0000          ?        ?     3.8311  16.6016          ?        ?       34.8       14.5       ?       ? 
1 1 1   47   14   45 o    149.4    5.8    0.0000   0.0000          ?        ?   224.7596  17.2401          ?        ?      149.4        5.8       ?       ? 
1 1 1   47   15    0 f    224.7    5.8  506.3477  26.1794   506.3477  26.1794   506.3477  26.1794      224.7      5.8      224.7        5.8     0.0     0.0 
1 1 1   47   15    1 o    295.1    3.6    0.0000   0.0000          ?        ?   871.5820  21.0712          ?        ?      295.1        3.6       ?       ? 
1 1 1   47   15    2 o    186.4    4.5    0.0000   0.0000          ?        ?   347.9943  16.6016          ?        ?      186.4        4.5       ?       ? 
1 1 1   47   15    3 o    146.4    5.0    0.0000   0.0000          ?        ?   214.5433  14.6860          ?        ?      146.4        5.0       ?       ? 
1 1 1   47   15    4 o    145.0    5.5    0.0000   0.0000          ?        ?   210.7121  15.9630          ?        ?      145.0        5.5       ?       ? 
1 1 1   47   15    5 o    359.9    3.2    0.0000   0.0000          ?        ?  1296.1989  22.9868          ?        ?      359.9        3.2       ?       ? 
1 1 1   47   15    6 o    239.9    3.1    0.0000   0.0000          ?        ?   575.9465  14.6860          ?        ?      239.9        3.1       ?       ? 
1 1 1   47   15    7 o    306.4    2.9    0.0000   0.0000          ?        ?   939.2654  17.8786          ?        ?      306.4        2.9       ?       ? 
1 1 1   47   15    8 o    124.2    5.4    0.0000   0.0000          ?        ?   154.5222  13.4090          ?        ?      124.2        5.4       ?       ? 
1 1 1   47   15    9 o    562.1    3.3    0.0000   0.0000          ?        ?  3161.9592  37.0343          ?        ?      562.1        3.3       ?       ? 
1 1 1   47   15   10 o    142.0    4.0    0.0000   0.0000          ?        ?   201.7728  11.4934          ?        ?      142.0        4.0       ?       ? 
1 1 1   47   15   11 o    259.1    3.1    0.0000   0.0000          ?        ?   671.7247  15.9630          ?        ?      259.1        3.1       ?       ? 
1 1 1   47   15   12 o    209.5    3.4    0.0000   0.0000          ?        ?   439.3029  14.0475          ?        ?      209.5        3.4       ?       ? 
1 1 1   47   15   13 o    161.1    3.6    0.0000   0.0000          ?        ?   259.8783  11.4934          ?        ?      161.1        3.6       ?       ? 
1 1 1   47   15   14 o     73.5    7.4    0.0000   0.0000          ?        ?    54.2743  10.8549          ?        ?       73.5        7.4       ?       ? 
1 1 1   47   15   15 o    214.9    3.3    0.0000   0.0000          ?        ?   462.2897  14.0475          ?        ?      214.9        3.3       ?       ? 
1 1 1   47   15   16 o    281.3    3.0    0.0000   0.0000          ?        ?   791.7668  16.6016          ?        ?      281.3        3.0       ?       ? 
1 1 1   47   15   17 o    135.7    4.7    0.0000   0.0000          ?        ?   184.5327  12.7704          ?        ?      135.7        4.7       ?       ? 
1 1 1   47   15   18 o    241.9    3.3    0.0000   0.0000          ?        ?   585.5243  15.9630          ?        ?      241.9        3.3       ?       ? 
1 1 1   47   15   19 o     87.4    7.3    0.0000   0.0000          ?        ?    76.6226  12.7704          ?        ?       87.4        7.3       ?       ? 
1 1 1   47   15   20 o     70.8    9.0    0.0000   0.0000          ?        ?    50.4432  12.7704          ?        ?       70.8        9.0       ?       ? 
1 1 1   47   15   21 o    198.4    3.7    0.0000   0.0000          ?        ?   393.9678  14.6860          ?        ?      198.4        3.7       ?       ? 
1 1 1   47   15   22 o    106.7    6.9    0.0000   0.0000          ?        ?   114.2954  14.6860          ?        ?      106.7        6.9       ?       ? 
1 1 1   47   15   23 f    295.0    2.8    0.0000   0.0000          ?        ?   870.9435  16.6016          ?        ?      295.0        2.8       ?       ? 
1 1 1   47   15   24 o     51.7   13.0    0.0000   0.0000          ?        ?    28.0950  13.4090          ?        ?       51.7       13.0       ?       ? 
1 1 1   47   15   25 o    185.9    4.1    0.0000   0.0000          ?        ?   346.0787  15.3245          ?        ?      185.9        4.1       ?       ? 
1 1 1   47   15   26 o     26.9   12.2    0.0000   0.0000          ?        ?    -7.6623  14.0475          ?        ?       26.9       12.2       ?       ? 
1 1 1   47   15   27 o    191.7    3.8    0.0000   0.0000          ?        ?   367.7885  14.6860          ?        ?      191.7        3.8       ?       ? 
1 1 1   47   15   28 o     43.4   14.8    0.0000   0.0000          ?        ?    17.8786  15.3245          ?        ?       43.4       14.8       ?       ? 
1 1 1   47   15   29 o    128.1    6.0    0.0000   0.0000          ?        ?   164.7386  15.3245          ?        ?      128.1        6.0       ?       ? 
1 1 1   47   15   30 o    152.5    5.0    0.0000   0.0000          ?        ?   233.0604  15.3245          ?        ?      152.5        5.0       ?       ? 
1 1 1   47   15   31 o    331.0    2.8    0.0000   0.0000          ?        ?  1096.3416  18.5171          ?        ?      331.0        2.8       ?       ? 
1 1 1   47   15   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47   15   33 o    121.7    6.3    0.0000   0.0000          ?        ?   148.7755  15.3245          ?        ?      121.7        6.3       ?       ? 
1 1 1   47   15   34 o    240.6    3.4    0.0000   0.0000          ?        ?   579.7776  16.6016          ?        ?      240.6        3.4       ?       ? 
1 1 1   47   15   35 o     26.0   12.2    0.0000   0.0000          ?        ?   -15.9630  15.9630          ?        ?       26.0       12.2       ?       ? 
1 1 1   47   15   36 o    158.4    5.0    0.0000   0.0000          ?        ?   251.5775  15.9630          ?        ?      158.4        5.0       ?       ? 
1 1 1   47   15   37 o    114.8    7.5    0.0000   0.0000          ?        ?   132.8125  17.2401          ?        ?      114.8        7.5       ?       ? 
1 1 1   47   15   38 o     78.1   10.6    0.0000   0.0000          ?        ?    61.9366  16.6016          ?        ?       78.1       10.6       ?       ? 
1 1 1   47   15   39 o    105.2    8.2    0.0000   0.0000          ?        ?   111.7413  17.2401          ?        ?      105.2        8.2       ?       ? 
1 1 1   47   15   40 o     50.5   15.2    0.0000   0.0000          ?        ?    26.8179  16.6016          ?        ?       50.5       15.2       ?       ? 
1 1 1   47   15   41 o     57.7   14.0    0.0000   0.0000          ?        ?    35.7572  15.9630          ?        ?       57.7       14.0       ?       ? 
1 1 1   47   15   42 o    195.8    4.1    0.0000   0.0000          ?        ?   384.3900  15.9630          ?        ?      195.8        4.1       ?       ? 
1 1 1   47   15   43 o    196.0    4.4    0.0000   0.0000          ?        ?   385.6671  17.2401          ?        ?      196.0        4.4       ?       ? 
1 1 1   47   15   44 o    113.5    7.3    0.0000   0.0000          ?        ?   130.2584  16.6016          ?        ?      113.5        7.3       ?       ? 
1 1 1   47   16    0 o    240.0    5.1  577.2236  24.2638   577.2236  24.2638   577.2236  24.2638      240.0      5.1      240.0        5.1     0.0     0.0 
1 1 1   47   16    1 o    222.5    4.0    0.0000   0.0000          ?        ?   495.4928  17.8786          ?        ?      222.5        4.0       ?       ? 
1 1 1   47   16    2 o    264.6    3.6    0.0000   0.0000          ?        ?   700.4582  19.1556          ?        ?      264.6        3.6       ?       ? 
1 1 1   47   16    3 o     65.5   12.1    0.0000   0.0000          ?        ?    44.6965  15.3245          ?        ?       65.5       12.1       ?       ? 
1 1 1   47   16    4 o     76.4   10.4    0.0000   0.0000          ?        ?    58.7440  15.9630          ?        ?       76.4       10.4       ?       ? 
1 1 1   47   16    5 o    365.5    3.6    0.0000   0.0000          ?        ?  1337.0642  26.1794          ?        ?      365.5        3.6       ?       ? 
1 1 1   47   16    6 o    299.2    3.8    0.0000   0.0000          ?        ?   895.8459  22.9868          ?        ?      299.2        3.8       ?       ? 
1 1 1   47   16    7 o    133.6    5.0    0.0000   0.0000          ?        ?   178.7861  13.4090          ?        ?      133.6        5.0       ?       ? 
1 1 1   47   16    8 o    319.2    3.0    0.0000   0.0000          ?        ?  1019.7190  19.1556          ?        ?      319.2        3.0       ?       ? 
1 1 1   47   16    9 o    323.5    3.2    0.0000   0.0000          ?        ?  1047.1754  20.4327          ?        ?      323.5        3.2       ?       ? 
1 1 1   47   16   10 o    496.3    3.3    0.0000   0.0000          ?        ?  2464.6934  32.5646          ?        ?      496.3        3.3       ?       ? 
1 1 1   47   16   11 o    421.5    3.3    0.0000   0.0000          ?        ?  1778.2827  28.0950          ?        ?      421.5        3.3       ?       ? 
1 1 1   47   16   12 o    318.7    3.4    0.0000   0.0000          ?        ?  1016.5264  21.7097          ?        ?      318.7        3.4       ?       ? 
1 1 1   47   16   13 o    404.5    2.9    0.0000   0.0000          ?        ?  1637.1694  23.6253          ?        ?      404.5        2.9       ?       ? 
1 1 1   47   16   14 o    401.5    2.7    0.0000   0.0000          ?        ?  1612.9056  21.7097          ?        ?      401.5        2.7       ?       ? 
1 1 1   47   16   15 o    234.2    3.3    0.0000   0.0000          ?        ?   549.1286  15.3245          ?        ?      234.2        3.3       ?       ? 
1 1 1   47   16   16 o    269.6    2.8    0.0000   0.0000          ?        ?   727.2761  15.3245          ?        ?      269.6        2.8       ?       ? 
1 1 1   47   16   17 o    158.5    3.8    0.0000   0.0000          ?        ?   251.5775  12.1319          ?        ?      158.5        3.8       ?       ? 
1 1 1   47   16   18 o    136.2    4.9    0.0000   0.0000          ?        ?   185.8098  13.4090          ?        ?      136.2        4.9       ?       ? 
1 1 1   47   16   19 o    139.0    4.8    0.0000   0.0000          ?        ?   193.4720  13.4090          ?        ?      139.0        4.8       ?       ? 
1 1 1   47   16   20 o    131.7    5.1    0.0000   0.0000          ?        ?   173.6779  13.4090          ?        ?      131.7        5.1       ?       ? 
1 1 1   47   16   21 o     61.7   11.3    0.0000   0.0000          ?        ?    39.5883  13.4090          ?        ?       61.7       11.3       ?       ? 
1 1 1   47   16   22 o    113.7    6.5    0.0000   0.0000          ?        ?   129.6199  14.6860          ?        ?      113.7        6.5       ?       ? 
1 1 1   47   16   23 o    140.3    5.0    0.0000   0.0000          ?        ?   197.3032  14.0475          ?        ?      140.3        5.0       ?       ? 
1 1 1   47   16   24 o    314.1    2.8    0.0000   0.0000          ?        ?   987.1545  17.8786          ?        ?      314.1        2.8       ?       ? 
1 1 1   47   16   25 o    206.5    3.9    0.0000   0.0000          ?        ?   427.1710  15.9630          ?        ?      206.5        3.9       ?       ? 
1 1 1   47   16   26 o    266.5    3.2    0.0000   0.0000          ?        ?   710.6746  17.2401          ?        ?      266.5        3.2       ?       ? 
1 1 1   47   16   27 o     96.0    7.7    0.0000   0.0000          ?        ?    92.5856  14.6860          ?        ?       96.0        7.7       ?       ? 
1 1 1   47   16   28 f    296.9    2.9    0.0000   0.0000          ?        ?   882.4369  17.2401          ?        ?      296.9        2.9       ?       ? 
1 1 1   47   16   29 o    253.6    3.3    0.0000   0.0000          ?        ?   643.6298  16.6016          ?        ?      253.6        3.3       ?       ? 
1 1 1   47   16   30 o     48.3   14.2    0.0000   0.0000          ?        ?    24.2638  14.6860          ?        ?       48.3       14.2       ?       ? 
1 1 1   47   16   31 o    166.3    4.6    0.0000   0.0000          ?        ?   277.1184  15.3245          ?        ?      166.3        4.6       ?       ? 
1 1 1   47   16   32 o    322.7    2.9    0.0000   0.0000          ?        ?  1042.0673  18.5171          ?        ?      322.7        2.9       ?       ? 
1 1 1   47   16   33 o    190.9    4.0    0.0000   0.0000          ?        ?   365.2344  15.3245          ?        ?      190.9        4.0       ?       ? 
1 1 1   47   16   34 o    399.1    2.7    0.0000   0.0000          ?        ?  1594.3884  21.7097          ?        ?      399.1        2.7       ?       ? 
1 1 1   47   16   35 o     71.3   11.2    0.0000   0.0000          ?        ?    51.7203  15.9630          ?        ?       71.3       11.2       ?       ? 
1 1 1   47   16   36 o     98.7    8.1    0.0000   0.0000          ?        ?    98.3323  15.9630          ?        ?       98.7        8.1       ?       ? 
1 1 1   47   16   37 o     56.3   14.2    0.0000   0.0000          ?        ?    33.8416  15.9630          ?        ?       56.3       14.2       ?       ? 
1 1 1   47   16   38 o    234.7    3.5    0.0000   0.0000          ?        ?   551.6827  16.6016          ?        ?      234.7        3.5       ?       ? 
1 1 1   47   16   39 o    164.2    5.1    0.0000   0.0000          ?        ?   270.7332  16.6016          ?        ?      164.2        5.1       ?       ? 
1 1 1   47   16   40 o     91.8    9.0    0.0000   0.0000          ?        ?    85.5619  16.6016          ?        ?       91.8        9.0       ?       ? 
1 1 1   47   16   41 o    170.3    4.9    0.0000   0.0000          ?        ?   291.1659  16.6016          ?        ?      170.3        4.9       ?       ? 
1 1 1   47   16   42 o     60.6   14.0    0.0000   0.0000          ?        ?    39.5883  16.6016          ?        ?       60.6       14.0       ?       ? 
1 1 1   47   16   43 o     87.8    9.5    0.0000   0.0000          ?        ?    78.5382  16.6016          ?        ?       87.8        9.5       ?       ? 
1 1 1   47   17    0 o    270.8    5.2  734.9384  28.0950   734.9384  28.0950   734.9384  28.0950      270.8      5.2      270.8        5.2     0.0     0.0 
1 1 1   47   17    1 f    284.8    3.6    0.0000   0.0000          ?        ?   811.5610  20.4327          ?        ?      284.8        3.6       ?       ? 
1 1 1   47   17    2 o    253.7    3.8    0.0000   0.0000          ?        ?   644.2683  19.1556          ?        ?      253.7        3.8       ?       ? 
1 1 1   47   17    3 o    295.6    3.8    0.0000   0.0000          ?        ?   874.7747  22.3483          ?        ?      295.6        3.8       ?       ? 
1 1 1   47   17    4 o    174.7    5.1    0.0000   0.0000          ?        ?   305.8519  17.8786          ?        ?      174.7        5.1       ?       ? 
1 1 1   47   17    5 o    199.5    4.8    0.0000   0.0000          ?        ?   398.4375  19.1556          ?        ?      199.5        4.8       ?       ? 
1 1 1   47   17    6 o    376.8    3.9    0.0000   0.0000          ?        ?  1421.3491  29.3720          ?        ?      376.8        3.9       ?       ? 
1 1 1   47   17    7 o    245.3    3.9    0.0000   0.0000          ?        ?   602.1259  19.1556          ?        ?      245.3        3.9       ?       ? 
1 1 1   47   17    8 o    189.7    3.7    0.0000   0.0000          ?        ?   360.1262  14.0475          ?        ?      189.7        3.7       ?       ? 
1 1 1   47   17    9 o    330.9    3.1    0.0000   0.0000          ?        ?  1095.7031  20.4327          ?        ?      330.9        3.1       ?       ? 
1 1 1   47   17   10 o    444.3    3.1    0.0000   0.0000          ?        ?  1975.5858  27.4564          ?        ?      444.3        3.1       ?       ? 
1 1 1   47   17   11 o    526.1    3.2    0.0000   0.0000          ?        ?  2769.9067  33.8416          ?        ?      526.1        3.2       ?       ? 
1 1 1   47   17   12 o    308.5    3.4    0.0000   0.0000          ?        ?   952.6743  21.0712          ?        ?      308.5        3.4       ?       ? 
1 1 1   47   17   13 f    263.3    3.3    0.0000   0.0000          ?        ?   694.0730  17.2401          ?        ?      263.3        3.3       ?       ? 
1 1 1   47   17   14 o    259.2    2.8    0.0000   0.0000          ?        ?   672.3633  14.6860          ?        ?      259.2        2.8       ?       ? 
1 1 1   47   17   15 o    227.0    3.2    0.0000   0.0000          ?        ?   515.9255  14.6860          ?        ?      227.0        3.2       ?       ? 
1 1 1   47   17   16 o    215.8    3.4    0.0000   0.0000          ?        ?   466.1208  14.6860          ?        ?      215.8        3.4       ?       ? 
1 1 1   47   17   17 o    185.2    4.1    0.0000   0.0000          ?        ?   343.5246  15.3245          ?        ?      185.2        4.1       ?       ? 
1 1 1   47   17   18 o     17.5    8.8    0.0000   0.0000          ?        ?   -43.4195  14.0475          ?        ?       17.5        8.8       ?       ? 
1 1 1   47   17   19 o    147.4    5.0    0.0000   0.0000          ?        ?   217.7359  14.6860          ?        ?      147.4        5.0       ?       ? 
1 1 1   47   17   20 o    158.9    4.2    0.0000   0.0000          ?        ?   252.8546  13.4090          ?        ?      158.9        4.2       ?       ? 
1 1 1   47   17   21 o    171.1    4.1    0.0000   0.0000          ?        ?   293.0815  14.0475          ?        ?      171.1        4.1       ?       ? 
1 1 1   47   17   22 o    271.4    2.8    0.0000   0.0000          ?        ?   736.8539  15.3245          ?        ?      271.4        2.8       ?       ? 
1 1 1   47   17   23 o    453.2    2.7    0.0000   0.0000          ?        ?  2055.4011  24.9023          ?        ?      453.2        2.7       ?       ? 
1 1 1   47   17   24 o    287.2    3.0    0.0000   0.0000          ?        ?   825.6085  17.2401          ?        ?      287.2        3.0       ?       ? 
1 1 1   47   17   25 o    305.5    2.9    0.0000   0.0000          ?        ?   934.1572  17.8786          ?        ?      305.5        2.9       ?       ? 
1 1 1   47   17   26 o    198.0    4.0    0.0000   0.0000          ?        ?   392.6908  15.9630          ?        ?      198.0        4.0       ?       ? 
1 1 1   47   17   27 o    239.5    3.3    0.0000   0.0000          ?        ?   574.0309  15.9630          ?        ?      239.5        3.3       ?       ? 
1 1 1   47   17   28 o     19.0    9.4    0.0000   0.0000          ?        ?   -35.1187  14.0475          ?        ?       19.0        9.4       ?       ? 
1 1 1   47   17   29 o    120.7    6.4    0.0000   0.0000          ?        ?   146.2215  15.3245          ?        ?      120.7        6.4       ?       ? 
1 1 1   47   17   30 o     25.6   11.9    0.0000   0.0000          ?        ?   -12.7704  14.6860          ?        ?       25.6       11.9       ?       ? 
1 1 1   47   17   31 f    453.7    2.7    0.0000   0.0000          ?        ?  2060.5093  24.9023          ?        ?      453.7        2.7       ?       ? 
1 1 1   47   17   32 o    121.7    6.6    0.0000   0.0000          ?        ?   148.7755  15.9630          ?        ?      121.7        6.6       ?       ? 
1 1 1   47   17   33 o    372.7    2.7    0.0000   0.0000          ?        ?  1390.7001  20.4327          ?        ?      372.7        2.7       ?       ? 
1 1 1   47   17   34 o     37.7   14.5    0.0000   0.0000          ?        ?    10.2163  15.3245          ?        ?       37.7       14.5       ?       ? 
1 1 1   47   17   35 o     76.1   10.1    0.0000   0.0000          ?        ?    58.7440  15.3245          ?        ?       76.1       10.1       ?       ? 
1 1 1   47   17   36 o    210.0    4.0    0.0000   0.0000          ?        ?   441.8569  16.6016          ?        ?      210.0        4.0       ?       ? 
1 1 1   47   17   37 o    389.4    2.7    0.0000   0.0000          ?        ?  1517.7659  21.0712          ?        ?      389.4        2.7       ?       ? 
1 1 1   47   17   38 o    229.7    3.8    0.0000   0.0000          ?        ?   528.6959  17.2401          ?        ?      229.7        3.8       ?       ? 
1 1 1   47   17   39 o    240.4    3.6    0.0000   0.0000          ?        ?   579.1391  17.2401          ?        ?      240.4        3.6       ?       ? 
1 1 1   47   17   40 o    128.9    6.2    0.0000   0.0000          ?        ?   167.2927  15.9630          ?        ?      128.9        6.2       ?       ? 
1 1 1   47   17   41 o     29.0   13.1    0.0000   0.0000          ?        ?    -7.0237  15.9630          ?        ?       29.0       13.1       ?       ? 
1 1 1   47   18    0 o    222.5    6.2  496.7698  27.4564   496.7698  27.4564   496.7698  27.4564      222.5      6.2      222.5        6.2     0.0     0.0 
1 1 1   47   18    1 o    155.2    5.3    0.0000   0.0000          ?        ?   241.3612  16.6016          ?        ?      155.2        5.3       ?       ? 
1 1 1   47   18    2 o    218.7    4.1    0.0000   0.0000          ?        ?   478.8912  17.8786          ?        ?      218.7        4.1       ?       ? 
1 1 1   47   18    3 o    244.0    3.8    0.0000   0.0000          ?        ?   595.7407  18.5171          ?        ?      244.0        3.8       ?       ? 
1 1 1   47   18    4 o    230.6    4.3    0.0000   0.0000          ?        ?   532.5270  19.7942          ?        ?      230.6        4.3       ?       ? 
1 1 1   47   18    5 o     27.4   12.5    0.0000   0.0000          ?        ?   -10.2163  15.3245          ?        ?       27.4       12.5       ?       ? 
1 1 1   47   18    6 f    230.2    4.0    0.0000   0.0000          ?        ?   530.6115  18.5171          ?        ?      230.2        4.0       ?       ? 
1 1 1   47   18    7 o    437.4    3.6    0.0000   0.0000          ?        ?  1914.9263  31.9261          ?        ?      437.4        3.6       ?       ? 
1 1 1   47   18    8 o    265.5    4.0    0.0000   0.0000          ?        ?   705.5664  21.0712          ?        ?      265.5        4.0       ?       ? 
1 1 1   47   18    9 o    208.2    4.4    0.0000   0.0000          ?        ?   434.1947  18.5171          ?        ?      208.2        4.4       ?       ? 
1 1 1   47   18   10 o     44.3   12.5    0.0000   0.0000          ?        ?    20.4327  11.4934          ?        ?       44.3       12.5       ?       ? 
1 1 1   47   18   11 o    216.4    3.5    0.0000   0.0000          ?        ?   468.6749  15.3245          ?        ?      216.4        3.5       ?       ? 
1 1 1   47   18   12 o    213.0    3.7    0.0000   0.0000          ?        ?   453.9889  15.9630          ?        ?      213.0        3.7       ?       ? 
1 1 1   47   18   13 o     84.0    8.0    0.0000   0.0000          ?        ?    70.8759  13.4090          ?        ?       84.0        8.0       ?       ? 
1 1 1   47   18   14 o     20.9   10.3    0.0000   0.0000          ?        ?   -29.3720  14.6860          ?        ?       20.9       10.3       ?       ? 
1 1 1   47   18   15 o    205.1    4.2    0.0000   0.0000          ?        ?   421.4243  17.2401          ?        ?      205.1        4.2       ?       ? 
1 1 1   47   18   16 o    272.4    2.8    0.0000   0.0000          ?        ?   742.6006  15.3245          ?        ?      272.4        2.8       ?       ? 
1 1 1   47   18   17 o    148.5    3.9    0.0000   0.0000          ?        ?   220.9285  11.4934          ?        ?      148.5        3.9       ?       ? 
1 1 1   47   18   18 o    336.3    3.0    0.0000   0.0000          ?        ?  1132.0989  20.4327          ?        ?      336.3        3.0       ?       ? 
1 1 1   47   18   19 o     86.2    7.8    0.0000   0.0000          ?        ?    74.7070  13.4090          ?        ?       86.2        7.8       ?       ? 
1 1 1   47   18   20 o     71.6   10.3    0.0000   0.0000          ?        ?    51.7203  14.6860          ?        ?       71.6       10.3       ?       ? 
1 1 1   47   18   21 o    293.0    2.9    0.0000   0.0000          ?        ?   859.4501  17.2401          ?        ?      293.0        2.9       ?       ? 
1 1 1   47   18   22 o    227.6    3.5    0.0000   0.0000          ?        ?   518.4796  15.9630          ?        ?      227.6        3.5       ?       ? 
1 1 1   47   18   23 f    103.4    6.5    0.0000   0.0000          ?        ?   107.2716  13.4090          ?        ?      103.4        6.5       ?       ? 
1 1 1   47   18   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47   18   25 o    255.1    3.3    0.0000   0.0000          ?        ?   651.2921  16.6016          ?        ?      255.1        3.3       ?       ? 
1 1 1   47   18   26 o    370.5    2.8    0.0000   0.0000          ?        ?  1373.4601  20.4327          ?        ?      370.5        2.8       ?       ? 
1 1 1   47   18   27 o    149.3    5.1    0.0000   0.0000          ?        ?   223.4826  15.3245          ?        ?      149.3        5.1       ?       ? 
1 1 1   47   18   28 o    135.8    5.6    0.0000   0.0000          ?        ?   185.1713  15.3245          ?        ?      135.8        5.6       ?       ? 
1 1 1   47   18   29 o    163.8    4.5    0.0000   0.0000          ?        ?   268.8176  14.6860          ?        ?      163.8        4.5       ?       ? 
1 1 1   47   18   30 o    109.3    6.7    0.0000   0.0000          ?        ?   120.0421  14.6860          ?        ?      109.3        6.7       ?       ? 
1 1 1   47   18   31 o    111.3    6.6    0.0000   0.0000          ?        ?   124.5117  14.6860          ?        ?      111.3        6.6       ?       ? 
1 1 1   47   18   32 o    365.6    2.7    0.0000   0.0000          ?        ?  1337.7028  19.7942          ?        ?      365.6        2.7       ?       ? 
1 1 1   47   18   33 o     27.5   12.5    0.0000   0.0000          ?        ?    -9.5778  15.3245          ?        ?       27.5       12.5       ?       ? 
1 1 1   47   18   34 o     77.7    9.9    0.0000   0.0000          ?        ?    61.2981  15.3245          ?        ?       77.7        9.9       ?       ? 
1 1 1   47   18   35 o    336.0    2.9    0.0000   0.0000          ?        ?  1130.1832  19.1556          ?        ?      336.0        2.9       ?       ? 
1 1 1   47   18   36 o    318.2    2.9    0.0000   0.0000          ?        ?  1013.9724  18.5171          ?        ?      318.2        2.9       ?       ? 
1 1 1   47   18   37 o    205.3    4.0    0.0000   0.0000          ?        ?   422.7013  16.6016          ?        ?      205.3        4.0       ?       ? 
1 1 1   47   18   38 o     66.8   12.4    0.0000   0.0000          ?        ?    47.2506  15.9630          ?        ?       66.8       12.4       ?       ? 
1 1 1   47   18   39 o     86.5    8.9    0.0000   0.0000          ?        ?    75.9841  15.3245          ?        ?       86.5        8.9       ?       ? 
1 1 1   47   18   40 o    113.5    7.0    0.0000   0.0000          ?        ?   130.2584  15.9630          ?        ?      113.5        7.0       ?       ? 
1 1 1   47   19    0 o     22.2   15.6  -22.3483  24.9023   -22.3483  24.9023   -22.3483  24.9023       22.2     15.6       22.2       15.6     0.0     0.0 
1 1 1   47   19    1 o    135.2    6.4    0.0000   0.0000          ?        ?   183.2557  17.2401          ?        ?      135.2        6.4       ?       ? 
1 1 1   47   19    2 o    149.3    5.8    0.0000   0.0000          ?        ?   223.4826  17.2401          ?        ?      149.3        5.8       ?       ? 
1 1 1   47   19    3 o    146.3    5.2    0.0000   0.0000          ?        ?   214.5433  15.3245          ?        ?      146.3        5.2       ?       ? 
1 1 1   47   19    4 o     43.8   15.1    0.0000   0.0000          ?        ?    17.8786  15.9630          ?        ?       43.8       15.1       ?       ? 
1 1 1   47   19    5 o    200.5    4.8    0.0000   0.0000          ?        ?   402.9071  19.1556          ?        ?      200.5        4.8       ?       ? 
1 1 1   47   19    6 o    289.8    4.1    0.0000   0.0000          ?        ?   840.9330  23.6253          ?        ?      289.8        4.1       ?       ? 
1 1 1   47   19    7 o    190.7    5.4    0.0000   0.0000          ?        ?   364.5958  20.4327          ?        ?      190.7        5.4       ?       ? 
1 1 1   47   19    8 o    118.3    7.6    0.0000   0.0000          ?        ?   140.4748  17.8786          ?        ?      118.3        7.6       ?       ? 
1 1 1   47   19    9 o    247.1    4.3    0.0000   0.0000          ?        ?   611.7037  21.0712          ?        ?      247.1        4.3       ?       ? 
1 1 1   47   19   10 o    405.2    4.5    0.0000   0.0000          ?        ?  1644.8318  36.3957          ?        ?      405.2        4.5       ?       ? 
1 1 1   47   19   11 o    506.8    3.8    0.0000   0.0000          ?        ?  2571.3267  38.3113          ?        ?      506.8        3.8       ?       ? 
1 1 1   47   19   12 o    320.4    3.2    0.0000   0.0000          ?        ?  1027.3812  20.4327          ?        ?      320.4        3.2       ?       ? 
1 1 1   47   19   13 o    118.3    5.9    0.0000   0.0000          ?        ?   140.4748  14.0475          ?        ?      118.3        5.9       ?       ? 
1 1 1   47   19   14 o    181.0    4.4    0.0000   0.0000          ?        ?   328.2001  15.9630          ?        ?      181.0        4.4       ?       ? 
1 1 1   47   19   15 o     26.7   12.5    0.0000   0.0000          ?        ?   -15.9630  16.6016          ?        ?       26.7       12.5       ?       ? 
1 1 1   47   19   16 o    159.6    5.2    0.0000   0.0000          ?        ?   255.4086  16.6016          ?        ?      159.6        5.2       ?       ? 
1 1 1   47   19   17 o    213.3    4.2    0.0000   0.0000          ?        ?   455.9044  17.8786          ?        ?      213.3        4.2       ?       ? 
1 1 1   47   19   18 f    348.2    2.6    0.0000   0.0000          ?        ?  1213.1910  17.8786          ?        ?      348.2        2.6       ?       ? 
1 1 1   47   19   19 o    226.1    3.0    0.0000   0.0000          ?        ?   511.4558  13.4090          ?        ?      226.1        3.0       ?       ? 
1 1 1   47   19   20 o    102.8    5.9    0.0000   0.0000          ?        ?   105.9946  12.1319          ?        ?      102.8        5.9       ?       ? 
1 1 1   47   19   21 o     20.9   10.2    0.0000   0.0000          ?        ?   -26.1794  14.0475          ?        ?       20.9       10.2       ?       ? 
1 1 1   47   19   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47   19   23 o    200.7    3.8    0.0000   0.0000          ?        ?   403.5457  15.3245          ?        ?      200.7        3.8       ?       ? 
1 1 1   47   19   24 o    227.4    3.7    0.0000   0.0000          ?        ?   517.8410  16.6016          ?        ?      227.4        3.7       ?       ? 
1 1 1   47   19   25 o    387.2    2.7    0.0000   0.0000          ?        ?  1500.5259  21.0712          ?        ?      387.2        2.7       ?       ? 
1 1 1   47   19   26 o    187.6    3.9    0.0000   0.0000          ?        ?   352.4639  14.6860          ?        ?      187.6        3.9       ?       ? 
1 1 1   47   19   27 o    189.1    4.1    0.0000   0.0000          ?        ?   358.2106  15.3245          ?        ?      189.1        4.1       ?       ? 
1 1 1   47   19   28 o    194.1    4.1    0.0000   0.0000          ?        ?   377.3663  15.9630          ?        ?      194.1        4.1       ?       ? 
1 1 1   47   19   29 o     75.4    9.3    0.0000   0.0000          ?        ?    57.4669  14.0475          ?        ?       75.4        9.3       ?       ? 
1 1 1   47   19   30 o     31.8   13.4    0.0000   0.0000          ?        ?     1.2770  14.6860          ?        ?       31.8       13.4       ?       ? 
1 1 1   47   19   31 o    133.2    5.8    0.0000   0.0000          ?        ?   178.1475  15.3245          ?        ?      133.2        5.8       ?       ? 
1 1 1   47   19   32 f    129.0    5.9    0.0000   0.0000          ?        ?   167.2927  15.3245          ?        ?      129.0        5.9       ?       ? 
1 1 1   47   19   33 o    443.7    2.7    0.0000   0.0000          ?        ?  1971.1163  23.6253          ?        ?      443.7        2.7       ?       ? 
1 1 1   47   19   34 o    119.7    6.4    0.0000   0.0000          ?        ?   144.3059  15.3245          ?        ?      119.7        6.4       ?       ? 
1 1 1   47   19   35 o    169.7    4.9    0.0000   0.0000          ?        ?   289.2503  16.6016          ?        ?      169.7        4.9       ?       ? 
1 1 1   47   19   36 o     84.3    9.1    0.0000   0.0000          ?        ?    72.1529  15.3245          ?        ?       84.3        9.1       ?       ? 
1 1 1   47   19   37 o     48.7   15.0    0.0000   0.0000          ?        ?    24.9023  15.9630          ?        ?       48.7       15.0       ?       ? 
1 1 1   47   19   38 o     31.9   13.7    0.0000   0.0000          ?        ?    -0.6385  15.9630          ?        ?       31.9       13.7       ?       ? 
1 1 1   47   20    0 o     86.6   15.4   81.7308  24.2638    81.7308  24.2638    81.7308  24.2638       86.6     15.4       86.6       15.4     0.0     0.0 
1 1 1   47   20    1 o    103.9    8.0    0.0000   0.0000          ?        ?   108.5487  16.6016          ?        ?      103.9        8.0       ?       ? 
1 1 1   47   20    2 o    403.6    4.3    0.0000   0.0000          ?        ?  1631.4227  34.4802          ?        ?      403.6        4.3       ?       ? 
1 1 1   47   20    3 o    307.6    4.2    0.0000   0.0000          ?        ?   947.5660  25.5409          ?        ?      307.6        4.2       ?       ? 
1 1 1   47   20    4 o    145.6    5.5    0.0000   0.0000          ?        ?   212.6277  15.9630          ?        ?      145.6        5.5       ?       ? 
1 1 1   47   20    5 o    164.7    6.0    0.0000   0.0000          ?        ?   272.0102  19.7942          ?        ?      164.7        6.0       ?       ? 
1 1 1   47   20    6 o     90.3   10.6    0.0000   0.0000          ?        ?    82.3693  19.1556          ?        ?       90.3       10.6       ?       ? 
1 1 1   47   20    7 o    381.8    3.8    0.0000   0.0000          ?        ?  1459.6605  29.3720          ?        ?      381.8        3.8       ?       ? 
1 1 1   47   20    8 o    151.8    5.5    0.0000   0.0000          ?        ?   231.1448  16.6016          ?        ?      151.8        5.5       ?       ? 
1 1 1   47   20    9 o    221.0    4.3    0.0000   0.0000          ?        ?   489.1075  19.1556          ?        ?      221.0        4.3       ?       ? 
1 1 1   47   20   10 o     79.1   10.9    0.0000   0.0000          ?        ?    63.2136  17.2401          ?        ?       79.1       10.9       ?       ? 
1 1 1   47   20   11 o    306.9    3.7    0.0000   0.0000          ?        ?   943.0964  22.9868          ?        ?      306.9        3.7       ?       ? 
1 1 1   47   20   12 o    128.9    5.9    0.0000   0.0000          ?        ?   166.6541  15.3245          ?        ?      128.9        5.9       ?       ? 
1 1 1   47   20   13 o     87.3    8.0    0.0000   0.0000          ?        ?    76.6226  14.0475          ?        ?       87.3        8.0       ?       ? 
1 1 1   47   20   14 o    113.9    6.4    0.0000   0.0000          ?        ?   130.2584  14.6860          ?        ?      113.9        6.4       ?       ? 
1 1 1   47   20   15 o    356.1    3.6    0.0000   0.0000          ?        ?  1269.3810  25.5409          ?        ?      356.1        3.6       ?       ? 
1 1 1   47   20   16 o    224.8    4.0    0.0000   0.0000          ?        ?   506.3477  17.8786          ?        ?      224.8        4.0       ?       ? 
1 1 1   47   20   17 o    433.1    3.3    0.0000   0.0000          ?        ?  1877.8921  28.7335          ?        ?      433.1        3.3       ?       ? 
1 1 1   47   20   18 o    124.6    6.2    0.0000   0.0000          ?        ?   155.7993  15.3245          ?        ?      124.6        6.2       ?       ? 
1 1 1   47   20   19 o    184.9    3.3    0.0000   0.0000          ?        ?   342.2476  12.1319          ?        ?      184.9        3.3       ?       ? 
1 1 1   47   20   20 o    461.2    2.7    0.0000   0.0000          ?        ?  2128.8311  24.9023          ?        ?      461.2        2.7       ?       ? 
1 1 1   47   20   21 o    177.1    3.8    0.0000   0.0000          ?        ?   314.1526  13.4090          ?        ?      177.1        3.8       ?       ? 
1 1 1   47   20   22 o    211.1    3.2    0.0000   0.0000          ?        ?   446.3266  13.4090          ?        ?      211.1        3.2       ?       ? 
1 1 1   47   20   23 o    167.1    4.2    0.0000   0.0000          ?        ?   279.6725  14.0475          ?        ?      167.1        4.2       ?       ? 
1 1 1   47   20   24 o    188.1    3.9    0.0000   0.0000          ?        ?   354.3795  14.6860          ?        ?      188.1        3.9       ?       ? 
1 1 1   47   20   25 o     18.8    9.3    0.0000   0.0000          ?        ?   -31.9261  13.4090          ?        ?       18.8        9.3       ?       ? 
1 1 1   47   20   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47   20   27 o    227.1    3.7    0.0000   0.0000          ?        ?   516.5640  16.6016          ?        ?      227.1        3.7       ?       ? 
1 1 1   47   20   28 o    137.4    5.6    0.0000   0.0000          ?        ?   189.6409  15.3245          ?        ?      137.4        5.6       ?       ? 
1 1 1   47   20   29 o    231.5    3.6    0.0000   0.0000          ?        ?   536.9967  16.6016          ?        ?      231.5        3.6       ?       ? 
1 1 1   47   20   30 o    132.7    5.8    0.0000   0.0000          ?        ?   176.8705  15.3245          ?        ?      132.7        5.8       ?       ? 
1 1 1   47   20   31 o    220.0    3.8    0.0000   0.0000          ?        ?   485.2764  16.6016          ?        ?      220.0        3.8       ?       ? 
1 1 1   47   20   32 o    135.9    5.9    0.0000   0.0000          ?        ?   185.8098  15.9630          ?        ?      135.9        5.9       ?       ? 
1 1 1   47   20   33 o     19.7    9.8    0.0000   0.0000          ?        ?   -34.4802  14.6860          ?        ?       19.7        9.8       ?       ? 
1 1 1   47   20   34 o     17.2    8.7    0.0000   0.0000          ?        ?   -45.3350  14.0475          ?        ?       17.2        8.7       ?       ? 
1 1 1   47   20   35 o    100.5    7.6    0.0000   0.0000          ?        ?   102.1635  15.3245          ?        ?      100.5        7.6       ?       ? 
1 1 1   47   20   36 o    113.0    7.1    0.0000   0.0000          ?        ?   128.9814  15.9630          ?        ?      113.0        7.1       ?       ? 
1 1 1   47   21    0 o     17.1   12.5  -45.3350  22.9868   -45.3350  22.9868   -45.3350  22.9868       17.1     12.5       17.1       12.5     0.0     0.0 
1 1 1   47   21    1 o    139.8    5.7    0.0000   0.0000          ?        ?   196.0261  15.9630          ?        ?      139.8        5.7       ?       ? 
1 1 1   47   21    2 o    215.9    4.4    0.0000   0.0000          ?        ?   466.7593  19.1556          ?        ?      215.9        4.4       ?       ? 
1 1 1   47   21    3 o    144.2    6.4    0.0000   0.0000          ?        ?   208.7966  18.5171          ?        ?      144.2        6.4       ?       ? 
1 1 1   47   21    4 o    397.7    3.9    0.0000   0.0000          ?        ?  1583.5337  31.2876          ?        ?      397.7        3.9       ?       ? 
1 1 1   47   21    5 o    123.8    6.4    0.0000   0.0000          ?        ?   153.8837  15.9630          ?        ?      123.8        6.4       ?       ? 
1 1 1   47   21    6 o    228.6    4.6    0.0000   0.0000          ?        ?   523.5877  21.0712          ?        ?      228.6        4.6       ?       ? 
1 1 1   47   21    7 o     33.8   14.6    0.0000   0.0000          ?        ?    -1.2770  17.8786          ?        ?       33.8       14.6       ?       ? 
1 1 1   47   21    8 o    251.5    4.2    0.0000   0.0000          ?        ?   633.4135  21.0712          ?        ?      251.5        4.2       ?       ? 
1 1 1   47   21    9 o    109.8    7.6    0.0000   0.0000          ?        ?   121.3191  16.6016          ?        ?      109.8        7.6       ?       ? 
1 1 1   47   21   10 o    280.1    4.7    0.0000   0.0000          ?        ?   786.0201  26.1794          ?        ?      280.1        4.7       ?       ? 
1 1 1   47   21   11 o    211.1    5.4    0.0000   0.0000          ?        ?   446.9651  22.9868          ?        ?      211.1        5.4       ?       ? 
1 1 1   47   21   12 o    342.7    4.4    0.0000   0.0000          ?        ?  1176.7954  30.0105          ?        ?      342.7        4.4       ?       ? 
1 1 1   47   21   13 o    453.7    3.7    0.0000   0.0000          ?        ?  2061.1477  33.8416          ?        ?      453.7        3.7       ?       ? 
1 1 1   47   21   14 f    320.5    3.3    0.0000   0.0000          ?        ?  1028.0198  21.0712          ?        ?      320.5        3.3       ?       ? 
1 1 1   47   21   15 o    253.2    3.9    0.0000   0.0000          ?        ?   642.3527  19.7942          ?        ?      253.2        3.9       ?       ? 
1 1 1   47   21   16 o    109.3    6.7    0.0000   0.0000          ?        ?   120.0421  14.6860          ?        ?      109.3        6.7       ?       ? 
1 1 1   47   21   17 o    275.6    3.5    0.0000   0.0000          ?        ?   760.4792  19.1556          ?        ?      275.6        3.5       ?       ? 
1 1 1   47   21   18 o    191.6    4.5    0.0000   0.0000          ?        ?   367.7885  17.2401          ?        ?      191.6        4.5       ?       ? 
1 1 1   47   21   19 o    289.7    3.4    0.0000   0.0000          ?        ?   840.2945  19.7942          ?        ?      289.7        3.4       ?       ? 
1 1 1   47   21   20 o    457.6    2.7    0.0000   0.0000          ?        ?  2095.6282  24.2638          ?        ?      457.6        2.7       ?       ? 
1 1 1   47   21   21 f    129.7    4.4    0.0000   0.0000          ?        ?   168.5697  11.4934          ?        ?      129.7        4.4       ?       ? 
1 1 1   47   21   22 o    121.0    5.0    0.0000   0.0000          ?        ?   146.8600  12.1319          ?        ?      121.0        5.0       ?       ? 
1 1 1   47   21   23 o     65.5    9.3    0.0000   0.0000          ?        ?    43.4195  12.1319          ?        ?       65.5        9.3       ?       ? 
1 1 1   47   21   24 o    228.8    3.2    0.0000   0.0000          ?        ?   524.2263  14.6860          ?        ?      228.8        3.2       ?       ? 
1 1 1   47   21   25 o    184.5    3.6    0.0000   0.0000          ?        ?   340.9706  13.4090          ?        ?      184.5        3.6       ?       ? 
1 1 1   47   21   26 o    239.4    3.1    0.0000   0.0000          ?        ?   574.0309  14.6860          ?        ?      239.4        3.1       ?       ? 
1 1 1   47   21   27 o    179.5    4.1    0.0000   0.0000          ?        ?   323.0919  14.6860          ?        ?      179.5        4.1       ?       ? 
1 1 1   47   21   28 o    245.5    3.1    0.0000   0.0000          ?        ?   603.4030  15.3245          ?        ?      245.5        3.1       ?       ? 
1 1 1   47   21   29 o     83.7    8.4    0.0000   0.0000          ?        ?    70.8759  14.0475          ?        ?       83.7        8.4       ?       ? 
1 1 1   47   21   30 o    182.1    4.0    0.0000   0.0000          ?        ?   332.6698  14.6860          ?        ?      182.1        4.0       ?       ? 
1 1 1   47   21   31 o     63.0   12.6    0.0000   0.0000          ?        ?    42.1424  15.3245          ?        ?       63.0       12.6       ?       ? 
1 1 1   47   21   32 f    145.7    5.3    0.0000   0.0000          ?        ?   213.2662  15.3245          ?        ?      145.7        5.3       ?       ? 
1 1 1   47   21   33 o     82.3    9.7    0.0000   0.0000          ?        ?    68.9603  15.9630          ?        ?       82.3        9.7       ?       ? 
1 1 1   47   21   34 o     47.5   14.7    0.0000   0.0000          ?        ?    23.6253  15.3245          ?        ?       47.5       14.7       ?       ? 
1 1 1   47   22    0 o    110.1   10.6  125.1502  22.9868   125.1502  22.9868   125.1502  22.9868      110.1     10.6      110.1       10.6     0.0     0.0 
1 1 1   47   22    1 o     80.3    9.5    0.0000   0.0000          ?        ?    65.1292  15.3245          ?        ?       80.3        9.5       ?       ? 
1 1 1   47   22    2 f     23.6   11.3    0.0000   0.0000          ?        ?   -21.7097  15.3245          ?        ?       23.6       11.3       ?       ? 
1 1 1   47   22    3 o    165.1    5.6    0.0000   0.0000          ?        ?   273.2873  18.5171          ?        ?      165.1        5.6       ?       ? 
1 1 1   47   22    4 f    161.5    5.7    0.0000   0.0000          ?        ?   261.7939  18.5171          ?        ?      161.5        5.7       ?       ? 
1 1 1   47   22    5 o    216.6    4.3    0.0000   0.0000          ?        ?   469.9519  18.5171          ?        ?      216.6        4.3       ?       ? 
1 1 1   47   22    6 o    158.4    5.6    0.0000   0.0000          ?        ?   251.5775  17.8786          ?        ?      158.4        5.6       ?       ? 
1 1 1   47   22    7 o     32.5   13.9    0.0000   0.0000          ?        ?     0.0000  15.9630          ?        ?       32.5       13.9       ?       ? 
1 1 1   47   22    8 o     34.7   14.6    0.0000   0.0000          ?        ?     1.9156  17.2401          ?        ?       34.7       14.6       ?       ? 
1 1 1   47   22    9 o    223.4    4.4    0.0000   0.0000          ?        ?   499.9625  19.7942          ?        ?      223.4        4.4       ?       ? 
1 1 1   47   22   10 o    228.6    5.3    0.0000   0.0000          ?        ?   524.2263  24.2638          ?        ?      228.6        5.3       ?       ? 
1 1 1   47   22   11 o    286.0    4.0    0.0000   0.0000          ?        ?   819.2233  22.9868          ?        ?      286.0        4.0       ?       ? 
1 1 1   47   22   12 o    171.1    5.8    0.0000   0.0000          ?        ?   293.7199  19.7942          ?        ?      171.1        5.8       ?       ? 
1 1 1   47   22   13 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47   22   14 o     56.9   11.1    0.0000   0.0000          ?        ?    33.8416  12.1319          ?        ?       56.9       11.1       ?       ? 
1 1 1   47   22   15 o    135.6    5.2    0.0000   0.0000          ?        ?   184.5327  14.0475          ?        ?      135.6        5.2       ?       ? 
1 1 1   47   22   16 o    223.0    3.6    0.0000   0.0000          ?        ?   498.0469  15.9630          ?        ?      223.0        3.6       ?       ? 
1 1 1   47   22   17 o    320.7    3.4    0.0000   0.0000          ?        ?  1029.9354  21.7097          ?        ?      320.7        3.4       ?       ? 
1 1 1   47   22   18 o    397.4    3.2    0.0000   0.0000          ?        ?  1580.9796  25.5409          ?        ?      397.4        3.2       ?       ? 
1 1 1   47   22   19 o    149.0    5.8    0.0000   0.0000          ?        ?   222.8441  17.2401          ?        ?      149.0        5.8       ?       ? 
1 1 1   47   22   20 o     20.2   10.0    0.0000   0.0000          ?        ?   -32.5646  14.6860          ?        ?       20.2       10.0       ?       ? 
1 1 1   47   22   21 o    155.6    3.5    0.0000   0.0000          ?        ?   242.6382  10.8549          ?        ?      155.6        3.5       ?       ? 
1 1 1   47   22   22 o    131.4    4.4    0.0000   0.0000          ?        ?   173.0394  11.4934          ?        ?      131.4        4.4       ?       ? 
1 1 1   47   22   23 o    179.8    3.6    0.0000   0.0000          ?        ?   323.7305  12.7704          ?        ?      179.8        3.6       ?       ? 
1 1 1   47   22   24 o    153.9    4.4    0.0000   0.0000          ?        ?   237.5300  13.4090          ?        ?      153.9        4.4       ?       ? 
1 1 1   47   22   25 o     57.2   11.6    0.0000   0.0000          ?        ?    34.4802  12.7704          ?        ?       57.2       11.6       ?       ? 
1 1 1   47   22   26 o     19.6    9.7    0.0000   0.0000          ?        ?   -28.0950  13.4090          ?        ?       19.6        9.7       ?       ? 
1 1 1   47   22   27 o     22.5   10.7    0.0000   0.0000          ?        ?   -17.2401  13.4090          ?        ?       22.5       10.7       ?       ? 
1 1 1   47   22   28 o     68.2    9.8    0.0000   0.0000          ?        ?    47.2506  13.4090          ?        ?       68.2        9.8       ?       ? 
1 1 1   47   22   29 o    101.6    6.9    0.0000   0.0000          ?        ?   104.0790  14.0475          ?        ?      101.6        6.9       ?       ? 
1 1 1   47   22   30 o     73.0    9.6    0.0000   0.0000          ?        ?    54.2743  14.0475          ?        ?       73.0        9.6       ?       ? 
1 1 1   47   22   31 o     72.9   10.5    0.0000   0.0000          ?        ?    54.2743  15.3245          ?        ?       72.9       10.5       ?       ? 
1 1 1   47   22   32 o     98.0    7.2    0.0000   0.0000          ?        ?    97.0553  14.0475          ?        ?       98.0        7.2       ?       ? 
1 1 1   47   23    0 o     37.5   20.5   20.4327  21.7097    20.4327  21.7097    20.4327  21.7097       37.5     20.5       37.5       20.5     0.0     0.0 
1 1 1   47   23    1 o    201.3    4.4    0.0000   0.0000          ?        ?   406.0997  17.8786          ?        ?      201.3        4.4       ?       ? 
1 1 1   47   23    2 o    223.5    4.1    0.0000   0.0000          ?        ?   500.6010  18.5171          ?        ?      223.5        4.1       ?       ? 
1 1 1   47   23    3 o    168.5    5.1    0.0000   0.0000          ?        ?   284.7806  17.2401          ?        ?      168.5        5.1       ?       ? 
1 1 1   47   23    4 o    252.8    4.3    0.0000   0.0000          ?        ?   640.4372  21.7097          ?        ?      252.8        4.3       ?       ? 
1 1 1   47   23    5 o     42.9   14.8    0.0000   0.0000          ?        ?    17.2401  15.3245          ?        ?       42.9       14.8       ?       ? 
1 1 1   47   23    6 o     63.0   14.5    0.0000   0.0000          ?        ?    42.1424  17.8786          ?        ?       63.0       14.5       ?       ? 
1 1 1   47   23    7 o    291.1    4.6    0.0000   0.0000          ?        ?   849.2338  26.8179          ?        ?      291.1        4.6       ?       ? 
1 1 1   47   23    8 o    296.5    4.0    0.0000   0.0000          ?        ?   880.5213  23.6253          ?        ?      296.5        4.0       ?       ? 
1 1 1   47   23    9 o    203.9    5.2    0.0000   0.0000          ?        ?   416.9547  21.0712          ?        ?      203.9        5.2       ?       ? 
1 1 1   47   23   10 f    377.7    4.1    0.0000   0.0000          ?        ?  1429.6499  30.6490          ?        ?      377.7        4.1       ?       ? 
1 1 1   47   23   11 o    196.1    5.0    0.0000   0.0000          ?        ?   385.6671  19.7942          ?        ?      196.1        5.0       ?       ? 
1 1 1   47   23   12 o    349.8    4.3    0.0000   0.0000          ?        ?  1226.6001  30.0105          ?        ?      349.8        4.3       ?       ? 
1 1 1   47   23   13 o    233.1    4.5    0.0000   0.0000          ?        ?   544.6590  21.0712          ?        ?      233.1        4.5       ?       ? 
1 1 1   47   23   14 o     87.7   10.6    0.0000   0.0000          ?        ?    77.8996  18.5171          ?        ?       87.7       10.6       ?       ? 
1 1 1   47   23   15 o    292.0    3.1    0.0000   0.0000          ?        ?   853.7034  17.8786          ?        ?      292.0        3.1       ?       ? 
1 1 1   47   23   16 f    148.0    4.7    0.0000   0.0000          ?        ?   219.6514  14.0475          ?        ?      148.0        4.7       ?       ? 
1 1 1   47   23   17 o    310.7    3.2    0.0000   0.0000          ?        ?   966.7217  19.7942          ?        ?      310.7        3.2       ?       ? 
1 1 1   47   23   18 o    245.8    3.9    0.0000   0.0000          ?        ?   605.3185  19.1556          ?        ?      245.8        3.9       ?       ? 
1 1 1   47   23   19 o    130.2    6.4    0.0000   0.0000          ?        ?   170.4853  16.6016          ?        ?      130.2        6.4       ?       ? 
1 1 1   47   23   20 o    188.7    4.6    0.0000   0.0000          ?        ?   356.9336  17.2401          ?        ?      188.7        4.6       ?       ? 
1 1 1   47   23   21 o    237.6    3.8    0.0000   0.0000          ?        ?   565.7302  17.8786          ?        ?      237.6        3.8       ?       ? 
1 1 1   47   23   22 o    251.5    2.7    0.0000   0.0000          ?        ?   633.4135  13.4090          ?        ?      251.5        2.7       ?       ? 
1 1 1   47   23   23 o    138.4    4.4    0.0000   0.0000          ?        ?   192.1950  12.1319          ?        ?      138.4        4.4       ?       ? 
1 1 1   47   23   24 o    103.9    6.1    0.0000   0.0000          ?        ?   108.5487  12.7704          ?        ?      103.9        6.1       ?       ? 
1 1 1   47   23   25 o    185.5    3.6    0.0000   0.0000          ?        ?   344.8017  13.4090          ?        ?      185.5        3.6       ?       ? 
1 1 1   47   23   26 o    231.5    3.2    0.0000   0.0000          ?        ?   536.9967  14.6860          ?        ?      231.5        3.2       ?       ? 
1 1 1   47   23   27 o     84.1    8.0    0.0000   0.0000          ?        ?    71.5144  13.4090          ?        ?       84.1        8.0       ?       ? 
1 1 1   47   23   28 o     57.0   11.6    0.0000   0.0000          ?        ?    34.4802  12.7704          ?        ?       57.0       11.6       ?       ? 
1 1 1   47   23   29 o     80.5    8.3    0.0000   0.0000          ?        ?    65.7677  13.4090          ?        ?       80.5        8.3       ?       ? 
1 1 1   47   23   30 o    111.7    6.3    0.0000   0.0000          ?        ?   125.7888  14.0475          ?        ?      111.7        6.3       ?       ? 
1 1 1   47   24    0 o     69.6   17.0   56.8284  20.4327    56.8284  20.4327    56.8284  20.4327       69.6     17.0       69.6       17.0     0.0     0.0 
1 1 1   47   24    1 o    277.7    3.8    0.0000   0.0000          ?        ?   772.6111  21.0712          ?        ?      277.7        3.8       ?       ? 
1 1 1   47   24    2 o    344.2    3.7    0.0000   0.0000          ?        ?  1186.3732  25.5409          ?        ?      344.2        3.7       ?       ? 
1 1 1   47   24    3 o    281.7    3.9    0.0000   0.0000          ?        ?   794.9594  21.7097          ?        ?      281.7        3.9       ?       ? 
1 1 1   47   24    4 o    134.8    6.9    0.0000   0.0000          ?        ?   182.6172  18.5171          ?        ?      134.8        6.9       ?       ? 
1 1 1   47   24    5 o    272.9    5.1    0.0000   0.0000          ?        ?   747.0703  28.0950          ?        ?      272.9        5.1       ?       ? 
1 1 1   47   24    6 o     52.4   15.4    0.0000   0.0000          ?        ?    28.7335  17.2401          ?        ?       52.4       15.4       ?       ? 
1 1 1   47   24    7 o    236.1    4.1    0.0000   0.0000          ?        ?   558.7064  19.1556          ?        ?      236.1        4.1       ?       ? 
1 1 1   47   24    8 o     99.4    7.7    0.0000   0.0000          ?        ?    99.6094  15.3245          ?        ?       99.4        7.7       ?       ? 
1 1 1   47   24    9 o     38.7   14.8    0.0000   0.0000          ?        ?    10.8549  15.9630          ?        ?       38.7       14.8       ?       ? 
1 1 1   47   24   10 o    255.5    4.2    0.0000   0.0000          ?        ?   654.4847  21.7097          ?        ?      255.5        4.2       ?       ? 
1 1 1   47   24   11 o    269.4    4.1    0.0000   0.0000          ?        ?   727.2761  22.3483          ?        ?      269.4        4.1       ?       ? 
1 1 1   47   24   12 o    127.9    7.0    0.0000   0.0000          ?        ?   164.7386  17.8786          ?        ?      127.9        7.0       ?       ? 
1 1 1   47   24   13 o    129.5    6.4    0.0000   0.0000          ?        ?   168.5697  16.6016          ?        ?      129.5        6.4       ?       ? 
1 1 1   47   24   14 o    191.1    4.8    0.0000   0.0000          ?        ?   366.5114  18.5171          ?        ?      191.1        4.8       ?       ? 
1 1 1   47   24   15 o     80.5   10.7    0.0000   0.0000          ?        ?    65.7677  17.2401          ?        ?       80.5       10.7       ?       ? 
1 1 1   47   24   16 o     55.0   11.4    0.0000   0.0000          ?        ?    31.9261  12.1319          ?        ?       55.0       11.4       ?       ? 
1 1 1   47   24   17 o     19.1    9.4    0.0000   0.0000          ?        ?   -30.6490  13.4090          ?        ?       19.1        9.4       ?       ? 
1 1 1   47   24   18 o    228.5    3.6    0.0000   0.0000          ?        ?   522.9492  16.6016          ?        ?      228.5        3.6       ?       ? 
1 1 1   47   24   19 o     89.2    8.2    0.0000   0.0000          ?        ?    80.4537  14.6860          ?        ?       89.2        8.2       ?       ? 
1 1 1   47   24   20 o    169.0    4.7    0.0000   0.0000          ?        ?   286.6962  15.9630          ?        ?      169.0        4.7       ?       ? 
1 1 1   47   24   21 o     87.0    8.8    0.0000   0.0000          ?        ?    76.6226  15.3245          ?        ?       87.0        8.8       ?       ? 
1 1 1   47   24   22 o     34.2   14.4    0.0000   0.0000          ?        ?     2.5541  16.6016          ?        ?       34.2       14.4       ?       ? 
1 1 1   47   24   23 o    126.4    4.0    0.0000   0.0000          ?        ?   160.2689  10.2163          ?        ?      126.4        4.0       ?       ? 
1 1 1   47   24   24 o    145.6    4.4    0.0000   0.0000          ?        ?   212.6277  12.7704          ?        ?      145.6        4.4       ?       ? 
1 1 1   47   24   25 o     71.4    8.5    0.0000   0.0000          ?        ?    51.7203  12.1319          ?        ?       71.4        8.5       ?       ? 
1 1 1   47   24   26 o    156.7    4.3    0.0000   0.0000          ?        ?   246.4693  13.4090          ?        ?      156.7        4.3       ?       ? 
1 1 1   47   24   27 o    366.2    2.8    0.0000   0.0000          ?        ?  1343.4495  20.4327          ?        ?      366.2        2.8       ?       ? 
1 1 1   47   24   28 o    166.9    4.2    0.0000   0.0000          ?        ?   279.6725  14.0475          ?        ?      166.9        4.2       ?       ? 
1 1 1   47   25    0 o    267.1    5.0  715.1442  26.8179   715.1442  26.8179   715.1442  26.8179      267.1      5.0      267.1        5.0     0.0     0.0 
1 1 1   47   25    1 f    186.8    4.6    0.0000   0.0000          ?        ?   349.9099  17.2401          ?        ?      186.8        4.6       ?       ? 
1 1 1   47   25    2 o     93.5    8.2    0.0000   0.0000          ?        ?    88.1160  15.3245          ?        ?       93.5        8.2       ?       ? 
1 1 1   47   25    3 o    272.0    4.1    0.0000   0.0000          ?        ?   741.3236  22.3483          ?        ?      272.0        4.1       ?       ? 
1 1 1   47   25    4 o    151.9    5.9    0.0000   0.0000          ?        ?   231.7833  17.8786          ?        ?      151.9        5.9       ?       ? 
1 1 1   47   25    5 o     49.4   14.5    0.0000   0.0000          ?        ?    25.5409  15.3245          ?        ?       49.4       14.5       ?       ? 
1 1 1   47   25    6 o     91.4    8.0    0.0000   0.0000          ?        ?    84.2849  14.6860          ?        ?       91.4        8.0       ?       ? 
1 1 1   47   25    7 o    292.1    4.2    0.0000   0.0000          ?        ?   854.9804  24.2638          ?        ?      292.1        4.2       ?       ? 
1 1 1   47   25    8 o     81.3    9.8    0.0000   0.0000          ?        ?    67.0448  15.9630          ?        ?       81.3        9.8       ?       ? 
1 1 1   47   25    9 o    174.5    5.5    0.0000   0.0000          ?        ?   305.8519  19.1556          ?        ?      174.5        5.5       ?       ? 
1 1 1   47   25   10 o    286.6    4.2    0.0000   0.0000          ?        ?   823.6929  24.2638          ?        ?      286.6        4.2       ?       ? 
1 1 1   47   25   11 o    220.1    4.9    0.0000   0.0000          ?        ?   485.9149  21.7097          ?        ?      220.1        4.9       ?       ? 
1 1 1   47   25   12 o     90.8    9.8    0.0000   0.0000          ?        ?    83.6463  17.8786          ?        ?       90.8        9.8       ?       ? 
1 1 1   47   25   13 o     22.4   11.0    0.0000   0.0000          ?        ?   -31.9261  16.6016          ?        ?       22.4       11.0       ?       ? 
1 1 1   47   25   14 o    240.0    4.5    0.0000   0.0000          ?        ?   577.8621  21.7097          ?        ?      240.0        4.5       ?       ? 
1 1 1   47   25   15 o     78.0   11.1    0.0000   0.0000          ?        ?    61.9366  17.2401          ?        ?       78.0       11.1       ?       ? 
1 1 1   47   25   16 o    202.9    4.9    0.0000   0.0000          ?        ?   413.1235  19.7942          ?        ?      202.9        4.9       ?       ? 
1 1 1   47   25   17 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47   25   18 o    156.7    4.7    0.0000   0.0000          ?        ?   246.4693  14.6860          ?        ?      156.7        4.7       ?       ? 
1 1 1   47   25   19 o    181.2    4.4    0.0000   0.0000          ?        ?   329.4771  15.9630          ?        ?      181.2        4.4       ?       ? 
1 1 1   47   25   20 f    124.9    5.9    0.0000   0.0000          ?        ?   157.0763  14.6860          ?        ?      124.9        5.9       ?       ? 
1 1 1   47   25   21 o    249.9    3.4    0.0000   0.0000          ?        ?   625.7512  17.2401          ?        ?      249.9        3.4       ?       ? 
1 1 1   47   25   22 o    187.4    4.1    0.0000   0.0000          ?        ?   352.4639  15.3245          ?        ?      187.4        4.1       ?       ? 
1 1 1   47   25   23 o    202.7    3.8    0.0000   0.0000          ?        ?   411.8464  15.3245          ?        ?      202.7        3.8       ?       ? 
1 1 1   47   25   24 o    133.7    4.1    0.0000   0.0000          ?        ?   179.4246  10.8549          ?        ?      133.7        4.1       ?       ? 
1 1 1   47   25   25 o    191.9    3.3    0.0000   0.0000          ?        ?   369.0655  12.7704          ?        ?      191.9        3.3       ?       ? 
1 1 1   47   26    0 o    134.1   10.4  184.5327  27.4564   184.5327  27.4564   184.5327  27.4564      134.1     10.4      134.1       10.4     0.0     0.0 
1 1 1   47   26    1 o    149.2    6.8    0.0000   0.0000          ?        ?   224.1211  20.4327          ?        ?      149.2        6.8       ?       ? 
1 1 1   47   26    2 o    157.4    4.7    0.0000   0.0000          ?        ?   248.3849  14.6860          ?        ?      157.4        4.7       ?       ? 
1 1 1   47   26    3 o    308.3    3.4    0.0000   0.0000          ?        ?   952.0358  21.0712          ?        ?      308.3        3.4       ?       ? 
1 1 1   47   26    4 o    268.0    3.3    0.0000   0.0000          ?        ?   719.6138  17.8786          ?        ?      268.0        3.3       ?       ? 
1 1 1   47   26    5 o    144.5    4.6    0.0000   0.0000          ?        ?   209.4351  13.4090          ?        ?      144.5        4.6       ?       ? 
1 1 1   47   26    6 o    204.0    3.6    0.0000   0.0000          ?        ?   416.9547  14.6860          ?        ?      204.0        3.6       ?       ? 
1 1 1   47   26    7 o    286.4    3.6    0.0000   0.0000          ?        ?   821.7773  20.4327          ?        ?      286.4        3.6       ?       ? 
1 1 1   47   26    8 f    280.7    3.3    0.0000   0.0000          ?        ?   789.2127  18.5171          ?        ?      280.7        3.3       ?       ? 
1 1 1   47   26    9 o     73.6    9.5    0.0000   0.0000          ?        ?    54.9129  14.0475          ?        ?       73.6        9.5       ?       ? 
1 1 1   47   26   10 o    232.7    4.0    0.0000   0.0000          ?        ?   542.7434  18.5171          ?        ?      232.7        4.0       ?       ? 
1 1 1   47   26   11 o    155.0    5.4    0.0000   0.0000          ?        ?   241.3612  16.6016          ?        ?      155.0        5.4       ?       ? 
1 1 1   47   26   12 o    198.0    4.5    0.0000   0.0000          ?        ?   393.3293  17.8786          ?        ?      198.0        4.5       ?       ? 
1 1 1   47   26   13 o    269.7    4.0    0.0000   0.0000          ?        ?   729.1917  21.7097          ?        ?      269.7        4.0       ?       ? 
1 1 1   47   26   14 o    164.5    5.4    0.0000   0.0000          ?        ?   272.0102  17.8786          ?        ?      164.5        5.4       ?       ? 
1 1 1   47   26   15 o    203.1    5.0    0.0000   0.0000          ?        ?   414.4005  20.4327          ?        ?      203.1        5.0       ?       ? 
1 1 1   47   26   16 o     61.1   14.3    0.0000   0.0000          ?        ?    40.2269  17.2401          ?        ?       61.1       14.3       ?       ? 
1 1 1   47   26   17 o    135.1    4.7    0.0000   0.0000          ?        ?   183.2557  12.7704          ?        ?      135.1        4.7       ?       ? 
1 1 1   47   26   18 o    251.3    3.2    0.0000   0.0000          ?        ?   632.7749  15.9630          ?        ?      251.3        3.2       ?       ? 
1 1 1   47   26   19 o     80.6    7.9    0.0000   0.0000          ?        ?    65.7677  12.7704          ?        ?       80.6        7.9       ?       ? 
1 1 1   47   26   20 o     73.4    9.6    0.0000   0.0000          ?        ?    54.9129  14.0475          ?        ?       73.4        9.6       ?       ? 
1 1 1   47   26   21 o    197.7    4.0    0.0000   0.0000          ?        ?   392.0523  15.9630          ?        ?      197.7        4.0       ?       ? 
1 1 1   47   26   22 o    101.4    7.2    0.0000   0.0000          ?        ?   104.0790  14.6860          ?        ?      101.4        7.2       ?       ? 
1 1 1   47   27    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47   27    1 o     51.9   17.0    0.0000   0.0000          ?        ?    27.4564  20.4327          ?        ?       51.9       17.0       ?       ? 
1 1 1   47   27    2 o    121.3    9.5    0.0000   0.0000          ?        ?   149.4141  22.9868          ?        ?      121.3        9.5       ?       ? 
1 1 1   47   27    3 o    149.0    8.6    0.0000   0.0000          ?        ?   224.7596  25.5409          ?        ?      149.0        8.6       ?       ? 
1 1 1   47   27    4 o    183.0    7.8    0.0000   0.0000          ?        ?   338.4165  28.7335          ?        ?      183.0        7.8       ?       ? 
1 1 1   47   27    5 o    197.6    5.2    0.0000   0.0000          ?        ?   392.0523  20.4327          ?        ?      197.6        5.2       ?       ? 
1 1 1   47   27    6 o     84.0   11.4    0.0000   0.0000          ?        ?    72.1529  19.1556          ?        ?       84.0       11.4       ?       ? 
1 1 1   47   27    7 o    101.7   10.4    0.0000   0.0000          ?        ?   105.3561  21.0712          ?        ?      101.7       10.4       ?       ? 
1 1 1   47   27    8 o    421.4    5.4    0.0000   0.0000          ?        ?  1784.6680  45.3350          ?        ?      421.4        5.4       ?       ? 
1 1 1   47   27    9 o    269.8    5.3    0.0000   0.0000          ?        ?   731.7458  28.7335          ?        ?      269.8        5.3       ?       ? 
1 1 1   47   27   10 o     89.0    6.8    0.0000   0.0000          ?        ?    79.8152  12.1319          ?        ?       89.0        6.8       ?       ? 
1 1 1   47   27   11 o    160.7    4.6    0.0000   0.0000          ?        ?   259.2398  14.6860          ?        ?      160.7        4.6       ?       ? 
1 1 1   47   27   12 o    189.3    4.4    0.0000   0.0000          ?        ?   359.4877  16.6016          ?        ?      189.3        4.4       ?       ? 
1 1 1   47   27   13 o    294.4    3.9    0.0000   0.0000          ?        ?   869.0280  22.9868          ?        ?      294.4        3.9       ?       ? 
1 1 1   47   27   14 o     82.4    8.9    0.0000   0.0000          ?        ?    68.9603  14.6860          ?        ?       82.4        8.9       ?       ? 
1 1 1   47   27   15 o    176.8    5.2    0.0000   0.0000          ?        ?   314.1526  18.5171          ?        ?      176.8        5.2       ?       ? 
1 1 1   47   27   16 f    118.5    6.7    0.0000   0.0000          ?        ?   141.7518  15.9630          ?        ?      118.5        6.7       ?       ? 
1 1 1   47   27   17 o    107.3    8.3    0.0000   0.0000          ?        ?   116.8494  17.8786          ?        ?      107.3        8.3       ?       ? 
1 1 1   47   27   18 o     90.7    6.7    0.0000   0.0000          ?        ?    83.0078  12.1319          ?        ?       90.7        6.7       ?       ? 
1 1 1   47   28    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47   28    1 o    109.7   22.0    0.0000   0.0000          ?        ?   134.7281  46.6121          ?        ?      109.7       22.0       ?       ? 
1 1 1   47   28    2 o    101.7   24.2    0.0000   0.0000          ?        ?   118.7650  48.5276          ?        ?      101.7       24.2       ?       ? 
1 1 1   47   28    3 o     64.8   25.4    0.0000   0.0000          ?        ?    35.1187  47.8891          ?        ?       64.8       25.4       ?       ? 
1 1 1   47   28    4 o     70.3   14.1    0.0000   0.0000          ?        ?    52.9973  19.1556          ?        ?       70.3       14.1       ?       ? 
1 1 1   47   28    5 o     56.8   17.4    0.0000   0.0000          ?        ?    34.4802  21.7097          ?        ?       56.8       17.4       ?       ? 
1 1 1   47   28    6 o     84.2   13.7    0.0000   0.0000          ?        ?    73.4300  22.9868          ?        ?       84.2       13.7       ?       ? 
1 1 1   47   28    7 o    211.5    7.5    0.0000   0.0000          ?        ?   452.0733  31.9261          ?        ?      211.5        7.5       ?       ? 
1 1 1   47   28    8 o     34.7   14.6    0.0000   0.0000          ?        ?     2.5541  17.2401          ?        ?       34.7       14.6       ?       ? 
1 1 1   47   28    9 o    169.9    6.8    0.0000   0.0000          ?        ?   291.1659  22.9868          ?        ?      169.9        6.8       ?       ? 
1 1 1   47   28   10 o    266.5    5.0    0.0000   0.0000          ?        ?   713.8672  26.8179          ?        ?      266.5        5.0       ?       ? 
1 1 1   47   28   11 o    139.9    7.3    0.0000   0.0000          ?        ?   197.9417  20.4327          ?        ?      139.9        7.3       ?       ? 
1 1 1   47   28   12 o    166.8    7.5    0.0000   0.0000          ?        ?   281.5880  24.9023          ?        ?      166.8        7.5       ?       ? 
1 1 1   47   28   13 o     51.3   11.5    0.0000   0.0000          ?        ?    28.0950  11.4934          ?        ?       51.3       11.5       ?       ? 
1 1 1   47   29    0 o    194.0   20.7  405.4612  78.5382   405.4612  78.5382   405.4612  78.5382      194.0     20.7      194.0       20.7     0.0     0.0 
1 1 1   47   29    1 o    312.0    7.6    0.0000   0.0000          ?        ?   985.2389  47.2506          ?        ?      312.0        7.6       ?       ? 
1 1 1   47   29    2 o    103.9   22.5    0.0000   0.0000          ?        ?   123.2347  45.3350          ?        ?      103.9       22.5       ?       ? 
1 1 1   47   29    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   47   29    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48    0    0 o    311.6    5.8  972.4684  36.3957   972.4684  36.3957   972.4684  36.3957      311.6      5.8      311.6        5.8     0.0     0.0 
1 1 1   48    0    1 o    172.7    5.7  299.4666  19.7942   299.4666  19.7942   299.4666  19.7942      172.7      5.7      172.7        5.7     0.0     0.0 
1 1 1   48    0    2 o    580.9    4.5 3375.8640  51.7203  3375.8640  51.7203  3375.8640  51.7203      580.9      4.5      580.9        4.5     0.0     0.0 
1 1 1   48    0    3 o    514.1    4.1 2644.1182  42.1424  2644.1182  42.1424  2644.1182  42.1424      514.1      4.1      514.1        4.1     0.0     0.0 
1 1 1   48    0    4 o    597.5    4.5 3571.2515  54.2743  3571.2515  54.2743  3571.2515  54.2743      597.5      4.5      597.5        4.5     0.0     0.0 
1 1 1   48    0    5 o    163.6    5.5  268.8176  17.8786   268.8176  17.8786   268.8176  17.8786      163.6      5.5      163.6        5.5     0.0     0.0 
1 1 1   48    0    6 o    234.2    4.2  549.1286  19.7942   549.1286  19.7942   549.1286  19.7942      234.2      4.2      234.2        4.2     0.0     0.0 
1 1 1   48    0    7 o    309.5    3.9  958.4210  24.2638   958.4210  24.2638   958.4210  24.2638      309.5      3.9      309.5        3.9     0.0     0.0 
1 1 1   48    0    8 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48    0    9 o     16.0   11.6  -30.0105  17.8786   -30.0105  17.8786   -30.0105  17.8786       16.0     11.6       16.0       11.6     0.0     0.0 
1 1 1   48    0   10 o    188.2    5.1  355.0180  19.1556   355.0180  19.1556   355.0180  19.1556      188.2      5.1      188.2        5.1     0.0     0.0 
1 1 1   48    0   11 f    399.1    3.5 1593.1115  28.0950  1593.1115  28.0950  1593.1115  28.0950      399.1      3.5      399.1        3.5     0.0     0.0 
1 1 1   48    0   12 o     82.0   10.8   70.8759  17.2401    70.8759  17.2401    70.8759  17.2401       82.0     10.8       82.0       10.8     0.0     0.0 
1 1 1   48    0   13 o    520.7    3.7 2712.4397  38.9498  2712.4397  38.9498  2712.4397  38.9498      520.7      3.7      520.7        3.7     0.0     0.0 
1 1 1   48    0   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48    0   15 o    102.1    8.6  106.6331  17.2401   106.6331  17.2401   106.6331  17.2401      102.1      8.6      102.1        8.6     0.0     0.0 
1 1 1   48    0   16 f     22.0   14.9   -8.9393  19.1556    -8.9393  19.1556    -8.9393  19.1556       22.0     14.9       22.0       14.9     0.0     0.0 
1 1 1   48    0   17 o     21.6   14.5   -5.7467  17.2401    -5.7467  17.2401    -5.7467  17.2401       21.6     14.5       21.6       14.5     0.0     0.0 
1 1 1   48    0   18 o     14.1   10.4  -35.7572  16.6016   -35.7572  16.6016   -35.7572  16.6016       14.1     10.4       14.1       10.4     0.0     0.0 
1 1 1   48    0   19 o    396.0    3.9 1568.8477  30.6490  1568.8477  30.6490  1568.8477  30.6490      396.0      3.9      396.0        3.9     0.0     0.0 
1 1 1   48    0   20 f    439.0    3.5 1928.3353  30.6490  1928.3353  30.6490  1928.3353  30.6490      439.0      3.5      439.0        3.5     0.0     0.0 
1 1 1   48    0   21 o    481.3    3.6 2317.8335  34.4802  2317.8335  34.4802  2317.8335  34.4802      481.3      3.6      481.3        3.6     0.0     0.0 
1 1 1   48    0   22 o    263.2    4.4  693.4344  22.9868   693.4344  22.9868   693.4344  22.9868      263.2      4.4      263.2        4.4     0.0     0.0 
1 1 1   48    0   23 f     13.8   10.2  -48.5276  18.5171   -48.5276  18.5171   -48.5276  18.5171       13.8     10.2       13.8       10.2     0.0     0.0 
1 1 1   48    0   24 o    614.2    3.9 3774.3013  47.8891  3774.3013  47.8891  3774.3013  47.8891      614.2      3.9      614.2        3.9     0.0     0.0 
1 1 1   48    0   25 o    247.9    4.3  615.5349  21.0712   615.5349  21.0712   615.5349  21.0712      247.9      4.3      247.9        4.3     0.0     0.0 
1 1 1   48    0   26 o    201.1    4.9  405.4612  19.7942   405.4612  19.7942   405.4612  19.7942      201.1      4.9      201.1        4.9     0.0     0.0 
1 1 1   48    0   27 o     12.9    9.7  -71.5144  20.4327   -71.5144  20.4327   -71.5144  20.4327       12.9      9.7       12.9        9.7     0.0     0.0 
1 1 1   48    0   28 o    347.7    3.6 1209.3599  24.9023  1209.3599  24.9023  1209.3599  24.9023      347.7      3.6      347.7        3.6     0.0     0.0 
1 1 1   48    0   29 o    232.8    4.3  542.7434  19.7942   542.7434  19.7942   542.7434  19.7942      232.8      4.3      232.8        4.3     0.0     0.0 
1 1 1   48    0   30 f    396.6    3.5 1573.9558  28.0950  1573.9558  28.0950  1573.9558  28.0950      396.6      3.5      396.6        3.5     0.0     0.0 
1 1 1   48    0   31 o    493.9    3.6 2441.0681  35.7572  2441.0681  35.7572  2441.0681  35.7572      493.9      3.6      493.9        3.6     0.0     0.0 
1 1 1   48    0   32 o    393.2    3.7 1547.1379  29.3720  1547.1379  29.3720  1547.1379  29.3720      393.2      3.7      393.2        3.7     0.0     0.0 
1 1 1   48    0   33 o    475.7    3.4 2264.1978  32.5646  2264.1978  32.5646  2264.1978  32.5646      475.7      3.4      475.7        3.4     0.0     0.0 
1 1 1   48    0   34 o    546.7    3.7 2990.8352  40.2269  2990.8352  40.2269  2990.8352  40.2269      546.7      3.7      546.7        3.7     0.0     0.0 
1 1 1   48    0   35 o     20.9   14.7  -21.0712  22.3483   -21.0712  22.3483   -21.0712  22.3483       20.9     14.7       20.9       14.7     0.0     0.0 
1 1 1   48    0   36 o    250.3    4.7  627.6667  23.6253   627.6667  23.6253   627.6667  23.6253      250.3      4.7      250.3        4.7     0.0     0.0 
1 1 1   48    0   37 o    113.3    9.7  131.5355  21.7097   131.5355  21.7097   131.5355  21.7097      113.3      9.7      113.3        9.7     0.0     0.0 
1 1 1   48    0   38 o    478.9    3.5 2294.8467  33.2031  2294.8467  33.2031  2294.8467  33.2031      478.9      3.5      478.9        3.5     0.0     0.0 
1 1 1   48    0   39 o    191.9    6.0  369.7040  22.9868   369.7040  22.9868   369.7040  22.9868      191.9      6.0      191.9        6.0     0.0     0.0 
1 1 1   48    0   40 o     49.1   22.6   35.7572  24.2638    35.7572  24.2638    35.7572  24.2638       49.1     22.6       49.1       22.6     0.0     0.0 
1 1 1   48    0   41 o    202.2    5.9  410.5694  23.6253   410.5694  23.6253   410.5694  23.6253      202.2      5.9      202.2        5.9     0.0     0.0 
1 1 1   48    0   42 o    248.7    5.1  620.0045  25.5409   620.0045  25.5409   620.0045  25.5409      248.7      5.1      248.7        5.1     0.0     0.0 
1 1 1   48    0   43 o    193.9    6.4  378.0048  24.9023   378.0048  24.9023   378.0048  24.9023      193.9      6.4      193.9        6.4     0.0     0.0 
1 1 1   48    0   44 o    245.7    5.6  605.3185  27.4564   605.3185  27.4564   605.3185  27.4564      245.7      5.6      245.7        5.6     0.0     0.0 
1 1 1   48    0   45 o    347.4    4.5 1208.7214  31.2876  1208.7214  31.2876  1208.7214  31.2876      347.4      4.5      347.4        4.5     0.0     0.0 
1 1 1   48    0   46 o    150.3    9.0  229.2293  26.8179   229.2293  26.8179   229.2293  26.8179      150.3      9.0      150.3        9.0     0.0     0.0 
1 1 1   48    0   47 o     21.0   15.0  -28.0950  24.9023   -28.0950  24.9023   -28.0950  24.9023       21.0     15.0       21.0       15.0     0.0     0.0 
1 1 1   48    0   48 o    109.3   11.9  124.5117  25.5409   124.5117  25.5409   124.5117  25.5409      109.3     11.9      109.3       11.9     0.0     0.0 
1 1 1   48    0   49 o    264.1    5.2  699.1812  27.4564   699.1812  27.4564   699.1812  27.4564      264.1      5.2      264.1        5.2     0.0     0.0 
1 1 1   48    0   50 o    169.3    7.6  289.2503  25.5409   289.2503  25.5409   289.2503  25.5409      169.3      7.6      169.3        7.6     0.0     0.0 
1 1 1   48    0   51 o     23.2   16.1  -17.8786  24.9023   -17.8786  24.9023   -17.8786  24.9023       23.2     16.1       23.2       16.1     0.0     0.0 
1 1 1   48    0   52 o     53.4   23.5   42.1424  26.1794    42.1424  26.1794    42.1424  26.1794       53.4     23.5       53.4       23.5     0.0     0.0 
1 1 1   48    0   53 o     23.3   16.2  -19.1556  25.5409   -19.1556  25.5409   -19.1556  25.5409       23.3     16.2       23.3       16.2     0.0     0.0 
1 1 1   48    0   54 o     14.9   11.1  -72.7915  24.2638   -72.7915  24.2638   -72.7915  24.2638       14.9     11.1       14.9       11.1     0.0     0.0 
1 1 1   48    0   55 o    107.2   12.2  120.6806  25.5409   120.6806  25.5409   120.6806  25.5409      107.2     12.2      107.2       12.2     0.0     0.0 
1 1 1   48    0   56 o     46.2   23.5   33.2031  26.8179    33.2031  26.8179    33.2031  26.8179       46.2     23.5       46.2       23.5     0.0     0.0 
1 1 1   48    0   57 o    108.9   12.0  124.5117  25.5409   124.5117  25.5409   124.5117  25.5409      108.9     12.0      108.9       12.0     0.0     0.0 
1 1 1   48    1    0 o     38.3   18.3   21.7097  15.9630    21.7097  15.9630    21.7097  15.9630       38.3     18.3       38.3       18.3     0.0     0.0 
1 1 1   48    1    1 o    361.7    2.5    0.0000   0.0000          ?        ?  1308.3308  17.8786          ?        ?      361.7        2.5       ?       ? 
1 1 1   48    1    2 o    573.0    3.0    0.0000   0.0000          ?        ?  3284.5554  33.8416          ?        ?      573.0        3.0       ?       ? 
1 1 1   48    1    3 o    354.9    2.5    0.0000   0.0000          ?        ?  1259.8032  17.8786          ?        ?      354.9        2.5       ?       ? 
1 1 1   48    1    4 o    769.4    3.3    0.0000   0.0000          ?        ?  5922.2881  50.4432          ?        ?      769.4        3.3       ?       ? 
1 1 1   48    1    5 o    419.0    2.5    0.0000   0.0000          ?        ?  1755.9344  21.0712          ?        ?      419.0        2.5       ?       ? 
1 1 1   48    1    6 o    431.1    2.7    0.0000   0.0000          ?        ?  1858.7365  22.9868          ?        ?      431.1        2.7       ?       ? 
1 1 1   48    1    7 o    458.6    2.6    0.0000   0.0000          ?        ?  2103.2903  23.6253          ?        ?      458.6        2.6       ?       ? 
1 1 1   48    1    8 o     87.5    6.6    0.0000   0.0000          ?        ?    76.6226  11.4934          ?        ?       87.5        6.6       ?       ? 
1 1 1   48    1    9 o    610.3    2.9    0.0000   0.0000          ?        ?  3725.1353  35.1187          ?        ?      610.3        2.9       ?       ? 
1 1 1   48    1   10 o    294.7    2.7    0.0000   0.0000          ?        ?   868.3894  15.9630          ?        ?      294.7        2.7       ?       ? 
1 1 1   48    1   11 o    465.0    2.7    0.0000   0.0000          ?        ?  2162.6729  24.9023          ?        ?      465.0        2.7       ?       ? 
1 1 1   48    1   12 o    127.6    4.5    0.0000   0.0000          ?        ?   162.8230  11.4934          ?        ?      127.6        4.5       ?       ? 
1 1 1   48    1   13 o    266.7    2.8    0.0000   0.0000          ?        ?   711.3131  14.6860          ?        ?      266.7        2.8       ?       ? 
1 1 1   48    1   14 o    344.9    2.6    0.0000   0.0000          ?        ?  1189.5658  17.8786          ?        ?      344.9        2.6       ?       ? 
1 1 1   48    1   15 o    257.5    3.0    0.0000   0.0000          ?        ?   663.4240  15.3245          ?        ?      257.5        3.0       ?       ? 
1 1 1   48    1   16 o    587.2    2.8    0.0000   0.0000          ?        ?  3449.2939  32.5646          ?        ?      587.2        2.8       ?       ? 
1 1 1   48    1   17 f    144.2    4.6    0.0000   0.0000          ?        ?   208.1580  13.4090          ?        ?      144.2        4.6       ?       ? 
1 1 1   48    1   18 f    242.5    2.9    0.0000   0.0000          ?        ?   588.0784  14.0475          ?        ?      242.5        2.9       ?       ? 
1 1 1   48    1   19 o    126.3    5.1    0.0000   0.0000          ?        ?   159.6304  12.7704          ?        ?      126.3        5.1       ?       ? 
1 1 1   48    1   20 o    185.8    4.0    0.0000   0.0000          ?        ?   345.4402  14.6860          ?        ?      185.8        4.0       ?       ? 
1 1 1   48    1   21 o     25.2   11.5    0.0000   0.0000          ?        ?    -8.3008  12.7704          ?        ?       25.2       11.5       ?       ? 
1 1 1   48    1   22 o     73.6    9.1    0.0000   0.0000          ?        ?    54.2743  13.4090          ?        ?       73.6        9.1       ?       ? 
1 1 1   48    1   23 o    266.5    2.6    0.0000   0.0000          ?        ?   710.6746  14.0475          ?        ?      266.5        2.6       ?       ? 
1 1 1   48    1   24 o    421.0    2.4    0.0000   0.0000          ?        ?  1773.1747  20.4327          ?        ?      421.0        2.4       ?       ? 
1 1 1   48    1   25 o    136.5    5.1    0.0000   0.0000          ?        ?   186.4483  14.0475          ?        ?      136.5        5.1       ?       ? 
1 1 1   48    1   26 o    363.9    2.6    0.0000   0.0000          ?        ?  1324.2938  19.1556          ?        ?      363.9        2.6       ?       ? 
1 1 1   48    1   27 o    450.8    2.4    0.0000   0.0000          ?        ?  2033.0529  21.7097          ?        ?      450.8        2.4       ?       ? 
1 1 1   48    1   28 o    276.2    3.0    0.0000   0.0000          ?        ?   763.0333  16.6016          ?        ?      276.2        3.0       ?       ? 
1 1 1   48    1   29 f     25.9   11.9    0.0000   0.0000          ?        ?   -10.2163  14.0475          ?        ?       25.9       11.9       ?       ? 
1 1 1   48    1   30 o    298.9    2.8    0.0000   0.0000          ?        ?   893.9303  16.6016          ?        ?      298.9        2.8       ?       ? 
1 1 1   48    1   31 o    244.3    3.3    0.0000   0.0000          ?        ?   597.0177  15.9630          ?        ?      244.3        3.3       ?       ? 
1 1 1   48    1   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48    1   33 o    162.7    4.7    0.0000   0.0000          ?        ?   264.9865  15.3245          ?        ?      162.7        4.7       ?       ? 
1 1 1   48    1   34 o    132.9    5.8    0.0000   0.0000          ?        ?   176.8705  15.3245          ?        ?      132.9        5.8       ?       ? 
1 1 1   48    1   35 o    188.8    4.4    0.0000   0.0000          ?        ?   356.9336  16.6016          ?        ?      188.8        4.4       ?       ? 
1 1 1   48    1   36 o    151.9    5.0    0.0000   0.0000          ?        ?   231.1448  15.3245          ?        ?      151.9        5.0       ?       ? 
1 1 1   48    1   37 o    271.8    3.2    0.0000   0.0000          ?        ?   739.4081  17.2401          ?        ?      271.8        3.2       ?       ? 
1 1 1   48    1   38 o    248.4    3.3    0.0000   0.0000          ?        ?   617.4504  16.6016          ?        ?      248.4        3.3       ?       ? 
1 1 1   48    1   39 o     58.8   13.8    0.0000   0.0000          ?        ?    36.3957  15.9630          ?        ?       58.8       13.8       ?       ? 
1 1 1   48    1   40 o    218.1    4.1    0.0000   0.0000          ?        ?   476.3371  17.8786          ?        ?      218.1        4.1       ?       ? 
1 1 1   48    1   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48    1   42 o    541.0    2.8    0.0000   0.0000          ?        ?  2928.8987  30.0105          ?        ?      541.0        2.8       ?       ? 
1 1 1   48    1   43 o    176.0    5.3    0.0000   0.0000          ?        ?   310.3215  18.5171          ?        ?      176.0        5.3       ?       ? 
1 1 1   48    1   44 o    273.1    3.5    0.0000   0.0000          ?        ?   746.4318  19.1556          ?        ?      273.1        3.5       ?       ? 
1 1 1   48    1   45 o    237.7    3.9    0.0000   0.0000          ?        ?   565.7302  18.5171          ?        ?      237.7        3.9       ?       ? 
1 1 1   48    1   46 f    260.7    3.4    0.0000   0.0000          ?        ?   680.6641  17.8786          ?        ?      260.7        3.4       ?       ? 
1 1 1   48    1   47 o     55.1   15.6    0.0000   0.0000          ?        ?    31.9261  17.8786          ?        ?       55.1       15.6       ?       ? 
1 1 1   48    1   48 o    144.4    6.2    0.0000   0.0000          ?        ?   209.4351  17.8786          ?        ?      144.4        6.2       ?       ? 
1 1 1   48    1   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48    1   50 o     37.2   15.2    0.0000   0.0000          ?        ?     5.7467  17.8786          ?        ?       37.2       15.2       ?       ? 
1 1 1   48    1   51 o     33.4   14.6    0.0000   0.0000          ?        ?    -3.1926  18.5171          ?        ?       33.4       14.6       ?       ? 
1 1 1   48    1   52 o    267.1    3.6    0.0000   0.0000          ?        ?   714.5057  19.1556          ?        ?      267.1        3.6       ?       ? 
1 1 1   48    1   53 o     19.3    9.8    0.0000   0.0000          ?        ?   -58.1055  17.8786          ?        ?       19.3        9.8       ?       ? 
1 1 1   48    1   54 o     47.0   15.9    0.0000   0.0000          ?        ?    21.7097  17.8786          ?        ?       47.0       15.9       ?       ? 
1 1 1   48    1   55 o     30.3   13.8    0.0000   0.0000          ?        ?   -10.8549  18.5171          ?        ?       30.3       13.8       ?       ? 
1 1 1   48    1   56 o     33.7   14.5    0.0000   0.0000          ?        ?    -0.6385  17.8786          ?        ?       33.7       14.5       ?       ? 
1 1 1   48    2    0 o    664.2    4.2 4413.4614  55.5514  4413.4614  55.5514  4413.4614  55.5514      664.2      4.2      664.2        4.2     0.0     0.0 
1 1 1   48    2    1 o    169.3    3.8    0.0000   0.0000          ?        ?   286.6962  12.7704          ?        ?      169.3        3.8       ?       ? 
1 1 1   48    2    2 o    227.0    3.1    0.0000   0.0000          ?        ?   515.2869  14.0475          ?        ?      227.0        3.1       ?       ? 
1 1 1   48    2    3 o    120.6    5.0    0.0000   0.0000          ?        ?   145.5829  12.1319          ?        ?      120.6        5.0       ?       ? 
1 1 1   48    2    4 o     21.5   10.1    0.0000   0.0000          ?        ?   -13.4090  11.4934          ?        ?       21.5       10.1       ?       ? 
1 1 1   48    2    5 o    233.6    3.0    0.0000   0.0000          ?        ?   545.9360  14.0475          ?        ?      233.6        3.0       ?       ? 
1 1 1   48    2    6 o    389.6    2.5    0.0000   0.0000          ?        ?  1518.4044  19.7942          ?        ?      389.6        2.5       ?       ? 
1 1 1   48    2    7 o    251.4    2.7    0.0000   0.0000          ?        ?   632.1364  13.4090          ?        ?      251.4        2.7       ?       ? 
1 1 1   48    2    8 o    385.3    2.6    0.0000   0.0000          ?        ?  1485.2013  19.7942          ?        ?      385.3        2.6       ?       ? 
1 1 1   48    2    9 o    639.5    3.0    0.0000   0.0000          ?        ?  4090.3694  38.3113          ?        ?      639.5        3.0       ?       ? 
1 1 1   48    2   10 o     17.9    8.9    0.0000   0.0000          ?        ?   -29.3720  12.1319          ?        ?       17.9        8.9       ?       ? 
1 1 1   48    2   11 o    294.3    2.7    0.0000   0.0000          ?        ?   866.4738  15.9630          ?        ?      294.3        2.7       ?       ? 
1 1 1   48    2   12 o    285.2    2.7    0.0000   0.0000          ?        ?   813.4766  15.3245          ?        ?      285.2        2.7       ?       ? 
1 1 1   48    2   13 o    448.6    2.7    0.0000   0.0000          ?        ?  2013.2587  24.2638          ?        ?      448.6        2.7       ?       ? 
1 1 1   48    2   14 o    361.0    2.6    0.0000   0.0000          ?        ?  1303.8611  18.5171          ?        ?      361.0        2.6       ?       ? 
1 1 1   48    2   15 o    441.6    2.7    0.0000   0.0000          ?        ?  1950.6836  24.2638          ?        ?      441.6        2.7       ?       ? 
1 1 1   48    2   16 o    362.5    2.4    0.0000   0.0000          ?        ?  1314.0775  17.2401          ?        ?      362.5        2.4       ?       ? 
1 1 1   48    2   17 o    286.0    2.8    0.0000   0.0000          ?        ?   817.9462  15.9630          ?        ?      286.0        2.8       ?       ? 
1 1 1   48    2   18 o    252.3    2.8    0.0000   0.0000          ?        ?   636.6060  14.0475          ?        ?      252.3        2.8       ?       ? 
1 1 1   48    2   19 o    385.3    2.5    0.0000   0.0000          ?        ?  1485.2013  19.1556          ?        ?      385.3        2.5       ?       ? 
1 1 1   48    2   20 o    412.5    2.7    0.0000   0.0000          ?        ?  1701.6602  22.3483          ?        ?      412.5        2.7       ?       ? 
1 1 1   48    2   21 f    404.0    2.5    0.0000   0.0000          ?        ?  1632.6998  20.4327          ?        ?      404.0        2.5       ?       ? 
1 1 1   48    2   22 o    320.3    2.6    0.0000   0.0000          ?        ?  1026.1042  16.6016          ?        ?      320.3        2.6       ?       ? 
1 1 1   48    2   23 f    216.4    3.2    0.0000   0.0000          ?        ?   468.6749  14.0475          ?        ?      216.4        3.2       ?       ? 
1 1 1   48    2   24 o    384.1    2.6    0.0000   0.0000          ?        ?  1475.6235  19.7942          ?        ?      384.1        2.6       ?       ? 
1 1 1   48    2   25 o    698.0    2.9    0.0000   0.0000          ?        ?  4874.4741  40.2269          ?        ?      698.0        2.9       ?       ? 
1 1 1   48    2   26 o    179.5    4.1    0.0000   0.0000          ?        ?   322.4534  14.6860          ?        ?      179.5        4.1       ?       ? 
1 1 1   48    2   27 o    249.2    2.9    0.0000   0.0000          ?        ?   621.2816  14.6860          ?        ?      249.2        2.9       ?       ? 
1 1 1   48    2   28 f    202.5    3.8    0.0000   0.0000          ?        ?   410.5694  15.3245          ?        ?      202.5        3.8       ?       ? 
1 1 1   48    2   29 o    489.9    2.6    0.0000   0.0000          ?        ?  2400.8413  25.5409          ?        ?      489.9        2.6       ?       ? 
1 1 1   48    2   30 o     96.4    7.6    0.0000   0.0000          ?        ?    93.2242  14.6860          ?        ?       96.4        7.6       ?       ? 
1 1 1   48    2   31 f    201.9    3.8    0.0000   0.0000          ?        ?   408.0153  15.3245          ?        ?      201.9        3.8       ?       ? 
1 1 1   48    2   32 o     70.8    9.9    0.0000   0.0000          ?        ?    50.4432  14.0475          ?        ?       70.8        9.9       ?       ? 
1 1 1   48    2   33 o    165.0    4.6    0.0000   0.0000          ?        ?   272.6487  15.3245          ?        ?      165.0        4.6       ?       ? 
1 1 1   48    2   34 o    330.7    2.8    0.0000   0.0000          ?        ?  1094.4260  18.5171          ?        ?      330.7        2.8       ?       ? 
1 1 1   48    2   35 o    223.4    3.6    0.0000   0.0000          ?        ?   499.3239  15.9630          ?        ?      223.4        3.6       ?       ? 
1 1 1   48    2   36 o    368.4    2.7    0.0000   0.0000          ?        ?  1358.1355  19.7942          ?        ?      368.4        2.7       ?       ? 
1 1 1   48    2   37 o    152.3    5.5    0.0000   0.0000          ?        ?   232.4219  16.6016          ?        ?      152.3        5.5       ?       ? 
1 1 1   48    2   38 o    253.3    3.5    0.0000   0.0000          ?        ?   642.3527  17.8786          ?        ?      253.3        3.5       ?       ? 
1 1 1   48    2   39 o    376.9    2.8    0.0000   0.0000          ?        ?  1421.3491  21.0712          ?        ?      376.9        2.8       ?       ? 
1 1 1   48    2   40 f    352.0    2.9    0.0000   0.0000          ?        ?  1240.0090  20.4327          ?        ?      352.0        2.9       ?       ? 
1 1 1   48    2   41 o    108.7    7.6    0.0000   0.0000          ?        ?   118.7650  16.6016          ?        ?      108.7        7.6       ?       ? 
1 1 1   48    2   42 o    135.3    6.8    0.0000   0.0000          ?        ?   183.8942  18.5171          ?        ?      135.3        6.8       ?       ? 
1 1 1   48    2   43 o    515.0    2.8    0.0000   0.0000          ?        ?  2654.3345  28.7335          ?        ?      515.0        2.8       ?       ? 
1 1 1   48    2   44 f    340.5    3.1    0.0000   0.0000          ?        ?  1160.1937  21.0712          ?        ?      340.5        3.1       ?       ? 
1 1 1   48    2   45 o    140.6    6.4    0.0000   0.0000          ?        ?   198.5802  17.8786          ?        ?      140.6        6.4       ?       ? 
1 1 1   48    2   46 o    260.1    3.7    0.0000   0.0000          ?        ?   677.4714  19.1556          ?        ?      260.1        3.7       ?       ? 
1 1 1   48    2   47 o    165.4    5.4    0.0000   0.0000          ?        ?   274.5643  17.8786          ?        ?      165.4        5.4       ?       ? 
1 1 1   48    2   48 o    139.0    6.4    0.0000   0.0000          ?        ?   194.1106  17.8786          ?        ?      139.0        6.4       ?       ? 
1 1 1   48    2   49 f    109.1    8.2    0.0000   0.0000          ?        ?   120.0421  17.8786          ?        ?      109.1        8.2       ?       ? 
1 1 1   48    2   50 o    164.6    5.6    0.0000   0.0000          ?        ?   272.0102  18.5171          ?        ?      164.6        5.6       ?       ? 
1 1 1   48    2   51 o    109.3    8.5    0.0000   0.0000          ?        ?   120.6806  18.5171          ?        ?      109.3        8.5       ?       ? 
1 1 1   48    2   52 f    203.5    4.7    0.0000   0.0000          ?        ?   415.6776  19.1556          ?        ?      203.5        4.7       ?       ? 
1 1 1   48    2   53 o    107.2    8.3    0.0000   0.0000          ?        ?   116.2109  17.8786          ?        ?      107.2        8.3       ?       ? 
1 1 1   48    2   54 o    228.2    4.1    0.0000   0.0000          ?        ?   522.3107  18.5171          ?        ?      228.2        4.1       ?       ? 
1 1 1   48    2   55 o     33.7   14.5    0.0000   0.0000          ?        ?    -0.6385  17.8786          ?        ?       33.7       14.5       ?       ? 
1 1 1   48    3    0 o    441.7    4.0 1951.9607  35.7572  1951.9607  35.7572  1951.9607  35.7572      441.7      4.0      441.7        4.0     0.0     0.0 
1 1 1   48    3    1 o    489.4    2.6    0.0000   0.0000          ?        ?  2395.7332  25.5409          ?        ?      489.4        2.6       ?       ? 
1 1 1   48    3    2 f    199.9    3.2    0.0000   0.0000          ?        ?   399.7145  12.7704          ?        ?      199.9        3.2       ?       ? 
1 1 1   48    3    3 o    460.2    2.6    0.0000   0.0000          ?        ?  2117.9763  24.2638          ?        ?      460.2        2.6       ?       ? 
1 1 1   48    3    4 o    265.2    2.6    0.0000   0.0000          ?        ?   703.6508  14.0475          ?        ?      265.2        2.6       ?       ? 
1 1 1   48    3    5 o     75.7    7.6    0.0000   0.0000          ?        ?    57.4669  11.4934          ?        ?       75.7        7.6       ?       ? 
1 1 1   48    3    6 o    238.2    2.9    0.0000   0.0000          ?        ?   567.6458  14.0475          ?        ?      238.2        2.9       ?       ? 
1 1 1   48    3    7 o    216.8    2.9    0.0000   0.0000          ?        ?   469.9519  12.7704          ?        ?      216.8        2.9       ?       ? 
1 1 1   48    3    8 o    432.6    2.7    0.0000   0.0000          ?        ?  1871.5070  22.9868          ?        ?      432.6        2.7       ?       ? 
1 1 1   48    3    9 o    352.2    2.6    0.0000   0.0000          ?        ?  1240.6476  18.5171          ?        ?      352.2        2.6       ?       ? 
1 1 1   48    3   10 o    418.8    2.5    0.0000   0.0000          ?        ?  1754.0190  21.0712          ?        ?      418.8        2.5       ?       ? 
1 1 1   48    3   11 o    169.8    3.6    0.0000   0.0000          ?        ?   288.6118  12.1319          ?        ?      169.8        3.6       ?       ? 
1 1 1   48    3   12 f    349.5    2.6    0.0000   0.0000          ?        ?  1221.4919  17.8786          ?        ?      349.5        2.6       ?       ? 
1 1 1   48    3   13 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48    3   14 o    232.9    3.0    0.0000   0.0000          ?        ?   542.7434  14.0475          ?        ?      232.9        3.0       ?       ? 
1 1 1   48    3   15 o    164.9    4.1    0.0000   0.0000          ?        ?   272.0102  13.4090          ?        ?      164.9        4.1       ?       ? 
1 1 1   48    3   16 o    520.9    2.8    0.0000   0.0000          ?        ?  2713.7168  28.7335          ?        ?      520.9        2.8       ?       ? 
1 1 1   48    3   17 o    103.8    6.2    0.0000   0.0000          ?        ?   107.9102  12.7704          ?        ?      103.8        6.2       ?       ? 
1 1 1   48    3   18 o    494.3    2.6    0.0000   0.0000          ?        ?  2443.6223  26.1794          ?        ?      494.3        2.6       ?       ? 
1 1 1   48    3   19 o    220.8    3.3    0.0000   0.0000          ?        ?   487.8305  14.6860          ?        ?      220.8        3.3       ?       ? 
1 1 1   48    3   20 o    363.2    2.6    0.0000   0.0000          ?        ?  1319.1857  19.1556          ?        ?      363.2        2.6       ?       ? 
1 1 1   48    3   21 o    324.5    2.7    0.0000   0.0000          ?        ?  1053.5607  17.2401          ?        ?      324.5        2.7       ?       ? 
1 1 1   48    3   22 o    210.0    3.5    0.0000   0.0000          ?        ?   441.2184  14.6860          ?        ?      210.0        3.5       ?       ? 
1 1 1   48    3   23 o    192.4    3.7    0.0000   0.0000          ?        ?   370.3425  14.0475          ?        ?      192.4        3.7       ?       ? 
1 1 1   48    3   24 o    278.9    2.9    0.0000   0.0000          ?        ?   778.3578  15.9630          ?        ?      278.9        2.9       ?       ? 
1 1 1   48    3   25 o    383.3    2.6    0.0000   0.0000          ?        ?  1469.8767  19.7942          ?        ?      383.3        2.6       ?       ? 
1 1 1   48    3   26 o    112.6    6.2    0.0000   0.0000          ?        ?   127.0658  14.0475          ?        ?      112.6        6.2       ?       ? 
1 1 1   48    3   27 o    140.1    5.0    0.0000   0.0000          ?        ?   196.6647  14.0475          ?        ?      140.1        5.0       ?       ? 
1 1 1   48    3   28 o    322.8    2.7    0.0000   0.0000          ?        ?  1042.7058  17.2401          ?        ?      322.8        2.7       ?       ? 
1 1 1   48    3   29 o    179.5    4.1    0.0000   0.0000          ?        ?   322.4534  14.6860          ?        ?      179.5        4.1       ?       ? 
1 1 1   48    3   30 o     80.5    9.1    0.0000   0.0000          ?        ?    65.1292  14.6860          ?        ?       80.5        9.1       ?       ? 
1 1 1   48    3   31 o    256.9    3.2    0.0000   0.0000          ?        ?   660.2314  16.6016          ?        ?      256.9        3.2       ?       ? 
1 1 1   48    3   32 f    217.1    3.5    0.0000   0.0000          ?        ?   471.8675  15.3245          ?        ?      217.1        3.5       ?       ? 
1 1 1   48    3   33 f    487.8    2.6    0.0000   0.0000          ?        ?  2380.4084  24.9023          ?        ?      487.8        2.6       ?       ? 
1 1 1   48    3   34 o    370.4    2.6    0.0000   0.0000          ?        ?  1372.1830  19.1556          ?        ?      370.4        2.6       ?       ? 
1 1 1   48    3   35 o    182.5    4.2    0.0000   0.0000          ?        ?   333.3083  15.3245          ?        ?      182.5        4.2       ?       ? 
1 1 1   48    3   36 o    211.3    4.1    0.0000   0.0000          ?        ?   446.9651  17.2401          ?        ?      211.3        4.1       ?       ? 
1 1 1   48    3   37 o     93.0    8.6    0.0000   0.0000          ?        ?    86.8389  15.9630          ?        ?       93.0        8.6       ?       ? 
1 1 1   48    3   38 o    201.6    4.0    0.0000   0.0000          ?        ?   406.7383  15.9630          ?        ?      201.6        4.0       ?       ? 
1 1 1   48    3   39 o     87.6    9.5    0.0000   0.0000          ?        ?    77.2611  16.6016          ?        ?       87.6        9.5       ?       ? 
1 1 1   48    3   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48    3   41 o    194.3    4.4    0.0000   0.0000          ?        ?   378.0048  17.2401          ?        ?      194.3        4.4       ?       ? 
1 1 1   48    3   42 o    179.0    4.8    0.0000   0.0000          ?        ?   321.1764  17.2401          ?        ?      179.0        4.8       ?       ? 
1 1 1   48    3   43 o    189.1    4.7    0.0000   0.0000          ?        ?   358.2106  17.8786          ?        ?      189.1        4.7       ?       ? 
1 1 1   48    3   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48    3   45 o    417.8    2.8    0.0000   0.0000          ?        ?  1746.9952  23.6253          ?        ?      417.8        2.8       ?       ? 
1 1 1   48    3   46 o    427.2    2.8    0.0000   0.0000          ?        ?  1826.1719  23.6253          ?        ?      427.2        2.8       ?       ? 
1 1 1   48    3   47 o    147.0    6.3    0.0000   0.0000          ?        ?   217.0974  18.5171          ?        ?      147.0        6.3       ?       ? 
1 1 1   48    3   48 o     24.0   11.6    0.0000   0.0000          ?        ?   -28.0950  17.2401          ?        ?       24.0       11.6       ?       ? 
1 1 1   48    3   49 o    247.2    3.9    0.0000   0.0000          ?        ?   612.3422  19.1556          ?        ?      247.2        3.9       ?       ? 
1 1 1   48    3   50 o    162.4    5.5    0.0000   0.0000          ?        ?   264.9865  17.8786          ?        ?      162.4        5.5       ?       ? 
1 1 1   48    3   51 o     89.0   10.0    0.0000   0.0000          ?        ?    80.4537  17.8786          ?        ?       89.0       10.0       ?       ? 
1 1 1   48    3   52 o    112.4    8.2    0.0000   0.0000          ?        ?   127.7043  18.5171          ?        ?      112.4        8.2       ?       ? 
1 1 1   48    3   53 o    178.3    5.2    0.0000   0.0000          ?        ?   319.2608  18.5171          ?        ?      178.3        5.2       ?       ? 
1 1 1   48    3   54 o     26.0   12.5    0.0000   0.0000          ?        ?   -24.9023  18.5171          ?        ?       26.0       12.5       ?       ? 
1 1 1   48    3   55 o     40.8   15.6    0.0000   0.0000          ?        ?    12.7704  17.8786          ?        ?       40.8       15.6       ?       ? 
1 1 1   48    4    0 o    570.0    4.4 3250.0752  49.8047  3250.0752  49.8047  3250.0752  49.8047      570.0      4.4      570.0        4.4     0.0     0.0 
1 1 1   48    4    1 o    667.0    3.4    0.0000   0.0000          ?        ?  4450.4956  44.6965          ?        ?      667.0        3.4       ?       ? 
1 1 1   48    4    2 o    553.9    3.1    0.0000   0.0000          ?        ?  3069.3735  34.4802          ?        ?      553.9        3.1       ?       ? 
1 1 1   48    4    3 o    687.9    3.2    0.0000   0.0000          ?        ?  4733.9995  44.6965          ?        ?      687.9        3.2       ?       ? 
1 1 1   48    4    4 o    362.0    2.6    0.0000   0.0000          ?        ?  1310.8849  19.1556          ?        ?      362.0        2.6       ?       ? 
1 1 1   48    4    5 o    245.3    2.9    0.0000   0.0000          ?        ?   602.1259  14.0475          ?        ?      245.3        2.9       ?       ? 
1 1 1   48    4    6 o    339.0    2.6    0.0000   0.0000          ?        ?  1149.3389  17.8786          ?        ?      339.0        2.6       ?       ? 
1 1 1   48    4    7 o    419.1    2.6    0.0000   0.0000          ?        ?  1756.5730  21.7097          ?        ?      419.1        2.6       ?       ? 
1 1 1   48    4    8 o    159.2    4.0    0.0000   0.0000          ?        ?   253.4931  12.7704          ?        ?      159.2        4.0       ?       ? 
1 1 1   48    4    9 o    409.3    2.7    0.0000   0.0000          ?        ?  1676.1193  22.3483          ?        ?      409.3        2.7       ?       ? 
1 1 1   48    4   10 o    482.4    2.8    0.0000   0.0000          ?        ?  2328.0498  26.8179          ?        ?      482.4        2.8       ?       ? 
1 1 1   48    4   11 o    141.1    4.5    0.0000   0.0000          ?        ?   199.2188  12.7704          ?        ?      141.1        4.5       ?       ? 
1 1 1   48    4   12 o    561.4    2.8    0.0000   0.0000          ?        ?  3153.0198  31.2876          ?        ?      561.4        2.8       ?       ? 
1 1 1   48    4   13 o    345.0    2.5    0.0000   0.0000          ?        ?  1190.2042  17.2401          ?        ?      345.0        2.5       ?       ? 
1 1 1   48    4   14 o     43.6   13.4    0.0000   0.0000          ?        ?    19.1556  12.7704          ?        ?       43.6       13.4       ?       ? 
1 1 1   48    4   15 o    227.9    3.2    0.0000   0.0000          ?        ?   519.7566  14.6860          ?        ?      227.9        3.2       ?       ? 
1 1 1   48    4   16 o    220.4    3.5    0.0000   0.0000          ?        ?   485.9149  15.3245          ?        ?      220.4        3.5       ?       ? 
1 1 1   48    4   17 o    623.6    3.0    0.0000   0.0000          ?        ?  3890.5122  37.6728          ?        ?      623.6        3.0       ?       ? 
1 1 1   48    4   18 o    113.5    5.9    0.0000   0.0000          ?        ?   128.9814  13.4090          ?        ?      113.5        5.9       ?       ? 
1 1 1   48    4   19 o    245.9    2.9    0.0000   0.0000          ?        ?   604.6799  14.0475          ?        ?      245.9        2.9       ?       ? 
1 1 1   48    4   20 o    114.3    5.9    0.0000   0.0000          ?        ?   130.8969  13.4090          ?        ?      114.3        5.9       ?       ? 
1 1 1   48    4   21 o    441.9    2.6    0.0000   0.0000          ?        ?  1953.2377  22.9868          ?        ?      441.9        2.6       ?       ? 
1 1 1   48    4   22 o    151.1    4.6    0.0000   0.0000          ?        ?   228.5907  14.0475          ?        ?      151.1        4.6       ?       ? 
1 1 1   48    4   23 o    221.7    3.3    0.0000   0.0000          ?        ?   491.6617  14.6860          ?        ?      221.7        3.3       ?       ? 
1 1 1   48    4   24 o    629.6    2.9    0.0000   0.0000          ?        ?  3965.8577  36.3957          ?        ?      629.6        2.9       ?       ? 
1 1 1   48    4   25 o    168.7    4.2    0.0000   0.0000          ?        ?   284.7806  14.0475          ?        ?      168.7        4.2       ?       ? 
1 1 1   48    4   26 o    100.6    6.7    0.0000   0.0000          ?        ?   101.5249  13.4090          ?        ?      100.6        6.7       ?       ? 
1 1 1   48    4   27 f    415.1    2.5    0.0000   0.0000          ?        ?  1724.0084  20.4327          ?        ?      415.1        2.5       ?       ? 
1 1 1   48    4   28 o     96.4    7.6    0.0000   0.0000          ?        ?    93.2242  14.6860          ?        ?       96.4        7.6       ?       ? 
1 1 1   48    4   29 o    120.5    5.8    0.0000   0.0000          ?        ?   145.5829  14.0475          ?        ?      120.5        5.8       ?       ? 
1 1 1   48    4   30 o    312.5    2.9    0.0000   0.0000          ?        ?   976.9381  17.8786          ?        ?      312.5        2.9       ?       ? 
1 1 1   48    4   31 o    270.1    3.0    0.0000   0.0000          ?        ?   729.8303  15.9630          ?        ?      270.1        3.0       ?       ? 
1 1 1   48    4   32 o    401.7    2.5    0.0000   0.0000          ?        ?  1614.1827  19.7942          ?        ?      401.7        2.5       ?       ? 
1 1 1   48    4   33 o    366.2    2.6    0.0000   0.0000          ?        ?  1341.5339  19.1556          ?        ?      366.2        2.6       ?       ? 
1 1 1   48    4   34 o     41.2   14.7    0.0000   0.0000          ?        ?    14.6860  15.3245          ?        ?       41.2       14.7       ?       ? 
1 1 1   48    4   35 o    329.5    2.9    0.0000   0.0000          ?        ?  1086.1254  19.1556          ?        ?      329.5        2.9       ?       ? 
1 1 1   48    4   36 o    232.8    3.8    0.0000   0.0000          ?        ?   542.7434  17.8786          ?        ?      232.8        3.8       ?       ? 
1 1 1   48    4   37 o     86.5    9.2    0.0000   0.0000          ?        ?    75.3456  15.9630          ?        ?       86.5        9.2       ?       ? 
1 1 1   48    4   38 o    373.5    2.8    0.0000   0.0000          ?        ?  1395.8083  21.0712          ?        ?      373.5        2.8       ?       ? 
1 1 1   48    4   39 o    137.1    5.8    0.0000   0.0000          ?        ?   188.3639  15.9630          ?        ?      137.1        5.8       ?       ? 
1 1 1   48    4   40 o    432.7    2.7    0.0000   0.0000          ?        ?  1873.4224  22.9868          ?        ?      432.7        2.7       ?       ? 
1 1 1   48    4   41 o     22.2   11.0    0.0000   0.0000          ?        ?   -40.2269  17.8786          ?        ?       22.2       11.0       ?       ? 
1 1 1   48    4   42 o    176.9    4.9    0.0000   0.0000          ?        ?   313.5141  17.2401          ?        ?      176.9        4.9       ?       ? 
1 1 1   48    4   43 o     73.6   12.1    0.0000   0.0000          ?        ?    54.9129  17.8786          ?        ?       73.6       12.1       ?       ? 
1 1 1   48    4   44 o    131.2    6.8    0.0000   0.0000          ?        ?   173.0394  17.8786          ?        ?      131.2        6.8       ?       ? 
1 1 1   48    4   45 o    211.8    4.4    0.0000   0.0000          ?        ?   449.5192  18.5171          ?        ?      211.8        4.4       ?       ? 
1 1 1   48    4   46 o    104.0    8.9    0.0000   0.0000          ?        ?   109.1872  18.5171          ?        ?      104.0        8.9       ?       ? 
1 1 1   48    4   47 o     85.1   10.5    0.0000   0.0000          ?        ?    73.4300  17.8786          ?        ?       85.1       10.5       ?       ? 
1 1 1   48    4   48 o    180.0    5.0    0.0000   0.0000          ?        ?   325.0075  17.8786          ?        ?      180.0        5.0       ?       ? 
1 1 1   48    4   49 o     36.3   14.9    0.0000   0.0000          ?        ?     5.1082  17.2401          ?        ?       36.3       14.9       ?       ? 
1 1 1   48    4   50 o    102.7    8.4    0.0000   0.0000          ?        ?   106.6331  17.2401          ?        ?      102.7        8.4       ?       ? 
1 1 1   48    4   51 o     32.4   14.3    0.0000   0.0000          ?        ?    -3.8311  17.8786          ?        ?       32.4       14.3       ?       ? 
1 1 1   48    4   52 o     98.5    9.1    0.0000   0.0000          ?        ?    98.3323  17.8786          ?        ?       98.5        9.1       ?       ? 
1 1 1   48    4   53 o    259.1    3.7    0.0000   0.0000          ?        ?   673.0018  19.1556          ?        ?      259.1        3.7       ?       ? 
1 1 1   48    4   54 o     19.1    9.7    0.0000   0.0000          ?        ?   -64.4907  18.5171          ?        ?       19.1        9.7       ?       ? 
1 1 1   48    5    0 o    466.5    3.7 2177.3586  34.4802  2177.3586  34.4802  2177.3586  34.4802      466.5      3.7      466.5        3.7     0.0     0.0 
1 1 1   48    5    1 o    445.6    2.6    0.0000   0.0000          ?        ?  1985.8022  22.9868          ?        ?      445.6        2.6       ?       ? 
1 1 1   48    5    2 o    316.3    2.7    0.0000   0.0000          ?        ?  1000.5634  17.2401          ?        ?      316.3        2.7       ?       ? 
1 1 1   48    5    3 o    191.1    3.5    0.0000   0.0000          ?        ?   365.2344  13.4090          ?        ?      191.1        3.5       ?       ? 
1 1 1   48    5    4 o    744.4    3.2    0.0000   0.0000          ?        ?  5543.6450  47.8891          ?        ?      744.4        3.2       ?       ? 
1 1 1   48    5    5 o    661.7    3.0    0.0000   0.0000          ?        ?  4379.6201  40.2269          ?        ?      661.7        3.0       ?       ? 
1 1 1   48    5    6 o    285.7    2.6    0.0000   0.0000          ?        ?   816.6692  14.6860          ?        ?      285.7        2.6       ?       ? 
1 1 1   48    5    7 o    362.1    2.7    0.0000   0.0000          ?        ?  1311.5234  19.7942          ?        ?      362.1        2.7       ?       ? 
1 1 1   48    5    8 o    249.1    2.9    0.0000   0.0000          ?        ?   620.6430  14.6860          ?        ?      249.1        2.9       ?       ? 
1 1 1   48    5    9 o     17.4    8.6    0.0000   0.0000          ?        ?   -24.2638  10.8549          ?        ?       17.4        8.6       ?       ? 
1 1 1   48    5   10 o    133.2    4.6    0.0000   0.0000          ?        ?   177.5090  12.1319          ?        ?      133.2        4.6       ?       ? 
1 1 1   48    5   11 o     53.0   11.8    0.0000   0.0000          ?        ?    29.3720  12.1319          ?        ?       53.0       11.8       ?       ? 
1 1 1   48    5   12 o    306.7    2.8    0.0000   0.0000          ?        ?   941.1808  17.2401          ?        ?      306.7        2.8       ?       ? 
1 1 1   48    5   13 o    211.1    3.3    0.0000   0.0000          ?        ?   445.6881  14.0475          ?        ?      211.1        3.3       ?       ? 
1 1 1   48    5   14 o    162.9    4.1    0.0000   0.0000          ?        ?   265.6250  13.4090          ?        ?      162.9        4.1       ?       ? 
1 1 1   48    5   15 o    390.9    2.7    0.0000   0.0000          ?        ?  1528.6207  21.0712          ?        ?      390.9        2.7       ?       ? 
1 1 1   48    5   16 o    143.6    4.4    0.0000   0.0000          ?        ?   206.2425  12.7704          ?        ?      143.6        4.4       ?       ? 
1 1 1   48    5   17 o    467.6    2.7    0.0000   0.0000          ?        ?  2187.5752  24.9023          ?        ?      467.6        2.7       ?       ? 
1 1 1   48    5   18 o    267.5    3.0    0.0000   0.0000          ?        ?   715.7827  15.9630          ?        ?      267.5        3.0       ?       ? 
1 1 1   48    5   19 o    223.4    3.4    0.0000   0.0000          ?        ?   499.3239  15.3245          ?        ?      223.4        3.4       ?       ? 
1 1 1   48    5   20 o    162.3    3.9    0.0000   0.0000          ?        ?   263.7094  12.7704          ?        ?      162.3        3.9       ?       ? 
1 1 1   48    5   21 o    351.8    2.5    0.0000   0.0000          ?        ?  1238.0934  17.8786          ?        ?      351.8        2.5       ?       ? 
1 1 1   48    5   22 o    365.4    2.5    0.0000   0.0000          ?        ?  1335.7872  18.5171          ?        ?      365.4        2.5       ?       ? 
1 1 1   48    5   23 o     35.6   13.6    0.0000   0.0000          ?        ?     8.9393  13.4090          ?        ?       35.6       13.6       ?       ? 
1 1 1   48    5   24 o    219.5    3.3    0.0000   0.0000          ?        ?   482.0838  14.6860          ?        ?      219.5        3.3       ?       ? 
1 1 1   48    5   25 o    111.4    6.6    0.0000   0.0000          ?        ?   124.5117  14.6860          ?        ?      111.4        6.6       ?       ? 
1 1 1   48    5   26 o    102.5    6.5    0.0000   0.0000          ?        ?   105.3561  13.4090          ?        ?      102.5        6.5       ?       ? 
1 1 1   48    5   27 o    488.0    2.5    0.0000   0.0000          ?        ?  2382.3242  24.2638          ?        ?      488.0        2.5       ?       ? 
1 1 1   48    5   28 o    104.4    6.7    0.0000   0.0000          ?        ?   109.1872  14.0475          ?        ?      104.4        6.7       ?       ? 
1 1 1   48    5   29 o    106.8    6.6    0.0000   0.0000          ?        ?   114.2954  14.0475          ?        ?      106.8        6.6       ?       ? 
1 1 1   48    5   30 o    269.4    3.0    0.0000   0.0000          ?        ?   725.9991  15.9630          ?        ?      269.4        3.0       ?       ? 
1 1 1   48    5   31 o    272.8    3.2    0.0000   0.0000          ?        ?   744.5162  17.2401          ?        ?      272.8        3.2       ?       ? 
1 1 1   48    5   32 o     78.1    9.4    0.0000   0.0000          ?        ?    61.2981  14.6860          ?        ?       78.1        9.4       ?       ? 
1 1 1   48    5   33 o    111.7    6.6    0.0000   0.0000          ?        ?   125.1502  14.6860          ?        ?      111.7        6.6       ?       ? 
1 1 1   48    5   34 o    191.8    4.2    0.0000   0.0000          ?        ?   368.4270  15.9630          ?        ?      191.8        4.2       ?       ? 
1 1 1   48    5   35 o     36.1   14.5    0.0000   0.0000          ?        ?     6.3852  15.9630          ?        ?       36.1       14.5       ?       ? 
1 1 1   48    5   36 o    276.5    3.2    0.0000   0.0000          ?        ?   764.9489  17.8786          ?        ?      276.5        3.2       ?       ? 
1 1 1   48    5   37 o    220.0    3.9    0.0000   0.0000          ?        ?   484.6379  17.2401          ?        ?      220.0        3.9       ?       ? 
1 1 1   48    5   38 o     86.9    9.6    0.0000   0.0000          ?        ?    75.9841  16.6016          ?        ?       86.9        9.6       ?       ? 
1 1 1   48    5   39 o    124.1    6.7    0.0000   0.0000          ?        ?   154.5222  16.6016          ?        ?      124.1        6.7       ?       ? 
1 1 1   48    5   40 o    145.8    5.7    0.0000   0.0000          ?        ?   213.2662  16.6016          ?        ?      145.8        5.7       ?       ? 
1 1 1   48    5   41 o     87.9    9.8    0.0000   0.0000          ?        ?    77.8996  17.2401          ?        ?       87.9        9.8       ?       ? 
1 1 1   48    5   42 o    239.0    3.6    0.0000   0.0000          ?        ?   572.1154  17.2401          ?        ?      239.0        3.6       ?       ? 
1 1 1   48    5   43 o    367.6    3.0    0.0000   0.0000          ?        ?  1352.3888  21.7097          ?        ?      367.6        3.0       ?       ? 
1 1 1   48    5   44 o    223.2    4.1    0.0000   0.0000          ?        ?   499.3239  18.5171          ?        ?      223.2        4.1       ?       ? 
1 1 1   48    5   45 o     97.1    8.9    0.0000   0.0000          ?        ?    95.1397  17.2401          ?        ?       97.1        8.9       ?       ? 
1 1 1   48    5   46 o    207.4    4.5    0.0000   0.0000          ?        ?   431.0021  18.5171          ?        ?      207.4        4.5       ?       ? 
1 1 1   48    5   47 o    232.8    4.3    0.0000   0.0000          ?        ?   543.3819  19.7942          ?        ?      232.8        4.3       ?       ? 
1 1 1   48    5   48 o     23.1   11.4    0.0000   0.0000          ?        ?   -38.3113  18.5171          ?        ?       23.1       11.4       ?       ? 
1 1 1   48    5   49 o     95.3    9.0    0.0000   0.0000          ?        ?    91.9471  17.2401          ?        ?       95.3        9.0       ?       ? 
1 1 1   48    5   50 o    121.0    7.1    0.0000   0.0000          ?        ?   147.4985  17.2401          ?        ?      121.0        7.1       ?       ? 
1 1 1   48    5   51 o     74.5   11.6    0.0000   0.0000          ?        ?    56.8284  17.2401          ?        ?       74.5       11.6       ?       ? 
1 1 1   48    5   52 o     45.7   15.7    0.0000   0.0000          ?        ?    20.4327  17.2401          ?        ?       45.7       15.7       ?       ? 
1 1 1   48    5   53 o     24.6   11.9    0.0000   0.0000          ?        ?   -24.9023  17.2401          ?        ?       24.6       11.9       ?       ? 
1 1 1   48    6    0 f    653.1    4.8 4267.8789  62.5751  4267.8789  62.5751  4267.8789  62.5751      653.1      4.8      653.1        4.8     0.0     0.0 
1 1 1   48    6    1 o    315.6    2.7    0.0000   0.0000          ?        ?   996.0938  17.2401          ?        ?      315.6        2.7       ?       ? 
1 1 1   48    6    2 f    224.3    3.1    0.0000   0.0000          ?        ?   503.1551  14.0475          ?        ?      224.3        3.1       ?       ? 
1 1 1   48    6    3 o     18.2    9.0    0.0000   0.0000          ?        ?   -28.0950  12.1319          ?        ?       18.2        9.0       ?       ? 
1 1 1   48    6    4 o    261.3    3.1    0.0000   0.0000          ?        ?   683.2181  15.9630          ?        ?      261.3        3.1       ?       ? 
1 1 1   48    6    5 o    419.0    2.7    0.0000   0.0000          ?        ?  1755.9344  22.3483          ?        ?      419.0        2.7       ?       ? 
1 1 1   48    6    6 o    162.1    3.9    0.0000   0.0000          ?        ?   263.0709  12.7704          ?        ?      162.1        3.9       ?       ? 
1 1 1   48    6    7 o    260.4    2.9    0.0000   0.0000          ?        ?   678.1099  15.3245          ?        ?      260.4        2.9       ?       ? 
1 1 1   48    6    8 o    315.5    2.6    0.0000   0.0000          ?        ?   995.4552  16.6016          ?        ?      315.5        2.6       ?       ? 
1 1 1   48    6    9 o    242.1    3.2    0.0000   0.0000          ?        ?   586.1629  15.3245          ?        ?      242.1        3.2       ?       ? 
1 1 1   48    6   10 o     74.0    7.8    0.0000   0.0000          ?        ?    54.9129  11.4934          ?        ?       74.0        7.8       ?       ? 
1 1 1   48    6   11 o     21.7   10.2    0.0000   0.0000          ?        ?   -12.7704  11.4934          ?        ?       21.7       10.2       ?       ? 
1 1 1   48    6   12 o     91.4    7.3    0.0000   0.0000          ?        ?    83.6463  13.4090          ?        ?       91.4        7.3       ?       ? 
1 1 1   48    6   13 f    560.2    3.1    0.0000   0.0000          ?        ?  3139.6108  34.4802          ?        ?      560.2        3.1       ?       ? 
1 1 1   48    6   14 o    235.5    3.1    0.0000   0.0000          ?        ?   554.8753  14.6860          ?        ?      235.5        3.1       ?       ? 
1 1 1   48    6   15 o    350.0    2.9    0.0000   0.0000          ?        ?  1225.3230  20.4327          ?        ?      350.0        2.9       ?       ? 
1 1 1   48    6   16 o    394.2    2.6    0.0000   0.0000          ?        ?  1554.8002  20.4327          ?        ?      394.2        2.6       ?       ? 
1 1 1   48    6   17 o    306.4    2.7    0.0000   0.0000          ?        ?   939.2654  16.6016          ?        ?      306.4        2.7       ?       ? 
1 1 1   48    6   18 o    263.9    2.8    0.0000   0.0000          ?        ?   696.6271  14.6860          ?        ?      263.9        2.8       ?       ? 
1 1 1   48    6   19 o    473.6    2.9    0.0000   0.0000          ?        ?  2243.7649  27.4564          ?        ?      473.6        2.9       ?       ? 
1 1 1   48    6   20 o    512.2    2.7    0.0000   0.0000          ?        ?  2624.3240  27.4564          ?        ?      512.2        2.7       ?       ? 
1 1 1   48    6   21 o    349.8    2.6    0.0000   0.0000          ?        ?  1224.0459  17.8786          ?        ?      349.8        2.6       ?       ? 
1 1 1   48    6   22 o    128.0    5.0    0.0000   0.0000          ?        ?   164.1001  12.7704          ?        ?      128.0        5.0       ?       ? 
1 1 1   48    6   23 o    330.9    2.6    0.0000   0.0000          ?        ?  1095.0646  17.2401          ?        ?      330.9        2.6       ?       ? 
1 1 1   48    6   24 o     93.7    7.2    0.0000   0.0000          ?        ?    88.1160  13.4090          ?        ?       93.7        7.2       ?       ? 
1 1 1   48    6   25 o    387.3    2.5    0.0000   0.0000          ?        ?  1500.5259  19.1556          ?        ?      387.3        2.5       ?       ? 
1 1 1   48    6   26 o     84.0    8.0    0.0000   0.0000          ?        ?    70.8759  13.4090          ?        ?       84.0        8.0       ?       ? 
1 1 1   48    6   27 o     24.4   11.4    0.0000   0.0000          ?        ?   -12.1319  13.4090          ?        ?       24.4       11.4       ?       ? 
1 1 1   48    6   28 o    261.8    3.0    0.0000   0.0000          ?        ?   685.7722  15.9630          ?        ?      261.8        3.0       ?       ? 
1 1 1   48    6   29 o    357.3    2.7    0.0000   0.0000          ?        ?  1277.0432  19.1556          ?        ?      357.3        2.7       ?       ? 
1 1 1   48    6   30 o     39.4   14.4    0.0000   0.0000          ?        ?    12.7704  14.6860          ?        ?       39.4       14.4       ?       ? 
1 1 1   48    6   31 o    210.3    3.6    0.0000   0.0000          ?        ?   442.4955  15.3245          ?        ?      210.3        3.6       ?       ? 
1 1 1   48    6   32 o     93.7    8.2    0.0000   0.0000          ?        ?    88.1160  15.3245          ?        ?       93.7        8.2       ?       ? 
1 1 1   48    6   33 o    300.0    3.0    0.0000   0.0000          ?        ?   900.3155  17.8786          ?        ?      300.0        3.0       ?       ? 
1 1 1   48    6   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48    6   35 o    208.7    4.0    0.0000   0.0000          ?        ?   436.1103  16.6016          ?        ?      208.7        4.0       ?       ? 
1 1 1   48    6   36 o    450.2    2.6    0.0000   0.0000          ?        ?  2027.9447  23.6253          ?        ?      450.2        2.6       ?       ? 
1 1 1   48    6   37 o    238.5    3.6    0.0000   0.0000          ?        ?   569.5613  17.2401          ?        ?      238.5        3.6       ?       ? 
1 1 1   48    6   38 o    404.6    2.7    0.0000   0.0000          ?        ?  1637.8080  21.7097          ?        ?      404.6        2.7       ?       ? 
1 1 1   48    6   39 o    198.7    4.2    0.0000   0.0000          ?        ?   395.2449  16.6016          ?        ?      198.7        4.2       ?       ? 
1 1 1   48    6   40 o    164.1    5.3    0.0000   0.0000          ?        ?   270.0946  17.2401          ?        ?      164.1        5.3       ?       ? 
1 1 1   48    6   41 o    101.1    7.9    0.0000   0.0000          ?        ?   102.8020  15.9630          ?        ?      101.1        7.9       ?       ? 
1 1 1   48    6   42 o     45.6   15.1    0.0000   0.0000          ?        ?    20.4327  15.9630          ?        ?       45.6       15.1       ?       ? 
1 1 1   48    6   43 o     26.3   12.3    0.0000   0.0000          ?        ?   -17.2401  16.6016          ?        ?       26.3       12.3       ?       ? 
1 1 1   48    6   44 o    100.3    8.9    0.0000   0.0000          ?        ?   101.5249  17.8786          ?        ?      100.3        8.9       ?       ? 
1 1 1   48    6   45 o     43.0   15.6    0.0000   0.0000          ?        ?    15.9630  17.2401          ?        ?       43.0       15.6       ?       ? 
1 1 1   48    6   46 o    140.6    6.1    0.0000   0.0000          ?        ?   198.5802  17.2401          ?        ?      140.6        6.1       ?       ? 
1 1 1   48    6   47 o    164.4    5.4    0.0000   0.0000          ?        ?   271.3717  17.8786          ?        ?      164.4        5.4       ?       ? 
1 1 1   48    6   48 o    139.4    6.4    0.0000   0.0000          ?        ?   195.3876  17.8786          ?        ?      139.4        6.4       ?       ? 
1 1 1   48    6   49 o    227.7    4.1    0.0000   0.0000          ?        ?   519.7566  18.5171          ?        ?      227.7        4.1       ?       ? 
1 1 1   48    6   50 o     79.5   10.8    0.0000   0.0000          ?        ?    64.4907  17.2401          ?        ?       79.5       10.8       ?       ? 
1 1 1   48    6   51 o    136.5    6.6    0.0000   0.0000          ?        ?   187.7254  17.8786          ?        ?      136.5        6.6       ?       ? 
1 1 1   48    6   52 o    173.9    5.1    0.0000   0.0000          ?        ?   303.9363  17.8786          ?        ?      173.9        5.1       ?       ? 
1 1 1   48    7    0 o    292.8    4.3  858.1730  24.9023   858.1730  24.9023   858.1730  24.9023      292.8      4.3      292.8        4.3     0.0     0.0 
1 1 1   48    7    1 o    213.0    3.1    0.0000   0.0000          ?        ?   453.9889  13.4090          ?        ?      213.0        3.1       ?       ? 
1 1 1   48    7    2 o    355.7    2.5    0.0000   0.0000          ?        ?  1265.5498  17.8786          ?        ?      355.7        2.5       ?       ? 
1 1 1   48    7    3 o    616.6    3.2    0.0000   0.0000          ?        ?  3803.0347  38.9498          ?        ?      616.6        3.2       ?       ? 
1 1 1   48    7    4 o    143.1    4.5    0.0000   0.0000          ?        ?   204.9654  12.7704          ?        ?      143.1        4.5       ?       ? 
1 1 1   48    7    5 o    253.5    2.9    0.0000   0.0000          ?        ?   642.9913  14.6860          ?        ?      253.5        2.9       ?       ? 
1 1 1   48    7    6 o    292.6    2.7    0.0000   0.0000          ?        ?   856.2576  15.9630          ?        ?      292.6        2.7       ?       ? 
1 1 1   48    7    7 o    283.1    2.7    0.0000   0.0000          ?        ?   801.9832  15.3245          ?        ?      283.1        2.7       ?       ? 
1 1 1   48    7    8 o    335.3    2.6    0.0000   0.0000          ?        ?  1124.4366  17.2401          ?        ?      335.3        2.6       ?       ? 
1 1 1   48    7    9 o    200.4    3.3    0.0000   0.0000          ?        ?   401.6301  13.4090          ?        ?      200.4        3.3       ?       ? 
1 1 1   48    7   10 f    284.8    2.7    0.0000   0.0000          ?        ?   811.5610  15.3245          ?        ?      284.8        2.7       ?       ? 
1 1 1   48    7   11 o     81.0    7.9    0.0000   0.0000          ?        ?    65.7677  12.7704          ?        ?       81.0        7.9       ?       ? 
1 1 1   48    7   12 o    187.5    3.6    0.0000   0.0000          ?        ?   351.8254  13.4090          ?        ?      187.5        3.6       ?       ? 
1 1 1   48    7   13 o    412.0    2.7    0.0000   0.0000          ?        ?  1697.8290  22.3483          ?        ?      412.0        2.7       ?       ? 
1 1 1   48    7   14 o    362.4    2.9    0.0000   0.0000          ?        ?  1314.0775  21.0712          ?        ?      362.4        2.9       ?       ? 
1 1 1   48    7   15 f     90.7    7.0    0.0000   0.0000          ?        ?    82.3693  12.7704          ?        ?       90.7        7.0       ?       ? 
1 1 1   48    7   16 o    301.3    2.9    0.0000   0.0000          ?        ?   907.9777  17.2401          ?        ?      301.3        2.9       ?       ? 
1 1 1   48    7   17 o    283.8    3.0    0.0000   0.0000          ?        ?   805.8143  17.2401          ?        ?      283.8        3.0       ?       ? 
1 1 1   48    7   18 o    625.9    2.9    0.0000   0.0000          ?        ?  3919.2456  35.7572          ?        ?      625.9        2.9       ?       ? 
1 1 1   48    7   19 o    351.5    2.7    0.0000   0.0000          ?        ?  1236.1779  19.1556          ?        ?      351.5        2.7       ?       ? 
1 1 1   48    7   20 o    216.3    3.4    0.0000   0.0000          ?        ?   468.0364  14.6860          ?        ?      216.3        3.4       ?       ? 
1 1 1   48    7   21 o     58.1   11.4    0.0000   0.0000          ?        ?    35.1187  12.7704          ?        ?       58.1       11.4       ?       ? 
1 1 1   48    7   22 o    297.6    2.7    0.0000   0.0000          ?        ?   886.2681  15.9630          ?        ?      297.6        2.7       ?       ? 
1 1 1   48    7   23 o    108.0    6.2    0.0000   0.0000          ?        ?   116.8494  13.4090          ?        ?      108.0        6.2       ?       ? 
1 1 1   48    7   24 o    141.3    5.0    0.0000   0.0000          ?        ?   199.8573  14.0475          ?        ?      141.3        5.0       ?       ? 
1 1 1   48    7   25 o    305.7    2.8    0.0000   0.0000          ?        ?   934.7956  17.2401          ?        ?      305.7        2.8       ?       ? 
1 1 1   48    7   26 o    376.3    2.6    0.0000   0.0000          ?        ?  1416.8794  19.7942          ?        ?      376.3        2.6       ?       ? 
1 1 1   48    7   27 o    460.7    2.5    0.0000   0.0000          ?        ?  2123.0845  22.9868          ?        ?      460.7        2.5       ?       ? 
1 1 1   48    7   28 o    309.8    2.8    0.0000   0.0000          ?        ?   960.3365  17.2401          ?        ?      309.8        2.8       ?       ? 
1 1 1   48    7   29 o    331.3    2.7    0.0000   0.0000          ?        ?  1098.2572  17.8786          ?        ?      331.3        2.7       ?       ? 
1 1 1   48    7   30 o    233.3    3.6    0.0000   0.0000          ?        ?   544.6590  16.6016          ?        ?      233.3        3.6       ?       ? 
1 1 1   48    7   31 o    290.7    2.9    0.0000   0.0000          ?        ?   845.4026  16.6016          ?        ?      290.7        2.9       ?       ? 
1 1 1   48    7   32 o    193.5    4.1    0.0000   0.0000          ?        ?   374.8122  15.9630          ?        ?      193.5        4.1       ?       ? 
1 1 1   48    7   33 o    194.8    4.1    0.0000   0.0000          ?        ?   379.9204  15.9630          ?        ?      194.8        4.1       ?       ? 
1 1 1   48    7   34 o    261.2    3.3    0.0000   0.0000          ?        ?   682.5797  17.2401          ?        ?      261.2        3.3       ?       ? 
1 1 1   48    7   35 o    272.8    3.2    0.0000   0.0000          ?        ?   744.5162  17.2401          ?        ?      272.8        3.2       ?       ? 
1 1 1   48    7   36 o    161.8    4.9    0.0000   0.0000          ?        ?   262.4324  15.9630          ?        ?      161.8        4.9       ?       ? 
1 1 1   48    7   37 o    241.6    3.6    0.0000   0.0000          ?        ?   584.2473  17.2401          ?        ?      241.6        3.6       ?       ? 
1 1 1   48    7   38 o    209.6    4.3    0.0000   0.0000          ?        ?   439.9414  17.8786          ?        ?      209.6        4.3       ?       ? 
1 1 1   48    7   39 o    106.6    7.5    0.0000   0.0000          ?        ?   114.2954  15.9630          ?        ?      106.6        7.5       ?       ? 
1 1 1   48    7   40 o     32.5   13.9    0.0000   0.0000          ?        ?     0.0000  15.9630          ?        ?       32.5       13.9       ?       ? 
1 1 1   48    7   41 o     95.9    8.3    0.0000   0.0000          ?        ?    92.5856  15.9630          ?        ?       95.9        8.3       ?       ? 
1 1 1   48    7   42 o    110.9    7.8    0.0000   0.0000          ?        ?   123.8732  17.2401          ?        ?      110.9        7.8       ?       ? 
1 1 1   48    7   43 o    112.3    7.7    0.0000   0.0000          ?        ?   127.0658  17.2401          ?        ?      112.3        7.7       ?       ? 
1 1 1   48    7   44 o    104.0    8.6    0.0000   0.0000          ?        ?   109.1872  17.8786          ?        ?      104.0        8.6       ?       ? 
1 1 1   48    7   45 o     53.5   16.0    0.0000   0.0000          ?        ?    30.0105  18.5171          ?        ?       53.5       16.0       ?       ? 
1 1 1   48    7   46 o    215.9    4.1    0.0000   0.0000          ?        ?   467.3978  17.8786          ?        ?      215.9        4.1       ?       ? 
1 1 1   48    7   47 o     29.1   13.3    0.0000   0.0000          ?        ?   -10.8549  17.2401          ?        ?       29.1       13.3       ?       ? 
1 1 1   48    7   48 o     27.0   12.6    0.0000   0.0000          ?        ?   -14.6860  16.6016          ?        ?       27.0       12.6       ?       ? 
1 1 1   48    7   49 o     31.6   14.0    0.0000   0.0000          ?        ?    -5.7467  17.8786          ?        ?       31.6       14.0       ?       ? 
1 1 1   48    7   50 o     45.5   15.9    0.0000   0.0000          ?        ?    19.7942  17.8786          ?        ?       45.5       15.9       ?       ? 
1 1 1   48    7   51 o     49.4   15.6    0.0000   0.0000          ?        ?    25.5409  17.2401          ?        ?       49.4       15.6       ?       ? 
1 1 1   48    8    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48    8    1 o    166.0    4.0    0.0000   0.0000          ?        ?   275.8413  13.4090          ?        ?      166.0        4.0       ?       ? 
1 1 1   48    8    2 o     27.8   11.6    0.0000   0.0000          ?        ?     1.2770  10.8549          ?        ?       27.8       11.6       ?       ? 
1 1 1   48    8    3 o    243.0    2.9    0.0000   0.0000          ?        ?   590.6325  14.0475          ?        ?      243.0        2.9       ?       ? 
1 1 1   48    8    4 o    447.6    2.9    0.0000   0.0000          ?        ?  2004.3193  25.5409          ?        ?      447.6        2.9       ?       ? 
1 1 1   48    8    5 o    503.8    3.0    0.0000   0.0000          ?        ?  2539.4006  30.6490          ?        ?      503.8        3.0       ?       ? 
1 1 1   48    8    6 o    262.1    2.8    0.0000   0.0000          ?        ?   687.0493  14.6860          ?        ?      262.1        2.8       ?       ? 
1 1 1   48    8    7 o    312.7    2.6    0.0000   0.0000          ?        ?   978.2151  15.9630          ?        ?      312.7        2.6       ?       ? 
1 1 1   48    8    8 o    325.6    2.6    0.0000   0.0000          ?        ?  1060.5845  17.2401          ?        ?      325.6        2.6       ?       ? 
1 1 1   48    8    9 o    218.2    3.1    0.0000   0.0000          ?        ?   476.3371  13.4090          ?        ?      218.2        3.1       ?       ? 
1 1 1   48    8   10 o     20.7   10.0    0.0000   0.0000          ?        ?   -21.0712  12.7704          ?        ?       20.7       10.0       ?       ? 
1 1 1   48    8   11 o    256.6    3.0    0.0000   0.0000          ?        ?   658.9543  15.3245          ?        ?      256.6        3.0       ?       ? 
1 1 1   48    8   12 o    272.3    3.0    0.0000   0.0000          ?        ?   741.9621  16.6016          ?        ?      272.3        3.0       ?       ? 
1 1 1   48    8   13 o    261.7    2.9    0.0000   0.0000          ?        ?   685.1337  15.3245          ?        ?      261.7        2.9       ?       ? 
1 1 1   48    8   14 o    156.3    4.1    0.0000   0.0000          ?        ?   244.5538  12.7704          ?        ?      156.3        4.1       ?       ? 
1 1 1   48    8   15 o    578.9    3.4    0.0000   0.0000          ?        ?  3353.5156  39.5883          ?        ?      578.9        3.4       ?       ? 
1 1 1   48    8   16 o    264.7    3.4    0.0000   0.0000          ?        ?   701.0967  17.8786          ?        ?      264.7        3.4       ?       ? 
1 1 1   48    8   17 o    571.5    3.1    0.0000   0.0000          ?        ?  3267.3152  35.1187          ?        ?      571.5        3.1       ?       ? 
1 1 1   48    8   18 o    274.7    2.8    0.0000   0.0000          ?        ?   754.7325  15.3245          ?        ?      274.7        2.8       ?       ? 
1 1 1   48    8   19 o    335.5    2.7    0.0000   0.0000          ?        ?  1126.3521  17.8786          ?        ?      335.5        2.7       ?       ? 
1 1 1   48    8   20 o    133.4    5.0    0.0000   0.0000          ?        ?   178.1475  13.4090          ?        ?      133.4        5.0       ?       ? 
1 1 1   48    8   21 o    552.4    2.8    0.0000   0.0000          ?        ?  3052.7720  30.6490          ?        ?      552.4        2.8       ?       ? 
1 1 1   48    8   22 o    131.7    5.1    0.0000   0.0000          ?        ?   173.6779  13.4090          ?        ?      131.7        5.1       ?       ? 
1 1 1   48    8   23 o    239.6    3.2    0.0000   0.0000          ?        ?   574.6694  15.3245          ?        ?      239.6        3.2       ?       ? 
1 1 1   48    8   24 o    395.7    2.5    0.0000   0.0000          ?        ?  1566.2936  19.7942          ?        ?      395.7        2.5       ?       ? 
1 1 1   48    8   25 o    175.2    4.2    0.0000   0.0000          ?        ?   307.1289  14.6860          ?        ?      175.2        4.2       ?       ? 
1 1 1   48    8   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48    8   27 o    202.9    3.6    0.0000   0.0000          ?        ?   411.8464  14.6860          ?        ?      202.9        3.6       ?       ? 
1 1 1   48    8   28 o    107.4    6.5    0.0000   0.0000          ?        ?   115.5724  14.0475          ?        ?      107.4        6.5       ?       ? 
1 1 1   48    8   29 o    195.0    3.9    0.0000   0.0000          ?        ?   380.5589  15.3245          ?        ?      195.0        3.9       ?       ? 
1 1 1   48    8   30 o    451.2    2.7    0.0000   0.0000          ?        ?  2036.8840  24.2638          ?        ?      451.2        2.7       ?       ? 
1 1 1   48    8   31 o    521.3    2.8    0.0000   0.0000          ?        ?  2718.8250  29.3720          ?        ?      521.3        2.8       ?       ? 
1 1 1   48    8   32 o    117.3    6.5    0.0000   0.0000          ?        ?   137.9207  15.3245          ?        ?      117.3        6.5       ?       ? 
1 1 1   48    8   33 o    336.5    2.8    0.0000   0.0000          ?        ?  1132.7373  19.1556          ?        ?      336.5        2.8       ?       ? 
1 1 1   48    8   34 o    358.9    2.7    0.0000   0.0000          ?        ?  1288.5366  19.1556          ?        ?      358.9        2.7       ?       ? 
1 1 1   48    8   35 o    135.4    5.9    0.0000   0.0000          ?        ?   183.8942  15.9630          ?        ?      135.4        5.9       ?       ? 
1 1 1   48    8   36 o    129.9    6.1    0.0000   0.0000          ?        ?   169.2082  15.9630          ?        ?      129.9        6.1       ?       ? 
1 1 1   48    8   37 o    367.2    2.8    0.0000   0.0000          ?        ?  1349.1962  20.4327          ?        ?      367.2        2.8       ?       ? 
1 1 1   48    8   38 o     56.5   14.1    0.0000   0.0000          ?        ?    33.8416  15.9630          ?        ?       56.5       14.1       ?       ? 
1 1 1   48    8   39 o    123.3    6.7    0.0000   0.0000          ?        ?   152.6067  16.6016          ?        ?      123.3        6.7       ?       ? 
1 1 1   48    8   40 o    198.0    4.2    0.0000   0.0000          ?        ?   392.6908  16.6016          ?        ?      198.0        4.2       ?       ? 
1 1 1   48    8   41 o    231.4    3.9    0.0000   0.0000          ?        ?   536.3582  17.8786          ?        ?      231.4        3.9       ?       ? 
1 1 1   48    8   42 o    268.7    3.3    0.0000   0.0000          ?        ?   722.8065  17.8786          ?        ?      268.7        3.3       ?       ? 
1 1 1   48    8   43 o    123.9    7.0    0.0000   0.0000          ?        ?   154.5222  17.2401          ?        ?      123.9        7.0       ?       ? 
1 1 1   48    8   44 o    166.7    5.6    0.0000   0.0000          ?        ?   279.0340  18.5171          ?        ?      166.7        5.6       ?       ? 
1 1 1   48    8   45 o     27.3   12.8    0.0000   0.0000          ?        ?   -15.9630  17.2401          ?        ?       27.3       12.8       ?       ? 
1 1 1   48    8   46 o    118.9    7.0    0.0000   0.0000          ?        ?   142.3903  16.6016          ?        ?      118.9        7.0       ?       ? 
1 1 1   48    8   47 o    144.3    6.0    0.0000   0.0000          ?        ?   209.4351  17.2401          ?        ?      144.3        6.0       ?       ? 
1 1 1   48    8   48 o    218.1    4.1    0.0000   0.0000          ?        ?   476.9756  17.8786          ?        ?      218.1        4.1       ?       ? 
1 1 1   48    8   49 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48    8   50 o     20.5   10.2    0.0000   0.0000          ?        ?   -45.3350  17.2401          ?        ?       20.5       10.2       ?       ? 
1 1 1   48    9    0 o    310.9    4.1  967.3603  25.5409   967.3603  25.5409   967.3603  25.5409      310.9      4.1      310.9        4.1     0.0     0.0 
1 1 1   48    9    1 o    701.8    3.2    0.0000   0.0000          ?        ?  4928.1099  45.3350          ?        ?      701.8        3.2       ?       ? 
1 1 1   48    9    2 o    168.3    3.6    0.0000   0.0000          ?        ?   283.5036  12.1319          ?        ?      168.3        3.6       ?       ? 
1 1 1   48    9    3 o    424.3    2.7    0.0000   0.0000          ?        ?  1800.6310  22.9868          ?        ?      424.3        2.7       ?       ? 
1 1 1   48    9    4 o    192.2    3.2    0.0000   0.0000          ?        ?   369.7040  12.1319          ?        ?      192.2        3.2       ?       ? 
1 1 1   48    9    5 o    391.1    2.5    0.0000   0.0000          ?        ?  1529.8978  19.7942          ?        ?      391.1        2.5       ?       ? 
1 1 1   48    9    6 o    266.5    2.8    0.0000   0.0000          ?        ?   710.6746  14.6860          ?        ?      266.5        2.8       ?       ? 
1 1 1   48    9    7 o    218.6    3.2    0.0000   0.0000          ?        ?   478.2527  14.0475          ?        ?      218.6        3.2       ?       ? 
1 1 1   48    9    8 o    180.0    3.5    0.0000   0.0000          ?        ?   324.3690  12.7704          ?        ?      180.0        3.5       ?       ? 
1 1 1   48    9    9 o    459.0    2.6    0.0000   0.0000          ?        ?  2107.1213  24.2638          ?        ?      459.0        2.6       ?       ? 
1 1 1   48    9   10 o    219.4    3.1    0.0000   0.0000          ?        ?   481.4453  13.4090          ?        ?      219.4        3.1       ?       ? 
1 1 1   48    9   11 o    361.2    2.9    0.0000   0.0000          ?        ?  1305.1382  21.0712          ?        ?      361.2        2.9       ?       ? 
1 1 1   48    9   12 o    153.8    4.2    0.0000   0.0000          ?        ?   236.8915  12.7704          ?        ?      153.8        4.2       ?       ? 
1 1 1   48    9   13 o    206.8    3.2    0.0000   0.0000          ?        ?   427.8095  13.4090          ?        ?      206.8        3.2       ?       ? 
1 1 1   48    9   14 o    151.7    4.6    0.0000   0.0000          ?        ?   230.5063  14.0475          ?        ?      151.7        4.6       ?       ? 
1 1 1   48    9   15 o    128.3    5.2    0.0000   0.0000          ?        ?   164.7386  13.4090          ?        ?      128.3        5.2       ?       ? 
1 1 1   48    9   16 o    136.7    5.4    0.0000   0.0000          ?        ?   187.0868  14.6860          ?        ?      136.7        5.4       ?       ? 
1 1 1   48    9   17 o    273.3    2.9    0.0000   0.0000          ?        ?   747.0703  15.9630          ?        ?      273.3        2.9       ?       ? 
1 1 1   48    9   18 o    147.7    4.1    0.0000   0.0000          ?        ?   218.3744  12.1319          ?        ?      147.7        4.1       ?       ? 
1 1 1   48    9   19 o    304.0    2.6    0.0000   0.0000          ?        ?   924.5793  15.9630          ?        ?      304.0        2.6       ?       ? 
1 1 1   48    9   20 o     46.0   13.6    0.0000   0.0000          ?        ?    21.7097  13.4090          ?        ?       46.0       13.6       ?       ? 
1 1 1   48    9   21 o     76.5    9.2    0.0000   0.0000          ?        ?    58.7440  14.0475          ?        ?       76.5        9.2       ?       ? 
1 1 1   48    9   22 o    266.7    3.1    0.0000   0.0000          ?        ?   711.9516  16.6016          ?        ?      266.7        3.1       ?       ? 
1 1 1   48    9   23 o    225.8    3.4    0.0000   0.0000          ?        ?   510.1788  15.3245          ?        ?      225.8        3.4       ?       ? 
1 1 1   48    9   24 o    212.1    3.5    0.0000   0.0000          ?        ?   450.1577  14.6860          ?        ?      212.1        3.5       ?       ? 
1 1 1   48    9   25 o     18.6    9.3    0.0000   0.0000          ?        ?   -41.5039  14.6860          ?        ?       18.6        9.3       ?       ? 
1 1 1   48    9   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48    9   27 o    139.0    5.1    0.0000   0.0000          ?        ?   193.4720  14.0475          ?        ?      139.0        5.1       ?       ? 
1 1 1   48    9   28 o     25.2   11.7    0.0000   0.0000          ?        ?   -12.1319  14.0475          ?        ?       25.2       11.7       ?       ? 
1 1 1   48    9   29 o    274.8    3.0    0.0000   0.0000          ?        ?   755.3711  16.6016          ?        ?      274.8        3.0       ?       ? 
1 1 1   48    9   30 o    396.4    2.7    0.0000   0.0000          ?        ?  1572.0403  21.7097          ?        ?      396.4        2.7       ?       ? 
1 1 1   48    9   31 o     80.8    9.1    0.0000   0.0000          ?        ?    65.7677  14.6860          ?        ?       80.8        9.1       ?       ? 
1 1 1   48    9   32 o    255.3    3.4    0.0000   0.0000          ?        ?   652.5691  17.2401          ?        ?      255.3        3.4       ?       ? 
1 1 1   48    9   33 o    112.2    6.5    0.0000   0.0000          ?        ?   126.4273  14.6860          ?        ?      112.2        6.5       ?       ? 
1 1 1   48    9   34 o    265.7    3.4    0.0000   0.0000          ?        ?   706.8434  17.8786          ?        ?      265.7        3.4       ?       ? 
1 1 1   48    9   35 o    171.4    4.7    0.0000   0.0000          ?        ?   294.3585  15.9630          ?        ?      171.4        4.7       ?       ? 
1 1 1   48    9   36 o    251.9    3.4    0.0000   0.0000          ?        ?   635.3290  17.2401          ?        ?      251.9        3.4       ?       ? 
1 1 1   48    9   37 o    191.3    4.3    0.0000   0.0000          ?        ?   366.5114  16.6016          ?        ?      191.3        4.3       ?       ? 
1 1 1   48    9   38 o    222.4    3.9    0.0000   0.0000          ?        ?   495.4928  17.2401          ?        ?      222.4        3.9       ?       ? 
1 1 1   48    9   39 o     18.7    9.4    0.0000   0.0000          ?        ?   -53.6358  16.6016          ?        ?       18.7        9.4       ?       ? 
1 1 1   48    9   40 o     73.5   11.7    0.0000   0.0000          ?        ?    54.9129  17.2401          ?        ?       73.5       11.7       ?       ? 
1 1 1   48    9   41 o    189.0    4.6    0.0000   0.0000          ?        ?   358.2106  17.2401          ?        ?      189.0        4.6       ?       ? 
1 1 1   48    9   42 o    131.7    6.5    0.0000   0.0000          ?        ?   174.3164  17.2401          ?        ?      131.7        6.5       ?       ? 
1 1 1   48    9   43 o     61.9   14.2    0.0000   0.0000          ?        ?    40.8654  17.2401          ?        ?       61.9       14.2       ?       ? 
1 1 1   48    9   44 o     89.5    9.6    0.0000   0.0000          ?        ?    81.0922  17.2401          ?        ?       89.5        9.6       ?       ? 
1 1 1   48    9   45 o     54.2   14.9    0.0000   0.0000          ?        ?    31.2876  16.6016          ?        ?       54.2       14.9       ?       ? 
1 1 1   48    9   46 o    164.3    5.4    0.0000   0.0000          ?        ?   271.3717  17.8786          ?        ?      164.3        5.4       ?       ? 
1 1 1   48    9   47 o    221.1    4.0    0.0000   0.0000          ?        ?   490.3846  17.8786          ?        ?      221.1        4.0       ?       ? 
1 1 1   48    9   48 o     23.3   11.4    0.0000   0.0000          ?        ?   -30.6490  17.2401          ?        ?       23.3       11.4       ?       ? 
1 1 1   48    9   49 o     38.3   15.3    0.0000   0.0000          ?        ?     8.3008  17.8786          ?        ?       38.3       15.3       ?       ? 
1 1 1   48   10    0 o     44.0   17.4   26.8179  14.6860    26.8179  14.6860    26.8179  14.6860       44.0     17.4       44.0       17.4     0.0     0.0 
1 1 1   48   10    1 f     17.8    8.7    0.0000   0.0000          ?        ?   -19.1556  10.2163          ?        ?       17.8        8.7       ?       ? 
1 1 1   48   10    2 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48   10    3 o    103.5    4.9    0.0000   0.0000          ?        ?   107.2716  10.2163          ?        ?      103.5        4.9       ?       ? 
1 1 1   48   10    4 o    293.2    2.7    0.0000   0.0000          ?        ?   860.0886  15.9630          ?        ?      293.2        2.7       ?       ? 
1 1 1   48   10    5 o    143.8    3.8    0.0000   0.0000          ?        ?   206.8810  10.8549          ?        ?      143.8        3.8       ?       ? 
1 1 1   48   10    6 o    195.0    3.3    0.0000   0.0000          ?        ?   380.5589  12.7704          ?        ?      195.0        3.3       ?       ? 
1 1 1   48   10    7 o     76.5    7.1    0.0000   0.0000          ?        ?    58.7440  10.8549          ?        ?       76.5        7.1       ?       ? 
1 1 1   48   10    8 o    474.3    2.9    0.0000   0.0000          ?        ?  2250.7888  27.4564          ?        ?      474.3        2.9       ?       ? 
1 1 1   48   10    9 o    557.1    3.1    0.0000   0.0000          ?        ?  3105.1306  34.4802          ?        ?      557.1        3.1       ?       ? 
1 1 1   48   10   10 o    322.0    2.8    0.0000   0.0000          ?        ?  1036.9591  17.8786          ?        ?      322.0        2.8       ?       ? 
1 1 1   48   10   11 o    192.0    3.7    0.0000   0.0000          ?        ?   369.0655  14.0475          ?        ?      192.0        3.7       ?       ? 
1 1 1   48   10   12 o     15.5    7.8    0.0000   0.0000          ?        ?   -42.7809  12.1319          ?        ?       15.5        7.8       ?       ? 
1 1 1   48   10   13 o    193.4    3.5    0.0000   0.0000          ?        ?   374.1737  13.4090          ?        ?      193.4        3.5       ?       ? 
1 1 1   48   10   14 o    248.9    2.9    0.0000   0.0000          ?        ?   620.0045  14.6860          ?        ?      248.9        2.9       ?       ? 
1 1 1   48   10   15 o    167.2    4.0    0.0000   0.0000          ?        ?   279.6725  13.4090          ?        ?      167.2        4.0       ?       ? 
1 1 1   48   10   16 o     85.2    7.5    0.0000   0.0000          ?        ?    72.7915  12.7704          ?        ?       85.2        7.5       ?       ? 
1 1 1   48   10   17 o     23.6   11.0    0.0000   0.0000          ?        ?   -12.1319  12.7704          ?        ?       23.6       11.0       ?       ? 
1 1 1   48   10   18 o    349.2    2.6    0.0000   0.0000          ?        ?  1220.2148  17.8786          ?        ?      349.2        2.6       ?       ? 
1 1 1   48   10   19 o    149.4    4.7    0.0000   0.0000          ?        ?   223.4826  14.0475          ?        ?      149.4        4.7       ?       ? 
1 1 1   48   10   20 f    212.1    3.5    0.0000   0.0000          ?        ?   450.1577  14.6860          ?        ?      212.1        3.5       ?       ? 
1 1 1   48   10   21 o    419.5    2.6    0.0000   0.0000          ?        ?  1760.4042  21.7097          ?        ?      419.5        2.6       ?       ? 
1 1 1   48   10   22 o    224.2    3.4    0.0000   0.0000          ?        ?   503.1551  15.3245          ?        ?      224.2        3.4       ?       ? 
1 1 1   48   10   23 o     99.3    7.4    0.0000   0.0000          ?        ?    98.9709  14.6860          ?        ?       99.3        7.4       ?       ? 
1 1 1   48   10   24 o     38.4   14.0    0.0000   0.0000          ?        ?    12.1319  14.0475          ?        ?       38.4       14.0       ?       ? 
1 1 1   48   10   25 o    179.5    3.9    0.0000   0.0000          ?        ?   322.4534  14.0475          ?        ?      179.5        3.9       ?       ? 
1 1 1   48   10   26 o    351.3    2.7    0.0000   0.0000          ?        ?  1234.9008  19.1556          ?        ?      351.3        2.7       ?       ? 
1 1 1   48   10   27 o    181.8    4.0    0.0000   0.0000          ?        ?   330.7542  14.6860          ?        ?      181.8        4.0       ?       ? 
1 1 1   48   10   28 o    214.6    3.7    0.0000   0.0000          ?        ?   461.0126  15.9630          ?        ?      214.6        3.7       ?       ? 
1 1 1   48   10   29 o    215.2    3.7    0.0000   0.0000          ?        ?   463.5667  15.9630          ?        ?      215.2        3.7       ?       ? 
1 1 1   48   10   30 o     18.7    9.3    0.0000   0.0000          ?        ?   -40.8654  14.6860          ?        ?       18.7        9.3       ?       ? 
1 1 1   48   10   31 o    505.4    2.6    0.0000   0.0000          ?        ?  2556.0020  26.1794          ?        ?      505.4        2.6       ?       ? 
1 1 1   48   10   32 o    116.7    6.8    0.0000   0.0000          ?        ?   136.6436  15.9630          ?        ?      116.7        6.8       ?       ? 
1 1 1   48   10   33 o    181.9    4.4    0.0000   0.0000          ?        ?   331.3927  15.9630          ?        ?      181.9        4.4       ?       ? 
1 1 1   48   10   34 o    132.5    6.3    0.0000   0.0000          ?        ?   176.2320  16.6016          ?        ?      132.5        6.3       ?       ? 
1 1 1   48   10   35 o    222.2    3.7    0.0000   0.0000          ?        ?   494.2158  16.6016          ?        ?      222.2        3.7       ?       ? 
1 1 1   48   10   36 o    219.1    3.8    0.0000   0.0000          ?        ?   480.8068  16.6016          ?        ?      219.1        3.8       ?       ? 
1 1 1   48   10   37 o    420.3    2.7    0.0000   0.0000          ?        ?  1768.0663  22.3483          ?        ?      420.3        2.7       ?       ? 
1 1 1   48   10   38 o     19.8    9.9    0.0000   0.0000          ?        ?   -42.1424  15.9630          ?        ?       19.8        9.9       ?       ? 
1 1 1   48   10   39 o    347.5    2.9    0.0000   0.0000          ?        ?  1208.7214  20.4327          ?        ?      347.5        2.9       ?       ? 
1 1 1   48   10   40 o    140.6    6.1    0.0000   0.0000          ?        ?   198.5802  17.2401          ?        ?      140.6        6.1       ?       ? 
1 1 1   48   10   41 o    196.8    4.2    0.0000   0.0000          ?        ?   388.2211  16.6016          ?        ?      196.8        4.2       ?       ? 
1 1 1   48   10   42 o    170.7    5.0    0.0000   0.0000          ?        ?   292.4429  17.2401          ?        ?      170.7        5.0       ?       ? 
1 1 1   48   10   43 o    132.4    6.5    0.0000   0.0000          ?        ?   176.2320  17.2401          ?        ?      132.4        6.5       ?       ? 
1 1 1   48   10   44 o     37.3   15.0    0.0000   0.0000          ?        ?     7.0237  17.2401          ?        ?       37.3       15.0       ?       ? 
1 1 1   48   10   45 o     44.0   15.6    0.0000   0.0000          ?        ?    17.8786  17.2401          ?        ?       44.0       15.6       ?       ? 
1 1 1   48   10   46 o    178.0    4.8    0.0000   0.0000          ?        ?   317.9838  17.2401          ?        ?      178.0        4.8       ?       ? 
1 1 1   48   10   47 o     77.0   11.2    0.0000   0.0000          ?        ?    60.6596  17.2401          ?        ?       77.0       11.2       ?       ? 
1 1 1   48   10   48 o     49.6   15.9    0.0000   0.0000          ?        ?    25.5409  17.8786          ?        ?       49.6       15.9       ?       ? 
1 1 1   48   11    0 o    105.6    7.9  113.6568  16.6016   113.6568  16.6016   113.6568  16.6016      105.6      7.9      105.6        7.9     0.0     0.0 
1 1 1   48   11    1 o    112.7    4.5    0.0000   0.0000          ?        ?   127.0658  10.2163          ?        ?      112.7        4.5       ?       ? 
1 1 1   48   11    2 o    334.6    2.6    0.0000   0.0000          ?        ?  1119.9669  17.2401          ?        ?      334.6        2.6       ?       ? 
1 1 1   48   11    3 o    221.7    3.0    0.0000   0.0000          ?        ?   491.6617  13.4090          ?        ?      221.7        3.0       ?       ? 
1 1 1   48   11    4 o    235.1    2.7    0.0000   0.0000          ?        ?   552.9597  12.7704          ?        ?      235.1        2.7       ?       ? 
1 1 1   48   11    5 o    282.3    2.7    0.0000   0.0000          ?        ?   797.5135  15.3245          ?        ?      282.3        2.7       ?       ? 
1 1 1   48   11    6 o     77.8    7.0    0.0000   0.0000          ?        ?    60.6596  10.8549          ?        ?       77.8        7.0       ?       ? 
1 1 1   48   11    7 o     72.7    7.5    0.0000   0.0000          ?        ?    52.9973  10.8549          ?        ?       72.7        7.5       ?       ? 
1 1 1   48   11    8 o    151.8    3.8    0.0000   0.0000          ?        ?   230.5063  11.4934          ?        ?      151.8        3.8       ?       ? 
1 1 1   48   11    9 o    442.5    3.2    0.0000   0.0000          ?        ?  1958.9843  28.0950          ?        ?      442.5        3.2       ?       ? 
1 1 1   48   11   10 o    350.4    2.8    0.0000   0.0000          ?        ?  1228.5156  19.7942          ?        ?      350.4        2.8       ?       ? 
1 1 1   48   11   11 o    436.1    2.6    0.0000   0.0000          ?        ?  1902.7944  22.3483          ?        ?      436.1        2.6       ?       ? 
1 1 1   48   11   12 o    148.6    4.3    0.0000   0.0000          ?        ?   220.9285  12.7704          ?        ?      148.6        4.3       ?       ? 
1 1 1   48   11   13 o     80.5    8.3    0.0000   0.0000          ?        ?    65.1292  13.4090          ?        ?       80.5        8.3       ?       ? 
1 1 1   48   11   14 o     17.9    8.9    0.0000   0.0000          ?        ?   -33.2031  12.7704          ?        ?       17.9        8.9       ?       ? 
1 1 1   48   11   15 o    261.7    2.8    0.0000   0.0000          ?        ?   685.1337  14.6860          ?        ?      261.7        2.8       ?       ? 
1 1 1   48   11   16 o     32.0   12.9    0.0000   0.0000          ?        ?     4.4697  12.7704          ?        ?       32.0       12.9       ?       ? 
1 1 1   48   11   17 o    199.8    3.8    0.0000   0.0000          ?        ?   399.7145  15.3245          ?        ?      199.8        3.8       ?       ? 
1 1 1   48   11   18 o    251.6    3.0    0.0000   0.0000          ?        ?   633.4135  15.3245          ?        ?      251.6        3.0       ?       ? 
1 1 1   48   11   19 o    441.1    2.8    0.0000   0.0000          ?        ?  1946.8524  24.2638          ?        ?      441.1        2.8       ?       ? 
1 1 1   48   11   20 o    197.6    3.9    0.0000   0.0000          ?        ?   390.7752  15.3245          ?        ?      197.6        3.9       ?       ? 
1 1 1   48   11   21 f     38.9   14.1    0.0000   0.0000          ?        ?    12.7704  14.0475          ?        ?       38.9       14.1       ?       ? 
1 1 1   48   11   22 o    371.4    2.7    0.0000   0.0000          ?        ?  1379.8452  19.7942          ?        ?      371.4        2.7       ?       ? 
1 1 1   48   11   23 o    304.5    2.8    0.0000   0.0000          ?        ?   927.7720  17.2401          ?        ?      304.5        2.8       ?       ? 
1 1 1   48   11   24 o    172.9    4.2    0.0000   0.0000          ?        ?   299.4666  14.6860          ?        ?      172.9        4.2       ?       ? 
1 1 1   48   11   25 o    168.5    4.2    0.0000   0.0000          ?        ?   284.1421  14.0475          ?        ?      168.5        4.2       ?       ? 
1 1 1   48   11   26 o    213.7    3.7    0.0000   0.0000          ?        ?   457.1815  15.9630          ?        ?      213.7        3.7       ?       ? 
1 1 1   48   11   27 o     31.0   13.3    0.0000   0.0000          ?        ?    -0.6385  14.6860          ?        ?       31.0       13.3       ?       ? 
1 1 1   48   11   28 o     17.1    8.7    0.0000   0.0000          ?        ?   -51.0817  14.6860          ?        ?       17.1        8.7       ?       ? 
1 1 1   48   11   29 o    165.4    4.4    0.0000   0.0000          ?        ?   273.9258  14.6860          ?        ?      165.4        4.4       ?       ? 
1 1 1   48   11   30 o    196.3    3.9    0.0000   0.0000          ?        ?   385.6671  15.3245          ?        ?      196.3        3.9       ?       ? 
1 1 1   48   11   31 o    386.8    2.6    0.0000   0.0000          ?        ?  1496.6947  20.4327          ?        ?      386.8        2.6       ?       ? 
1 1 1   48   11   32 o    127.4    6.0    0.0000   0.0000          ?        ?   162.8230  15.3245          ?        ?      127.4        6.0       ?       ? 
1 1 1   48   11   33 o    374.9    2.8    0.0000   0.0000          ?        ?  1406.6632  21.0712          ?        ?      374.9        2.8       ?       ? 
1 1 1   48   11   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48   11   35 o     29.0   13.2    0.0000   0.0000          ?        ?    -9.5778  16.6016          ?        ?       29.0       13.2       ?       ? 
1 1 1   48   11   36 o    175.4    4.7    0.0000   0.0000          ?        ?   308.4059  16.6016          ?        ?      175.4        4.7       ?       ? 
1 1 1   48   11   37 f     50.7   14.8    0.0000   0.0000          ?        ?    26.8179  15.9630          ?        ?       50.7       14.8       ?       ? 
1 1 1   48   11   38 o     23.7   11.4    0.0000   0.0000          ?        ?   -23.6253  15.9630          ?        ?       23.7       11.4       ?       ? 
1 1 1   48   11   39 o    100.0    8.3    0.0000   0.0000          ?        ?   100.8864  16.6016          ?        ?      100.0        8.3       ?       ? 
1 1 1   48   11   40 o    207.2    4.2    0.0000   0.0000          ?        ?   430.3636  17.2401          ?        ?      207.2        4.2       ?       ? 
1 1 1   48   11   41 o    275.0    3.3    0.0000   0.0000          ?        ?   757.2866  17.8786          ?        ?      275.0        3.3       ?       ? 
1 1 1   48   11   42 o    101.5    8.2    0.0000   0.0000          ?        ?   104.0790  16.6016          ?        ?      101.5        8.2       ?       ? 
1 1 1   48   11   43 o    102.8    8.1    0.0000   0.0000          ?        ?   106.6331  16.6016          ?        ?      102.8        8.1       ?       ? 
1 1 1   48   11   44 o    111.1    7.2    0.0000   0.0000          ?        ?   124.5117  15.9630          ?        ?      111.1        7.2       ?       ? 
1 1 1   48   11   45 o    256.7    3.6    0.0000   0.0000          ?        ?   660.2314  18.5171          ?        ?      256.7        3.6       ?       ? 
1 1 1   48   11   46 o     66.5   13.4    0.0000   0.0000          ?        ?    47.2506  17.2401          ?        ?       66.5       13.4       ?       ? 
1 1 1   48   11   47 o    111.8    7.4    0.0000   0.0000          ?        ?   126.4273  16.6016          ?        ?      111.8        7.4       ?       ? 
1 1 1   48   12    0 o    217.6    4.3  474.4216  18.5171   474.4216  18.5171   474.4216  18.5171      217.6      4.3      217.6        4.3     0.0     0.0 
1 1 1   48   12    1 o    137.7    3.7    0.0000   0.0000          ?        ?   189.6409  10.2163          ?        ?      137.7        3.7       ?       ? 
1 1 1   48   12    2 o    180.1    3.0    0.0000   0.0000          ?        ?   324.3690  10.8549          ?        ?      180.1        3.0       ?       ? 
1 1 1   48   12    3 o    156.5    3.5    0.0000   0.0000          ?        ?   245.1923  10.8549          ?        ?      156.5        3.5       ?       ? 
1 1 1   48   12    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48   12    5 o    209.5    3.0    0.0000   0.0000          ?        ?   439.3029  12.7704          ?        ?      209.5        3.0       ?       ? 
1 1 1   48   12    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48   12    7 o    296.1    3.1    0.0000   0.0000          ?        ?   877.3287  18.5171          ?        ?      296.1        3.1       ?       ? 
1 1 1   48   12    8 o    584.6    3.1    0.0000   0.0000          ?        ?  3419.2832  35.7572          ?        ?      584.6        3.1       ?       ? 
1 1 1   48   12    9 f    153.6    3.9    0.0000   0.0000          ?        ?   236.2530  12.1319          ?        ?      153.6        3.9       ?       ? 
1 1 1   48   12   10 o    459.8    2.9    0.0000   0.0000          ?        ?  2115.4221  26.8179          ?        ?      459.8        2.9       ?       ? 
1 1 1   48   12   11 o     24.1   11.0    0.0000   0.0000          ?        ?    -8.9393  12.1319          ?        ?       24.1       11.0       ?       ? 
1 1 1   48   12   12 o     61.7   11.3    0.0000   0.0000          ?        ?    39.5883  13.4090          ?        ?       61.7       11.3       ?       ? 
1 1 1   48   12   13 o     16.2    8.2    0.0000   0.0000          ?        ?   -38.3113  12.1319          ?        ?       16.2        8.2       ?       ? 
1 1 1   48   12   14 o    416.8    3.1    0.0000   0.0000          ?        ?  1738.0559  26.1794          ?        ?      416.8        3.1       ?       ? 
1 1 1   48   12   15 o    259.2    2.8    0.0000   0.0000          ?        ?   672.3633  14.6860          ?        ?      259.2        2.8       ?       ? 
1 1 1   48   12   16 o    360.6    2.7    0.0000   0.0000          ?        ?  1300.6686  19.7942          ?        ?      360.6        2.7       ?       ? 
1 1 1   48   12   17 o    175.7    3.8    0.0000   0.0000          ?        ?   309.0445  13.4090          ?        ?      175.7        3.8       ?       ? 
1 1 1   48   12   18 o     26.0   11.7    0.0000   0.0000          ?        ?    -6.3852  12.7704          ?        ?       26.0       11.7       ?       ? 
1 1 1   48   12   19 o    257.1    3.4    0.0000   0.0000          ?        ?   661.5084  17.2401          ?        ?      257.1        3.4       ?       ? 
1 1 1   48   12   20 o    246.5    3.2    0.0000   0.0000          ?        ?   607.8726  15.9630          ?        ?      246.5        3.2       ?       ? 
1 1 1   48   12   21 o    345.5    2.8    0.0000   0.0000          ?        ?  1194.0354  19.1556          ?        ?      345.5        2.8       ?       ? 
1 1 1   48   12   22 o    260.6    3.2    0.0000   0.0000          ?        ?   679.3870  16.6016          ?        ?      260.6        3.2       ?       ? 
1 1 1   48   12   23 o    243.3    3.1    0.0000   0.0000          ?        ?   592.5481  15.3245          ?        ?      243.3        3.1       ?       ? 
1 1 1   48   12   24 o    271.4    2.9    0.0000   0.0000          ?        ?   736.8539  15.9630          ?        ?      271.4        2.9       ?       ? 
1 1 1   48   12   25 o    144.4    4.9    0.0000   0.0000          ?        ?   208.7966  14.0475          ?        ?      144.4        4.9       ?       ? 
1 1 1   48   12   26 o    236.5    3.4    0.0000   0.0000          ?        ?   559.9835  15.9630          ?        ?      236.5        3.4       ?       ? 
1 1 1   48   12   27 o    346.5    2.9    0.0000   0.0000          ?        ?  1201.6976  19.7942          ?        ?      346.5        2.9       ?       ? 
1 1 1   48   12   28 o    325.8    2.7    0.0000   0.0000          ?        ?  1061.8615  17.8786          ?        ?      325.8        2.7       ?       ? 
1 1 1   48   12   29 o    224.6    3.6    0.0000   0.0000          ?        ?   505.0706  15.9630          ?        ?      224.6        3.6       ?       ? 
1 1 1   48   12   30 o    319.9    2.8    0.0000   0.0000          ?        ?  1024.1886  17.8786          ?        ?      319.9        2.8       ?       ? 
1 1 1   48   12   31 f    312.5    2.9    0.0000   0.0000          ?        ?   977.5767  17.8786          ?        ?      312.5        2.9       ?       ? 
1 1 1   48   12   32 o    229.2    3.6    0.0000   0.0000          ?        ?   526.1418  16.6016          ?        ?      229.2        3.6       ?       ? 
1 1 1   48   12   33 o    359.1    2.8    0.0000   0.0000          ?        ?  1290.4523  19.7942          ?        ?      359.1        2.8       ?       ? 
1 1 1   48   12   34 o    275.8    3.5    0.0000   0.0000          ?        ?   761.7563  19.1556          ?        ?      275.8        3.5       ?       ? 
1 1 1   48   12   35 o    329.5    2.9    0.0000   0.0000          ?        ?  1086.7638  19.1556          ?        ?      329.5        2.9       ?       ? 
1 1 1   48   12   36 o    269.3    3.3    0.0000   0.0000          ?        ?   725.9991  17.8786          ?        ?      269.3        3.3       ?       ? 
1 1 1   48   12   37 o     25.3   12.0    0.0000   0.0000          ?        ?   -20.4327  16.6016          ?        ?       25.3       12.0       ?       ? 
1 1 1   48   12   38 o     79.0   10.1    0.0000   0.0000          ?        ?    63.2136  15.9630          ?        ?       79.0       10.1       ?       ? 
1 1 1   48   12   39 o    174.6    4.8    0.0000   0.0000          ?        ?   305.8519  16.6016          ?        ?      174.6        4.8       ?       ? 
1 1 1   48   12   40 o    259.7    3.4    0.0000   0.0000          ?        ?   675.5559  17.8786          ?        ?      259.7        3.4       ?       ? 
1 1 1   48   12   41 o     23.2   11.2    0.0000   0.0000          ?        ?   -25.5409  15.9630          ?        ?       23.2       11.2       ?       ? 
1 1 1   48   12   42 o     39.0   15.0    0.0000   0.0000          ?        ?    10.8549  16.6016          ?        ?       39.0       15.0       ?       ? 
1 1 1   48   12   43 o     56.1   14.6    0.0000   0.0000          ?        ?    33.8416  16.6016          ?        ?       56.1       14.6       ?       ? 
1 1 1   48   12   44 o     86.5    9.6    0.0000   0.0000          ?        ?    75.9841  16.6016          ?        ?       86.5        9.6       ?       ? 
1 1 1   48   12   45 o    267.1    3.3    0.0000   0.0000          ?        ?   715.1442  17.8786          ?        ?      267.1        3.3       ?       ? 
1 1 1   48   12   46 o     94.5    8.8    0.0000   0.0000          ?        ?    90.6701  16.6016          ?        ?       94.5        8.8       ?       ? 
1 1 1   48   13    0 f    225.9    3.5  510.8173  15.9630   510.8173  15.9630   510.8173  15.9630      225.9      3.5      225.9        3.5     0.0     0.0 
1 1 1   48   13    1 f    308.5    2.7    0.0000   0.0000          ?        ?   952.0358  16.6016          ?        ?      308.5        2.7       ?       ? 
1 1 1   48   13    2 o    346.1    2.8    0.0000   0.0000          ?        ?  1198.5051  19.1556          ?        ?      346.1        2.8       ?       ? 
1 1 1   48   13    3 o    131.2    3.9    0.0000   0.0000          ?        ?   172.4008  10.2163          ?        ?      131.2        3.9       ?       ? 
1 1 1   48   13    4 o    316.4    2.6    0.0000   0.0000          ?        ?  1001.2019  16.6016          ?        ?      316.4        2.6       ?       ? 
1 1 1   48   13    5 o    336.7    2.7    0.0000   0.0000          ?        ?  1134.0144  17.8786          ?        ?      336.7        2.7       ?       ? 
1 1 1   48   13    6 o    114.3    4.5    0.0000   0.0000          ?        ?   130.8969  10.2163          ?        ?      114.3        4.5       ?       ? 
1 1 1   48   13    7 o    133.6    4.1    0.0000   0.0000          ?        ?   178.7861  10.8549          ?        ?      133.6        4.1       ?       ? 
1 1 1   48   13    8 o    348.5    2.7    0.0000   0.0000          ?        ?  1215.1067  19.1556          ?        ?      348.5        2.7       ?       ? 
1 1 1   48   13    9 o    266.8    2.8    0.0000   0.0000          ?        ?   711.9516  14.6860          ?        ?      266.8        2.8       ?       ? 
1 1 1   48   13   10 o    292.7    2.7    0.0000   0.0000          ?        ?   856.8960  15.9630          ?        ?      292.7        2.7       ?       ? 
1 1 1   48   13   11 o    530.1    3.1    0.0000   0.0000          ?        ?  2811.4106  33.2031          ?        ?      530.1        3.1       ?       ? 
1 1 1   48   13   12 o    279.8    3.1    0.0000   0.0000          ?        ?   783.4660  17.2401          ?        ?      279.8        3.1       ?       ? 
1 1 1   48   13   13 f    196.8    3.4    0.0000   0.0000          ?        ?   387.5826  13.4090          ?        ?      196.8        3.4       ?       ? 
1 1 1   48   13   14 o    142.9    4.5    0.0000   0.0000          ?        ?   204.3269  12.7704          ?        ?      142.9        4.5       ?       ? 
1 1 1   48   13   15 o    376.0    2.9    0.0000   0.0000          ?        ?  1414.3254  21.7097          ?        ?      376.0        2.9       ?       ? 
1 1 1   48   13   16 o    158.1    4.0    0.0000   0.0000          ?        ?   250.3005  12.7704          ?        ?      158.1        4.0       ?       ? 
1 1 1   48   13   17 o    365.3    3.1    0.0000   0.0000          ?        ?  1335.1488  22.3483          ?        ?      365.3        3.1       ?       ? 
1 1 1   48   13   18 o    117.9    5.7    0.0000   0.0000          ?        ?   139.1977  13.4090          ?        ?      117.9        5.7       ?       ? 
1 1 1   48   13   19 o    188.3    3.9    0.0000   0.0000          ?        ?   355.0180  14.6860          ?        ?      188.3        3.9       ?       ? 
1 1 1   48   13   20 o    409.6    3.0    0.0000   0.0000          ?        ?  1678.6733  24.2638          ?        ?      409.6        3.0       ?       ? 
1 1 1   48   13   21 o     95.1    6.7    0.0000   0.0000          ?        ?    90.6701  12.7704          ?        ?       95.1        6.7       ?       ? 
1 1 1   48   13   22 o    198.0    4.0    0.0000   0.0000          ?        ?   392.6908  15.9630          ?        ?      198.0        4.0       ?       ? 
1 1 1   48   13   23 o    176.6    4.5    0.0000   0.0000          ?        ?   312.2371  15.9630          ?        ?      176.6        4.5       ?       ? 
1 1 1   48   13   24 f     58.9   12.3    0.0000   0.0000          ?        ?    36.3957  14.0475          ?        ?       58.9       12.3       ?       ? 
1 1 1   48   13   25 o    179.3    4.3    0.0000   0.0000          ?        ?   321.8149  15.3245          ?        ?      179.3        4.3       ?       ? 
1 1 1   48   13   26 o    365.3    2.7    0.0000   0.0000          ?        ?  1335.1488  19.7942          ?        ?      365.3        2.7       ?       ? 
1 1 1   48   13   27 o    208.2    3.8    0.0000   0.0000          ?        ?   434.1947  15.9630          ?        ?      208.2        3.8       ?       ? 
1 1 1   48   13   28 o     98.3    7.5    0.0000   0.0000          ?        ?    97.0553  14.6860          ?        ?       98.3        7.5       ?       ? 
1 1 1   48   13   29 o     26.4   12.2    0.0000   0.0000          ?        ?   -12.7704  15.3245          ?        ?       26.4       12.2       ?       ? 
1 1 1   48   13   30 o     28.9   12.9    0.0000   0.0000          ?        ?    -6.3852  15.3245          ?        ?       28.9       12.9       ?       ? 
1 1 1   48   13   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48   13   32 o     71.1   10.3    0.0000   0.0000          ?        ?    51.0817  14.6860          ?        ?       71.1       10.3       ?       ? 
1 1 1   48   13   33 o     18.0    9.1    0.0000   0.0000          ?        ?   -49.8047  15.3245          ?        ?       18.0        9.1       ?       ? 
1 1 1   48   13   34 o     24.3   11.6    0.0000   0.0000          ?        ?   -21.7097  15.9630          ?        ?       24.3       11.6       ?       ? 
1 1 1   48   13   35 o    283.6    3.2    0.0000   0.0000          ?        ?   805.1758  17.8786          ?        ?      283.6        3.2       ?       ? 
1 1 1   48   13   36 o     22.0   10.8    0.0000   0.0000          ?        ?   -30.6490  15.9630          ?        ?       22.0       10.8       ?       ? 
1 1 1   48   13   37 o     18.6    9.4    0.0000   0.0000          ?        ?   -49.8047  15.9630          ?        ?       18.6        9.4       ?       ? 
1 1 1   48   13   38 o    204.1    4.2    0.0000   0.0000          ?        ?   417.5931  17.2401          ?        ?      204.1        4.2       ?       ? 
1 1 1   48   13   39 o     34.3   14.4    0.0000   0.0000          ?        ?     2.5541  16.6016          ?        ?       34.3       14.4       ?       ? 
1 1 1   48   13   40 o    121.0    6.9    0.0000   0.0000          ?        ?   147.4985  16.6016          ?        ?      121.0        6.9       ?       ? 
1 1 1   48   13   41 o    228.6    3.8    0.0000   0.0000          ?        ?   523.5877  17.2401          ?        ?      228.6        3.8       ?       ? 
1 1 1   48   13   42 o     57.6   14.9    0.0000   0.0000          ?        ?    35.7572  17.2401          ?        ?       57.6       14.9       ?       ? 
1 1 1   48   13   43 o     74.5   11.1    0.0000   0.0000          ?        ?    56.8284  16.6016          ?        ?       74.5       11.1       ?       ? 
1 1 1   48   13   44 o    221.4    3.9    0.0000   0.0000          ?        ?   491.6617  17.2401          ?        ?      221.4        3.9       ?       ? 
1 1 1   48   13   45 o     29.4   13.3    0.0000   0.0000          ?        ?    -7.6623  16.6016          ?        ?       29.4       13.3       ?       ? 
1 1 1   48   14    0 o    305.2    5.0  932.8801  30.6490   932.8801  30.6490   932.8801  30.6490      305.2      5.0      305.2        5.0     0.0     0.0 
1 1 1   48   14    1 o    426.2    3.4    0.0000   0.0000          ?        ?  1817.8711  28.7335          ?        ?      426.2        3.4       ?       ? 
1 1 1   48   14    2 o    205.4    3.4    0.0000   0.0000          ?        ?   422.0628  14.0475          ?        ?      205.4        3.4       ?       ? 
1 1 1   48   14    3 o    113.2    5.6    0.0000   0.0000          ?        ?   128.3428  12.7704          ?        ?      113.2        5.6       ?       ? 
1 1 1   48   14    4 f    129.8    4.4    0.0000   0.0000          ?        ?   168.5697  11.4934          ?        ?      129.8        4.4       ?       ? 
1 1 1   48   14    5 o    170.4    3.7    0.0000   0.0000          ?        ?   290.5273  12.7704          ?        ?      170.4        3.7       ?       ? 
1 1 1   48   14    6 o    280.3    3.4    0.0000   0.0000          ?        ?   786.0201  19.1556          ?        ?      280.3        3.4       ?       ? 
1 1 1   48   14    7 o    157.9    4.0    0.0000   0.0000          ?        ?   249.6619  12.7704          ?        ?      157.9        4.0       ?       ? 
1 1 1   48   14    8 o    517.9    3.1    0.0000   0.0000          ?        ?  2684.3450  32.5646          ?        ?      517.9        3.1       ?       ? 
1 1 1   48   14    9 o     80.2    7.6    0.0000   0.0000          ?        ?    64.4907  12.1319          ?        ?       80.2        7.6       ?       ? 
1 1 1   48   14   10 o    262.2    2.9    0.0000   0.0000          ?        ?   687.6877  15.3245          ?        ?      262.2        2.9       ?       ? 
1 1 1   48   14   11 o    425.7    2.8    0.0000   0.0000          ?        ?  1812.7628  23.6253          ?        ?      425.7        2.8       ?       ? 
1 1 1   48   14   12 o    139.7    3.9    0.0000   0.0000          ?        ?   195.3876  10.8549          ?        ?      139.7        3.9       ?       ? 
1 1 1   48   14   13 o    276.0    2.8    0.0000   0.0000          ?        ?   762.3948  15.3245          ?        ?      276.0        2.8       ?       ? 
1 1 1   48   14   14 f    108.3    5.3    0.0000   0.0000          ?        ?   117.4880  11.4934          ?        ?      108.3        5.3       ?       ? 
1 1 1   48   14   15 o     19.7    9.6    0.0000   0.0000          ?        ?   -21.7097  12.1319          ?        ?       19.7        9.6       ?       ? 
1 1 1   48   14   16 o    108.9    5.9    0.0000   0.0000          ?        ?   118.7650  12.7704          ?        ?      108.9        5.9       ?       ? 
1 1 1   48   14   17 o     24.6   11.3    0.0000   0.0000          ?        ?    -9.5778  12.7704          ?        ?       24.6       11.3       ?       ? 
1 1 1   48   14   18 o    220.8    3.3    0.0000   0.0000          ?        ?   487.8305  14.6860          ?        ?      220.8        3.3       ?       ? 
1 1 1   48   14   19 o    204.6    3.6    0.0000   0.0000          ?        ?   418.8702  14.6860          ?        ?      204.6        3.6       ?       ? 
1 1 1   48   14   20 o    101.8    7.2    0.0000   0.0000          ?        ?   104.0790  14.6860          ?        ?      101.8        7.2       ?       ? 
1 1 1   48   14   21 f    137.6    4.9    0.0000   0.0000          ?        ?   189.6409  13.4090          ?        ?      137.6        4.9       ?       ? 
1 1 1   48   14   22 o    334.0    3.1    0.0000   0.0000          ?        ?  1116.1359  20.4327          ?        ?      334.0        3.1       ?       ? 
1 1 1   48   14   23 o    336.5    2.9    0.0000   0.0000          ?        ?  1133.3759  19.7942          ?        ?      336.5        2.9       ?       ? 
1 1 1   48   14   24 o    204.1    3.8    0.0000   0.0000          ?        ?   416.9547  15.3245          ?        ?      204.1        3.8       ?       ? 
1 1 1   48   14   25 o    210.4    3.6    0.0000   0.0000          ?        ?   443.1340  15.3245          ?        ?      210.4        3.6       ?       ? 
1 1 1   48   14   26 o     38.3   14.3    0.0000   0.0000          ?        ?    11.4934  14.6860          ?        ?       38.3       14.3       ?       ? 
1 1 1   48   14   27 o    282.9    2.9    0.0000   0.0000          ?        ?   800.7061  16.6016          ?        ?      282.9        2.9       ?       ? 
1 1 1   48   14   28 o    137.7    5.6    0.0000   0.0000          ?        ?   190.2794  15.3245          ?        ?      137.7        5.6       ?       ? 
1 1 1   48   14   29 o    111.1    6.6    0.0000   0.0000          ?        ?   123.8732  14.6860          ?        ?      111.1        6.6       ?       ? 
1 1 1   48   14   30 o     27.1   12.3    0.0000   0.0000          ?        ?    -8.9393  14.6860          ?        ?       27.1       12.3       ?       ? 
1 1 1   48   14   31 o    157.0    4.9    0.0000   0.0000          ?        ?   247.1079  15.3245          ?        ?      157.0        4.9       ?       ? 
1 1 1   48   14   32 o    207.1    3.9    0.0000   0.0000          ?        ?   429.7251  15.9630          ?        ?      207.1        3.9       ?       ? 
1 1 1   48   14   33 o     81.5    9.4    0.0000   0.0000          ?        ?    67.0448  15.3245          ?        ?       81.5        9.4       ?       ? 
1 1 1   48   14   34 o    175.2    4.6    0.0000   0.0000          ?        ?   307.7674  15.9630          ?        ?      175.2        4.6       ?       ? 
1 1 1   48   14   35 o    209.2    4.0    0.0000   0.0000          ?        ?   438.6643  16.6016          ?        ?      209.2        4.0       ?       ? 
1 1 1   48   14   36 o    128.0    6.2    0.0000   0.0000          ?        ?   164.7386  15.9630          ?        ?      128.0        6.2       ?       ? 
1 1 1   48   14   37 o     34.8   14.3    0.0000   0.0000          ?        ?     4.4697  15.9630          ?        ?       34.8       14.3       ?       ? 
1 1 1   48   14   38 f     84.4    9.8    0.0000   0.0000          ?        ?    72.1529  16.6016          ?        ?       84.4        9.8       ?       ? 
1 1 1   48   14   39 o     95.4    8.4    0.0000   0.0000          ?        ?    91.9471  15.9630          ?        ?       95.4        8.4       ?       ? 
1 1 1   48   14   40 o    139.1    6.0    0.0000   0.0000          ?        ?   194.7491  16.6016          ?        ?      139.1        6.0       ?       ? 
1 1 1   48   14   41 o    155.8    5.3    0.0000   0.0000          ?        ?   243.9153  16.6016          ?        ?      155.8        5.3       ?       ? 
1 1 1   48   14   42 o    157.4    5.1    0.0000   0.0000          ?        ?   249.0234  15.9630          ?        ?      157.4        5.1       ?       ? 
1 1 1   48   14   43 o    144.4    6.0    0.0000   0.0000          ?        ?   210.0736  17.2401          ?        ?      144.4        6.0       ?       ? 
1 1 1   48   14   44 o    141.5    5.9    0.0000   0.0000          ?        ?   201.7728  16.6016          ?        ?      141.5        5.9       ?       ? 
1 1 1   48   15    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48   15    1 o     48.7   14.6    0.0000   0.0000          ?        ?    24.2638  15.3245          ?        ?       48.7       14.6       ?       ? 
1 1 1   48   15    2 o    116.2    6.9    0.0000   0.0000          ?        ?   135.3666  15.9630          ?        ?      116.2        6.9       ?       ? 
1 1 1   48   15    3 o     93.7    7.8    0.0000   0.0000          ?        ?    88.1160  14.6860          ?        ?       93.7        7.8       ?       ? 
1 1 1   48   15    4 o     97.0    8.6    0.0000   0.0000          ?        ?    94.5012  16.6016          ?        ?       97.0        8.6       ?       ? 
1 1 1   48   15    5 o    330.8    3.4    0.0000   0.0000          ?        ?  1095.0646  22.3483          ?        ?      330.8        3.4       ?       ? 
1 1 1   48   15    6 f    146.6    3.9    0.0000   0.0000          ?        ?   215.1818  11.4934          ?        ?      146.6        3.9       ?       ? 
1 1 1   48   15    7 o    154.4    4.5    0.0000   0.0000          ?        ?   238.8071  14.0475          ?        ?      154.4        4.5       ?       ? 
1 1 1   48   15    8 o    562.9    3.5    0.0000   0.0000          ?        ?  3171.5371  38.9498          ?        ?      562.9        3.5       ?       ? 
1 1 1   48   15    9 o    215.6    4.1    0.0000   0.0000          ?        ?   465.4823  17.8786          ?        ?      215.6        4.1       ?       ? 
1 1 1   48   15   10 o    638.9    3.5    0.0000   0.0000          ?        ?  4085.9001  44.6965          ?        ?      638.9        3.5       ?       ? 
1 1 1   48   15   11 o    205.7    3.3    0.0000   0.0000          ?        ?   423.3398  13.4090          ?        ?      205.7        3.3       ?       ? 
1 1 1   48   15   12 o    161.5    4.0    0.0000   0.0000          ?        ?   261.1554  12.7704          ?        ?      161.5        4.0       ?       ? 
1 1 1   48   15   13 o    237.4    2.8    0.0000   0.0000          ?        ?   563.8146  13.4090          ?        ?      237.4        2.8       ?       ? 
1 1 1   48   15   14 o    324.6    2.8    0.0000   0.0000          ?        ?  1054.1992  17.8786          ?        ?      324.6        2.8       ?       ? 
1 1 1   48   15   15 o    249.4    2.8    0.0000   0.0000          ?        ?   622.5586  14.0475          ?        ?      249.4        2.8       ?       ? 
1 1 1   48   15   16 o    264.1    2.9    0.0000   0.0000          ?        ?   697.9042  15.3245          ?        ?      264.1        2.9       ?       ? 
1 1 1   48   15   17 o    267.1    3.0    0.0000   0.0000          ?        ?   713.8672  15.9630          ?        ?      267.1        3.0       ?       ? 
1 1 1   48   15   18 f    300.9    2.7    0.0000   0.0000          ?        ?   906.0621  15.9630          ?        ?      300.9        2.7       ?       ? 
1 1 1   48   15   19 o    160.1    4.2    0.0000   0.0000          ?        ?   256.6857  13.4090          ?        ?      160.1        4.2       ?       ? 
1 1 1   48   15   20 o     90.9    7.4    0.0000   0.0000          ?        ?    83.0078  13.4090          ?        ?       90.9        7.4       ?       ? 
1 1 1   48   15   21 o     36.5   13.9    0.0000   0.0000          ?        ?     9.5778  14.0475          ?        ?       36.5       13.9       ?       ? 
1 1 1   48   15   22 o    267.1    3.1    0.0000   0.0000          ?        ?   713.8672  16.6016          ?        ?      267.1        3.1       ?       ? 
1 1 1   48   15   23 o    156.5    4.3    0.0000   0.0000          ?        ?   245.1923  13.4090          ?        ?      156.5        4.3       ?       ? 
1 1 1   48   15   24 o    357.5    2.8    0.0000   0.0000          ?        ?  1278.9589  19.7942          ?        ?      357.5        2.8       ?       ? 
1 1 1   48   15   25 o    191.8    4.0    0.0000   0.0000          ?        ?   368.4270  15.3245          ?        ?      191.8        4.0       ?       ? 
1 1 1   48   15   26 o    367.3    2.7    0.0000   0.0000          ?        ?  1349.8347  19.7942          ?        ?      367.3        2.7       ?       ? 
1 1 1   48   15   27 o    159.5    4.6    0.0000   0.0000          ?        ?   254.7701  14.6860          ?        ?      159.5        4.6       ?       ? 
1 1 1   48   15   28 o    253.7    3.3    0.0000   0.0000          ?        ?   644.2683  16.6016          ?        ?      253.7        3.3       ?       ? 
1 1 1   48   15   29 o    308.3    2.9    0.0000   0.0000          ?        ?   951.3972  17.8786          ?        ?      308.3        2.9       ?       ? 
1 1 1   48   15   30 o    228.5    3.6    0.0000   0.0000          ?        ?   522.9492  16.6016          ?        ?      228.5        3.6       ?       ? 
1 1 1   48   15   31 o    173.0    4.4    0.0000   0.0000          ?        ?   300.1052  15.3245          ?        ?      173.0        4.4       ?       ? 
1 1 1   48   15   32 o     19.9    9.9    0.0000   0.0000          ?        ?   -41.5039  15.9630          ?        ?       19.9        9.9       ?       ? 
1 1 1   48   15   33 o    244.8    3.4    0.0000   0.0000          ?        ?   600.2103  16.6016          ?        ?      244.8        3.4       ?       ? 
1 1 1   48   15   34 o     47.3   14.7    0.0000   0.0000          ?        ?    22.9868  15.3245          ?        ?       47.3       14.7       ?       ? 
1 1 1   48   15   35 o    164.3    4.9    0.0000   0.0000          ?        ?   270.7332  15.9630          ?        ?      164.3        4.9       ?       ? 
1 1 1   48   15   36 o    124.5    6.4    0.0000   0.0000          ?        ?   155.7993  15.9630          ?        ?      124.5        6.4       ?       ? 
1 1 1   48   15   37 o     20.9   10.4    0.0000   0.0000          ?        ?   -39.5883  16.6016          ?        ?       20.9       10.4       ?       ? 
1 1 1   48   15   38 o    110.8    7.5    0.0000   0.0000          ?        ?   123.8732  16.6016          ?        ?      110.8        7.5       ?       ? 
1 1 1   48   15   39 o    216.5    3.8    0.0000   0.0000          ?        ?   469.9519  16.6016          ?        ?      216.5        3.8       ?       ? 
1 1 1   48   15   40 f    226.2    3.7    0.0000   0.0000          ?        ?   512.7329  16.6016          ?        ?      226.2        3.7       ?       ? 
1 1 1   48   15   41 o     37.6   14.7    0.0000   0.0000          ?        ?     9.5778  15.9630          ?        ?       37.6       14.7       ?       ? 
1 1 1   48   15   42 o     30.1   13.3    0.0000   0.0000          ?        ?    -4.4697  15.9630          ?        ?       30.1       13.3       ?       ? 
1 1 1   48   16    0 o    179.7    6.2  324.3690  22.3483   324.3690  22.3483   324.3690  22.3483      179.7      6.2      179.7        6.2     0.0     0.0 
1 1 1   48   16    1 o    229.3    3.9    0.0000   0.0000          ?        ?   526.1418  17.8786          ?        ?      229.3        3.9       ?       ? 
1 1 1   48   16    2 f     55.1   13.4    0.0000   0.0000          ?        ?    31.9261  14.6860          ?        ?       55.1       13.4       ?       ? 
1 1 1   48   16    3 o    183.7    4.5    0.0000   0.0000          ?        ?   337.7780  16.6016          ?        ?      183.7        4.5       ?       ? 
1 1 1   48   16    4 f    111.1    7.2    0.0000   0.0000          ?        ?   123.8732  15.9630          ?        ?      111.1        7.2       ?       ? 
1 1 1   48   16    5 o    135.7    5.9    0.0000   0.0000          ?        ?   184.5327  15.9630          ?        ?      135.7        5.9       ?       ? 
1 1 1   48   16    6 o    364.5    3.4    0.0000   0.0000          ?        ?  1329.4020  24.9023          ?        ?      364.5        3.4       ?       ? 
1 1 1   48   16    7 o    320.0    3.2    0.0000   0.0000          ?        ?  1024.8273  20.4327          ?        ?      320.0        3.2       ?       ? 
1 1 1   48   16    8 o    328.5    3.4    0.0000   0.0000          ?        ?  1079.7401  22.3483          ?        ?      328.5        3.4       ?       ? 
1 1 1   48   16    9 o    219.5    3.8    0.0000   0.0000          ?        ?   482.0838  16.6016          ?        ?      219.5        3.8       ?       ? 
1 1 1   48   16   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48   16   11 o    152.9    5.2    0.0000   0.0000          ?        ?   234.3374  15.9630          ?        ?      152.9        5.2       ?       ? 
1 1 1   48   16   12 o    351.1    3.5    0.0000   0.0000          ?        ?  1233.6238  24.9023          ?        ?      351.1        3.5       ?       ? 
1 1 1   48   16   13 o    163.3    3.9    0.0000   0.0000          ?        ?   266.9020  12.7704          ?        ?      163.3        3.9       ?       ? 
1 1 1   48   16   14 o    242.3    3.3    0.0000   0.0000          ?        ?   587.4399  15.9630          ?        ?      242.3        3.3       ?       ? 
1 1 1   48   16   15 o    155.4    4.5    0.0000   0.0000          ?        ?   241.9997  14.0475          ?        ?      155.4        4.5       ?       ? 
1 1 1   48   16   16 o     45.6   12.3    0.0000   0.0000          ?        ?    21.7097  11.4934          ?        ?       45.6       12.3       ?       ? 
1 1 1   48   16   17 o    357.8    2.9    0.0000   0.0000          ?        ?  1280.8744  20.4327          ?        ?      357.8        2.9       ?       ? 
1 1 1   48   16   18 o     69.0    9.3    0.0000   0.0000          ?        ?    47.8891  12.7704          ?        ?       69.0        9.3       ?       ? 
1 1 1   48   16   19 o    109.4    6.1    0.0000   0.0000          ?        ?   120.0421  13.4090          ?        ?      109.4        6.1       ?       ? 
1 1 1   48   16   20 o    183.2    3.8    0.0000   0.0000          ?        ?   335.8624  14.0475          ?        ?      183.2        3.8       ?       ? 
1 1 1   48   16   21 o    319.0    2.9    0.0000   0.0000          ?        ?  1018.4420  18.5171          ?        ?      319.0        2.9       ?       ? 
1 1 1   48   16   22 o    225.6    3.4    0.0000   0.0000          ?        ?   509.5403  15.3245          ?        ?      225.6        3.4       ?       ? 
1 1 1   48   16   23 o    203.8    3.4    0.0000   0.0000          ?        ?   415.6776  14.0475          ?        ?      203.8        3.4       ?       ? 
1 1 1   48   16   24 o    176.9    4.2    0.0000   0.0000          ?        ?   313.5141  14.6860          ?        ?      176.9        4.2       ?       ? 
1 1 1   48   16   25 o     79.2    9.3    0.0000   0.0000          ?        ?    63.2136  14.6860          ?        ?       79.2        9.3       ?       ? 
1 1 1   48   16   26 o    183.1    4.2    0.0000   0.0000          ?        ?   335.8624  15.3245          ?        ?      183.1        4.2       ?       ? 
1 1 1   48   16   27 o    458.2    2.7    0.0000   0.0000          ?        ?  2101.3748  24.9023          ?        ?      458.2        2.7       ?       ? 
1 1 1   48   16   28 o     87.9    8.7    0.0000   0.0000          ?        ?    77.8996  15.3245          ?        ?       87.9        8.7       ?       ? 
1 1 1   48   16   29 o    137.7    5.6    0.0000   0.0000          ?        ?   190.2794  15.3245          ?        ?      137.7        5.6       ?       ? 
1 1 1   48   16   30 o     19.5    9.6    0.0000   0.0000          ?        ?   -32.5646  14.0475          ?        ?       19.5        9.6       ?       ? 
1 1 1   48   16   31 o    142.9    5.4    0.0000   0.0000          ?        ?   204.9654  15.3245          ?        ?      142.9        5.4       ?       ? 
1 1 1   48   16   32 o    119.0    6.7    0.0000   0.0000          ?        ?   142.3903  15.9630          ?        ?      119.0        6.7       ?       ? 
1 1 1   48   16   33 o    147.5    5.2    0.0000   0.0000          ?        ?   218.3744  15.3245          ?        ?      147.5        5.2       ?       ? 
1 1 1   48   16   34 o    200.2    4.1    0.0000   0.0000          ?        ?   401.6301  16.6016          ?        ?      200.2        4.1       ?       ? 
1 1 1   48   16   35 o    281.6    3.2    0.0000   0.0000          ?        ?   794.3209  17.8786          ?        ?      281.6        3.2       ?       ? 
1 1 1   48   16   36 o     88.4    9.4    0.0000   0.0000          ?        ?    79.1767  16.6016          ?        ?       88.4        9.4       ?       ? 
1 1 1   48   16   37 o    210.2    3.9    0.0000   0.0000          ?        ?   443.1340  16.6016          ?        ?      210.2        3.9       ?       ? 
1 1 1   48   16   38 o     25.2   12.1    0.0000   0.0000          ?        ?   -22.9868  17.2401          ?        ?       25.2       12.1       ?       ? 
1 1 1   48   16   39 o    164.6    4.9    0.0000   0.0000          ?        ?   272.0102  15.9630          ?        ?      164.6        4.9       ?       ? 
1 1 1   48   16   40 o     30.1   13.3    0.0000   0.0000          ?        ?    -4.4697  15.9630          ?        ?       30.1       13.3       ?       ? 
1 1 1   48   16   41 o     27.5   12.6    0.0000   0.0000          ?        ?   -10.8549  15.9630          ?        ?       27.5       12.6       ?       ? 
1 1 1   48   17    0 o    112.9   10.0  130.8969  22.3483   130.8969  22.3483   130.8969  22.3483      112.9     10.0      112.9       10.0     0.0     0.0 
1 1 1   48   17    1 o    250.7    4.3    0.0000   0.0000          ?        ?   629.5823  21.7097          ?        ?      250.7        4.3       ?       ? 
1 1 1   48   17    2 o    292.8    3.6    0.0000   0.0000          ?        ?   858.1730  21.0712          ?        ?      292.8        3.6       ?       ? 
1 1 1   48   17    3 o    247.6    3.7    0.0000   0.0000          ?        ?   613.6193  18.5171          ?        ?      247.6        3.7       ?       ? 
1 1 1   48   17    4 o    377.9    3.7    0.0000   0.0000          ?        ?  1429.6499  28.0950          ?        ?      377.9        3.7       ?       ? 
1 1 1   48   17    5 o    287.9    3.7    0.0000   0.0000          ?        ?   829.4396  21.0712          ?        ?      287.9        3.7       ?       ? 
1 1 1   48   17    6 o    388.8    3.5    0.0000   0.0000          ?        ?  1513.2963  27.4564          ?        ?      388.8        3.5       ?       ? 
1 1 1   48   17    7 o    296.8    3.9    0.0000   0.0000          ?        ?   881.7984  22.9868          ?        ?      296.8        3.9       ?       ? 
1 1 1   48   17    8 f    216.0    4.3    0.0000   0.0000          ?        ?   467.3978  18.5171          ?        ?      216.0        4.3       ?       ? 
1 1 1   48   17    9 o    264.2    3.0    0.0000   0.0000          ?        ?   698.5427  15.9630          ?        ?      264.2        3.0       ?       ? 
1 1 1   48   17   10 o    226.2    3.5    0.0000   0.0000          ?        ?   512.0943  15.9630          ?        ?      226.2        3.5       ?       ? 
1 1 1   48   17   11 o    248.8    3.3    0.0000   0.0000          ?        ?   619.3660  16.6016          ?        ?      248.8        3.3       ?       ? 
1 1 1   48   17   12 o    233.0    3.6    0.0000   0.0000          ?        ?   543.3819  16.6016          ?        ?      233.0        3.6       ?       ? 
1 1 1   48   17   13 o    254.2    3.6    0.0000   0.0000          ?        ?   646.8224  18.5171          ?        ?      254.2        3.6       ?       ? 
1 1 1   48   17   14 o     75.1    9.8    0.0000   0.0000          ?        ?    56.8284  14.6860          ?        ?       75.1        9.8       ?       ? 
1 1 1   48   17   15 o    196.3    3.6    0.0000   0.0000          ?        ?   385.6671  14.0475          ?        ?      196.3        3.6       ?       ? 
1 1 1   48   17   16 o    223.9    3.6    0.0000   0.0000          ?        ?   501.8780  15.9630          ?        ?      223.9        3.6       ?       ? 
1 1 1   48   17   17 o    245.8    3.6    0.0000   0.0000          ?        ?   604.6799  17.8786          ?        ?      245.8        3.6       ?       ? 
1 1 1   48   17   18 f    191.8    4.2    0.0000   0.0000          ?        ?   368.4270  15.9630          ?        ?      191.8        4.2       ?       ? 
1 1 1   48   17   19 o    214.7    4.0    0.0000   0.0000          ?        ?   461.6512  17.2401          ?        ?      214.7        4.0       ?       ? 
1 1 1   48   17   20 o    280.4    3.0    0.0000   0.0000          ?        ?   786.6586  16.6016          ?        ?      280.4        3.0       ?       ? 
1 1 1   48   17   21 o     41.2   13.5    0.0000   0.0000          ?        ?    16.6016  12.7704          ?        ?       41.2       13.5       ?       ? 
1 1 1   48   17   22 o    318.1    2.8    0.0000   0.0000          ?        ?  1012.6953  17.8786          ?        ?      318.1        2.8       ?       ? 
1 1 1   48   17   23 o     18.7    9.3    0.0000   0.0000          ?        ?   -36.3957  14.0475          ?        ?       18.7        9.3       ?       ? 
1 1 1   48   17   24 o     19.1    9.4    0.0000   0.0000          ?        ?   -27.4564  12.7704          ?        ?       19.1        9.4       ?       ? 
1 1 1   48   17   25 o    176.4    3.8    0.0000   0.0000          ?        ?   311.5985  13.4090          ?        ?      176.4        3.8       ?       ? 
1 1 1   48   17   26 o    250.9    3.4    0.0000   0.0000          ?        ?   630.2208  17.2401          ?        ?      250.9        3.4       ?       ? 
1 1 1   48   17   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48   17   28 o    211.2    3.9    0.0000   0.0000          ?        ?   446.9651  16.6016          ?        ?      211.2        3.9       ?       ? 
1 1 1   48   17   29 o    126.3    6.3    0.0000   0.0000          ?        ?   160.2689  15.9630          ?        ?      126.3        6.3       ?       ? 
1 1 1   48   17   30 o    201.2    4.0    0.0000   0.0000          ?        ?   405.4612  15.9630          ?        ?      201.2        4.0       ?       ? 
1 1 1   48   17   31 o    121.7    6.3    0.0000   0.0000          ?        ?   148.7755  15.3245          ?        ?      121.7        6.3       ?       ? 
1 1 1   48   17   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48   17   33 o     62.1   12.8    0.0000   0.0000          ?        ?    40.8654  15.3245          ?        ?       62.1       12.8       ?       ? 
1 1 1   48   17   34 o    131.7    5.8    0.0000   0.0000          ?        ?   174.3164  15.3245          ?        ?      131.7        5.8       ?       ? 
1 1 1   48   17   35 o     19.1    9.5    0.0000   0.0000          ?        ?   -42.1424  15.3245          ?        ?       19.1        9.5       ?       ? 
1 1 1   48   17   36 o    163.2    4.9    0.0000   0.0000          ?        ?   267.5406  15.9630          ?        ?      163.2        4.9       ?       ? 
1 1 1   48   17   37 o    209.7    4.1    0.0000   0.0000          ?        ?   441.2184  17.2401          ?        ?      209.7        4.1       ?       ? 
1 1 1   48   17   38 o    155.7    5.3    0.0000   0.0000          ?        ?   243.9153  16.6016          ?        ?      155.7        5.3       ?       ? 
1 1 1   48   17   39 o    203.2    4.1    0.0000   0.0000          ?        ?   414.4005  16.6016          ?        ?      203.2        4.1       ?       ? 
1 1 1   48   18    0 o     27.4   18.0   -1.2770  23.6253    -1.2770  23.6253    -1.2770  23.6253       27.4     18.0       27.4       18.0     0.0     0.0 
1 1 1   48   18    1 o     28.6   13.0    0.0000   0.0000          ?        ?   -10.8549  16.6016          ?        ?       28.6       13.0       ?       ? 
1 1 1   48   18    2 o    207.6    4.5    0.0000   0.0000          ?        ?   431.6406  18.5171          ?        ?      207.6        4.5       ?       ? 
1 1 1   48   18    3 o    239.4    4.4    0.0000   0.0000          ?        ?   574.0309  21.0712          ?        ?      239.4        4.4       ?       ? 
1 1 1   48   18    4 o    203.9    4.5    0.0000   0.0000          ?        ?   416.3161  18.5171          ?        ?      203.9        4.5       ?       ? 
1 1 1   48   18    5 f    284.9    4.0    0.0000   0.0000          ?        ?   812.8381  22.9868          ?        ?      284.9        4.0       ?       ? 
1 1 1   48   18    6 o    238.5    4.1    0.0000   0.0000          ?        ?   569.5613  19.7942          ?        ?      238.5        4.1       ?       ? 
1 1 1   48   18    7 o    307.1    3.8    0.0000   0.0000          ?        ?   944.3735  23.6253          ?        ?      307.1        3.8       ?       ? 
1 1 1   48   18    8 o    258.3    4.7    0.0000   0.0000          ?        ?   668.5321  24.2638          ?        ?      258.3        4.7       ?       ? 
1 1 1   48   18    9 o    306.4    4.0    0.0000   0.0000          ?        ?   939.9038  24.2638          ?        ?      306.4        4.0       ?       ? 
1 1 1   48   18   10 o    108.8    6.2    0.0000   0.0000          ?        ?   118.7650  13.4090          ?        ?      108.8        6.2       ?       ? 
1 1 1   48   18   11 o    329.8    3.3    0.0000   0.0000          ?        ?  1088.6793  21.7097          ?        ?      329.8        3.3       ?       ? 
1 1 1   48   18   12 o    408.8    3.1    0.0000   0.0000          ?        ?  1672.2881  25.5409          ?        ?      408.8        3.1       ?       ? 
1 1 1   48   18   13 o    175.1    4.2    0.0000   0.0000          ?        ?   307.1289  14.6860          ?        ?      175.1        4.2       ?       ? 
1 1 1   48   18   14 o    168.8    4.7    0.0000   0.0000          ?        ?   285.4192  15.9630          ?        ?      168.8        4.7       ?       ? 
1 1 1   48   18   15 o    252.3    3.8    0.0000   0.0000          ?        ?   637.2446  19.1556          ?        ?      252.3        3.8       ?       ? 
1 1 1   48   18   16 o    287.9    3.8    0.0000   0.0000          ?        ?   830.0781  21.7097          ?        ?      287.9        3.8       ?       ? 
1 1 1   48   18   17 o    130.0    4.2    0.0000   0.0000          ?        ?   169.2082  10.8549          ?        ?      130.0        4.2       ?       ? 
1 1 1   48   18   18 o    159.9    3.8    0.0000   0.0000          ?        ?   256.0471  12.1319          ?        ?      159.9        3.8       ?       ? 
1 1 1   48   18   19 o    259.5    3.3    0.0000   0.0000          ?        ?   674.2788  17.2401          ?        ?      259.5        3.3       ?       ? 
1 1 1   48   18   20 o    273.1    3.3    0.0000   0.0000          ?        ?   746.4318  17.8786          ?        ?      273.1        3.3       ?       ? 
1 1 1   48   18   21 o    288.4    3.1    0.0000   0.0000          ?        ?   832.6321  17.8786          ?        ?      288.4        3.1       ?       ? 
1 1 1   48   18   22 o    120.9    6.1    0.0000   0.0000          ?        ?   146.8600  14.6860          ?        ?      120.9        6.1       ?       ? 
1 1 1   48   18   23 o    101.1    7.6    0.0000   0.0000          ?        ?   102.8020  15.3245          ?        ?      101.1        7.6       ?       ? 
1 1 1   48   18   24 o    315.6    2.7    0.0000   0.0000          ?        ?   996.7323  17.2401          ?        ?      315.6        2.7       ?       ? 
1 1 1   48   18   25 o     69.3    9.7    0.0000   0.0000          ?        ?    48.5276  13.4090          ?        ?       69.3        9.7       ?       ? 
1 1 1   48   18   26 o    128.8    5.7    0.0000   0.0000          ?        ?   166.6541  14.6860          ?        ?      128.8        5.7       ?       ? 
1 1 1   48   18   27 o     99.8    7.4    0.0000   0.0000          ?        ?   100.2479  14.6860          ?        ?       99.8        7.4       ?       ? 
1 1 1   48   18   28 o    171.3    4.5    0.0000   0.0000          ?        ?   294.3585  15.3245          ?        ?      171.3        4.5       ?       ? 
1 1 1   48   18   29 o    161.6    4.5    0.0000   0.0000          ?        ?   261.7939  14.6860          ?        ?      161.6        4.5       ?       ? 
1 1 1   48   18   30 o     76.6    9.6    0.0000   0.0000          ?        ?    59.3825  14.6860          ?        ?       76.6        9.6       ?       ? 
1 1 1   48   18   31 o     79.0    9.7    0.0000   0.0000          ?        ?    63.2136  15.3245          ?        ?       79.0        9.7       ?       ? 
1 1 1   48   18   32 o    132.2    5.6    0.0000   0.0000          ?        ?   175.5934  14.6860          ?        ?      132.2        5.6       ?       ? 
1 1 1   48   18   33 o     28.7   12.9    0.0000   0.0000          ?        ?    -6.3852  15.3245          ?        ?       28.7       12.9       ?       ? 
1 1 1   48   18   34 o    101.6    7.2    0.0000   0.0000          ?        ?   104.0790  14.6860          ?        ?      101.6        7.2       ?       ? 
1 1 1   48   18   35 o    119.5    6.1    0.0000   0.0000          ?        ?   143.6674  14.6860          ?        ?      119.5        6.1       ?       ? 
1 1 1   48   18   36 o     17.4    8.8    0.0000   0.0000          ?        ?   -53.6358  15.3245          ?        ?       17.4        8.8       ?       ? 
1 1 1   48   18   37 o    200.7    4.1    0.0000   0.0000          ?        ?   404.1842  16.6016          ?        ?      200.7        4.1       ?       ? 
1 1 1   48   18   38 o    103.5    7.7    0.0000   0.0000          ?        ?   108.5487  15.9630          ?        ?      103.5        7.7       ?       ? 
1 1 1   48   19    0 o    152.5    7.6  234.9760  22.9868   234.9760  22.9868   234.9760  22.9868      152.5      7.6      152.5        7.6     0.0     0.0 
1 1 1   48   19    1 o    265.1    3.9    0.0000   0.0000          ?        ?   703.6508  20.4327          ?        ?      265.1        3.9       ?       ? 
1 1 1   48   19    2 o    369.9    3.4    0.0000   0.0000          ?        ?  1369.6289  24.9023          ?        ?      369.9        3.4       ?       ? 
1 1 1   48   19    3 o    517.1    4.0    0.0000   0.0000          ?        ?  2677.9597  41.5039          ?        ?      517.1        4.0       ?       ? 
1 1 1   48   19    4 o    314.9    4.0    0.0000   0.0000          ?        ?   992.9011  24.9023          ?        ?      314.9        4.0       ?       ? 
1 1 1   48   19    5 o    105.4    8.8    0.0000   0.0000          ?        ?   111.7413  18.5171          ?        ?      105.4        8.8       ?       ? 
1 1 1   48   19    6 o    312.9    3.8    0.0000   0.0000          ?        ?   980.1307  23.6253          ?        ?      312.9        3.8       ?       ? 
1 1 1   48   19    7 o    150.5    5.9    0.0000   0.0000          ?        ?   227.3137  17.8786          ?        ?      150.5        5.9       ?       ? 
1 1 1   48   19    8 o    222.0    4.6    0.0000   0.0000          ?        ?   493.5772  20.4327          ?        ?      222.0        4.6       ?       ? 
1 1 1   48   19    9 o    333.4    4.3    0.0000   0.0000          ?        ?  1113.5817  28.7335          ?        ?      333.4        4.3       ?       ? 
1 1 1   48   19   10 o    344.3    4.0    0.0000   0.0000          ?        ?  1187.0117  27.4564          ?        ?      344.3        4.0       ?       ? 
1 1 1   48   19   11 o    225.2    3.7    0.0000   0.0000          ?        ?   507.6247  16.6016          ?        ?      225.2        3.7       ?       ? 
1 1 1   48   19   12 o    229.1    3.5    0.0000   0.0000          ?        ?   525.5033  15.9630          ?        ?      229.1        3.5       ?       ? 
1 1 1   48   19   13 o    468.7    3.3    0.0000   0.0000          ?        ?  2199.0684  31.2876          ?        ?      468.7        3.3       ?       ? 
1 1 1   48   19   14 o    222.4    3.7    0.0000   0.0000          ?        ?   495.4928  16.6016          ?        ?      222.4        3.7       ?       ? 
1 1 1   48   19   15 o    220.4    4.3    0.0000   0.0000          ?        ?   486.5535  19.1556          ?        ?      220.4        4.3       ?       ? 
1 1 1   48   19   16 o     30.3   13.3    0.0000   0.0000          ?        ?    -3.1926  15.3245          ?        ?       30.3       13.3       ?       ? 
1 1 1   48   19   17 o    204.2    4.4    0.0000   0.0000          ?        ?   417.5931  17.8786          ?        ?      204.2        4.4       ?       ? 
1 1 1   48   19   18 o    400.2    3.0    0.0000   0.0000          ?        ?  1603.3279  24.2638          ?        ?      400.2        3.0       ?       ? 
1 1 1   48   19   19 o    194.6    3.3    0.0000   0.0000          ?        ?   379.2819  12.7704          ?        ?      194.6        3.3       ?       ? 
1 1 1   48   19   20 o    301.4    2.9    0.0000   0.0000          ?        ?   909.2548  17.2401          ?        ?      301.4        2.9       ?       ? 
1 1 1   48   19   21 o    166.1    4.0    0.0000   0.0000          ?        ?   276.4799  13.4090          ?        ?      166.1        4.0       ?       ? 
1 1 1   48   19   22 o    212.5    3.6    0.0000   0.0000          ?        ?   452.0733  15.3245          ?        ?      212.5        3.6       ?       ? 
1 1 1   48   19   23 o    375.0    2.9    0.0000   0.0000          ?        ?  1407.3016  21.7097          ?        ?      375.0        2.9       ?       ? 
1 1 1   48   19   24 o     26.2   12.2    0.0000   0.0000          ?        ?   -15.3245  15.9630          ?        ?       26.2       12.2       ?       ? 
1 1 1   48   19   25 o     17.9    9.0    0.0000   0.0000          ?        ?   -45.3350  14.6860          ?        ?       17.9        9.0       ?       ? 
1 1 1   48   19   26 o     57.5   13.1    0.0000   0.0000          ?        ?    35.1187  14.6860          ?        ?       57.5       13.1       ?       ? 
1 1 1   48   19   27 o    172.8    4.6    0.0000   0.0000          ?        ?   299.4666  15.9630          ?        ?      172.8        4.6       ?       ? 
1 1 1   48   19   28 f    191.1    4.0    0.0000   0.0000          ?        ?   365.8729  15.3245          ?        ?      191.1        4.0       ?       ? 
1 1 1   48   19   29 o    201.6    4.0    0.0000   0.0000          ?        ?   407.3768  15.9630          ?        ?      201.6        4.0       ?       ? 
1 1 1   48   19   30 o     26.0   12.1    0.0000   0.0000          ?        ?   -13.4090  15.3245          ?        ?       26.0       12.1       ?       ? 
1 1 1   48   19   31 o     58.9   13.3    0.0000   0.0000          ?        ?    37.0343  15.3245          ?        ?       58.9       13.3       ?       ? 
1 1 1   48   19   32 o    316.8    3.0    0.0000   0.0000          ?        ?  1005.0330  19.1556          ?        ?      316.8        3.0       ?       ? 
1 1 1   48   19   33 o     68.4   11.2    0.0000   0.0000          ?        ?    47.8891  15.3245          ?        ?       68.4       11.2       ?       ? 
1 1 1   48   19   34 f    247.1    3.4    0.0000   0.0000          ?        ?   611.7037  16.6016          ?        ?      247.1        3.4       ?       ? 
1 1 1   48   19   35 o    178.5    4.3    0.0000   0.0000          ?        ?   319.8993  15.3245          ?        ?      178.5        4.3       ?       ? 
1 1 1   48   19   36 o    114.4    6.7    0.0000   0.0000          ?        ?   132.1740  15.3245          ?        ?      114.4        6.7       ?       ? 
1 1 1   48   20    0 o    367.9    5.1 1355.5814  37.6728  1355.5814  37.6728  1355.5814  37.6728      367.9      5.1      367.9        5.1     0.0     0.0 
1 1 1   48   20    1 o    154.1    5.2    0.0000   0.0000          ?        ?   238.1686  15.9630          ?        ?      154.1        5.2       ?       ? 
1 1 1   48   20    2 o    207.4    4.8    0.0000   0.0000          ?        ?   431.0021  19.7942          ?        ?      207.4        4.8       ?       ? 
1 1 1   48   20    3 o    155.3    6.0    0.0000   0.0000          ?        ?   241.9997  18.5171          ?        ?      155.3        6.0       ?       ? 
1 1 1   48   20    4 o     90.7    9.5    0.0000   0.0000          ?        ?    83.0078  17.2401          ?        ?       90.7        9.5       ?       ? 
1 1 1   48   20    5 o    203.5    4.5    0.0000   0.0000          ?        ?   415.0391  18.5171          ?        ?      203.5        4.5       ?       ? 
1 1 1   48   20    6 f    197.6    5.5    0.0000   0.0000          ?        ?   391.4138  21.7097          ?        ?      197.6        5.5       ?       ? 
1 1 1   48   20    7 o     22.1   11.0    0.0000   0.0000          ?        ?   -47.8891  19.1556          ?        ?       22.1       11.0       ?       ? 
1 1 1   48   20    8 f    123.5    6.7    0.0000   0.0000          ?        ?   153.2452  16.6016          ?        ?      123.5        6.7       ?       ? 
1 1 1   48   20    9 o    262.5    3.9    0.0000   0.0000          ?        ?   690.2419  20.4327          ?        ?      262.5        3.9       ?       ? 
1 1 1   48   20   10 o    300.2    4.3    0.0000   0.0000          ?        ?   902.8696  25.5409          ?        ?      300.2        4.3       ?       ? 
1 1 1   48   20   11 f     22.9   11.3    0.0000   0.0000          ?        ?   -39.5883  18.5171          ?        ?       22.9       11.3       ?       ? 
1 1 1   48   20   12 o     89.8    7.5    0.0000   0.0000          ?        ?    81.0922  13.4090          ?        ?       89.8        7.5       ?       ? 
1 1 1   48   20   13 o    150.0    4.7    0.0000   0.0000          ?        ?   225.3981  14.0475          ?        ?      150.0        4.7       ?       ? 
1 1 1   48   20   14 o    254.2    3.6    0.0000   0.0000          ?        ?   646.8224  18.5171          ?        ?      254.2        3.6       ?       ? 
1 1 1   48   20   15 o    369.5    3.2    0.0000   0.0000          ?        ?  1367.0748  23.6253          ?        ?      369.5        3.2       ?       ? 
1 1 1   48   20   16 o    135.6    5.7    0.0000   0.0000          ?        ?   184.5327  15.3245          ?        ?      135.6        5.7       ?       ? 
1 1 1   48   20   17 o    285.9    3.6    0.0000   0.0000          ?        ?   818.5847  20.4327          ?        ?      285.9        3.6       ?       ? 
1 1 1   48   20   18 o     43.6   15.1    0.0000   0.0000          ?        ?    17.8786  15.9630          ?        ?       43.6       15.1       ?       ? 
1 1 1   48   20   19 o    206.1    2.9    0.0000   0.0000          ?        ?   425.2554  12.1319          ?        ?      206.1        2.9       ?       ? 
1 1 1   48   20   20 o    264.5    2.9    0.0000   0.0000          ?        ?   700.4582  15.3245          ?        ?      264.5        2.9       ?       ? 
1 1 1   48   20   21 o     40.1   14.1    0.0000   0.0000          ?        ?    14.6860  14.0475          ?        ?       40.1       14.1       ?       ? 
1 1 1   48   20   22 o     15.3    7.8    0.0000   0.0000          ?        ?   -44.0580  12.1319          ?        ?       15.3        7.8       ?       ? 
1 1 1   48   20   23 o    201.4    3.5    0.0000   0.0000          ?        ?   406.0997  14.0475          ?        ?      201.4        3.5       ?       ? 
1 1 1   48   20   24 o    111.3    6.3    0.0000   0.0000          ?        ?   124.5117  14.0475          ?        ?      111.3        6.3       ?       ? 
1 1 1   48   20   25 o    278.0    3.0    0.0000   0.0000          ?        ?   773.8882  16.6016          ?        ?      278.0        3.0       ?       ? 
1 1 1   48   20   26 o    207.1    3.7    0.0000   0.0000          ?        ?   429.7251  15.3245          ?        ?      207.1        3.7       ?       ? 
1 1 1   48   20   27 o    271.0    3.2    0.0000   0.0000          ?        ?   735.5769  17.2401          ?        ?      271.0        3.2       ?       ? 
1 1 1   48   20   28 o    159.1    4.8    0.0000   0.0000          ?        ?   254.1316  15.3245          ?        ?      159.1        4.8       ?       ? 
1 1 1   48   20   29 o    232.9    3.6    0.0000   0.0000          ?        ?   543.3819  16.6016          ?        ?      232.9        3.6       ?       ? 
1 1 1   48   20   30 o     79.2   10.1    0.0000   0.0000          ?        ?    63.8522  15.9630          ?        ?       79.2       10.1       ?       ? 
1 1 1   48   20   31 o    104.0    7.4    0.0000   0.0000          ?        ?   109.1872  15.3245          ?        ?      104.0        7.4       ?       ? 
1 1 1   48   20   32 o    241.9    3.6    0.0000   0.0000          ?        ?   586.8014  17.2401          ?        ?      241.9        3.6       ?       ? 
1 1 1   48   20   33 o    155.4    4.5    0.0000   0.0000          ?        ?   242.6382  14.0475          ?        ?      155.4        4.5       ?       ? 
1 1 1   48   20   34 o    145.9    5.0    0.0000   0.0000          ?        ?   213.9047  14.6860          ?        ?      145.9        5.0       ?       ? 
1 1 1   48   21    0 o    141.5    8.4  203.0499  23.6253   203.0499  23.6253   203.0499  23.6253      141.5      8.4      141.5        8.4     0.0     0.0 
1 1 1   48   21    1 o    280.9    4.0    0.0000   0.0000          ?        ?   790.4898  22.3483          ?        ?      280.9        4.0       ?       ? 
1 1 1   48   21    2 o    111.0    7.8    0.0000   0.0000          ?        ?   123.8732  17.2401          ?        ?      111.0        7.8       ?       ? 
1 1 1   48   21    3 o    399.0    4.2    0.0000   0.0000          ?        ?  1595.0271  33.2031          ?        ?      399.0        4.2       ?       ? 
1 1 1   48   21    4 o    268.3    4.5    0.0000   0.0000          ?        ?   721.5294  24.2638          ?        ?      268.3        4.5       ?       ? 
1 1 1   48   21    5 o     86.4    9.2    0.0000   0.0000          ?        ?    75.3456  15.9630          ?        ?       86.4        9.2       ?       ? 
1 1 1   48   21    6 o     51.7   14.3    0.0000   0.0000          ?        ?    28.0950  15.3245          ?        ?       51.7       14.3       ?       ? 
1 1 1   48   21    7 o    107.2    7.7    0.0000   0.0000          ?        ?   115.5724  16.6016          ?        ?      107.2        7.7       ?       ? 
1 1 1   48   21    8 o    103.7    9.2    0.0000   0.0000          ?        ?   108.5487  19.1556          ?        ?      103.7        9.2       ?       ? 
1 1 1   48   21    9 o    224.8    4.4    0.0000   0.0000          ?        ?   506.3477  19.7942          ?        ?      224.8        4.4       ?       ? 
1 1 1   48   21   10 o    191.6    5.5    0.0000   0.0000          ?        ?   368.4270  21.0712          ?        ?      191.6        5.5       ?       ? 
1 1 1   48   21   11 o    329.9    4.6    0.0000   0.0000          ?        ?  1090.5950  30.6490          ?        ?      329.9        4.6       ?       ? 
1 1 1   48   21   12 o    178.5    5.7    0.0000   0.0000          ?        ?   319.8993  20.4327          ?        ?      178.5        5.7       ?       ? 
1 1 1   48   21   13 o    310.9    3.6    0.0000   0.0000          ?        ?   967.9988  22.3483          ?        ?      310.9        3.6       ?       ? 
1 1 1   48   21   14 o    126.2    5.1    0.0000   0.0000          ?        ?   159.6304  12.7704          ?        ?      126.2        5.1       ?       ? 
1 1 1   48   21   15 o     83.1    8.5    0.0000   0.0000          ?        ?    69.5989  14.0475          ?        ?       83.1        8.5       ?       ? 
1 1 1   48   21   16 o     96.6    7.3    0.0000   0.0000          ?        ?    93.8627  14.0475          ?        ?       96.6        7.3       ?       ? 
1 1 1   48   21   17 o     93.9    7.8    0.0000   0.0000          ?        ?    88.7545  14.6860          ?        ?       93.9        7.8       ?       ? 
1 1 1   48   21   18 f    129.6    5.9    0.0000   0.0000          ?        ?   168.5697  15.3245          ?        ?      129.6        5.9       ?       ? 
1 1 1   48   21   19 o    201.4    4.3    0.0000   0.0000          ?        ?   406.7383  17.2401          ?        ?      201.4        4.3       ?       ? 
1 1 1   48   21   20 o     14.4    7.2    0.0000   0.0000          ?        ?   -25.5409   8.9393          ?        ?       14.4        7.2       ?       ? 
1 1 1   48   21   21 o    113.4    5.1    0.0000   0.0000          ?        ?   128.9814  11.4934          ?        ?      113.4        5.1       ?       ? 
1 1 1   48   21   22 o     29.4   12.5    0.0000   0.0000          ?        ?     0.6385  12.7704          ?        ?       29.4       12.5       ?       ? 
1 1 1   48   21   23 o     94.6    6.8    0.0000   0.0000          ?        ?    90.0316  12.7704          ?        ?       94.6        6.8       ?       ? 
1 1 1   48   21   24 o    202.8    3.5    0.0000   0.0000          ?        ?   411.8464  14.0475          ?        ?      202.8        3.5       ?       ? 
1 1 1   48   21   25 o    193.2    3.8    0.0000   0.0000          ?        ?   374.1737  14.6860          ?        ?      193.2        3.8       ?       ? 
1 1 1   48   21   26 f    275.8    2.9    0.0000   0.0000          ?        ?   761.7563  15.9630          ?        ?      275.8        2.9       ?       ? 
1 1 1   48   21   27 o     84.5    7.6    0.0000   0.0000          ?        ?    72.1529  12.7704          ?        ?       84.5        7.6       ?       ? 
1 1 1   48   21   28 o    291.1    2.9    0.0000   0.0000          ?        ?   848.5952  16.6016          ?        ?      291.1        2.9       ?       ? 
1 1 1   48   21   29 o     29.7   13.0    0.0000   0.0000          ?        ?    -2.5541  14.6860          ?        ?       29.7       13.0       ?       ? 
1 1 1   48   21   30 o     58.4   12.4    0.0000   0.0000          ?        ?    36.3957  14.0475          ?        ?       58.4       12.4       ?       ? 
1 1 1   48   21   31 o     86.5    8.9    0.0000   0.0000          ?        ?    75.9841  15.3245          ?        ?       86.5        8.9       ?       ? 
1 1 1   48   21   32 o     23.2   11.1    0.0000   0.0000          ?        ?   -19.7942  14.6860          ?        ?       23.2       11.1       ?       ? 
1 1 1   48   22    0 o    331.9    5.6 1104.6425  37.0343  1104.6425  37.0343  1104.6425  37.0343      331.9      5.6      331.9        5.6     0.0     0.0 
1 1 1   48   22    1 o    224.6    4.4    0.0000   0.0000          ?        ?   505.7091  19.7942          ?        ?      224.6        4.4       ?       ? 
1 1 1   48   22    2 o    267.0    3.9    0.0000   0.0000          ?        ?   713.8672  21.0712          ?        ?      267.0        3.9       ?       ? 
1 1 1   48   22    3 o    358.3    3.7    0.0000   0.0000          ?        ?  1285.9825  26.8179          ?        ?      358.3        3.7       ?       ? 
1 1 1   48   22    4 o    180.5    5.3    0.0000   0.0000          ?        ?   326.9231  19.1556          ?        ?      180.5        5.3       ?       ? 
1 1 1   48   22    5 o     68.0   12.7    0.0000   0.0000          ?        ?    48.5276  16.6016          ?        ?       68.0       12.7       ?       ? 
1 1 1   48   22    6 o    145.3    6.2    0.0000   0.0000          ?        ?   211.9892  17.8786          ?        ?      145.3        6.2       ?       ? 
1 1 1   48   22    7 o    185.4    5.2    0.0000   0.0000          ?        ?   344.8017  19.1556          ?        ?      185.4        5.2       ?       ? 
1 1 1   48   22    8 o    291.4    4.6    0.0000   0.0000          ?        ?   851.1494  26.8179          ?        ?      291.4        4.6       ?       ? 
1 1 1   48   22    9 o     66.0   15.7    0.0000   0.0000          ?        ?    46.6121  20.4327          ?        ?       66.0       15.7       ?       ? 
1 1 1   48   22   10 o    157.6    7.9    0.0000   0.0000          ?        ?   250.3005  24.9023          ?        ?      157.6        7.9       ?       ? 
1 1 1   48   22   11 o    142.3    7.2    0.0000   0.0000          ?        ?   203.6884  20.4327          ?        ?      142.3        7.2       ?       ? 
1 1 1   48   22   12 o    261.3    4.5    0.0000   0.0000          ?        ?   684.4952  23.6253          ?        ?      261.3        4.5       ?       ? 
1 1 1   48   22   13 o    277.2    4.4    0.0000   0.0000          ?        ?   770.0571  24.2638          ?        ?      277.2        4.4       ?       ? 
1 1 1   48   22   14 o    102.7    6.5    0.0000   0.0000          ?        ?   105.9946  13.4090          ?        ?      102.7        6.5       ?       ? 
1 1 1   48   22   15 o     86.1    7.4    0.0000   0.0000          ?        ?    74.7070  12.7704          ?        ?       86.1        7.4       ?       ? 
1 1 1   48   22   16 o    146.0    5.0    0.0000   0.0000          ?        ?   213.9047  14.6860          ?        ?      146.0        5.0       ?       ? 
1 1 1   48   22   17 o    311.9    3.5    0.0000   0.0000          ?        ?   974.3840  21.7097          ?        ?      311.9        3.5       ?       ? 
1 1 1   48   22   18 o    148.8    5.4    0.0000   0.0000          ?        ?   222.2055  15.9630          ?        ?      148.8        5.4       ?       ? 
1 1 1   48   22   19 o    240.0    3.7    0.0000   0.0000          ?        ?   577.2236  17.8786          ?        ?      240.0        3.7       ?       ? 
1 1 1   48   22   20 o     46.0   14.4    0.0000   0.0000          ?        ?    21.7097  14.6860          ?        ?       46.0       14.4       ?       ? 
1 1 1   48   22   21 o    110.6    6.6    0.0000   0.0000          ?        ?   123.2347  14.6860          ?        ?      110.6        6.6       ?       ? 
1 1 1   48   22   22 o     70.7    7.2    0.0000   0.0000          ?        ?    50.4432  10.2163          ?        ?       70.7        7.2       ?       ? 
1 1 1   48   22   23 o    122.8    4.7    0.0000   0.0000          ?        ?   151.3296  11.4934          ?        ?      122.8        4.7       ?       ? 
1 1 1   48   22   24 o    106.0    6.0    0.0000   0.0000          ?        ?   113.0183  12.7704          ?        ?      106.0        6.0       ?       ? 
1 1 1   48   22   25 o     81.4    8.2    0.0000   0.0000          ?        ?    67.0448  13.4090          ?        ?       81.4        8.2       ?       ? 
1 1 1   48   22   26 o    238.9    3.1    0.0000   0.0000          ?        ?   571.4769  14.6860          ?        ?      238.9        3.1       ?       ? 
1 1 1   48   22   27 o    155.5    4.5    0.0000   0.0000          ?        ?   242.6382  14.0475          ?        ?      155.5        4.5       ?       ? 
1 1 1   48   22   28 o     21.0   10.2    0.0000   0.0000          ?        ?   -22.3483  13.4090          ?        ?       21.0       10.2       ?       ? 
1 1 1   48   22   29 o    173.3    4.1    0.0000   0.0000          ?        ?   301.3822  14.0475          ?        ?      173.3        4.1       ?       ? 
1 1 1   48   22   30 o     71.6    9.8    0.0000   0.0000          ?        ?    52.3588  14.0475          ?        ?       71.6        9.8       ?       ? 
1 1 1   48   23    0 o     89.0   12.0   81.7308  21.0712    81.7308  21.0712    81.7308  21.0712       89.0     12.0       89.0       12.0     0.0     0.0 
1 1 1   48   23    1 o    365.7    4.1    0.0000   0.0000          ?        ?  1340.2568  30.0105          ?        ?      365.7        4.1       ?       ? 
1 1 1   48   23    2 o    419.9    4.0    0.0000   0.0000          ?        ?  1766.7894  33.2031          ?        ?      419.9        4.0       ?       ? 
1 1 1   48   23    3 o    270.2    4.1    0.0000   0.0000          ?        ?   731.7458  22.3483          ?        ?      270.2        4.1       ?       ? 
1 1 1   48   23    4 o    116.6    6.8    0.0000   0.0000          ?        ?   136.6436  15.9630          ?        ?      116.6        6.8       ?       ? 
1 1 1   48   23    5 o    254.1    4.1    0.0000   0.0000          ?        ?   646.8224  21.0712          ?        ?      254.1        4.1       ?       ? 
1 1 1   48   23    6 o    118.6    8.1    0.0000   0.0000          ?        ?   141.7518  19.1556          ?        ?      118.6        8.1       ?       ? 
1 1 1   48   23    7 o    246.6    4.5    0.0000   0.0000          ?        ?   609.7881  22.3483          ?        ?      246.6        4.5       ?       ? 
1 1 1   48   23    8 o    418.6    4.4    0.0000   0.0000          ?        ?  1756.5730  37.0343          ?        ?      418.6        4.4       ?       ? 
1 1 1   48   23    9 o    343.5    3.9    0.0000   0.0000          ?        ?  1182.5420  26.8179          ?        ?      343.5        3.9       ?       ? 
1 1 1   48   23   10 o    227.9    4.6    0.0000   0.0000          ?        ?   521.0336  21.0712          ?        ?      227.9        4.6       ?       ? 
1 1 1   48   23   11 o    271.5    4.1    0.0000   0.0000          ?        ?   738.7695  22.3483          ?        ?      271.5        4.1       ?       ? 
1 1 1   48   23   12 o    307.0    4.4    0.0000   0.0000          ?        ?   945.0120  26.8179          ?        ?      307.0        4.4       ?       ? 
1 1 1   48   23   13 o    215.1    5.6    0.0000   0.0000          ?        ?   464.8438  24.2638          ?        ?      215.1        5.6       ?       ? 
1 1 1   48   23   14 o    158.6    6.4    0.0000   0.0000          ?        ?   252.8546  20.4327          ?        ?      158.6        6.4       ?       ? 
1 1 1   48   23   15 o    269.7    3.7    0.0000   0.0000          ?        ?   728.5532  19.7942          ?        ?      269.7        3.7       ?       ? 
1 1 1   48   23   16 o    123.0    5.5    0.0000   0.0000          ?        ?   151.9681  13.4090          ?        ?      123.0        5.5       ?       ? 
1 1 1   48   23   17 o     18.6    9.3    0.0000   0.0000          ?        ?   -37.0343  14.0475          ?        ?       18.6        9.3       ?       ? 
1 1 1   48   23   18 o    114.3    6.7    0.0000   0.0000          ?        ?   131.5355  15.3245          ?        ?      114.3        6.7       ?       ? 
1 1 1   48   23   19 o    115.9    6.9    0.0000   0.0000          ?        ?   135.3666  15.9630          ?        ?      115.9        6.9       ?       ? 
1 1 1   48   23   20 o    303.9    3.3    0.0000   0.0000          ?        ?   925.2178  19.7942          ?        ?      303.9        3.3       ?       ? 
1 1 1   48   23   21 o     63.0   12.6    0.0000   0.0000          ?        ?    42.1424  15.3245          ?        ?       63.0       12.6       ?       ? 
1 1 1   48   23   22 o    185.2    4.3    0.0000   0.0000          ?        ?   344.1632  15.9630          ?        ?      185.2        4.3       ?       ? 
1 1 1   48   23   23 o     61.5    8.8    0.0000   0.0000          ?        ?    38.3113  10.8549          ?        ?       61.5        8.8       ?       ? 
1 1 1   48   23   24 o    240.7    2.9    0.0000   0.0000          ?        ?   580.4161  14.0475          ?        ?      240.7        2.9       ?       ? 
1 1 1   48   23   25 o     63.8   10.0    0.0000   0.0000          ?        ?    41.5039  12.7704          ?        ?       63.8       10.0       ?       ? 
1 1 1   48   23   26 o     84.9    7.1    0.0000   0.0000          ?        ?    72.7915  12.1319          ?        ?       84.9        7.1       ?       ? 
1 1 1   48   23   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   48   24    0 o    427.7    4.9 1833.1957  42.1424  1833.1957  42.1424  1833.1957  42.1424      427.7      4.9      427.7        4.9     0.0     0.0 
1 1 1   48   24    1 f    218.0    4.5    0.0000   0.0000          ?        ?   476.3371  19.7942          ?        ?      218.0        4.5       ?       ? 
1 1 1   48   24    2 f    141.5    5.9    0.0000   0.0000          ?        ?   201.1343  16.6016          ?        ?      141.5        5.9       ?       ? 
1 1 1   48   24    3 o    219.3    4.5    0.0000   0.0000          ?        ?   482.0838  19.7942          ?        ?      219.3        4.5       ?       ? 
1 1 1   48   24    4 o    133.5    7.4    0.0000   0.0000          ?        ?   179.4246  19.7942          ?        ?      133.5        7.4       ?       ? 
1 1 1   48   24    5 o    249.2    4.2    0.0000   0.0000          ?        ?   622.5586  21.0712          ?        ?      249.2        4.2       ?       ? 
1 1 1   48   24    6 o    247.2    4.6    0.0000   0.0000          ?        ?   612.9808  22.9868          ?        ?      247.2        4.6       ?       ? 
1 1 1   48   24    7 o    236.6    4.5    0.0000   0.0000          ?        ?   561.2605  21.0712          ?        ?      236.6        4.5       ?       ? 
1 1 1   48   24    8 o    255.7    4.4    0.0000   0.0000          ?        ?   655.7617  22.3483          ?        ?      255.7        4.4       ?       ? 
1 1 1   48   24    9 f    581.8    4.4    0.0000   0.0000          ?        ?  3394.3809  51.7203          ?        ?      581.8        4.4       ?       ? 
1 1 1   48   24   10 o    318.2    4.1    0.0000   0.0000          ?        ?  1015.2494  26.1794          ?        ?      318.2        4.1       ?       ? 
1 1 1   48   24   11 o     42.0   15.5    0.0000   0.0000          ?        ?    14.6860  17.2401          ?        ?       42.0       15.5       ?       ? 
1 1 1   48   24   12 o     29.9   13.6    0.0000   0.0000          ?        ?   -10.2163  17.8786          ?        ?       29.9       13.6       ?       ? 
1 1 1   48   24   13 o    158.0    6.1    0.0000   0.0000          ?        ?   250.9390  19.1556          ?        ?      158.0        6.1       ?       ? 
1 1 1   48   24   14 o    101.0    9.2    0.0000   0.0000          ?        ?   103.4405  18.5171          ?        ?      101.0        9.2       ?       ? 
1 1 1   48   24   15 o    140.2    6.6    0.0000   0.0000          ?        ?   197.9417  18.5171          ?        ?      140.2        6.6       ?       ? 
1 1 1   48   24   16 o    120.6    5.3    0.0000   0.0000          ?        ?   146.2215  12.7704          ?        ?      120.6        5.3       ?       ? 
1 1 1   48   24   17 o    326.4    3.5    0.0000   0.0000          ?        ?  1067.6082  22.9868          ?        ?      326.4        3.5       ?       ? 
1 1 1   48   24   18 o    232.6    3.7    0.0000   0.0000          ?        ?   542.1049  17.2401          ?        ?      232.6        3.7       ?       ? 
1 1 1   48   24   19 o     76.4   10.0    0.0000   0.0000          ?        ?    59.3825  15.3245          ?        ?       76.4       10.0       ?       ? 
1 1 1   48   24   20 f    238.1    3.4    0.0000   0.0000          ?        ?   568.2842  15.9630          ?        ?      238.1        3.4       ?       ? 
1 1 1   48   24   21 o     99.7    7.0    0.0000   0.0000          ?        ?   100.2479  14.0475          ?        ?       99.7        7.0       ?       ? 
1 1 1   48   24   22 o    216.4    4.1    0.0000   0.0000          ?        ?   469.9519  17.8786          ?        ?      216.4        4.1       ?       ? 
1 1 1   48   24   23 o     70.6   10.8    0.0000   0.0000          ?        ?    51.0817  15.3245          ?        ?       70.6       10.8       ?       ? 
1 1 1   48   24   24 o    136.1    4.2    0.0000   0.0000          ?        ?   185.8098  11.4934          ?        ?      136.1        4.2       ?       ? 
1 1 1   48   25    0 o    164.6    6.8  273.2873  22.3483   273.2873  22.3483   273.2873  22.3483      164.6      6.8      164.6        6.8     0.0     0.0 
1 1 1   48   25    1 o    249.6    3.7    0.0000   0.0000          ?        ?   624.4742  18.5171          ?        ?      249.6        3.7       ?       ? 
1 1 1   48   25    2 o    180.3    5.3    0.0000   0.0000          ?        ?   326.2845  19.1556          ?        ?      180.3        5.3       ?       ? 
1 1 1   48   25    3 o    212.0    4.5    0.0000   0.0000          ?        ?   450.7963  19.1556          ?        ?      212.0        4.5       ?       ? 
1 1 1   48   25    4 f    178.6    5.5    0.0000   0.0000          ?        ?   320.5379  19.7942          ?        ?      178.6        5.5       ?       ? 
1 1 1   48   25    5 o     69.5   11.0    0.0000   0.0000          ?        ?    49.1662  15.3245          ?        ?       69.5       11.0       ?       ? 
1 1 1   48   25    6 o    229.5    4.3    0.0000   0.0000          ?        ?   528.0574  19.7942          ?        ?      229.5        4.3       ?       ? 
1 1 1   48   25    7 o    176.9    4.9    0.0000   0.0000          ?        ?   314.1526  17.2401          ?        ?      176.9        4.9       ?       ? 
1 1 1   48   25    8 o    104.2    8.3    0.0000   0.0000          ?        ?   109.8257  17.2401          ?        ?      104.2        8.3       ?       ? 
1 1 1   48   25    9 o    243.1    4.9    0.0000   0.0000          ?        ?   593.1866  23.6253          ?        ?      243.1        4.9       ?       ? 
1 1 1   48   25   10 o    117.2    7.6    0.0000   0.0000          ?        ?   138.5592  17.8786          ?        ?      117.2        7.6       ?       ? 
1 1 1   48   25   11 o    300.9    4.2    0.0000   0.0000          ?        ?   907.9777  25.5409          ?        ?      300.9        4.2       ?       ? 
1 1 1   48   25   12 o    353.3    4.4    0.0000   0.0000          ?        ?  1252.1410  31.2876          ?        ?      353.3        4.4       ?       ? 
1 1 1   48   25   13 o    179.0    5.2    0.0000   0.0000          ?        ?   321.8149  18.5171          ?        ?      179.0        5.2       ?       ? 
1 1 1   48   25   14 o    179.3    5.2    0.0000   0.0000          ?        ?   323.0919  18.5171          ?        ?      179.3        5.2       ?       ? 
1 1 1   48   25   15 o    141.6    5.9    0.0000   0.0000          ?        ?   201.7728  16.6016          ?        ?      141.6        5.9       ?       ? 
1 1 1   48   25   16 o    114.9    7.5    0.0000   0.0000          ?        ?   133.4510  17.2401          ?        ?      114.9        7.5       ?       ? 
1 1 1   48   25   17 o    388.2    3.5    0.0000   0.0000          ?        ?  1510.7422  27.4564          ?        ?      388.2        3.5       ?       ? 
1 1 1   48   25   18 o    213.3    3.6    0.0000   0.0000          ?        ?   455.9044  15.3245          ?        ?      213.3        3.6       ?       ? 
1 1 1   48   25   19 o    126.7    5.8    0.0000   0.0000          ?        ?   161.5460  14.6860          ?        ?      126.7        5.8       ?       ? 
1 1 1   48   25   20 o    260.6    3.3    0.0000   0.0000          ?        ?   680.6641  17.2401          ?        ?      260.6        3.3       ?       ? 
1 1 1   48   25   21 o    233.9    3.7    0.0000   0.0000          ?        ?   548.4901  17.2401          ?        ?      233.9        3.7       ?       ? 
1 1 1   48   26    0 o    151.7    8.5  233.6989  25.5409   233.6989  25.5409   233.6989  25.5409      151.7      8.5      151.7        8.5     0.0     0.0 
1 1 1   48   26    1 o     90.8    9.1    0.0000   0.0000          ?        ?    83.6463  16.6016          ?        ?       90.8        9.1       ?       ? 
1 1 1   48   26    2 o    167.9    4.6    0.0000   0.0000          ?        ?   282.8651  15.3245          ?        ?      167.9        4.6       ?       ? 
1 1 1   48   26    3 o    152.4    4.6    0.0000   0.0000          ?        ?   233.0604  14.0475          ?        ?      152.4        4.6       ?       ? 
1 1 1   48   26    4 o    282.6    3.5    0.0000   0.0000          ?        ?   800.0676  19.7942          ?        ?      282.6        3.5       ?       ? 
1 1 1   48   26    5 o    354.4    3.5    0.0000   0.0000          ?        ?  1258.5261  24.9023          ?        ?      354.4        3.5       ?       ? 
1 1 1   48   26    6 o    211.3    3.8    0.0000   0.0000          ?        ?   447.6036  15.9630          ?        ?      211.3        3.8       ?       ? 
1 1 1   48   26    7 o     23.9   11.1    0.0000   0.0000          ?        ?   -10.8549  12.7704          ?        ?       23.9       11.1       ?       ? 
1 1 1   48   26    8 o    102.2    6.9    0.0000   0.0000          ?        ?   105.3561  14.0475          ?        ?      102.2        6.9       ?       ? 
1 1 1   48   26    9 o    161.2    4.9    0.0000   0.0000          ?        ?   261.1554  15.9630          ?        ?      161.2        4.9       ?       ? 
1 1 1   48   26   10 o    304.4    3.8    0.0000   0.0000          ?        ?   929.0490  22.9868          ?        ?      304.4        3.8       ?       ? 
1 1 1   48   26   11 o    322.3    3.9    0.0000   0.0000          ?        ?  1041.4288  24.9023          ?        ?      322.3        3.9       ?       ? 
1 1 1   48   26   12 o    124.8    6.7    0.0000   0.0000          ?        ?   157.0763  16.6016          ?        ?      124.8        6.7       ?       ? 
1 1 1   48   26   13 o     96.2    8.6    0.0000   0.0000          ?        ?    93.8627  16.6016          ?        ?       96.2        8.6       ?       ? 
1 1 1   48   26   14 o    206.6    4.9    0.0000   0.0000          ?        ?   429.0865  20.4327          ?        ?      206.6        4.9       ?       ? 
1 1 1   48   26   15 o     75.7   11.4    0.0000   0.0000          ?        ?    58.7440  17.2401          ?        ?       75.7       11.4       ?       ? 
1 1 1   48   26   16 o     33.8   14.1    0.0000   0.0000          ?        ?     3.1926  15.9630          ?        ?       33.8       14.1       ?       ? 
1 1 1   48   26   17 o     40.4   15.2    0.0000   0.0000          ?        ?    13.4090  16.6016          ?        ?       40.4       15.2       ?       ? 
1 1 1   48   27    0 o     47.2   20.1   32.5646  19.1556    32.5646  19.1556    32.5646  19.1556       47.2     20.1       47.2       20.1     0.0     0.0 
1 1 1   48   27    1 o    107.0   10.4    0.0000   0.0000          ?        ?   116.8494  22.3483          ?        ?      107.0       10.4       ?       ? 
1 1 1   48   27    2 o     45.5   17.8    0.0000   0.0000          ?        ?    14.6860  23.6253          ?        ?       45.5       17.8       ?       ? 
1 1 1   48   27    3 o    124.1    9.3    0.0000   0.0000          ?        ?   156.4378  22.9868          ?        ?      124.1        9.3       ?       ? 
1 1 1   48   27    4 o    176.8    6.9    0.0000   0.0000          ?        ?   315.4297  24.2638          ?        ?      176.8        6.9       ?       ? 
1 1 1   48   27    5 o    134.6    6.6    0.0000   0.0000          ?        ?   182.6172  17.8786          ?        ?      134.6        6.6       ?       ? 
1 1 1   48   27    6 o    184.9    5.0    0.0000   0.0000          ?        ?   343.5246  18.5171          ?        ?      184.9        5.0       ?       ? 
1 1 1   48   27    7 o     23.3   11.5    0.0000   0.0000          ?        ?   -37.0343  18.5171          ?        ?       23.3       11.5       ?       ? 
1 1 1   48   27    8 o     55.7   17.2    0.0000   0.0000          ?        ?    33.2031  21.0712          ?        ?       55.7       17.2       ?       ? 
1 1 1   48   27    9 o    103.6    5.5    0.0000   0.0000          ?        ?   107.9102  11.4934          ?        ?      103.6        5.5       ?       ? 
1 1 1   48   27   10 o     41.3   13.5    0.0000   0.0000          ?        ?    17.2401  12.7704          ?        ?       41.3       13.5       ?       ? 
1 1 1   48   27   11 o    166.3    4.4    0.0000   0.0000          ?        ?   277.7569  14.6860          ?        ?      166.3        4.4       ?       ? 
1 1 1   48   27   12 o     27.0   12.1    0.0000   0.0000          ?        ?    -5.1082  13.4090          ?        ?       27.0       12.1       ?       ? 
1 1 1   49    0    0 o    258.7    5.4  670.4477  28.0950   670.4477  28.0950   670.4477  28.0950      258.7      5.4      258.7        5.4     0.0     0.0 
1 1 1   49    0    1 o     97.7    8.6   97.6938  16.6016    97.6938  16.6016    97.6938  16.6016       97.7      8.6       97.7        8.6     0.0     0.0 
1 1 1   49    0    2 o    518.3    3.8 2686.8989  38.9498  2686.8989  38.9498  2686.8989  38.9498      518.3      3.8      518.3        3.8     0.0     0.0 
1 1 1   49    0    3 o    171.3    5.4  294.3585  18.5171   294.3585  18.5171   294.3585  18.5171      171.3      5.4      171.3        5.4     0.0     0.0 
1 1 1   49    0    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49    0    5 o    164.0    5.5  270.0946  17.8786   270.0946  17.8786   270.0946  17.8786      164.0      5.5      164.0        5.5     0.0     0.0 
1 1 1   49    0    6 o    324.1    3.5 1051.0066  22.9868  1051.0066  22.9868  1051.0066  22.9868      324.1      3.5      324.1        3.5     0.0     0.0 
1 1 1   49    0    7 o    627.1    4.0 3933.9316  49.8047  3933.9316  49.8047  3933.9316  49.8047      627.1      4.0      627.1        4.0     0.0     0.0 
1 1 1   49    0    8 o    273.1    3.7  746.4318  20.4327   746.4318  20.4327   746.4318  20.4327      273.1      3.7      273.1        3.7     0.0     0.0 
1 1 1   49    0    9 o     67.5   13.3   50.4432  15.9630    50.4432  15.9630    50.4432  15.9630       67.5     13.3       67.5       13.3     0.0     0.0 
1 1 1   49    0   10 o    433.8    3.8 1883.0002  32.5646  1883.0002  32.5646  1883.0002  32.5646      433.8      3.8      433.8        3.8     0.0     0.0 
1 1 1   49    0   11 o    710.2    4.5 5045.5981  63.8522  5045.5981  63.8522  5045.5981  63.8522      710.2      4.5      710.2        4.5     0.0     0.0 
1 1 1   49    0   12 o    503.7    3.8 2538.1235  38.3113  2538.1235  38.3113  2538.1235  38.3113      503.7      3.8      503.7        3.8     0.0     0.0 
1 1 1   49    0   13 o    601.2    3.9 3615.9480  46.6121  3615.9480  46.6121  3615.9480  46.6121      601.2      3.9      601.2        3.9     0.0     0.0 
1 1 1   49    0   14 f    721.6    4.6 5209.0596  65.7677  5209.0596  65.7677  5209.0596  65.7677      721.6      4.6      721.6        4.6     0.0     0.0 
1 1 1   49    0   15 o    148.6    6.3  222.2055  18.5171   222.2055  18.5171   222.2055  18.5171      148.6      6.3      148.6        6.3     0.0     0.0 
1 1 1   49    0   16 o    487.1    3.6 2374.0234  35.1187  2374.0234  35.1187  2374.0234  35.1187      487.1      3.6      487.1        3.6     0.0     0.0 
1 1 1   49    0   17 o     64.6   17.2   49.8047  19.1556    49.8047  19.1556    49.8047  19.1556       64.6     17.2       64.6       17.2     0.0     0.0 
1 1 1   49    0   18 o    297.4    4.1  884.9910  24.2638   884.9910  24.2638   884.9910  24.2638      297.4      4.1      297.4        4.1     0.0     0.0 
1 1 1   49    0   19 o     40.6   18.7   24.2638  16.6016    24.2638  16.6016    24.2638  16.6016       40.6     18.7       40.6       18.7     0.0     0.0 
1 1 1   49    0   20 o    207.4    4.6  431.0021  19.1556   431.0021  19.1556   431.0021  19.1556      207.4      4.6      207.4        4.6     0.0     0.0 
1 1 1   49    0   21 o    321.9    3.9 1036.9591  24.9023  1036.9591  24.9023  1036.9591  24.9023      321.9      3.9      321.9        3.9     0.0     0.0 
1 1 1   49    0   22 o    324.2    3.5 1051.6451  22.9868  1051.6451  22.9868  1051.6451  22.9868      324.2      3.5      324.2        3.5     0.0     0.0 
1 1 1   49    0   23 o     64.6   17.2   49.8047  19.1556    49.8047  19.1556    49.8047  19.1556       64.6     17.2       64.6       17.2     0.0     0.0 
1 1 1   49    0   24 o    149.8    6.6  226.0367  19.7942   226.0367  19.7942   226.0367  19.7942      149.8      6.6      149.8        6.6     0.0     0.0 
1 1 1   49    0   25 o    186.9    5.3  350.5484  19.7942   350.5484  19.7942   350.5484  19.7942      186.9      5.3      186.9        5.3     0.0     0.0 
1 1 1   49    0   26 o    420.1    3.6 1765.5123  30.0105  1765.5123  30.0105  1765.5123  30.0105      420.1      3.6      420.1        3.6     0.0     0.0 
1 1 1   49    0   27 o     31.2   19.0    9.5778  21.7097     9.5778  21.7097     9.5778  21.7097       31.2     19.0       31.2       19.0     0.0     0.0 
1 1 1   49    0   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49    0   29 o    260.3    4.4  678.7485  22.9868   678.7485  22.9868   678.7485  22.9868      260.3      4.4      260.3        4.4     0.0     0.0 
1 1 1   49    0   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49    0   31 o     79.2   13.6   67.6833  19.7942    67.6833  19.7942    67.6833  19.7942       79.2     13.6       79.2       13.6     0.0     0.0 
1 1 1   49    0   32 o     19.7   13.9  -18.5171  19.7942   -18.5171  19.7942   -18.5171  19.7942       19.7     13.9       19.7       13.9     0.0     0.0 
1 1 1   49    0   33 o     38.3   20.0   21.7097  19.7942    21.7097  19.7942    21.7097  19.7942       38.3     20.0       38.3       20.0     0.0     0.0 
1 1 1   49    0   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49    0   35 o    125.4    8.5  159.6304  21.0712   159.6304  21.0712   159.6304  21.0712      125.4      8.5      125.4        8.5     0.0     0.0 
1 1 1   49    0   36 o    404.2    3.6 1635.2539  29.3720  1635.2539  29.3720  1635.2539  29.3720      404.2      3.6      404.2        3.6     0.0     0.0 
1 1 1   49    0   37 o    292.6    4.4  857.5345  25.5409   857.5345  25.5409   857.5345  25.5409      292.6      4.4      292.6        4.4     0.0     0.0 
1 1 1   49    0   38 o    196.6    6.2  388.2211  24.2638   388.2211  24.2638   388.2211  24.2638      196.6      6.2      196.6        6.2     0.0     0.0 
1 1 1   49    0   39 o    307.8    4.4  948.8432  26.8179   948.8432  26.8179   948.8432  26.8179      307.8      4.4      307.8        4.4     0.0     0.0 
1 1 1   49    0   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49    0   41 o    259.5    5.3  674.9174  27.4564   674.9174  27.4564   674.9174  27.4564      259.5      5.3      259.5        5.3     0.0     0.0 
1 1 1   49    0   42 o     89.4   15.6   86.8389  25.5409    86.8389  25.5409    86.8389  25.5409       89.4     15.6       89.4       15.6     0.0     0.0 
1 1 1   49    0   43 o     24.8   16.9  -12.1319  24.9023   -12.1319  24.9023   -12.1319  24.9023       24.8     16.9       24.8       16.9     0.0     0.0 
1 1 1   49    0   44 o     37.7   21.3   19.7942  24.2638    19.7942  24.2638    19.7942  24.2638       37.7     21.3       37.7       21.3     0.0     0.0 
1 1 1   49    0   45 o    215.2    6.1  464.8438  26.1794   464.8438  26.1794   464.8438  26.1794      215.2      6.1      215.2        6.1     0.0     0.0 
1 1 1   49    0   46 o     20.6   14.7  -30.6490  24.9023   -30.6490  24.9023   -30.6490  24.9023       20.6     14.7       20.6       14.7     0.0     0.0 
1 1 1   49    0   47 o    297.4    4.7  886.2681  28.0950   886.2681  28.0950   886.2681  28.0950      297.4      4.7      297.4        4.7     0.0     0.0 
1 1 1   49    0   48 o    104.3   12.6  114.2954  25.5409   114.2954  25.5409   114.2954  25.5409      104.3     12.6      104.3       12.6     0.0     0.0 
1 1 1   49    0   49 o     15.6   11.7  -86.2004  27.4564   -86.2004  27.4564   -86.2004  27.4564       15.6     11.7       15.6       11.7     0.0     0.0 
1 1 1   49    0   50 o    351.5    4.3 1237.4550  30.0105  1237.4550  30.0105  1237.4550  30.0105      351.5      4.3      351.5        4.3     0.0     0.0 
1 1 1   49    0   51 o    322.8    4.7 1043.9829  30.0105  1043.9829  30.0105  1043.9829  30.0105      322.8      4.7      322.8        4.7     0.0     0.0 
1 1 1   49    0   52 o     89.9   16.5   89.3930  26.8179    89.3930  26.8179    89.3930  26.8179       89.9     16.5       89.9       16.5     0.0     0.0 
1 1 1   49    0   53 o     17.7   13.0  -52.3588  25.5409   -52.3588  25.5409   -52.3588  25.5409       17.7     13.0       17.7       13.0     0.0     0.0 
1 1 1   49    0   54 o     17.3   12.7  -59.3825  26.1794   -59.3825  26.1794   -59.3825  26.1794       17.3     12.7       17.3       12.7     0.0     0.0 
1 1 1   49    0   55 o     30.3   19.4    4.4697  25.5409     4.4697  25.5409     4.4697  25.5409       30.3     19.4       30.3       19.4     0.0     0.0 
1 1 1   49    0   56 o    167.8    8.0  285.4192  26.8179   285.4192  26.8179   285.4192  26.8179      167.8      8.0      167.8        8.0     0.0     0.0 
1 1 1   49    1    0 o     93.1    9.4   89.3930  17.2401    89.3930  17.2401    89.3930  17.2401       93.1      9.4       93.1        9.4     0.0     0.0 
1 1 1   49    1    1 o    298.3    2.8    0.0000   0.0000          ?        ?   890.0991  16.6016          ?        ?      298.3        2.8       ?       ? 
1 1 1   49    1    2 o    279.8    3.0    0.0000   0.0000          ?        ?   782.8275  16.6016          ?        ?      279.8        3.0       ?       ? 
1 1 1   49    1    3 o    742.5    3.7    0.0000   0.0000          ?        ?  5514.9111  54.2743          ?        ?      742.5        3.7       ?       ? 
1 1 1   49    1    4 o    525.6    2.8    0.0000   0.0000          ?        ?  2762.8831  29.3720          ?        ?      525.6        2.8       ?       ? 
1 1 1   49    1    5 o    170.0    3.8    0.0000   0.0000          ?        ?   289.2503  12.7704          ?        ?      170.0        3.8       ?       ? 
1 1 1   49    1    6 o    299.3    2.6    0.0000   0.0000          ?        ?   895.8459  15.3245          ?        ?      299.3        2.6       ?       ? 
1 1 1   49    1    7 o    386.6    2.6    0.0000   0.0000          ?        ?  1494.7792  19.7942          ?        ?      386.6        2.6       ?       ? 
1 1 1   49    1    8 o    148.2    4.1    0.0000   0.0000          ?        ?   219.6514  12.1319          ?        ?      148.2        4.1       ?       ? 
1 1 1   49    1    9 o    245.5    3.1    0.0000   0.0000          ?        ?   602.7644  15.3245          ?        ?      245.5        3.1       ?       ? 
1 1 1   49    1   10 o    231.8    3.0    0.0000   0.0000          ?        ?   537.6352  14.0475          ?        ?      231.8        3.0       ?       ? 
1 1 1   49    1   11 o    583.4    2.8    0.0000   0.0000          ?        ?  3403.9587  32.5646          ?        ?      583.4        2.8       ?       ? 
1 1 1   49    1   12 o    115.5    5.5    0.0000   0.0000          ?        ?   133.4510  12.7704          ?        ?      115.5        5.5       ?       ? 
1 1 1   49    1   13 o    234.0    3.1    0.0000   0.0000          ?        ?   547.8516  14.6860          ?        ?      234.0        3.1       ?       ? 
1 1 1   49    1   14 o    364.9    2.4    0.0000   0.0000          ?        ?  1331.9562  17.8786          ?        ?      364.9        2.4       ?       ? 
1 1 1   49    1   15 o    115.2    5.5    0.0000   0.0000          ?        ?   132.8125  12.7704          ?        ?      115.2        5.5       ?       ? 
1 1 1   49    1   16 o    103.2    6.5    0.0000   0.0000          ?        ?   106.6331  13.4090          ?        ?      103.2        6.5       ?       ? 
1 1 1   49    1   17 o    241.7    3.0    0.0000   0.0000          ?        ?   584.2473  14.6860          ?        ?      241.7        3.0       ?       ? 
1 1 1   49    1   18 o    225.4    3.0    0.0000   0.0000          ?        ?   508.2632  13.4090          ?        ?      225.4        3.0       ?       ? 
1 1 1   49    1   19 o    288.5    2.8    0.0000   0.0000          ?        ?   832.6321  15.9630          ?        ?      288.5        2.8       ?       ? 
1 1 1   49    1   20 o    315.3    2.6    0.0000   0.0000          ?        ?   994.1782  16.6016          ?        ?      315.3        2.6       ?       ? 
1 1 1   49    1   21 o    216.7    3.2    0.0000   0.0000          ?        ?   469.9519  14.0475          ?        ?      216.7        3.2       ?       ? 
1 1 1   49    1   22 o     88.9    7.5    0.0000   0.0000          ?        ?    79.1767  13.4090          ?        ?       88.9        7.5       ?       ? 
1 1 1   49    1   23 o    293.8    2.6    0.0000   0.0000          ?        ?   863.2812  15.3245          ?        ?      293.8        2.6       ?       ? 
1 1 1   49    1   24 o    103.8    6.5    0.0000   0.0000          ?        ?   107.9102  13.4090          ?        ?      103.8        6.5       ?       ? 
1 1 1   49    1   25 o    345.1    2.8    0.0000   0.0000          ?        ?  1191.4814  19.1556          ?        ?      345.1        2.8       ?       ? 
1 1 1   49    1   26 f    415.3    2.5    0.0000   0.0000          ?        ?  1725.2855  20.4327          ?        ?      415.3        2.5       ?       ? 
1 1 1   49    1   27 o     80.9    8.7    0.0000   0.0000          ?        ?    65.7677  14.0475          ?        ?       80.9        8.7       ?       ? 
1 1 1   49    1   28 o    212.7    3.8    0.0000   0.0000          ?        ?   452.7119  15.9630          ?        ?      212.7        3.8       ?       ? 
1 1 1   49    1   29 o    107.1    6.6    0.0000   0.0000          ?        ?   114.9339  14.0475          ?        ?      107.1        6.6       ?       ? 
1 1 1   49    1   30 o    200.8    3.8    0.0000   0.0000          ?        ?   403.5457  15.3245          ?        ?      200.8        3.8       ?       ? 
1 1 1   49    1   31 o    182.5    4.0    0.0000   0.0000          ?        ?   333.3083  14.6860          ?        ?      182.5        4.0       ?       ? 
1 1 1   49    1   32 o    380.4    2.6    0.0000   0.0000          ?        ?  1447.5286  19.7942          ?        ?      380.4        2.6       ?       ? 
1 1 1   49    1   33 o    124.7    5.6    0.0000   0.0000          ?        ?   155.7993  14.0475          ?        ?      124.7        5.6       ?       ? 
1 1 1   49    1   34 o     86.2    8.9    0.0000   0.0000          ?        ?    74.7070  15.3245          ?        ?       86.2        8.9       ?       ? 
1 1 1   49    1   35 o    457.5    2.5    0.0000   0.0000          ?        ?  2093.7124  22.9868          ?        ?      457.5        2.5       ?       ? 
1 1 1   49    1   36 o    222.4    3.6    0.0000   0.0000          ?        ?   494.8542  15.9630          ?        ?      222.4        3.6       ?       ? 
1 1 1   49    1   37 o    316.8    2.9    0.0000   0.0000          ?        ?  1004.3945  18.5171          ?        ?      316.8        2.9       ?       ? 
1 1 1   49    1   38 o    249.3    3.5    0.0000   0.0000          ?        ?   621.9200  17.2401          ?        ?      249.3        3.5       ?       ? 
1 1 1   49    1   39 f    374.8    2.9    0.0000   0.0000          ?        ?  1405.3861  21.7097          ?        ?      374.8        2.9       ?       ? 
1 1 1   49    1   40 o    164.2    5.4    0.0000   0.0000          ?        ?   270.0946  17.8786          ?        ?      164.2        5.4       ?       ? 
1 1 1   49    1   41 o    448.2    2.8    0.0000   0.0000          ?        ?  2010.0660  24.9023          ?        ?      448.2        2.8       ?       ? 
1 1 1   49    1   42 o    137.9    6.5    0.0000   0.0000          ?        ?   190.9180  17.8786          ?        ?      137.9        6.5       ?       ? 
1 1 1   49    1   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49    1   44 o    249.4    3.6    0.0000   0.0000          ?        ?   622.5586  17.8786          ?        ?      249.4        3.6       ?       ? 
1 1 1   49    1   45 o     36.3   15.0    0.0000   0.0000          ?        ?     3.8311  17.8786          ?        ?       36.3       15.0       ?       ? 
1 1 1   49    1   46 o     64.0   13.9    0.0000   0.0000          ?        ?    43.4195  17.2401          ?        ?       64.0       13.9       ?       ? 
1 1 1   49    1   47 o    320.3    3.2    0.0000   0.0000          ?        ?  1027.3812  20.4327          ?        ?      320.3        3.2       ?       ? 
1 1 1   49    1   48 o    161.5    5.7    0.0000   0.0000          ?        ?   261.7939  18.5171          ?        ?      161.5        5.7       ?       ? 
1 1 1   49    1   49 o    150.2    5.7    0.0000   0.0000          ?        ?   226.6752  17.2401          ?        ?      150.2        5.7       ?       ? 
1 1 1   49    1   50 o     25.4   12.2    0.0000   0.0000          ?        ?   -22.3483  17.2401          ?        ?       25.4       12.2       ?       ? 
1 1 1   49    1   51 o    216.2    4.1    0.0000   0.0000          ?        ?   468.6749  17.8786          ?        ?      216.2        4.1       ?       ? 
1 1 1   49    1   52 o    123.5    7.2    0.0000   0.0000          ?        ?   153.8837  17.8786          ?        ?      123.5        7.2       ?       ? 
1 1 1   49    1   53 o    233.6    4.1    0.0000   0.0000          ?        ?   547.2130  19.1556          ?        ?      233.6        4.1       ?       ? 
1 1 1   49    1   54 o     61.5   14.7    0.0000   0.0000          ?        ?    40.8654  17.8786          ?        ?       61.5       14.7       ?       ? 
1 1 1   49    1   55 o     26.0   12.4    0.0000   0.0000          ?        ?   -22.3483  17.8786          ?        ?       26.0       12.4       ?       ? 
1 1 1   49    2    0 o    230.3    4.3  531.2500  19.7942   531.2500  19.7942   531.2500  19.7942      230.3      4.3      230.3        4.3     0.0     0.0 
1 1 1   49    2    1 o    424.9    2.5    0.0000   0.0000          ?        ?  1805.7391  21.0712          ?        ?      424.9        2.5       ?       ? 
1 1 1   49    2    2 f    279.2    2.6    0.0000   0.0000          ?        ?   779.6349  14.6860          ?        ?      279.2        2.6       ?       ? 
1 1 1   49    2    3 o    432.8    2.6    0.0000   0.0000          ?        ?  1873.4224  22.3483          ?        ?      432.8        2.6       ?       ? 
1 1 1   49    2    4 o    398.7    2.6    0.0000   0.0000          ?        ?  1589.9188  21.0712          ?        ?      398.7        2.6       ?       ? 
1 1 1   49    2    5 o    207.7    3.2    0.0000   0.0000          ?        ?   431.6406  13.4090          ?        ?      207.7        3.2       ?       ? 
1 1 1   49    2    6 o    280.0    3.0    0.0000   0.0000          ?        ?   784.1046  16.6016          ?        ?      280.0        3.0       ?       ? 
1 1 1   49    2    7 o    243.0    3.0    0.0000   0.0000          ?        ?   590.6325  14.6860          ?        ?      243.0        3.0       ?       ? 
1 1 1   49    2    8 o    350.7    2.5    0.0000   0.0000          ?        ?  1230.4312  17.8786          ?        ?      350.7        2.5       ?       ? 
1 1 1   49    2    9 o    418.5    2.6    0.0000   0.0000          ?        ?  1751.4647  21.7097          ?        ?      418.5        2.6       ?       ? 
1 1 1   49    2   10 o    256.0    3.0    0.0000   0.0000          ?        ?   655.7617  15.3245          ?        ?      256.0        3.0       ?       ? 
1 1 1   49    2   11 o    335.2    2.6    0.0000   0.0000          ?        ?  1123.7981  17.2401          ?        ?      335.2        2.6       ?       ? 
1 1 1   49    2   12 o    564.5    2.7    0.0000   0.0000          ?        ?  3187.5000  30.6490          ?        ?      564.5        2.7       ?       ? 
1 1 1   49    2   13 f    167.6    3.8    0.0000   0.0000          ?        ?   280.9495  12.7704          ?        ?      167.6        3.8       ?       ? 
1 1 1   49    2   14 o    211.4    3.2    0.0000   0.0000          ?        ?   446.9651  13.4090          ?        ?      211.4        3.2       ?       ? 
1 1 1   49    2   15 o    114.6    5.3    0.0000   0.0000          ?        ?   131.5355  12.1319          ?        ?      114.6        5.3       ?       ? 
1 1 1   49    2   16 o    311.3    2.7    0.0000   0.0000          ?        ?   969.2759  16.6016          ?        ?      311.3        2.7       ?       ? 
1 1 1   49    2   17 o    240.3    3.1    0.0000   0.0000          ?        ?   577.8621  14.6860          ?        ?      240.3        3.1       ?       ? 
1 1 1   49    2   18 o    180.9    3.9    0.0000   0.0000          ?        ?   327.5616  14.0475          ?        ?      180.9        3.9       ?       ? 
1 1 1   49    2   19 o     75.7    8.4    0.0000   0.0000          ?        ?    57.4669  12.7704          ?        ?       75.7        8.4       ?       ? 
1 1 1   49    2   20 o    238.1    3.4    0.0000   0.0000          ?        ?   567.0072  15.9630          ?        ?      238.1        3.4       ?       ? 
1 1 1   49    2   21 o    171.5    3.9    0.0000   0.0000          ?        ?   294.3585  13.4090          ?        ?      171.5        3.9       ?       ? 
1 1 1   49    2   22 o    464.3    2.5    0.0000   0.0000          ?        ?  2156.2876  22.9868          ?        ?      464.3        2.5       ?       ? 
1 1 1   49    2   23 o    201.3    3.6    0.0000   0.0000          ?        ?   405.4612  14.6860          ?        ?      201.3        3.6       ?       ? 
1 1 1   49    2   24 o    119.5    5.9    0.0000   0.0000          ?        ?   143.0288  14.0475          ?        ?      119.5        5.9       ?       ? 
1 1 1   49    2   25 o    210.6    3.5    0.0000   0.0000          ?        ?   443.7725  14.6860          ?        ?      210.6        3.5       ?       ? 
1 1 1   49    2   26 f    270.8    3.1    0.0000   0.0000          ?        ?   733.6614  16.6016          ?        ?      270.8        3.1       ?       ? 
1 1 1   49    2   27 o    105.9    6.3    0.0000   0.0000          ?        ?   112.3798  13.4090          ?        ?      105.9        6.3       ?       ? 
1 1 1   49    2   28 o     19.9    9.8    0.0000   0.0000          ?        ?   -30.6490  14.0475          ?        ?       19.9        9.8       ?       ? 
1 1 1   49    2   29 o    228.0    3.4    0.0000   0.0000          ?        ?   520.3951  15.3245          ?        ?      228.0        3.4       ?       ? 
1 1 1   49    2   30 o     23.8   11.2    0.0000   0.0000          ?        ?   -15.9630  14.0475          ?        ?       23.8       11.2       ?       ? 
1 1 1   49    2   31 o     54.0   14.1    0.0000   0.0000          ?        ?    30.6490  15.3245          ?        ?       54.0       14.1       ?       ? 
1 1 1   49    2   32 o    185.1    4.1    0.0000   0.0000          ?        ?   342.8861  15.3245          ?        ?      185.1        4.1       ?       ? 
1 1 1   49    2   33 o    133.6    5.7    0.0000   0.0000          ?        ?   178.7861  15.3245          ?        ?      133.6        5.7       ?       ? 
1 1 1   49    2   34 o     17.4    8.8    0.0000   0.0000          ?        ?   -54.2743  15.3245          ?        ?       17.4        8.8       ?       ? 
1 1 1   49    2   35 o    307.4    2.9    0.0000   0.0000          ?        ?   945.6506  17.8786          ?        ?      307.4        2.9       ?       ? 
1 1 1   49    2   36 o    277.1    3.2    0.0000   0.0000          ?        ?   768.1415  17.8786          ?        ?      277.1        3.2       ?       ? 
1 1 1   49    2   37 o    240.4    3.5    0.0000   0.0000          ?        ?   578.5006  16.6016          ?        ?      240.4        3.5       ?       ? 
1 1 1   49    2   38 o    132.5    6.5    0.0000   0.0000          ?        ?   176.2320  17.2401          ?        ?      132.5        6.5       ?       ? 
1 1 1   49    2   39 o    141.8    6.3    0.0000   0.0000          ?        ?   201.7728  17.8786          ?        ?      141.8        6.3       ?       ? 
1 1 1   49    2   40 o    302.3    3.1    0.0000   0.0000          ?        ?   914.3630  18.5171          ?        ?      302.3        3.1       ?       ? 
1 1 1   49    2   41 o    263.9    3.5    0.0000   0.0000          ?        ?   697.2656  18.5171          ?        ?      263.9        3.5       ?       ? 
1 1 1   49    2   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49    2   43 o    150.5    5.7    0.0000   0.0000          ?        ?   227.3137  17.2401          ?        ?      150.5        5.7       ?       ? 
1 1 1   49    2   44 f    246.0    3.6    0.0000   0.0000          ?        ?   605.9570  17.8786          ?        ?      246.0        3.6       ?       ? 
1 1 1   49    2   45 o    287.6    3.3    0.0000   0.0000          ?        ?   828.1625  19.1556          ?        ?      287.6        3.3       ?       ? 
1 1 1   49    2   46 o     31.9   13.9    0.0000   0.0000          ?        ?    -2.5541  16.6016          ?        ?       31.9       13.9       ?       ? 
1 1 1   49    2   47 o     89.9    9.6    0.0000   0.0000          ?        ?    81.7308  17.2401          ?        ?       89.9        9.6       ?       ? 
1 1 1   49    2   48 o    321.4    3.3    0.0000   0.0000          ?        ?  1034.4050  21.0712          ?        ?      321.4        3.3       ?       ? 
1 1 1   49    2   49 o     91.3    9.4    0.0000   0.0000          ?        ?    84.2849  17.2401          ?        ?       91.3        9.4       ?       ? 
1 1 1   49    2   50 o    271.4    3.6    0.0000   0.0000          ?        ?   738.1310  19.7942          ?        ?      271.4        3.6       ?       ? 
1 1 1   49    2   51 o    166.7    5.4    0.0000   0.0000          ?        ?   279.0340  17.8786          ?        ?      166.7        5.4       ?       ? 
1 1 1   49    2   52 o    270.1    3.7    0.0000   0.0000          ?        ?   731.1072  19.7942          ?        ?      270.1        3.7       ?       ? 
1 1 1   49    2   53 o    135.3    6.6    0.0000   0.0000          ?        ?   184.5327  17.8786          ?        ?      135.3        6.6       ?       ? 
1 1 1   49    2   54 o    157.7    5.9    0.0000   0.0000          ?        ?   250.3005  18.5171          ?        ?      157.7        5.9       ?       ? 
1 1 1   49    3    0 o    437.6    3.7 1916.2035  32.5646  1916.2035  32.5646  1916.2035  32.5646      437.6      3.7      437.6        3.7     0.0     0.0 
1 1 1   49    3    1 o    275.2    2.8    0.0000   0.0000          ?        ?   757.2866  15.3245          ?        ?      275.2        2.8       ?       ? 
1 1 1   49    3    2 o    277.3    2.6    0.0000   0.0000          ?        ?   769.4186  14.6860          ?        ?      277.3        2.6       ?       ? 
1 1 1   49    3    3 o    620.9    3.2    0.0000   0.0000          ?        ?  3856.6707  40.2269          ?        ?      620.9        3.2       ?       ? 
1 1 1   49    3    4 o    246.1    2.9    0.0000   0.0000          ?        ?   605.9570  14.0475          ?        ?      246.1        2.9       ?       ? 
1 1 1   49    3    5 o    254.2    2.8    0.0000   0.0000          ?        ?   646.1838  14.0475          ?        ?      254.2        2.8       ?       ? 
1 1 1   49    3    6 o    348.6    2.6    0.0000   0.0000          ?        ?  1215.7451  17.8786          ?        ?      348.6        2.6       ?       ? 
1 1 1   49    3    7 o    515.2    2.8    0.0000   0.0000          ?        ?  2654.9729  28.7335          ?        ?      515.2        2.8       ?       ? 
1 1 1   49    3    8 o    306.8    2.9    0.0000   0.0000          ?        ?   941.8194  17.8786          ?        ?      306.8        2.9       ?       ? 
1 1 1   49    3    9 o    161.4    4.0    0.0000   0.0000          ?        ?   260.5168  12.7704          ?        ?      161.4        4.0       ?       ? 
1 1 1   49    3   10 o    228.6    3.1    0.0000   0.0000          ?        ?   522.9492  14.0475          ?        ?      228.6        3.1       ?       ? 
1 1 1   49    3   11 o    524.0    2.6    0.0000   0.0000          ?        ?  2746.2815  27.4564          ?        ?      524.0        2.6       ?       ? 
1 1 1   49    3   12 f    235.0    3.3    0.0000   0.0000          ?        ?   552.3212  15.3245          ?        ?      235.0        3.3       ?       ? 
1 1 1   49    3   13 o    553.7    2.9    0.0000   0.0000          ?        ?  3066.8193  31.9261          ?        ?      553.7        2.9       ?       ? 
1 1 1   49    3   14 o    227.2    3.0    0.0000   0.0000          ?        ?   516.5640  13.4090          ?        ?      227.2        3.0       ?       ? 
1 1 1   49    3   15 o    202.9    3.3    0.0000   0.0000          ?        ?   411.8464  13.4090          ?        ?      202.9        3.3       ?       ? 
1 1 1   49    3   16 o    205.7    3.4    0.0000   0.0000          ?        ?   423.3398  14.0475          ?        ?      205.7        3.4       ?       ? 
1 1 1   49    3   17 o    349.2    2.5    0.0000   0.0000          ?        ?  1219.5763  17.2401          ?        ?      349.2        2.5       ?       ? 
1 1 1   49    3   18 o    129.8    5.2    0.0000   0.0000          ?        ?   168.5697  13.4090          ?        ?      129.8        5.2       ?       ? 
1 1 1   49    3   19 f    328.9    2.6    0.0000   0.0000          ?        ?  1082.2942  17.2401          ?        ?      328.9        2.6       ?       ? 
1 1 1   49    3   20 f    282.5    2.8    0.0000   0.0000          ?        ?   798.1520  15.9630          ?        ?      282.5        2.8       ?       ? 
1 1 1   49    3   21 o     20.9   10.1    0.0000   0.0000          ?        ?   -20.4327  12.7704          ?        ?       20.9       10.1       ?       ? 
1 1 1   49    3   22 o    185.5    3.8    0.0000   0.0000          ?        ?   344.1632  14.0475          ?        ?      185.5        3.8       ?       ? 
1 1 1   49    3   23 o    280.8    2.8    0.0000   0.0000          ?        ?   788.5742  15.9630          ?        ?      280.8        2.8       ?       ? 
1 1 1   49    3   24 o    202.4    3.5    0.0000   0.0000          ?        ?   409.9309  14.0475          ?        ?      202.4        3.5       ?       ? 
1 1 1   49    3   25 o    116.8    5.7    0.0000   0.0000          ?        ?   136.6436  13.4090          ?        ?      116.8        5.7       ?       ? 
1 1 1   49    3   26 o    214.2    3.4    0.0000   0.0000          ?        ?   459.0970  14.6860          ?        ?      214.2        3.4       ?       ? 
1 1 1   49    3   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49    3   28 o    158.5    4.6    0.0000   0.0000          ?        ?   251.5775  14.6860          ?        ?      158.5        4.6       ?       ? 
1 1 1   49    3   29 f     56.8   13.2    0.0000   0.0000          ?        ?    33.8416  14.6860          ?        ?       56.8       13.2       ?       ? 
1 1 1   49    3   30 o    445.0    2.4    0.0000   0.0000          ?        ?  1981.3325  21.7097          ?        ?      445.0        2.4       ?       ? 
1 1 1   49    3   31 o    240.0    3.3    0.0000   0.0000          ?        ?   576.5850  15.9630          ?        ?      240.0        3.3       ?       ? 
1 1 1   49    3   32 f    127.2    6.0    0.0000   0.0000          ?        ?   162.1845  15.3245          ?        ?      127.2        6.0       ?       ? 
1 1 1   49    3   33 o     18.9    9.4    0.0000   0.0000          ?        ?   -39.5883  14.6860          ?        ?       18.9        9.4       ?       ? 
1 1 1   49    3   34 o    199.7    3.8    0.0000   0.0000          ?        ?   399.0760  15.3245          ?        ?      199.7        3.8       ?       ? 
1 1 1   49    3   35 o    224.5    3.6    0.0000   0.0000          ?        ?   504.4321  15.9630          ?        ?      224.5        3.6       ?       ? 
1 1 1   49    3   36 o    167.7    4.8    0.0000   0.0000          ?        ?   281.5880  15.9630          ?        ?      167.7        4.8       ?       ? 
1 1 1   49    3   37 o    418.5    2.7    0.0000   0.0000          ?        ?  1752.7418  22.9868          ?        ?      418.5        2.7       ?       ? 
1 1 1   49    3   38 o     83.5    9.2    0.0000   0.0000          ?        ?    70.2374  15.3245          ?        ?       83.5        9.2       ?       ? 
1 1 1   49    3   39 o    341.2    3.0    0.0000   0.0000          ?        ?  1165.3020  20.4327          ?        ?      341.2        3.0       ?       ? 
1 1 1   49    3   40 o    256.6    3.6    0.0000   0.0000          ?        ?   658.9543  18.5171          ?        ?      256.6        3.6       ?       ? 
1 1 1   49    3   41 o    337.8    2.9    0.0000   0.0000          ?        ?  1141.6766  19.7942          ?        ?      337.8        2.9       ?       ? 
1 1 1   49    3   42 o    157.4    5.7    0.0000   0.0000          ?        ?   248.3849  17.8786          ?        ?      157.4        5.7       ?       ? 
1 1 1   49    3   43 o    353.8    2.9    0.0000   0.0000          ?        ?  1252.7794  20.4327          ?        ?      353.8        2.9       ?       ? 
1 1 1   49    3   44 o     66.4   13.9    0.0000   0.0000          ?        ?    46.6121  17.8786          ?        ?       66.4       13.9       ?       ? 
1 1 1   49    3   45 o    296.7    3.6    0.0000   0.0000          ?        ?   881.7984  21.0712          ?        ?      296.7        3.6       ?       ? 
1 1 1   49    3   46 o    156.1    5.9    0.0000   0.0000          ?        ?   244.5538  18.5171          ?        ?      156.1        5.9       ?       ? 
1 1 1   49    3   47 f    299.8    3.3    0.0000   0.0000          ?        ?   900.3155  19.7942          ?        ?      299.8        3.3       ?       ? 
1 1 1   49    3   48 o    202.2    4.6    0.0000   0.0000          ?        ?   409.9309  18.5171          ?        ?      202.2        4.6       ?       ? 
1 1 1   49    3   49 o     32.5   14.3    0.0000   0.0000          ?        ?    -3.8311  17.8786          ?        ?       32.5       14.3       ?       ? 
1 1 1   49    3   50 o     28.4   13.2    0.0000   0.0000          ?        ?   -14.6860  17.8786          ?        ?       28.4       13.2       ?       ? 
1 1 1   49    3   51 o    152.0    6.1    0.0000   0.0000          ?        ?   232.4219  18.5171          ?        ?      152.0        6.1       ?       ? 
1 1 1   49    3   52 o    152.8    6.1    0.0000   0.0000          ?        ?   234.9760  18.5171          ?        ?      152.8        6.1       ?       ? 
1 1 1   49    3   53 o    273.5    3.6    0.0000   0.0000          ?        ?   750.2629  19.7942          ?        ?      273.5        3.6       ?       ? 
1 1 1   49    4    0 o    232.9    4.4  543.3819  20.4327   543.3819  20.4327   543.3819  20.4327      232.9      4.4      232.9        4.4     0.0     0.0 
1 1 1   49    4    1 o    294.1    2.8    0.0000   0.0000          ?        ?   865.1968  16.6016          ?        ?      294.1        2.8       ?       ? 
1 1 1   49    4    2 o    338.6    2.7    0.0000   0.0000          ?        ?  1146.7849  18.5171          ?        ?      338.6        2.7       ?       ? 
1 1 1   49    4    3 o    284.7    2.8    0.0000   0.0000          ?        ?   810.9225  15.9630          ?        ?      284.7        2.8       ?       ? 
1 1 1   49    4    4 o    529.2    2.7    0.0000   0.0000          ?        ?  2801.8328  28.7335          ?        ?      529.2        2.7       ?       ? 
1 1 1   49    4    5 o    256.4    3.0    0.0000   0.0000          ?        ?   657.6772  15.3245          ?        ?      256.4        3.0       ?       ? 
1 1 1   49    4    6 o    500.2    2.7    0.0000   0.0000          ?        ?  2503.0049  27.4564          ?        ?      500.2        2.7       ?       ? 
1 1 1   49    4    7 o    242.9    3.0    0.0000   0.0000          ?        ?   589.9940  14.6860          ?        ?      242.9        3.0       ?       ? 
1 1 1   49    4    8 o    277.6    2.8    0.0000   0.0000          ?        ?   770.6956  15.3245          ?        ?      277.6        2.8       ?       ? 
1 1 1   49    4    9 o    255.0    3.0    0.0000   0.0000          ?        ?   650.6536  15.3245          ?        ?      255.0        3.0       ?       ? 
1 1 1   49    4   10 o     72.7    8.3    0.0000   0.0000          ?        ?    52.9973  12.1319          ?        ?       72.7        8.3       ?       ? 
1 1 1   49    4   11 o     18.9    9.2    0.0000   0.0000          ?        ?   -21.7097  11.4934          ?        ?       18.9        9.2       ?       ? 
1 1 1   49    4   12 o     16.3    8.2    0.0000   0.0000          ?        ?   -42.7809  12.7704          ?        ?       16.3        8.2       ?       ? 
1 1 1   49    4   13 o    203.2    3.3    0.0000   0.0000          ?        ?   413.1235  13.4090          ?        ?      203.2        3.3       ?       ? 
1 1 1   49    4   14 o    366.6    2.6    0.0000   0.0000          ?        ?  1344.0880  19.1556          ?        ?      366.6        2.6       ?       ? 
1 1 1   49    4   15 o    134.6    5.0    0.0000   0.0000          ?        ?   181.3401  13.4090          ?        ?      134.6        5.0       ?       ? 
1 1 1   49    4   16 o    210.2    3.3    0.0000   0.0000          ?        ?   441.8569  14.0475          ?        ?      210.2        3.3       ?       ? 
1 1 1   49    4   17 o    224.7    3.1    0.0000   0.0000          ?        ?   505.0706  14.0475          ?        ?      224.7        3.1       ?       ? 
1 1 1   49    4   18 o    195.0    3.8    0.0000   0.0000          ?        ?   380.5589  14.6860          ?        ?      195.0        3.8       ?       ? 
1 1 1   49    4   19 o     31.3   12.6    0.0000   0.0000          ?        ?     4.4697  12.1319          ?        ?       31.3       12.6       ?       ? 
1 1 1   49    4   20 o    166.2    4.4    0.0000   0.0000          ?        ?   276.4799  14.6860          ?        ?      166.2        4.4       ?       ? 
1 1 1   49    4   21 o     34.2   13.2    0.0000   0.0000          ?        ?     7.6623  12.7704          ?        ?       34.2       13.2       ?       ? 
1 1 1   49    4   22 o    131.4    5.3    0.0000   0.0000          ?        ?   173.0394  14.0475          ?        ?      131.4        5.3       ?       ? 
1 1 1   49    4   23 o     59.6   11.7    0.0000   0.0000          ?        ?    37.0343  13.4090          ?        ?       59.6       11.7       ?       ? 
1 1 1   49    4   24 o     97.4    7.2    0.0000   0.0000          ?        ?    95.1397  14.0475          ?        ?       97.4        7.2       ?       ? 
1 1 1   49    4   25 o    252.2    3.0    0.0000   0.0000          ?        ?   636.6060  15.3245          ?        ?      252.2        3.0       ?       ? 
1 1 1   49    4   26 o    238.7    3.2    0.0000   0.0000          ?        ?   570.1998  15.3245          ?        ?      238.7        3.2       ?       ? 
1 1 1   49    4   27 o    185.3    3.8    0.0000   0.0000          ?        ?   343.5246  14.0475          ?        ?      185.3        3.8       ?       ? 
1 1 1   49    4   28 o    323.3    2.7    0.0000   0.0000          ?        ?  1045.8984  17.2401          ?        ?      323.3        2.7       ?       ? 
1 1 1   49    4   29 o     34.0   13.6    0.0000   0.0000          ?        ?     5.7467  14.0475          ?        ?       34.0       13.6       ?       ? 
1 1 1   49    4   30 o    320.9    2.8    0.0000   0.0000          ?        ?  1030.5739  17.8786          ?        ?      320.9        2.8       ?       ? 
1 1 1   49    4   31 o    280.5    3.0    0.0000   0.0000          ?        ?   787.2972  16.6016          ?        ?      280.5        3.0       ?       ? 
1 1 1   49    4   32 o    294.2    2.8    0.0000   0.0000          ?        ?   865.8354  16.6016          ?        ?      294.2        2.8       ?       ? 
1 1 1   49    4   33 o    224.2    3.6    0.0000   0.0000          ?        ?   503.1551  15.9630          ?        ?      224.2        3.6       ?       ? 
1 1 1   49    4   34 o    271.8    3.2    0.0000   0.0000          ?        ?   739.4081  17.2401          ?        ?      271.8        3.2       ?       ? 
1 1 1   49    4   35 o     73.4   10.4    0.0000   0.0000          ?        ?    54.2743  15.3245          ?        ?       73.4       10.4       ?       ? 
1 1 1   49    4   36 o    176.6    4.7    0.0000   0.0000          ?        ?   312.2371  16.6016          ?        ?      176.6        4.7       ?       ? 
1 1 1   49    4   37 o    159.8    5.2    0.0000   0.0000          ?        ?   256.0471  16.6016          ?        ?      159.8        5.2       ?       ? 
1 1 1   49    4   38 o    104.2    8.0    0.0000   0.0000          ?        ?   109.1872  16.6016          ?        ?      104.2        8.0       ?       ? 
1 1 1   49    4   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49    4   40 o    294.1    3.1    0.0000   0.0000          ?        ?   865.8354  18.5171          ?        ?      294.1        3.1       ?       ? 
1 1 1   49    4   41 o    279.0    3.3    0.0000   0.0000          ?        ?   778.9964  18.5171          ?        ?      279.0        3.3       ?       ? 
1 1 1   49    4   42 o    298.9    3.2    0.0000   0.0000          ?        ?   894.5688  19.1556          ?        ?      298.9        3.2       ?       ? 
1 1 1   49    4   43 o    192.2    4.7    0.0000   0.0000          ?        ?   370.3425  17.8786          ?        ?      192.2        4.7       ?       ? 
1 1 1   49    4   44 o    128.0    6.7    0.0000   0.0000          ?        ?   164.7386  17.2401          ?        ?      128.0        6.7       ?       ? 
1 1 1   49    4   45 o    137.4    6.3    0.0000   0.0000          ?        ?   189.6409  17.2401          ?        ?      137.4        6.3       ?       ? 
1 1 1   49    4   46 o     86.6   10.3    0.0000   0.0000          ?        ?    75.9841  17.8786          ?        ?       86.6       10.3       ?       ? 
1 1 1   49    4   47 o    105.2    8.5    0.0000   0.0000          ?        ?   111.7413  17.8786          ?        ?      105.2        8.5       ?       ? 
1 1 1   49    4   48 o    142.3    6.1    0.0000   0.0000          ?        ?   203.6884  17.2401          ?        ?      142.3        6.1       ?       ? 
1 1 1   49    4   49 o    161.0    5.4    0.0000   0.0000          ?        ?   260.5168  17.2401          ?        ?      161.0        5.4       ?       ? 
1 1 1   49    4   50 o     43.6   15.6    0.0000   0.0000          ?        ?    17.2401  17.2401          ?        ?       43.6       15.6       ?       ? 
1 1 1   49    4   51 o    143.3    6.5    0.0000   0.0000          ?        ?   206.8810  18.5171          ?        ?      143.3        6.5       ?       ? 
1 1 1   49    4   52 o     78.6   11.0    0.0000   0.0000          ?        ?    63.2136  17.2401          ?        ?       78.6       11.0       ?       ? 
1 1 1   49    4   53 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49    5    0 o    199.3    5.3  398.4375  21.0712   398.4375  21.0712   398.4375  21.0712      199.3      5.3      199.3        5.3     0.0     0.0 
1 1 1   49    5    1 o    324.5    3.0    0.0000   0.0000          ?        ?  1053.5607  19.1556          ?        ?      324.5        3.0       ?       ? 
1 1 1   49    5    2 o    162.9    3.9    0.0000   0.0000          ?        ?   265.6250  12.7704          ?        ?      162.9        3.9       ?       ? 
1 1 1   49    5    3 o    614.9    3.0    0.0000   0.0000          ?        ?  3781.9636  36.3957          ?        ?      614.9        3.0       ?       ? 
1 1 1   49    5    4 o    376.4    2.9    0.0000   0.0000          ?        ?  1416.8794  21.7097          ?        ?      376.4        2.9       ?       ? 
1 1 1   49    5    5 o    497.8    3.1    0.0000   0.0000          ?        ?  2478.7410  30.6490          ?        ?      497.8        3.1       ?       ? 
1 1 1   49    5    6 o    502.6    2.8    0.0000   0.0000          ?        ?  2527.2686  28.0950          ?        ?      502.6        2.8       ?       ? 
1 1 1   49    5    7 o    297.4    2.8    0.0000   0.0000          ?        ?   884.9910  16.6016          ?        ?      297.4        2.8       ?       ? 
1 1 1   49    5    8 o    112.6    5.7    0.0000   0.0000          ?        ?   127.0658  12.7704          ?        ?      112.6        5.7       ?       ? 
1 1 1   49    5    9 o     85.2    6.7    0.0000   0.0000          ?        ?    72.7915  11.4934          ?        ?       85.2        6.7       ?       ? 
1 1 1   49    5   10 o    225.8    3.1    0.0000   0.0000          ?        ?   510.1788  14.0475          ?        ?      225.8        3.1       ?       ? 
1 1 1   49    5   11 o    204.8    3.7    0.0000   0.0000          ?        ?   419.5087  15.3245          ?        ?      204.8        3.7       ?       ? 
1 1 1   49    5   12 o    553.6    3.0    0.0000   0.0000          ?        ?  3066.1809  33.2031          ?        ?      553.6        3.0       ?       ? 
1 1 1   49    5   13 o    209.7    3.3    0.0000   0.0000          ?        ?   439.9414  14.0475          ?        ?      209.7        3.3       ?       ? 
1 1 1   49    5   14 f     83.3    7.3    0.0000   0.0000          ?        ?    69.5989  12.1319          ?        ?       83.3        7.3       ?       ? 
1 1 1   49    5   15 o    241.8    3.0    0.0000   0.0000          ?        ?   584.8858  14.6860          ?        ?      241.8        3.0       ?       ? 
1 1 1   49    5   16 o    429.9    2.6    0.0000   0.0000          ?        ?  1849.1587  22.3483          ?        ?      429.9        2.6       ?       ? 
1 1 1   49    5   17 o    186.5    3.8    0.0000   0.0000          ?        ?   347.9943  14.0475          ?        ?      186.5        3.8       ?       ? 
1 1 1   49    5   18 o    292.7    2.8    0.0000   0.0000          ?        ?   856.8960  16.6016          ?        ?      292.7        2.8       ?       ? 
1 1 1   49    5   19 o    495.4    2.6    0.0000   0.0000          ?        ?  2455.1157  25.5409          ?        ?      495.4        2.6       ?       ? 
1 1 1   49    5   20 o    273.5    2.8    0.0000   0.0000          ?        ?   748.3474  15.3245          ?        ?      273.5        2.8       ?       ? 
1 1 1   49    5   21 o    173.0    4.1    0.0000   0.0000          ?        ?   299.4666  14.0475          ?        ?      173.0        4.1       ?       ? 
1 1 1   49    5   22 o    195.3    3.8    0.0000   0.0000          ?        ?   381.8359  14.6860          ?        ?      195.3        3.8       ?       ? 
1 1 1   49    5   23 o     92.7    7.2    0.0000   0.0000          ?        ?    86.2004  13.4090          ?        ?       92.7        7.2       ?       ? 
1 1 1   49    5   24 o    184.1    3.8    0.0000   0.0000          ?        ?   339.0550  14.0475          ?        ?      184.1        3.8       ?       ? 
1 1 1   49    5   25 o    138.8    5.1    0.0000   0.0000          ?        ?   192.8335  14.0475          ?        ?      138.8        5.1       ?       ? 
1 1 1   49    5   26 o     60.6   12.0    0.0000   0.0000          ?        ?    38.3113  14.0475          ?        ?       60.6       12.0       ?       ? 
1 1 1   49    5   27 o     16.2    8.2    0.0000   0.0000          ?        ?   -47.8891  13.4090          ?        ?       16.2        8.2       ?       ? 
1 1 1   49    5   28 o    123.2    5.7    0.0000   0.0000          ?        ?   151.9681  14.0475          ?        ?      123.2        5.7       ?       ? 
1 1 1   49    5   29 o    196.9    3.7    0.0000   0.0000          ?        ?   388.2211  14.6860          ?        ?      196.9        3.7       ?       ? 
1 1 1   49    5   30 o     95.4    7.4    0.0000   0.0000          ?        ?    91.3086  14.0475          ?        ?       95.4        7.4       ?       ? 
1 1 1   49    5   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49    5   32 o     51.8   13.9    0.0000   0.0000          ?        ?    28.0950  14.6860          ?        ?       51.8       13.9       ?       ? 
1 1 1   49    5   33 o     68.4   11.2    0.0000   0.0000          ?        ?    47.2506  15.3245          ?        ?       68.4       11.2       ?       ? 
1 1 1   49    5   34 o     41.5   15.0    0.0000   0.0000          ?        ?    14.6860  15.9630          ?        ?       41.5       15.0       ?       ? 
1 1 1   49    5   35 o    526.4    2.7    0.0000   0.0000          ?        ?  2772.4609  28.7335          ?        ?      526.4        2.7       ?       ? 
1 1 1   49    5   36 o    201.8    4.3    0.0000   0.0000          ?        ?   408.0153  17.2401          ?        ?      201.8        4.3       ?       ? 
1 1 1   49    5   37 o     44.3   15.1    0.0000   0.0000          ?        ?    18.5171  15.9630          ?        ?       44.3       15.1       ?       ? 
1 1 1   49    5   38 o    255.8    3.5    0.0000   0.0000          ?        ?   655.1232  17.8786          ?        ?      255.8        3.5       ?       ? 
1 1 1   49    5   39 o    215.6    4.0    0.0000   0.0000          ?        ?   465.4823  17.2401          ?        ?      215.6        4.0       ?       ? 
1 1 1   49    5   40 o     25.6   12.1    0.0000   0.0000          ?        ?   -19.7942  16.6016          ?        ?       25.6       12.1       ?       ? 
1 1 1   49    5   41 f    267.6    3.3    0.0000   0.0000          ?        ?   717.0598  17.8786          ?        ?      267.6        3.3       ?       ? 
1 1 1   49    5   42 o     75.3   11.0    0.0000   0.0000          ?        ?    57.4669  16.6016          ?        ?       75.3       11.0       ?       ? 
1 1 1   49    5   43 o     61.1   13.9    0.0000   0.0000          ?        ?    39.5883  16.6016          ?        ?       61.1       13.9       ?       ? 
1 1 1   49    5   44 o    111.2    7.8    0.0000   0.0000          ?        ?   124.5117  17.2401          ?        ?      111.2        7.8       ?       ? 
1 1 1   49    5   45 o     63.5   13.5    0.0000   0.0000          ?        ?    42.7809  16.6016          ?        ?       63.5       13.5       ?       ? 
1 1 1   49    5   46 o     19.1    9.7    0.0000   0.0000          ?        ?   -60.0210  17.8786          ?        ?       19.1        9.7       ?       ? 
1 1 1   49    5   47 o    149.9    6.2    0.0000   0.0000          ?        ?   226.0367  18.5171          ?        ?      149.9        6.2       ?       ? 
1 1 1   49    5   48 o     53.3   15.7    0.0000   0.0000          ?        ?    30.0105  17.8786          ?        ?       53.3       15.7       ?       ? 
1 1 1   49    5   49 o    197.3    4.7    0.0000   0.0000          ?        ?   390.7752  18.5171          ?        ?      197.3        4.7       ?       ? 
1 1 1   49    5   50 o    165.6    5.6    0.0000   0.0000          ?        ?   275.8413  18.5171          ?        ?      165.6        5.6       ?       ? 
1 1 1   49    5   51 o    124.2    7.2    0.0000   0.0000          ?        ?   155.7993  17.8786          ?        ?      124.2        7.2       ?       ? 
1 1 1   49    5   52 o    178.5    5.2    0.0000   0.0000          ?        ?   320.5379  18.5171          ?        ?      178.5        5.2       ?       ? 
1 1 1   49    6    0 o    210.6    4.9  444.4110  20.4327   444.4110  20.4327   444.4110  20.4327      210.6      4.9      210.6        4.9     0.0     0.0 
1 1 1   49    6    1 o    254.8    3.0    0.0000   0.0000          ?        ?   649.3765  15.3245          ?        ?      254.8        3.0       ?       ? 
1 1 1   49    6    2 o    203.5    3.3    0.0000   0.0000          ?        ?   414.4005  13.4090          ?        ?      203.5        3.3       ?       ? 
1 1 1   49    6    3 o    590.2    3.3    0.0000   0.0000          ?        ?  3485.0510  38.9498          ?        ?      590.2        3.3       ?       ? 
1 1 1   49    6    4 o    192.9    3.3    0.0000   0.0000          ?        ?   372.2581  12.7704          ?        ?      192.9        3.3       ?       ? 
1 1 1   49    6    5 o    402.1    2.9    0.0000   0.0000          ?        ?  1617.3752  22.9868          ?        ?      402.1        2.9       ?       ? 
1 1 1   49    6    6 o     74.4    8.2    0.0000   0.0000          ?        ?    55.5514  12.1319          ?        ?       74.4        8.2       ?       ? 
1 1 1   49    6    7 o    159.2    3.8    0.0000   0.0000          ?        ?   253.4931  12.1319          ?        ?      159.2        3.8       ?       ? 
1 1 1   49    6    8 o     22.1   10.4    0.0000   0.0000          ?        ?   -14.0475  12.1319          ?        ?       22.1       10.4       ?       ? 
1 1 1   49    6    9 o    247.5    3.1    0.0000   0.0000          ?        ?   612.9808  15.3245          ?        ?      247.5        3.1       ?       ? 
1 1 1   49    6   10 o     47.7   13.0    0.0000   0.0000          ?        ?    23.6253  12.7704          ?        ?       47.7       13.0       ?       ? 
1 1 1   49    6   11 o    245.2    3.0    0.0000   0.0000          ?        ?   601.4874  14.6860          ?        ?      245.2        3.0       ?       ? 
1 1 1   49    6   12 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49    6   13 o    155.3    4.1    0.0000   0.0000          ?        ?   241.3612  12.7704          ?        ?      155.3        4.1       ?       ? 
1 1 1   49    6   14 o    202.1    3.6    0.0000   0.0000          ?        ?   408.6538  14.6860          ?        ?      202.1        3.6       ?       ? 
1 1 1   49    6   15 o     77.3    8.7    0.0000   0.0000          ?        ?    60.0210  13.4090          ?        ?       77.3        8.7       ?       ? 
1 1 1   49    6   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49    6   17 o    245.7    3.0    0.0000   0.0000          ?        ?   604.0414  14.6860          ?        ?      245.7        3.0       ?       ? 
1 1 1   49    6   18 o     20.3    9.9    0.0000   0.0000          ?        ?   -25.5409  13.4090          ?        ?       20.3        9.9       ?       ? 
1 1 1   49    6   19 o     90.6    7.4    0.0000   0.0000          ?        ?    82.3693  13.4090          ?        ?       90.6        7.4       ?       ? 
1 1 1   49    6   20 o    199.7    3.4    0.0000   0.0000          ?        ?   399.0760  13.4090          ?        ?      199.7        3.4       ?       ? 
1 1 1   49    6   21 o    301.0    2.8    0.0000   0.0000          ?        ?   906.7007  16.6016          ?        ?      301.0        2.8       ?       ? 
1 1 1   49    6   22 o    128.7    5.2    0.0000   0.0000          ?        ?   166.0156  13.4090          ?        ?      128.7        5.2       ?       ? 
1 1 1   49    6   23 f    242.3    3.2    0.0000   0.0000          ?        ?   587.4399  15.3245          ?        ?      242.3        3.2       ?       ? 
1 1 1   49    6   24 o    232.1    3.3    0.0000   0.0000          ?        ?   538.9123  15.3245          ?        ?      232.1        3.3       ?       ? 
1 1 1   49    6   25 o    181.6    3.9    0.0000   0.0000          ?        ?   330.1157  14.0475          ?        ?      181.6        3.9       ?       ? 
1 1 1   49    6   26 o    232.1    3.3    0.0000   0.0000          ?        ?   538.9123  15.3245          ?        ?      232.1        3.3       ?       ? 
1 1 1   49    6   27 o     68.0   10.8    0.0000   0.0000          ?        ?    46.6121  14.6860          ?        ?       68.0       10.8       ?       ? 
1 1 1   49    6   28 o     23.6   11.2    0.0000   0.0000          ?        ?   -16.6016  14.0475          ?        ?       23.6       11.2       ?       ? 
1 1 1   49    6   29 o    202.7    3.8    0.0000   0.0000          ?        ?   411.2079  15.3245          ?        ?      202.7        3.8       ?       ? 
1 1 1   49    6   30 o    132.9    5.5    0.0000   0.0000          ?        ?   176.8705  14.6860          ?        ?      132.9        5.5       ?       ? 
1 1 1   49    6   31 f    283.6    3.0    0.0000   0.0000          ?        ?   804.5372  17.2401          ?        ?      283.6        3.0       ?       ? 
1 1 1   49    6   32 o    263.6    3.1    0.0000   0.0000          ?        ?   695.3500  16.6016          ?        ?      263.6        3.1       ?       ? 
1 1 1   49    6   33 o     52.3   14.3    0.0000   0.0000          ?        ?    28.7335  15.3245          ?        ?       52.3       14.3       ?       ? 
1 1 1   49    6   34 o    316.3    3.0    0.0000   0.0000          ?        ?  1001.2019  19.1556          ?        ?      316.3        3.0       ?       ? 
1 1 1   49    6   35 o    193.6    4.1    0.0000   0.0000          ?        ?   375.4507  15.9630          ?        ?      193.6        4.1       ?       ? 
1 1 1   49    6   36 o    156.0    5.3    0.0000   0.0000          ?        ?   243.9153  16.6016          ?        ?      156.0        5.3       ?       ? 
1 1 1   49    6   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49    6   38 o     64.2   13.4    0.0000   0.0000          ?        ?    43.4195  16.6016          ?        ?       64.2       13.4       ?       ? 
1 1 1   49    6   39 o     75.4   11.0    0.0000   0.0000          ?        ?    57.4669  16.6016          ?        ?       75.4       11.0       ?       ? 
1 1 1   49    6   40 o    166.7    4.8    0.0000   0.0000          ?        ?   278.3954  15.9630          ?        ?      166.7        4.8       ?       ? 
1 1 1   49    6   41 o     66.6   12.9    0.0000   0.0000          ?        ?    46.6121  16.6016          ?        ?       66.6       12.9       ?       ? 
1 1 1   49    6   42 o    145.7    5.9    0.0000   0.0000          ?        ?   213.2662  17.2401          ?        ?      145.7        5.9       ?       ? 
1 1 1   49    6   43 o    147.9    6.0    0.0000   0.0000          ?        ?   219.6514  17.8786          ?        ?      147.9        6.0       ?       ? 
1 1 1   49    6   44 o     42.9   15.8    0.0000   0.0000          ?        ?    15.3245  17.8786          ?        ?       42.9       15.8       ?       ? 
1 1 1   49    6   45 o     32.2   14.1    0.0000   0.0000          ?        ?    -3.1926  17.2401          ?        ?       32.2       14.1       ?       ? 
1 1 1   49    6   46 o    244.7    3.9    0.0000   0.0000          ?        ?   600.2103  19.1556          ?        ?      244.7        3.9       ?       ? 
1 1 1   49    6   47 o    126.4    7.1    0.0000   0.0000          ?        ?   160.9075  17.8786          ?        ?      126.4        7.1       ?       ? 
1 1 1   49    6   48 o     67.9   13.6    0.0000   0.0000          ?        ?    49.1662  17.8786          ?        ?       67.9       13.6       ?       ? 
1 1 1   49    6   49 o    196.0    4.6    0.0000   0.0000          ?        ?   385.6671  17.8786          ?        ?      196.0        4.6       ?       ? 
1 1 1   49    6   50 o     32.0   14.0    0.0000   0.0000          ?        ?    -3.1926  17.2401          ?        ?       32.0       14.0       ?       ? 
1 1 1   49    6   51 o     51.8   15.1    0.0000   0.0000          ?        ?    28.7335  16.6016          ?        ?       51.8       15.1       ?       ? 
1 1 1   49    7    0 o    422.0    3.9 1782.1139  33.2031  1782.1139  33.2031  1782.1139  33.2031      422.0      3.9      422.0        3.9     0.0     0.0 
1 1 1   49    7    1 o    162.5    3.7    0.0000   0.0000          ?        ?   264.3480  12.1319          ?        ?      162.5        3.7       ?       ? 
1 1 1   49    7    2 o    235.9    3.0    0.0000   0.0000          ?        ?   556.7908  14.0475          ?        ?      235.9        3.0       ?       ? 
1 1 1   49    7    3 o    230.0    3.1    0.0000   0.0000          ?        ?   529.3344  14.0475          ?        ?      230.0        3.1       ?       ? 
1 1 1   49    7    4 o    400.7    2.9    0.0000   0.0000          ?        ?  1606.5205  22.9868          ?        ?      400.7        2.9       ?       ? 
1 1 1   49    7    5 o    307.6    2.8    0.0000   0.0000          ?        ?   946.2890  17.2401          ?        ?      307.6        2.8       ?       ? 
1 1 1   49    7    6 o    256.1    3.0    0.0000   0.0000          ?        ?   656.4003  15.3245          ?        ?      256.1        3.0       ?       ? 
1 1 1   49    7    7 o    405.3    2.7    0.0000   0.0000          ?        ?  1642.9160  21.7097          ?        ?      405.3        2.7       ?       ? 
1 1 1   49    7    8 o    123.5    4.9    0.0000   0.0000          ?        ?   152.6067  12.1319          ?        ?      123.5        4.9       ?       ? 
1 1 1   49    7    9 o    284.3    2.8    0.0000   0.0000          ?        ?   808.3683  15.9630          ?        ?      284.3        2.8       ?       ? 
1 1 1   49    7   10 o    261.2    2.9    0.0000   0.0000          ?        ?   682.5797  15.3245          ?        ?      261.2        2.9       ?       ? 
1 1 1   49    7   11 o    270.8    3.1    0.0000   0.0000          ?        ?   733.6614  16.6016          ?        ?      270.8        3.1       ?       ? 
1 1 1   49    7   12 o    202.6    3.3    0.0000   0.0000          ?        ?   410.5694  13.4090          ?        ?      202.6        3.3       ?       ? 
1 1 1   49    7   13 o    255.3    3.3    0.0000   0.0000          ?        ?   651.9305  16.6016          ?        ?      255.3        3.3       ?       ? 
1 1 1   49    7   14 o    342.9    2.8    0.0000   0.0000          ?        ?  1176.1569  19.1556          ?        ?      342.9        2.8       ?       ? 
1 1 1   49    7   15 o    555.6    3.0    0.0000   0.0000          ?        ?  3088.5293  33.2031          ?        ?      555.6        3.0       ?       ? 
1 1 1   49    7   16 o    307.3    2.9    0.0000   0.0000          ?        ?   945.0120  17.8786          ?        ?      307.3        2.9       ?       ? 
1 1 1   49    7   17 o    157.9    4.4    0.0000   0.0000          ?        ?   249.6619  14.0475          ?        ?      157.9        4.4       ?       ? 
1 1 1   49    7   18 o    292.5    2.9    0.0000   0.0000          ?        ?   856.2576  17.2401          ?        ?      292.5        2.9       ?       ? 
1 1 1   49    7   19 o    180.9    3.9    0.0000   0.0000          ?        ?   327.5616  14.0475          ?        ?      180.9        3.9       ?       ? 
1 1 1   49    7   20 o    143.3    4.9    0.0000   0.0000          ?        ?   205.6040  14.0475          ?        ?      143.3        4.9       ?       ? 
1 1 1   49    7   21 o    160.7    4.2    0.0000   0.0000          ?        ?   258.6013  13.4090          ?        ?      160.7        4.2       ?       ? 
1 1 1   49    7   22 o    198.9    3.7    0.0000   0.0000          ?        ?   395.8834  14.6860          ?        ?      198.9        3.7       ?       ? 
1 1 1   49    7   23 o     82.1    8.6    0.0000   0.0000          ?        ?    67.6833  14.0475          ?        ?       82.1        8.6       ?       ? 
1 1 1   49    7   24 o    176.2    4.2    0.0000   0.0000          ?        ?   310.9600  14.6860          ?        ?      176.2        4.2       ?       ? 
1 1 1   49    7   25 o    400.0    2.6    0.0000   0.0000          ?        ?  1600.7737  20.4327          ?        ?      400.0        2.6       ?       ? 
1 1 1   49    7   26 o    126.7    5.5    0.0000   0.0000          ?        ?   160.9075  14.0475          ?        ?      126.7        5.5       ?       ? 
1 1 1   49    7   27 o    122.1    5.8    0.0000   0.0000          ?        ?   149.4141  14.0475          ?        ?      122.1        5.8       ?       ? 
1 1 1   49    7   28 o     50.0   13.7    0.0000   0.0000          ?        ?    26.1794  14.0475          ?        ?       50.0       13.7       ?       ? 
1 1 1   49    7   29 o    161.3    4.4    0.0000   0.0000          ?        ?   260.5168  14.0475          ?        ?      161.3        4.4       ?       ? 
1 1 1   49    7   30 o    410.2    2.6    0.0000   0.0000          ?        ?  1683.7816  21.7097          ?        ?      410.2        2.6       ?       ? 
1 1 1   49    7   31 o    320.8    2.9    0.0000   0.0000          ?        ?  1029.9354  18.5171          ?        ?      320.8        2.9       ?       ? 
1 1 1   49    7   32 o    353.5    3.0    0.0000   0.0000          ?        ?  1250.2253  21.0712          ?        ?      353.5        3.0       ?       ? 
1 1 1   49    7   33 f     32.6   13.7    0.0000   0.0000          ?        ?     1.2770  15.3245          ?        ?       32.6       13.7       ?       ? 
1 1 1   49    7   34 f    333.3    2.8    0.0000   0.0000          ?        ?  1111.6661  18.5171          ?        ?      333.3        2.8       ?       ? 
1 1 1   49    7   35 o    433.3    2.7    0.0000   0.0000          ?        ?  1878.5308  22.9868          ?        ?      433.3        2.7       ?       ? 
1 1 1   49    7   36 o     21.8   10.8    0.0000   0.0000          ?        ?   -35.1187  16.6016          ?        ?       21.8       10.8       ?       ? 
1 1 1   49    7   37 o    182.7    4.5    0.0000   0.0000          ?        ?   334.5853  16.6016          ?        ?      182.7        4.5       ?       ? 
1 1 1   49    7   38 o    349.5    2.8    0.0000   0.0000          ?        ?  1222.7689  19.7942          ?        ?      349.5        2.8       ?       ? 
1 1 1   49    7   39 o    213.0    4.0    0.0000   0.0000          ?        ?   454.6274  17.2401          ?        ?      213.0        4.0       ?       ? 
1 1 1   49    7   40 o    325.1    3.0    0.0000   0.0000          ?        ?  1058.0303  19.7942          ?        ?      325.1        3.0       ?       ? 
1 1 1   49    7   41 o    238.5    3.6    0.0000   0.0000          ?        ?   569.5613  17.2401          ?        ?      238.5        3.6       ?       ? 
1 1 1   49    7   42 o    257.2    3.7    0.0000   0.0000          ?        ?   662.7855  19.1556          ?        ?      257.2        3.7       ?       ? 
1 1 1   49    7   43 o     78.5   10.6    0.0000   0.0000          ?        ?    62.5751  16.6016          ?        ?       78.5       10.6       ?       ? 
1 1 1   49    7   44 o    207.3    4.3    0.0000   0.0000          ?        ?   431.0021  17.8786          ?        ?      207.3        4.3       ?       ? 
1 1 1   49    7   45 o    268.0    3.6    0.0000   0.0000          ?        ?   719.6138  19.1556          ?        ?      268.0        3.6       ?       ? 
1 1 1   49    7   46 o    157.0    5.5    0.0000   0.0000          ?        ?   247.7464  17.2401          ?        ?      157.0        5.5       ?       ? 
1 1 1   49    7   47 o    195.2    4.6    0.0000   0.0000          ?        ?   382.4745  17.8786          ?        ?      195.2        4.6       ?       ? 
1 1 1   49    7   48 o    149.8    6.2    0.0000   0.0000          ?        ?   226.0367  18.5171          ?        ?      149.8        6.2       ?       ? 
1 1 1   49    7   49 o     26.2   12.5    0.0000   0.0000          ?        ?   -21.7097  17.8786          ?        ?       26.2       12.5       ?       ? 
1 1 1   49    7   50 o    278.1    3.4    0.0000   0.0000          ?        ?   775.1653  19.1556          ?        ?      278.1        3.4       ?       ? 
1 1 1   49    8    0 o    722.8    4.5 5227.5767  65.1292  5227.5767  65.1292  5227.5767  65.1292      722.8      4.5      722.8        4.5     0.0     0.0 
1 1 1   49    8    1 o    402.2    2.7    0.0000   0.0000          ?        ?  1618.0138  21.7097          ?        ?      402.2        2.7       ?       ? 
1 1 1   49    8    2 o    213.0    3.1    0.0000   0.0000          ?        ?   453.9889  13.4090          ?        ?      213.0        3.1       ?       ? 
1 1 1   49    8    3 o    228.8    3.1    0.0000   0.0000          ?        ?   523.5877  14.0475          ?        ?      228.8        3.1       ?       ? 
1 1 1   49    8    4 o    179.7    3.6    0.0000   0.0000          ?        ?   323.0919  12.7704          ?        ?      179.7        3.6       ?       ? 
1 1 1   49    8    5 o    170.6    3.7    0.0000   0.0000          ?        ?   291.1659  12.7704          ?        ?      170.6        3.7       ?       ? 
1 1 1   49    8    6 o    260.2    2.8    0.0000   0.0000          ?        ?   677.4714  14.6860          ?        ?      260.2        2.8       ?       ? 
1 1 1   49    8    7 o    373.4    2.7    0.0000   0.0000          ?        ?  1395.1698  20.4327          ?        ?      373.4        2.7       ?       ? 
1 1 1   49    8    8 o    340.2    2.6    0.0000   0.0000          ?        ?  1157.6398  17.8786          ?        ?      340.2        2.6       ?       ? 
1 1 1   49    8    9 o    422.6    2.8    0.0000   0.0000          ?        ?  1786.5834  23.6253          ?        ?      422.6        2.8       ?       ? 
1 1 1   49    8   10 o    356.0    2.9    0.0000   0.0000          ?        ?  1268.1040  20.4327          ?        ?      356.0        2.9       ?       ? 
1 1 1   49    8   11 o    170.0    3.8    0.0000   0.0000          ?        ?   289.2503  12.7704          ?        ?      170.0        3.8       ?       ? 
1 1 1   49    8   12 o    381.7    2.7    0.0000   0.0000          ?        ?  1457.7449  20.4327          ?        ?      381.7        2.7       ?       ? 
1 1 1   49    8   13 o    312.4    2.8    0.0000   0.0000          ?        ?   976.2995  17.2401          ?        ?      312.4        2.8       ?       ? 
1 1 1   49    8   14 o    131.2    5.6    0.0000   0.0000          ?        ?   172.4008  14.6860          ?        ?      131.2        5.6       ?       ? 
1 1 1   49    8   15 o    650.7    3.5    0.0000   0.0000          ?        ?  4236.5908  45.3350          ?        ?      650.7        3.5       ?       ? 
1 1 1   49    8   16 o    313.8    3.0    0.0000   0.0000          ?        ?   985.2389  18.5171          ?        ?      313.8        3.0       ?       ? 
1 1 1   49    8   17 o    378.8    2.6    0.0000   0.0000          ?        ?  1435.3966  19.7942          ?        ?      378.8        2.6       ?       ? 
1 1 1   49    8   18 o    153.6    4.4    0.0000   0.0000          ?        ?   236.2530  13.4090          ?        ?      153.6        4.4       ?       ? 
1 1 1   49    8   19 o    459.8    2.7    0.0000   0.0000          ?        ?  2114.7837  24.9023          ?        ?      459.8        2.7       ?       ? 
1 1 1   49    8   20 o     64.2   10.4    0.0000   0.0000          ?        ?    41.5039  13.4090          ?        ?       64.2       10.4       ?       ? 
1 1 1   49    8   21 o    137.6    4.9    0.0000   0.0000          ?        ?   189.6409  13.4090          ?        ?      137.6        4.9       ?       ? 
1 1 1   49    8   22 o    399.6    2.7    0.0000   0.0000          ?        ?  1597.5811  21.7097          ?        ?      399.6        2.7       ?       ? 
1 1 1   49    8   23 o    148.3    4.7    0.0000   0.0000          ?        ?   220.2900  14.0475          ?        ?      148.3        4.7       ?       ? 
1 1 1   49    8   24 o    156.1    4.5    0.0000   0.0000          ?        ?   243.9153  14.0475          ?        ?      156.1        4.5       ?       ? 
1 1 1   49    8   25 o    226.6    3.5    0.0000   0.0000          ?        ?   514.0099  15.9630          ?        ?      226.6        3.5       ?       ? 
1 1 1   49    8   26 f    293.1    2.8    0.0000   0.0000          ?        ?   859.4501  16.6016          ?        ?      293.1        2.8       ?       ? 
1 1 1   49    8   27 o    162.1    4.5    0.0000   0.0000          ?        ?   263.0709  14.6860          ?        ?      162.1        4.5       ?       ? 
1 1 1   49    8   28 o     23.4   11.2    0.0000   0.0000          ?        ?   -19.7942  14.6860          ?        ?       23.4       11.2       ?       ? 
1 1 1   49    8   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49    8   30 o     39.3   14.6    0.0000   0.0000          ?        ?    12.1319  15.3245          ?        ?       39.3       14.6       ?       ? 
1 1 1   49    8   31 o    228.8    3.8    0.0000   0.0000          ?        ?   524.2263  17.2401          ?        ?      228.8        3.8       ?       ? 
1 1 1   49    8   32 o    420.1    2.7    0.0000   0.0000          ?        ?  1765.5123  22.3483          ?        ?      420.1        2.7       ?       ? 
1 1 1   49    8   33 f    187.2    4.6    0.0000   0.0000          ?        ?   351.1869  17.2401          ?        ?      187.2        4.6       ?       ? 
1 1 1   49    8   34 o    298.5    3.0    0.0000   0.0000          ?        ?   892.0147  17.8786          ?        ?      298.5        3.0       ?       ? 
1 1 1   49    8   35 o    205.4    4.0    0.0000   0.0000          ?        ?   422.7013  16.6016          ?        ?      205.4        4.0       ?       ? 
1 1 1   49    8   36 o    187.4    4.4    0.0000   0.0000          ?        ?   351.8254  16.6016          ?        ?      187.4        4.4       ?       ? 
1 1 1   49    8   37 o     17.9    9.1    0.0000   0.0000          ?        ?   -54.9129  15.9630          ?        ?       17.9        9.1       ?       ? 
1 1 1   49    8   38 o     87.2    8.8    0.0000   0.0000          ?        ?    76.6226  15.3245          ?        ?       87.2        8.8       ?       ? 
1 1 1   49    8   39 o    184.8    4.7    0.0000   0.0000          ?        ?   342.2476  17.2401          ?        ?      184.8        4.7       ?       ? 
1 1 1   49    8   40 o    182.3    4.9    0.0000   0.0000          ?        ?   333.3083  17.8786          ?        ?      182.3        4.9       ?       ? 
1 1 1   49    8   41 o    250.6    3.6    0.0000   0.0000          ?        ?   628.9438  17.8786          ?        ?      250.6        3.6       ?       ? 
1 1 1   49    8   42 o    115.6    7.7    0.0000   0.0000          ?        ?   134.7281  17.8786          ?        ?      115.6        7.7       ?       ? 
1 1 1   49    8   43 o    132.2    6.3    0.0000   0.0000          ?        ?   175.5934  16.6016          ?        ?      132.2        6.3       ?       ? 
1 1 1   49    8   44 o    217.3    4.1    0.0000   0.0000          ?        ?   473.1445  17.8786          ?        ?      217.3        4.1       ?       ? 
1 1 1   49    8   45 o    101.4    8.5    0.0000   0.0000          ?        ?   104.0790  17.2401          ?        ?      101.4        8.5       ?       ? 
1 1 1   49    8   46 o    195.1    4.6    0.0000   0.0000          ?        ?   381.8359  17.8786          ?        ?      195.1        4.6       ?       ? 
1 1 1   49    8   47 o    168.7    5.3    0.0000   0.0000          ?        ?   286.0577  17.8786          ?        ?      168.7        5.3       ?       ? 
1 1 1   49    8   48 o    223.4    4.1    0.0000   0.0000          ?        ?   500.6010  18.5171          ?        ?      223.4        4.1       ?       ? 
1 1 1   49    8   49 o    181.8    4.9    0.0000   0.0000          ?        ?   332.0312  17.8786          ?        ?      181.8        4.9       ?       ? 
1 1 1   49    9    0 o     11.4    8.5  -46.6121  14.6860   -46.6121  14.6860   -46.6121  14.6860       11.4      8.5       11.4        8.5     0.0     0.0 
1 1 1   49    9    1 o    282.5    2.7    0.0000   0.0000          ?        ?   798.1520  15.3245          ?        ?      282.5        2.7       ?       ? 
1 1 1   49    9    2 o    152.0    3.8    0.0000   0.0000          ?        ?   231.1448  11.4934          ?        ?      152.0        3.8       ?       ? 
1 1 1   49    9    3 o    433.8    2.7    0.0000   0.0000          ?        ?  1882.3617  23.6253          ?        ?      433.8        2.7       ?       ? 
1 1 1   49    9    4 o    283.7    2.8    0.0000   0.0000          ?        ?   805.1758  15.9630          ?        ?      283.7        2.8       ?       ? 
1 1 1   49    9    5 o    117.6    4.6    0.0000   0.0000          ?        ?   138.5592  10.8549          ?        ?      117.6        4.6       ?       ? 
1 1 1   49    9    6 o    209.2    3.4    0.0000   0.0000          ?        ?   438.0258  14.0475          ?        ?      209.2        3.4       ?       ? 
1 1 1   49    9    7 o    145.5    4.2    0.0000   0.0000          ?        ?   211.9892  12.1319          ?        ?      145.5        4.2       ?       ? 
1 1 1   49    9    8 o    446.2    2.9    0.0000   0.0000          ?        ?  1991.5490  25.5409          ?        ?      446.2        2.9       ?       ? 
1 1 1   49    9    9 o     19.1    9.4    0.0000   0.0000          ?        ?   -24.2638  12.1319          ?        ?       19.1        9.4       ?       ? 
1 1 1   49    9   10 o     17.4    8.7    0.0000   0.0000          ?        ?   -31.9261  12.1319          ?        ?       17.4        8.7       ?       ? 
1 1 1   49    9   11 o    256.0    3.1    0.0000   0.0000          ?        ?   655.7617  15.9630          ?        ?      256.0        3.1       ?       ? 
1 1 1   49    9   12 o    575.2    3.1    0.0000   0.0000          ?        ?  3310.0962  35.1187          ?        ?      575.2        3.1       ?       ? 
1 1 1   49    9   13 o    266.3    2.9    0.0000   0.0000          ?        ?   709.3975  15.3245          ?        ?      266.3        2.9       ?       ? 
1 1 1   49    9   14 o    281.9    2.8    0.0000   0.0000          ?        ?   794.9594  15.9630          ?        ?      281.9        2.8       ?       ? 
1 1 1   49    9   15 o     46.7   14.0    0.0000   0.0000          ?        ?    22.3483  14.0475          ?        ?       46.7       14.0       ?       ? 
1 1 1   49    9   16 o    268.2    3.1    0.0000   0.0000          ?        ?   719.6138  16.6016          ?        ?      268.2        3.1       ?       ? 
1 1 1   49    9   17 o     47.0   13.1    0.0000   0.0000          ?        ?    22.9868  12.7704          ?        ?       47.0       13.1       ?       ? 
1 1 1   49    9   18 o     66.2   10.6    0.0000   0.0000          ?        ?    44.0580  14.0475          ?        ?       66.2       10.6       ?       ? 
1 1 1   49    9   19 o    165.8    4.2    0.0000   0.0000          ?        ?   275.2028  14.0475          ?        ?      165.8        4.2       ?       ? 
1 1 1   49    9   20 o    158.3    4.2    0.0000   0.0000          ?        ?   250.9390  13.4090          ?        ?      158.3        4.2       ?       ? 
1 1 1   49    9   21 o    134.3    5.2    0.0000   0.0000          ?        ?   180.7016  14.0475          ?        ?      134.3        5.2       ?       ? 
1 1 1   49    9   22 o    194.8    3.8    0.0000   0.0000          ?        ?   379.9204  14.6860          ?        ?      194.8        3.8       ?       ? 
1 1 1   49    9   23 o    272.2    2.9    0.0000   0.0000          ?        ?   741.3236  15.9630          ?        ?      272.2        2.9       ?       ? 
1 1 1   49    9   24 o    191.4    3.7    0.0000   0.0000          ?        ?   366.5114  14.0475          ?        ?      191.4        3.7       ?       ? 
1 1 1   49    9   25 o    292.1    3.1    0.0000   0.0000          ?        ?   853.7034  17.8786          ?        ?      292.1        3.1       ?       ? 
1 1 1   49    9   26 o    196.6    3.9    0.0000   0.0000          ?        ?   386.9441  15.3245          ?        ?      196.6        3.9       ?       ? 
1 1 1   49    9   27 o    237.2    3.4    0.0000   0.0000          ?        ?   563.1760  15.9630          ?        ?      237.2        3.4       ?       ? 
1 1 1   49    9   28 o     22.1   10.6    0.0000   0.0000          ?        ?   -21.7097  14.0475          ?        ?       22.1       10.6       ?       ? 
1 1 1   49    9   29 o    177.5    4.3    0.0000   0.0000          ?        ?   315.4297  15.3245          ?        ?      177.5        4.3       ?       ? 
1 1 1   49    9   30 o    212.6    3.9    0.0000   0.0000          ?        ?   452.7119  16.6016          ?        ?      212.6        3.9       ?       ? 
1 1 1   49    9   31 o    351.1    2.7    0.0000   0.0000          ?        ?  1233.6238  19.1556          ?        ?      351.1        2.7       ?       ? 
1 1 1   49    9   32 o    196.4    4.2    0.0000   0.0000          ?        ?   386.3056  16.6016          ?        ?      196.4        4.2       ?       ? 
1 1 1   49    9   33 o     88.3    9.0    0.0000   0.0000          ?        ?    78.5382  15.9630          ?        ?       88.3        9.0       ?       ? 
1 1 1   49    9   34 o    214.1    3.7    0.0000   0.0000          ?        ?   459.0970  15.9630          ?        ?      214.1        3.7       ?       ? 
1 1 1   49    9   35 o    145.6    5.5    0.0000   0.0000          ?        ?   212.6277  15.9630          ?        ?      145.6        5.5       ?       ? 
1 1 1   49    9   36 o     81.5    9.8    0.0000   0.0000          ?        ?    67.0448  15.9630          ?        ?       81.5        9.8       ?       ? 
1 1 1   49    9   37 o     36.8   14.6    0.0000   0.0000          ?        ?     7.6623  15.9630          ?        ?       36.8       14.6       ?       ? 
1 1 1   49    9   38 o    453.3    2.7    0.0000   0.0000          ?        ?  2056.0396  24.2638          ?        ?      453.3        2.7       ?       ? 
1 1 1   49    9   39 o    105.3    7.9    0.0000   0.0000          ?        ?   111.7413  16.6016          ?        ?      105.3        7.9       ?       ? 
1 1 1   49    9   40 o    170.7    5.0    0.0000   0.0000          ?        ?   292.4429  17.2401          ?        ?      170.7        5.0       ?       ? 
1 1 1   49    9   41 o     29.4   13.3    0.0000   0.0000          ?        ?    -8.3008  16.6016          ?        ?       29.4       13.3       ?       ? 
1 1 1   49    9   42 o     96.7    8.9    0.0000   0.0000          ?        ?    94.5012  17.2401          ?        ?       96.7        8.9       ?       ? 
1 1 1   49    9   43 o     92.9    9.3    0.0000   0.0000          ?        ?    87.4775  17.2401          ?        ?       92.9        9.3       ?       ? 
1 1 1   49    9   44 o     99.2    8.7    0.0000   0.0000          ?        ?    99.6094  17.2401          ?        ?       99.2        8.7       ?       ? 
1 1 1   49    9   45 o     31.7   13.9    0.0000   0.0000          ?        ?    -2.5541  16.6016          ?        ?       31.7       13.9       ?       ? 
1 1 1   49    9   46 o    208.0    4.1    0.0000   0.0000          ?        ?   434.1947  17.2401          ?        ?      208.0        4.1       ?       ? 
1 1 1   49    9   47 o     50.3   15.2    0.0000   0.0000          ?        ?    26.8179  16.6016          ?        ?       50.3       15.2       ?       ? 
1 1 1   49    9   48 o    202.3    4.6    0.0000   0.0000          ?        ?   411.2079  18.5171          ?        ?      202.3        4.6       ?       ? 
1 1 1   49   10    0 o    247.7    4.4  614.2578  21.7097   614.2578  21.7097   614.2578  21.7097      247.7      4.4      247.7        4.4     0.0     0.0 
1 1 1   49   10    1 o    197.1    3.1    0.0000   0.0000          ?        ?   388.8597  12.1319          ?        ?      197.1        3.1       ?       ? 
1 1 1   49   10    2 o    509.8    2.8    0.0000   0.0000          ?        ?  2600.0601  28.7335          ?        ?      509.8        2.8       ?       ? 
1 1 1   49   10    3 o     46.8   11.1    0.0000   0.0000          ?        ?    22.9868  10.2163          ?        ?       46.8       11.1       ?       ? 
1 1 1   49   10    4 o    234.4    3.0    0.0000   0.0000          ?        ?   549.7671  14.0475          ?        ?      234.4        3.0       ?       ? 
1 1 1   49   10    5 o    124.2    4.6    0.0000   0.0000          ?        ?   154.5222  11.4934          ?        ?      124.2        4.6       ?       ? 
1 1 1   49   10    6 o    150.3    4.0    0.0000   0.0000          ?        ?   226.0367  12.1319          ?        ?      150.3        4.0       ?       ? 
1 1 1   49   10    7 o    274.7    3.0    0.0000   0.0000          ?        ?   754.7325  16.6016          ?        ?      274.7        3.0       ?       ? 
1 1 1   49   10    8 o    282.7    2.8    0.0000   0.0000          ?        ?   799.4291  15.9630          ?        ?      282.7        2.8       ?       ? 
1 1 1   49   10    9 o    572.9    3.3    0.0000   0.0000          ?        ?  3284.5554  37.6728          ?        ?      572.9        3.3       ?       ? 
1 1 1   49   10   10 o    256.6    2.9    0.0000   0.0000          ?        ?   658.9543  14.6860          ?        ?      256.6        2.9       ?       ? 
1 1 1   49   10   11 o    228.3    3.2    0.0000   0.0000          ?        ?   521.6721  14.6860          ?        ?      228.3        3.2       ?       ? 
1 1 1   49   10   12 o    272.4    2.9    0.0000   0.0000          ?        ?   742.6006  15.9630          ?        ?      272.4        2.9       ?       ? 
1 1 1   49   10   13 o    160.1    4.0    0.0000   0.0000          ?        ?   256.6857  12.7704          ?        ?      160.1        4.0       ?       ? 
1 1 1   49   10   14 o    281.0    2.8    0.0000   0.0000          ?        ?   789.8513  15.9630          ?        ?      281.0        2.8       ?       ? 
1 1 1   49   10   15 o    117.3    5.7    0.0000   0.0000          ?        ?   137.9207  13.4090          ?        ?      117.3        5.7       ?       ? 
1 1 1   49   10   16 o    271.1    3.4    0.0000   0.0000          ?        ?   735.5769  18.5171          ?        ?      271.1        3.4       ?       ? 
1 1 1   49   10   17 o    185.4    4.1    0.0000   0.0000          ?        ?   344.1632  15.3245          ?        ?      185.4        4.1       ?       ? 
1 1 1   49   10   18 o    174.1    4.0    0.0000   0.0000          ?        ?   303.2978  14.0475          ?        ?      174.1        4.0       ?       ? 
1 1 1   49   10   19 o    357.6    2.8    0.0000   0.0000          ?        ?  1279.5973  19.7942          ?        ?      357.6        2.8       ?       ? 
1 1 1   49   10   20 o    381.6    2.7    0.0000   0.0000          ?        ?  1457.1063  20.4327          ?        ?      381.6        2.7       ?       ? 
1 1 1   49   10   21 o    352.5    2.5    0.0000   0.0000          ?        ?  1243.2015  17.8786          ?        ?      352.5        2.5       ?       ? 
1 1 1   49   10   22 o    362.4    2.8    0.0000   0.0000          ?        ?  1314.0775  20.4327          ?        ?      362.4        2.8       ?       ? 
1 1 1   49   10   23 o    619.6    2.9    0.0000   0.0000          ?        ?  3840.7075  36.3957          ?        ?      619.6        2.9       ?       ? 
1 1 1   49   10   24 o    192.5    3.8    0.0000   0.0000          ?        ?   370.9810  14.6860          ?        ?      192.5        3.8       ?       ? 
1 1 1   49   10   25 o    445.3    2.7    0.0000   0.0000          ?        ?  1983.8867  24.2638          ?        ?      445.3        2.7       ?       ? 
1 1 1   49   10   26 o    132.1    5.6    0.0000   0.0000          ?        ?   174.9549  14.6860          ?        ?      132.1        5.6       ?       ? 
1 1 1   49   10   27 f    184.4    4.2    0.0000   0.0000          ?        ?   340.3320  15.3245          ?        ?      184.4        4.2       ?       ? 
1 1 1   49   10   28 o    155.8    4.9    0.0000   0.0000          ?        ?   243.2767  15.3245          ?        ?      155.8        4.9       ?       ? 
1 1 1   49   10   29 o    193.1    4.1    0.0000   0.0000          ?        ?   373.5352  15.9630          ?        ?      193.1        4.1       ?       ? 
1 1 1   49   10   30 o    465.4    2.6    0.0000   0.0000          ?        ?  2167.1423  24.2638          ?        ?      465.4        2.6       ?       ? 
1 1 1   49   10   31 o    215.2    3.7    0.0000   0.0000          ?        ?   463.5667  15.9630          ?        ?      215.2        3.7       ?       ? 
1 1 1   49   10   32 o     18.1    9.2    0.0000   0.0000          ?        ?   -53.6358  15.9630          ?        ?       18.1        9.2       ?       ? 
1 1 1   49   10   33 o     50.6   14.4    0.0000   0.0000          ?        ?    26.8179  15.3245          ?        ?       50.6       14.4       ?       ? 
1 1 1   49   10   34 o    226.6    3.7    0.0000   0.0000          ?        ?   514.0099  16.6016          ?        ?      226.6        3.7       ?       ? 
1 1 1   49   10   35 o    319.3    2.9    0.0000   0.0000          ?        ?  1020.3576  18.5171          ?        ?      319.3        2.9       ?       ? 
1 1 1   49   10   36 o     27.8   12.7    0.0000   0.0000          ?        ?   -10.8549  15.9630          ?        ?       27.8       12.7       ?       ? 
1 1 1   49   10   37 o    108.9    7.3    0.0000   0.0000          ?        ?   119.4035  15.9630          ?        ?      108.9        7.3       ?       ? 
1 1 1   49   10   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49   10   39 o     35.9   14.5    0.0000   0.0000          ?        ?     6.3852  15.9630          ?        ?       35.9       14.5       ?       ? 
1 1 1   49   10   40 o     98.1    8.5    0.0000   0.0000          ?        ?    97.0553  16.6016          ?        ?       98.1        8.5       ?       ? 
1 1 1   49   10   41 o    200.6    4.3    0.0000   0.0000          ?        ?   403.5457  17.2401          ?        ?      200.6        4.3       ?       ? 
1 1 1   49   10   42 o    118.1    7.3    0.0000   0.0000          ?        ?   140.4748  17.2401          ?        ?      118.1        7.3       ?       ? 
1 1 1   49   10   43 o     85.7   10.1    0.0000   0.0000          ?        ?    74.7070  17.2401          ?        ?       85.7       10.1       ?       ? 
1 1 1   49   10   44 o    163.8    5.3    0.0000   0.0000          ?        ?   269.4561  17.2401          ?        ?      163.8        5.3       ?       ? 
1 1 1   49   10   45 o     66.0   13.5    0.0000   0.0000          ?        ?    46.6121  17.2401          ?        ?       66.0       13.5       ?       ? 
1 1 1   49   10   46 o    294.7    3.1    0.0000   0.0000          ?        ?   870.3050  18.5171          ?        ?      294.7        3.1       ?       ? 
1 1 1   49   10   47 o    161.9    5.5    0.0000   0.0000          ?        ?   263.7094  17.8786          ?        ?      161.9        5.5       ?       ? 
1 1 1   49   11    0 o    291.7    3.8  851.7878  22.3483   851.7878  22.3483   851.7878  22.3483      291.7      3.8      291.7        3.8     0.0     0.0 
1 1 1   49   11    1 o    544.5    2.9    0.0000   0.0000          ?        ?  2966.5715  31.2876          ?        ?      544.5        2.9       ?       ? 
1 1 1   49   11    2 o     95.5    5.7    0.0000   0.0000          ?        ?    91.3086  10.8549          ?        ?       95.5        5.7       ?       ? 
1 1 1   49   11    3 o     18.0    8.8    0.0000   0.0000          ?        ?   -18.5171  10.2163          ?        ?       18.0        8.8       ?       ? 
1 1 1   49   11    4 o     35.9   12.1    0.0000   0.0000          ?        ?    12.1319  10.2163          ?        ?       35.9       12.1       ?       ? 
1 1 1   49   11    5 o    206.2    2.9    0.0000   0.0000          ?        ?   425.2554  12.1319          ?        ?      206.2        2.9       ?       ? 
1 1 1   49   11    6 o    197.6    3.2    0.0000   0.0000          ?        ?   390.7752  12.7704          ?        ?      197.6        3.2       ?       ? 
1 1 1   49   11    7 o     20.0    9.6    0.0000   0.0000          ?        ?   -17.8786  11.4934          ?        ?       20.0        9.6       ?       ? 
1 1 1   49   11    8 o    105.9    5.4    0.0000   0.0000          ?        ?   112.3798  11.4934          ?        ?      105.9        5.4       ?       ? 
1 1 1   49   11    9 o    582.0    3.1    0.0000   0.0000          ?        ?  3389.2727  35.7572          ?        ?      582.0        3.1       ?       ? 
1 1 1   49   11   10 o    205.8    3.9    0.0000   0.0000          ?        ?   423.9784  15.9630          ?        ?      205.8        3.9       ?       ? 
1 1 1   49   11   11 o    426.6    2.8    0.0000   0.0000          ?        ?  1820.4252  23.6253          ?        ?      426.6        2.8       ?       ? 
1 1 1   49   11   12 o    156.7    4.1    0.0000   0.0000          ?        ?   245.8308  12.7704          ?        ?      156.7        4.1       ?       ? 
1 1 1   49   11   13 o    160.9    4.2    0.0000   0.0000          ?        ?   259.2398  13.4090          ?        ?      160.9        4.2       ?       ? 
1 1 1   49   11   14 o     33.8   13.4    0.0000   0.0000          ?        ?     6.3852  13.4090          ?        ?       33.8       13.4       ?       ? 
1 1 1   49   11   15 o    361.3    3.0    0.0000   0.0000          ?        ?  1306.4153  21.7097          ?        ?      361.3        3.0       ?       ? 
1 1 1   49   11   16 o    439.8    2.8    0.0000   0.0000          ?        ?  1935.3591  24.9023          ?        ?      439.8        2.8       ?       ? 
1 1 1   49   11   17 o    319.7    3.2    0.0000   0.0000          ?        ?  1022.9116  20.4327          ?        ?      319.7        3.2       ?       ? 
1 1 1   49   11   18 o    164.0    4.7    0.0000   0.0000          ?        ?   269.4561  15.3245          ?        ?      164.0        4.7       ?       ? 
1 1 1   49   11   19 f    335.3    3.0    0.0000   0.0000          ?        ?  1125.0751  20.4327          ?        ?      335.3        3.0       ?       ? 
1 1 1   49   11   20 o    310.1    2.9    0.0000   0.0000          ?        ?   962.2521  17.8786          ?        ?      310.1        2.9       ?       ? 
1 1 1   49   11   21 o    422.5    2.6    0.0000   0.0000          ?        ?  1785.9451  21.7097          ?        ?      422.5        2.6       ?       ? 
1 1 1   49   11   22 o    289.6    3.1    0.0000   0.0000          ?        ?   839.0174  17.8786          ?        ?      289.6        3.1       ?       ? 
1 1 1   49   11   23 o    221.2    3.6    0.0000   0.0000          ?        ?   489.7461  15.9630          ?        ?      221.2        3.6       ?       ? 
1 1 1   49   11   24 o    265.1    3.0    0.0000   0.0000          ?        ?   703.0123  15.9630          ?        ?      265.1        3.0       ?       ? 
1 1 1   49   11   25 o    106.1    6.9    0.0000   0.0000          ?        ?   113.0183  14.6860          ?        ?      106.1        6.9       ?       ? 
1 1 1   49   11   26 o    136.1    5.9    0.0000   0.0000          ?        ?   185.8098  15.9630          ?        ?      136.1        5.9       ?       ? 
1 1 1   49   11   27 o    284.8    3.3    0.0000   0.0000          ?        ?   811.5610  18.5171          ?        ?      284.8        3.3       ?       ? 
1 1 1   49   11   28 o     72.5   10.6    0.0000   0.0000          ?        ?    52.9973  15.3245          ?        ?       72.5       10.6       ?       ? 
1 1 1   49   11   29 o     23.0   11.0    0.0000   0.0000          ?        ?   -21.0712  14.6860          ?        ?       23.0       11.0       ?       ? 
1 1 1   49   11   30 o     53.3   13.7    0.0000   0.0000          ?        ?    30.0105  14.6860          ?        ?       53.3       13.7       ?       ? 
1 1 1   49   11   31 o    225.3    3.5    0.0000   0.0000          ?        ?   508.2632  15.9630          ?        ?      225.3        3.5       ?       ? 
1 1 1   49   11   32 o    149.1    5.4    0.0000   0.0000          ?        ?   222.8441  15.9630          ?        ?      149.1        5.4       ?       ? 
1 1 1   49   11   33 o    189.6    4.4    0.0000   0.0000          ?        ?   360.1262  16.6016          ?        ?      189.6        4.4       ?       ? 
1 1 1   49   11   34 o    255.3    3.5    0.0000   0.0000          ?        ?   652.5691  17.8786          ?        ?      255.3        3.5       ?       ? 
1 1 1   49   11   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49   11   36 o    187.0    4.4    0.0000   0.0000          ?        ?   350.5484  16.6016          ?        ?      187.0        4.4       ?       ? 
1 1 1   49   11   37 o    144.0    5.8    0.0000   0.0000          ?        ?   208.1580  16.6016          ?        ?      144.0        5.8       ?       ? 
1 1 1   49   11   38 o    307.1    3.0    0.0000   0.0000          ?        ?   944.3735  18.5171          ?        ?      307.1        3.0       ?       ? 
1 1 1   49   11   39 o    199.2    4.2    0.0000   0.0000          ?        ?   397.7990  16.6016          ?        ?      199.2        4.2       ?       ? 
1 1 1   49   11   40 o    128.5    6.2    0.0000   0.0000          ?        ?   166.0156  15.9630          ?        ?      128.5        6.2       ?       ? 
1 1 1   49   11   41 o    180.0    4.8    0.0000   0.0000          ?        ?   325.0075  17.2401          ?        ?      180.0        4.8       ?       ? 
1 1 1   49   11   42 o    140.5    5.9    0.0000   0.0000          ?        ?   198.5802  16.6016          ?        ?      140.5        5.9       ?       ? 
1 1 1   49   11   43 o    268.1    3.3    0.0000   0.0000          ?        ?   720.2524  17.8786          ?        ?      268.1        3.3       ?       ? 
1 1 1   49   11   44 o    139.3    6.2    0.0000   0.0000          ?        ?   195.3876  17.2401          ?        ?      139.3        6.2       ?       ? 
1 1 1   49   11   45 o    264.8    3.5    0.0000   0.0000          ?        ?   703.0123  18.5171          ?        ?      264.8        3.5       ?       ? 
1 1 1   49   11   46 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49   12    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49   12    1 o    124.5    4.4    0.0000   0.0000          ?        ?   155.1608  10.8549          ?        ?      124.5        4.4       ?       ? 
1 1 1   49   12    2 o    350.2    2.6    0.0000   0.0000          ?        ?  1226.6001  17.8786          ?        ?      350.2        2.6       ?       ? 
1 1 1   49   12    3 o     92.4    5.5    0.0000   0.0000          ?        ?    85.5619  10.2163          ?        ?       92.4        5.5       ?       ? 
1 1 1   49   12    4 o    114.1    4.8    0.0000   0.0000          ?        ?   130.2584  10.8549          ?        ?      114.1        4.8       ?       ? 
1 1 1   49   12    5 o    143.8    4.0    0.0000   0.0000          ?        ?   206.8810  11.4934          ?        ?      143.8        4.0       ?       ? 
1 1 1   49   12    6 o    397.4    2.7    0.0000   0.0000          ?        ?  1579.7025  21.7097          ?        ?      397.4        2.7       ?       ? 
1 1 1   49   12    7 o    446.2    2.9    0.0000   0.0000          ?        ?  1992.1875  25.5409          ?        ?      446.2        2.9       ?       ? 
1 1 1   49   12    8 o     19.5    9.4    0.0000   0.0000          ?        ?   -16.6016  10.8549          ?        ?       19.5        9.4       ?       ? 
1 1 1   49   12    9 o    125.8    4.6    0.0000   0.0000          ?        ?   158.3534  11.4934          ?        ?      125.8        4.6       ?       ? 
1 1 1   49   12   10 o    376.9    2.7    0.0000   0.0000          ?        ?  1421.3491  20.4327          ?        ?      376.9        2.7       ?       ? 
1 1 1   49   12   11 o    435.3    3.2    0.0000   0.0000          ?        ?  1896.4092  27.4564          ?        ?      435.3        3.2       ?       ? 
1 1 1   49   12   12 o    209.7    3.3    0.0000   0.0000          ?        ?   439.9414  14.0475          ?        ?      209.7        3.3       ?       ? 
1 1 1   49   12   13 o    269.0    3.3    0.0000   0.0000          ?        ?   724.0836  17.8786          ?        ?      269.0        3.3       ?       ? 
1 1 1   49   12   14 o     52.9   12.3    0.0000   0.0000          ?        ?    29.3720  12.7704          ?        ?       52.9       12.3       ?       ? 
1 1 1   49   12   15 o    249.1    3.1    0.0000   0.0000          ?        ?   620.6430  15.3245          ?        ?      249.1        3.1       ?       ? 
1 1 1   49   12   16 o    125.2    5.1    0.0000   0.0000          ?        ?   157.0763  12.7704          ?        ?      125.2        5.1       ?       ? 
1 1 1   49   12   17 o    176.2    4.2    0.0000   0.0000          ?        ?   310.9600  14.6860          ?        ?      176.2        4.2       ?       ? 
1 1 1   49   12   18 o     90.6    7.8    0.0000   0.0000          ?        ?    82.3693  14.0475          ?        ?       90.6        7.8       ?       ? 
1 1 1   49   12   19 o    185.2    4.0    0.0000   0.0000          ?        ?   343.5246  14.6860          ?        ?      185.2        4.0       ?       ? 
1 1 1   49   12   20 o    151.9    4.8    0.0000   0.0000          ?        ?   231.1448  14.6860          ?        ?      151.9        4.8       ?       ? 
1 1 1   49   12   21 o    124.1    5.9    0.0000   0.0000          ?        ?   154.5222  14.6860          ?        ?      124.1        5.9       ?       ? 
1 1 1   49   12   22 o     17.8    9.0    0.0000   0.0000          ?        ?   -51.0817  15.3245          ?        ?       17.8        9.0       ?       ? 
1 1 1   49   12   23 f     41.0   13.8    0.0000   0.0000          ?        ?    15.9630  13.4090          ?        ?       41.0       13.8       ?       ? 
1 1 1   49   12   24 o     20.0    9.9    0.0000   0.0000          ?        ?   -33.8416  14.6860          ?        ?       20.0        9.9       ?       ? 
1 1 1   49   12   25 o    124.9    6.1    0.0000   0.0000          ?        ?   156.4378  15.3245          ?        ?      124.9        6.1       ?       ? 
1 1 1   49   12   26 o    223.4    4.0    0.0000   0.0000          ?        ?   499.9625  17.8786          ?        ?      223.4        4.0       ?       ? 
1 1 1   49   12   27 o    510.8    2.9    0.0000   0.0000          ?        ?  2611.5535  29.3720          ?        ?      510.8        2.9       ?       ? 
1 1 1   49   12   28 o    288.5    3.1    0.0000   0.0000          ?        ?   833.2708  17.8786          ?        ?      288.5        3.1       ?       ? 
1 1 1   49   12   29 o    239.3    3.5    0.0000   0.0000          ?        ?   573.3925  16.6016          ?        ?      239.3        3.5       ?       ? 
1 1 1   49   12   30 o     78.7    9.7    0.0000   0.0000          ?        ?    62.5751  15.3245          ?        ?       78.7        9.7       ?       ? 
1 1 1   49   12   31 o     99.5    7.4    0.0000   0.0000          ?        ?    99.6094  14.6860          ?        ?       99.5        7.4       ?       ? 
1 1 1   49   12   32 o    194.4    4.1    0.0000   0.0000          ?        ?   378.6433  15.9630          ?        ?      194.4        4.1       ?       ? 
1 1 1   49   12   33 o    180.6    4.8    0.0000   0.0000          ?        ?   326.9231  17.2401          ?        ?      180.6        4.8       ?       ? 
1 1 1   49   12   34 o     89.3    8.9    0.0000   0.0000          ?        ?    80.4537  15.9630          ?        ?       89.3        8.9       ?       ? 
1 1 1   49   12   35 o     62.8   12.7    0.0000   0.0000          ?        ?    41.5039  15.3245          ?        ?       62.8       12.7       ?       ? 
1 1 1   49   12   36 f    124.5    6.4    0.0000   0.0000          ?        ?   155.7993  15.9630          ?        ?      124.5        6.4       ?       ? 
1 1 1   49   12   37 o    163.9    5.1    0.0000   0.0000          ?        ?   269.4561  16.6016          ?        ?      163.9        5.1       ?       ? 
1 1 1   49   12   38 o     24.9   11.9    0.0000   0.0000          ?        ?   -21.7097  16.6016          ?        ?       24.9       11.9       ?       ? 
1 1 1   49   12   39 o    143.7    5.8    0.0000   0.0000          ?        ?   207.5195  16.6016          ?        ?      143.7        5.8       ?       ? 
1 1 1   49   12   40 o     37.1   14.8    0.0000   0.0000          ?        ?     7.6623  16.6016          ?        ?       37.1       14.8       ?       ? 
1 1 1   49   12   41 o    173.8    4.8    0.0000   0.0000          ?        ?   303.2978  16.6016          ?        ?      173.8        4.8       ?       ? 
1 1 1   49   12   42 o     42.8   15.3    0.0000   0.0000          ?        ?    16.6016  16.6016          ?        ?       42.8       15.3       ?       ? 
1 1 1   49   12   43 o     45.7   15.7    0.0000   0.0000          ?        ?    20.4327  17.2401          ?        ?       45.7       15.7       ?       ? 
1 1 1   49   12   44 o    139.0    6.2    0.0000   0.0000          ?        ?   194.7491  17.2401          ?        ?      139.0        6.2       ?       ? 
1 1 1   49   13    0 o    140.4    4.8  197.9417  13.4090   197.9417  13.4090   197.9417  13.4090      140.4      4.8      140.4        4.8     0.0     0.0 
1 1 1   49   13    1 o    246.9    2.7    0.0000   0.0000          ?        ?   609.7881  13.4090          ?        ?      246.9        2.7       ?       ? 
1 1 1   49   13    2 o    126.8    4.3    0.0000   0.0000          ?        ?   160.9075  10.8549          ?        ?      126.8        4.3       ?       ? 
1 1 1   49   13    3 o    115.7    4.7    0.0000   0.0000          ?        ?   134.0895  10.8549          ?        ?      115.7        4.7       ?       ? 
1 1 1   49   13    4 o     45.5   11.3    0.0000   0.0000          ?        ?    21.7097  10.2163          ?        ?       45.5       11.3       ?       ? 
1 1 1   49   13    5 o    150.1    3.4    0.0000   0.0000          ?        ?   225.3981  10.2163          ?        ?      150.1        3.4       ?       ? 
1 1 1   49   13    6 o    321.5    2.7    0.0000   0.0000          ?        ?  1034.4050  17.2401          ?        ?      321.5        2.7       ?       ? 
1 1 1   49   13    7 o    506.4    2.9    0.0000   0.0000          ?        ?  2565.5798  29.3720          ?        ?      506.4        2.9       ?       ? 
1 1 1   49   13    8 o     77.4    7.0    0.0000   0.0000          ?        ?    60.0210  10.8549          ?        ?       77.4        7.0       ?       ? 
1 1 1   49   13    9 o    177.4    3.4    0.0000   0.0000          ?        ?   314.7912  12.1319          ?        ?      177.4        3.4       ?       ? 
1 1 1   49   13   10 o    213.3    3.1    0.0000   0.0000          ?        ?   455.2659  13.4090          ?        ?      213.3        3.1       ?       ? 
1 1 1   49   13   11 o     30.9   12.1    0.0000   0.0000          ?        ?     5.7467  10.8549          ?        ?       30.9       12.1       ?       ? 
1 1 1   49   13   12 o    255.4    3.0    0.0000   0.0000          ?        ?   652.5691  15.3245          ?        ?      255.4        3.0       ?       ? 
1 1 1   49   13   13 o    125.5    5.1    0.0000   0.0000          ?        ?   157.7148  12.7704          ?        ?      125.5        5.1       ?       ? 
1 1 1   49   13   14 f    585.8    3.3    0.0000   0.0000          ?        ?  3433.9692  38.9498          ?        ?      585.8        3.3       ?       ? 
1 1 1   49   13   15 o    173.7    4.0    0.0000   0.0000          ?        ?   302.0207  14.0475          ?        ?      173.7        4.0       ?       ? 
1 1 1   49   13   16 o     52.3   12.9    0.0000   0.0000          ?        ?    28.7335  13.4090          ?        ?       52.3       12.9       ?       ? 
1 1 1   49   13   17 o     50.5   13.1    0.0000   0.0000          ?        ?    26.8179  13.4090          ?        ?       50.5       13.1       ?       ? 
1 1 1   49   13   18 o     93.7    7.2    0.0000   0.0000          ?        ?    88.1160  13.4090          ?        ?       93.7        7.2       ?       ? 
1 1 1   49   13   19 o    316.7    3.1    0.0000   0.0000          ?        ?  1003.7560  19.7942          ?        ?      316.7        3.1       ?       ? 
1 1 1   49   13   20 o    159.5    4.6    0.0000   0.0000          ?        ?   254.7701  14.6860          ?        ?      159.5        4.6       ?       ? 
1 1 1   49   13   21 o    148.3    4.7    0.0000   0.0000          ?        ?   220.2900  14.0475          ?        ?      148.3        4.7       ?       ? 
1 1 1   49   13   22 o    489.0    2.6    0.0000   0.0000          ?        ?  2392.5405  25.5409          ?        ?      489.0        2.6       ?       ? 
1 1 1   49   13   23 o    226.0    3.4    0.0000   0.0000          ?        ?   511.4558  15.3245          ?        ?      226.0        3.4       ?       ? 
1 1 1   49   13   24 o     92.2    8.7    0.0000   0.0000          ?        ?    85.5619  15.9630          ?        ?       92.2        8.7       ?       ? 
1 1 1   49   13   25 o    315.3    3.0    0.0000   0.0000          ?        ?   994.8167  19.1556          ?        ?      315.3        3.0       ?       ? 
1 1 1   49   13   26 o     66.5   11.0    0.0000   0.0000          ?        ?    44.6965  14.6860          ?        ?       66.5       11.0       ?       ? 
1 1 1   49   13   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49   13   28 o    152.7    4.8    0.0000   0.0000          ?        ?   233.6989  14.6860          ?        ?      152.7        4.8       ?       ? 
1 1 1   49   13   29 o    166.9    4.4    0.0000   0.0000          ?        ?   279.0340  14.6860          ?        ?      166.9        4.4       ?       ? 
1 1 1   49   13   30 o    220.9    3.8    0.0000   0.0000          ?        ?   488.4691  16.6016          ?        ?      220.9        3.8       ?       ? 
1 1 1   49   13   31 o    151.6    5.1    0.0000   0.0000          ?        ?   230.5063  15.3245          ?        ?      151.6        5.1       ?       ? 
1 1 1   49   13   32 o    173.9    4.6    0.0000   0.0000          ?        ?   303.2978  15.9630          ?        ?      173.9        4.6       ?       ? 
1 1 1   49   13   33 o     20.2   10.0    0.0000   0.0000          ?        ?   -32.5646  14.6860          ?        ?       20.2       10.0       ?       ? 
1 1 1   49   13   34 o    186.7    4.4    0.0000   0.0000          ?        ?   349.2713  16.6016          ?        ?      186.7        4.4       ?       ? 
1 1 1   49   13   35 o    100.7    7.6    0.0000   0.0000          ?        ?   102.1635  15.3245          ?        ?      100.7        7.6       ?       ? 
1 1 1   49   13   36 o    213.7    3.9    0.0000   0.0000          ?        ?   457.8200  16.6016          ?        ?      213.7        3.9       ?       ? 
1 1 1   49   13   37 o     32.4   14.0    0.0000   0.0000          ?        ?    -1.2770  16.6016          ?        ?       32.4       14.0       ?       ? 
1 1 1   49   13   38 o    128.4    6.5    0.0000   0.0000          ?        ?   166.0156  16.6016          ?        ?      128.4        6.5       ?       ? 
1 1 1   49   13   39 f    199.5    4.0    0.0000   0.0000          ?        ?   399.0760  15.9630          ?        ?      199.5        4.0       ?       ? 
1 1 1   49   13   40 o    229.5    3.8    0.0000   0.0000          ?        ?   528.0574  17.2401          ?        ?      229.5        3.8       ?       ? 
1 1 1   49   13   41 o    103.9    8.0    0.0000   0.0000          ?        ?   109.1872  16.6016          ?        ?      103.9        8.0       ?       ? 
1 1 1   49   13   42 o     39.7   14.9    0.0000   0.0000          ?        ?    12.7704  15.9630          ?        ?       39.7       14.9       ?       ? 
1 1 1   49   13   43 o    103.5    8.0    0.0000   0.0000          ?        ?   108.5487  16.6016          ?        ?      103.5        8.0       ?       ? 
1 1 1   49   14    0 o    825.7    6.7 6828.3506 110.4642  6828.3506 110.4642  6828.3506 110.4642      825.7      6.7      825.7        6.7     0.0     0.0 
1 1 1   49   14    1 o    316.2    5.1    0.0000   0.0000          ?        ?  1001.8404  32.5646          ?        ?      316.2        5.1       ?       ? 
1 1 1   49   14    2 o    338.0    3.5    0.0000   0.0000          ?        ?  1143.5923  23.6253          ?        ?      338.0        3.5       ?       ? 
1 1 1   49   14    3 o    158.9    5.4    0.0000   0.0000          ?        ?   252.8546  17.2401          ?        ?      158.9        5.4       ?       ? 
1 1 1   49   14    4 o    216.0    3.3    0.0000   0.0000          ?        ?   466.7593  14.0475          ?        ?      216.0        3.3       ?       ? 
1 1 1   49   14    5 o    183.0    3.7    0.0000   0.0000          ?        ?   335.2238  13.4090          ?        ?      183.0        3.7       ?       ? 
1 1 1   49   14    6 o     30.7   12.9    0.0000   0.0000          ?        ?     1.2770  13.4090          ?        ?       30.7       12.9       ?       ? 
1 1 1   49   14    7 o     21.0   10.3    0.0000   0.0000          ?        ?   -32.5646  15.3245          ?        ?       21.0       10.3       ?       ? 
1 1 1   49   14    8 o    221.5    3.3    0.0000   0.0000          ?        ?   491.0231  14.6860          ?        ?      221.5        3.3       ?       ? 
1 1 1   49   14    9 o    434.5    2.9    0.0000   0.0000          ?        ?  1889.3855  25.5409          ?        ?      434.5        2.9       ?       ? 
1 1 1   49   14   10 o    166.8    3.4    0.0000   0.0000          ?        ?   278.3954  11.4934          ?        ?      166.8        3.4       ?       ? 
1 1 1   49   14   11 o    269.0    2.7    0.0000   0.0000          ?        ?   724.0836  14.6860          ?        ?      269.0        2.7       ?       ? 
1 1 1   49   14   12 o    463.4    3.0    0.0000   0.0000          ?        ?  2149.2639  28.0950          ?        ?      463.4        3.0       ?       ? 
1 1 1   49   14   13 o    107.1    5.4    0.0000   0.0000          ?        ?   114.9339  11.4934          ?        ?      107.1        5.4       ?       ? 
1 1 1   49   14   14 o    350.2    2.9    0.0000   0.0000          ?        ?  1227.2385  20.4327          ?        ?      350.2        2.9       ?       ? 
1 1 1   49   14   15 o    219.9    3.3    0.0000   0.0000          ?        ?   483.9994  14.6860          ?        ?      219.9        3.3       ?       ? 
1 1 1   49   14   16 o    195.0    3.6    0.0000   0.0000          ?        ?   380.5589  14.0475          ?        ?      195.0        3.6       ?       ? 
1 1 1   49   14   17 o    149.2    4.5    0.0000   0.0000          ?        ?   222.8441  13.4090          ?        ?      149.2        4.5       ?       ? 
1 1 1   49   14   18 o    275.8    2.9    0.0000   0.0000          ?        ?   761.1177  15.9630          ?        ?      275.8        2.9       ?       ? 
1 1 1   49   14   19 o    122.4    5.2    0.0000   0.0000          ?        ?   150.0526  12.7704          ?        ?      122.4        5.2       ?       ? 
1 1 1   49   14   20 o    162.3    4.3    0.0000   0.0000          ?        ?   263.7094  14.0475          ?        ?      162.3        4.3       ?       ? 
1 1 1   49   14   21 o    406.1    2.8    0.0000   0.0000          ?        ?  1650.5784  22.3483          ?        ?      406.1        2.8       ?       ? 
1 1 1   49   14   22 o    220.2    3.6    0.0000   0.0000          ?        ?   485.2764  15.9630          ?        ?      220.2        3.6       ?       ? 
1 1 1   49   14   23 o    206.4    3.6    0.0000   0.0000          ?        ?   426.5325  14.6860          ?        ?      206.4        3.6       ?       ? 
1 1 1   49   14   24 o    292.2    3.0    0.0000   0.0000          ?        ?   854.3420  17.2401          ?        ?      292.2        3.0       ?       ? 
1 1 1   49   14   25 o     34.7   13.7    0.0000   0.0000          ?        ?     7.0237  14.0475          ?        ?       34.7       13.7       ?       ? 
1 1 1   49   14   26 o    245.4    3.4    0.0000   0.0000          ?        ?   602.7644  16.6016          ?        ?      245.4        3.4       ?       ? 
1 1 1   49   14   27 o    189.4    4.2    0.0000   0.0000          ?        ?   359.4877  15.9630          ?        ?      189.4        4.2       ?       ? 
1 1 1   49   14   28 o    192.8    4.0    0.0000   0.0000          ?        ?   372.2581  15.3245          ?        ?      192.8        4.0       ?       ? 
1 1 1   49   14   29 o    189.1    4.2    0.0000   0.0000          ?        ?   358.2106  15.9630          ?        ?      189.1        4.2       ?       ? 
1 1 1   49   14   30 o    247.4    3.4    0.0000   0.0000          ?        ?   612.9808  16.6016          ?        ?      247.4        3.4       ?       ? 
1 1 1   49   14   31 o     47.4   14.7    0.0000   0.0000          ?        ?    22.9868  15.3245          ?        ?       47.4       14.7       ?       ? 
1 1 1   49   14   32 o     71.9   10.7    0.0000   0.0000          ?        ?    52.3588  15.3245          ?        ?       71.9       10.7       ?       ? 
1 1 1   49   14   33 o    100.0    8.0    0.0000   0.0000          ?        ?   100.8864  15.9630          ?        ?      100.0        8.0       ?       ? 
1 1 1   49   14   34 o    268.2    3.3    0.0000   0.0000          ?        ?   720.2524  17.8786          ?        ?      268.2        3.3       ?       ? 
1 1 1   49   14   35 o     25.3   12.0    0.0000   0.0000          ?        ?   -20.4327  16.6016          ?        ?       25.3       12.0       ?       ? 
1 1 1   49   14   36 o    168.1    4.7    0.0000   0.0000          ?        ?   283.5036  15.9630          ?        ?      168.1        4.7       ?       ? 
1 1 1   49   14   37 o     81.3    9.8    0.0000   0.0000          ?        ?    67.0448  15.9630          ?        ?       81.3        9.8       ?       ? 
1 1 1   49   14   38 o    173.8    5.0    0.0000   0.0000          ?        ?   303.2978  17.2401          ?        ?      173.8        5.0       ?       ? 
1 1 1   49   14   39 f     22.5   11.0    0.0000   0.0000          ?        ?   -28.0950  15.9630          ?        ?       22.5       11.0       ?       ? 
1 1 1   49   14   40 o     25.4   12.1    0.0000   0.0000          ?        ?   -19.7942  16.6016          ?        ?       25.4       12.1       ?       ? 
1 1 1   49   14   41 o     91.4    9.1    0.0000   0.0000          ?        ?    84.9234  16.6016          ?        ?       91.4        9.1       ?       ? 
1 1 1   49   14   42 f     81.0   10.3    0.0000   0.0000          ?        ?    67.0448  16.6016          ?        ?       81.0       10.3       ?       ? 
1 1 1   49   15    0 o    242.1    6.2  588.0784  30.0105   588.0784  30.0105   588.0784  30.0105      242.1      6.2      242.1        6.2     0.0     0.0 
1 1 1   49   15    1 o    250.8    4.1    0.0000   0.0000          ?        ?   629.5823  20.4327          ?        ?      250.8        4.1       ?       ? 
1 1 1   49   15    2 o    153.3    6.2    0.0000   0.0000          ?        ?   235.6145  19.1556          ?        ?      153.3        6.2       ?       ? 
1 1 1   49   15    3 o    253.1    4.5    0.0000   0.0000          ?        ?   641.7142  22.9868          ?        ?      253.1        4.5       ?       ? 
1 1 1   49   15    4 o    311.1    4.5    0.0000   0.0000          ?        ?   969.2759  28.0950          ?        ?      311.1        4.5       ?       ? 
1 1 1   49   15    5 o    190.9    3.7    0.0000   0.0000          ?        ?   364.5958  14.0475          ?        ?      190.9        3.7       ?       ? 
1 1 1   49   15    6 o     89.9    6.4    0.0000   0.0000          ?        ?    81.0922  11.4934          ?        ?       89.9        6.4       ?       ? 
1 1 1   49   15    7 o    114.6    5.6    0.0000   0.0000          ?        ?   131.5355  12.7704          ?        ?      114.6        5.6       ?       ? 
1 1 1   49   15    8 o    180.9    4.1    0.0000   0.0000          ?        ?   327.5616  14.6860          ?        ?      180.9        4.1       ?       ? 
1 1 1   49   15    9 o     25.6   11.8    0.0000   0.0000          ?        ?   -10.8549  14.0475          ?        ?       25.6       11.8       ?       ? 
1 1 1   49   15   10 o    162.3    4.5    0.0000   0.0000          ?        ?   263.7094  14.6860          ?        ?      162.3        4.5       ?       ? 
1 1 1   49   15   11 o    107.1    5.4    0.0000   0.0000          ?        ?   114.9339  11.4934          ?        ?      107.1        5.4       ?       ? 
1 1 1   49   15   12 f    168.7    3.8    0.0000   0.0000          ?        ?   284.7806  12.7704          ?        ?      168.7        3.8       ?       ? 
1 1 1   49   15   13 o    104.7    5.2    0.0000   0.0000          ?        ?   109.8257  10.8549          ?        ?      104.7        5.2       ?       ? 
1 1 1   49   15   14 o     35.5   12.7    0.0000   0.0000          ?        ?    10.8549  11.4934          ?        ?       35.5       12.7       ?       ? 
1 1 1   49   15   15 o    103.1    5.6    0.0000   0.0000          ?        ?   106.6331  11.4934          ?        ?      103.1        5.6       ?       ? 
1 1 1   49   15   16 o    295.9    3.0    0.0000   0.0000          ?        ?   876.0516  17.8786          ?        ?      295.9        3.0       ?       ? 
1 1 1   49   15   17 o    173.7    3.9    0.0000   0.0000          ?        ?   302.0207  13.4090          ?        ?      173.7        3.9       ?       ? 
1 1 1   49   15   18 o    161.5    4.2    0.0000   0.0000          ?        ?   261.1554  13.4090          ?        ?      161.5        4.2       ?       ? 
1 1 1   49   15   19 o    275.0    2.9    0.0000   0.0000          ?        ?   756.6481  15.9630          ?        ?      275.0        2.9       ?       ? 
1 1 1   49   15   20 o    278.2    3.0    0.0000   0.0000          ?        ?   774.5267  16.6016          ?        ?      278.2        3.0       ?       ? 
1 1 1   49   15   21 o    119.7    5.6    0.0000   0.0000          ?        ?   143.6674  13.4090          ?        ?      119.7        5.6       ?       ? 
1 1 1   49   15   22 o    217.4    3.5    0.0000   0.0000          ?        ?   473.1445  15.3245          ?        ?      217.4        3.5       ?       ? 
1 1 1   49   15   23 o    145.4    5.3    0.0000   0.0000          ?        ?   211.9892  15.3245          ?        ?      145.4        5.3       ?       ? 
1 1 1   49   15   24 o     57.2   12.6    0.0000   0.0000          ?        ?    34.4802  14.0475          ?        ?       57.2       12.6       ?       ? 
1 1 1   49   15   25 o    143.0    4.9    0.0000   0.0000          ?        ?   204.9654  14.0475          ?        ?      143.0        4.9       ?       ? 
1 1 1   49   15   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49   15   27 o    203.7    4.1    0.0000   0.0000          ?        ?   415.6776  16.6016          ?        ?      203.7        4.1       ?       ? 
1 1 1   49   15   28 o     25.6   12.0    0.0000   0.0000          ?        ?   -17.2401  15.9630          ?        ?       25.6       12.0       ?       ? 
1 1 1   49   15   29 o    281.8    3.1    0.0000   0.0000          ?        ?   794.9594  17.2401          ?        ?      281.8        3.1       ?       ? 
1 1 1   49   15   30 o    175.6    4.4    0.0000   0.0000          ?        ?   309.0445  15.3245          ?        ?      175.6        4.4       ?       ? 
1 1 1   49   15   31 o    110.1    7.0    0.0000   0.0000          ?        ?   121.9576  15.3245          ?        ?      110.1        7.0       ?       ? 
1 1 1   49   15   32 o    240.9    3.4    0.0000   0.0000          ?        ?   581.0547  16.6016          ?        ?      240.9        3.4       ?       ? 
1 1 1   49   15   33 o     79.4   10.1    0.0000   0.0000          ?        ?    63.8522  15.9630          ?        ?       79.4       10.1       ?       ? 
1 1 1   49   15   34 o    187.5    4.3    0.0000   0.0000          ?        ?   352.4639  15.9630          ?        ?      187.5        4.3       ?       ? 
1 1 1   49   15   35 o    289.8    3.2    0.0000   0.0000          ?        ?   840.9330  18.5171          ?        ?      289.8        3.2       ?       ? 
1 1 1   49   15   36 o    225.2    3.5    0.0000   0.0000          ?        ?   508.2632  15.9630          ?        ?      225.2        3.5       ?       ? 
1 1 1   49   15   37 o    223.7    4.0    0.0000   0.0000          ?        ?   501.8780  17.8786          ?        ?      223.7        4.0       ?       ? 
1 1 1   49   15   38 o    195.8    4.1    0.0000   0.0000          ?        ?   384.3900  15.9630          ?        ?      195.8        4.1       ?       ? 
1 1 1   49   15   39 o    159.2    5.0    0.0000   0.0000          ?        ?   254.7701  15.9630          ?        ?      159.2        5.0       ?       ? 
1 1 1   49   15   40 o     92.4    9.0    0.0000   0.0000          ?        ?    86.8389  16.6016          ?        ?       92.4        9.0       ?       ? 
1 1 1   49   16    0 o     13.6   10.1  -72.1529  21.7097   -72.1529  21.7097   -72.1529  21.7097       13.6     10.1       13.6       10.1     0.0     0.0 
1 1 1   49   16    1 o    139.2    5.7    0.0000   0.0000          ?        ?   194.1106  15.9630          ?        ?      139.2        5.7       ?       ? 
1 1 1   49   16    2 o    102.7    7.8    0.0000   0.0000          ?        ?   105.9946  15.9630          ?        ?      102.7        7.8       ?       ? 
1 1 1   49   16    3 o    111.0    8.9    0.0000   0.0000          ?        ?   123.8732  19.7942          ?        ?      111.0        8.9       ?       ? 
1 1 1   49   16    4 o    166.6    5.9    0.0000   0.0000          ?        ?   278.3954  19.7942          ?        ?      166.6        5.9       ?       ? 
1 1 1   49   16    5 f    118.5    7.8    0.0000   0.0000          ?        ?   141.1133  18.5171          ?        ?      118.5        7.8       ?       ? 
1 1 1   49   16    6 o    550.3    5.0    0.0000   0.0000          ?        ?  3034.2549  55.5514          ?        ?      550.3        5.0       ?       ? 
1 1 1   49   16    7 o    170.7    4.3    0.0000   0.0000          ?        ?   291.8044  14.6860          ?        ?      170.7        4.3       ?       ? 
1 1 1   49   16    8 o    333.6    3.2    0.0000   0.0000          ?        ?  1113.5817  21.0712          ?        ?      333.6        3.2       ?       ? 
1 1 1   49   16    9 o    411.4    3.4    0.0000   0.0000          ?        ?  1693.9978  28.0950          ?        ?      411.4        3.4       ?       ? 
1 1 1   49   16   10 o    528.8    3.9    0.0000   0.0000          ?        ?  2799.9172  40.8654          ?        ?      528.8        3.9       ?       ? 
1 1 1   49   16   11 o    133.8    5.2    0.0000   0.0000          ?        ?   179.4246  14.0475          ?        ?      133.8        5.2       ?       ? 
1 1 1   49   16   12 o    250.3    3.6    0.0000   0.0000          ?        ?   627.0282  17.8786          ?        ?      250.3        3.6       ?       ? 
1 1 1   49   16   13 o    277.3    3.1    0.0000   0.0000          ?        ?   769.4186  17.2401          ?        ?      277.3        3.1       ?       ? 
1 1 1   49   16   14 o     57.4   11.5    0.0000   0.0000          ?        ?    34.4802  12.7704          ?        ?       57.4       11.5       ?       ? 
1 1 1   49   16   15 o     97.0    6.9    0.0000   0.0000          ?        ?    94.5012  13.4090          ?        ?       97.0        6.9       ?       ? 
1 1 1   49   16   16 o    221.7    3.7    0.0000   0.0000          ?        ?   492.3002  16.6016          ?        ?      221.7        3.7       ?       ? 
1 1 1   49   16   17 o    217.7    3.5    0.0000   0.0000          ?        ?   474.4216  15.3245          ?        ?      217.7        3.5       ?       ? 
1 1 1   49   16   18 o    383.2    3.0    0.0000   0.0000          ?        ?  1469.8767  22.9868          ?        ?      383.2        3.0       ?       ? 
1 1 1   49   16   19 o    160.5    4.2    0.0000   0.0000          ?        ?   257.9627  13.4090          ?        ?      160.5        4.2       ?       ? 
1 1 1   49   16   20 o    134.7    5.0    0.0000   0.0000          ?        ?   181.9787  13.4090          ?        ?      134.7        5.0       ?       ? 
1 1 1   49   16   21 o    203.6    3.9    0.0000   0.0000          ?        ?   415.0391  15.9630          ?        ?      203.6        3.9       ?       ? 
1 1 1   49   16   22 o     72.9    9.2    0.0000   0.0000          ?        ?    53.6358  13.4090          ?        ?       72.9        9.2       ?       ? 
1 1 1   49   16   23 o     21.5   10.4    0.0000   0.0000          ?        ?   -23.6253  14.0475          ?        ?       21.5       10.4       ?       ? 
1 1 1   49   16   24 o     36.0   13.8    0.0000   0.0000          ?        ?     8.9393  14.0475          ?        ?       36.0       13.8       ?       ? 
1 1 1   49   16   25 o    105.7    6.9    0.0000   0.0000          ?        ?   112.3798  14.6860          ?        ?      105.7        6.9       ?       ? 
1 1 1   49   16   26 o    113.3    6.8    0.0000   0.0000          ?        ?   128.9814  15.3245          ?        ?      113.3        6.8       ?       ? 
1 1 1   49   16   27 o    390.1    2.7    0.0000   0.0000          ?        ?  1522.8740  21.0712          ?        ?      390.1        2.7       ?       ? 
1 1 1   49   16   28 o    241.3    3.4    0.0000   0.0000          ?        ?   582.9703  16.6016          ?        ?      241.3        3.4       ?       ? 
1 1 1   49   16   29 o    368.0    2.7    0.0000   0.0000          ?        ?  1355.5814  19.7942          ?        ?      368.0        2.7       ?       ? 
1 1 1   49   16   30 o     48.8   14.2    0.0000   0.0000          ?        ?    24.9023  14.6860          ?        ?       48.8       14.2       ?       ? 
1 1 1   49   16   31 o    114.6    6.7    0.0000   0.0000          ?        ?   132.1740  15.3245          ?        ?      114.6        6.7       ?       ? 
1 1 1   49   16   32 o    188.2    4.1    0.0000   0.0000          ?        ?   355.0180  15.3245          ?        ?      188.2        4.1       ?       ? 
1 1 1   49   16   33 o    226.7    3.4    0.0000   0.0000          ?        ?   514.6484  15.3245          ?        ?      226.7        3.4       ?       ? 
1 1 1   49   16   34 o    148.1    5.2    0.0000   0.0000          ?        ?   220.2900  15.3245          ?        ?      148.1        5.2       ?       ? 
1 1 1   49   16   35 o     27.7   12.5    0.0000   0.0000          ?        ?    -7.0237  14.6860          ?        ?       27.7       12.5       ?       ? 
1 1 1   49   16   36 o    145.4    5.7    0.0000   0.0000          ?        ?   212.6277  16.6016          ?        ?      145.4        5.7       ?       ? 
1 1 1   49   16   37 o     58.2   13.4    0.0000   0.0000          ?        ?    36.3957  15.3245          ?        ?       58.2       13.4       ?       ? 
1 1 1   49   16   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49   16   39 o    153.9    5.2    0.0000   0.0000          ?        ?   238.1686  15.9630          ?        ?      153.9        5.2       ?       ? 
1 1 1   49   17    0 o     21.3   15.1  -24.9023  24.2638   -24.9023  24.2638   -24.9023  24.2638       21.3     15.1       21.3       15.1     0.0     0.0 
1 1 1   49   17    1 o     80.4   10.3    0.0000   0.0000          ?        ?    65.1292  16.6016          ?        ?       80.4       10.3       ?       ? 
1 1 1   49   17    2 o    176.7    5.1    0.0000   0.0000          ?        ?   312.8756  17.8786          ?        ?      176.7        5.1       ?       ? 
1 1 1   49   17    3 f    403.0    3.5    0.0000   0.0000          ?        ?  1625.6761  28.0950          ?        ?      403.0        3.5       ?       ? 
1 1 1   49   17    4 o    369.8    3.9    0.0000   0.0000          ?        ?  1368.9904  28.7335          ?        ?      369.8        3.9       ?       ? 
1 1 1   49   17    5 o    178.6    5.9    0.0000   0.0000          ?        ?   319.8993  21.0712          ?        ?      178.6        5.9       ?       ? 
1 1 1   49   17    6 o    209.7    5.0    0.0000   0.0000          ?        ?   440.5799  21.0712          ?        ?      209.7        5.0       ?       ? 
1 1 1   49   17    7 o    138.1    6.9    0.0000   0.0000          ?        ?   191.5565  19.1556          ?        ?      138.1        6.9       ?       ? 
1 1 1   49   17    8 o    219.3    4.9    0.0000   0.0000          ?        ?   482.0838  21.7097          ?        ?      219.3        4.9       ?       ? 
1 1 1   49   17    9 o     68.9   10.2    0.0000   0.0000          ?        ?    47.8891  14.0475          ?        ?       68.9       10.2       ?       ? 
1 1 1   49   17   10 o    323.8    3.5    0.0000   0.0000          ?        ?  1049.7295  22.3483          ?        ?      323.8        3.5       ?       ? 
1 1 1   49   17   11 o     39.9   13.8    0.0000   0.0000          ?        ?    14.6860  13.4090          ?        ?       39.9       13.8       ?       ? 
1 1 1   49   17   12 o    279.4    3.1    0.0000   0.0000          ?        ?   781.5505  17.2401          ?        ?      279.4        3.1       ?       ? 
1 1 1   49   17   13 o    158.8    4.8    0.0000   0.0000          ?        ?   252.8546  15.3245          ?        ?      158.8        4.8       ?       ? 
1 1 1   49   17   14 o    111.7    6.3    0.0000   0.0000          ?        ?   125.1502  14.0475          ?        ?      111.7        6.3       ?       ? 
1 1 1   49   17   15 o     32.3   12.2    0.0000   0.0000          ?        ?     7.6623  10.8549          ?        ?       32.3       12.2       ?       ? 
1 1 1   49   17   16 f    189.1    3.7    0.0000   0.0000          ?        ?   358.2106  14.0475          ?        ?      189.1        3.7       ?       ? 
1 1 1   49   17   17 o    487.4    3.2    0.0000   0.0000          ?        ?  2377.8545  31.2876          ?        ?      487.4        3.2       ?       ? 
1 1 1   49   17   18 f    118.0    6.8    0.0000   0.0000          ?        ?   139.8362  15.9630          ?        ?      118.0        6.8       ?       ? 
1 1 1   49   17   19 o    323.3    3.1    0.0000   0.0000          ?        ?  1046.5369  19.7942          ?        ?      323.3        3.1       ?       ? 
1 1 1   49   17   20 o    182.8    3.7    0.0000   0.0000          ?        ?   334.5853  13.4090          ?        ?      182.8        3.7       ?       ? 
1 1 1   49   17   21 o    328.6    2.8    0.0000   0.0000          ?        ?  1081.0171  18.5171          ?        ?      328.6        2.8       ?       ? 
1 1 1   49   17   22 o     92.9    7.6    0.0000   0.0000          ?        ?    86.8389  14.0475          ?        ?       92.9        7.6       ?       ? 
1 1 1   49   17   23 o    265.6    3.1    0.0000   0.0000          ?        ?   706.2049  16.6016          ?        ?      265.6        3.1       ?       ? 
1 1 1   49   17   24 o    206.8    3.7    0.0000   0.0000          ?        ?   428.4480  15.3245          ?        ?      206.8        3.7       ?       ? 
1 1 1   49   17   25 o    153.5    5.0    0.0000   0.0000          ?        ?   236.2530  15.3245          ?        ?      153.5        5.0       ?       ? 
1 1 1   49   17   26 o    331.3    3.0    0.0000   0.0000          ?        ?  1098.8958  19.7942          ?        ?      331.3        3.0       ?       ? 
1 1 1   49   17   27 o    292.7    2.9    0.0000   0.0000          ?        ?   857.5345  17.2401          ?        ?      292.7        2.9       ?       ? 
1 1 1   49   17   28 o     27.8   12.5    0.0000   0.0000          ?        ?    -7.0237  14.6860          ?        ?       27.8       12.5       ?       ? 
1 1 1   49   17   29 o    129.5    6.2    0.0000   0.0000          ?        ?   168.5697  15.9630          ?        ?      129.5        6.2       ?       ? 
1 1 1   49   17   30 o    161.5    4.7    0.0000   0.0000          ?        ?   261.7939  15.3245          ?        ?      161.5        4.7       ?       ? 
1 1 1   49   17   31 o     88.5    8.3    0.0000   0.0000          ?        ?    79.1767  14.6860          ?        ?       88.5        8.3       ?       ? 
1 1 1   49   17   32 o    181.8    4.2    0.0000   0.0000          ?        ?   331.3927  15.3245          ?        ?      181.8        4.2       ?       ? 
1 1 1   49   17   33 o     98.4    7.5    0.0000   0.0000          ?        ?    97.6938  14.6860          ?        ?       98.4        7.5       ?       ? 
1 1 1   49   17   34 o     99.3    7.7    0.0000   0.0000          ?        ?    99.6094  15.3245          ?        ?       99.3        7.7       ?       ? 
1 1 1   49   17   35 o    285.5    3.1    0.0000   0.0000          ?        ?   816.6692  17.8786          ?        ?      285.5        3.1       ?       ? 
1 1 1   49   17   36 o    255.3    3.4    0.0000   0.0000          ?        ?   653.2076  17.2401          ?        ?      255.3        3.4       ?       ? 
1 1 1   49   17   37 o    278.1    3.3    0.0000   0.0000          ?        ?   775.1653  18.5171          ?        ?      278.1        3.3       ?       ? 
1 1 1   49   18    0 o    365.5    6.6 1339.6184  47.8891  1339.6184  47.8891  1339.6184  47.8891      365.5      6.6      365.5        6.6     0.0     0.0 
1 1 1   49   18    1 o    246.4    4.7    0.0000   0.0000          ?        ?   608.5111  22.9868          ?        ?      246.4        4.7       ?       ? 
1 1 1   49   18    2 o    307.4    4.4    0.0000   0.0000          ?        ?   946.2890  26.8179          ?        ?      307.4        4.4       ?       ? 
1 1 1   49   18    3 o    469.1    5.2    0.0000   0.0000          ?        ?  2206.0923  49.1662          ?        ?      469.1        5.2       ?       ? 
1 1 1   49   18    4 o    325.0    4.1    0.0000   0.0000          ?        ?  1058.0303  26.8179          ?        ?      325.0        4.1       ?       ? 
1 1 1   49   18    5 f    335.2    4.2    0.0000   0.0000          ?        ?  1125.0751  28.0950          ?        ?      335.2        4.2       ?       ? 
1 1 1   49   18    6 o    433.3    4.3    0.0000   0.0000          ?        ?  1880.4462  37.0343          ?        ?      433.3        4.3       ?       ? 
1 1 1   49   18    7 o    222.0    4.3    0.0000   0.0000          ?        ?   493.5772  19.1556          ?        ?      222.0        4.3       ?       ? 
1 1 1   49   18    8 o    421.6    4.3    0.0000   0.0000          ?        ?  1780.8368  36.3957          ?        ?      421.6        4.3       ?       ? 
1 1 1   49   18    9 o     96.7   10.2    0.0000   0.0000          ?        ?    94.5012  19.7942          ?        ?       96.7       10.2       ?       ? 
1 1 1   49   18   10 o    186.4    3.9    0.0000   0.0000          ?        ?   347.9943  14.6860          ?        ?      186.4        3.9       ?       ? 
1 1 1   49   18   11 o    227.7    3.4    0.0000   0.0000          ?        ?   519.1181  15.3245          ?        ?      227.7        3.4       ?       ? 
1 1 1   49   18   12 o    359.8    3.4    0.0000   0.0000          ?        ?  1296.1989  24.2638          ?        ?      359.8        3.4       ?       ? 
1 1 1   49   18   13 o     57.7   12.5    0.0000   0.0000          ?        ?    35.1187  14.0475          ?        ?       57.7       12.5       ?       ? 
1 1 1   49   18   14 o    179.2    4.6    0.0000   0.0000          ?        ?   321.8149  16.6016          ?        ?      179.2        4.6       ?       ? 
1 1 1   49   18   15 o    142.9    6.0    0.0000   0.0000          ?        ?   204.9654  17.2401          ?        ?      142.9        6.0       ?       ? 
1 1 1   49   18   16 o    116.6    7.1    0.0000   0.0000          ?        ?   136.6436  16.6016          ?        ?      116.6        7.1       ?       ? 
1 1 1   49   18   17 o     59.0    9.2    0.0000   0.0000          ?        ?    35.1187  10.8549          ?        ?       59.0        9.2       ?       ? 
1 1 1   49   18   18 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49   18   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49   18   20 o    145.4    5.1    0.0000   0.0000          ?        ?   211.9892  14.6860          ?        ?      145.4        5.1       ?       ? 
1 1 1   49   18   21 o    189.3    3.9    0.0000   0.0000          ?        ?   358.8492  14.6860          ?        ?      189.3        3.9       ?       ? 
1 1 1   49   18   22 o    252.9    3.3    0.0000   0.0000          ?        ?   640.4372  16.6016          ?        ?      252.9        3.3       ?       ? 
1 1 1   49   18   23 o     96.8    7.9    0.0000   0.0000          ?        ?    94.5012  15.3245          ?        ?       96.8        7.9       ?       ? 
1 1 1   49   18   24 o     17.5    8.8    0.0000   0.0000          ?        ?   -38.9498  13.4090          ?        ?       17.5        8.8       ?       ? 
1 1 1   49   18   25 o     19.1    9.5    0.0000   0.0000          ?        ?   -34.4802  14.0475          ?        ?       19.1        9.5       ?       ? 
1 1 1   49   18   26 o    182.3    4.2    0.0000   0.0000          ?        ?   333.3083  15.3245          ?        ?      182.3        4.2       ?       ? 
1 1 1   49   18   27 o    140.2    5.0    0.0000   0.0000          ?        ?   197.3032  14.0475          ?        ?      140.2        5.0       ?       ? 
1 1 1   49   18   28 o    127.1    5.5    0.0000   0.0000          ?        ?   162.1845  14.0475          ?        ?      127.1        5.5       ?       ? 
1 1 1   49   18   29 o     19.1    9.5    0.0000   0.0000          ?        ?   -38.3113  14.6860          ?        ?       19.1        9.5       ?       ? 
1 1 1   49   18   30 o    162.9    4.5    0.0000   0.0000          ?        ?   266.2635  14.6860          ?        ?      162.9        4.5       ?       ? 
1 1 1   49   18   31 o     98.7    7.8    0.0000   0.0000          ?        ?    98.3323  15.3245          ?        ?       98.7        7.8       ?       ? 
1 1 1   49   18   32 o    173.1    4.4    0.0000   0.0000          ?        ?   300.7437  15.3245          ?        ?      173.1        4.4       ?       ? 
1 1 1   49   18   33 o    167.9    4.6    0.0000   0.0000          ?        ?   282.8651  15.3245          ?        ?      167.9        4.6       ?       ? 
1 1 1   49   18   34 o    173.4    4.6    0.0000   0.0000          ?        ?   302.0207  15.9630          ?        ?      173.4        4.6       ?       ? 
1 1 1   49   18   35 o    340.1    2.7    0.0000   0.0000          ?        ?  1158.2782  18.5171          ?        ?      340.1        2.7       ?       ? 
1 1 1   49   19    0 o     91.2   15.1   89.3930  25.5409    89.3930  25.5409    89.3930  25.5409       91.2     15.1       91.2       15.1     0.0     0.0 
1 1 1   49   19    1 o    232.5    5.5    0.0000   0.0000          ?        ?   542.1049  25.5409          ?        ?      232.5        5.5       ?       ? 
1 1 1   49   19    2 f    194.0    5.1    0.0000   0.0000          ?        ?   377.3663  19.7942          ?        ?      194.0        5.1       ?       ? 
1 1 1   49   19    3 o    305.1    4.2    0.0000   0.0000          ?        ?   932.2416  25.5409          ?        ?      305.1        4.2       ?       ? 
1 1 1   49   19    4 o    456.8    4.1    0.0000   0.0000          ?        ?  2089.8811  37.6728          ?        ?      456.8        4.1       ?       ? 
1 1 1   49   19    5 o    272.7    4.2    0.0000   0.0000          ?        ?   745.1547  22.9868          ?        ?      272.7        4.2       ?       ? 
1 1 1   49   19    6 o    183.3    5.6    0.0000   0.0000          ?        ?   337.1394  20.4327          ?        ?      183.3        5.6       ?       ? 
1 1 1   49   19    7 o     70.8   14.5    0.0000   0.0000          ?        ?    52.9973  19.7942          ?        ?       70.8       14.5       ?       ? 
1 1 1   49   19    8 o    150.9    6.3    0.0000   0.0000          ?        ?   228.5907  19.1556          ?        ?      150.9        6.3       ?       ? 
1 1 1   49   19    9 o     51.1   16.5    0.0000   0.0000          ?        ?    26.1794  19.1556          ?        ?       51.1       16.5       ?       ? 
1 1 1   49   19   10 o    183.0    5.6    0.0000   0.0000          ?        ?   335.8624  20.4327          ?        ?      183.0        5.6       ?       ? 
1 1 1   49   19   11 o    219.7    3.8    0.0000   0.0000          ?        ?   483.3608  16.6016          ?        ?      219.7        3.8       ?       ? 
1 1 1   49   19   12 o    222.7    3.6    0.0000   0.0000          ?        ?   496.7698  15.9630          ?        ?      222.7        3.6       ?       ? 
1 1 1   49   19   13 o    201.4    4.0    0.0000   0.0000          ?        ?   406.0997  15.9630          ?        ?      201.4        4.0       ?       ? 
1 1 1   49   19   14 o    298.9    3.5    0.0000   0.0000          ?        ?   894.5688  21.0712          ?        ?      298.9        3.5       ?       ? 
1 1 1   49   19   15 o     41.0   14.7    0.0000   0.0000          ?        ?    14.6860  15.3245          ?        ?       41.0       14.7       ?       ? 
1 1 1   49   19   16 o    270.4    3.7    0.0000   0.0000          ?        ?   732.3843  19.7942          ?        ?      270.4        3.7       ?       ? 
1 1 1   49   19   17 o     36.0   14.5    0.0000   0.0000          ?        ?     6.3852  15.9630          ?        ?       36.0       14.5       ?       ? 
1 1 1   49   19   18 o    116.7    4.6    0.0000   0.0000          ?        ?   136.6436  10.8549          ?        ?      116.7        4.6       ?       ? 
1 1 1   49   19   19 o    158.7    3.8    0.0000   0.0000          ?        ?   252.2160  12.1319          ?        ?      158.7        3.8       ?       ? 
1 1 1   49   19   20 o     46.1   12.7    0.0000   0.0000          ?        ?    22.3483  12.1319          ?        ?       46.1       12.7       ?       ? 
1 1 1   49   19   21 o    197.5    3.4    0.0000   0.0000          ?        ?   390.7752  13.4090          ?        ?      197.5        3.4       ?       ? 
1 1 1   49   19   22 o    268.2    3.0    0.0000   0.0000          ?        ?   720.2524  15.9630          ?        ?      268.2        3.0       ?       ? 
1 1 1   49   19   23 o    187.3    4.3    0.0000   0.0000          ?        ?   351.8254  15.9630          ?        ?      187.3        4.3       ?       ? 
1 1 1   49   19   24 o     27.0   12.3    0.0000   0.0000          ?        ?    -8.9393  14.6860          ?        ?       27.0       12.3       ?       ? 
1 1 1   49   19   25 o    123.2    6.2    0.0000   0.0000          ?        ?   152.6067  15.3245          ?        ?      123.2        6.2       ?       ? 
1 1 1   49   19   26 f     60.6   12.5    0.0000   0.0000          ?        ?    38.9498  14.6860          ?        ?       60.6       12.5       ?       ? 
1 1 1   49   19   27 o    208.1    4.0    0.0000   0.0000          ?        ?   434.1947  16.6016          ?        ?      208.1        4.0       ?       ? 
1 1 1   49   19   28 o    154.0    5.2    0.0000   0.0000          ?        ?   238.1686  15.9630          ?        ?      154.0        5.2       ?       ? 
1 1 1   49   19   29 o    103.8    6.8    0.0000   0.0000          ?        ?   108.5487  14.0475          ?        ?      103.8        6.8       ?       ? 
1 1 1   49   19   30 o    177.1    4.3    0.0000   0.0000          ?        ?   314.7912  15.3245          ?        ?      177.1        4.3       ?       ? 
1 1 1   49   19   31 o     96.7    7.3    0.0000   0.0000          ?        ?    94.5012  14.0475          ?        ?       96.7        7.3       ?       ? 
1 1 1   49   19   32 o     26.0   12.1    0.0000   0.0000          ?        ?   -13.4090  15.3245          ?        ?       26.0       12.1       ?       ? 
1 1 1   49   19   33 o    112.2    6.5    0.0000   0.0000          ?        ?   127.0658  14.6860          ?        ?      112.2        6.5       ?       ? 
1 1 1   49   20    0 o     41.7   21.6   26.1794  22.9868    26.1794  22.9868    26.1794  22.9868       41.7     21.6       41.7       21.6     0.0     0.0 
1 1 1   49   20    1 o    154.7    5.8    0.0000   0.0000          ?        ?   240.0841  17.8786          ?        ?      154.7        5.8       ?       ? 
1 1 1   49   20    2 o    119.0    7.2    0.0000   0.0000          ?        ?   142.3903  17.2401          ?        ?      119.0        7.2       ?       ? 
1 1 1   49   20    3 o    292.5    4.0    0.0000   0.0000          ?        ?   856.8960  23.6253          ?        ?      292.5        4.0       ?       ? 
1 1 1   49   20    4 o    323.6    3.7    0.0000   0.0000          ?        ?  1048.4525  24.2638          ?        ?      323.6        3.7       ?       ? 
1 1 1   49   20    5 o    214.6    4.8    0.0000   0.0000          ?        ?   461.6512  20.4327          ?        ?      214.6        4.8       ?       ? 
1 1 1   49   20    6 o    159.1    6.2    0.0000   0.0000          ?        ?   254.1316  19.7942          ?        ?      159.1        6.2       ?       ? 
1 1 1   49   20    7 o    287.5    4.8    0.0000   0.0000          ?        ?   828.8011  27.4564          ?        ?      287.5        4.8       ?       ? 
1 1 1   49   20    8 o    160.4    6.6    0.0000   0.0000          ?        ?   258.6013  21.0712          ?        ?      160.4        6.6       ?       ? 
1 1 1   49   20    9 o    216.2    5.0    0.0000   0.0000          ?        ?   468.6749  21.7097          ?        ?      216.2        5.0       ?       ? 
1 1 1   49   20   10 f    121.8    7.6    0.0000   0.0000          ?        ?   149.4141  18.5171          ?        ?      121.8        7.6       ?       ? 
1 1 1   49   20   11 o    334.8    4.2    0.0000   0.0000          ?        ?  1123.1595  28.0950          ?        ?      334.8        4.2       ?       ? 
1 1 1   49   20   12 o    147.5    7.6    0.0000   0.0000          ?        ?   219.0129  22.3483          ?        ?      147.5        7.6       ?       ? 
1 1 1   49   20   13 o    186.7    3.8    0.0000   0.0000          ?        ?   349.2713  14.0475          ?        ?      186.7        3.8       ?       ? 
1 1 1   49   20   14 f    152.7    4.8    0.0000   0.0000          ?        ?   233.6989  14.6860          ?        ?      152.7        4.8       ?       ? 
1 1 1   49   20   15 o    272.7    3.3    0.0000   0.0000          ?        ?   744.5162  17.8786          ?        ?      272.7        3.3       ?       ? 
1 1 1   49   20   16 o    228.0    3.9    0.0000   0.0000          ?        ?   521.0336  17.8786          ?        ?      228.0        3.9       ?       ? 
1 1 1   49   20   17 f    166.6    4.8    0.0000   0.0000          ?        ?   278.3954  15.9630          ?        ?      166.6        4.8       ?       ? 
1 1 1   49   20   18 o    161.9    5.1    0.0000   0.0000          ?        ?   263.0709  16.6016          ?        ?      161.9        5.1       ?       ? 
1 1 1   49   20   19 o    158.9    5.4    0.0000   0.0000          ?        ?   253.4931  17.2401          ?        ?      158.9        5.4       ?       ? 
1 1 1   49   20   20 o    129.9    4.7    0.0000   0.0000          ?        ?   169.2082  12.1319          ?        ?      129.9        4.7       ?       ? 
1 1 1   49   20   21 o    195.9    3.4    0.0000   0.0000          ?        ?   384.3900  13.4090          ?        ?      195.9        3.4       ?       ? 
1 1 1   49   20   22 o    229.6    3.2    0.0000   0.0000          ?        ?   528.0574  14.6860          ?        ?      229.6        3.2       ?       ? 
1 1 1   49   20   23 o    224.8    3.3    0.0000   0.0000          ?        ?   506.3477  14.6860          ?        ?      224.8        3.3       ?       ? 
1 1 1   49   20   24 o     42.8   13.8    0.0000   0.0000          ?        ?    18.5171  13.4090          ?        ?       42.8       13.8       ?       ? 
1 1 1   49   20   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   49   20   26 o    200.2    3.5    0.0000   0.0000          ?        ?   401.6301  14.0475          ?        ?      200.2        3.5       ?       ? 
1 1 1   49   20   27 o    220.3    3.6    0.0000   0.0000          ?        ?   486.5535  15.9630          ?        ?      220.3        3.6       ?       ? 
1 1 1   49   20   28 o    240.8    3.6    0.0000   0.0000          ?        ?   581.0547  17.2401          ?        ?      240.8        3.6       ?       ? 
1 1 1   49   20   29 o    142.8    5.4    0.0000   0.0000          ?        ?   204.9654  15.3245          ?        ?      142.8        5.4       ?       ? 
1 1 1   49   20   30 o     68.8   11.1    0.0000   0.0000          ?        ?    48.5276  15.3245          ?        ?       68.8       11.1       ?       ? 
1 1 1   49   20   31 o    209.7    3.8    0.0000   0.0000          ?        ?   441.2184  15.9630          ?        ?      209.7        3.8       ?       ? 
1 1 1   49   21    0 o    159.3    7.2  256.0471  22.9868   256.0471  22.9868   256.0471  22.9868      159.3      7.2      159.3        7.2     0.0     0.0 
1 1 1   49   21    1 o    233.7    4.2    0.0000   0.0000          ?        ?   547.2130  19.7942          ?        ?      233.7        4.2       ?       ? 
1 1 1   49   21    2 o    121.8    8.1    0.0000   0.0000          ?        ?   149.4141  19.7942          ?        ?      121.8        8.1       ?       ? 
1 1 1   49   21    3 o    273.2    4.7    0.0000   0.0000          ?        ?   748.3474  25.5409          ?        ?      273.2        4.7       ?       ? 
1 1 1   49   21    4 o     95.8    8.7    0.0000   0.0000          ?        ?    92.5856  16.6016          ?        ?       95.8        8.7       ?       ? 
1 1 1   49   21    5 o     22.7   11.1    0.0000   0.0000          ?        ?   -30.6490  16.6016          ?        ?       22.7       11.1       ?       ? 
1 1 1   49   21    6 o    135.7    6.6    0.0000   0.0000          ?        ?   185.1713  17.8786          ?        ?      135.7        6.6       ?       ? 
1 1 1   49   21    7 o    273.5    4.3    0.0000   0.0000          ?        ?   749.6244  23.6253          ?        ?      273.5        4.3       ?       ? 
1 1 1   49   21    8 o     47.8   15.3    0.0000   0.0000          ?        ?    22.9868  16.6016          ?        ?       47.8       15.3       ?       ? 
1 1 1   49   21    9 o    122.3    7.8    0.0000   0.0000          ?        ?   150.6911  19.1556          ?        ?      122.3        7.8       ?       ? 
1 1 1   49   21   10 o    354.4    4.5    0.0000   0.0000          ?        ?  1259.1647  31.9261          ?        ?      354.4        4.5       ?       ? 
1 1 1   49   21   11 f     97.3    9.5    0.0000   0.0000          ?        ?    95.7782  18.5171          ?        ?       97.3        9.5       ?       ? 
1 1 1   49   21   12 o    157.2    6.1    0.0000   0.0000          ?        ?   248.3849  19.1556          ?        ?      157.2        6.1       ?       ? 
1 1 1   49   21   13 o    500.6    4.7    0.0000   0.0000          ?        ?  2513.2212  46.6121          ?        ?      500.6        4.7       ?       ? 
1 1 1   49   21   14 o    103.6    6.5    0.0000   0.0000          ?        ?   107.9102  13.4090          ?        ?      103.6        6.5       ?       ? 
1 1 1   49   21   15 o    187.5    4.4    0.0000   0.0000          ?        ?   352.4639  16.6016          ?        ?      187.5        4.4       ?       ? 
1 1 1   49   21   16 o    231.2    4.0    0.0000   0.0000          ?        ?   535.7197  18.5171          ?        ?      231.2        4.0       ?       ? 
1 1 1   49   21   17 o     64.6   12.8    0.0000   0.0000          ?        ?    44.0580  15.9630          ?        ?       64.6       12.8       ?       ? 
1 1 1   49   21   18 o     27.5   12.6    0.0000   0.0000          ?        ?   -11.4934  15.9630          ?        ?       27.5       12.6       ?       ? 
1 1 1   49   21   19 o    251.5    3.8    0.0000   0.0000          ?        ?   634.0520  19.1556          ?        ?      251.5        3.8       ?       ? 
1 1 1   49   21   20 o    177.3    4.7    0.0000   0.0000          ?        ?   315.4297  16.6016          ?        ?      177.3        4.7       ?       ? 
1 1 1   49   21   21 f    285.9    2.7    0.0000   0.0000          ?        ?   818.5847  15.3245          ?        ?      285.9        2.7       ?       ? 
1 1 1   49   21   22 o     23.4   10.8    0.0000   0.0000          ?        ?   -10.2163  12.1319          ?        ?       23.4       10.8       ?       ? 
1 1 1   49   21   23 o     90.1    6.7    0.0000   0.0000          ?        ?    81.7308  12.1319          ?        ?       90.1        6.7       ?       ? 
1 1 1   49   21   24 o    158.6    4.0    0.0000   0.0000          ?        ?   252.2160  12.7704          ?        ?      158.6        4.0       ?       ? 
1 1 1   49   21   25 o    194.8    3.8    0.0000   0.0000          ?        ?   380.5589  14.6860          ?        ?      194.8        3.8       ?       ? 
1 1 1   49   21   26 o    155.5    4.3    0.0000   0.0000          ?        ?   242.6382  13.4090          ?        ?      155.5        4.3       ?       ? 
1 1 1   49   21   27 o     66.7   10.1    0.0000   0.0000          ?        ?    45.3350  13.4090          ?        ?       66.7       10.1       ?       ? 
1 1 1   49   21   28 o     83.6    8.4    0.0000   0.0000          ?        ?    70.8759  14.0475          ?        ?       83.6        8.4       ?       ? 
1 1 1   49   21   29 o    158.7    4.6    0.0000   0.0000          ?        ?   252.8546  14.6860          ?        ?      158.7        4.6       ?       ? 
1 1 1   49   22    0 o    254.3    5.7  648.7380  28.7335   648.7380  28.7335   648.7380  28.7335      254.3      5.7      254.3        5.7     0.0     0.0 
1 1 1   49   22    1 o    161.3    5.7    0.0000   0.0000          ?        ?   261.1554  18.5171          ?        ?      161.3        5.7       ?       ? 
1 1 1   49   22    2 o     95.5    8.4    0.0000   0.0000          ?        ?    91.9471  15.9630          ?        ?       95.5        8.4       ?       ? 
1 1 1   49   22    3 o     18.2    9.2    0.0000   0.0000          ?        ?   -62.5751  17.2401          ?        ?       18.2        9.2       ?       ? 
1 1 1   49   22    4 o     62.0   14.2    0.0000   0.0000          ?        ?    40.8654  17.2401          ?        ?       62.0       14.2       ?       ? 
1 1 1   49   22    5 o     87.0    9.5    0.0000   0.0000          ?        ?    76.6226  16.6016          ?        ?       87.0        9.5       ?       ? 
1 1 1   49   22    6 o    469.9    4.6    0.0000   0.0000          ?        ?  2213.7546  43.4195          ?        ?      469.9        4.6       ?       ? 
1 1 1   49   22    7 o    223.2    4.4    0.0000   0.0000          ?        ?   499.3239  19.7942          ?        ?      223.2        4.4       ?       ? 
1 1 1   49   22    8 o    168.0    5.9    0.0000   0.0000          ?        ?   283.5036  19.7942          ?        ?      168.0        5.9       ?       ? 
1 1 1   49   22    9 o    295.1    4.7    0.0000   0.0000          ?        ?   873.4976  27.4564          ?        ?      295.1        4.7       ?       ? 
1 1 1   49   22   10 o    249.7    5.0    0.0000   0.0000          ?        ?   625.7512  24.9023          ?        ?      249.7        5.0       ?       ? 
1 1 1   49   22   11 o    407.2    4.9    0.0000   0.0000          ?        ?  1663.3489  39.5883          ?        ?      407.2        4.9       ?       ? 
1 1 1   49   22   12 o    244.6    5.1    0.0000   0.0000          ?        ?   600.2103  24.9023          ?        ?      244.6        5.1       ?       ? 
1 1 1   49   22   13 f    257.6    5.0    0.0000   0.0000          ?        ?   665.9781  25.5409          ?        ?      257.6        5.0       ?       ? 
1 1 1   49   22   14 o    161.6    6.1    0.0000   0.0000          ?        ?   262.4324  19.7942          ?        ?      161.6        6.1       ?       ? 
1 1 1   49   22   15 o     80.3    7.9    0.0000   0.0000          ?        ?    65.1292  12.7704          ?        ?       80.3        7.9       ?       ? 
1 1 1   49   22   16 o    133.4    5.5    0.0000   0.0000          ?        ?   178.7861  14.6860          ?        ?      133.4        5.5       ?       ? 
1 1 1   49   22   17 o    268.6    3.4    0.0000   0.0000          ?        ?   722.8065  18.5171          ?        ?      268.6        3.4       ?       ? 
1 1 1   49   22   18 o    309.4    3.2    0.0000   0.0000          ?        ?   959.0594  19.7942          ?        ?      309.4        3.2       ?       ? 
1 1 1   49   22   19 o    312.6    3.5    0.0000   0.0000          ?        ?   978.8537  21.7097          ?        ?      312.6        3.5       ?       ? 
1 1 1   49   22   20 o    112.9    6.8    0.0000   0.0000          ?        ?   128.3428  15.3245          ?        ?      112.9        6.8       ?       ? 
1 1 1   49   22   21 o    110.5    7.5    0.0000   0.0000          ?        ?   123.2347  16.6016          ?        ?      110.5        7.5       ?       ? 
1 1 1   49   22   22 o    196.4    3.1    0.0000   0.0000          ?        ?   386.3056  12.1319          ?        ?      196.4        3.1       ?       ? 
1 1 1   49   22   23 o    196.7    3.4    0.0000   0.0000          ?        ?   387.5826  13.4090          ?        ?      196.7        3.4       ?       ? 
1 1 1   49   22   24 o    124.5    4.9    0.0000   0.0000          ?        ?   155.7993  12.1319          ?        ?      124.5        4.9       ?       ? 
1 1 1   49   22   25 o     77.7    8.6    0.0000   0.0000          ?        ?    61.2981  13.4090          ?        ?       77.7        8.6       ?       ? 
1 1 1   49   22   26 o    227.2    3.1    0.0000   0.0000          ?        ?   517.2025  14.0475          ?        ?      227.2        3.1       ?       ? 
1 1 1   49   23    0 o     36.7   21.5   17.2401  26.1794    17.2401  26.1794    17.2401  26.1794       36.7     21.5       36.7       21.5     0.0     0.0 
1 1 1   49   23    1 o    140.5    6.6    0.0000   0.0000          ?        ?   198.5802  18.5171          ?        ?      140.5        6.6       ?       ? 
1 1 1   49   23    2 o    123.6    7.0    0.0000   0.0000          ?        ?   153.8837  17.2401          ?        ?      123.6        7.0       ?       ? 
1 1 1   49   23    3 o     33.1   13.8    0.0000   0.0000          ?        ?     2.5541  15.3245          ?        ?       33.1       13.8       ?       ? 
1 1 1   49   23    4 o     20.2   10.0    0.0000   0.0000          ?        ?   -35.7572  15.3245          ?        ?       20.2       10.0       ?       ? 
1 1 1   49   23    5 o     30.1   13.5    0.0000   0.0000          ?        ?    -6.3852  16.6016          ?        ?       30.1       13.5       ?       ? 
1 1 1   49   23    6 o    220.2    5.2    0.0000   0.0000          ?        ?   486.5535  22.9868          ?        ?      220.2        5.2       ?       ? 
1 1 1   49   23    7 o    166.2    6.3    0.0000   0.0000          ?        ?   277.7569  21.0712          ?        ?      166.2        6.3       ?       ? 
1 1 1   49   23    8 o     22.6   11.1    0.0000   0.0000          ?        ?   -37.6728  17.8786          ?        ?       22.6       11.1       ?       ? 
1 1 1   49   23    9 o     29.1   13.2    0.0000   0.0000          ?        ?    -8.9393  16.6016          ?        ?       29.1       13.2       ?       ? 
1 1 1   49   23   10 o    135.1    7.1    0.0000   0.0000          ?        ?   183.8942  19.1556          ?        ?      135.1        7.1       ?       ? 
1 1 1   49   23   11 o     23.0   11.4    0.0000   0.0000          ?        ?   -42.1424  19.1556          ?        ?       23.0       11.4       ?       ? 
1 1 1   49   23   12 o    106.9    8.4    0.0000   0.0000          ?        ?   115.5724  17.8786          ?        ?      106.9        8.4       ?       ? 
1 1 1   49   23   13 o    171.3    5.6    0.0000   0.0000          ?        ?   294.9970  19.1556          ?        ?      171.3        5.6       ?       ? 
1 1 1   49   23   14 o    251.5    4.6    0.0000   0.0000          ?        ?   634.6905  22.9868          ?        ?      251.5        4.6       ?       ? 
1 1 1   49   23   15 o    170.7    6.0    0.0000   0.0000          ?        ?   293.0815  20.4327          ?        ?      170.7        6.0       ?       ? 
1 1 1   49   23   16 o     96.5    6.6    0.0000   0.0000          ?        ?    93.8627  12.7704          ?        ?       96.5        6.6       ?       ? 
1 1 1   49   23   17 o     97.8    6.9    0.0000   0.0000          ?        ?    96.4168  13.4090          ?        ?       97.8        6.9       ?       ? 
1 1 1   49   23   18 o    173.1    4.2    0.0000   0.0000          ?        ?   300.7437  14.6860          ?        ?      173.1        4.2       ?       ? 
1 1 1   49   23   19 o    434.7    3.7    0.0000   0.0000          ?        ?  1894.4938  31.9261          ?        ?      434.7        3.7       ?       ? 
1 1 1   49   23   20 o    157.5    4.9    0.0000   0.0000          ?        ?   249.0234  15.3245          ?        ?      157.5        4.9       ?       ? 
1 1 1   49   23   21 o    226.2    4.0    0.0000   0.0000          ?        ?   513.3714  17.8786          ?        ?      226.2        4.0       ?       ? 
1 1 1   49   23   22 o    151.9    4.8    0.0000   0.0000          ?        ?   231.7833  14.6860          ?        ?      151.9        4.8       ?       ? 
1 1 1   49   23   23 o    134.7    4.0    0.0000   0.0000          ?        ?   181.9787  10.8549          ?        ?      134.7        4.0       ?       ? 
1 1 1   49   24    0 o    289.8    6.4  843.4871  37.0343   843.4871  37.0343   843.4871  37.0343      289.8      6.4      289.8        6.4     0.0     0.0 
1 1 1   49   24    1 o     93.5   10.2    0.0000   0.0000          ?        ?    88.7545  19.1556          ?        ?       93.5       10.2       ?       ? 
1 1 1   49   24    2 o     93.6    8.9    0.0000   0.0000          ?        ?    88.7545  16.6016          ?        ?       93.6        8.9       ?       ? 
1 1 1   49   24    3 o    275.3    4.5    0.0000   0.0000          ?        ?   760.4792  24.9023          ?        ?      275.3        4.5       ?       ? 
1 1 1   49   24    4 o    211.1    5.1    0.0000   0.0000          ?        ?   447.6036  21.7097          ?        ?      211.1        5.1       ?       ? 
1 1 1   49   24    5 o    257.9    4.7    0.0000   0.0000          ?        ?   667.2551  24.2638          ?        ?      257.9        4.7       ?       ? 
1 1 1   49   24    6 o    193.2    5.1    0.0000   0.0000          ?        ?   374.8122  19.7942          ?        ?      193.2        5.1       ?       ? 
1 1 1   49   24    7 o    291.3    4.7    0.0000   0.0000          ?        ?   851.7878  27.4564          ?        ?      291.3        4.7       ?       ? 
1 1 1   49   24    8 o     21.9   10.8    0.0000   0.0000          ?        ?   -34.4802  16.6016          ?        ?       21.9       10.8       ?       ? 
1 1 1   49   24    9 o    124.0    7.7    0.0000   0.0000          ?        ?   155.1608  19.1556          ?        ?      124.0        7.7       ?       ? 
1 1 1   49   24   10 o    197.3    5.5    0.0000   0.0000          ?        ?   391.4138  21.7097          ?        ?      197.3        5.5       ?       ? 
1 1 1   49   24   11 o    417.2    4.4    0.0000   0.0000          ?        ?  1746.3567  36.3957          ?        ?      417.2        4.4       ?       ? 
1 1 1   49   24   12 o    150.3    6.2    0.0000   0.0000          ?        ?   227.3137  18.5171          ?        ?      150.3        6.2       ?       ? 
1 1 1   49   24   13 o    196.0    4.7    0.0000   0.0000          ?        ?   385.6671  18.5171          ?        ?      196.0        4.7       ?       ? 
1 1 1   49   24   14 o    169.6    5.8    0.0000   0.0000          ?        ?   289.2503  19.7942          ?        ?      169.6        5.8       ?       ? 
1 1 1   49   24   15 o     21.2   10.5    0.0000   0.0000          ?        ?   -45.3350  17.8786          ?        ?       21.2       10.5       ?       ? 
1 1 1   49   24   16 o     97.6    9.8    0.0000   0.0000          ?        ?    97.0553  19.1556          ?        ?       97.6        9.8       ?       ? 
1 1 1   49   24   17 o     49.5   12.3    0.0000   0.0000          ?        ?    26.1794  12.1319          ?        ?       49.5       12.3       ?       ? 
1 1 1   49   24   18 o    213.2    3.9    0.0000   0.0000          ?        ?   455.9044  16.6016          ?        ?      213.2        3.9       ?       ? 
1 1 1   49   24   19 o    114.2    6.4    0.0000   0.0000          ?        ?   131.5355  14.6860          ?        ?      114.2        6.4       ?       ? 
1 1 1   49   24   20 o     20.9   10.2    0.0000   0.0000          ?        ?   -25.5409  14.0475          ?        ?       20.9       10.2       ?       ? 
1 1 1   49   25    0 o    232.7    5.6  544.0204  26.1794   544.0204  26.1794   544.0204  26.1794      232.7      5.6      232.7        5.6     0.0     0.0 
1 1 1   49   25    1 o    147.4    5.4    0.0000   0.0000          ?        ?   218.3744  15.9630          ?        ?      147.4        5.4       ?       ? 
1 1 1   49   25    2 o    166.6    5.6    0.0000   0.0000          ?        ?   279.0340  18.5171          ?        ?      166.6        5.6       ?       ? 
1 1 1   49   25    3 o     56.1   15.5    0.0000   0.0000          ?        ?    33.8416  17.8786          ?        ?       56.1       15.5       ?       ? 
1 1 1   49   25    4 f     31.7   13.8    0.0000   0.0000          ?        ?    -2.5541  16.6016          ?        ?       31.7       13.8       ?       ? 
1 1 1   49   25    5 o    135.9    5.9    0.0000   0.0000          ?        ?   185.8098  15.9630          ?        ?      135.9        5.9       ?       ? 
1 1 1   49   25    6 o     90.2    8.5    0.0000   0.0000          ?        ?    82.3693  15.3245          ?        ?       90.2        8.5       ?       ? 
1 1 1   49   25    7 o    157.4    5.5    0.0000   0.0000          ?        ?   249.0234  17.2401          ?        ?      157.4        5.5       ?       ? 
1 1 1   49   25    8 o    206.5    4.2    0.0000   0.0000          ?        ?   427.8095  17.2401          ?        ?      206.5        4.2       ?       ? 
1 1 1   49   25    9 o    249.5    4.4    0.0000   0.0000          ?        ?   624.4742  21.7097          ?        ?      249.5        4.4       ?       ? 
1 1 1   49   25   10 o    175.7    5.1    0.0000   0.0000          ?        ?   310.3215  17.8786          ?        ?      175.7        5.1       ?       ? 
1 1 1   49   25   11 o     42.3   15.0    0.0000   0.0000          ?        ?    16.6016  15.9630          ?        ?       42.3       15.0       ?       ? 
1 1 1   49   25   12 o     20.8   10.3    0.0000   0.0000          ?        ?   -36.3957  15.9630          ?        ?       20.8       10.3       ?       ? 
1 1 1   49   25   13 o    196.4    5.0    0.0000   0.0000          ?        ?   387.5826  19.7942          ?        ?      196.4        5.0       ?       ? 
1 1 1   49   25   14 o    234.3    4.8    0.0000   0.0000          ?        ?   551.6827  22.3483          ?        ?      234.3        4.8       ?       ? 
1 1 1   49   25   15 o    130.2    6.6    0.0000   0.0000          ?        ?   171.1238  17.2401          ?        ?      130.2        6.6       ?       ? 
1 1 1   49   25   16 o    177.2    5.6    0.0000   0.0000          ?        ?   316.0682  19.7942          ?        ?      177.2        5.6       ?       ? 
1 1 1   49   26    0 o     29.7   19.0    4.4697  24.2638     4.4697  24.2638     4.4697  24.2638       29.7     19.0       29.7       19.0     0.0     0.0 
1 1 1   49   26    1 o     83.2    8.4    0.0000   0.0000          ?        ?    70.2374  14.0475          ?        ?       83.2        8.4       ?       ? 
1 1 1   49   26    2 o     63.0   14.0    0.0000   0.0000          ?        ?    42.7809  17.2401          ?        ?       63.0       14.0       ?       ? 
1 1 1   49   26    3 o    102.6    5.9    0.0000   0.0000          ?        ?   105.9946  12.1319          ?        ?      102.6        5.9       ?       ? 
1 1 1   49   26    4 o    122.9    5.2    0.0000   0.0000          ?        ?   151.9681  12.7704          ?        ?      122.9        5.2       ?       ? 
1 1 1   49   26    5 o    150.0    4.7    0.0000   0.0000          ?        ?   226.0367  14.0475          ?        ?      150.0        4.7       ?       ? 
1 1 1   49   26    6 o     45.3   13.3    0.0000   0.0000          ?        ?    21.7097  12.7704          ?        ?       45.3       13.3       ?       ? 
1 1 1   49   26    7 o     82.5    7.7    0.0000   0.0000          ?        ?    68.9603  12.7704          ?        ?       82.5        7.7       ?       ? 
1 1 1   49   26    8 o    215.3    3.9    0.0000   0.0000          ?        ?   464.8438  16.6016          ?        ?      215.3        3.9       ?       ? 
1 1 1   49   26    9 o    205.5    4.2    0.0000   0.0000          ?        ?   423.9784  17.2401          ?        ?      205.5        4.2       ?       ? 
1 1 1   49   26   10 o     43.6   15.1    0.0000   0.0000          ?        ?    18.5171  15.9630          ?        ?       43.6       15.1       ?       ? 
1 1 1   50    0    0 o    559.6    5.9 3133.8640  65.7677  3133.8640  65.7677  3133.8640  65.7677      559.6      5.9      559.6        5.9     0.0     0.0 
1 1 1   50    0    1 o    159.9    5.6  256.6857  17.8786   256.6857  17.8786   256.6857  17.8786      159.9      5.6      159.9        5.6     0.0     0.0 
1 1 1   50    0    2 o    504.5    3.9 2546.4241  38.9498  2546.4241  38.9498  2546.4241  38.9498      504.5      3.9      504.5        3.9     0.0     0.0 
1 1 1   50    0    3 o    211.4    4.7  447.6036  19.7942   447.6036  19.7942   447.6036  19.7942      211.4      4.7      211.4        4.7     0.0     0.0 
1 1 1   50    0    4 o    260.7    3.9  680.0255  20.4327   680.0255  20.4327   680.0255  20.4327      260.7      3.9      260.7        3.9     0.0     0.0 
1 1 1   50    0    5 o    105.1    8.0  112.3798  16.6016   112.3798  16.6016   112.3798  16.6016      105.1      8.0      105.1        8.0     0.0     0.0 
1 1 1   50    0    6 o     15.0   11.0  -35.7572  17.8786   -35.7572  17.8786   -35.7572  17.8786       15.0     11.0       15.0       11.0     0.0     0.0 
1 1 1   50    0    7 o    470.6    4.2 2216.3086  39.5883  2216.3086  39.5883  2216.3086  39.5883      470.6      4.2      470.6        4.2     0.0     0.0 
1 1 1   50    0    8 o    558.2    3.8 3116.6240  42.7809  3116.6240  42.7809  3116.6240  42.7809      558.2      3.8      558.2        3.8     0.0     0.0 
1 1 1   50    0    9 o    163.0    5.7  266.9020  18.5171   266.9020  18.5171   266.9020  18.5171      163.0      5.7      163.0        5.7     0.0     0.0 
1 1 1   50    0   10 o    724.4    4.4 5249.9248  63.8522  5249.9248  63.8522  5249.9248  63.8522      724.4      4.4      724.4        4.4     0.0     0.0 
1 1 1   50    0   11 o    100.3    9.4  103.4405  18.5171   103.4405  18.5171   103.4405  18.5171      100.3      9.4      100.3        9.4     0.0     0.0 
1 1 1   50    0   12 o    203.5    4.6  415.0391  18.5171   415.0391  18.5171   415.0391  18.5171      203.5      4.6      203.5        4.6     0.0     0.0 
1 1 1   50    0   13 o    261.6    4.0  685.1337  21.0712   685.1337  21.0712   685.1337  21.0712      261.6      4.0      261.6        4.0     0.0     0.0 
1 1 1   50    0   14 f    766.3    4.8 5875.6763  73.4300  5875.6763  73.4300  5875.6763  73.4300      766.3      4.8      766.3        4.8     0.0     0.0 
1 1 1   50    0   15 o    137.3    7.0  190.2794  19.1556   190.2794  19.1556   190.2794  19.1556      137.3      7.0      137.3        7.0     0.0     0.0 
1 1 1   50    0   16 o    402.8    3.5 1623.1219  28.0950  1623.1219  28.0950  1623.1219  28.0950      402.8      3.5      402.8        3.5     0.0     0.0 
1 1 1   50    0   17 o    126.0    7.9  160.9075  19.7942   160.9075  19.7942   160.9075  19.7942      126.0      7.9      126.0        7.9     0.0     0.0 
1 1 1   50    0   18 o     13.5   10.0  -47.8891  17.8786   -47.8891  17.8786   -47.8891  17.8786       13.5     10.0       13.5       10.0     0.0     0.0 
1 1 1   50    0   19 o    171.5    5.2  294.9970  17.8786   294.9970  17.8786   294.9970  17.8786      171.5      5.2      171.5        5.2     0.0     0.0 
1 1 1   50    0   20 o    197.5    4.7  390.7752  18.5171   390.7752  18.5171   390.7752  18.5171      197.5      4.7      197.5        4.7     0.0     0.0 
1 1 1   50    0   21 o     26.6   16.8    3.8311  18.5171     3.8311  18.5171     3.8311  18.5171       26.6     16.8       26.6       16.8     0.0     0.0 
1 1 1   50    0   22 o    118.6    8.4  143.0288  19.7942   143.0288  19.7942   143.0288  19.7942      118.6      8.4      118.6        8.4     0.0     0.0 
1 1 1   50    0   23 f    366.5    4.0 1344.0880  29.3720  1344.0880  29.3720  1344.0880  29.3720      366.5      4.0      366.5        4.0     0.0     0.0 
1 1 1   50    0   24 o     12.3    9.2  -59.3825  17.8786   -59.3825  17.8786   -59.3825  17.8786       12.3      9.2       12.3        9.2     0.0     0.0 
1 1 1   50    0   25 o    222.2    4.7  494.8542  21.0712   494.8542  21.0712   494.8542  21.0712      222.2      4.7      222.2        4.7     0.0     0.0 
1 1 1   50    0   26 o    177.8    5.9  317.3452  21.0712   317.3452  21.0712   317.3452  21.0712      177.8      5.9      177.8        5.9     0.0     0.0 
1 1 1   50    0   27 o    258.5    4.3  669.1707  22.3483   669.1707  22.3483   669.1707  22.3483      258.5      4.3      258.5        4.3     0.0     0.0 
1 1 1   50    0   28 o    343.4    3.7 1179.9880  25.5409  1179.9880  25.5409  1179.9880  25.5409      343.4      3.7      343.4        3.7     0.0     0.0 
1 1 1   50    0   29 o     24.9   16.3   -0.6385  19.1556    -0.6385  19.1556    -0.6385  19.1556       24.9     16.3       24.9       16.3     0.0     0.0 
1 1 1   50    0   30 o    204.4    5.2  418.8702  21.0712   418.8702  21.0712   418.8702  21.0712      204.4      5.2      204.4        5.2     0.0     0.0 
1 1 1   50    0   31 o     69.0   16.0   54.9129  19.1556    54.9129  19.1556    54.9129  19.1556       69.0     16.0       69.0       16.0     0.0     0.0 
1 1 1   50    0   32 o     17.0   12.3  -31.9261  19.7942   -31.9261  19.7942   -31.9261  19.7942       17.0     12.3       17.0       12.3     0.0     0.0 
1 1 1   50    0   33 o     24.9   16.6   -3.8311  21.0712    -3.8311  21.0712    -3.8311  21.0712       24.9     16.6       24.9       16.6     0.0     0.0 
1 1 1   50    0   34 o     33.8   19.9   14.0475  22.3483    14.0475  22.3483    14.0475  22.3483       33.8     19.9       33.8       19.9     0.0     0.0 
1 1 1   50    0   35 o     92.5   11.6   86.8389  21.7097    86.8389  21.7097    86.8389  21.7097       92.5     11.6       92.5       11.6     0.0     0.0 
1 1 1   50    0   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50    0   37 o     15.6   11.5  -51.0817  21.7097   -51.0817  21.7097   -51.0817  21.7097       15.6     11.5       15.6       11.5     0.0     0.0 
1 1 1   50    0   38 o    346.0    4.2 1198.5051  29.3720  1198.5051  29.3720  1198.5051  29.3720      346.0      4.2      346.0        4.2     0.0     0.0 
1 1 1   50    0   39 o    303.2    4.4  920.7482  26.8179   920.7482  26.8179   920.7482  26.8179      303.2      4.4      303.2        4.4     0.0     0.0 
1 1 1   50    0   40 o    465.9    3.9 2172.8889  36.3957  2172.8889  36.3957  2172.8889  36.3957      465.9      3.9      465.9        3.9     0.0     0.0 
1 1 1   50    0   41 o    282.8    4.9  801.3447  27.4564   801.3447  27.4564   801.3447  27.4564      282.8      4.9      282.8        4.9     0.0     0.0 
1 1 1   50    0   42 o     17.1   12.6  -47.8891  23.6253   -47.8891  23.6253   -47.8891  23.6253       17.1     12.6       17.1       12.6     0.0     0.0 
1 1 1   50    0   43 o    360.4    4.0 1300.6686  28.7335  1300.6686  28.7335  1300.6686  28.7335      360.4      4.0      360.4        4.0     0.0     0.0 
1 1 1   50    0   44 o     19.8   14.2  -30.6490  23.6253   -30.6490  23.6253   -30.6490  23.6253       19.8     14.2       19.8       14.2     0.0     0.0 
1 1 1   50    0   45 o    364.2    4.1 1328.1250  30.0105  1328.1250  30.0105  1328.1250  30.0105      364.2      4.1      364.2        4.1     0.0     0.0 
1 1 1   50    0   46 o     19.7   14.2  -33.2031  24.2638   -33.2031  24.2638   -33.2031  24.2638       19.7     14.2       19.7       14.2     0.0     0.0 
1 1 1   50    0   47 o    167.4    7.5  282.8651  24.9023   282.8651  24.9023   282.8651  24.9023      167.4      7.5      167.4        7.5     0.0     0.0 
1 1 1   50    0   48 o    154.0    7.9  240.0841  24.2638   240.0841  24.2638   240.0841  24.2638      154.0      7.9      154.0        7.9     0.0     0.0 
1 1 1   50    0   49 o    409.1    4.1 1676.1193  33.2031  1676.1193  33.2031  1676.1193  33.2031      409.1      4.1      409.1        4.1     0.0     0.0 
1 1 1   50    0   50 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50    0   51 o    135.1    9.6  186.4483  25.5409   186.4483  25.5409   186.4483  25.5409      135.1      9.6      135.1        9.6     0.0     0.0 
1 1 1   50    0   52 o     24.3   16.8  -15.9630  26.1794   -15.9630  26.1794   -15.9630  26.1794       24.3     16.8       24.3       16.8     0.0     0.0 
1 1 1   50    0   53 o     25.8   17.5   -8.9393  25.5409    -8.9393  25.5409    -8.9393  25.5409       25.8     17.5       25.8       17.5     0.0     0.0 
1 1 1   50    0   54 o    385.9    4.1 1492.2250  31.9261  1492.2250  31.9261  1492.2250  31.9261      385.9      4.1      385.9        4.1     0.0     0.0 
1 1 1   50    1    0 o    596.9    4.3 3564.8662  51.0817  3564.8662  51.0817  3564.8662  51.0817      596.9      4.3      596.9        4.3     0.0     0.0 
1 1 1   50    1    1 o    278.1    2.9    0.0000   0.0000          ?        ?   773.8882  15.9630          ?        ?      278.1        2.9       ?       ? 
1 1 1   50    1    2 o    631.2    2.9    0.0000   0.0000          ?        ?  3985.6521  37.0343          ?        ?      631.2        2.9       ?       ? 
1 1 1   50    1    3 o    262.8    2.8    0.0000   0.0000          ?        ?   690.8804  14.6860          ?        ?      262.8        2.8       ?       ? 
1 1 1   50    1    4 o    437.5    2.8    0.0000   0.0000          ?        ?  1914.9263  24.2638          ?        ?      437.5        2.8       ?       ? 
1 1 1   50    1    5 o    180.6    3.7    0.0000   0.0000          ?        ?   326.2845  13.4090          ?        ?      180.6        3.7       ?       ? 
1 1 1   50    1    6 o    654.2    3.0    0.0000   0.0000          ?        ?  4280.6489  39.5883          ?        ?      654.2        3.0       ?       ? 
1 1 1   50    1    7 o    304.3    2.7    0.0000   0.0000          ?        ?   926.4949  16.6016          ?        ?      304.3        2.7       ?       ? 
1 1 1   50    1    8 o    332.8    2.7    0.0000   0.0000          ?        ?  1107.8350  17.8786          ?        ?      332.8        2.7       ?       ? 
1 1 1   50    1    9 o    399.2    2.6    0.0000   0.0000          ?        ?  1594.3884  20.4327          ?        ?      399.2        2.6       ?       ? 
1 1 1   50    1   10 o    682.4    3.2    0.0000   0.0000          ?        ?  4658.6538  43.4195          ?        ?      682.4        3.2       ?       ? 
1 1 1   50    1   11 o    195.5    3.3    0.0000   0.0000          ?        ?   382.4745  12.7704          ?        ?      195.5        3.3       ?       ? 
1 1 1   50    1   12 o    219.1    3.1    0.0000   0.0000          ?        ?   480.1682  13.4090          ?        ?      219.1        3.1       ?       ? 
1 1 1   50    1   13 o    229.0    3.3    0.0000   0.0000          ?        ?   524.8647  15.3245          ?        ?      229.0        3.3       ?       ? 
1 1 1   50    1   14 o    157.7    4.3    0.0000   0.0000          ?        ?   249.0234  13.4090          ?        ?      157.7        4.3       ?       ? 
1 1 1   50    1   15 o     97.5    5.9    0.0000   0.0000          ?        ?    95.1397  11.4934          ?        ?       97.5        5.9       ?       ? 
1 1 1   50    1   16 o    247.5    3.2    0.0000   0.0000          ?        ?   612.9808  15.9630          ?        ?      247.5        3.2       ?       ? 
1 1 1   50    1   17 o    122.7    5.5    0.0000   0.0000          ?        ?   150.6911  13.4090          ?        ?      122.7        5.5       ?       ? 
1 1 1   50    1   18 o     81.0    7.9    0.0000   0.0000          ?        ?    65.7677  12.7704          ?        ?       81.0        7.9       ?       ? 
1 1 1   50    1   19 o     38.8   13.1    0.0000   0.0000          ?        ?    14.0475  12.1319          ?        ?       38.8       13.1       ?       ? 
1 1 1   50    1   20 o     17.5    8.8    0.0000   0.0000          ?        ?   -35.1187  12.7704          ?        ?       17.5        8.8       ?       ? 
1 1 1   50    1   21 f    357.3    2.5    0.0000   0.0000          ?        ?  1277.0432  17.8786          ?        ?      357.3        2.5       ?       ? 
1 1 1   50    1   22 o    250.9    2.9    0.0000   0.0000          ?        ?   629.5823  14.6860          ?        ?      250.9        2.9       ?       ? 
1 1 1   50    1   23 o    115.7    5.8    0.0000   0.0000          ?        ?   134.0895  13.4090          ?        ?      115.7        5.8       ?       ? 
1 1 1   50    1   24 o    128.0    5.2    0.0000   0.0000          ?        ?   164.1001  13.4090          ?        ?      128.0        5.2       ?       ? 
1 1 1   50    1   25 o    223.1    3.3    0.0000   0.0000          ?        ?   498.0469  14.6860          ?        ?      223.1        3.3       ?       ? 
1 1 1   50    1   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50    1   27 o    229.3    3.3    0.0000   0.0000          ?        ?   526.1418  15.3245          ?        ?      229.3        3.3       ?       ? 
1 1 1   50    1   28 o    151.3    4.6    0.0000   0.0000          ?        ?   229.2293  14.0475          ?        ?      151.3        4.6       ?       ? 
1 1 1   50    1   29 o    112.3    6.3    0.0000   0.0000          ?        ?   126.4273  14.0475          ?        ?      112.3        6.3       ?       ? 
1 1 1   50    1   30 o    165.2    4.6    0.0000   0.0000          ?        ?   273.2873  15.3245          ?        ?      165.2        4.6       ?       ? 
1 1 1   50    1   31 o    308.2    2.8    0.0000   0.0000          ?        ?   950.1202  17.2401          ?        ?      308.2        2.8       ?       ? 
1 1 1   50    1   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50    1   33 f    257.7    3.1    0.0000   0.0000          ?        ?   664.7010  15.9630          ?        ?      257.7        3.1       ?       ? 
1 1 1   50    1   34 o    237.6    3.5    0.0000   0.0000          ?        ?   565.0916  16.6016          ?        ?      237.6        3.5       ?       ? 
1 1 1   50    1   35 o    260.1    3.3    0.0000   0.0000          ?        ?   676.8329  17.2401          ?        ?      260.1        3.3       ?       ? 
1 1 1   50    1   36 o    130.1    6.1    0.0000   0.0000          ?        ?   169.8468  15.9630          ?        ?      130.1        6.1       ?       ? 
1 1 1   50    1   37 o    239.9    3.5    0.0000   0.0000          ?        ?   575.9465  16.6016          ?        ?      239.9        3.5       ?       ? 
1 1 1   50    1   38 o    230.4    3.6    0.0000   0.0000          ?        ?   531.2500  16.6016          ?        ?      230.4        3.6       ?       ? 
1 1 1   50    1   39 o    244.3    3.7    0.0000   0.0000          ?        ?   597.6562  17.8786          ?        ?      244.3        3.7       ?       ? 
1 1 1   50    1   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50    1   41 o     37.7   14.9    0.0000   0.0000          ?        ?     8.3008  16.6016          ?        ?       37.7       14.9       ?       ? 
1 1 1   50    1   42 o    211.7    4.1    0.0000   0.0000          ?        ?   448.8807  17.2401          ?        ?      211.7        4.1       ?       ? 
1 1 1   50    1   43 o    162.9    5.3    0.0000   0.0000          ?        ?   266.2635  17.2401          ?        ?      162.9        5.3       ?       ? 
1 1 1   50    1   44 o    421.8    2.8    0.0000   0.0000          ?        ?  1780.8368  23.6253          ?        ?      421.8        2.8       ?       ? 
1 1 1   50    1   45 o     73.5   12.2    0.0000   0.0000          ?        ?    54.9129  17.8786          ?        ?       73.5       12.2       ?       ? 
1 1 1   50    1   46 o    138.0    6.7    0.0000   0.0000          ?        ?   191.5565  18.5171          ?        ?      138.0        6.7       ?       ? 
1 1 1   50    1   47 o    257.2    3.7    0.0000   0.0000          ?        ?   662.7855  19.1556          ?        ?      257.2        3.7       ?       ? 
1 1 1   50    1   48 o     37.0   15.0    0.0000   0.0000          ?        ?     6.3852  17.2401          ?        ?       37.0       15.0       ?       ? 
1 1 1   50    1   49 o     33.3   14.5    0.0000   0.0000          ?        ?    -1.9156  17.8786          ?        ?       33.3       14.5       ?       ? 
1 1 1   50    1   50 o     21.6   10.8    0.0000   0.0000          ?        ?   -46.6121  18.5171          ?        ?       21.6       10.8       ?       ? 
1 1 1   50    1   51 o    232.2    4.0    0.0000   0.0000          ?        ?   540.8278  18.5171          ?        ?      232.2        4.0       ?       ? 
1 1 1   50    1   52 o     53.0   15.4    0.0000   0.0000          ?        ?    30.0105  17.2401          ?        ?       53.0       15.4       ?       ? 
1 1 1   50    1   53 o     30.9   13.8    0.0000   0.0000          ?        ?    -5.7467  17.2401          ?        ?       30.9       13.8       ?       ? 
1 1 1   50    2    0 o    256.8    4.0  660.2314  20.4327   660.2314  20.4327   660.2314  20.4327      256.8      4.0      256.8        4.0     0.0     0.0 
1 1 1   50    2    1 o    228.1    3.1    0.0000   0.0000          ?        ?   520.3951  14.0475          ?        ?      228.1        3.1       ?       ? 
1 1 1   50    2    2 o    695.1    3.5    0.0000   0.0000          ?        ?  4833.6089  49.1662          ?        ?      695.1        3.5       ?       ? 
1 1 1   50    2    3 o    384.2    2.9    0.0000   0.0000          ?        ?  1476.2620  22.3483          ?        ?      384.2        2.9       ?       ? 
1 1 1   50    2    4 o    561.8    3.0    0.0000   0.0000          ?        ?  3156.8508  33.8416          ?        ?      561.8        3.0       ?       ? 
1 1 1   50    2    5 o    194.4    3.3    0.0000   0.0000          ?        ?   378.0048  12.7704          ?        ?      194.4        3.3       ?       ? 
1 1 1   50    2    6 o    247.0    3.0    0.0000   0.0000          ?        ?   610.4266  14.6860          ?        ?      247.0        3.0       ?       ? 
1 1 1   50    2    7 o    471.8    2.9    0.0000   0.0000          ?        ?  2226.5249  27.4564          ?        ?      471.8        2.9       ?       ? 
1 1 1   50    2    8 o    334.0    2.8    0.0000   0.0000          ?        ?  1116.1359  18.5171          ?        ?      334.0        2.8       ?       ? 
1 1 1   50    2    9 o    471.3    2.6    0.0000   0.0000          ?        ?  2222.0552  24.2638          ?        ?      471.3        2.6       ?       ? 
1 1 1   50    2   10 o    295.4    2.8    0.0000   0.0000          ?        ?   872.8591  16.6016          ?        ?      295.4        2.8       ?       ? 
1 1 1   50    2   11 o    197.3    3.4    0.0000   0.0000          ?        ?   389.4982  13.4090          ?        ?      197.3        3.4       ?       ? 
1 1 1   50    2   12 o     19.4    9.5    0.0000   0.0000          ?        ?   -22.9868  12.1319          ?        ?       19.4        9.5       ?       ? 
1 1 1   50    2   13 o     68.6    8.8    0.0000   0.0000          ?        ?    47.2506  12.1319          ?        ?       68.6        8.8       ?       ? 
1 1 1   50    2   14 o     22.1   10.6    0.0000   0.0000          ?        ?   -19.1556  13.4090          ?        ?       22.1       10.6       ?       ? 
1 1 1   50    2   15 o    256.8    2.9    0.0000   0.0000          ?        ?   659.5928  14.6860          ?        ?      256.8        2.9       ?       ? 
1 1 1   50    2   16 o    222.4    3.4    0.0000   0.0000          ?        ?   494.8542  15.3245          ?        ?      222.4        3.4       ?       ? 
1 1 1   50    2   17 o    241.5    3.2    0.0000   0.0000          ?        ?   583.6088  15.3245          ?        ?      241.5        3.2       ?       ? 
1 1 1   50    2   18 o    242.7    3.0    0.0000   0.0000          ?        ?   589.3555  14.6860          ?        ?      242.7        3.0       ?       ? 
1 1 1   50    2   19 o    461.8    2.8    0.0000   0.0000          ?        ?  2133.3008  26.1794          ?        ?      461.8        2.8       ?       ? 
1 1 1   50    2   20 o    255.6    3.1    0.0000   0.0000          ?        ?   653.8461  15.9630          ?        ?      255.6        3.1       ?       ? 
1 1 1   50    2   21 o    197.5    3.4    0.0000   0.0000          ?        ?   390.1367  13.4090          ?        ?      197.5        3.4       ?       ? 
1 1 1   50    2   22 o    325.9    2.6    0.0000   0.0000          ?        ?  1062.5000  17.2401          ?        ?      325.9        2.6       ?       ? 
1 1 1   50    2   23 o    251.9    3.0    0.0000   0.0000          ?        ?   634.6905  15.3245          ?        ?      251.9        3.0       ?       ? 
1 1 1   50    2   24 o    364.5    2.6    0.0000   0.0000          ?        ?  1328.7635  19.1556          ?        ?      364.5        2.6       ?       ? 
1 1 1   50    2   25 o    171.7    4.3    0.0000   0.0000          ?        ?   294.9970  14.6860          ?        ?      171.7        4.3       ?       ? 
1 1 1   50    2   26 o    116.5    6.0    0.0000   0.0000          ?        ?   136.0051  14.0475          ?        ?      116.5        6.0       ?       ? 
1 1 1   50    2   27 o    348.1    2.6    0.0000   0.0000          ?        ?  1211.9141  17.8786          ?        ?      348.1        2.6       ?       ? 
1 1 1   50    2   28 o    135.3    5.4    0.0000   0.0000          ?        ?   183.2557  14.6860          ?        ?      135.3        5.4       ?       ? 
1 1 1   50    2   29 o    226.4    3.4    0.0000   0.0000          ?        ?   512.7329  15.3245          ?        ?      226.4        3.4       ?       ? 
1 1 1   50    2   30 o    181.8    4.0    0.0000   0.0000          ?        ?   330.7542  14.6860          ?        ?      181.8        4.0       ?       ? 
1 1 1   50    2   31 o    225.4    3.4    0.0000   0.0000          ?        ?   508.2632  15.3245          ?        ?      225.4        3.4       ?       ? 
1 1 1   50    2   32 o    350.0    2.6    0.0000   0.0000          ?        ?  1225.3230  18.5171          ?        ?      350.0        2.6       ?       ? 
1 1 1   50    2   33 o    255.4    3.1    0.0000   0.0000          ?        ?   652.5691  15.9630          ?        ?      255.4        3.1       ?       ? 
1 1 1   50    2   34 o    262.3    3.3    0.0000   0.0000          ?        ?   688.3264  17.2401          ?        ?      262.3        3.3       ?       ? 
1 1 1   50    2   35 o     40.8   14.1    0.0000   0.0000          ?        ?    15.3245  14.0475          ?        ?       40.8       14.1       ?       ? 
1 1 1   50    2   36 o     27.4   12.7    0.0000   0.0000          ?        ?   -14.0475  16.6016          ?        ?       27.4       12.7       ?       ? 
1 1 1   50    2   37 o     45.0   14.8    0.0000   0.0000          ?        ?    19.7942  15.3245          ?        ?       45.0       14.8       ?       ? 
1 1 1   50    2   38 o    298.1    3.3    0.0000   0.0000          ?        ?   889.4606  19.7942          ?        ?      298.1        3.3       ?       ? 
1 1 1   50    2   39 o     99.5    8.3    0.0000   0.0000          ?        ?    99.6094  16.6016          ?        ?       99.5        8.3       ?       ? 
1 1 1   50    2   40 o    117.2    7.4    0.0000   0.0000          ?        ?   137.9207  17.2401          ?        ?      117.2        7.4       ?       ? 
1 1 1   50    2   41 o    148.0    6.0    0.0000   0.0000          ?        ?   219.6514  17.8786          ?        ?      148.0        6.0       ?       ? 
1 1 1   50    2   42 o    429.0    2.8    0.0000   0.0000          ?        ?  1842.1349  23.6253          ?        ?      429.0        2.8       ?       ? 
1 1 1   50    2   43 o     98.1    8.8    0.0000   0.0000          ?        ?    97.0553  17.2401          ?        ?       98.1        8.8       ?       ? 
1 1 1   50    2   44 o    362.2    3.0    0.0000   0.0000          ?        ?  1313.4390  21.7097          ?        ?      362.2        3.0       ?       ? 
1 1 1   50    2   45 o    148.3    6.2    0.0000   0.0000          ?        ?   220.9285  18.5171          ?        ?      148.3        6.2       ?       ? 
1 1 1   50    2   46 o    251.7    3.8    0.0000   0.0000          ?        ?   634.6905  19.1556          ?        ?      251.7        3.8       ?       ? 
1 1 1   50    2   47 o    115.6    7.7    0.0000   0.0000          ?        ?   134.7281  17.8786          ?        ?      115.6        7.7       ?       ? 
1 1 1   50    2   48 o    312.7    3.2    0.0000   0.0000          ?        ?   979.4921  19.7942          ?        ?      312.7        3.2       ?       ? 
1 1 1   50    2   49 o    105.7    8.5    0.0000   0.0000          ?        ?   113.0183  17.8786          ?        ?      105.7        8.5       ?       ? 
1 1 1   50    2   50 o     70.6   13.6    0.0000   0.0000          ?        ?    52.9973  18.5171          ?        ?       70.6       13.6       ?       ? 
1 1 1   50    2   51 o     32.5   14.4    0.0000   0.0000          ?        ?    -5.1082  18.5171          ?        ?       32.5       14.4       ?       ? 
1 1 1   50    2   52 o    214.5    4.3    0.0000   0.0000          ?        ?   461.6512  18.5171          ?        ?      214.5        4.3       ?       ? 
1 1 1   50    2   53 o     55.9   15.5    0.0000   0.0000          ?        ?    33.8416  17.8786          ?        ?       55.9       15.5       ?       ? 
1 1 1   50    3    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50    3    1 o    114.9    5.8    0.0000   0.0000          ?        ?   132.1740  13.4090          ?        ?      114.9        5.8       ?       ? 
1 1 1   50    3    2 o    283.7    2.9    0.0000   0.0000          ?        ?   805.1758  16.6016          ?        ?      283.7        2.9       ?       ? 
1 1 1   50    3    3 f    369.1    2.9    0.0000   0.0000          ?        ?  1362.6051  21.7097          ?        ?      369.1        2.9       ?       ? 
1 1 1   50    3    4 o    127.8    5.7    0.0000   0.0000          ?        ?   163.4615  14.6860          ?        ?      127.8        5.7       ?       ? 
1 1 1   50    3    5 o    818.7    3.8    0.0000   0.0000          ?        ?  6706.3931  62.5751          ?        ?      818.7        3.8       ?       ? 
1 1 1   50    3    6 o    151.5    4.6    0.0000   0.0000          ?        ?   229.8678  14.0475          ?        ?      151.5        4.6       ?       ? 
1 1 1   50    3    7 o    132.5    4.6    0.0000   0.0000          ?        ?   175.5934  12.1319          ?        ?      132.5        4.6       ?       ? 
1 1 1   50    3    8 o    235.0    2.9    0.0000   0.0000          ?        ?   552.3212  13.4090          ?        ?      235.0        2.9       ?       ? 
1 1 1   50    3    9 o    385.3    2.7    0.0000   0.0000          ?        ?  1485.2013  20.4327          ?        ?      385.3        2.7       ?       ? 
1 1 1   50    3   10 o    365.9    2.7    0.0000   0.0000          ?        ?  1338.9799  19.7942          ?        ?      365.9        2.7       ?       ? 
1 1 1   50    3   11 o    292.9    2.8    0.0000   0.0000          ?        ?   858.1730  16.6016          ?        ?      292.9        2.8       ?       ? 
1 1 1   50    3   12 o    218.3    3.2    0.0000   0.0000          ?        ?   476.9756  14.0475          ?        ?      218.3        3.2       ?       ? 
1 1 1   50    3   13 o    370.2    2.8    0.0000   0.0000          ?        ?  1370.9059  20.4327          ?        ?      370.2        2.8       ?       ? 
1 1 1   50    3   14 o    250.2    3.1    0.0000   0.0000          ?        ?   626.3897  15.3245          ?        ?      250.2        3.1       ?       ? 
1 1 1   50    3   15 o    211.2    3.5    0.0000   0.0000          ?        ?   446.3266  14.6860          ?        ?      211.2        3.5       ?       ? 
1 1 1   50    3   16 f     81.8    7.8    0.0000   0.0000          ?        ?    67.0448  12.7704          ?        ?       81.8        7.8       ?       ? 
1 1 1   50    3   17 f    462.4    2.6    0.0000   0.0000          ?        ?  2138.4089  23.6253          ?        ?      462.4        2.6       ?       ? 
1 1 1   50    3   18 o    163.9    4.5    0.0000   0.0000          ?        ?   268.8176  14.6860          ?        ?      163.9        4.5       ?       ? 
1 1 1   50    3   19 o    176.3    4.0    0.0000   0.0000          ?        ?   310.9600  14.0475          ?        ?      176.3        4.0       ?       ? 
1 1 1   50    3   20 o    615.3    2.8    0.0000   0.0000          ?        ?  3787.7104  34.4802          ?        ?      615.3        2.8       ?       ? 
1 1 1   50    3   21 o    626.6    2.8    0.0000   0.0000          ?        ?  3928.1851  35.1187          ?        ?      626.6        2.8       ?       ? 
1 1 1   50    3   22 o    265.2    3.0    0.0000   0.0000          ?        ?   703.6508  15.9630          ?        ?      265.2        3.0       ?       ? 
1 1 1   50    3   23 o     70.4   10.4    0.0000   0.0000          ?        ?    49.8047  14.6860          ?        ?       70.4       10.4       ?       ? 
1 1 1   50    3   24 o     27.4   12.2    0.0000   0.0000          ?        ?    -5.1082  13.4090          ?        ?       27.4       12.2       ?       ? 
1 1 1   50    3   25 o    336.2    2.8    0.0000   0.0000          ?        ?  1130.8219  18.5171          ?        ?      336.2        2.8       ?       ? 
1 1 1   50    3   26 o    264.8    3.0    0.0000   0.0000          ?        ?   701.7353  15.9630          ?        ?      264.8        3.0       ?       ? 
1 1 1   50    3   27 o    303.3    2.7    0.0000   0.0000          ?        ?   920.1097  16.6016          ?        ?      303.3        2.7       ?       ? 
1 1 1   50    3   28 o    206.1    3.7    0.0000   0.0000          ?        ?   425.2554  15.3245          ?        ?      206.1        3.7       ?       ? 
1 1 1   50    3   29 o    350.5    2.8    0.0000   0.0000          ?        ?  1229.1542  19.7942          ?        ?      350.5        2.8       ?       ? 
1 1 1   50    3   30 f    190.8    4.0    0.0000   0.0000          ?        ?   364.5958  15.3245          ?        ?      190.8        4.0       ?       ? 
1 1 1   50    3   31 o    139.2    5.3    0.0000   0.0000          ?        ?   194.1106  14.6860          ?        ?      139.2        5.3       ?       ? 
1 1 1   50    3   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50    3   33 o    272.8    3.0    0.0000   0.0000          ?        ?   744.5162  16.6016          ?        ?      272.8        3.0       ?       ? 
1 1 1   50    3   34 o     20.1   10.0    0.0000   0.0000          ?        ?   -37.0343  15.3245          ?        ?       20.1       10.0       ?       ? 
1 1 1   50    3   35 o     26.2   12.2    0.0000   0.0000          ?        ?   -13.4090  15.3245          ?        ?       26.2       12.2       ?       ? 
1 1 1   50    3   36 o    212.9    3.9    0.0000   0.0000          ?        ?   453.9889  16.6016          ?        ?      212.9        3.9       ?       ? 
1 1 1   50    3   37 o    148.7    5.6    0.0000   0.0000          ?        ?   221.5670  16.6016          ?        ?      148.7        5.6       ?       ? 
1 1 1   50    3   38 o    117.7    6.8    0.0000   0.0000          ?        ?   139.1977  15.9630          ?        ?      117.7        6.8       ?       ? 
1 1 1   50    3   39 o    223.2    3.7    0.0000   0.0000          ?        ?   498.6854  16.6016          ?        ?      223.2        3.7       ?       ? 
1 1 1   50    3   40 o     87.2    9.2    0.0000   0.0000          ?        ?    76.6226  15.9630          ?        ?       87.2        9.2       ?       ? 
1 1 1   50    3   41 o     37.3   14.9    0.0000   0.0000          ?        ?     7.6623  16.6016          ?        ?       37.3       14.9       ?       ? 
1 1 1   50    3   42 o     32.0   14.0    0.0000   0.0000          ?        ?    -3.8311  17.2401          ?        ?       32.0       14.0       ?       ? 
1 1 1   50    3   43 o    316.4    3.1    0.0000   0.0000          ?        ?  1002.4789  19.7942          ?        ?      316.4        3.1       ?       ? 
1 1 1   50    3   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50    3   45 o    117.0    7.9    0.0000   0.0000          ?        ?   137.9207  18.5171          ?        ?      117.0        7.9       ?       ? 
1 1 1   50    3   46 o    242.1    4.0    0.0000   0.0000          ?        ?   587.4399  19.1556          ?        ?      242.1        4.0       ?       ? 
1 1 1   50    3   47 o     25.3   12.1    0.0000   0.0000          ?        ?   -22.9868  17.2401          ?        ?       25.3       12.1       ?       ? 
1 1 1   50    3   48 o    148.2    6.2    0.0000   0.0000          ?        ?   220.9285  18.5171          ?        ?      148.2        6.2       ?       ? 
1 1 1   50    3   49 o    284.9    3.4    0.0000   0.0000          ?        ?   813.4766  19.1556          ?        ?      284.9        3.4       ?       ? 
1 1 1   50    3   50 o    228.7    4.2    0.0000   0.0000          ?        ?   524.8647  19.1556          ?        ?      228.7        4.2       ?       ? 
1 1 1   50    3   51 o    260.2    3.7    0.0000   0.0000          ?        ?   678.7485  19.1556          ?        ?      260.2        3.7       ?       ? 
1 1 1   50    3   52 o     26.2   12.4    0.0000   0.0000          ?        ?   -19.1556  17.2401          ?        ?       26.2       12.4       ?       ? 
1 1 1   50    4    0 o    169.4    5.7  287.9732  19.1556   287.9732  19.1556   287.9732  19.1556      169.4      5.7      169.4        5.7     0.0     0.0 
1 1 1   50    4    1 o    357.4    2.7    0.0000   0.0000          ?        ?  1277.6818  19.1556          ?        ?      357.4        2.7       ?       ? 
1 1 1   50    4    2 o    446.9    2.6    0.0000   0.0000          ?        ?  1997.9341  23.6253          ?        ?      446.9        2.6       ?       ? 
1 1 1   50    4    3 o    293.9    2.7    0.0000   0.0000          ?        ?   863.9198  15.9630          ?        ?      293.9        2.7       ?       ? 
1 1 1   50    4    4 o    461.3    2.8    0.0000   0.0000          ?        ?  2128.8311  26.1794          ?        ?      461.3        2.8       ?       ? 
1 1 1   50    4    5 o     81.0    7.1    0.0000   0.0000          ?        ?    65.7677  11.4934          ?        ?       81.0        7.1       ?       ? 
1 1 1   50    4    6 o    240.7    3.1    0.0000   0.0000          ?        ?   579.7776  14.6860          ?        ?      240.7        3.1       ?       ? 
1 1 1   50    4    7 o    520.8    2.8    0.0000   0.0000          ?        ?  2713.0784  29.3720          ?        ?      520.8        2.8       ?       ? 
1 1 1   50    4    8 o    252.5    2.9    0.0000   0.0000          ?        ?   637.8831  14.6860          ?        ?      252.5        2.9       ?       ? 
1 1 1   50    4    9 o    155.5    4.1    0.0000   0.0000          ?        ?   241.9997  12.7704          ?        ?      155.5        4.1       ?       ? 
1 1 1   50    4   10 o    103.2    5.9    0.0000   0.0000          ?        ?   106.6331  12.1319          ?        ?      103.2        5.9       ?       ? 
1 1 1   50    4   11 o    175.4    3.8    0.0000   0.0000          ?        ?   307.7674  13.4090          ?        ?      175.4        3.8       ?       ? 
1 1 1   50    4   12 o    655.1    3.0    0.0000   0.0000          ?        ?  4292.7808  39.5883          ?        ?      655.1        3.0       ?       ? 
1 1 1   50    4   13 o    132.7    5.3    0.0000   0.0000          ?        ?   176.2320  14.0475          ?        ?      132.7        5.3       ?       ? 
1 1 1   50    4   14 o    195.0    3.6    0.0000   0.0000          ?        ?   380.5589  14.0475          ?        ?      195.0        3.6       ?       ? 
1 1 1   50    4   15 o    249.1    2.9    0.0000   0.0000          ?        ?   620.6430  14.6860          ?        ?      249.1        2.9       ?       ? 
1 1 1   50    4   16 o     92.7    6.9    0.0000   0.0000          ?        ?    86.2004  12.7704          ?        ?       92.7        6.9       ?       ? 
1 1 1   50    4   17 o    201.3    3.3    0.0000   0.0000          ?        ?   405.4612  13.4090          ?        ?      201.3        3.3       ?       ? 
1 1 1   50    4   18 o    411.4    2.6    0.0000   0.0000          ?        ?  1693.3594  21.7097          ?        ?      411.4        2.6       ?       ? 
1 1 1   50    4   19 o    161.1    4.6    0.0000   0.0000          ?        ?   259.8783  14.6860          ?        ?      161.1        4.6       ?       ? 
1 1 1   50    4   20 o    467.6    2.5    0.0000   0.0000          ?        ?  2186.9365  23.6253          ?        ?      467.6        2.5       ?       ? 
1 1 1   50    4   21 o     37.1   13.9    0.0000   0.0000          ?        ?    10.2163  14.0475          ?        ?       37.1       13.9       ?       ? 
1 1 1   50    4   22 o    292.8    2.8    0.0000   0.0000          ?        ?   857.5345  16.6016          ?        ?      292.8        2.8       ?       ? 
1 1 1   50    4   23 o    244.3    3.1    0.0000   0.0000          ?        ?   597.0177  15.3245          ?        ?      244.3        3.1       ?       ? 
1 1 1   50    4   24 o    527.0    2.7    0.0000   0.0000          ?        ?  2778.8462  28.0950          ?        ?      527.0        2.7       ?       ? 
1 1 1   50    4   25 f    155.0    4.7    0.0000   0.0000          ?        ?   240.7227  14.6860          ?        ?      155.0        4.7       ?       ? 
1 1 1   50    4   26 o     20.0    9.8    0.0000   0.0000          ?        ?   -26.8179  13.4090          ?        ?       20.0        9.8       ?       ? 
1 1 1   50    4   27 o    155.0    4.7    0.0000   0.0000          ?        ?   240.7227  14.6860          ?        ?      155.0        4.7       ?       ? 
1 1 1   50    4   28 o    165.6    4.4    0.0000   0.0000          ?        ?   274.5643  14.6860          ?        ?      165.6        4.4       ?       ? 
1 1 1   50    4   29 o     79.3    9.3    0.0000   0.0000          ?        ?    63.2136  14.6860          ?        ?       79.3        9.3       ?       ? 
1 1 1   50    4   30 o    399.4    2.6    0.0000   0.0000          ?        ?  1596.3041  21.0712          ?        ?      399.4        2.6       ?       ? 
1 1 1   50    4   31 o     70.3   10.4    0.0000   0.0000          ?        ?    49.8047  14.6860          ?        ?       70.3       10.4       ?       ? 
1 1 1   50    4   32 o    169.8    4.7    0.0000   0.0000          ?        ?   288.6118  15.9630          ?        ?      169.8        4.7       ?       ? 
1 1 1   50    4   33 o    109.9    7.3    0.0000   0.0000          ?        ?   121.3191  15.9630          ?        ?      109.9        7.3       ?       ? 
1 1 1   50    4   34 o     58.7   13.8    0.0000   0.0000          ?        ?    36.3957  15.9630          ?        ?       58.7       13.8       ?       ? 
1 1 1   50    4   35 o    187.6    4.6    0.0000   0.0000          ?        ?   352.4639  17.2401          ?        ?      187.6        4.6       ?       ? 
1 1 1   50    4   36 o    334.9    3.0    0.0000   0.0000          ?        ?  1122.5210  19.7942          ?        ?      334.9        3.0       ?       ? 
1 1 1   50    4   37 o    329.1    2.9    0.0000   0.0000          ?        ?  1083.5712  19.1556          ?        ?      329.1        2.9       ?       ? 
1 1 1   50    4   38 o    277.8    3.2    0.0000   0.0000          ?        ?   772.6111  17.8786          ?        ?      277.8        3.2       ?       ? 
1 1 1   50    4   39 o    304.8    3.1    0.0000   0.0000          ?        ?   929.6875  19.1556          ?        ?      304.8        3.1       ?       ? 
1 1 1   50    4   40 o     94.9    8.8    0.0000   0.0000          ?        ?    90.6701  16.6016          ?        ?       94.9        8.8       ?       ? 
1 1 1   50    4   41 o    244.0    3.8    0.0000   0.0000          ?        ?   596.3792  18.5171          ?        ?      244.0        3.8       ?       ? 
1 1 1   50    4   42 o     85.6    9.7    0.0000   0.0000          ?        ?    74.0685  16.6016          ?        ?       85.6        9.7       ?       ? 
1 1 1   50    4   43 o     75.6   11.4    0.0000   0.0000          ?        ?    58.1055  17.2401          ?        ?       75.6       11.4       ?       ? 
1 1 1   50    4   44 o    238.4    3.7    0.0000   0.0000          ?        ?   569.5613  17.8786          ?        ?      238.4        3.7       ?       ? 
1 1 1   50    4   45 o     85.1   10.5    0.0000   0.0000          ?        ?    73.4300  17.8786          ?        ?       85.1       10.5       ?       ? 
1 1 1   50    4   46 o    250.8    3.8    0.0000   0.0000          ?        ?   630.2208  19.1556          ?        ?      250.8        3.8       ?       ? 
1 1 1   50    4   47 o    134.2    6.4    0.0000   0.0000          ?        ?   181.3401  17.2401          ?        ?      134.2        6.4       ?       ? 
1 1 1   50    4   48 o    238.2    3.8    0.0000   0.0000          ?        ?   568.9227  17.8786          ?        ?      238.2        3.8       ?       ? 
1 1 1   50    4   49 o     28.5   13.1    0.0000   0.0000          ?        ?   -12.1319  17.2401          ?        ?       28.5       13.1       ?       ? 
1 1 1   50    4   50 o    122.2    7.1    0.0000   0.0000          ?        ?   150.6911  17.2401          ?        ?      122.2        7.1       ?       ? 
1 1 1   50    4   51 o    158.8    5.2    0.0000   0.0000          ?        ?   253.4931  16.6016          ?        ?      158.8        5.2       ?       ? 
1 1 1   50    5    0 o    400.0    3.4 1600.7737  27.4564  1600.7737  27.4564  1600.7737  27.4564      400.0      3.4      400.0        3.4     0.0     0.0 
1 1 1   50    5    1 o    384.6    2.8    0.0000   0.0000          ?        ?  1479.4546  21.7097          ?        ?      384.6        2.8       ?       ? 
1 1 1   50    5    2 o    358.7    2.8    0.0000   0.0000          ?        ?  1287.2596  19.7942          ?        ?      358.7        2.8       ?       ? 
1 1 1   50    5    3 o    215.4    3.3    0.0000   0.0000          ?        ?   464.2052  14.0475          ?        ?      215.4        3.3       ?       ? 
1 1 1   50    5    4 o    379.7    2.6    0.0000   0.0000          ?        ?  1441.7819  19.7942          ?        ?      379.7        2.6       ?       ? 
1 1 1   50    5    5 o     29.6   12.7    0.0000   0.0000          ?        ?    -0.6385  13.4090          ?        ?       29.6       12.7       ?       ? 
1 1 1   50    5    6 o    113.2    5.4    0.0000   0.0000          ?        ?   128.3428  12.1319          ?        ?      113.2        5.4       ?       ? 
1 1 1   50    5    7 o    268.6    2.9    0.0000   0.0000          ?        ?   721.5294  15.3245          ?        ?      268.6        2.9       ?       ? 
1 1 1   50    5    8 o     89.2    7.2    0.0000   0.0000          ?        ?    79.8152  12.7704          ?        ?       89.2        7.2       ?       ? 
1 1 1   50    5    9 o    281.8    2.8    0.0000   0.0000          ?        ?   794.3209  15.9630          ?        ?      281.8        2.8       ?       ? 
1 1 1   50    5   10 o    217.3    3.2    0.0000   0.0000          ?        ?   472.5060  14.0475          ?        ?      217.3        3.2       ?       ? 
1 1 1   50    5   11 o    135.5    4.9    0.0000   0.0000          ?        ?   183.8942  13.4090          ?        ?      135.5        4.9       ?       ? 
1 1 1   50    5   12 o    298.1    2.8    0.0000   0.0000          ?        ?   888.8221  16.6016          ?        ?      298.1        2.8       ?       ? 
1 1 1   50    5   13 o    239.1    2.9    0.0000   0.0000          ?        ?   572.1154  14.0475          ?        ?      239.1        2.9       ?       ? 
1 1 1   50    5   14 o    282.7    3.2    0.0000   0.0000          ?        ?   799.4291  17.8786          ?        ?      282.7        3.2       ?       ? 
1 1 1   50    5   15 o     18.4    9.1    0.0000   0.0000          ?        ?   -30.6490  12.7704          ?        ?       18.4        9.1       ?       ? 
1 1 1   50    5   16 o     96.7    7.3    0.0000   0.0000          ?        ?    93.8627  14.0475          ?        ?       96.7        7.3       ?       ? 
1 1 1   50    5   17 o     59.1   11.8    0.0000   0.0000          ?        ?    36.3957  13.4090          ?        ?       59.1       11.8       ?       ? 
1 1 1   50    5   18 o    242.8    2.9    0.0000   0.0000          ?        ?   589.9940  14.0475          ?        ?      242.8        2.9       ?       ? 
1 1 1   50    5   19 o    404.2    2.6    0.0000   0.0000          ?        ?  1634.6154  21.0712          ?        ?      404.2        2.6       ?       ? 
1 1 1   50    5   20 o    297.0    2.7    0.0000   0.0000          ?        ?   882.4369  15.9630          ?        ?      297.0        2.7       ?       ? 
1 1 1   50    5   21 o    347.0    2.6    0.0000   0.0000          ?        ?  1204.8903  17.8786          ?        ?      347.0        2.6       ?       ? 
1 1 1   50    5   22 o    224.1    3.4    0.0000   0.0000          ?        ?   502.5165  15.3245          ?        ?      224.1        3.4       ?       ? 
1 1 1   50    5   23 o    427.1    2.5    0.0000   0.0000          ?        ?  1824.8948  21.7097          ?        ?      427.1        2.5       ?       ? 
1 1 1   50    5   24 f    378.4    2.8    0.0000   0.0000          ?        ?  1432.2040  21.0712          ?        ?      378.4        2.8       ?       ? 
1 1 1   50    5   25 o    115.1    6.4    0.0000   0.0000          ?        ?   132.8125  14.6860          ?        ?      115.1        6.4       ?       ? 
1 1 1   50    5   26 o    127.2    5.5    0.0000   0.0000          ?        ?   162.1845  14.0475          ?        ?      127.2        5.5       ?       ? 
1 1 1   50    5   27 o    166.6    4.2    0.0000   0.0000          ?        ?   277.7569  14.0475          ?        ?      166.6        4.2       ?       ? 
1 1 1   50    5   28 o    273.6    3.0    0.0000   0.0000          ?        ?   748.9859  16.6016          ?        ?      273.6        3.0       ?       ? 
1 1 1   50    5   29 o    173.3    4.2    0.0000   0.0000          ?        ?   300.7437  14.6860          ?        ?      173.3        4.2       ?       ? 
1 1 1   50    5   30 o     82.4    8.9    0.0000   0.0000          ?        ?    68.3218  14.6860          ?        ?       82.4        8.9       ?       ? 
1 1 1   50    5   31 o    277.2    3.0    0.0000   0.0000          ?        ?   768.7800  16.6016          ?        ?      277.2        3.0       ?       ? 
1 1 1   50    5   32 o    347.4    2.7    0.0000   0.0000          ?        ?  1207.4445  18.5171          ?        ?      347.4        2.7       ?       ? 
1 1 1   50    5   33 o    137.8    5.6    0.0000   0.0000          ?        ?   190.2794  15.3245          ?        ?      137.8        5.6       ?       ? 
1 1 1   50    5   34 o    163.4    4.9    0.0000   0.0000          ?        ?   267.5406  15.9630          ?        ?      163.4        4.9       ?       ? 
1 1 1   50    5   35 o    203.3    4.1    0.0000   0.0000          ?        ?   413.7620  16.6016          ?        ?      203.3        4.1       ?       ? 
1 1 1   50    5   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50    5   37 o    158.0    5.1    0.0000   0.0000          ?        ?   250.3005  15.9630          ?        ?      158.0        5.1       ?       ? 
1 1 1   50    5   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50    5   39 o    297.9    3.1    0.0000   0.0000          ?        ?   888.1836  18.5171          ?        ?      297.9        3.1       ?       ? 
1 1 1   50    5   40 o    337.6    3.0    0.0000   0.0000          ?        ?  1141.0381  20.4327          ?        ?      337.6        3.0       ?       ? 
1 1 1   50    5   41 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50    5   42 f    144.2    5.8    0.0000   0.0000          ?        ?   208.7966  16.6016          ?        ?      144.2        5.8       ?       ? 
1 1 1   50    5   43 o    223.1    3.9    0.0000   0.0000          ?        ?   498.6854  17.2401          ?        ?      223.1        3.9       ?       ? 
1 1 1   50    5   44 o    210.1    4.4    0.0000   0.0000          ?        ?   442.4955  18.5171          ?        ?      210.1        4.4       ?       ? 
1 1 1   50    5   45 o     47.4   15.7    0.0000   0.0000          ?        ?    22.3483  17.2401          ?        ?       47.4       15.7       ?       ? 
1 1 1   50    5   46 o     30.8   13.7    0.0000   0.0000          ?        ?    -6.3852  17.2401          ?        ?       30.8       13.7       ?       ? 
1 1 1   50    5   47 o    102.4    8.1    0.0000   0.0000          ?        ?   105.9946  16.6016          ?        ?      102.4        8.1       ?       ? 
1 1 1   50    5   48 o     76.2   11.3    0.0000   0.0000          ?        ?    59.3825  17.2401          ?        ?       76.2       11.3       ?       ? 
1 1 1   50    5   49 o    350.5    2.9    0.0000   0.0000          ?        ?  1230.4312  20.4327          ?        ?      350.5        2.9       ?       ? 
1 1 1   50    5   50 o     75.6   11.4    0.0000   0.0000          ?        ?    58.7440  17.2401          ?        ?       75.6       11.4       ?       ? 
1 1 1   50    6    0 o    382.1    4.3 1460.9375  33.2031  1460.9375  33.2031  1460.9375  33.2031      382.1      4.3      382.1        4.3     0.0     0.0 
1 1 1   50    6    1 o    211.7    3.3    0.0000   0.0000          ?        ?   448.2422  14.0475          ?        ?      211.7        3.3       ?       ? 
1 1 1   50    6    2 o     87.8    6.9    0.0000   0.0000          ?        ?    77.2611  12.1319          ?        ?       87.8        6.9       ?       ? 
1 1 1   50    6    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50    6    4 o    220.8    3.5    0.0000   0.0000          ?        ?   487.8305  15.3245          ?        ?      220.8        3.5       ?       ? 
1 1 1   50    6    5 o    353.3    2.9    0.0000   0.0000          ?        ?  1248.9484  20.4327          ?        ?      353.3        2.9       ?       ? 
1 1 1   50    6    6 o    513.7    3.0    0.0000   0.0000          ?        ?  2640.2869  31.2876          ?        ?      513.7        3.0       ?       ? 
1 1 1   50    6    7 o    309.1    3.0    0.0000   0.0000          ?        ?   955.8669  18.5171          ?        ?      309.1        3.0       ?       ? 
1 1 1   50    6    8 o    692.3    3.3    0.0000   0.0000          ?        ?  4795.9355  45.9736          ?        ?      692.3        3.3       ?       ? 
1 1 1   50    6    9 o    394.6    2.8    0.0000   0.0000          ?        ?  1557.9928  21.7097          ?        ?      394.6        2.8       ?       ? 
1 1 1   50    6   10 f    325.0    2.7    0.0000   0.0000          ?        ?  1056.7533  17.2401          ?        ?      325.0        2.7       ?       ? 
1 1 1   50    6   11 o    298.0    2.9    0.0000   0.0000          ?        ?   888.1836  17.2401          ?        ?      298.0        2.9       ?       ? 
1 1 1   50    6   12 o    152.8    4.2    0.0000   0.0000          ?        ?   233.6989  12.7704          ?        ?      152.8        4.2       ?       ? 
1 1 1   50    6   13 o    149.0    4.5    0.0000   0.0000          ?        ?   222.2055  13.4090          ?        ?      149.0        4.5       ?       ? 
1 1 1   50    6   14 o    435.8    2.9    0.0000   0.0000          ?        ?  1900.2404  25.5409          ?        ?      435.8        2.9       ?       ? 
1 1 1   50    6   15 o    228.3    3.4    0.0000   0.0000          ?        ?   521.6721  15.3245          ?        ?      228.3        3.4       ?       ? 
1 1 1   50    6   16 o    405.3    2.8    0.0000   0.0000          ?        ?  1643.5547  22.3483          ?        ?      405.3        2.8       ?       ? 
1 1 1   50    6   17 o    430.9    2.8    0.0000   0.0000          ?        ?  1857.4594  24.2638          ?        ?      430.9        2.8       ?       ? 
1 1 1   50    6   18 o    343.3    2.8    0.0000   0.0000          ?        ?  1179.3494  19.1556          ?        ?      343.3        2.8       ?       ? 
1 1 1   50    6   19 o     16.5    8.3    0.0000   0.0000          ?        ?   -40.8654  12.7704          ?        ?       16.5        8.3       ?       ? 
1 1 1   50    6   20 o    265.4    3.0    0.0000   0.0000          ?        ?   704.9279  15.9630          ?        ?      265.4        3.0       ?       ? 
1 1 1   50    6   21 o     19.4    9.6    0.0000   0.0000          ?        ?   -33.2031  14.0475          ?        ?       19.4        9.6       ?       ? 
1 1 1   50    6   22 o    143.1    4.9    0.0000   0.0000          ?        ?   204.9654  14.0475          ?        ?      143.1        4.9       ?       ? 
1 1 1   50    6   23 o    100.9    7.0    0.0000   0.0000          ?        ?   102.1635  14.0475          ?        ?      100.9        7.0       ?       ? 
1 1 1   50    6   24 o    325.8    2.7    0.0000   0.0000          ?        ?  1061.8615  17.8786          ?        ?      325.8        2.7       ?       ? 
1 1 1   50    6   25 o    265.4    3.1    0.0000   0.0000          ?        ?   704.9279  16.6016          ?        ?      265.4        3.1       ?       ? 
1 1 1   50    6   26 f    294.7    2.9    0.0000   0.0000          ?        ?   869.0280  17.2401          ?        ?      294.7        2.9       ?       ? 
1 1 1   50    6   27 o    143.9    5.1    0.0000   0.0000          ?        ?   207.5195  14.6860          ?        ?      143.9        5.1       ?       ? 
1 1 1   50    6   28 o    465.1    2.5    0.0000   0.0000          ?        ?  2164.5884  23.6253          ?        ?      465.1        2.5       ?       ? 
1 1 1   50    6   29 o    144.3    5.5    0.0000   0.0000          ?        ?   208.7966  15.9630          ?        ?      144.3        5.5       ?       ? 
1 1 1   50    6   30 o     30.3   13.1    0.0000   0.0000          ?        ?    -1.9156  14.6860          ?        ?       30.3       13.1       ?       ? 
1 1 1   50    6   31 o    248.9    3.3    0.0000   0.0000          ?        ?   620.0045  16.6016          ?        ?      248.9        3.3       ?       ? 
1 1 1   50    6   32 f    262.3    3.2    0.0000   0.0000          ?        ?   688.3264  16.6016          ?        ?      262.3        3.2       ?       ? 
1 1 1   50    6   33 o    348.6    2.9    0.0000   0.0000          ?        ?  1216.3837  20.4327          ?        ?      348.6        2.9       ?       ? 
1 1 1   50    6   34 o     90.4    9.2    0.0000   0.0000          ?        ?    82.3693  16.6016          ?        ?       90.4        9.2       ?       ? 
1 1 1   50    6   35 o    234.2    3.5    0.0000   0.0000          ?        ?   549.1286  16.6016          ?        ?      234.2        3.5       ?       ? 
1 1 1   50    6   36 o     24.7   11.8    0.0000   0.0000          ?        ?   -20.4327  15.9630          ?        ?       24.7       11.8       ?       ? 
1 1 1   50    6   37 o     22.7   11.0    0.0000   0.0000          ?        ?   -28.0950  15.9630          ?        ?       22.7       11.0       ?       ? 
1 1 1   50    6   38 o    172.3    4.8    0.0000   0.0000          ?        ?   297.5511  16.6016          ?        ?      172.3        4.8       ?       ? 
1 1 1   50    6   39 o    130.8    6.1    0.0000   0.0000          ?        ?   171.7623  15.9630          ?        ?      130.8        6.1       ?       ? 
1 1 1   50    6   40 o    102.3    8.1    0.0000   0.0000          ?        ?   105.3561  16.6016          ?        ?      102.3        8.1       ?       ? 
1 1 1   50    6   41 o     21.9   10.8    0.0000   0.0000          ?        ?   -34.4802  16.6016          ?        ?       21.9       10.8       ?       ? 
1 1 1   50    6   42 o    311.3    3.2    0.0000   0.0000          ?        ?   970.5529  19.7942          ?        ?      311.3        3.2       ?       ? 
1 1 1   50    6   43 o    251.7    3.6    0.0000   0.0000          ?        ?   634.6905  17.8786          ?        ?      251.7        3.6       ?       ? 
1 1 1   50    6   44 o    128.7    6.7    0.0000   0.0000          ?        ?   166.6541  17.2401          ?        ?      128.7        6.7       ?       ? 
1 1 1   50    6   45 o     20.8   10.4    0.0000   0.0000          ?        ?   -44.0580  17.2401          ?        ?       20.8       10.4       ?       ? 
1 1 1   50    6   46 o     28.6   13.1    0.0000   0.0000          ?        ?   -12.1319  17.2401          ?        ?       28.6       13.1       ?       ? 
1 1 1   50    6   47 o     35.1   14.7    0.0000   0.0000          ?        ?     3.1926  17.2401          ?        ?       35.1       14.7       ?       ? 
1 1 1   50    6   48 o    238.4    3.9    0.0000   0.0000          ?        ?   570.1998  18.5171          ?        ?      238.4        3.9       ?       ? 
1 1 1   50    6   49 o    166.0    5.4    0.0000   0.0000          ?        ?   277.1184  17.8786          ?        ?      166.0        5.4       ?       ? 
1 1 1   50    7    0 o     83.0   10.8   70.2374  17.8786    70.2374  17.8786    70.2374  17.8786       83.0     10.8       83.0       10.8     0.0     0.0 
1 1 1   50    7    1 o    415.0    3.0    0.0000   0.0000          ?        ?  1722.7313  24.9023          ?        ?      415.0        3.0       ?       ? 
1 1 1   50    7    2 o     97.4    6.6    0.0000   0.0000          ?        ?    95.1397  12.7704          ?        ?       97.4        6.6       ?       ? 
1 1 1   50    7    3 o    300.0    3.1    0.0000   0.0000          ?        ?   900.3155  18.5171          ?        ?      300.0        3.1       ?       ? 
1 1 1   50    7    4 o    109.5    5.5    0.0000   0.0000          ?        ?   120.0421  12.1319          ?        ?      109.5        5.5       ?       ? 
1 1 1   50    7    5 f    229.7    3.5    0.0000   0.0000          ?        ?   528.0574  15.9630          ?        ?      229.7        3.5       ?       ? 
1 1 1   50    7    6 o    332.4    2.8    0.0000   0.0000          ?        ?  1105.2810  18.5171          ?        ?      332.4        2.8       ?       ? 
1 1 1   50    7    7 o    373.7    3.0    0.0000   0.0000          ?        ?  1397.0853  22.3483          ?        ?      373.7        3.0       ?       ? 
1 1 1   50    7    8 o    307.0    3.0    0.0000   0.0000          ?        ?   943.0964  18.5171          ?        ?      307.0        3.0       ?       ? 
1 1 1   50    7    9 o    105.9    6.0    0.0000   0.0000          ?        ?   112.3798  12.7704          ?        ?      105.9        6.0       ?       ? 
1 1 1   50    7   10 o    205.4    3.3    0.0000   0.0000          ?        ?   422.0628  13.4090          ?        ?      205.4        3.3       ?       ? 
1 1 1   50    7   11 o     44.3   13.7    0.0000   0.0000          ?        ?    19.7942  13.4090          ?        ?       44.3       13.7       ?       ? 
1 1 1   50    7   12 o    172.8    4.1    0.0000   0.0000          ?        ?   298.8281  14.0475          ?        ?      172.8        4.1       ?       ? 
1 1 1   50    7   13 o    260.8    3.2    0.0000   0.0000          ?        ?   680.6641  16.6016          ?        ?      260.8        3.2       ?       ? 
1 1 1   50    7   14 o    201.4    3.8    0.0000   0.0000          ?        ?   406.0997  15.3245          ?        ?      201.4        3.8       ?       ? 
1 1 1   50    7   15 o    307.5    2.8    0.0000   0.0000          ?        ?   946.2890  17.2401          ?        ?      307.5        2.8       ?       ? 
1 1 1   50    7   16 o    166.6    4.4    0.0000   0.0000          ?        ?   277.7569  14.6860          ?        ?      166.6        4.4       ?       ? 
1 1 1   50    7   17 o     49.1   14.2    0.0000   0.0000          ?        ?    24.9023  14.6860          ?        ?       49.1       14.2       ?       ? 
1 1 1   50    7   18 f    298.9    3.0    0.0000   0.0000          ?        ?   893.9303  17.8786          ?        ?      298.9        3.0       ?       ? 
1 1 1   50    7   19 o    306.7    2.8    0.0000   0.0000          ?        ?   941.1808  17.2401          ?        ?      306.7        2.8       ?       ? 
1 1 1   50    7   20 o    379.5    2.6    0.0000   0.0000          ?        ?  1441.1433  19.7942          ?        ?      379.5        2.6       ?       ? 
1 1 1   50    7   21 o    114.3    6.1    0.0000   0.0000          ?        ?   130.8969  14.0475          ?        ?      114.3        6.1       ?       ? 
1 1 1   50    7   22 o     94.1    7.1    0.0000   0.0000          ?        ?    88.7545  13.4090          ?        ?       94.1        7.1       ?       ? 
1 1 1   50    7   23 o     94.7    7.4    0.0000   0.0000          ?        ?    90.0316  14.0475          ?        ?       94.7        7.4       ?       ? 
1 1 1   50    7   24 o    100.6    6.7    0.0000   0.0000          ?        ?   101.5249  13.4090          ?        ?      100.6        6.7       ?       ? 
1 1 1   50    7   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50    7   26 o    115.1    6.7    0.0000   0.0000          ?        ?   132.8125  15.3245          ?        ?      115.1        6.7       ?       ? 
1 1 1   50    7   27 o    317.9    2.7    0.0000   0.0000          ?        ?  1011.4182  17.2401          ?        ?      317.9        2.7       ?       ? 
1 1 1   50    7   28 f    143.5    5.1    0.0000   0.0000          ?        ?   206.2425  14.6860          ?        ?      143.5        5.1       ?       ? 
1 1 1   50    7   29 o     18.9    9.4    0.0000   0.0000          ?        ?   -39.5883  14.6860          ?        ?       18.9        9.4       ?       ? 
1 1 1   50    7   30 o    398.1    2.6    0.0000   0.0000          ?        ?  1585.4492  21.0712          ?        ?      398.1        2.6       ?       ? 
1 1 1   50    7   31 o     97.6    7.8    0.0000   0.0000          ?        ?    95.7782  15.3245          ?        ?       97.6        7.8       ?       ? 
1 1 1   50    7   32 o    291.2    3.3    0.0000   0.0000          ?        ?   848.5952  19.1556          ?        ?      291.2        3.3       ?       ? 
1 1 1   50    7   33 o     49.4   15.3    0.0000   0.0000          ?        ?    24.9023  16.6016          ?        ?       49.4       15.3       ?       ? 
1 1 1   50    7   34 o    200.1    4.1    0.0000   0.0000          ?        ?   400.9916  16.6016          ?        ?      200.1        4.1       ?       ? 
1 1 1   50    7   35 o    205.0    4.0    0.0000   0.0000          ?        ?   420.7858  16.6016          ?        ?      205.0        4.0       ?       ? 
1 1 1   50    7   36 f    146.2    5.7    0.0000   0.0000          ?        ?   214.5433  16.6016          ?        ?      146.2        5.7       ?       ? 
1 1 1   50    7   37 o    154.1    5.2    0.0000   0.0000          ?        ?   238.1686  15.9630          ?        ?      154.1        5.2       ?       ? 
1 1 1   50    7   38 o    176.1    4.7    0.0000   0.0000          ?        ?   310.9600  16.6016          ?        ?      176.1        4.7       ?       ? 
1 1 1   50    7   39 o    231.0    3.7    0.0000   0.0000          ?        ?   534.4426  17.2401          ?        ?      231.0        3.7       ?       ? 
1 1 1   50    7   40 o     62.5   14.1    0.0000   0.0000          ?        ?    41.5039  17.2401          ?        ?       62.5       14.1       ?       ? 
1 1 1   50    7   41 o    402.6    2.8    0.0000   0.0000          ?        ?  1622.4835  22.3483          ?        ?      402.6        2.8       ?       ? 
1 1 1   50    7   42 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50    7   43 o    280.9    3.4    0.0000   0.0000          ?        ?   790.4898  19.1556          ?        ?      280.9        3.4       ?       ? 
1 1 1   50    7   44 o     81.9   10.9    0.0000   0.0000          ?        ?    68.3218  17.8786          ?        ?       81.9       10.9       ?       ? 
1 1 1   50    7   45 f    221.4    4.0    0.0000   0.0000          ?        ?   491.6617  17.8786          ?        ?      221.4        4.0       ?       ? 
1 1 1   50    7   46 f    163.1    5.5    0.0000   0.0000          ?        ?   267.5406  17.8786          ?        ?      163.1        5.5       ?       ? 
1 1 1   50    7   47 o    374.7    2.9    0.0000   0.0000          ?        ?  1406.0247  21.7097          ?        ?      374.7        2.9       ?       ? 
1 1 1   50    7   48 o     59.0   14.7    0.0000   0.0000          ?        ?    37.6728  17.2401          ?        ?       59.0       14.7       ?       ? 
1 1 1   50    8    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50    8    1 o    128.3    4.7    0.0000   0.0000          ?        ?   164.7386  12.1319          ?        ?      128.3        4.7       ?       ? 
1 1 1   50    8    2 o     37.8   12.8    0.0000   0.0000          ?        ?    13.4090  11.4934          ?        ?       37.8       12.8       ?       ? 
1 1 1   50    8    3 o    339.4    2.6    0.0000   0.0000          ?        ?  1152.5315  17.8786          ?        ?      339.4        2.6       ?       ? 
1 1 1   50    8    4 o    488.0    3.0    0.0000   0.0000          ?        ?  2382.9629  29.3720          ?        ?      488.0        3.0       ?       ? 
1 1 1   50    8    5 o    211.6    3.5    0.0000   0.0000          ?        ?   448.2422  14.6860          ?        ?      211.6        3.5       ?       ? 
1 1 1   50    8    6 o    157.5    3.9    0.0000   0.0000          ?        ?   248.3849  12.1319          ?        ?      157.5        3.9       ?       ? 
1 1 1   50    8    7 o    218.6    3.2    0.0000   0.0000          ?        ?   478.2527  14.0475          ?        ?      218.6        3.2       ?       ? 
1 1 1   50    8    8 o    533.4    3.0    0.0000   0.0000          ?        ?  2846.5293  31.9261          ?        ?      533.4        3.0       ?       ? 
1 1 1   50    8    9 o    179.7    3.6    0.0000   0.0000          ?        ?   323.0919  12.7704          ?        ?      179.7        3.6       ?       ? 
1 1 1   50    8   10 o    266.2    3.0    0.0000   0.0000          ?        ?   708.7590  15.9630          ?        ?      266.2        3.0       ?       ? 
1 1 1   50    8   11 o    187.5    3.6    0.0000   0.0000          ?        ?   351.8254  13.4090          ?        ?      187.5        3.6       ?       ? 
1 1 1   50    8   12 o    593.4    3.3    0.0000   0.0000          ?        ?  3524.0010  38.9498          ?        ?      593.4        3.3       ?       ? 
1 1 1   50    8   13 o    468.1    3.1    0.0000   0.0000          ?        ?  2192.6831  28.7335          ?        ?      468.1        3.1       ?       ? 
1 1 1   50    8   14 o    307.8    2.7    0.0000   0.0000          ?        ?   947.5660  16.6016          ?        ?      307.8        2.7       ?       ? 
1 1 1   50    8   15 o     77.7    8.2    0.0000   0.0000          ?        ?    60.6596  12.7704          ?        ?       77.7        8.2       ?       ? 
1 1 1   50    8   16 o    105.0    6.4    0.0000   0.0000          ?        ?   110.4642  13.4090          ?        ?      105.0        6.4       ?       ? 
1 1 1   50    8   17 f     92.7    7.2    0.0000   0.0000          ?        ?    86.2004  13.4090          ?        ?       92.7        7.2       ?       ? 
1 1 1   50    8   18 o    310.0    2.9    0.0000   0.0000          ?        ?   961.6136  17.8786          ?        ?      310.0        2.9       ?       ? 
1 1 1   50    8   19 o    176.1    4.2    0.0000   0.0000          ?        ?   310.3215  14.6860          ?        ?      176.1        4.2       ?       ? 
1 1 1   50    8   20 o    145.1    4.8    0.0000   0.0000          ?        ?   210.7121  14.0475          ?        ?      145.1        4.8       ?       ? 
1 1 1   50    8   21 o    203.2    3.8    0.0000   0.0000          ?        ?   413.1235  15.3245          ?        ?      203.2        3.8       ?       ? 
1 1 1   50    8   22 o    159.9    4.8    0.0000   0.0000          ?        ?   256.0471  15.3245          ?        ?      159.9        4.8       ?       ? 
1 1 1   50    8   23 o    226.8    3.5    0.0000   0.0000          ?        ?   514.6484  15.9630          ?        ?      226.8        3.5       ?       ? 
1 1 1   50    8   24 o    190.5    3.9    0.0000   0.0000          ?        ?   363.3188  14.6860          ?        ?      190.5        3.9       ?       ? 
1 1 1   50    8   25 o    176.8    4.2    0.0000   0.0000          ?        ?   312.8756  14.6860          ?        ?      176.8        4.2       ?       ? 
1 1 1   50    8   26 o    236.8    3.4    0.0000   0.0000          ?        ?   561.2605  15.9630          ?        ?      236.8        3.4       ?       ? 
1 1 1   50    8   27 o    209.3    3.7    0.0000   0.0000          ?        ?   438.6643  15.3245          ?        ?      209.3        3.7       ?       ? 
1 1 1   50    8   28 o     74.7    9.8    0.0000   0.0000          ?        ?    56.1899  14.6860          ?        ?       74.7        9.8       ?       ? 
1 1 1   50    8   29 o    299.2    3.0    0.0000   0.0000          ?        ?   895.8459  17.8786          ?        ?      299.2        3.0       ?       ? 
1 1 1   50    8   30 o    224.5    3.7    0.0000   0.0000          ?        ?   504.4321  16.6016          ?        ?      224.5        3.7       ?       ? 
1 1 1   50    8   31 o    247.1    3.5    0.0000   0.0000          ?        ?   611.0652  17.2401          ?        ?      247.1        3.5       ?       ? 
1 1 1   50    8   32 o    279.7    3.2    0.0000   0.0000          ?        ?   782.8275  17.8786          ?        ?      279.7        3.2       ?       ? 
1 1 1   50    8   33 f    222.9    3.9    0.0000   0.0000          ?        ?   497.4084  17.2401          ?        ?      222.9        3.9       ?       ? 
1 1 1   50    8   34 o     30.5   13.6    0.0000   0.0000          ?        ?    -5.7467  16.6016          ?        ?       30.5       13.6       ?       ? 
1 1 1   50    8   35 o    187.9    4.2    0.0000   0.0000          ?        ?   353.7410  15.9630          ?        ?      187.9        4.2       ?       ? 
1 1 1   50    8   36 o    144.0    5.5    0.0000   0.0000          ?        ?   208.1580  15.9630          ?        ?      144.0        5.5       ?       ? 
1 1 1   50    8   37 o    218.5    3.8    0.0000   0.0000          ?        ?   478.2527  16.6016          ?        ?      218.5        3.8       ?       ? 
1 1 1   50    8   38 o    225.1    3.8    0.0000   0.0000          ?        ?   507.6247  17.2401          ?        ?      225.1        3.8       ?       ? 
1 1 1   50    8   39 o    119.0    7.0    0.0000   0.0000          ?        ?   142.3903  16.6016          ?        ?      119.0        7.0       ?       ? 
1 1 1   50    8   40 o     67.9   12.7    0.0000   0.0000          ?        ?    48.5276  16.6016          ?        ?       67.9       12.7       ?       ? 
1 1 1   50    8   41 o     77.7   10.3    0.0000   0.0000          ?        ?    61.2981  15.9630          ?        ?       77.7       10.3       ?       ? 
1 1 1   50    8   42 o     23.8   11.5    0.0000   0.0000          ?        ?   -28.7335  17.2401          ?        ?       23.8       11.5       ?       ? 
1 1 1   50    8   43 o     50.6   15.2    0.0000   0.0000          ?        ?    26.8179  16.6016          ?        ?       50.6       15.2       ?       ? 
1 1 1   50    8   44 o    141.8    6.1    0.0000   0.0000          ?        ?   202.4114  17.2401          ?        ?      141.8        6.1       ?       ? 
1 1 1   50    8   45 o    131.6    6.3    0.0000   0.0000          ?        ?   174.3164  16.6016          ?        ?      131.6        6.3       ?       ? 
1 1 1   50    8   46 o     53.5   15.3    0.0000   0.0000          ?        ?    30.6490  17.2401          ?        ?       53.5       15.3       ?       ? 
1 1 1   50    8   47 o    239.2    3.9    0.0000   0.0000          ?        ?   574.0309  18.5171          ?        ?      239.2        3.9       ?       ? 
1 1 1   50    9    0 o    196.5    4.9  386.9441  19.1556   386.9441  19.1556   386.9441  19.1556      196.5      4.9      196.5        4.9     0.0     0.0 
1 1 1   50    9    1 o    247.6    3.0    0.0000   0.0000          ?        ?   613.6193  14.6860          ?        ?      247.6        3.0       ?       ? 
1 1 1   50    9    2 f     33.5   12.6    0.0000   0.0000          ?        ?     8.3008  11.4934          ?        ?       33.5       12.6       ?       ? 
1 1 1   50    9    3 o     18.9    9.2    0.0000   0.0000          ?        ?   -21.7097  11.4934          ?        ?       18.9        9.2       ?       ? 
1 1 1   50    9    4 o     37.8   12.8    0.0000   0.0000          ?        ?    13.4090  11.4934          ?        ?       37.8       12.8       ?       ? 
1 1 1   50    9    5 o    495.1    2.8    0.0000   0.0000          ?        ?  2452.5615  27.4564          ?        ?      495.1        2.8       ?       ? 
1 1 1   50    9    6 o    261.6    3.2    0.0000   0.0000          ?        ?   684.4952  16.6016          ?        ?      261.6        3.2       ?       ? 
1 1 1   50    9    7 o    224.7    3.3    0.0000   0.0000          ?        ?   505.0706  14.6860          ?        ?      224.7        3.3       ?       ? 
1 1 1   50    9    8 o    411.0    3.0    0.0000   0.0000          ?        ?  1690.1669  24.9023          ?        ?      411.0        3.0       ?       ? 
1 1 1   50    9    9 o    239.0    2.9    0.0000   0.0000          ?        ?   571.4769  14.0475          ?        ?      239.0        2.9       ?       ? 
1 1 1   50    9   10 o    437.4    2.6    0.0000   0.0000          ?        ?  1914.2877  22.9868          ?        ?      437.4        2.6       ?       ? 
1 1 1   50    9   11 o    293.7    2.9    0.0000   0.0000          ?        ?   863.2812  17.2401          ?        ?      293.7        2.9       ?       ? 
1 1 1   50    9   12 o     50.6   13.1    0.0000   0.0000          ?        ?    26.8179  13.4090          ?        ?       50.6       13.1       ?       ? 
1 1 1   50    9   13 o    148.3    4.3    0.0000   0.0000          ?        ?   220.2900  12.7704          ?        ?      148.3        4.3       ?       ? 
1 1 1   50    9   14 o    344.3    3.1    0.0000   0.0000          ?        ?  1186.3732  21.0712          ?        ?      344.3        3.1       ?       ? 
1 1 1   50    9   15 o    307.6    2.9    0.0000   0.0000          ?        ?   946.9276  17.8786          ?        ?      307.6        2.9       ?       ? 
1 1 1   50    9   16 o    392.1    2.9    0.0000   0.0000          ?        ?  1538.1986  22.9868          ?        ?      392.1        2.9       ?       ? 
1 1 1   50    9   17 o    316.4    2.9    0.0000   0.0000          ?        ?  1001.8404  18.5171          ?        ?      316.4        2.9       ?       ? 
1 1 1   50    9   18 o    257.6    3.0    0.0000   0.0000          ?        ?   664.0625  15.3245          ?        ?      257.6        3.0       ?       ? 
1 1 1   50    9   19 o     84.4    8.7    0.0000   0.0000          ?        ?    71.5144  14.6860          ?        ?       84.4        8.7       ?       ? 
1 1 1   50    9   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50    9   21 o     90.2    7.8    0.0000   0.0000          ?        ?    81.7308  14.0475          ?        ?       90.2        7.8       ?       ? 
1 1 1   50    9   22 o    342.8    2.7    0.0000   0.0000          ?        ?  1175.5183  18.5171          ?        ?      342.8        2.7       ?       ? 
1 1 1   50    9   23 o    348.4    2.7    0.0000   0.0000          ?        ?  1214.4681  19.1556          ?        ?      348.4        2.7       ?       ? 
1 1 1   50    9   24 o    187.3    3.9    0.0000   0.0000          ?        ?   351.1869  14.6860          ?        ?      187.3        3.9       ?       ? 
1 1 1   50    9   25 f    131.6    5.8    0.0000   0.0000          ?        ?   173.6779  15.3245          ?        ?      131.6        5.8       ?       ? 
1 1 1   50    9   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50    9   27 o     48.1   14.6    0.0000   0.0000          ?        ?    23.6253  15.3245          ?        ?       48.1       14.6       ?       ? 
1 1 1   50    9   28 o    234.0    3.4    0.0000   0.0000          ?        ?   547.8516  15.9630          ?        ?      234.0        3.4       ?       ? 
1 1 1   50    9   29 f     32.3   13.8    0.0000   0.0000          ?        ?    -0.6385  15.9630          ?        ?       32.3       13.8       ?       ? 
1 1 1   50    9   30 o    288.4    3.1    0.0000   0.0000          ?        ?   832.6321  17.8786          ?        ?      288.4        3.1       ?       ? 
1 1 1   50    9   31 o    226.7    3.7    0.0000   0.0000          ?        ?   514.6484  16.6016          ?        ?      226.7        3.7       ?       ? 
1 1 1   50    9   32 o    106.0    7.2    0.0000   0.0000          ?        ?   113.0183  15.3245          ?        ?      106.0        7.2       ?       ? 
1 1 1   50    9   33 o    256.6    3.4    0.0000   0.0000          ?        ?   658.9543  17.2401          ?        ?      256.6        3.4       ?       ? 
1 1 1   50    9   34 o    187.4    4.4    0.0000   0.0000          ?        ?   351.8254  16.6016          ?        ?      187.4        4.4       ?       ? 
1 1 1   50    9   35 f     36.0   14.5    0.0000   0.0000          ?        ?     6.3852  15.9630          ?        ?       36.0       14.5       ?       ? 
1 1 1   50    9   36 o    313.7    3.1    0.0000   0.0000          ?        ?   985.2389  19.1556          ?        ?      313.7        3.1       ?       ? 
1 1 1   50    9   37 o     66.3   12.0    0.0000   0.0000          ?        ?    45.9736  15.3245          ?        ?       66.3       12.0       ?       ? 
1 1 1   50    9   38 o     66.8   13.9    0.0000   0.0000          ?        ?    47.2506  17.8786          ?        ?       66.8       13.9       ?       ? 
1 1 1   50    9   39 o    176.2    4.9    0.0000   0.0000          ?        ?   311.5985  17.2401          ?        ?      176.2        4.9       ?       ? 
1 1 1   50    9   40 o    117.3    7.1    0.0000   0.0000          ?        ?   138.5592  16.6016          ?        ?      117.3        7.1       ?       ? 
1 1 1   50    9   41 o    200.6    4.3    0.0000   0.0000          ?        ?   403.5457  17.2401          ?        ?      200.6        4.3       ?       ? 
1 1 1   50    9   42 o     55.2   14.8    0.0000   0.0000          ?        ?    32.5646  16.6016          ?        ?       55.2       14.8       ?       ? 
1 1 1   50    9   43 o    286.9    3.4    0.0000   0.0000          ?        ?   824.9699  19.7942          ?        ?      286.9        3.4       ?       ? 
1 1 1   50    9   44 o    158.8    5.6    0.0000   0.0000          ?        ?   253.4931  17.8786          ?        ?      158.8        5.6       ?       ? 
1 1 1   50    9   45 o     28.0   12.9    0.0000   0.0000          ?        ?   -11.4934  16.6016          ?        ?       28.0       12.9       ?       ? 
1 1 1   50    9   46 f     65.4   13.6    0.0000   0.0000          ?        ?    45.9736  17.2401          ?        ?       65.4       13.6       ?       ? 
1 1 1   50   10    0 o     76.1   10.8   60.0210  15.9630    60.0210  15.9630    60.0210  15.9630       76.1     10.8       76.1       10.8     0.0     0.0 
1 1 1   50   10    1 o    190.0    3.4    0.0000   0.0000          ?        ?   361.4032  12.7704          ?        ?      190.0        3.4       ?       ? 
1 1 1   50   10    2 o    378.7    2.9    0.0000   0.0000          ?        ?  1434.7581  21.7097          ?        ?      378.7        2.9       ?       ? 
1 1 1   50   10    3 o    174.8    3.3    0.0000   0.0000          ?        ?   305.8519  11.4934          ?        ?      174.8        3.3       ?       ? 
1 1 1   50   10    4 o    320.0    2.7    0.0000   0.0000          ?        ?  1024.1886  17.2401          ?        ?      320.0        2.7       ?       ? 
1 1 1   50   10    5 o    410.0    2.9    0.0000   0.0000          ?        ?  1681.8660  23.6253          ?        ?      410.0        2.9       ?       ? 
1 1 1   50   10    6 o    447.1    3.0    0.0000   0.0000          ?        ?  1999.8499  26.8179          ?        ?      447.1        3.0       ?       ? 
1 1 1   50   10    7 o    547.1    3.1    0.0000   0.0000          ?        ?  2995.3049  33.8416          ?        ?      547.1        3.1       ?       ? 
1 1 1   50   10    8 o    468.5    2.9    0.0000   0.0000          ?        ?  2195.8757  26.8179          ?        ?      468.5        2.9       ?       ? 
1 1 1   50   10    9 o    304.6    2.9    0.0000   0.0000          ?        ?   928.4104  17.8786          ?        ?      304.6        2.9       ?       ? 
1 1 1   50   10   10 o    325.7    2.8    0.0000   0.0000          ?        ?  1061.2229  18.5171          ?        ?      325.7        2.8       ?       ? 
1 1 1   50   10   11 o    325.4    2.7    0.0000   0.0000          ?        ?  1059.3074  17.8786          ?        ?      325.4        2.7       ?       ? 
1 1 1   50   10   12 o    208.8    3.5    0.0000   0.0000          ?        ?   436.1103  14.6860          ?        ?      208.8        3.5       ?       ? 
1 1 1   50   10   13 o    224.2    3.7    0.0000   0.0000          ?        ?   503.1551  16.6016          ?        ?      224.2        3.7       ?       ? 
1 1 1   50   10   14 o    296.8    2.8    0.0000   0.0000          ?        ?   881.1599  16.6016          ?        ?      296.8        2.8       ?       ? 
1 1 1   50   10   15 o     94.1    7.1    0.0000   0.0000          ?        ?    88.7545  13.4090          ?        ?       94.1        7.1       ?       ? 
1 1 1   50   10   16 o    341.7    3.3    0.0000   0.0000          ?        ?  1168.4946  22.3483          ?        ?      341.7        3.3       ?       ? 
1 1 1   50   10   17 o    365.2    2.9    0.0000   0.0000          ?        ?  1334.5103  21.0712          ?        ?      365.2        2.9       ?       ? 
1 1 1   50   10   18 o    342.9    2.9    0.0000   0.0000          ?        ?  1176.7954  19.7942          ?        ?      342.9        2.9       ?       ? 
1 1 1   50   10   19 o    158.7    4.4    0.0000   0.0000          ?        ?   252.2160  14.0475          ?        ?      158.7        4.4       ?       ? 
1 1 1   50   10   20 o    239.8    3.5    0.0000   0.0000          ?        ?   575.3080  16.6016          ?        ?      239.8        3.5       ?       ? 
1 1 1   50   10   21 o    345.1    3.0    0.0000   0.0000          ?        ?  1191.4814  20.4327          ?        ?      345.1        3.0       ?       ? 
1 1 1   50   10   22 o    312.0    3.2    0.0000   0.0000          ?        ?   974.3840  19.7942          ?        ?      312.0        3.2       ?       ? 
1 1 1   50   10   23 o    212.4    3.8    0.0000   0.0000          ?        ?   451.4348  15.9630          ?        ?      212.4        3.8       ?       ? 
1 1 1   50   10   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50   10   25 o    192.5    4.1    0.0000   0.0000          ?        ?   370.9810  15.9630          ?        ?      192.5        4.1       ?       ? 
1 1 1   50   10   26 o    192.2    3.8    0.0000   0.0000          ?        ?   369.7040  14.6860          ?        ?      192.2        3.8       ?       ? 
1 1 1   50   10   27 o    401.1    2.6    0.0000   0.0000          ?        ?  1609.7130  21.0712          ?        ?      401.1        2.6       ?       ? 
1 1 1   50   10   28 o    188.6    4.2    0.0000   0.0000          ?        ?   356.2951  15.9630          ?        ?      188.6        4.2       ?       ? 
1 1 1   50   10   29 o    180.3    4.4    0.0000   0.0000          ?        ?   325.6460  15.9630          ?        ?      180.3        4.4       ?       ? 
1 1 1   50   10   30 o     58.7   12.9    0.0000   0.0000          ?        ?    36.3957  14.6860          ?        ?       58.7       12.9       ?       ? 
1 1 1   50   10   31 o    170.6    4.7    0.0000   0.0000          ?        ?   291.8044  15.9630          ?        ?      170.6        4.7       ?       ? 
1 1 1   50   10   32 o    100.1    8.0    0.0000   0.0000          ?        ?   100.8864  15.9630          ?        ?      100.1        8.0       ?       ? 
1 1 1   50   10   33 o     29.8   13.3    0.0000   0.0000          ?        ?    -5.7467  15.9630          ?        ?       29.8       13.3       ?       ? 
1 1 1   50   10   34 o    125.0    6.6    0.0000   0.0000          ?        ?   157.0763  16.6016          ?        ?      125.0        6.6       ?       ? 
1 1 1   50   10   35 o     28.0   12.8    0.0000   0.0000          ?        ?   -10.2163  15.9630          ?        ?       28.0       12.8       ?       ? 
1 1 1   50   10   36 o    261.8    3.4    0.0000   0.0000          ?        ?   686.4108  17.8786          ?        ?      261.8        3.4       ?       ? 
1 1 1   50   10   37 o    188.7    4.4    0.0000   0.0000          ?        ?   356.9336  16.6016          ?        ?      188.7        4.4       ?       ? 
1 1 1   50   10   38 o    299.0    3.2    0.0000   0.0000          ?        ?   895.2073  19.1556          ?        ?      299.0        3.2       ?       ? 
1 1 1   50   10   39 o    148.7    5.8    0.0000   0.0000          ?        ?   222.2055  17.2401          ?        ?      148.7        5.8       ?       ? 
1 1 1   50   10   40 o    120.5    7.2    0.0000   0.0000          ?        ?   146.2215  17.2401          ?        ?      120.5        7.2       ?       ? 
1 1 1   50   10   41 o     33.6   14.2    0.0000   0.0000          ?        ?     1.2770  16.6016          ?        ?       33.6       14.2       ?       ? 
1 1 1   50   10   42 o    231.9    3.7    0.0000   0.0000          ?        ?   538.9123  17.2401          ?        ?      231.9        3.7       ?       ? 
1 1 1   50   10   43 o     98.8    8.4    0.0000   0.0000          ?        ?    98.9709  16.6016          ?        ?       98.8        8.4       ?       ? 
1 1 1   50   10   44 o     19.0    9.6    0.0000   0.0000          ?        ?   -51.0817  16.6016          ?        ?       19.0        9.6       ?       ? 
1 1 1   50   10   45 o     98.7    8.4    0.0000   0.0000          ?        ?    98.9709  16.6016          ?        ?       98.7        8.4       ?       ? 
1 1 1   50   11    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50   11    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50   11    2 o     36.7   12.8    0.0000   0.0000          ?        ?    12.1319  11.4934          ?        ?       36.7       12.8       ?       ? 
1 1 1   50   11    3 o     21.5   10.1    0.0000   0.0000          ?        ?   -10.8549  10.8549          ?        ?       21.5       10.1       ?       ? 
1 1 1   50   11    4 o    150.1    3.8    0.0000   0.0000          ?        ?   225.3981  11.4934          ?        ?      150.1        3.8       ?       ? 
1 1 1   50   11    5 f     81.8    7.0    0.0000   0.0000          ?        ?    67.0448  11.4934          ?        ?       81.8        7.0       ?       ? 
1 1 1   50   11    6 o    111.8    5.4    0.0000   0.0000          ?        ?   125.1502  12.1319          ?        ?      111.8        5.4       ?       ? 
1 1 1   50   11    7 o    126.5    4.8    0.0000   0.0000          ?        ?   160.2689  12.1319          ?        ?      126.5        4.8       ?       ? 
1 1 1   50   11    8 o    466.9    2.9    0.0000   0.0000          ?        ?  2181.1899  27.4564          ?        ?      466.9        2.9       ?       ? 
1 1 1   50   11    9 o    277.5    3.1    0.0000   0.0000          ?        ?   770.6956  17.2401          ?        ?      277.5        3.1       ?       ? 
1 1 1   50   11   10 f    297.2    3.2    0.0000   0.0000          ?        ?   883.7139  19.1556          ?        ?      297.2        3.2       ?       ? 
1 1 1   50   11   11 o    336.7    3.1    0.0000   0.0000          ?        ?  1134.6530  21.0712          ?        ?      336.7        3.1       ?       ? 
1 1 1   50   11   12 o     77.3    7.8    0.0000   0.0000          ?        ?    60.0210  12.1319          ?        ?       77.3        7.8       ?       ? 
1 1 1   50   11   13 o    154.6    4.3    0.0000   0.0000          ?        ?   239.4456  13.4090          ?        ?      154.6        4.3       ?       ? 
1 1 1   50   11   14 o    434.8    2.9    0.0000   0.0000          ?        ?  1891.9395  25.5409          ?        ?      434.8        2.9       ?       ? 
1 1 1   50   11   15 o    260.1    3.2    0.0000   0.0000          ?        ?   676.8329  16.6016          ?        ?      260.1        3.2       ?       ? 
1 1 1   50   11   16 o    382.9    3.2    0.0000   0.0000          ?        ?  1467.3228  24.2638          ?        ?      382.9        3.2       ?       ? 
1 1 1   50   11   17 o    255.0    3.4    0.0000   0.0000          ?        ?   650.6536  17.2401          ?        ?      255.0        3.4       ?       ? 
1 1 1   50   11   18 o    310.4    3.1    0.0000   0.0000          ?        ?   964.1677  19.1556          ?        ?      310.4        3.1       ?       ? 
1 1 1   50   11   19 o    146.8    5.2    0.0000   0.0000          ?        ?   215.8203  15.3245          ?        ?      146.8        5.2       ?       ? 
1 1 1   50   11   20 o    114.0    6.2    0.0000   0.0000          ?        ?   130.2584  14.0475          ?        ?      114.0        6.2       ?       ? 
1 1 1   50   11   21 o    255.6    3.1    0.0000   0.0000          ?        ?   653.8461  15.9630          ?        ?      255.6        3.1       ?       ? 
1 1 1   50   11   22 o    319.6    3.0    0.0000   0.0000          ?        ?  1022.2732  19.1556          ?        ?      319.6        3.0       ?       ? 
1 1 1   50   11   23 o    125.4    6.1    0.0000   0.0000          ?        ?   157.7148  15.3245          ?        ?      125.4        6.1       ?       ? 
1 1 1   50   11   24 o    206.7    3.7    0.0000   0.0000          ?        ?   427.8095  15.3245          ?        ?      206.7        3.7       ?       ? 
1 1 1   50   11   25 o     51.1   13.5    0.0000   0.0000          ?        ?    27.4564  14.0475          ?        ?       51.1       13.5       ?       ? 
1 1 1   50   11   26 f    296.9    2.9    0.0000   0.0000          ?        ?   882.4369  17.2401          ?        ?      296.9        2.9       ?       ? 
1 1 1   50   11   27 o     92.6    8.3    0.0000   0.0000          ?        ?    86.2004  15.3245          ?        ?       92.6        8.3       ?       ? 
1 1 1   50   11   28 o    246.5    3.6    0.0000   0.0000          ?        ?   608.5111  17.8786          ?        ?      246.5        3.6       ?       ? 
1 1 1   50   11   29 o    194.3    3.9    0.0000   0.0000          ?        ?   378.0048  15.3245          ?        ?      194.3        3.9       ?       ? 
1 1 1   50   11   30 f    188.8    4.2    0.0000   0.0000          ?        ?   356.9336  15.9630          ?        ?      188.8        4.2       ?       ? 
1 1 1   50   11   31 o     18.6    9.4    0.0000   0.0000          ?        ?   -45.3350  15.3245          ?        ?       18.6        9.4       ?       ? 
1 1 1   50   11   32 o    239.3    3.6    0.0000   0.0000          ?        ?   573.3925  17.2401          ?        ?      239.3        3.6       ?       ? 
1 1 1   50   11   33 o     30.1   13.3    0.0000   0.0000          ?        ?    -5.1082  15.9630          ?        ?       30.1       13.3       ?       ? 
1 1 1   50   11   34 o    198.1    4.0    0.0000   0.0000          ?        ?   393.3293  15.9630          ?        ?      198.1        4.0       ?       ? 
1 1 1   50   11   35 f    431.9    2.7    0.0000   0.0000          ?        ?  1867.0372  23.6253          ?        ?      431.9        2.7       ?       ? 
1 1 1   50   11   36 o    149.0    5.8    0.0000   0.0000          ?        ?   222.8441  17.2401          ?        ?      149.0        5.8       ?       ? 
1 1 1   50   11   37 o    193.0    4.3    0.0000   0.0000          ?        ?   373.5352  16.6016          ?        ?      193.0        4.3       ?       ? 
1 1 1   50   11   38 o    137.1    6.3    0.0000   0.0000          ?        ?   189.0024  17.2401          ?        ?      137.1        6.3       ?       ? 
1 1 1   50   11   39 o     44.9   15.1    0.0000   0.0000          ?        ?    19.7942  15.9630          ?        ?       44.9       15.1       ?       ? 
1 1 1   50   11   40 o     27.4   12.6    0.0000   0.0000          ?        ?   -11.4934  15.9630          ?        ?       27.4       12.6       ?       ? 
1 1 1   50   11   41 o     30.3   13.5    0.0000   0.0000          ?        ?    -5.7467  16.6016          ?        ?       30.3       13.5       ?       ? 
1 1 1   50   11   42 o     22.8   11.1    0.0000   0.0000          ?        ?   -30.0105  16.6016          ?        ?       22.8       11.1       ?       ? 
1 1 1   50   11   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50   11   44 o     29.3   13.1    0.0000   0.0000          ?        ?    -6.3852  15.9630          ?        ?       29.3       13.1       ?       ? 
1 1 1   50   12    0 o    466.9    4.6 2181.8284  42.7809  2181.8284  42.7809  2181.8284  42.7809      466.9      4.6      466.9        4.6     0.0     0.0 
1 1 1   50   12    1 o    453.4    2.8    0.0000   0.0000          ?        ?  2056.6782  25.5409          ?        ?      453.4        2.8       ?       ? 
1 1 1   50   12    2 o    191.9    3.7    0.0000   0.0000          ?        ?   368.4270  14.0475          ?        ?      191.9        3.7       ?       ? 
1 1 1   50   12    3 o    380.8    2.9    0.0000   0.0000          ?        ?  1450.7211  22.3483          ?        ?      380.8        2.9       ?       ? 
1 1 1   50   12    4 o    365.8    2.6    0.0000   0.0000          ?        ?  1338.9799  19.1556          ?        ?      365.8        2.6       ?       ? 
1 1 1   50   12    5 o    186.7    3.2    0.0000   0.0000          ?        ?   348.6328  12.1319          ?        ?      186.7        3.2       ?       ? 
1 1 1   50   12    6 o    168.9    3.6    0.0000   0.0000          ?        ?   285.4192  12.1319          ?        ?      168.9        3.6       ?       ? 
1 1 1   50   12    7 o     92.7    6.2    0.0000   0.0000          ?        ?    86.2004  11.4934          ?        ?       92.7        6.2       ?       ? 
1 1 1   50   12    8 o    318.4    3.0    0.0000   0.0000          ?        ?  1014.6108  19.1556          ?        ?      318.4        3.0       ?       ? 
1 1 1   50   12    9 f     15.3    7.8    0.0000   0.0000          ?        ?   -38.9498  11.4934          ?        ?       15.3        7.8       ?       ? 
1 1 1   50   12   10 o    345.6    2.9    0.0000   0.0000          ?        ?  1195.3125  19.7942          ?        ?      345.6        2.9       ?       ? 
1 1 1   50   12   11 o    148.7    4.5    0.0000   0.0000          ?        ?   221.5670  13.4090          ?        ?      148.7        4.5       ?       ? 
1 1 1   50   12   12 o    458.6    2.9    0.0000   0.0000          ?        ?  2104.5674  26.1794          ?        ?      458.6        2.9       ?       ? 
1 1 1   50   12   13 o    296.7    3.2    0.0000   0.0000          ?        ?   881.1599  19.1556          ?        ?      296.7        3.2       ?       ? 
1 1 1   50   12   14 o     22.9   10.8    0.0000   0.0000          ?        ?   -14.0475  12.7704          ?        ?       22.9       10.8       ?       ? 
1 1 1   50   12   15 o    226.1    3.5    0.0000   0.0000          ?        ?   511.4558  15.9630          ?        ?      226.1        3.5       ?       ? 
1 1 1   50   12   16 o    199.7    3.8    0.0000   0.0000          ?        ?   399.0760  15.3245          ?        ?      199.7        3.8       ?       ? 
1 1 1   50   12   17 o    114.8    6.1    0.0000   0.0000          ?        ?   132.1740  14.0475          ?        ?      114.8        6.1       ?       ? 
1 1 1   50   12   18 f    305.1    2.9    0.0000   0.0000          ?        ?   931.6030  17.8786          ?        ?      305.1        2.9       ?       ? 
1 1 1   50   12   19 o     99.0    7.1    0.0000   0.0000          ?        ?    98.3323  14.0475          ?        ?       99.0        7.1       ?       ? 
1 1 1   50   12   20 o    237.9    3.2    0.0000   0.0000          ?        ?   566.3687  15.3245          ?        ?      237.9        3.2       ?       ? 
1 1 1   50   12   21 o    265.9    2.9    0.0000   0.0000          ?        ?   707.4820  15.3245          ?        ?      265.9        2.9       ?       ? 
1 1 1   50   12   22 o    226.9    3.7    0.0000   0.0000          ?        ?   515.2869  16.6016          ?        ?      226.9        3.7       ?       ? 
1 1 1   50   12   23 o    107.9    6.8    0.0000   0.0000          ?        ?   116.8494  14.6860          ?        ?      107.9        6.8       ?       ? 
1 1 1   50   12   24 o    341.8    2.9    0.0000   0.0000          ?        ?  1169.1332  19.7942          ?        ?      341.8        2.9       ?       ? 
1 1 1   50   12   25 o    257.4    3.3    0.0000   0.0000          ?        ?   663.4240  17.2401          ?        ?      257.4        3.3       ?       ? 
1 1 1   50   12   26 f    149.5    5.1    0.0000   0.0000          ?        ?   224.1211  15.3245          ?        ?      149.5        5.1       ?       ? 
1 1 1   50   12   27 o    144.1    5.5    0.0000   0.0000          ?        ?   208.1580  15.9630          ?        ?      144.1        5.5       ?       ? 
1 1 1   50   12   28 o     39.6   14.6    0.0000   0.0000          ?        ?    12.7704  15.3245          ?        ?       39.6       14.6       ?       ? 
1 1 1   50   12   29 o    327.0    3.0    0.0000   0.0000          ?        ?  1070.1622  19.7942          ?        ?      327.0        3.0       ?       ? 
1 1 1   50   12   30 o    147.5    5.4    0.0000   0.0000          ?        ?   218.3744  15.9630          ?        ?      147.5        5.4       ?       ? 
1 1 1   50   12   31 o    397.1    2.7    0.0000   0.0000          ?        ?  1578.4254  21.7097          ?        ?      397.1        2.7       ?       ? 
1 1 1   50   12   32 o     25.2   11.8    0.0000   0.0000          ?        ?   -15.9630  15.3245          ?        ?       25.2       11.8       ?       ? 
1 1 1   50   12   33 o    139.1    5.5    0.0000   0.0000          ?        ?   194.1106  15.3245          ?        ?      139.1        5.5       ?       ? 
1 1 1   50   12   34 o    111.2    7.5    0.0000   0.0000          ?        ?   124.5117  16.6016          ?        ?      111.2        7.5       ?       ? 
1 1 1   50   12   35 o     23.6   11.4    0.0000   0.0000          ?        ?   -26.8179  16.6016          ?        ?       23.6       11.4       ?       ? 
1 1 1   50   12   36 o     75.6   11.0    0.0000   0.0000          ?        ?    58.1055  16.6016          ?        ?       75.6       11.0       ?       ? 
1 1 1   50   12   37 o    237.9    3.6    0.0000   0.0000          ?        ?   567.0072  17.2401          ?        ?      237.9        3.6       ?       ? 
1 1 1   50   12   38 o    266.0    3.2    0.0000   0.0000          ?        ?   708.7590  17.2401          ?        ?      266.0        3.2       ?       ? 
1 1 1   50   12   39 o     98.0    8.1    0.0000   0.0000          ?        ?    97.0553  15.9630          ?        ?       98.0        8.1       ?       ? 
1 1 1   50   12   40 o    122.3    6.8    0.0000   0.0000          ?        ?   150.6911  16.6016          ?        ?      122.3        6.8       ?       ? 
1 1 1   50   12   41 o     71.4   11.6    0.0000   0.0000          ?        ?    52.3588  16.6016          ?        ?       71.4       11.6       ?       ? 
1 1 1   50   12   42 o     55.4   14.3    0.0000   0.0000          ?        ?    33.2031  15.9630          ?        ?       55.4       14.3       ?       ? 
1 1 1   50   13    0 o    345.1    4.1 1192.1199  28.0950  1192.1199  28.0950  1192.1199  28.0950      345.1      4.1      345.1        4.1     0.0     0.0 
1 1 1   50   13    1 o    269.4    3.0    0.0000   0.0000          ?        ?   725.9991  15.9630          ?        ?      269.4        3.0       ?       ? 
1 1 1   50   13    2 o     18.3    8.8    0.0000   0.0000          ?        ?   -14.6860   9.5778          ?        ?       18.3        8.8       ?       ? 
1 1 1   50   13    3 o    117.4    4.4    0.0000   0.0000          ?        ?   137.9207  10.2163          ?        ?      117.4        4.4       ?       ? 
1 1 1   50   13    4 o    267.6    2.9    0.0000   0.0000          ?        ?   716.4213  15.3245          ?        ?      267.6        2.9       ?       ? 
1 1 1   50   13    5 o     30.7   11.5    0.0000   0.0000          ?        ?     7.0237   9.5778          ?        ?       30.7       11.5       ?       ? 
1 1 1   50   13    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50   13    7 o     42.9   11.6    0.0000   0.0000          ?        ?    19.1556  10.2163          ?        ?       42.9       11.6       ?       ? 
1 1 1   50   13    8 o    191.4    3.2    0.0000   0.0000          ?        ?   366.5114  12.1319          ?        ?      191.4        3.2       ?       ? 
1 1 1   50   13    9 o    293.1    2.8    0.0000   0.0000          ?        ?   859.4501  16.6016          ?        ?      293.1        2.8       ?       ? 
1 1 1   50   13   10 o     65.7    8.7    0.0000   0.0000          ?        ?    43.4195  11.4934          ?        ?       65.7        8.7       ?       ? 
1 1 1   50   13   11 o     49.9   12.2    0.0000   0.0000          ?        ?    26.1794  12.1319          ?        ?       49.9       12.2       ?       ? 
1 1 1   50   13   12 o     23.8   11.1    0.0000   0.0000          ?        ?   -11.4934  12.7704          ?        ?       23.8       11.1       ?       ? 
1 1 1   50   13   13 o    122.6    5.5    0.0000   0.0000          ?        ?   150.6911  13.4090          ?        ?      122.6        5.5       ?       ? 
1 1 1   50   13   14 o    118.9    5.6    0.0000   0.0000          ?        ?   141.7518  13.4090          ?        ?      118.9        5.6       ?       ? 
1 1 1   50   13   15 o     22.2   10.6    0.0000   0.0000          ?        ?   -18.5171  13.4090          ?        ?       22.2       10.6       ?       ? 
1 1 1   50   13   16 o     98.3    6.8    0.0000   0.0000          ?        ?    97.0553  13.4090          ?        ?       98.3        6.8       ?       ? 
1 1 1   50   13   17 f     76.8    8.7    0.0000   0.0000          ?        ?    59.3825  13.4090          ?        ?       76.8        8.7       ?       ? 
1 1 1   50   13   18 o    181.7    4.0    0.0000   0.0000          ?        ?   330.7542  14.6860          ?        ?      181.7        4.0       ?       ? 
1 1 1   50   13   19 o    384.8    2.7    0.0000   0.0000          ?        ?  1481.3701  20.4327          ?        ?      384.8        2.7       ?       ? 
1 1 1   50   13   20 o    365.9    2.7    0.0000   0.0000          ?        ?  1339.6184  19.7942          ?        ?      365.9        2.7       ?       ? 
1 1 1   50   13   21 o    305.3    2.8    0.0000   0.0000          ?        ?   932.8801  17.2401          ?        ?      305.3        2.8       ?       ? 
1 1 1   50   13   22 o     91.6    7.7    0.0000   0.0000          ?        ?    84.2849  14.0475          ?        ?       91.6        7.7       ?       ? 
1 1 1   50   13   23 o    295.8    2.9    0.0000   0.0000          ?        ?   875.4132  17.2401          ?        ?      295.8        2.9       ?       ? 
1 1 1   50   13   24 o     24.1   11.5    0.0000   0.0000          ?        ?   -19.7942  15.3245          ?        ?       24.1       11.5       ?       ? 
1 1 1   50   13   25 o     23.8   11.2    0.0000   0.0000          ?        ?   -15.9630  14.0475          ?        ?       23.8       11.2       ?       ? 
1 1 1   50   13   26 o    116.4    6.0    0.0000   0.0000          ?        ?   136.0051  14.0475          ?        ?      116.4        6.0       ?       ? 
1 1 1   50   13   27 o    240.0    3.5    0.0000   0.0000          ?        ?   576.5850  16.6016          ?        ?      240.0        3.5       ?       ? 
1 1 1   50   13   28 o     17.0    8.6    0.0000   0.0000          ?        ?   -51.7203  14.6860          ?        ?       17.0        8.6       ?       ? 
1 1 1   50   13   29 o     79.5   10.0    0.0000   0.0000          ?        ?    63.8522  15.9630          ?        ?       79.5       10.0       ?       ? 
1 1 1   50   13   30 o    416.0    2.6    0.0000   0.0000          ?        ?  1732.3091  21.7097          ?        ?      416.0        2.6       ?       ? 
1 1 1   50   13   31 o     75.8    9.7    0.0000   0.0000          ?        ?    58.1055  14.6860          ?        ?       75.8        9.7       ?       ? 
1 1 1   50   13   32 o    214.1    3.9    0.0000   0.0000          ?        ?   459.0970  16.6016          ?        ?      214.1        3.9       ?       ? 
1 1 1   50   13   33 o    257.0    3.2    0.0000   0.0000          ?        ?   661.5084  16.6016          ?        ?      257.0        3.2       ?       ? 
1 1 1   50   13   34 o    234.3    3.7    0.0000   0.0000          ?        ?   549.7671  17.2401          ?        ?      234.3        3.7       ?       ? 
1 1 1   50   13   35 o     73.0   10.9    0.0000   0.0000          ?        ?    54.2743  15.9630          ?        ?       73.0       10.9       ?       ? 
1 1 1   50   13   36 o     88.4    9.0    0.0000   0.0000          ?        ?    79.1767  15.9630          ?        ?       88.4        9.0       ?       ? 
1 1 1   50   13   37 o    184.7    4.5    0.0000   0.0000          ?        ?   342.2476  16.6016          ?        ?      184.7        4.5       ?       ? 
1 1 1   50   13   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50   13   39 o     80.8    9.9    0.0000   0.0000          ?        ?    66.4062  15.9630          ?        ?       80.8        9.9       ?       ? 
1 1 1   50   13   40 o     82.5   10.4    0.0000   0.0000          ?        ?    69.5989  17.2401          ?        ?       82.5       10.4       ?       ? 
1 1 1   50   13   41 o     22.2   10.8    0.0000   0.0000          ?        ?   -29.3720  15.9630          ?        ?       22.2       10.8       ?       ? 
1 1 1   50   14    0 o    280.9    6.1  791.1283  34.4802   791.1283  34.4802   791.1283  34.4802      280.9      6.1      280.9        6.1     0.0     0.0 
1 1 1   50   14    1 o    146.3    6.1    0.0000   0.0000          ?        ?   214.5433  17.8786          ?        ?      146.3        6.1       ?       ? 
1 1 1   50   14    2 o     88.3    9.8    0.0000   0.0000          ?        ?    78.5382  17.2401          ?        ?       88.3        9.8       ?       ? 
1 1 1   50   14    3 o    452.2    3.2    0.0000   0.0000          ?        ?  2046.4618  29.3720          ?        ?      452.2        3.2       ?       ? 
1 1 1   50   14    4 o    169.7    5.1    0.0000   0.0000          ?        ?   288.6118  17.2401          ?        ?      169.7        5.1       ?       ? 
1 1 1   50   14    5 o    363.1    3.0    0.0000   0.0000          ?        ?  1319.1857  21.7097          ?        ?      363.1        3.0       ?       ? 
1 1 1   50   14    6 o    191.5    4.5    0.0000   0.0000          ?        ?   367.1499  17.2401          ?        ?      191.5        4.5       ?       ? 
1 1 1   50   14    7 o    651.3    3.9    0.0000   0.0000          ?        ?  4246.1689  50.4432          ?        ?      651.3        3.9       ?       ? 
1 1 1   50   14    8 o    259.1    3.1    0.0000   0.0000          ?        ?   671.7247  15.9630          ?        ?      259.1        3.1       ?       ? 
1 1 1   50   14    9 o    370.6    3.0    0.0000   0.0000          ?        ?  1374.7371  22.3483          ?        ?      370.6        3.0       ?       ? 
1 1 1   50   14   10 o    355.0    2.9    0.0000   0.0000          ?        ?  1261.0802  20.4327          ?        ?      355.0        2.9       ?       ? 
1 1 1   50   14   11 o    292.1    2.8    0.0000   0.0000          ?        ?   853.7034  16.6016          ?        ?      292.1        2.8       ?       ? 
1 1 1   50   14   12 o     78.1    7.4    0.0000   0.0000          ?        ?    61.2981  11.4934          ?        ?       78.1        7.4       ?       ? 
1 1 1   50   14   13 o    243.5    3.0    0.0000   0.0000          ?        ?   593.1866  14.6860          ?        ?      243.5        3.0       ?       ? 
1 1 1   50   14   14 o    229.4    3.3    0.0000   0.0000          ?        ?   526.7803  15.3245          ?        ?      229.4        3.3       ?       ? 
1 1 1   50   14   15 o    156.0    4.7    0.0000   0.0000          ?        ?   243.9153  14.6860          ?        ?      156.0        4.7       ?       ? 
1 1 1   50   14   16 o    119.7    5.3    0.0000   0.0000          ?        ?   143.6674  12.7704          ?        ?      119.7        5.3       ?       ? 
1 1 1   50   14   17 o    118.1    5.9    0.0000   0.0000          ?        ?   139.8362  14.0475          ?        ?      118.1        5.9       ?       ? 
1 1 1   50   14   18 o    180.9    3.9    0.0000   0.0000          ?        ?   327.5616  14.0475          ?        ?      180.9        3.9       ?       ? 
1 1 1   50   14   19 o    235.4    3.4    0.0000   0.0000          ?        ?   554.8753  15.9630          ?        ?      235.4        3.4       ?       ? 
1 1 1   50   14   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50   14   21 o    133.0    5.5    0.0000   0.0000          ?        ?   177.5090  14.6860          ?        ?      133.0        5.5       ?       ? 
1 1 1   50   14   22 o     49.4   13.7    0.0000   0.0000          ?        ?    25.5409  14.0475          ?        ?       49.4       13.7       ?       ? 
1 1 1   50   14   23 o    332.5    2.9    0.0000   0.0000          ?        ?  1106.5580  19.1556          ?        ?      332.5        2.9       ?       ? 
1 1 1   50   14   24 o     74.2    9.5    0.0000   0.0000          ?        ?    55.5514  14.0475          ?        ?       74.2        9.5       ?       ? 
1 1 1   50   14   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50   14   26 o     64.9   11.7    0.0000   0.0000          ?        ?    44.0580  14.6860          ?        ?       64.9       11.7       ?       ? 
1 1 1   50   14   27 o    135.3    5.9    0.0000   0.0000          ?        ?   183.8942  15.9630          ?        ?      135.3        5.9       ?       ? 
1 1 1   50   14   28 o    565.6    2.8    0.0000   0.0000          ?        ?  3202.1860  31.9261          ?        ?      565.6        2.8       ?       ? 
1 1 1   50   14   29 o     90.4    8.5    0.0000   0.0000          ?        ?    82.3693  15.3245          ?        ?       90.4        8.5       ?       ? 
1 1 1   50   14   30 o    136.8    5.4    0.0000   0.0000          ?        ?   187.7254  14.6860          ?        ?      136.8        5.4       ?       ? 
1 1 1   50   14   31 o    119.8    6.7    0.0000   0.0000          ?        ?   144.3059  15.9630          ?        ?      119.8        6.7       ?       ? 
1 1 1   50   14   32 o    391.2    2.7    0.0000   0.0000          ?        ?  1531.8134  21.0712          ?        ?      391.2        2.7       ?       ? 
1 1 1   50   14   33 o     80.5    9.9    0.0000   0.0000          ?        ?    65.7677  15.9630          ?        ?       80.5        9.9       ?       ? 
1 1 1   50   14   34 o    209.2    3.8    0.0000   0.0000          ?        ?   438.6643  15.9630          ?        ?      209.2        3.8       ?       ? 
1 1 1   50   14   35 o    185.6    4.5    0.0000   0.0000          ?        ?   345.4402  16.6016          ?        ?      185.6        4.5       ?       ? 
1 1 1   50   14   36 o     78.5    9.8    0.0000   0.0000          ?        ?    62.5751  15.3245          ?        ?       78.5        9.8       ?       ? 
1 1 1   50   14   37 f     69.4   11.0    0.0000   0.0000          ?        ?    49.1662  15.3245          ?        ?       69.4       11.0       ?       ? 
1 1 1   50   14   38 o    295.2    3.1    0.0000   0.0000          ?        ?   872.8591  18.5171          ?        ?      295.2        3.1       ?       ? 
1 1 1   50   14   39 o    121.1    6.9    0.0000   0.0000          ?        ?   148.1370  16.6016          ?        ?      121.1        6.9       ?       ? 
1 1 1   50   15    0 o    240.0    7.6  579.1391  36.3957   579.1391  36.3957   579.1391  36.3957      240.0      7.6      240.0        7.6     0.0     0.0 
1 1 1   50   15    1 o    231.3    4.3    0.0000   0.0000          ?        ?   535.7197  19.7942          ?        ?      231.3        4.3       ?       ? 
1 1 1   50   15    2 o     51.5   16.2    0.0000   0.0000          ?        ?    26.8179  18.5171          ?        ?       51.5       16.2       ?       ? 
1 1 1   50   15    3 o     33.0   14.4    0.0000   0.0000          ?        ?    -3.1926  17.8786          ?        ?       33.0       14.4       ?       ? 
1 1 1   50   15    4 o    228.7    4.2    0.0000   0.0000          ?        ?   523.5877  19.1556          ?        ?      228.7        4.2       ?       ? 
1 1 1   50   15    5 o    318.1    3.2    0.0000   0.0000          ?        ?  1012.6953  20.4327          ?        ?      318.1        3.2       ?       ? 
1 1 1   50   15    6 o     68.1    8.4    0.0000   0.0000          ?        ?    46.6121  11.4934          ?        ?       68.1        8.4       ?       ? 
1 1 1   50   15    7 o    226.3    3.5    0.0000   0.0000          ?        ?   512.7329  15.9630          ?        ?      226.3        3.5       ?       ? 
1 1 1   50   15    8 o    124.2    5.4    0.0000   0.0000          ?        ?   154.5222  13.4090          ?        ?      124.2        5.4       ?       ? 
1 1 1   50   15    9 o    288.3    3.3    0.0000   0.0000          ?        ?   831.9937  19.1556          ?        ?      288.3        3.3       ?       ? 
1 1 1   50   15   10 o    195.3    3.9    0.0000   0.0000          ?        ?   381.8359  15.3245          ?        ?      195.3        3.9       ?       ? 
1 1 1   50   15   11 o    144.6    4.2    0.0000   0.0000          ?        ?   209.4351  12.1319          ?        ?      144.6        4.2       ?       ? 
1 1 1   50   15   12 o    265.4    3.1    0.0000   0.0000          ?        ?   704.9279  16.6016          ?        ?      265.4        3.1       ?       ? 
1 1 1   50   15   13 o    166.0    3.8    0.0000   0.0000          ?        ?   275.8413  12.7704          ?        ?      166.0        3.8       ?       ? 
1 1 1   50   15   14 o    130.9    4.4    0.0000   0.0000          ?        ?   171.7623  11.4934          ?        ?      130.9        4.4       ?       ? 
1 1 1   50   15   15 o     80.1    7.2    0.0000   0.0000          ?        ?    64.4907  11.4934          ?        ?       80.1        7.2       ?       ? 
1 1 1   50   15   16 o     39.2   13.1    0.0000   0.0000          ?        ?    14.6860  12.1319          ?        ?       39.2       13.1       ?       ? 
1 1 1   50   15   17 o    118.3    5.9    0.0000   0.0000          ?        ?   140.4748  14.0475          ?        ?      118.3        5.9       ?       ? 
1 1 1   50   15   18 o    184.8    4.1    0.0000   0.0000          ?        ?   342.2476  15.3245          ?        ?      184.8        4.1       ?       ? 
1 1 1   50   15   19 o    211.1    3.8    0.0000   0.0000          ?        ?   446.3266  15.9630          ?        ?      211.1        3.8       ?       ? 
1 1 1   50   15   20 f    215.0    3.6    0.0000   0.0000          ?        ?   462.9282  15.3245          ?        ?      215.0        3.6       ?       ? 
1 1 1   50   15   21 o     22.3   10.8    0.0000   0.0000          ?        ?   -23.6253  14.6860          ?        ?       22.3       10.8       ?       ? 
1 1 1   50   15   22 o     42.0   13.8    0.0000   0.0000          ?        ?    17.2401  13.4090          ?        ?       42.0       13.8       ?       ? 
1 1 1   50   15   23 o    104.8    6.7    0.0000   0.0000          ?        ?   110.4642  14.0475          ?        ?      104.8        6.7       ?       ? 
1 1 1   50   15   24 o     69.3    9.7    0.0000   0.0000          ?        ?    48.5276  13.4090          ?        ?       69.3        9.7       ?       ? 
1 1 1   50   15   25 o    133.5    5.3    0.0000   0.0000          ?        ?   178.7861  14.0475          ?        ?      133.5        5.3       ?       ? 
1 1 1   50   15   26 o     55.4   13.4    0.0000   0.0000          ?        ?    32.5646  14.6860          ?        ?       55.4       13.4       ?       ? 
1 1 1   50   15   27 o    130.1    5.6    0.0000   0.0000          ?        ?   169.8468  14.6860          ?        ?      130.1        5.6       ?       ? 
1 1 1   50   15   28 o     35.0   14.1    0.0000   0.0000          ?        ?     5.7467  15.3245          ?        ?       35.0       14.1       ?       ? 
1 1 1   50   15   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50   15   30 o    153.7    5.0    0.0000   0.0000          ?        ?   236.8915  15.3245          ?        ?      153.7        5.0       ?       ? 
1 1 1   50   15   31 o     29.2   12.9    0.0000   0.0000          ?        ?    -3.8311  14.6860          ?        ?       29.2       12.9       ?       ? 
1 1 1   50   15   32 o     20.0    9.9    0.0000   0.0000          ?        ?   -37.0343  15.3245          ?        ?       20.0        9.9       ?       ? 
1 1 1   50   15   33 o    326.5    2.8    0.0000   0.0000          ?        ?  1067.6082  18.5171          ?        ?      326.5        2.8       ?       ? 
1 1 1   50   15   34 o    157.0    5.3    0.0000   0.0000          ?        ?   247.7464  16.6016          ?        ?      157.0        5.3       ?       ? 
1 1 1   50   15   35 o     19.7    9.8    0.0000   0.0000          ?        ?   -34.4802  14.6860          ?        ?       19.7        9.8       ?       ? 
1 1 1   50   15   36 o    411.5    2.8    0.0000   0.0000          ?        ?  1695.9135  22.9868          ?        ?      411.5        2.8       ?       ? 
1 1 1   50   15   37 o    148.8    5.8    0.0000   0.0000          ?        ?   222.8441  17.2401          ?        ?      148.8        5.8       ?       ? 
1 1 1   50   15   38 o    263.6    3.4    0.0000   0.0000          ?        ?   696.6271  17.8786          ?        ?      263.6        3.4       ?       ? 
1 1 1   50   16    0 o    394.4    5.2 1557.9928  40.8654  1557.9928  40.8654  1557.9928  40.8654      394.4      5.2      394.4        5.2     0.0     0.0 
1 1 1   50   16    1 o    214.4    4.8    0.0000   0.0000          ?        ?   460.3741  20.4327          ?        ?      214.4        4.8       ?       ? 
1 1 1   50   16    2 f    163.7    5.7    0.0000   0.0000          ?        ?   268.8176  18.5171          ?        ?      163.7        5.7       ?       ? 
1 1 1   50   16    3 f    180.7    5.7    0.0000   0.0000          ?        ?   327.5616  20.4327          ?        ?      180.7        5.7       ?       ? 
1 1 1   50   16    4 o    318.6    4.6    0.0000   0.0000          ?        ?  1017.1650  29.3720          ?        ?      318.6        4.6       ?       ? 
1 1 1   50   16    5 o    269.0    4.6    0.0000   0.0000          ?        ?   724.7220  24.9023          ?        ?      269.0        4.6       ?       ? 
1 1 1   50   16    6 f    225.5    5.1    0.0000   0.0000          ?        ?   509.5403  22.9868          ?        ?      225.5        5.1       ?       ? 
1 1 1   50   16    7 o    160.7    4.4    0.0000   0.0000          ?        ?   258.6013  14.0475          ?        ?      160.7        4.4       ?       ? 
1 1 1   50   16    8 o     63.1   10.1    0.0000   0.0000          ?        ?    40.2269  12.7704          ?        ?       63.1       10.1       ?       ? 
1 1 1   50   16    9 o    373.7    3.7    0.0000   0.0000          ?        ?  1398.3623  27.4564          ?        ?      373.7        3.7       ?       ? 
1 1 1   50   16   10 o    309.9    3.6    0.0000   0.0000          ?        ?   961.6136  22.3483          ?        ?      309.9        3.6       ?       ? 
1 1 1   50   16   11 o    173.8    4.8    0.0000   0.0000          ?        ?   302.6593  16.6016          ?        ?      173.8        4.8       ?       ? 
1 1 1   50   16   12 f     35.1   14.2    0.0000   0.0000          ?        ?     5.7467  15.3245          ?        ?       35.1       14.2       ?       ? 
1 1 1   50   16   13 o    106.2    5.1    0.0000   0.0000          ?        ?   113.0183  10.8549          ?        ?      106.2        5.1       ?       ? 
1 1 1   50   16   14 o     71.7    8.5    0.0000   0.0000          ?        ?    51.7203  12.1319          ?        ?       71.7        8.5       ?       ? 
1 1 1   50   16   15 o     85.8    7.4    0.0000   0.0000          ?        ?    74.0685  12.7704          ?        ?       85.8        7.4       ?       ? 
1 1 1   50   16   16 o    288.5    3.1    0.0000   0.0000          ?        ?   833.2708  17.8786          ?        ?      288.5        3.1       ?       ? 
1 1 1   50   16   17 o    208.7    3.2    0.0000   0.0000          ?        ?   436.1103  13.4090          ?        ?      208.7        3.2       ?       ? 
1 1 1   50   16   18 o     24.0   11.1    0.0000   0.0000          ?        ?   -10.8549  12.7704          ?        ?       24.0       11.1       ?       ? 
1 1 1   50   16   19 o    390.3    3.1    0.0000   0.0000          ?        ?  1524.7897  24.2638          ?        ?      390.3        3.1       ?       ? 
1 1 1   50   16   20 o    167.8    4.8    0.0000   0.0000          ?        ?   282.2266  15.9630          ?        ?      167.8        4.8       ?       ? 
1 1 1   50   16   21 o    383.8    2.9    0.0000   0.0000          ?        ?  1474.3464  22.3483          ?        ?      383.8        2.9       ?       ? 
1 1 1   50   16   22 o    166.1    4.2    0.0000   0.0000          ?        ?   276.4799  14.0475          ?        ?      166.1        4.2       ?       ? 
1 1 1   50   16   23 o    110.8    6.1    0.0000   0.0000          ?        ?   123.2347  13.4090          ?        ?      110.8        6.1       ?       ? 
1 1 1   50   16   24 o    174.4    4.0    0.0000   0.0000          ?        ?   304.5748  14.0475          ?        ?      174.4        4.0       ?       ? 
1 1 1   50   16   25 o    301.2    2.8    0.0000   0.0000          ?        ?   907.9777  16.6016          ?        ?      301.2        2.8       ?       ? 
1 1 1   50   16   26 o     30.8   13.1    0.0000   0.0000          ?        ?     0.6385  14.0475          ?        ?       30.8       13.1       ?       ? 
1 1 1   50   16   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50   16   28 o     20.2   10.0    0.0000   0.0000          ?        ?   -32.5646  14.6860          ?        ?       20.2       10.0       ?       ? 
1 1 1   50   16   29 o     78.2    9.4    0.0000   0.0000          ?        ?    61.9366  14.6860          ?        ?       78.2        9.4       ?       ? 
1 1 1   50   16   30 o    167.6    4.4    0.0000   0.0000          ?        ?   281.5880  14.6860          ?        ?      167.6        4.4       ?       ? 
1 1 1   50   16   31 o    123.9    6.2    0.0000   0.0000          ?        ?   154.5222  15.3245          ?        ?      123.9        6.2       ?       ? 
1 1 1   50   16   32 o    203.9    3.9    0.0000   0.0000          ?        ?   416.9547  15.9630          ?        ?      203.9        3.9       ?       ? 
1 1 1   50   16   33 o     22.7   11.0    0.0000   0.0000          ?        ?   -24.2638  15.3245          ?        ?       22.7       11.0       ?       ? 
1 1 1   50   16   34 o    333.5    2.9    0.0000   0.0000          ?        ?  1114.2202  19.1556          ?        ?      333.5        2.9       ?       ? 
1 1 1   50   16   35 o    235.0    3.5    0.0000   0.0000          ?        ?   553.5982  16.6016          ?        ?      235.0        3.5       ?       ? 
1 1 1   50   16   36 o    207.4    4.2    0.0000   0.0000          ?        ?   431.6406  17.2401          ?        ?      207.4        4.2       ?       ? 
1 1 1   50   17    0 o     84.7   17.0   80.4537  25.5409    80.4537  25.5409    80.4537  25.5409       84.7     17.0       84.7       17.0     0.0     0.0 
1 1 1   50   17    1 o    271.7    4.2    0.0000   0.0000          ?        ?   739.4081  22.9868          ?        ?      271.7        4.2       ?       ? 
1 1 1   50   17    2 o    174.3    5.3    0.0000   0.0000          ?        ?   304.5748  18.5171          ?        ?      174.3        5.3       ?       ? 
1 1 1   50   17    3 o    290.9    4.7    0.0000   0.0000          ?        ?   847.9567  27.4564          ?        ?      290.9        4.7       ?       ? 
1 1 1   50   17    4 o    266.3    4.6    0.0000   0.0000          ?        ?   710.6746  24.2638          ?        ?      266.3        4.6       ?       ? 
1 1 1   50   17    5 o    268.9    4.3    0.0000   0.0000          ?        ?   724.0836  22.9868          ?        ?      268.9        4.3       ?       ? 
1 1 1   50   17    6 o    238.5    4.7    0.0000   0.0000          ?        ?   570.1998  22.3483          ?        ?      238.5        4.7       ?       ? 
1 1 1   50   17    7 o    304.4    3.9    0.0000   0.0000          ?        ?   927.7720  23.6253          ?        ?      304.4        3.9       ?       ? 
1 1 1   50   17    8 o    289.5    4.1    0.0000   0.0000          ?        ?   839.6559  23.6253          ?        ?      289.5        4.1       ?       ? 
1 1 1   50   17    9 o    552.8    3.5    0.0000   0.0000          ?        ?  3059.7957  38.3113          ?        ?      552.8        3.5       ?       ? 
1 1 1   50   17   10 o    204.5    3.7    0.0000   0.0000          ?        ?   418.8702  15.3245          ?        ?      204.5        3.7       ?       ? 
1 1 1   50   17   11 o    301.0    3.5    0.0000   0.0000          ?        ?   907.3393  21.0712          ?        ?      301.0        3.5       ?       ? 
1 1 1   50   17   12 o     23.6   11.1    0.0000   0.0000          ?        ?   -14.0475  13.4090          ?        ?       23.6       11.1       ?       ? 
1 1 1   50   17   13 o     28.6   12.6    0.0000   0.0000          ?        ?    -3.8311  14.0475          ?        ?       28.6       12.6       ?       ? 
1 1 1   50   17   14 o    159.4    5.2    0.0000   0.0000          ?        ?   254.7701  16.6016          ?        ?      159.4        5.2       ?       ? 
1 1 1   50   17   15 o    246.7    3.9    0.0000   0.0000          ?        ?   609.7881  19.1556          ?        ?      246.7        3.9       ?       ? 
1 1 1   50   17   16 o     87.3    7.3    0.0000   0.0000          ?        ?    76.6226  12.7704          ?        ?       87.3        7.3       ?       ? 
1 1 1   50   17   17 o    144.3    4.9    0.0000   0.0000          ?        ?   208.7966  14.0475          ?        ?      144.3        4.9       ?       ? 
1 1 1   50   17   18 o    166.3    4.6    0.0000   0.0000          ?        ?   277.1184  15.3245          ?        ?      166.3        4.6       ?       ? 
1 1 1   50   17   19 o    175.1    4.4    0.0000   0.0000          ?        ?   307.1289  15.3245          ?        ?      175.1        4.4       ?       ? 
1 1 1   50   17   20 o    243.4    3.4    0.0000   0.0000          ?        ?   593.1866  16.6016          ?        ?      243.4        3.4       ?       ? 
1 1 1   50   17   21 o    213.1    3.6    0.0000   0.0000          ?        ?   454.6274  15.3245          ?        ?      213.1        3.6       ?       ? 
1 1 1   50   17   22 o     69.8    9.2    0.0000   0.0000          ?        ?    49.1662  12.7704          ?        ?       69.8        9.2       ?       ? 
1 1 1   50   17   23 o    241.2    3.2    0.0000   0.0000          ?        ?   582.3317  15.3245          ?        ?      241.2        3.2       ?       ? 
1 1 1   50   17   24 o    184.6    4.0    0.0000   0.0000          ?        ?   341.6091  14.6860          ?        ?      184.6        4.0       ?       ? 
1 1 1   50   17   25 f    148.0    4.7    0.0000   0.0000          ?        ?   219.6514  14.0475          ?        ?      148.0        4.7       ?       ? 
1 1 1   50   17   26 o     20.7   10.1    0.0000   0.0000          ?        ?   -23.6253  13.4090          ?        ?       20.7       10.1       ?       ? 
1 1 1   50   17   27 o    144.2    5.1    0.0000   0.0000          ?        ?   208.7966  14.6860          ?        ?      144.2        5.1       ?       ? 
1 1 1   50   17   28 o    173.7    4.4    0.0000   0.0000          ?        ?   302.6593  15.3245          ?        ?      173.7        4.4       ?       ? 
1 1 1   50   17   29 o    269.0    3.1    0.0000   0.0000          ?        ?   724.7220  16.6016          ?        ?      269.0        3.1       ?       ? 
1 1 1   50   17   30 o    136.5    5.1    0.0000   0.0000          ?        ?   187.0868  14.0475          ?        ?      136.5        5.1       ?       ? 
1 1 1   50   17   31 o    149.3    5.3    0.0000   0.0000          ?        ?   224.1211  15.9630          ?        ?      149.3        5.3       ?       ? 
1 1 1   50   17   32 o    160.7    4.6    0.0000   0.0000          ?        ?   259.2398  14.6860          ?        ?      160.7        4.6       ?       ? 
1 1 1   50   17   33 o     97.0    7.6    0.0000   0.0000          ?        ?    95.1397  14.6860          ?        ?       97.0        7.6       ?       ? 
1 1 1   50   17   34 o    135.8    5.9    0.0000   0.0000          ?        ?   185.8098  15.9630          ?        ?      135.8        5.9       ?       ? 
1 1 1   50   18    0 o     80.3   17.2   73.4300  24.2638    73.4300  24.2638    73.4300  24.2638       80.3     17.2       80.3       17.2     0.0     0.0 
1 1 1   50   18    1 o    190.7    5.0    0.0000   0.0000          ?        ?   364.5958  19.1556          ?        ?      190.7        5.0       ?       ? 
1 1 1   50   18    2 o    345.9    3.4    0.0000   0.0000          ?        ?  1197.8666  23.6253          ?        ?      345.9        3.4       ?       ? 
1 1 1   50   18    3 o     88.5   10.8    0.0000   0.0000          ?        ?    79.1767  19.1556          ?        ?       88.5       10.8       ?       ? 
1 1 1   50   18    4 o    161.1    5.9    0.0000   0.0000          ?        ?   260.5168  19.1556          ?        ?      161.1        5.9       ?       ? 
1 1 1   50   18    5 f    114.6    7.8    0.0000   0.0000          ?        ?   132.1740  17.8786          ?        ?      114.6        7.8       ?       ? 
1 1 1   50   18    6 o    180.9    5.6    0.0000   0.0000          ?        ?   328.2001  20.4327          ?        ?      180.9        5.6       ?       ? 
1 1 1   50   18    7 o    215.7    4.7    0.0000   0.0000          ?        ?   466.1208  20.4327          ?        ?      215.7        4.7       ?       ? 
1 1 1   50   18    8 o    111.0    7.8    0.0000   0.0000          ?        ?   123.8732  17.2401          ?        ?      111.0        7.8       ?       ? 
1 1 1   50   18    9 o    292.1    4.2    0.0000   0.0000          ?        ?   854.9804  24.2638          ?        ?      292.1        4.2       ?       ? 
1 1 1   50   18   10 o    207.6    3.8    0.0000   0.0000          ?        ?   431.6406  15.9630          ?        ?      207.6        3.8       ?       ? 
1 1 1   50   18   11 o     67.0    9.0    0.0000   0.0000          ?        ?    45.3350  12.1319          ?        ?       67.0        9.0       ?       ? 
1 1 1   50   18   12 o     79.2    8.5    0.0000   0.0000          ?        ?    63.2136  13.4090          ?        ?       79.2        8.5       ?       ? 
1 1 1   50   18   13 o     17.7    8.8    0.0000   0.0000          ?        ?   -38.3113  13.4090          ?        ?       17.7        8.8       ?       ? 
1 1 1   50   18   14 o    228.5    4.1    0.0000   0.0000          ?        ?   522.9492  18.5171          ?        ?      228.5        4.1       ?       ? 
1 1 1   50   18   15 o    145.3    5.5    0.0000   0.0000          ?        ?   211.9892  15.9630          ?        ?      145.3        5.5       ?       ? 
1 1 1   50   18   16 f    122.7    6.2    0.0000   0.0000          ?        ?   151.3296  15.3245          ?        ?      122.7        6.2       ?       ? 
1 1 1   50   18   17 f    227.7    2.9    0.0000   0.0000          ?        ?   519.1181  13.4090          ?        ?      227.7        2.9       ?       ? 
1 1 1   50   18   18 o    224.9    3.3    0.0000   0.0000          ?        ?   506.3477  14.6860          ?        ?      224.9        3.3       ?       ? 
1 1 1   50   18   19 o    224.8    3.5    0.0000   0.0000          ?        ?   506.3477  15.9630          ?        ?      224.8        3.5       ?       ? 
1 1 1   50   18   20 o    249.0    3.3    0.0000   0.0000          ?        ?   620.6430  16.6016          ?        ?      249.0        3.3       ?       ? 
1 1 1   50   18   21 o    186.0    4.1    0.0000   0.0000          ?        ?   346.7172  15.3245          ?        ?      186.0        4.1       ?       ? 
1 1 1   50   18   22 o    302.4    3.3    0.0000   0.0000          ?        ?   915.6400  19.7942          ?        ?      302.4        3.3       ?       ? 
1 1 1   50   18   23 o    154.5    5.0    0.0000   0.0000          ?        ?   239.4456  15.3245          ?        ?      154.5        5.0       ?       ? 
1 1 1   50   18   24 o    268.5    3.1    0.0000   0.0000          ?        ?   722.1680  16.6016          ?        ?      268.5        3.1       ?       ? 
1 1 1   50   18   25 o     20.6   10.1    0.0000   0.0000          ?        ?   -27.4564  14.0475          ?        ?       20.6       10.1       ?       ? 
1 1 1   50   18   26 o     57.5   12.6    0.0000   0.0000          ?        ?    35.1187  14.0475          ?        ?       57.5       12.6       ?       ? 
1 1 1   50   18   27 o     21.5   10.4    0.0000   0.0000          ?        ?   -23.6253  14.0475          ?        ?       21.5       10.4       ?       ? 
1 1 1   50   18   28 o    164.3    4.3    0.0000   0.0000          ?        ?   270.7332  14.0475          ?        ?      164.3        4.3       ?       ? 
1 1 1   50   18   29 o     74.7    9.8    0.0000   0.0000          ?        ?    56.8284  14.6860          ?        ?       74.7        9.8       ?       ? 
1 1 1   50   18   30 o     69.1    9.7    0.0000   0.0000          ?        ?    48.5276  13.4090          ?        ?       69.1        9.7       ?       ? 
1 1 1   50   18   31 o    169.4    4.5    0.0000   0.0000          ?        ?   287.9732  15.3245          ?        ?      169.4        4.5       ?       ? 
1 1 1   50   18   32 o    137.5    5.3    0.0000   0.0000          ?        ?   190.2794  14.6860          ?        ?      137.5        5.3       ?       ? 
1 1 1   50   18   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50   19    0 o    237.5    6.1  566.3687  28.7335   566.3687  28.7335   566.3687  28.7335      237.5      6.1      237.5        6.1     0.0     0.0 
1 1 1   50   19    1 o    252.1    4.9    0.0000   0.0000          ?        ?   637.2446  24.9023          ?        ?      252.1        4.9       ?       ? 
1 1 1   50   19    2 o    321.5    4.4    0.0000   0.0000          ?        ?  1035.6820  28.0950          ?        ?      321.5        4.4       ?       ? 
1 1 1   50   19    3 o     78.6   10.6    0.0000   0.0000          ?        ?    62.5751  16.6016          ?        ?       78.6       10.6       ?       ? 
1 1 1   50   19    4 o     25.9   12.2    0.0000   0.0000          ?        ?   -18.5171  16.6016          ?        ?       25.9       12.2       ?       ? 
1 1 1   50   19    5 o     82.1   11.3    0.0000   0.0000          ?        ?    68.3218  18.5171          ?        ?       82.1       11.3       ?       ? 
1 1 1   50   19    6 o    178.6    5.5    0.0000   0.0000          ?        ?   319.8993  19.7942          ?        ?      178.6        5.5       ?       ? 
1 1 1   50   19    7 o     50.8   16.8    0.0000   0.0000          ?        ?    25.5409  19.7942          ?        ?       50.8       16.8       ?       ? 
1 1 1   50   19    8 o    329.3    4.1    0.0000   0.0000          ?        ?  1086.1254  26.8179          ?        ?      329.3        4.1       ?       ? 
1 1 1   50   19    9 o    176.3    5.1    0.0000   0.0000          ?        ?   311.5985  17.8786          ?        ?      176.3        5.1       ?       ? 
1 1 1   50   19   10 o     98.0    9.4    0.0000   0.0000          ?        ?    97.0553  18.5171          ?        ?       98.0        9.4       ?       ? 
1 1 1   50   19   11 o    262.6    4.9    0.0000   0.0000          ?        ?   691.5189  25.5409          ?        ?      262.6        4.9       ?       ? 
1 1 1   50   19   12 o    242.5    3.4    0.0000   0.0000          ?        ?   588.7169  16.6016          ?        ?      242.5        3.4       ?       ? 
1 1 1   50   19   13 o    149.3    4.7    0.0000   0.0000          ?        ?   223.4826  14.0475          ?        ?      149.3        4.7       ?       ? 
1 1 1   50   19   14 o    201.2    4.1    0.0000   0.0000          ?        ?   405.4612  16.6016          ?        ?      201.2        4.1       ?       ? 
1 1 1   50   19   15 o    246.3    4.1    0.0000   0.0000          ?        ?   607.8726  20.4327          ?        ?      246.3        4.1       ?       ? 
1 1 1   50   19   16 o     37.4   14.4    0.0000   0.0000          ?        ?     9.5778  15.3245          ?        ?       37.4       14.4       ?       ? 
1 1 1   50   19   17 o     40.4   14.7    0.0000   0.0000          ?        ?    14.0475  15.3245          ?        ?       40.4       14.7       ?       ? 
1 1 1   50   19   18 o    101.3    7.6    0.0000   0.0000          ?        ?   103.4405  15.3245          ?        ?      101.3        7.6       ?       ? 
1 1 1   50   19   19 o    235.7    2.8    0.0000   0.0000          ?        ?   556.1523  13.4090          ?        ?      235.7        2.8       ?       ? 
1 1 1   50   19   20 o    159.3    3.8    0.0000   0.0000          ?        ?   254.1316  12.1319          ?        ?      159.3        3.8       ?       ? 
1 1 1   50   19   21 o    245.4    3.0    0.0000   0.0000          ?        ?   602.7644  14.6860          ?        ?      245.4        3.0       ?       ? 
1 1 1   50   19   22 o     39.2   13.8    0.0000   0.0000          ?        ?    14.0475  13.4090          ?        ?       39.2       13.8       ?       ? 
1 1 1   50   19   23 o     34.7   13.9    0.0000   0.0000          ?        ?     6.3852  14.6860          ?        ?       34.7       13.9       ?       ? 
1 1 1   50   19   24 o    225.9    3.5    0.0000   0.0000          ?        ?   511.4558  15.9630          ?        ?      225.9        3.5       ?       ? 
1 1 1   50   19   25 f    294.8    3.1    0.0000   0.0000          ?        ?   870.3050  18.5171          ?        ?      294.8        3.1       ?       ? 
1 1 1   50   19   26 o    131.9    5.6    0.0000   0.0000          ?        ?   174.9549  14.6860          ?        ?      131.9        5.6       ?       ? 
1 1 1   50   19   27 o    253.1    3.4    0.0000   0.0000          ?        ?   641.7142  17.2401          ?        ?      253.1        3.4       ?       ? 
1 1 1   50   19   28 o    177.3    4.5    0.0000   0.0000          ?        ?   315.4297  15.9630          ?        ?      177.3        4.5       ?       ? 
1 1 1   50   19   29 o    132.1    5.6    0.0000   0.0000          ?        ?   175.5934  14.6860          ?        ?      132.1        5.6       ?       ? 
1 1 1   50   19   30 o    199.3    4.0    0.0000   0.0000          ?        ?   398.4375  15.9630          ?        ?      199.3        4.0       ?       ? 
1 1 1   50   20    0 o    105.8   12.4  117.4880  25.5409   117.4880  25.5409   117.4880  25.5409      105.8     12.4      105.8       12.4     0.0     0.0 
1 1 1   50   20    1 o     19.3    9.7    0.0000   0.0000          ?        ?   -53.6358  17.2401          ?        ?       19.3        9.7       ?       ? 
1 1 1   50   20    2 o     19.7   10.0    0.0000   0.0000          ?        ?   -70.2374  19.7942          ?        ?       19.7       10.0       ?       ? 
1 1 1   50   20    3 o    158.0    6.3    0.0000   0.0000          ?        ?   250.9390  19.7942          ?        ?      158.0        6.3       ?       ? 
1 1 1   50   20    4 o     91.7    9.1    0.0000   0.0000          ?        ?    84.9234  16.6016          ?        ?       91.7        9.1       ?       ? 
1 1 1   50   20    5 o     41.3   15.7    0.0000   0.0000          ?        ?    12.7704  17.8786          ?        ?       41.3       15.7       ?       ? 
1 1 1   50   20    6 o    208.4    4.7    0.0000   0.0000          ?        ?   435.4717  19.7942          ?        ?      208.4        4.7       ?       ? 
1 1 1   50   20    7 o    232.1    4.5    0.0000   0.0000          ?        ?   540.1893  21.0712          ?        ?      232.1        4.5       ?       ? 
1 1 1   50   20    8 o     77.3   11.2    0.0000   0.0000          ?        ?    60.6596  17.2401          ?        ?       77.3       11.2       ?       ? 
1 1 1   50   20    9 o    217.9    4.8    0.0000   0.0000          ?        ?   476.3371  21.0712          ?        ?      217.9        4.8       ?       ? 
1 1 1   50   20   10 o    110.6    8.1    0.0000   0.0000          ?        ?   123.2347  17.8786          ?        ?      110.6        8.1       ?       ? 
1 1 1   50   20   11 o     39.5   15.7    0.0000   0.0000          ?        ?     8.9393  18.5171          ?        ?       39.5       15.7       ?       ? 
1 1 1   50   20   12 o    112.1    9.4    0.0000   0.0000          ?        ?   127.0658  21.0712          ?        ?      112.1        9.4       ?       ? 
1 1 1   50   20   13 o    165.3    4.2    0.0000   0.0000          ?        ?   273.9258  14.0475          ?        ?      165.3        4.2       ?       ? 
1 1 1   50   20   14 o    301.0    3.3    0.0000   0.0000          ?        ?   907.3393  19.7942          ?        ?      301.0        3.3       ?       ? 
1 1 1   50   20   15 o    170.6    4.3    0.0000   0.0000          ?        ?   291.8044  14.6860          ?        ?      170.6        4.3       ?       ? 
1 1 1   50   20   16 o     34.2   13.6    0.0000   0.0000          ?        ?     6.3852  14.0475          ?        ?       34.2       13.6       ?       ? 
1 1 1   50   20   17 o    196.6    4.1    0.0000   0.0000          ?        ?   387.5826  15.9630          ?        ?      196.6        4.1       ?       ? 
1 1 1   50   20   18 o    219.3    3.9    0.0000   0.0000          ?        ?   482.0838  17.2401          ?        ?      219.3        3.9       ?       ? 
1 1 1   50   20   19 o    140.1    5.7    0.0000   0.0000          ?        ?   197.3032  15.9630          ?        ?      140.1        5.7       ?       ? 
1 1 1   50   20   20 o    112.8    4.5    0.0000   0.0000          ?        ?   127.7043  10.2163          ?        ?      112.8        4.5       ?       ? 
1 1 1   50   20   21 o     45.9   11.8    0.0000   0.0000          ?        ?    22.3483  10.8549          ?        ?       45.9       11.8       ?       ? 
1 1 1   50   20   22 o    269.1    2.8    0.0000   0.0000          ?        ?   725.3605  15.3245          ?        ?      269.1        2.8       ?       ? 
1 1 1   50   20   23 o    199.4    3.4    0.0000   0.0000          ?        ?   398.4375  13.4090          ?        ?      199.4        3.4       ?       ? 
1 1 1   50   20   24 o    100.0    6.7    0.0000   0.0000          ?        ?   100.8864  13.4090          ?        ?      100.0        6.7       ?       ? 
1 1 1   50   20   25 o    105.6    6.3    0.0000   0.0000          ?        ?   112.3798  13.4090          ?        ?      105.6        6.3       ?       ? 
1 1 1   50   20   26 o    126.0    5.3    0.0000   0.0000          ?        ?   159.6304  13.4090          ?        ?      126.0        5.3       ?       ? 
1 1 1   50   20   27 o    128.7    5.7    0.0000   0.0000          ?        ?   166.6541  14.6860          ?        ?      128.7        5.7       ?       ? 
1 1 1   50   20   28 o     54.9   13.9    0.0000   0.0000          ?        ?    32.5646  15.3245          ?        ?       54.9       13.9       ?       ? 
1 1 1   50   21    0 o     15.0   11.1  -64.4907  22.9868   -64.4907  22.9868   -64.4907  22.9868       15.0     11.1       15.0       11.1     0.0     0.0 
1 1 1   50   21    1 o    128.1    7.5    0.0000   0.0000          ?        ?   165.3771  19.1556          ?        ?      128.1        7.5       ?       ? 
1 1 1   50   21    2 o    139.8    6.6    0.0000   0.0000          ?        ?   196.6647  18.5171          ?        ?      139.8        6.6       ?       ? 
1 1 1   50   21    3 o     45.4   15.9    0.0000   0.0000          ?        ?    19.1556  17.8786          ?        ?       45.4       15.9       ?       ? 
1 1 1   50   21    4 o    104.6    8.9    0.0000   0.0000          ?        ?   110.4642  18.5171          ?        ?      104.6        8.9       ?       ? 
1 1 1   50   21    5 f    453.6    4.4    0.0000   0.0000          ?        ?  2062.4248  39.5883          ?        ?      453.6        4.4       ?       ? 
1 1 1   50   21    6 o    283.6    4.4    0.0000   0.0000          ?        ?   806.4528  24.9023          ?        ?      283.6        4.4       ?       ? 
1 1 1   50   21    7 o    141.0    6.6    0.0000   0.0000          ?        ?   199.8573  18.5171          ?        ?      141.0        6.6       ?       ? 
1 1 1   50   21    8 o    296.2    4.1    0.0000   0.0000          ?        ?   879.2443  24.2638          ?        ?      296.2        4.1       ?       ? 
1 1 1   50   21    9 o     75.0   12.3    0.0000   0.0000          ?        ?    57.4669  18.5171          ?        ?       75.0       12.3       ?       ? 
1 1 1   50   21   10 o     73.5   14.9    0.0000   0.0000          ?        ?    57.4669  21.0712          ?        ?       73.5       14.9       ?       ? 
1 1 1   50   21   11 o    293.6    5.0    0.0000   0.0000          ?        ?   865.1968  29.3720          ?        ?      293.6        5.0       ?       ? 
1 1 1   50   21   12 o    323.8    4.4    0.0000   0.0000          ?        ?  1051.6451  28.7335          ?        ?      323.8        4.4       ?       ? 
1 1 1   50   21   13 o     96.0    9.0    0.0000   0.0000          ?        ?    93.2242  17.2401          ?        ?       96.0        9.0       ?       ? 
1 1 1   50   21   14 f     98.6    6.2    0.0000   0.0000          ?        ?    97.6938  12.1319          ?        ?       98.6        6.2       ?       ? 
1 1 1   50   21   15 o    150.3    4.9    0.0000   0.0000          ?        ?   226.6752  14.6860          ?        ?      150.3        4.9       ?       ? 
1 1 1   50   21   16 o    263.0    3.5    0.0000   0.0000          ?        ?   692.7960  18.5171          ?        ?      263.0        3.5       ?       ? 
1 1 1   50   21   17 o     60.1   12.6    0.0000   0.0000          ?        ?    38.3113  14.6860          ?        ?       60.1       12.6       ?       ? 
1 1 1   50   21   18 o    161.3    4.9    0.0000   0.0000          ?        ?   261.1554  15.9630          ?        ?      161.3        4.9       ?       ? 
1 1 1   50   21   19 o    227.3    3.7    0.0000   0.0000          ?        ?   517.8410  16.6016          ?        ?      227.3        3.7       ?       ? 
1 1 1   50   21   20 o    125.0    5.6    0.0000   0.0000          ?        ?   157.0763  14.0475          ?        ?      125.0        5.6       ?       ? 
1 1 1   50   21   21 o    154.8    3.5    0.0000   0.0000          ?        ?   240.0841  10.8549          ?        ?      154.8        3.5       ?       ? 
1 1 1   50   21   22 o    106.7    5.1    0.0000   0.0000          ?        ?   114.2954  10.8549          ?        ?      106.7        5.1       ?       ? 
1 1 1   50   21   23 o    103.0    5.6    0.0000   0.0000          ?        ?   106.6331  11.4934          ?        ?      103.0        5.6       ?       ? 
1 1 1   50   21   24 o    212.4    3.3    0.0000   0.0000          ?        ?   452.0733  14.0475          ?        ?      212.4        3.3       ?       ? 
1 1 1   50   21   25 o    236.8    3.0    0.0000   0.0000          ?        ?   561.8990  14.0475          ?        ?      236.8        3.0       ?       ? 
1 1 1   50   21   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   50   22    0 o     30.1   19.1    5.1082  24.2638     5.1082  24.2638     5.1082  24.2638       30.1     19.1       30.1       19.1     0.0     0.0 
1 1 1   50   22    1 o    129.4    7.2    0.0000   0.0000          ?        ?   168.5697  18.5171          ?        ?      129.4        7.2       ?       ? 
1 1 1   50   22    2 o    293.9    4.2    0.0000   0.0000          ?        ?   865.8354  24.9023          ?        ?      293.9        4.2       ?       ? 
1 1 1   50   22    3 o    214.0    4.9    0.0000   0.0000          ?        ?   459.7356  21.0712          ?        ?      214.0        4.9       ?       ? 
1 1 1   50   22    4 o    251.0    4.8    0.0000   0.0000          ?        ?   632.1364  24.2638          ?        ?      251.0        4.8       ?       ? 
1 1 1   50   22    5 o     58.8   14.7    0.0000   0.0000          ?        ?    37.0343  17.2401          ?        ?       58.8       14.7       ?       ? 
1 1 1   50   22    6 o    140.0    6.4    0.0000   0.0000          ?        ?   197.3032  17.8786          ?        ?      140.0        6.4       ?       ? 
1 1 1   50   22    7 o     98.6    8.7    0.0000   0.0000          ?        ?    98.3323  17.2401          ?        ?       98.6        8.7       ?       ? 
1 1 1   50   22    8 o    217.8    5.4    0.0000   0.0000          ?        ?   476.3371  23.6253          ?        ?      217.8        5.4       ?       ? 
1 1 1   50   22    9 o    172.9    6.1    0.0000   0.0000          ?        ?   300.7437  21.0712          ?        ?      172.9        6.1       ?       ? 
1 1 1   50   22   10 o    200.5    5.7    0.0000   0.0000          ?        ?   404.1842  22.9868          ?        ?      200.5        5.7       ?       ? 
1 1 1   50   22   11 o    148.7    6.9    0.0000   0.0000          ?        ?   222.8441  20.4327          ?        ?      148.7        6.9       ?       ? 
1 1 1   50   22   12 o    148.0    7.1    0.0000   0.0000          ?        ?   220.9285  21.0712          ?        ?      148.0        7.1       ?       ? 
1 1 1   50   22   13 o    132.9    7.4    0.0000   0.0000          ?        ?   178.1475  19.7942          ?        ?      132.9        7.4       ?       ? 
1 1 1   50   22   14 f    163.6    6.2    0.0000   0.0000          ?        ?   269.4561  20.4327          ?        ?      163.6        6.2       ?       ? 
1 1 1   50   22   15 o     25.6   11.5    0.0000   0.0000          ?        ?    -5.1082  12.1319          ?        ?       25.6       11.5       ?       ? 
1 1 1   50   22   16 o    185.1    4.1    0.0000   0.0000          ?        ?   343.5246  15.3245          ?        ?      185.1        4.1       ?       ? 
1 1 1   50   22   17 o    132.4    5.8    0.0000   0.0000          ?        ?   176.2320  15.3245          ?        ?      132.4        5.8       ?       ? 
1 1 1   50   22   18 o    155.4    5.3    0.0000   0.0000          ?        ?   242.6382  16.6016          ?        ?      155.4        5.3       ?       ? 
1 1 1   50   22   19 o    137.4    6.5    0.0000   0.0000          ?        ?   190.2794  17.8786          ?        ?      137.4        6.5       ?       ? 
1 1 1   50   22   20 o     37.5   14.2    0.0000   0.0000          ?        ?    10.8549  14.6860          ?        ?       37.5       14.2       ?       ? 
1 1 1   50   22   21 o    310.9    3.3    0.0000   0.0000          ?        ?   968.6373  20.4327          ?        ?      310.9        3.3       ?       ? 
1 1 1   50   22   22 o     90.8    8.4    0.0000   0.0000          ?        ?    83.6463  15.3245          ?        ?       90.8        8.4       ?       ? 
1 1 1   50   22   23 o     29.6   11.9    0.0000   0.0000          ?        ?     4.4697  10.8549          ?        ?       29.6       11.9       ?       ? 
1 1 1   50   23    0 o    290.8    6.4  849.8723  37.0343   849.8723  37.0343   849.8723  37.0343      290.8      6.4      290.8        6.4     0.0     0.0 
1 1 1   50   23    1 o    203.5    5.0    0.0000   0.0000          ?        ?   415.6776  20.4327          ?        ?      203.5        5.0       ?       ? 
1 1 1   50   23    2 f    236.5    4.6    0.0000   0.0000          ?        ?   561.2605  21.7097          ?        ?      236.5        4.6       ?       ? 
1 1 1   50   23    3 o     70.4   12.7    0.0000   0.0000          ?        ?    52.3588  17.2401          ?        ?       70.4       12.7       ?       ? 
1 1 1   50   23    4 o    126.2    6.6    0.0000   0.0000          ?        ?   160.2689  16.6016          ?        ?      126.2        6.6       ?       ? 
1 1 1   50   23    5 o    219.0    4.8    0.0000   0.0000          ?        ?   481.4453  21.0712          ?        ?      219.0        4.8       ?       ? 
1 1 1   50   23    6 o    156.2    6.7    0.0000   0.0000          ?        ?   245.8308  21.0712          ?        ?      156.2        6.7       ?       ? 
1 1 1   50   23    7 o    143.4    7.3    0.0000   0.0000          ?        ?   207.5195  21.0712          ?        ?      143.4        7.3       ?       ? 
1 1 1   50   23    8 o    246.1    5.4    0.0000   0.0000          ?        ?   608.5111  26.8179          ?        ?      246.1        5.4       ?       ? 
1 1 1   50   23    9 o    257.7    5.0    0.0000   0.0000          ?        ?   666.6166  25.5409          ?        ?      257.7        5.0       ?       ? 
1 1 1   50   23   10 o     51.2   15.8    0.0000   0.0000          ?        ?    27.4564  17.8786          ?        ?       51.2       15.8       ?       ? 
1 1 1   50   23   11 o    133.6    7.2    0.0000   0.0000          ?        ?   180.0631  19.1556          ?        ?      133.6        7.2       ?       ? 
1 1 1   50   23   12 o    104.2    8.3    0.0000   0.0000          ?        ?   109.8257  17.2401          ?        ?      104.2        8.3       ?       ? 
1 1 1   50   23   13 o     78.2   11.4    0.0000   0.0000          ?        ?    62.5751  17.8786          ?        ?       78.2       11.4       ?       ? 
1 1 1   50   23   14 o     60.5   15.3    0.0000   0.0000          ?        ?    39.5883  18.5171          ?        ?       60.5       15.3       ?       ? 
1 1 1   50   23   15 o    282.4    4.4    0.0000   0.0000          ?        ?   800.7061  24.9023          ?        ?      282.4        4.4       ?       ? 
1 1 1   50   23   16 o    196.0    3.4    0.0000   0.0000          ?        ?   385.0285  13.4090          ?        ?      196.0        3.4       ?       ? 
1 1 1   50   23   17 o     79.7    8.4    0.0000   0.0000          ?        ?    64.4907  13.4090          ?        ?       79.7        8.4       ?       ? 
1 1 1   50   23   18 o    141.9    5.2    0.0000   0.0000          ?        ?   202.4114  14.6860          ?        ?      141.9        5.2       ?       ? 
1 1 1   50   23   19 o     58.2   13.0    0.0000   0.0000          ?        ?    36.3957  14.6860          ?        ?       58.2       13.0       ?       ? 
1 1 1   50   24    0 o    155.8    8.7  246.4693  26.8179   246.4693  26.8179   246.4693  26.8179      155.8      8.7      155.8        8.7     0.0     0.0 
1 1 1   50   24    1 o    120.9    7.1    0.0000   0.0000          ?        ?   147.4985  17.2401          ?        ?      120.9        7.1       ?       ? 
1 1 1   50   24    2 o     29.9   13.5    0.0000   0.0000          ?        ?    -8.3008  17.2401          ?        ?       29.9       13.5       ?       ? 
1 1 1   50   24    3 o    125.4    6.4    0.0000   0.0000          ?        ?   158.3534  15.9630          ?        ?      125.4        6.4       ?       ? 
1 1 1   50   24    4 o    180.8    5.8    0.0000   0.0000          ?        ?   328.8386  21.0712          ?        ?      180.8        5.8       ?       ? 
1 1 1   50   24    5 o    302.4    4.5    0.0000   0.0000          ?        ?   918.1941  27.4564          ?        ?      302.4        4.5       ?       ? 
1 1 1   50   24    6 o    177.0    6.0    0.0000   0.0000          ?        ?   315.4297  21.0712          ?        ?      177.0        6.0       ?       ? 
1 1 1   50   24    7 o     77.2   12.4    0.0000   0.0000          ?        ?    61.2981  19.1556          ?        ?       77.2       12.4       ?       ? 
1 1 1   50   24    8 o    127.0    7.0    0.0000   0.0000          ?        ?   162.8230  17.8786          ?        ?      127.0        7.0       ?       ? 
1 1 1   50   24    9 o    213.6    4.5    0.0000   0.0000          ?        ?   457.8200  19.1556          ?        ?      213.6        4.5       ?       ? 
1 1 1   50   24   10 o    191.2    4.8    0.0000   0.0000          ?        ?   367.1499  18.5171          ?        ?      191.2        4.8       ?       ? 
1 1 1   50   24   11 f    215.1    4.7    0.0000   0.0000          ?        ?   464.8438  20.4327          ?        ?      215.1        4.7       ?       ? 
1 1 1   50   24   12 o     35.5   14.6    0.0000   0.0000          ?        ?     5.1082  16.6016          ?        ?       35.5       14.6       ?       ? 
1 1 1   50   24   13 o    130.4    7.1    0.0000   0.0000          ?        ?   171.7623  18.5171          ?        ?      130.4        7.1       ?       ? 
1 1 1   50   24   14 o     70.7   14.1    0.0000   0.0000          ?        ?    53.6358  19.1556          ?        ?       70.7       14.1       ?       ? 
1 1 1   50   24   15 o    127.0    8.0    0.0000   0.0000          ?        ?   163.4615  20.4327          ?        ?      127.0        8.0       ?       ? 
1 1 1   50   25    0 o     39.7   20.7   24.2638  21.0712    24.2638  21.0712    24.2638  21.0712       39.7     20.7       39.7       20.7     0.0     0.0 
1 1 1   50   25    1 o    205.4    4.4    0.0000   0.0000          ?        ?   423.3398  17.8786          ?        ?      205.4        4.4       ?       ? 
1 1 1   50   25    2 o    177.5    5.2    0.0000   0.0000          ?        ?   316.7067  18.5171          ?        ?      177.5        5.2       ?       ? 
1 1 1   50   25    3 o    135.2    6.8    0.0000   0.0000          ?        ?   184.5327  18.5171          ?        ?      135.2        6.8       ?       ? 
1 1 1   50   25    4 o    212.6    5.1    0.0000   0.0000          ?        ?   454.6274  21.7097          ?        ?      212.6        5.1       ?       ? 
1 1 1   50   25    5 o     31.1   13.8    0.0000   0.0000          ?        ?    -5.1082  17.2401          ?        ?       31.1       13.8       ?       ? 
1 1 1   50   25    6 o     48.9   14.2    0.0000   0.0000          ?        ?    25.5409  14.6860          ?        ?       48.9       14.2       ?       ? 
1 1 1   50   25    7 o    168.5    4.9    0.0000   0.0000          ?        ?   285.4192  16.6016          ?        ?      168.5        4.9       ?       ? 
1 1 1   50   25    8 o    138.8    6.0    0.0000   0.0000          ?        ?   194.1106  16.6016          ?        ?      138.8        6.0       ?       ? 
1 1 1   50   25    9 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51    0    0 o    114.2   10.8  134.0895  24.2638   134.0895  24.2638   134.0895  24.2638      114.2     10.8      114.2       10.8     0.0     0.0 
1 1 1   51    0    1 f     91.3    9.6   86.2004  17.2401    86.2004  17.2401    86.2004  17.2401       91.3      9.6       91.3        9.6     0.0     0.0 
1 1 1   51    0    2 o    275.2    3.9  757.9252  21.7097   757.9252  21.7097   757.9252  21.7097      275.2      3.9      275.2        3.9     0.0     0.0 
1 1 1   51    0    3 o    755.5    5.2 5711.5762  79.1767  5711.5762  79.1767  5711.5762  79.1767      755.5      5.2      755.5        5.2     0.0     0.0 
1 1 1   51    0    4 o    226.0    4.7  511.4558  21.0712   511.4558  21.0712   511.4558  21.0712      226.0      4.7      226.0        4.7     0.0     0.0 
1 1 1   51    0    5 o    316.1    3.7  999.9249  23.6253   999.9249  23.6253   999.9249  23.6253      316.1      3.7      316.1        3.7     0.0     0.0 
1 1 1   51    0    6 o    270.9    3.9  734.2999  21.0712   734.2999  21.0712   734.2999  21.0712      270.9      3.9      270.9        3.9     0.0     0.0 
1 1 1   51    0    7 o    404.2    4.0 1634.6154  31.9261  1634.6154  31.9261  1634.6154  31.9261      404.2      4.0      404.2        4.0     0.0     0.0 
1 1 1   51    0    8 o    553.1    4.1 3061.0728  45.3350  3061.0728  45.3350  3061.0728  45.3350      553.1      4.1      553.1        4.1     0.0     0.0 
1 1 1   51    0    9 o    157.0    5.9  247.7464  18.5171   247.7464  18.5171   247.7464  18.5171      157.0      5.9      157.0        5.9     0.0     0.0 
1 1 1   51    0   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51    0   11 o    135.8    6.6  185.8098  17.8786   185.8098  17.8786   185.8098  17.8786      135.8      6.6      135.8        6.6     0.0     0.0 
1 1 1   51    0   12 o    235.4    4.3  554.8753  20.4327   554.8753  20.4327   554.8753  20.4327      235.4      4.3      235.4        4.3     0.0     0.0 
1 1 1   51    0   13 f    271.4    4.0  737.4925  21.7097   737.4925  21.7097   737.4925  21.7097      271.4      4.0      271.4        4.0     0.0     0.0 
1 1 1   51    0   14 o    115.2    7.8  134.7281  17.8786   134.7281  17.8786   134.7281  17.8786      115.2      7.8      115.2        7.8     0.0     0.0 
1 1 1   51    0   15 o    215.8    4.7  466.7593  20.4327   466.7593  20.4327   466.7593  20.4327      215.8      4.7      215.8        4.7     0.0     0.0 
1 1 1   51    0   16 o    343.2    3.6 1178.7109  24.9023  1178.7109  24.9023  1178.7109  24.9023      343.2      3.6      343.2        3.6     0.0     0.0 
1 1 1   51    0   17 o     17.2   12.5  -33.2031  20.4327   -33.2031  20.4327   -33.2031  20.4327       17.2     12.5       17.2       12.5     0.0     0.0 
1 1 1   51    0   18 o    152.8    6.5  234.9760  19.7942   234.9760  19.7942   234.9760  19.7942      152.8      6.5      152.8        6.5     0.0     0.0 
1 1 1   51    0   19 o     14.5   10.7  -46.6121  19.1556   -46.6121  19.1556   -46.6121  19.1556       14.5     10.7       14.5       10.7     0.0     0.0 
1 1 1   51    0   20 o    115.3    8.7  135.3666  19.7942   135.3666  19.7942   135.3666  19.7942      115.3      8.7      115.3        8.7     0.0     0.0 
1 1 1   51    0   21 o    167.2    6.1  280.9495  20.4327   280.9495  20.4327   280.9495  20.4327      167.2      6.1      167.2        6.1     0.0     0.0 
1 1 1   51    0   22 o    154.3    6.2  239.4456  19.1556   239.4456  19.1556   239.4456  19.1556      154.3      6.2      154.3        6.2     0.0     0.0 
1 1 1   51    0   23 o    244.8    4.8  600.2103  23.6253   600.2103  23.6253   600.2103  23.6253      244.8      4.8      244.8        4.8     0.0     0.0 
1 1 1   51    0   24 o    326.7    3.9 1068.2467  25.5409  1068.2467  25.5409  1068.2467  25.5409      326.7      3.9      326.7        3.9     0.0     0.0 
1 1 1   51    0   25 o    103.6    9.7  110.4642  19.7942   110.4642  19.7942   110.4642  19.7942      103.6      9.7      103.6        9.7     0.0     0.0 
1 1 1   51    0   26 o    238.6    4.6  570.1998  21.7097   570.1998  21.7097   570.1998  21.7097      238.6      4.6      238.6        4.6     0.0     0.0 
1 1 1   51    0   27 o    222.5    4.6  496.1313  20.4327   496.1313  20.4327   496.1313  20.4327      222.5      4.6      222.5        4.6     0.0     0.0 
1 1 1   51    0   28 o    111.2    9.0  126.4273  19.7942   126.4273  19.7942   126.4273  19.7942      111.2      9.0      111.2        9.0     0.0     0.0 
1 1 1   51    0   29 o    147.4    7.0  219.0129  20.4327   219.0129  20.4327   219.0129  20.4327      147.4      7.0      147.4        7.0     0.0     0.0 
1 1 1   51    0   30 o    346.2    3.9 1199.7821  26.8179  1199.7821  26.8179  1199.7821  26.8179      346.2      3.9      346.2        3.9     0.0     0.0 
1 1 1   51    0   31 o    267.6    4.3  717.0598  22.9868   717.0598  22.9868   717.0598  22.9868      267.6      4.3      267.6        4.3     0.0     0.0 
1 1 1   51    0   32 o    266.6    4.4  711.9516  23.6253   711.9516  23.6253   711.9516  23.6253      266.6      4.4      266.6        4.4     0.0     0.0 
1 1 1   51    0   33 o    398.0    3.9 1585.4492  30.6490  1585.4492  30.6490  1585.4492  30.6490      398.0      3.9      398.0        3.9     0.0     0.0 
1 1 1   51    0   34 o    326.9    4.2 1069.5237  27.4564  1069.5237  27.4564  1069.5237  27.4564      326.9      4.2      326.9        4.2     0.0     0.0 
1 1 1   51    0   35 o     63.8   19.5   51.0817  21.7097    51.0817  21.7097    51.0817  21.7097       63.8     19.5       63.8       19.5     0.0     0.0 
1 1 1   51    0   36 o    134.3    8.9  183.2557  23.6253   183.2557  23.6253   183.2557  23.6253      134.3      8.9      134.3        8.9     0.0     0.0 
1 1 1   51    0   37 o    451.2    3.7 2036.8840  33.2031  2036.8840  33.2031  2036.8840  33.2031      451.2      3.7      451.2        3.7     0.0     0.0 
1 1 1   51    0   38 o    131.4    9.1  175.5934  23.6253   175.5934  23.6253   175.5934  23.6253      131.4      9.1      131.4        9.1     0.0     0.0 
1 1 1   51    0   39 f     80.3   16.7   72.7915  23.6253    72.7915  23.6253    72.7915  23.6253       80.3     16.7       80.3       16.7     0.0     0.0 
1 1 1   51    0   40 o    291.0    4.5  847.9567  26.1794   847.9567  26.1794   847.9567  26.1794      291.0      4.5      291.0        4.5     0.0     0.0 
1 1 1   51    0   41 o     20.6   14.7  -28.0950  24.2638   -28.0950  24.2638   -28.0950  24.2638       20.6     14.7       20.6       14.7     0.0     0.0 
1 1 1   51    0   42 o    288.3    4.7  832.6321  26.8179   832.6321  26.8179   832.6321  26.8179      288.3      4.7      288.3        4.7     0.0     0.0 
1 1 1   51    0   43 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51    0   44 o     33.8   20.2   13.4090  23.6253    13.4090  23.6253    13.4090  23.6253       33.8     20.2       33.8       20.2     0.0     0.0 
1 1 1   51    0   45 o    254.1    5.2  647.4609  26.1794   647.4609  26.1794   647.4609  26.1794      254.1      5.2      254.1        5.2     0.0     0.0 
1 1 1   51    0   46 o    207.5    6.5  432.9177  26.8179   432.9177  26.8179   432.9177  26.8179      207.5      6.5      207.5        6.5     0.0     0.0 
1 1 1   51    0   47 f    224.3    5.8  505.0706  26.1794   505.0706  26.1794   505.0706  26.1794      224.3      5.8      224.3        5.8     0.0     0.0 
1 1 1   51    0   48 o    192.4    7.0  372.8966  26.8179   372.8966  26.8179   372.8966  26.8179      192.4      7.0      192.4        7.0     0.0     0.0 
1 1 1   51    0   49 o     22.8   15.9  -21.0712  25.5409   -21.0712  25.5409   -21.0712  25.5409       22.8     15.9       22.8       15.9     0.0     0.0 
1 1 1   51    0   50 f    302.6    4.8  918.1941  28.7335   918.1941  28.7335   918.1941  28.7335      302.6      4.8      302.6        4.8     0.0     0.0 
1 1 1   51    0   51 o    170.2    7.7  293.0815  26.1794   293.0815  26.1794   293.0815  26.1794      170.2      7.7      170.2        7.7     0.0     0.0 
1 1 1   51    0   52 o    266.2    5.3  711.3131  28.0950   711.3131  28.0950   711.3131  28.0950      266.2      5.3      266.2        5.3     0.0     0.0 
1 1 1   51    0   53 o    145.5    9.5  216.4588  27.4564   216.4588  27.4564   216.4588  27.4564      145.5      9.5      145.5        9.5     0.0     0.0 
1 1 1   51    1    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51    1    1 o    237.5    3.0    0.0000   0.0000          ?        ?   564.4531  14.0475          ?        ?      237.5        3.0       ?       ? 
1 1 1   51    1    2 o    556.2    3.0    0.0000   0.0000          ?        ?  3094.2759  33.8416          ?        ?      556.2        3.0       ?       ? 
1 1 1   51    1    3 o    496.6    3.0    0.0000   0.0000          ?        ?  2467.2476  29.3720          ?        ?      496.6        3.0       ?       ? 
1 1 1   51    1    4 o    238.6    2.8    0.0000   0.0000          ?        ?   569.5613  13.4090          ?        ?      238.6        2.8       ?       ? 
1 1 1   51    1    5 o     15.2    7.7    0.0000   0.0000          ?        ?   -39.5883  11.4934          ?        ?       15.2        7.7       ?       ? 
1 1 1   51    1    6 o    180.1    3.7    0.0000   0.0000          ?        ?   324.3690  13.4090          ?        ?      180.1        3.7       ?       ? 
1 1 1   51    1    7 o    397.9    2.7    0.0000   0.0000          ?        ?  1583.5337  21.7097          ?        ?      397.9        2.7       ?       ? 
1 1 1   51    1    8 o    161.6    4.0    0.0000   0.0000          ?        ?   261.1554  12.7704          ?        ?      161.6        4.0       ?       ? 
1 1 1   51    1    9 f    379.1    2.8    0.0000   0.0000          ?        ?  1437.3123  21.0712          ?        ?      379.1        2.8       ?       ? 
1 1 1   51    1   10 o     20.8   10.0    0.0000   0.0000          ?        ?   -17.8786  12.1319          ?        ?       20.8       10.0       ?       ? 
1 1 1   51    1   11 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51    1   12 o    132.9    4.6    0.0000   0.0000          ?        ?   176.8705  12.1319          ?        ?      132.9        4.6       ?       ? 
1 1 1   51    1   13 o     67.2    9.5    0.0000   0.0000          ?        ?    45.3350  12.7704          ?        ?       67.2        9.5       ?       ? 
1 1 1   51    1   14 o    133.6    5.0    0.0000   0.0000          ?        ?   178.7861  13.4090          ?        ?      133.6        5.0       ?       ? 
1 1 1   51    1   15 o    137.2    4.9    0.0000   0.0000          ?        ?   188.3639  13.4090          ?        ?      137.2        4.9       ?       ? 
1 1 1   51    1   16 o    414.8    2.6    0.0000   0.0000          ?        ?  1720.8158  21.7097          ?        ?      414.8        2.6       ?       ? 
1 1 1   51    1   17 o    121.9    5.0    0.0000   0.0000          ?        ?   148.7755  12.1319          ?        ?      121.9        5.0       ?       ? 
1 1 1   51    1   18 o    347.1    2.8    0.0000   0.0000          ?        ?  1204.8903  19.1556          ?        ?      347.1        2.8       ?       ? 
1 1 1   51    1   19 o    235.9    3.2    0.0000   0.0000          ?        ?   556.7908  15.3245          ?        ?      235.9        3.2       ?       ? 
1 1 1   51    1   20 f    227.9    3.2    0.0000   0.0000          ?        ?   519.7566  14.6860          ?        ?      227.9        3.2       ?       ? 
1 1 1   51    1   21 o    284.0    3.0    0.0000   0.0000          ?        ?   807.0914  17.2401          ?        ?      284.0        3.0       ?       ? 
1 1 1   51    1   22 o    339.5    2.5    0.0000   0.0000          ?        ?  1153.1700  17.2401          ?        ?      339.5        2.5       ?       ? 
1 1 1   51    1   23 o    116.8    5.7    0.0000   0.0000          ?        ?   136.6436  13.4090          ?        ?      116.8        5.7       ?       ? 
1 1 1   51    1   24 o    434.5    2.6    0.0000   0.0000          ?        ?  1888.7469  22.3483          ?        ?      434.5        2.6       ?       ? 
1 1 1   51    1   25 o    359.6    2.8    0.0000   0.0000          ?        ?  1293.6449  19.7942          ?        ?      359.6        2.8       ?       ? 
1 1 1   51    1   26 o     25.4   11.6    0.0000   0.0000          ?        ?    -9.5778  13.4090          ?        ?       25.4       11.6       ?       ? 
1 1 1   51    1   27 o    214.2    3.7    0.0000   0.0000          ?        ?   459.0970  15.9630          ?        ?      214.2        3.7       ?       ? 
1 1 1   51    1   28 o    146.4    4.6    0.0000   0.0000          ?        ?   214.5433  13.4090          ?        ?      146.4        4.6       ?       ? 
1 1 1   51    1   29 o     48.4   13.8    0.0000   0.0000          ?        ?    24.2638  14.0475          ?        ?       48.4       13.8       ?       ? 
1 1 1   51    1   30 o     42.2   14.4    0.0000   0.0000          ?        ?    16.6016  14.6860          ?        ?       42.2       14.4       ?       ? 
1 1 1   51    1   31 o    315.4    2.8    0.0000   0.0000          ?        ?   995.4552  17.8786          ?        ?      315.4        2.8       ?       ? 
1 1 1   51    1   32 o    227.6    3.5    0.0000   0.0000          ?        ?   518.4796  15.9630          ?        ?      227.6        3.5       ?       ? 
1 1 1   51    1   33 o    229.8    3.5    0.0000   0.0000          ?        ?   528.6959  15.9630          ?        ?      229.8        3.5       ?       ? 
1 1 1   51    1   34 o    336.8    2.7    0.0000   0.0000          ?        ?  1134.6530  18.5171          ?        ?      336.8        2.7       ?       ? 
1 1 1   51    1   35 o    219.7    3.9    0.0000   0.0000          ?        ?   483.3608  17.2401          ?        ?      219.7        3.9       ?       ? 
1 1 1   51    1   36 o    275.2    3.2    0.0000   0.0000          ?        ?   757.9252  17.8786          ?        ?      275.2        3.2       ?       ? 
1 1 1   51    1   37 o    366.5    2.8    0.0000   0.0000          ?        ?  1344.0880  20.4327          ?        ?      366.5        2.8       ?       ? 
1 1 1   51    1   38 o    182.2    4.7    0.0000   0.0000          ?        ?   332.6698  17.2401          ?        ?      182.2        4.7       ?       ? 
1 1 1   51    1   39 o    262.8    3.5    0.0000   0.0000          ?        ?   691.5189  18.5171          ?        ?      262.8        3.5       ?       ? 
1 1 1   51    1   40 o    124.0    6.7    0.0000   0.0000          ?        ?   154.5222  16.6016          ?        ?      124.0        6.7       ?       ? 
1 1 1   51    1   41 o    356.5    3.0    0.0000   0.0000          ?        ?  1271.9351  21.0712          ?        ?      356.5        3.0       ?       ? 
1 1 1   51    1   42 o    279.3    3.5    0.0000   0.0000          ?        ?   780.9120  19.7942          ?        ?      279.3        3.5       ?       ? 
1 1 1   51    1   43 o     53.1   15.7    0.0000   0.0000          ?        ?    29.3720  17.8786          ?        ?       53.1       15.7       ?       ? 
1 1 1   51    1   44 f     73.5   11.7    0.0000   0.0000          ?        ?    54.9129  17.2401          ?        ?       73.5       11.7       ?       ? 
1 1 1   51    1   45 o     42.1   15.8    0.0000   0.0000          ?        ?    14.0475  17.8786          ?        ?       42.1       15.8       ?       ? 
1 1 1   51    1   46 o    214.4    4.3    0.0000   0.0000          ?        ?   461.0126  18.5171          ?        ?      214.4        4.3       ?       ? 
1 1 1   51    1   47 f    218.0    4.4    0.0000   0.0000          ?        ?   476.3371  19.1556          ?        ?      218.0        4.4       ?       ? 
1 1 1   51    1   48 o     24.4   11.8    0.0000   0.0000          ?        ?   -26.1794  17.2401          ?        ?       24.4       11.8       ?       ? 
1 1 1   51    1   49 o    148.4    5.8    0.0000   0.0000          ?        ?   221.5670  17.2401          ?        ?      148.4        5.8       ?       ? 
1 1 1   51    1   50 o    109.5    8.2    0.0000   0.0000          ?        ?   121.3191  17.8786          ?        ?      109.5        8.2       ?       ? 
1 1 1   51    1   51 o     45.1   15.9    0.0000   0.0000          ?        ?    19.1556  17.8786          ?        ?       45.1       15.9       ?       ? 
1 1 1   51    1   52 o     98.3    9.4    0.0000   0.0000          ?        ?    98.3323  18.5171          ?        ?       98.3        9.4       ?       ? 
1 1 1   51    2    0 o    345.9    4.1 1197.2280  28.0950  1197.2280  28.0950  1197.2280  28.0950      345.9      4.1      345.9        4.1     0.0     0.0 
1 1 1   51    2    1 o    625.9    3.1    0.0000   0.0000          ?        ?  3918.6072  38.9498          ?        ?      625.9        3.1       ?       ? 
1 1 1   51    2    2 o    408.5    2.6    0.0000   0.0000          ?        ?  1669.0955  21.0712          ?        ?      408.5        2.6       ?       ? 
1 1 1   51    2    3 o    555.0    2.8    0.0000   0.0000          ?        ?  3080.8669  31.2876          ?        ?      555.0        2.8       ?       ? 
1 1 1   51    2    4 o    406.4    2.7    0.0000   0.0000          ?        ?  1652.4939  22.3483          ?        ?      406.4        2.7       ?       ? 
1 1 1   51    2    5 o    332.6    2.7    0.0000   0.0000          ?        ?  1106.5580  17.8786          ?        ?      332.6        2.7       ?       ? 
1 1 1   51    2    6 o    338.7    2.6    0.0000   0.0000          ?        ?  1147.4233  17.8786          ?        ?      338.7        2.6       ?       ? 
1 1 1   51    2    7 o    249.2    2.8    0.0000   0.0000          ?        ?   621.2816  14.0475          ?        ?      249.2        2.8       ?       ? 
1 1 1   51    2    8 o    134.8    4.7    0.0000   0.0000          ?        ?   181.9787  12.7704          ?        ?      134.8        4.7       ?       ? 
1 1 1   51    2    9 o    339.8    2.7    0.0000   0.0000          ?        ?  1155.0856  18.5171          ?        ?      339.8        2.7       ?       ? 
1 1 1   51    2   10 o     70.5    8.6    0.0000   0.0000          ?        ?    49.8047  12.1319          ?        ?       70.5        8.6       ?       ? 
1 1 1   51    2   11 o    422.3    2.5    0.0000   0.0000          ?        ?  1784.0294  21.0712          ?        ?      422.3        2.5       ?       ? 
1 1 1   51    2   12 o    332.7    2.6    0.0000   0.0000          ?        ?  1107.1964  17.2401          ?        ?      332.7        2.6       ?       ? 
1 1 1   51    2   13 o    398.9    2.8    0.0000   0.0000          ?        ?  1591.8345  22.3483          ?        ?      398.9        2.8       ?       ? 
1 1 1   51    2   14 o    195.2    3.3    0.0000   0.0000          ?        ?   381.1974  12.7704          ?        ?      195.2        3.3       ?       ? 
1 1 1   51    2   15 o    363.8    2.6    0.0000   0.0000          ?        ?  1324.2938  19.1556          ?        ?      363.8        2.6       ?       ? 
1 1 1   51    2   16 o    147.3    4.6    0.0000   0.0000          ?        ?   217.0974  13.4090          ?        ?      147.3        4.6       ?       ? 
1 1 1   51    2   17 o     97.4    6.6    0.0000   0.0000          ?        ?    95.1397  12.7704          ?        ?       97.4        6.6       ?       ? 
1 1 1   51    2   18 f    161.9    4.1    0.0000   0.0000          ?        ?   262.4324  13.4090          ?        ?      161.9        4.1       ?       ? 
1 1 1   51    2   19 o    379.9    2.5    0.0000   0.0000          ?        ?  1443.6974  19.1556          ?        ?      379.9        2.5       ?       ? 
1 1 1   51    2   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51    2   21 f    124.5    5.6    0.0000   0.0000          ?        ?   155.1608  14.0475          ?        ?      124.5        5.6       ?       ? 
1 1 1   51    2   22 o    302.8    3.0    0.0000   0.0000          ?        ?   917.5555  17.8786          ?        ?      302.8        3.0       ?       ? 
1 1 1   51    2   23 o    143.3    5.1    0.0000   0.0000          ?        ?   205.6040  14.6860          ?        ?      143.3        5.1       ?       ? 
1 1 1   51    2   24 o    330.6    2.7    0.0000   0.0000          ?        ?  1093.1490  17.8786          ?        ?      330.6        2.7       ?       ? 
1 1 1   51    2   25 o    290.8    3.1    0.0000   0.0000          ?        ?   846.0411  17.8786          ?        ?      290.8        3.1       ?       ? 
1 1 1   51    2   26 o    316.6    2.6    0.0000   0.0000          ?        ?  1002.4789  16.6016          ?        ?      316.6        2.6       ?       ? 
1 1 1   51    2   27 o    224.8    3.4    0.0000   0.0000          ?        ?   505.7091  15.3245          ?        ?      224.8        3.4       ?       ? 
1 1 1   51    2   28 o    267.0    3.1    0.0000   0.0000          ?        ?   713.2286  16.6016          ?        ?      267.0        3.1       ?       ? 
1 1 1   51    2   29 o     18.4    9.2    0.0000   0.0000          ?        ?   -42.7809  14.6860          ?        ?       18.4        9.2       ?       ? 
1 1 1   51    2   30 o     22.2   10.7    0.0000   0.0000          ?        ?   -24.2638  14.6860          ?        ?       22.2       10.7       ?       ? 
1 1 1   51    2   31 o    114.0    6.4    0.0000   0.0000          ?        ?   130.2584  14.6860          ?        ?      114.0        6.4       ?       ? 
1 1 1   51    2   32 f     96.7    7.9    0.0000   0.0000          ?        ?    93.8627  15.3245          ?        ?       96.7        7.9       ?       ? 
1 1 1   51    2   33 o    342.1    2.8    0.0000   0.0000          ?        ?  1171.0486  19.1556          ?        ?      342.1        2.8       ?       ? 
1 1 1   51    2   34 o     31.1   13.6    0.0000   0.0000          ?        ?    -3.1926  15.9630          ?        ?       31.1       13.6       ?       ? 
1 1 1   51    2   35 o     22.6   10.9    0.0000   0.0000          ?        ?   -25.5409  15.3245          ?        ?       22.6       10.9       ?       ? 
1 1 1   51    2   36 o    153.1    5.4    0.0000   0.0000          ?        ?   234.9760  16.6016          ?        ?      153.1        5.4       ?       ? 
1 1 1   51    2   37 o    271.1    3.3    0.0000   0.0000          ?        ?   735.5769  17.8786          ?        ?      271.1        3.3       ?       ? 
1 1 1   51    2   38 o     92.9    8.9    0.0000   0.0000          ?        ?    86.8389  16.6016          ?        ?       92.9        8.9       ?       ? 
1 1 1   51    2   39 f    142.3    5.8    0.0000   0.0000          ?        ?   203.0499  16.6016          ?        ?      142.3        5.8       ?       ? 
1 1 1   51    2   40 o    132.0    6.5    0.0000   0.0000          ?        ?   174.9549  17.2401          ?        ?      132.0        6.5       ?       ? 
1 1 1   51    2   41 o     28.9   13.2    0.0000   0.0000          ?        ?   -11.4934  17.2401          ?        ?       28.9       13.2       ?       ? 
1 1 1   51    2   42 o    302.1    3.2    0.0000   0.0000          ?        ?   913.7245  19.1556          ?        ?      302.1        3.2       ?       ? 
1 1 1   51    2   43 o     29.6   13.4    0.0000   0.0000          ?        ?    -9.5778  17.2401          ?        ?       29.6       13.4       ?       ? 
1 1 1   51    2   44 o    167.7    5.5    0.0000   0.0000          ?        ?   282.2266  18.5171          ?        ?      167.7        5.5       ?       ? 
1 1 1   51    2   45 o     47.2   15.9    0.0000   0.0000          ?        ?    21.7097  17.8786          ?        ?       47.2       15.9       ?       ? 
1 1 1   51    2   46 o    142.1    6.1    0.0000   0.0000          ?        ?   203.0499  17.2401          ?        ?      142.1        6.1       ?       ? 
1 1 1   51    2   47 o     70.5   12.7    0.0000   0.0000          ?        ?    52.3588  17.2401          ?        ?       70.5       12.7       ?       ? 
1 1 1   51    2   48 o    254.8    3.6    0.0000   0.0000          ?        ?   650.6536  18.5171          ?        ?      254.8        3.6       ?       ? 
1 1 1   51    2   49 o     48.1   15.7    0.0000   0.0000          ?        ?    23.6253  17.2401          ?        ?       48.1       15.7       ?       ? 
1 1 1   51    2   50 o     34.0   14.6    0.0000   0.0000          ?        ?     0.0000  17.8786          ?        ?       34.0       14.6       ?       ? 
1 1 1   51    2   51 o    156.1    5.7    0.0000   0.0000          ?        ?   245.1923  17.8786          ?        ?      156.1        5.7       ?       ? 
1 1 1   51    3    0 o    188.4    5.6  356.2951  21.0712   356.2951  21.0712   356.2951  21.0712      188.4      5.6      188.4        5.6     0.0     0.0 
1 1 1   51    3    1 o    582.8    3.2    0.0000   0.0000          ?        ?  3398.2122  37.6728          ?        ?      582.8        3.2       ?       ? 
1 1 1   51    3    2 o    188.7    3.7    0.0000   0.0000          ?        ?   356.2951  14.0475          ?        ?      188.7        3.7       ?       ? 
1 1 1   51    3    3 o    281.4    2.9    0.0000   0.0000          ?        ?   792.4053  16.6016          ?        ?      281.4        2.9       ?       ? 
1 1 1   51    3    4 o    167.0    4.0    0.0000   0.0000          ?        ?   279.0340  13.4090          ?        ?      167.0        4.0       ?       ? 
1 1 1   51    3    5 o     26.1   11.6    0.0000   0.0000          ?        ?    -4.4697  12.1319          ?        ?       26.1       11.6       ?       ? 
1 1 1   51    3    6 o    345.0    2.8    0.0000   0.0000          ?        ?  1190.8428  19.1556          ?        ?      345.0        2.8       ?       ? 
1 1 1   51    3    7 o    345.2    2.8    0.0000   0.0000          ?        ?  1192.1199  19.1556          ?        ?      345.2        2.8       ?       ? 
1 1 1   51    3    8 o    148.6    4.3    0.0000   0.0000          ?        ?   220.9285  12.7704          ?        ?      148.6        4.3       ?       ? 
1 1 1   51    3    9 o     79.4    7.2    0.0000   0.0000          ?        ?    63.2136  11.4934          ?        ?       79.4        7.2       ?       ? 
1 1 1   51    3   10 o     79.4    8.0    0.0000   0.0000          ?        ?    63.2136  12.7704          ?        ?       79.4        8.0       ?       ? 
1 1 1   51    3   11 o    163.7    4.3    0.0000   0.0000          ?        ?   268.1791  14.0475          ?        ?      163.7        4.3       ?       ? 
1 1 1   51    3   12 o    331.0    2.6    0.0000   0.0000          ?        ?  1095.7031  17.2401          ?        ?      331.0        2.6       ?       ? 
1 1 1   51    3   13 o    148.4    4.3    0.0000   0.0000          ?        ?   220.2900  12.7704          ?        ?      148.4        4.3       ?       ? 
1 1 1   51    3   14 o    157.5    4.5    0.0000   0.0000          ?        ?   248.3849  14.0475          ?        ?      157.5        4.5       ?       ? 
1 1 1   51    3   15 o    319.3    2.9    0.0000   0.0000          ?        ?  1019.7190  18.5171          ?        ?      319.3        2.9       ?       ? 
1 1 1   51    3   16 o    224.0    3.1    0.0000   0.0000          ?        ?   501.8780  14.0475          ?        ?      224.0        3.1       ?       ? 
1 1 1   51    3   17 o     60.7   11.5    0.0000   0.0000          ?        ?    38.3113  13.4090          ?        ?       60.7       11.5       ?       ? 
1 1 1   51    3   18 o    379.8    2.7    0.0000   0.0000          ?        ?  1443.0588  20.4327          ?        ?      379.8        2.7       ?       ? 
1 1 1   51    3   19 o    154.0    4.4    0.0000   0.0000          ?        ?   237.5300  13.4090          ?        ?      154.0        4.4       ?       ? 
1 1 1   51    3   20 o    229.6    3.5    0.0000   0.0000          ?        ?   527.4188  15.9630          ?        ?      229.6        3.5       ?       ? 
1 1 1   51    3   21 o    292.2    3.1    0.0000   0.0000          ?        ?   854.3420  17.8786          ?        ?      292.2        3.1       ?       ? 
1 1 1   51    3   22 o    447.9    2.8    0.0000   0.0000          ?        ?  2006.8734  24.9023          ?        ?      447.9        2.8       ?       ? 
1 1 1   51    3   23 f    375.8    2.5    0.0000   0.0000          ?        ?  1413.0483  19.1556          ?        ?      375.8        2.5       ?       ? 
1 1 1   51    3   24 o    411.6    2.6    0.0000   0.0000          ?        ?  1694.6364  21.0712          ?        ?      411.6        2.6       ?       ? 
1 1 1   51    3   25 o    235.1    3.3    0.0000   0.0000          ?        ?   552.9597  15.3245          ?        ?      235.1        3.3       ?       ? 
1 1 1   51    3   26 o    349.3    2.7    0.0000   0.0000          ?        ?  1220.8533  19.1556          ?        ?      349.3        2.7       ?       ? 
1 1 1   51    3   27 o    103.1    6.8    0.0000   0.0000          ?        ?   106.6331  14.0475          ?        ?      103.1        6.8       ?       ? 
1 1 1   51    3   28 f    230.3    3.5    0.0000   0.0000          ?        ?   530.6115  15.9630          ?        ?      230.3        3.5       ?       ? 
1 1 1   51    3   29 o    202.7    3.9    0.0000   0.0000          ?        ?   411.2079  15.9630          ?        ?      202.7        3.9       ?       ? 
1 1 1   51    3   30 o    298.0    3.0    0.0000   0.0000          ?        ?   888.8221  17.8786          ?        ?      298.0        3.0       ?       ? 
1 1 1   51    3   31 o    156.9    4.9    0.0000   0.0000          ?        ?   246.4693  15.3245          ?        ?      156.9        4.9       ?       ? 
1 1 1   51    3   32 o    161.7    4.7    0.0000   0.0000          ?        ?   261.7939  15.3245          ?        ?      161.7        4.7       ?       ? 
1 1 1   51    3   33 o     23.1   11.2    0.0000   0.0000          ?        ?   -26.1794  15.9630          ?        ?       23.1       11.2       ?       ? 
1 1 1   51    3   34 o    189.3    4.4    0.0000   0.0000          ?        ?   358.8492  16.6016          ?        ?      189.3        4.4       ?       ? 
1 1 1   51    3   35 o    269.1    3.2    0.0000   0.0000          ?        ?   724.7220  17.2401          ?        ?      269.1        3.2       ?       ? 
1 1 1   51    3   36 o    142.1    5.4    0.0000   0.0000          ?        ?   202.4114  15.3245          ?        ?      142.1        5.4       ?       ? 
1 1 1   51    3   37 o    188.4    4.7    0.0000   0.0000          ?        ?   355.6566  17.8786          ?        ?      188.4        4.7       ?       ? 
1 1 1   51    3   38 o     24.7   11.8    0.0000   0.0000          ?        ?   -22.9868  16.6016          ?        ?       24.7       11.8       ?       ? 
1 1 1   51    3   39 o    142.3    5.8    0.0000   0.0000          ?        ?   203.0499  16.6016          ?        ?      142.3        5.8       ?       ? 
1 1 1   51    3   40 o    202.6    4.4    0.0000   0.0000          ?        ?   411.2079  17.8786          ?        ?      202.6        4.4       ?       ? 
1 1 1   51    3   41 o    188.9    4.6    0.0000   0.0000          ?        ?   357.5721  17.2401          ?        ?      188.9        4.6       ?       ? 
1 1 1   51    3   42 o    177.7    4.9    0.0000   0.0000          ?        ?   316.7067  17.2401          ?        ?      177.7        4.9       ?       ? 
1 1 1   51    3   43 o    316.3    3.2    0.0000   0.0000          ?        ?  1001.8404  20.4327          ?        ?      316.3        3.2       ?       ? 
1 1 1   51    3   44 o    270.5    3.7    0.0000   0.0000          ?        ?   733.0228  19.7942          ?        ?      270.5        3.7       ?       ? 
1 1 1   51    3   45 o     73.0   11.8    0.0000   0.0000          ?        ?    54.2743  17.2401          ?        ?       73.0       11.8       ?       ? 
1 1 1   51    3   46 o    152.7    5.4    0.0000   0.0000          ?        ?   234.3374  16.6016          ?        ?      152.7        5.4       ?       ? 
1 1 1   51    3   47 o    102.0    8.8    0.0000   0.0000          ?        ?   105.3561  17.8786          ?        ?      102.0        8.8       ?       ? 
1 1 1   51    3   48 o    169.1    5.5    0.0000   0.0000          ?        ?   287.3347  18.5171          ?        ?      169.1        5.5       ?       ? 
1 1 1   51    3   49 o    111.0    7.8    0.0000   0.0000          ?        ?   124.5117  17.2401          ?        ?      111.0        7.8       ?       ? 
1 1 1   51    3   50 o     94.4    9.5    0.0000   0.0000          ?        ?    90.6701  17.8786          ?        ?       94.4        9.5       ?       ? 
1 1 1   51    4    0 f    686.2    4.4 4711.6514  60.0210  4711.6514  60.0210  4711.6514  60.0210      686.2      4.4      686.2        4.4     0.0     0.0 
1 1 1   51    4    1 o    445.5    2.8    0.0000   0.0000          ?        ?  1985.1637  24.9023          ?        ?      445.5        2.8       ?       ? 
1 1 1   51    4    2 o    343.2    2.8    0.0000   0.0000          ?        ?  1178.0724  19.1556          ?        ?      343.2        2.8       ?       ? 
1 1 1   51    4    3 o    216.4    3.2    0.0000   0.0000          ?        ?   468.6749  14.0475          ?        ?      216.4        3.2       ?       ? 
1 1 1   51    4    4 o    289.5    3.0    0.0000   0.0000          ?        ?   838.3789  17.2401          ?        ?      289.5        3.0       ?       ? 
1 1 1   51    4    5 o    358.0    2.8    0.0000   0.0000          ?        ?  1282.1515  19.7942          ?        ?      358.0        2.8       ?       ? 
1 1 1   51    4    6 o    185.6    3.6    0.0000   0.0000          ?        ?   344.8017  13.4090          ?        ?      185.6        3.6       ?       ? 
1 1 1   51    4    7 o    367.6    2.9    0.0000   0.0000          ?        ?  1351.7502  21.0712          ?        ?      367.6        2.9       ?       ? 
1 1 1   51    4    8 o    200.3    3.5    0.0000   0.0000          ?        ?   401.6301  14.0475          ?        ?      200.3        3.5       ?       ? 
1 1 1   51    4    9 o    427.9    2.7    0.0000   0.0000          ?        ?  1831.2799  22.9868          ?        ?      427.9        2.7       ?       ? 
1 1 1   51    4   10 o    225.5    3.3    0.0000   0.0000          ?        ?   508.9017  14.6860          ?        ?      225.5        3.3       ?       ? 
1 1 1   51    4   11 o    201.0    3.7    0.0000   0.0000          ?        ?   404.1842  14.6860          ?        ?      201.0        3.7       ?       ? 
1 1 1   51    4   12 o    410.0    2.6    0.0000   0.0000          ?        ?  1681.2274  21.7097          ?        ?      410.0        2.6       ?       ? 
1 1 1   51    4   13 o    263.9    3.1    0.0000   0.0000          ?        ?   696.6271  16.6016          ?        ?      263.9        3.1       ?       ? 
1 1 1   51    4   14 o    311.2    2.9    0.0000   0.0000          ?        ?   968.6373  17.8786          ?        ?      311.2        2.9       ?       ? 
1 1 1   51    4   15 o    270.4    2.8    0.0000   0.0000          ?        ?   731.7458  15.3245          ?        ?      270.4        2.8       ?       ? 
1 1 1   51    4   16 o    322.2    2.7    0.0000   0.0000          ?        ?  1038.2362  17.2401          ?        ?      322.2        2.7       ?       ? 
1 1 1   51    4   17 o    137.1    5.4    0.0000   0.0000          ?        ?   188.3639  14.6860          ?        ?      137.1        5.4       ?       ? 
1 1 1   51    4   18 o    177.0    4.3    0.0000   0.0000          ?        ?   313.5141  15.3245          ?        ?      177.0        4.3       ?       ? 
1 1 1   51    4   19 o     16.4    8.3    0.0000   0.0000          ?        ?   -46.6121  13.4090          ?        ?       16.4        8.3       ?       ? 
1 1 1   51    4   20 o     84.4    7.9    0.0000   0.0000          ?        ?    71.5144  13.4090          ?        ?       84.4        7.9       ?       ? 
1 1 1   51    4   21 f    238.1    3.1    0.0000   0.0000          ?        ?   567.0072  14.6860          ?        ?      238.1        3.1       ?       ? 
1 1 1   51    4   22 o    216.7    3.7    0.0000   0.0000          ?        ?   469.9519  15.9630          ?        ?      216.7        3.7       ?       ? 
1 1 1   51    4   23 o    575.8    2.7    0.0000   0.0000          ?        ?  3317.1199  30.6490          ?        ?      575.8        2.7       ?       ? 
1 1 1   51    4   24 o    211.2    3.6    0.0000   0.0000          ?        ?   446.3266  15.3245          ?        ?      211.2        3.6       ?       ? 
1 1 1   51    4   25 o    290.9    2.9    0.0000   0.0000          ?        ?   846.6797  16.6016          ?        ?      290.9        2.9       ?       ? 
1 1 1   51    4   26 o    251.8    3.2    0.0000   0.0000          ?        ?   634.6905  15.9630          ?        ?      251.8        3.2       ?       ? 
1 1 1   51    4   27 o    272.3    3.0    0.0000   0.0000          ?        ?   741.9621  16.6016          ?        ?      272.3        3.0       ?       ? 
1 1 1   51    4   28 f    217.6    3.7    0.0000   0.0000          ?        ?   473.7830  15.9630          ?        ?      217.6        3.7       ?       ? 
1 1 1   51    4   29 f    217.4    3.7    0.0000   0.0000          ?        ?   473.1445  15.9630          ?        ?      217.4        3.7       ?       ? 
1 1 1   51    4   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51    4   31 o    239.5    3.3    0.0000   0.0000          ?        ?   574.0309  15.9630          ?        ?      239.5        3.3       ?       ? 
1 1 1   51    4   32 o     22.5   11.0    0.0000   0.0000          ?        ?   -28.7335  15.9630          ?        ?       22.5       11.0       ?       ? 
1 1 1   51    4   33 o    200.1    4.0    0.0000   0.0000          ?        ?   400.9916  15.9630          ?        ?      200.1        4.0       ?       ? 
1 1 1   51    4   34 o    354.0    2.8    0.0000   0.0000          ?        ?  1254.0564  19.7942          ?        ?      354.0        2.8       ?       ? 
1 1 1   51    4   35 o     47.4   15.4    0.0000   0.0000          ?        ?    22.3483  16.6016          ?        ?       47.4       15.4       ?       ? 
1 1 1   51    4   36 o     86.1    9.3    0.0000   0.0000          ?        ?    74.7070  15.9630          ?        ?       86.1        9.3       ?       ? 
1 1 1   51    4   37 o     42.3   15.3    0.0000   0.0000          ?        ?    15.3245  16.6016          ?        ?       42.3       15.3       ?       ? 
1 1 1   51    4   38 o    243.8    3.8    0.0000   0.0000          ?        ?   595.1021  18.5171          ?        ?      243.8        3.8       ?       ? 
1 1 1   51    4   39 o    422.6    2.7    0.0000   0.0000          ?        ?  1787.2220  22.9868          ?        ?      422.6        2.7       ?       ? 
1 1 1   51    4   40 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51    4   41 o    156.5    5.3    0.0000   0.0000          ?        ?   245.8308  16.6016          ?        ?      156.5        5.3       ?       ? 
1 1 1   51    4   42 o    103.7    8.3    0.0000   0.0000          ?        ?   108.5487  17.2401          ?        ?      103.7        8.3       ?       ? 
1 1 1   51    4   43 o     22.0   10.8    0.0000   0.0000          ?        ?   -33.8416  16.6016          ?        ?       22.0       10.8       ?       ? 
1 1 1   51    4   44 o    161.1    5.4    0.0000   0.0000          ?        ?   260.5168  17.2401          ?        ?      161.1        5.4       ?       ? 
1 1 1   51    4   45 o    210.5    4.2    0.0000   0.0000          ?        ?   444.4110  17.8786          ?        ?      210.5        4.2       ?       ? 
1 1 1   51    4   46 o    199.1    4.7    0.0000   0.0000          ?        ?   397.7990  18.5171          ?        ?      199.1        4.7       ?       ? 
1 1 1   51    4   47 o    110.1    7.8    0.0000   0.0000          ?        ?   122.5962  17.2401          ?        ?      110.1        7.8       ?       ? 
1 1 1   51    4   48 f     79.9   10.4    0.0000   0.0000          ?        ?    65.1292  16.6016          ?        ?       79.9       10.4       ?       ? 
1 1 1   51    4   49 o    174.3    4.9    0.0000   0.0000          ?        ?   305.2133  17.2401          ?        ?      174.3        4.9       ?       ? 
1 1 1   51    5    0 o    582.2    4.6 3392.4653  53.6358  3392.4653  53.6358  3392.4653  53.6358      582.2      4.6      582.2        4.6     0.0     0.0 
1 1 1   51    5    1 o    108.3    5.9    0.0000   0.0000          ?        ?   117.4880  12.7704          ?        ?      108.3        5.9       ?       ? 
1 1 1   51    5    2 o    159.7    4.2    0.0000   0.0000          ?        ?   255.4086  13.4090          ?        ?      159.7        4.2       ?       ? 
1 1 1   51    5    3 o    142.4    4.5    0.0000   0.0000          ?        ?   203.0499  12.7704          ?        ?      142.4        4.5       ?       ? 
1 1 1   51    5    4 o    573.0    3.2    0.0000   0.0000          ?        ?  3284.5554  37.0343          ?        ?      573.0        3.2       ?       ? 
1 1 1   51    5    5 o    327.2    2.6    0.0000   0.0000          ?        ?  1070.8008  17.2401          ?        ?      327.2        2.6       ?       ? 
1 1 1   51    5    6 o    219.1    3.5    0.0000   0.0000          ?        ?   480.1682  15.3245          ?        ?      219.1        3.5       ?       ? 
1 1 1   51    5    7 o    253.7    3.4    0.0000   0.0000          ?        ?   644.2683  17.2401          ?        ?      253.7        3.4       ?       ? 
1 1 1   51    5    8 o    481.9    2.8    0.0000   0.0000          ?        ?  2322.9417  27.4564          ?        ?      481.9        2.8       ?       ? 
1 1 1   51    5    9 o    220.2    3.5    0.0000   0.0000          ?        ?   485.2764  15.3245          ?        ?      220.2        3.5       ?       ? 
1 1 1   51    5   10 o     17.5    8.7    0.0000   0.0000          ?        ?   -31.2876  12.1319          ?        ?       17.5        8.7       ?       ? 
1 1 1   51    5   11 o    203.7    3.4    0.0000   0.0000          ?        ?   415.0391  14.0475          ?        ?      203.7        3.4       ?       ? 
1 1 1   51    5   12 o    307.9    3.1    0.0000   0.0000          ?        ?   948.8432  19.1556          ?        ?      307.9        3.1       ?       ? 
1 1 1   51    5   13 o    121.4    5.0    0.0000   0.0000          ?        ?   147.4985  12.1319          ?        ?      121.4        5.0       ?       ? 
1 1 1   51    5   14 o     23.3   11.0    0.0000   0.0000          ?        ?   -15.3245  13.4090          ?        ?       23.3       11.0       ?       ? 
1 1 1   51    5   15 o    338.0    3.0    0.0000   0.0000          ?        ?  1142.9537  20.4327          ?        ?      338.0        3.0       ?       ? 
1 1 1   51    5   16 f    159.5    4.4    0.0000   0.0000          ?        ?   254.7701  14.0475          ?        ?      159.5        4.4       ?       ? 
1 1 1   51    5   17 o    213.9    3.7    0.0000   0.0000          ?        ?   457.8200  15.9630          ?        ?      213.9        3.7       ?       ? 
1 1 1   51    5   18 o    435.6    2.6    0.0000   0.0000          ?        ?  1898.3247  22.9868          ?        ?      435.6        2.6       ?       ? 
1 1 1   51    5   19 o    103.1    6.5    0.0000   0.0000          ?        ?   106.6331  13.4090          ?        ?      103.1        6.5       ?       ? 
1 1 1   51    5   20 o    131.7    5.3    0.0000   0.0000          ?        ?   173.6779  14.0475          ?        ?      131.7        5.3       ?       ? 
1 1 1   51    5   21 o    361.6    2.6    0.0000   0.0000          ?        ?  1308.3308  18.5171          ?        ?      361.6        2.6       ?       ? 
1 1 1   51    5   22 o    335.5    2.8    0.0000   0.0000          ?        ?  1126.3521  18.5171          ?        ?      335.5        2.8       ?       ? 
1 1 1   51    5   23 f     54.0   12.6    0.0000   0.0000          ?        ?    30.6490  13.4090          ?        ?       54.0       12.6       ?       ? 
1 1 1   51    5   24 o    371.5    2.8    0.0000   0.0000          ?        ?  1380.4838  20.4327          ?        ?      371.5        2.8       ?       ? 
1 1 1   51    5   25 o    281.6    2.9    0.0000   0.0000          ?        ?   793.6824  16.6016          ?        ?      281.6        2.9       ?       ? 
1 1 1   51    5   26 o    273.0    3.0    0.0000   0.0000          ?        ?   745.7933  16.6016          ?        ?      273.0        3.0       ?       ? 
1 1 1   51    5   27 o    377.1    2.7    0.0000   0.0000          ?        ?  1422.6262  20.4327          ?        ?      377.1        2.7       ?       ? 
1 1 1   51    5   28 o    117.0    6.8    0.0000   0.0000          ?        ?   137.2822  15.9630          ?        ?      117.0        6.8       ?       ? 
1 1 1   51    5   29 o     47.0   14.7    0.0000   0.0000          ?        ?    22.3483  15.3245          ?        ?       47.0       14.7       ?       ? 
1 1 1   51    5   30 o    208.3    3.8    0.0000   0.0000          ?        ?   434.1947  15.9630          ?        ?      208.3        3.8       ?       ? 
1 1 1   51    5   31 o    157.6    5.1    0.0000   0.0000          ?        ?   249.0234  15.9630          ?        ?      157.6        5.1       ?       ? 
1 1 1   51    5   32 o     28.8   13.0    0.0000   0.0000          ?        ?    -8.3008  15.9630          ?        ?       28.8       13.0       ?       ? 
1 1 1   51    5   33 o    148.9    5.1    0.0000   0.0000          ?        ?   222.2055  15.3245          ?        ?      148.9        5.1       ?       ? 
1 1 1   51    5   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51    5   35 o     52.4   15.0    0.0000   0.0000          ?        ?    28.7335  16.6016          ?        ?       52.4       15.0       ?       ? 
1 1 1   51    5   36 o    318.5    2.9    0.0000   0.0000          ?        ?  1015.2494  18.5171          ?        ?      318.5        2.9       ?       ? 
1 1 1   51    5   37 o    201.8    4.3    0.0000   0.0000          ?        ?   408.0153  17.2401          ?        ?      201.8        4.3       ?       ? 
1 1 1   51    5   38 o    172.6    5.0    0.0000   0.0000          ?        ?   298.8281  17.2401          ?        ?      172.6        5.0       ?       ? 
1 1 1   51    5   39 o     62.0   14.2    0.0000   0.0000          ?        ?    40.8654  17.2401          ?        ?       62.0       14.2       ?       ? 
1 1 1   51    5   40 o    252.9    3.4    0.0000   0.0000          ?        ?   640.4372  17.2401          ?        ?      252.9        3.4       ?       ? 
1 1 1   51    5   41 o    206.7    4.3    0.0000   0.0000          ?        ?   428.4480  17.8786          ?        ?      206.7        4.3       ?       ? 
1 1 1   51    5   42 o    205.7    4.3    0.0000   0.0000          ?        ?   423.9784  17.8786          ?        ?      205.7        4.3       ?       ? 
1 1 1   51    5   43 o    215.2    4.3    0.0000   0.0000          ?        ?   464.2052  18.5171          ?        ?      215.2        4.3       ?       ? 
1 1 1   51    5   44 o    210.1    4.3    0.0000   0.0000          ?        ?   442.4955  17.8786          ?        ?      210.1        4.3       ?       ? 
1 1 1   51    5   45 o     22.0   10.8    0.0000   0.0000          ?        ?   -33.8416  16.6016          ?        ?       22.0       10.8       ?       ? 
1 1 1   51    5   46 o    100.7    8.9    0.0000   0.0000          ?        ?   102.8020  17.8786          ?        ?      100.7        8.9       ?       ? 
1 1 1   51    5   47 o     91.7    9.4    0.0000   0.0000          ?        ?    85.5619  17.2401          ?        ?       91.7        9.4       ?       ? 
1 1 1   51    5   48 o    163.9    5.3    0.0000   0.0000          ?        ?   270.0946  17.2401          ?        ?      163.9        5.3       ?       ? 
1 1 1   51    6    0 o    571.0    4.6 3263.4841  52.9973  3263.4841  52.9973  3263.4841  52.9973      571.0      4.6      571.0        4.6     0.0     0.0 
1 1 1   51    6    1 o    445.9    2.8    0.0000   0.0000          ?        ?  1988.9949  24.9023          ?        ?      445.9        2.8       ?       ? 
1 1 1   51    6    2 o    295.0    2.7    0.0000   0.0000          ?        ?   870.3050  15.9630          ?        ?      295.0        2.7       ?       ? 
1 1 1   51    6    3 o    230.2    3.1    0.0000   0.0000          ?        ?   529.9730  14.0475          ?        ?      230.2        3.1       ?       ? 
1 1 1   51    6    4 o    222.8    3.2    0.0000   0.0000          ?        ?   496.7698  14.0475          ?        ?      222.8        3.2       ?       ? 
1 1 1   51    6    5 o    439.8    2.9    0.0000   0.0000          ?        ?  1934.7206  25.5409          ?        ?      439.8        2.9       ?       ? 
1 1 1   51    6    6 o    261.4    2.9    0.0000   0.0000          ?        ?   683.8566  15.3245          ?        ?      261.4        2.9       ?       ? 
1 1 1   51    6    7 o    392.4    2.8    0.0000   0.0000          ?        ?  1540.7527  22.3483          ?        ?      392.4        2.8       ?       ? 
1 1 1   51    6    8 o    117.6    5.7    0.0000   0.0000          ?        ?   138.5592  13.4090          ?        ?      117.6        5.7       ?       ? 
1 1 1   51    6    9 o    217.2    3.2    0.0000   0.0000          ?        ?   471.8675  14.0475          ?        ?      217.2        3.2       ?       ? 
1 1 1   51    6   10 o    285.6    2.9    0.0000   0.0000          ?        ?   816.0306  16.6016          ?        ?      285.6        2.9       ?       ? 
1 1 1   51    6   11 o    502.5    2.9    0.0000   0.0000          ?        ?  2526.6301  28.7335          ?        ?      502.5        2.9       ?       ? 
1 1 1   51    6   12 f    154.4    4.3    0.0000   0.0000          ?        ?   238.8071  13.4090          ?        ?      154.4        4.3       ?       ? 
1 1 1   51    6   13 o    346.5    2.9    0.0000   0.0000          ?        ?  1201.0592  19.7942          ?        ?      346.5        2.9       ?       ? 
1 1 1   51    6   14 o    345.0    3.1    0.0000   0.0000          ?        ?  1190.8428  21.7097          ?        ?      345.0        3.1       ?       ? 
1 1 1   51    6   15 o    168.1    4.2    0.0000   0.0000          ?        ?   282.8651  14.0475          ?        ?      168.1        4.2       ?       ? 
1 1 1   51    6   16 o     76.9    8.7    0.0000   0.0000          ?        ?    59.3825  13.4090          ?        ?       76.9        8.7       ?       ? 
1 1 1   51    6   17 o    184.7    4.0    0.0000   0.0000          ?        ?   341.6091  14.6860          ?        ?      184.7        4.0       ?       ? 
1 1 1   51    6   18 o    276.3    2.9    0.0000   0.0000          ?        ?   763.6719  15.9630          ?        ?      276.3        2.9       ?       ? 
1 1 1   51    6   19 o    136.9    4.9    0.0000   0.0000          ?        ?   187.7254  13.4090          ?        ?      136.9        4.9       ?       ? 
1 1 1   51    6   20 o    420.8    2.7    0.0000   0.0000          ?        ?  1771.2589  22.9868          ?        ?      420.8        2.7       ?       ? 
1 1 1   51    6   21 o    208.6    3.5    0.0000   0.0000          ?        ?   435.4717  14.6860          ?        ?      208.6        3.5       ?       ? 
1 1 1   51    6   22 o    141.0    5.0    0.0000   0.0000          ?        ?   199.2188  14.0475          ?        ?      141.0        5.0       ?       ? 
1 1 1   51    6   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51    6   24 o     55.1   13.4    0.0000   0.0000          ?        ?    31.9261  14.6860          ?        ?       55.1       13.4       ?       ? 
1 1 1   51    6   25 o    580.6    2.8    0.0000   0.0000          ?        ?  3373.3096  32.5646          ?        ?      580.6        2.8       ?       ? 
1 1 1   51    6   26 o    214.6    3.7    0.0000   0.0000          ?        ?   461.0126  15.9630          ?        ?      214.6        3.7       ?       ? 
1 1 1   51    6   27 o    211.9    3.8    0.0000   0.0000          ?        ?   449.5192  15.9630          ?        ?      211.9        3.8       ?       ? 
1 1 1   51    6   28 f    146.5    5.2    0.0000   0.0000          ?        ?   215.1818  15.3245          ?        ?      146.5        5.2       ?       ? 
1 1 1   51    6   29 o    422.9    2.6    0.0000   0.0000          ?        ?  1789.1377  22.3483          ?        ?      422.9        2.6       ?       ? 
1 1 1   51    6   30 o    194.5    4.1    0.0000   0.0000          ?        ?   378.6433  15.9630          ?        ?      194.5        4.1       ?       ? 
1 1 1   51    6   31 o    342.5    3.0    0.0000   0.0000          ?        ?  1173.6028  20.4327          ?        ?      342.5        3.0       ?       ? 
1 1 1   51    6   32 o     18.5    9.3    0.0000   0.0000          ?        ?   -45.9736  15.3245          ?        ?       18.5        9.3       ?       ? 
1 1 1   51    6   33 f    298.0    3.0    0.0000   0.0000          ?        ?   888.8221  17.8786          ?        ?      298.0        3.0       ?       ? 
1 1 1   51    6   34 o     29.3   13.1    0.0000   0.0000          ?        ?    -7.0237  15.9630          ?        ?       29.3       13.1       ?       ? 
1 1 1   51    6   35 o    216.8    4.0    0.0000   0.0000          ?        ?   470.5904  17.2401          ?        ?      216.8        4.0       ?       ? 
1 1 1   51    6   36 o    126.8    6.3    0.0000   0.0000          ?        ?   161.5460  15.9630          ?        ?      126.8        6.3       ?       ? 
1 1 1   51    6   37 o     66.6   12.9    0.0000   0.0000          ?        ?    46.6121  16.6016          ?        ?       66.6       12.9       ?       ? 
1 1 1   51    6   38 o     37.1   14.6    0.0000   0.0000          ?        ?     8.3008  15.9630          ?        ?       37.1       14.6       ?       ? 
1 1 1   51    6   39 o    245.7    3.5    0.0000   0.0000          ?        ?   604.6799  17.2401          ?        ?      245.7        3.5       ?       ? 
1 1 1   51    6   40 o    172.8    4.8    0.0000   0.0000          ?        ?   299.4666  16.6016          ?        ?      172.8        4.8       ?       ? 
1 1 1   51    6   41 o     83.6    9.9    0.0000   0.0000          ?        ?    70.8759  16.6016          ?        ?       83.6        9.9       ?       ? 
1 1 1   51    6   42 o    311.2    3.3    0.0000   0.0000          ?        ?   969.9143  20.4327          ?        ?      311.2        3.3       ?       ? 
1 1 1   51    6   43 o     45.9   15.7    0.0000   0.0000          ?        ?    20.4327  17.2401          ?        ?       45.9       15.7       ?       ? 
1 1 1   51    6   44 o    162.6    5.3    0.0000   0.0000          ?        ?   265.6250  17.2401          ?        ?      162.6        5.3       ?       ? 
1 1 1   51    6   45 o    186.5    4.8    0.0000   0.0000          ?        ?   349.2713  17.8786          ?        ?      186.5        4.8       ?       ? 
1 1 1   51    6   46 o    183.4    4.9    0.0000   0.0000          ?        ?   337.7780  17.8786          ?        ?      183.4        4.9       ?       ? 
1 1 1   51    6   47 o     45.2   15.6    0.0000   0.0000          ?        ?    19.7942  17.2401          ?        ?       45.2       15.6       ?       ? 
1 1 1   51    7    0 o    203.6    5.0  415.6776  20.4327   415.6776  20.4327   415.6776  20.4327      203.6      5.0      203.6        5.0     0.0     0.0 
1 1 1   51    7    1 o    178.6    3.9    0.0000   0.0000          ?        ?   319.2608  14.0475          ?        ?      178.6        3.9       ?       ? 
1 1 1   51    7    2 o    166.0    3.8    0.0000   0.0000          ?        ?   275.8413  12.7704          ?        ?      166.0        3.8       ?       ? 
1 1 1   51    7    3 f    332.4    3.2    0.0000   0.0000          ?        ?  1105.2810  21.0712          ?        ?      332.4        3.2       ?       ? 
1 1 1   51    7    4 o    127.5    5.0    0.0000   0.0000          ?        ?   162.8230  12.7704          ?        ?      127.5        5.0       ?       ? 
1 1 1   51    7    5 o    253.8    3.1    0.0000   0.0000          ?        ?   644.2683  15.9630          ?        ?      253.8        3.1       ?       ? 
1 1 1   51    7    6 o     68.1    8.9    0.0000   0.0000          ?        ?    46.6121  12.1319          ?        ?       68.1        8.9       ?       ? 
1 1 1   51    7    7 o    410.4    3.0    0.0000   0.0000          ?        ?  1685.0586  24.9023          ?        ?      410.4        3.0       ?       ? 
1 1 1   51    7    8 o    340.7    3.0    0.0000   0.0000          ?        ?  1161.4708  20.4327          ?        ?      340.7        3.0       ?       ? 
1 1 1   51    7    9 o    364.5    2.6    0.0000   0.0000          ?        ?  1329.4020  19.1556          ?        ?      364.5        2.6       ?       ? 
1 1 1   51    7   10 o    399.3    2.9    0.0000   0.0000          ?        ?  1595.0271  22.9868          ?        ?      399.3        2.9       ?       ? 
1 1 1   51    7   11 o     57.5   11.5    0.0000   0.0000          ?        ?    34.4802  12.7704          ?        ?       57.5       11.5       ?       ? 
1 1 1   51    7   12 o    133.8    5.0    0.0000   0.0000          ?        ?   179.4246  13.4090          ?        ?      133.8        5.0       ?       ? 
1 1 1   51    7   13 o    516.6    2.9    0.0000   0.0000          ?        ?  2670.2976  30.0105          ?        ?      516.6        2.9       ?       ? 
1 1 1   51    7   14 o    237.6    3.4    0.0000   0.0000          ?        ?   565.0916  15.9630          ?        ?      237.6        3.4       ?       ? 
1 1 1   51    7   15 o    345.8    2.9    0.0000   0.0000          ?        ?  1196.5895  19.7942          ?        ?      345.8        2.9       ?       ? 
1 1 1   51    7   16 o    348.1    2.8    0.0000   0.0000          ?        ?  1212.5525  19.7942          ?        ?      348.1        2.8       ?       ? 
1 1 1   51    7   17 o    229.1    3.6    0.0000   0.0000          ?        ?   525.5033  16.6016          ?        ?      229.1        3.6       ?       ? 
1 1 1   51    7   18 o    283.3    2.9    0.0000   0.0000          ?        ?   803.2603  16.6016          ?        ?      283.3        2.9       ?       ? 
1 1 1   51    7   19 o    258.9    3.1    0.0000   0.0000          ?        ?   670.4477  15.9630          ?        ?      258.9        3.1       ?       ? 
1 1 1   51    7   20 o    265.7    3.0    0.0000   0.0000          ?        ?   706.2049  15.9630          ?        ?      265.7        3.0       ?       ? 
1 1 1   51    7   21 o    220.5    3.5    0.0000   0.0000          ?        ?   486.5535  15.3245          ?        ?      220.5        3.5       ?       ? 
1 1 1   51    7   22 o    173.1    4.2    0.0000   0.0000          ?        ?   300.1052  14.6860          ?        ?      173.1        4.2       ?       ? 
1 1 1   51    7   23 o    249.8    3.3    0.0000   0.0000          ?        ?   624.4742  16.6016          ?        ?      249.8        3.3       ?       ? 
1 1 1   51    7   24 o    142.8    5.4    0.0000   0.0000          ?        ?   204.3269  15.3245          ?        ?      142.8        5.4       ?       ? 
1 1 1   51    7   25 o    364.6    2.7    0.0000   0.0000          ?        ?  1330.0405  19.7942          ?        ?      364.6        2.7       ?       ? 
1 1 1   51    7   26 o     72.5    9.7    0.0000   0.0000          ?        ?    52.9973  14.0475          ?        ?       72.5        9.7       ?       ? 
1 1 1   51    7   27 o    389.1    2.6    0.0000   0.0000          ?        ?  1514.5732  20.4327          ?        ?      389.1        2.6       ?       ? 
1 1 1   51    7   28 f    175.1    4.4    0.0000   0.0000          ?        ?   307.1289  15.3245          ?        ?      175.1        4.4       ?       ? 
1 1 1   51    7   29 f    160.0    5.0    0.0000   0.0000          ?        ?   256.6857  15.9630          ?        ?      160.0        5.0       ?       ? 
1 1 1   51    7   30 o     78.8   10.1    0.0000   0.0000          ?        ?    62.5751  15.9630          ?        ?       78.8       10.1       ?       ? 
1 1 1   51    7   31 o    303.0    3.1    0.0000   0.0000          ?        ?   918.8326  18.5171          ?        ?      303.0        3.1       ?       ? 
1 1 1   51    7   32 o    271.2    3.4    0.0000   0.0000          ?        ?   736.2155  18.5171          ?        ?      271.2        3.4       ?       ? 
1 1 1   51    7   33 o     63.7   13.5    0.0000   0.0000          ?        ?    42.7809  16.6016          ?        ?       63.7       13.5       ?       ? 
1 1 1   51    7   34 f    203.9    4.2    0.0000   0.0000          ?        ?   416.3161  17.2401          ?        ?      203.9        4.2       ?       ? 
1 1 1   51    7   35 o     19.1    9.6    0.0000   0.0000          ?        ?   -46.6121  15.9630          ?        ?       19.1        9.6       ?       ? 
1 1 1   51    7   36 o     40.5   14.9    0.0000   0.0000          ?        ?    13.4090  15.9630          ?        ?       40.5       14.9       ?       ? 
1 1 1   51    7   37 o    286.9    3.2    0.0000   0.0000          ?        ?   824.3315  18.5171          ?        ?      286.9        3.2       ?       ? 
1 1 1   51    7   38 o     57.4   14.5    0.0000   0.0000          ?        ?    35.1187  16.6016          ?        ?       57.4       14.5       ?       ? 
1 1 1   51    7   39 o    109.7    8.2    0.0000   0.0000          ?        ?   121.3191  17.8786          ?        ?      109.7        8.2       ?       ? 
1 1 1   51    7   40 o     25.6   12.0    0.0000   0.0000          ?        ?   -14.6860  15.3245          ?        ?       25.6       12.0       ?       ? 
1 1 1   51    7   41 o    191.9    4.3    0.0000   0.0000          ?        ?   369.0655  16.6016          ?        ?      191.9        4.3       ?       ? 
1 1 1   51    7   42 o    278.3    3.3    0.0000   0.0000          ?        ?   775.8038  18.5171          ?        ?      278.3        3.3       ?       ? 
1 1 1   51    7   43 o    150.6    5.7    0.0000   0.0000          ?        ?   227.9522  17.2401          ?        ?      150.6        5.7       ?       ? 
1 1 1   51    7   44 o    174.3    4.9    0.0000   0.0000          ?        ?   305.2133  17.2401          ?        ?      174.3        4.9       ?       ? 
1 1 1   51    7   45 f     26.5   12.4    0.0000   0.0000          ?        ?   -15.9630  16.6016          ?        ?       26.5       12.4       ?       ? 
1 1 1   51    7   46 o     24.3   11.6    0.0000   0.0000          ?        ?   -21.0712  15.9630          ?        ?       24.3       11.6       ?       ? 
1 1 1   51    8    0 o     79.8   10.3   67.0448  15.9630    67.0448  15.9630    67.0448  15.9630       79.8     10.3       79.8       10.3     0.0     0.0 
1 1 1   51    8    1 o    254.5    2.9    0.0000   0.0000          ?        ?   648.0994  14.6860          ?        ?      254.5        2.9       ?       ? 
1 1 1   51    8    2 o    298.7    2.9    0.0000   0.0000          ?        ?   892.6533  17.2401          ?        ?      298.7        2.9       ?       ? 
1 1 1   51    8    3 o    406.2    2.9    0.0000   0.0000          ?        ?  1651.2169  23.6253          ?        ?      406.2        2.9       ?       ? 
1 1 1   51    8    4 f    136.7    4.4    0.0000   0.0000          ?        ?   187.0868  12.1319          ?        ?      136.7        4.4       ?       ? 
1 1 1   51    8    5 o     63.7   10.0    0.0000   0.0000          ?        ?    40.8654  12.7704          ?        ?       63.7       10.0       ?       ? 
1 1 1   51    8    6 o    295.7    2.9    0.0000   0.0000          ?        ?   874.7747  17.2401          ?        ?      295.7        2.9       ?       ? 
1 1 1   51    8    7 o    291.2    2.9    0.0000   0.0000          ?        ?   848.5952  16.6016          ?        ?      291.2        2.9       ?       ? 
1 1 1   51    8    8 o    343.8    3.2    0.0000   0.0000          ?        ?  1182.5420  21.7097          ?        ?      343.8        3.2       ?       ? 
1 1 1   51    8    9 o    230.6    3.3    0.0000   0.0000          ?        ?   531.8885  15.3245          ?        ?      230.6        3.3       ?       ? 
1 1 1   51    8   10 o    276.8    3.1    0.0000   0.0000          ?        ?   766.8644  17.2401          ?        ?      276.8        3.1       ?       ? 
1 1 1   51    8   11 o     82.5    8.5    0.0000   0.0000          ?        ?    68.3218  14.0475          ?        ?       82.5        8.5       ?       ? 
1 1 1   51    8   12 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51    8   13 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51    8   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51    8   15 o    130.5    4.9    0.0000   0.0000          ?        ?   170.4853  12.7704          ?        ?      130.5        4.9       ?       ? 
1 1 1   51    8   16 o    110.6    6.4    0.0000   0.0000          ?        ?   122.5962  14.0475          ?        ?      110.6        6.4       ?       ? 
1 1 1   51    8   17 o    190.3    4.4    0.0000   0.0000          ?        ?   362.6803  16.6016          ?        ?      190.3        4.4       ?       ? 
1 1 1   51    8   18 o    353.4    2.9    0.0000   0.0000          ?        ?  1249.5868  20.4327          ?        ?      353.4        2.9       ?       ? 
1 1 1   51    8   19 o    436.1    2.6    0.0000   0.0000          ?        ?  1902.7944  22.3483          ?        ?      436.1        2.6       ?       ? 
1 1 1   51    8   20 o    293.8    2.9    0.0000   0.0000          ?        ?   863.9198  17.2401          ?        ?      293.8        2.9       ?       ? 
1 1 1   51    8   21 o     95.1    7.1    0.0000   0.0000          ?        ?    90.6701  13.4090          ?        ?       95.1        7.1       ?       ? 
1 1 1   51    8   22 o     73.0   10.1    0.0000   0.0000          ?        ?    53.6358  14.6860          ?        ?       73.0       10.1       ?       ? 
1 1 1   51    8   23 o    176.2    4.5    0.0000   0.0000          ?        ?   310.9600  15.9630          ?        ?      176.2        4.5       ?       ? 
1 1 1   51    8   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51    8   25 o    123.9    5.9    0.0000   0.0000          ?        ?   153.8837  14.6860          ?        ?      123.9        5.9       ?       ? 
1 1 1   51    8   26 o    217.8    3.7    0.0000   0.0000          ?        ?   475.0601  15.9630          ?        ?      217.8        3.7       ?       ? 
1 1 1   51    8   27 o    137.5    5.3    0.0000   0.0000          ?        ?   189.6409  14.6860          ?        ?      137.5        5.3       ?       ? 
1 1 1   51    8   28 o    238.1    3.4    0.0000   0.0000          ?        ?   567.6458  15.9630          ?        ?      238.1        3.4       ?       ? 
1 1 1   51    8   29 o    532.3    2.6    0.0000   0.0000          ?        ?  2835.6746  28.0950          ?        ?      532.3        2.6       ?       ? 
1 1 1   51    8   30 o    382.2    2.6    0.0000   0.0000          ?        ?  1461.5759  19.7942          ?        ?      382.2        2.6       ?       ? 
1 1 1   51    8   31 o    176.7    4.7    0.0000   0.0000          ?        ?   312.8756  16.6016          ?        ?      176.7        4.7       ?       ? 
1 1 1   51    8   32 o    104.2    7.4    0.0000   0.0000          ?        ?   109.1872  15.3245          ?        ?      104.2        7.4       ?       ? 
1 1 1   51    8   33 o     55.4   14.3    0.0000   0.0000          ?        ?    32.5646  15.9630          ?        ?       55.4       14.3       ?       ? 
1 1 1   51    8   34 f    158.0    4.8    0.0000   0.0000          ?        ?   250.3005  15.3245          ?        ?      158.0        4.8       ?       ? 
1 1 1   51    8   35 o    369.5    2.7    0.0000   0.0000          ?        ?  1366.4363  19.7942          ?        ?      369.5        2.7       ?       ? 
1 1 1   51    8   36 o    129.3    6.4    0.0000   0.0000          ?        ?   167.9312  16.6016          ?        ?      129.3        6.4       ?       ? 
1 1 1   51    8   37 o     18.5    9.3    0.0000   0.0000          ?        ?   -50.4432  15.9630          ?        ?       18.5        9.3       ?       ? 
1 1 1   51    8   38 o    180.2    4.8    0.0000   0.0000          ?        ?   325.6460  17.2401          ?        ?      180.2        4.8       ?       ? 
1 1 1   51    8   39 o     92.4    8.6    0.0000   0.0000          ?        ?    86.2004  15.9630          ?        ?       92.4        8.6       ?       ? 
1 1 1   51    8   40 o     63.9   13.4    0.0000   0.0000          ?        ?    43.4195  16.6016          ?        ?       63.9       13.4       ?       ? 
1 1 1   51    8   41 o     82.8   10.0    0.0000   0.0000          ?        ?    69.5989  16.6016          ?        ?       82.8       10.0       ?       ? 
1 1 1   51    8   42 o    172.9    5.0    0.0000   0.0000          ?        ?   300.1052  17.2401          ?        ?      172.9        5.0       ?       ? 
1 1 1   51    8   43 o    217.2    4.0    0.0000   0.0000          ?        ?   473.1445  17.2401          ?        ?      217.2        4.0       ?       ? 
1 1 1   51    8   44 o    151.2    5.5    0.0000   0.0000          ?        ?   229.8678  16.6016          ?        ?      151.2        5.5       ?       ? 
1 1 1   51    8   45 o    115.9    7.7    0.0000   0.0000          ?        ?   136.0051  17.8786          ?        ?      115.9        7.7       ?       ? 
1 1 1   51    9    0 o     18.6   13.0  -13.4090  16.6016   -13.4090  16.6016   -13.4090  16.6016       18.6     13.0       18.6       13.0     0.0     0.0 
1 1 1   51    9    1 o    292.1    2.7    0.0000   0.0000          ?        ?   853.7034  15.9630          ?        ?      292.1        2.7       ?       ? 
1 1 1   51    9    2 o    293.4    2.7    0.0000   0.0000          ?        ?   861.3657  15.9630          ?        ?      293.4        2.7       ?       ? 
1 1 1   51    9    3 o    309.5    2.8    0.0000   0.0000          ?        ?   958.4210  17.2401          ?        ?      309.5        2.8       ?       ? 
1 1 1   51    9    4 o    213.3    3.4    0.0000   0.0000          ?        ?   455.2659  14.6860          ?        ?      213.3        3.4       ?       ? 
1 1 1   51    9    5 o    243.0    2.9    0.0000   0.0000          ?        ?   590.6325  14.0475          ?        ?      243.0        2.9       ?       ? 
1 1 1   51    9    6 o    341.2    3.0    0.0000   0.0000          ?        ?  1164.6635  20.4327          ?        ?      341.2        3.0       ?       ? 
1 1 1   51    9    7 o    331.2    2.8    0.0000   0.0000          ?        ?  1097.6187  18.5171          ?        ?      331.2        2.8       ?       ? 
1 1 1   51    9    8 o    476.1    3.1    0.0000   0.0000          ?        ?  2268.0288  29.3720          ?        ?      476.1        3.1       ?       ? 
1 1 1   51    9    9 o    190.7    3.7    0.0000   0.0000          ?        ?   363.9573  14.0475          ?        ?      190.7        3.7       ?       ? 
1 1 1   51    9   10 o    251.2    3.2    0.0000   0.0000          ?        ?   631.4979  15.9630          ?        ?      251.2        3.2       ?       ? 
1 1 1   51    9   11 o     76.5    8.3    0.0000   0.0000          ?        ?    58.7440  12.7704          ?        ?       76.5        8.3       ?       ? 
1 1 1   51    9   12 o    133.6    5.3    0.0000   0.0000          ?        ?   178.7861  14.0475          ?        ?      133.6        5.3       ?       ? 
1 1 1   51    9   13 o    112.0    6.6    0.0000   0.0000          ?        ?   125.7888  14.6860          ?        ?      112.0        6.6       ?       ? 
1 1 1   51    9   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51    9   15 o    243.9    3.1    0.0000   0.0000          ?        ?   595.1021  15.3245          ?        ?      243.9        3.1       ?       ? 
1 1 1   51    9   16 o    302.6    3.3    0.0000   0.0000          ?        ?   916.2786  19.7942          ?        ?      302.6        3.3       ?       ? 
1 1 1   51    9   17 f    301.8    3.0    0.0000   0.0000          ?        ?   911.1703  17.8786          ?        ?      301.8        3.0       ?       ? 
1 1 1   51    9   18 o    368.9    2.9    0.0000   0.0000          ?        ?  1361.3281  21.7097          ?        ?      368.9        2.9       ?       ? 
1 1 1   51    9   19 o     33.2   13.5    0.0000   0.0000          ?        ?     4.4697  14.0475          ?        ?       33.2       13.5       ?       ? 
1 1 1   51    9   20 f    316.8    3.0    0.0000   0.0000          ?        ?  1004.3945  19.1556          ?        ?      316.8        3.0       ?       ? 
1 1 1   51    9   21 o     99.6    7.4    0.0000   0.0000          ?        ?    99.6094  14.6860          ?        ?       99.6        7.4       ?       ? 
1 1 1   51    9   22 o    231.8    3.3    0.0000   0.0000          ?        ?   537.6352  15.3245          ?        ?      231.8        3.3       ?       ? 
1 1 1   51    9   23 o    368.8    2.8    0.0000   0.0000          ?        ?  1360.6896  20.4327          ?        ?      368.8        2.8       ?       ? 
1 1 1   51    9   24 o     97.6    7.5    0.0000   0.0000          ?        ?    95.7782  14.6860          ?        ?       97.6        7.5       ?       ? 
1 1 1   51    9   25 o    104.9    6.7    0.0000   0.0000          ?        ?   110.4642  14.0475          ?        ?      104.9        6.7       ?       ? 
1 1 1   51    9   26 o     41.3   14.1    0.0000   0.0000          ?        ?    15.9630  14.0475          ?        ?       41.3       14.1       ?       ? 
1 1 1   51    9   27 o    213.7    3.6    0.0000   0.0000          ?        ?   457.1815  15.3245          ?        ?      213.7        3.6       ?       ? 
1 1 1   51    9   28 o    186.2    4.1    0.0000   0.0000          ?        ?   347.3558  15.3245          ?        ?      186.2        4.1       ?       ? 
1 1 1   51    9   29 o    234.9    3.4    0.0000   0.0000          ?        ?   552.3212  15.9630          ?        ?      234.9        3.4       ?       ? 
1 1 1   51    9   30 f    467.1    2.7    0.0000   0.0000          ?        ?  2183.1055  24.9023          ?        ?      467.1        2.7       ?       ? 
1 1 1   51    9   31 o    238.2    3.5    0.0000   0.0000          ?        ?   568.2842  16.6016          ?        ?      238.2        3.5       ?       ? 
1 1 1   51    9   32 o    249.5    3.5    0.0000   0.0000          ?        ?   623.1971  17.2401          ?        ?      249.5        3.5       ?       ? 
1 1 1   51    9   33 o    153.9    5.4    0.0000   0.0000          ?        ?   237.5300  16.6016          ?        ?      153.9        5.4       ?       ? 
1 1 1   51    9   34 o     21.3   10.5    0.0000   0.0000          ?        ?   -30.6490  15.3245          ?        ?       21.3       10.5       ?       ? 
1 1 1   51    9   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51    9   36 o    175.7    4.7    0.0000   0.0000          ?        ?   309.6830  16.6016          ?        ?      175.7        4.7       ?       ? 
1 1 1   51    9   37 o    220.6    3.9    0.0000   0.0000          ?        ?   487.8305  17.2401          ?        ?      220.6        3.9       ?       ? 
1 1 1   51    9   38 o    268.4    3.3    0.0000   0.0000          ?        ?   721.5294  17.8786          ?        ?      268.4        3.3       ?       ? 
1 1 1   51    9   39 o    124.2    6.7    0.0000   0.0000          ?        ?   155.1608  16.6016          ?        ?      124.2        6.7       ?       ? 
1 1 1   51    9   40 o    168.0    5.1    0.0000   0.0000          ?        ?   283.5036  17.2401          ?        ?      168.0        5.1       ?       ? 
1 1 1   51    9   41 o     54.1   14.9    0.0000   0.0000          ?        ?    31.2876  16.6016          ?        ?       54.1       14.9       ?       ? 
1 1 1   51    9   42 o    252.0    3.5    0.0000   0.0000          ?        ?   636.6060  17.8786          ?        ?      252.0        3.5       ?       ? 
1 1 1   51    9   43 o     20.9   10.4    0.0000   0.0000          ?        ?   -38.9498  16.6016          ?        ?       20.9       10.4       ?       ? 
1 1 1   51    9   44 o    119.8    7.2    0.0000   0.0000          ?        ?   144.9444  17.2401          ?        ?      119.8        7.2       ?       ? 
1 1 1   51   10    0 o    593.6    4.7 3526.5549  55.5514  3526.5549  55.5514  3526.5549  55.5514      593.6      4.7      593.6        4.7     0.0     0.0 
1 1 1   51   10    1 o    380.8    2.8    0.0000   0.0000          ?        ?  1450.7211  21.0712          ?        ?      380.8        2.8       ?       ? 
1 1 1   51   10    2 o    450.5    2.9    0.0000   0.0000          ?        ?  2030.4988  26.1794          ?        ?      450.5        2.9       ?       ? 
1 1 1   51   10    3 o     87.8    6.5    0.0000   0.0000          ?        ?    77.2611  11.4934          ?        ?       87.8        6.5       ?       ? 
1 1 1   51   10    4 o    148.6    4.3    0.0000   0.0000          ?        ?   220.9285  12.7704          ?        ?      148.6        4.3       ?       ? 
1 1 1   51   10    5 o    299.1    3.0    0.0000   0.0000          ?        ?   895.2073  17.8786          ?        ?      299.1        3.0       ?       ? 
1 1 1   51   10    6 o    270.8    2.8    0.0000   0.0000          ?        ?   733.6614  15.3245          ?        ?      270.8        2.8       ?       ? 
1 1 1   51   10    7 o    145.1    4.8    0.0000   0.0000          ?        ?   210.7121  14.0475          ?        ?      145.1        4.8       ?       ? 
1 1 1   51   10    8 o    271.1    3.3    0.0000   0.0000          ?        ?   735.5769  17.8786          ?        ?      271.1        3.3       ?       ? 
1 1 1   51   10    9 o    134.8    5.0    0.0000   0.0000          ?        ?   181.9787  13.4090          ?        ?      134.8        5.0       ?       ? 
1 1 1   51   10   10 o    118.2    5.1    0.0000   0.0000          ?        ?   139.8362  12.1319          ?        ?      118.2        5.1       ?       ? 
1 1 1   51   10   11 o    157.5    4.3    0.0000   0.0000          ?        ?   248.3849  13.4090          ?        ?      157.5        4.3       ?       ? 
1 1 1   51   10   12 o    254.4    3.1    0.0000   0.0000          ?        ?   647.4609  15.9630          ?        ?      254.4        3.1       ?       ? 
1 1 1   51   10   13 o    403.8    3.4    0.0000   0.0000          ?        ?  1631.4227  27.4564          ?        ?      403.8        3.4       ?       ? 
1 1 1   51   10   14 o    328.6    3.1    0.0000   0.0000          ?        ?  1080.3785  20.4327          ?        ?      328.6        3.1       ?       ? 
1 1 1   51   10   15 o    285.2    3.4    0.0000   0.0000          ?        ?   814.1151  19.1556          ?        ?      285.2        3.4       ?       ? 
1 1 1   51   10   16 o    144.8    4.6    0.0000   0.0000          ?        ?   210.0736  13.4090          ?        ?      144.8        4.6       ?       ? 
1 1 1   51   10   17 o    131.7    5.3    0.0000   0.0000          ?        ?   173.6779  14.0475          ?        ?      131.7        5.3       ?       ? 
1 1 1   51   10   18 f     59.0   11.8    0.0000   0.0000          ?        ?    36.3957  13.4090          ?        ?       59.0       11.8       ?       ? 
1 1 1   51   10   19 o     78.5    9.0    0.0000   0.0000          ?        ?    61.9366  14.0475          ?        ?       78.5        9.0       ?       ? 
1 1 1   51   10   20 o    175.0    4.0    0.0000   0.0000          ?        ?   306.4904  14.0475          ?        ?      175.0        4.0       ?       ? 
1 1 1   51   10   21 o    333.3    2.8    0.0000   0.0000          ?        ?  1111.6661  18.5171          ?        ?      333.3        2.8       ?       ? 
1 1 1   51   10   22 o    149.3    4.9    0.0000   0.0000          ?        ?   223.4826  14.6860          ?        ?      149.3        4.9       ?       ? 
1 1 1   51   10   23 o    138.9    5.3    0.0000   0.0000          ?        ?   193.4720  14.6860          ?        ?      138.9        5.3       ?       ? 
1 1 1   51   10   24 o    250.9    3.2    0.0000   0.0000          ?        ?   630.2208  15.9630          ?        ?      250.9        3.2       ?       ? 
1 1 1   51   10   25 o    377.8    2.8    0.0000   0.0000          ?        ?  1428.3728  21.0712          ?        ?      377.8        2.8       ?       ? 
1 1 1   51   10   26 o    227.4    3.5    0.0000   0.0000          ?        ?   517.8410  15.9630          ?        ?      227.4        3.5       ?       ? 
1 1 1   51   10   27 o     19.4    9.7    0.0000   0.0000          ?        ?   -40.8654  15.3245          ?        ?       19.4        9.7       ?       ? 
1 1 1   51   10   28 o    314.7    2.9    0.0000   0.0000          ?        ?   990.9855  18.5171          ?        ?      314.7        2.9       ?       ? 
1 1 1   51   10   29 o     48.6   15.0    0.0000   0.0000          ?        ?    24.2638  15.9630          ?        ?       48.6       15.0       ?       ? 
1 1 1   51   10   30 o    302.8    3.2    0.0000   0.0000          ?        ?   917.5555  19.1556          ?        ?      302.8        3.2       ?       ? 
1 1 1   51   10   31 o     61.8   12.8    0.0000   0.0000          ?        ?    40.2269  15.3245          ?        ?       61.8       12.8       ?       ? 
1 1 1   51   10   32 o    114.7    7.0    0.0000   0.0000          ?        ?   132.1740  15.9630          ?        ?      114.7        7.0       ?       ? 
1 1 1   51   10   33 o    226.3    3.5    0.0000   0.0000          ?        ?   512.7329  15.9630          ?        ?      226.3        3.5       ?       ? 
1 1 1   51   10   34 o    173.7    4.8    0.0000   0.0000          ?        ?   302.6593  16.6016          ?        ?      173.7        4.8       ?       ? 
1 1 1   51   10   35 o    162.1    4.9    0.0000   0.0000          ?        ?   263.7094  15.9630          ?        ?      162.1        4.9       ?       ? 
1 1 1   51   10   36 o    128.5    6.5    0.0000   0.0000          ?        ?   166.0156  16.6016          ?        ?      128.5        6.5       ?       ? 
1 1 1   51   10   37 o     28.0   12.7    0.0000   0.0000          ?        ?    -8.3008  15.3245          ?        ?       28.0       12.7       ?       ? 
1 1 1   51   10   38 o    136.2    6.1    0.0000   0.0000          ?        ?   186.4483  16.6016          ?        ?      136.2        6.1       ?       ? 
1 1 1   51   10   39 o    126.2    6.6    0.0000   0.0000          ?        ?   160.2689  16.6016          ?        ?      126.2        6.6       ?       ? 
1 1 1   51   10   40 o    176.5    4.7    0.0000   0.0000          ?        ?   312.8756  16.6016          ?        ?      176.5        4.7       ?       ? 
1 1 1   51   10   41 o    123.5    6.7    0.0000   0.0000          ?        ?   153.8837  16.6016          ?        ?      123.5        6.7       ?       ? 
1 1 1   51   10   42 o    119.0    7.0    0.0000   0.0000          ?        ?   143.0288  16.6016          ?        ?      119.0        7.0       ?       ? 
1 1 1   51   10   43 o    193.2    4.6    0.0000   0.0000          ?        ?   374.8122  17.8786          ?        ?      193.2        4.6       ?       ? 
1 1 1   51   11    0 o    583.6    3.9 3408.4285  45.3350  3408.4285  45.3350  3408.4285  45.3350      583.6      3.9      583.6        3.9     0.0     0.0 
1 1 1   51   11    1 o    443.7    2.9    0.0000   0.0000          ?        ?  1969.8392  25.5409          ?        ?      443.7        2.9       ?       ? 
1 1 1   51   11    2 o    230.4    3.2    0.0000   0.0000          ?        ?   531.2500  14.6860          ?        ?      230.4        3.2       ?       ? 
1 1 1   51   11    3 o    361.8    2.7    0.0000   0.0000          ?        ?  1309.6079  19.7942          ?        ?      361.8        2.7       ?       ? 
1 1 1   51   11    4 o    183.0    3.5    0.0000   0.0000          ?        ?   335.2238  12.7704          ?        ?      183.0        3.5       ?       ? 
1 1 1   51   11    5 o    147.9    4.3    0.0000   0.0000          ?        ?   219.0129  12.7704          ?        ?      147.9        4.3       ?       ? 
1 1 1   51   11    6 o    121.9    4.7    0.0000   0.0000          ?        ?   148.7755  11.4934          ?        ?      121.9        4.7       ?       ? 
1 1 1   51   11    7 o    310.5    3.0    0.0000   0.0000          ?        ?   964.8062  18.5171          ?        ?      310.5        3.0       ?       ? 
1 1 1   51   11    8 o    352.0    2.7    0.0000   0.0000          ?        ?  1239.3705  19.1556          ?        ?      352.0        2.7       ?       ? 
1 1 1   51   11    9 o    276.3    3.0    0.0000   0.0000          ?        ?   763.6719  16.6016          ?        ?      276.3        3.0       ?       ? 
1 1 1   51   11   10 o    270.5    3.3    0.0000   0.0000          ?        ?   732.3843  17.8786          ?        ?      270.5        3.3       ?       ? 
1 1 1   51   11   11 o    183.0    3.7    0.0000   0.0000          ?        ?   335.2238  13.4090          ?        ?      183.0        3.7       ?       ? 
1 1 1   51   11   12 o    420.4    2.9    0.0000   0.0000          ?        ?  1768.0663  24.2638          ?        ?      420.4        2.9       ?       ? 
1 1 1   51   11   13 o    327.8    2.9    0.0000   0.0000          ?        ?  1075.2704  19.1556          ?        ?      327.8        2.9       ?       ? 
1 1 1   51   11   14 o    320.1    3.0    0.0000   0.0000          ?        ?  1025.4658  19.1556          ?        ?      320.1        3.0       ?       ? 
1 1 1   51   11   15 o    387.2    2.9    0.0000   0.0000          ?        ?  1500.5259  22.3483          ?        ?      387.2        2.9       ?       ? 
1 1 1   51   11   16 o    260.3    3.2    0.0000   0.0000          ?        ?   678.1099  16.6016          ?        ?      260.3        3.2       ?       ? 
1 1 1   51   11   17 o    109.4    6.7    0.0000   0.0000          ?        ?   120.0421  14.6860          ?        ?      109.4        6.7       ?       ? 
1 1 1   51   11   18 o    375.5    2.9    0.0000   0.0000          ?        ?  1411.1328  21.7097          ?        ?      375.5        2.9       ?       ? 
1 1 1   51   11   19 o    267.8    3.2    0.0000   0.0000          ?        ?   717.6983  17.2401          ?        ?      267.8        3.2       ?       ? 
1 1 1   51   11   20 o    180.0    4.1    0.0000   0.0000          ?        ?   324.3690  14.6860          ?        ?      180.0        4.1       ?       ? 
1 1 1   51   11   21 o    364.8    2.8    0.0000   0.0000          ?        ?  1331.3176  20.4327          ?        ?      364.8        2.8       ?       ? 
1 1 1   51   11   22 o    142.1    5.4    0.0000   0.0000          ?        ?   202.4114  15.3245          ?        ?      142.1        5.4       ?       ? 
1 1 1   51   11   23 o    185.6    4.0    0.0000   0.0000          ?        ?   344.8017  14.6860          ?        ?      185.6        4.0       ?       ? 
1 1 1   51   11   24 o    293.3    3.0    0.0000   0.0000          ?        ?   860.7272  17.8786          ?        ?      293.3        3.0       ?       ? 
1 1 1   51   11   25 o    211.0    3.9    0.0000   0.0000          ?        ?   445.6881  16.6016          ?        ?      211.0        3.9       ?       ? 
1 1 1   51   11   26 o    314.5    2.9    0.0000   0.0000          ?        ?   989.7085  18.5171          ?        ?      314.5        2.9       ?       ? 
1 1 1   51   11   27 o    106.0    7.2    0.0000   0.0000          ?        ?   113.0183  15.3245          ?        ?      106.0        7.2       ?       ? 
1 1 1   51   11   28 o    146.2    5.5    0.0000   0.0000          ?        ?   214.5433  15.9630          ?        ?      146.2        5.5       ?       ? 
1 1 1   51   11   29 o     64.8   12.3    0.0000   0.0000          ?        ?    44.0580  15.3245          ?        ?       64.8       12.3       ?       ? 
1 1 1   51   11   30 o    285.9    3.0    0.0000   0.0000          ?        ?   817.9462  17.2401          ?        ?      285.9        3.0       ?       ? 
1 1 1   51   11   31 o    187.4    4.1    0.0000   0.0000          ?        ?   351.8254  15.3245          ?        ?      187.4        4.1       ?       ? 
1 1 1   51   11   32 o    166.8    4.8    0.0000   0.0000          ?        ?   279.0340  15.9630          ?        ?      166.8        4.8       ?       ? 
1 1 1   51   11   33 o    163.1    5.1    0.0000   0.0000          ?        ?   266.9020  16.6016          ?        ?      163.1        5.1       ?       ? 
1 1 1   51   11   34 o    146.6    5.4    0.0000   0.0000          ?        ?   215.8203  15.9630          ?        ?      146.6        5.4       ?       ? 
1 1 1   51   11   35 o     23.0   11.2    0.0000   0.0000          ?        ?   -29.3720  16.6016          ?        ?       23.0       11.2       ?       ? 
1 1 1   51   11   36 o    542.3    2.6    0.0000   0.0000          ?        ?  2943.5847  28.7335          ?        ?      542.3        2.6       ?       ? 
1 1 1   51   11   37 o    132.1    6.0    0.0000   0.0000          ?        ?   175.5934  15.9630          ?        ?      132.1        6.0       ?       ? 
1 1 1   51   11   38 o    175.9    4.5    0.0000   0.0000          ?        ?   310.3215  15.9630          ?        ?      175.9        4.5       ?       ? 
1 1 1   51   11   39 o    104.5    7.9    0.0000   0.0000          ?        ?   110.4642  16.6016          ?        ?      104.5        7.9       ?       ? 
1 1 1   51   11   40 o    118.3    6.7    0.0000   0.0000          ?        ?   141.1133  15.9630          ?        ?      118.3        6.7       ?       ? 
1 1 1   51   11   41 o    137.7    6.0    0.0000   0.0000          ?        ?   190.9180  16.6016          ?        ?      137.7        6.0       ?       ? 
1 1 1   51   11   42 o    155.5    5.3    0.0000   0.0000          ?        ?   243.2767  16.6016          ?        ?      155.5        5.3       ?       ? 
1 1 1   51   12    0 o    267.8    4.1  718.3369  21.7097   718.3369  21.7097   718.3369  21.7097      267.8      4.1      267.8        4.1     0.0     0.0 
1 1 1   51   12    1 o    474.4    2.9    0.0000   0.0000          ?        ?  2252.0659  27.4564          ?        ?      474.4        2.9       ?       ? 
1 1 1   51   12    2 o    100.3    5.4    0.0000   0.0000          ?        ?   100.8864  10.8549          ?        ?      100.3        5.4       ?       ? 
1 1 1   51   12    3 o    146.6    3.7    0.0000   0.0000          ?        ?   215.1818  10.8549          ?        ?      146.6        3.7       ?       ? 
1 1 1   51   12    4 o    280.5    2.7    0.0000   0.0000          ?        ?   787.2972  15.3245          ?        ?      280.5        2.7       ?       ? 
1 1 1   51   12    5 o    276.3    2.8    0.0000   0.0000          ?        ?   763.6719  15.3245          ?        ?      276.3        2.8       ?       ? 
1 1 1   51   12    6 o    183.7    3.5    0.0000   0.0000          ?        ?   337.7780  12.7704          ?        ?      183.7        3.5       ?       ? 
1 1 1   51   12    7 o    227.8    3.2    0.0000   0.0000          ?        ?   519.1181  14.6860          ?        ?      227.8        3.2       ?       ? 
1 1 1   51   12    8 o    401.5    3.1    0.0000   0.0000          ?        ?  1613.5442  24.9023          ?        ?      401.5        3.1       ?       ? 
1 1 1   51   12    9 o    303.7    2.9    0.0000   0.0000          ?        ?   922.6638  17.8786          ?        ?      303.7        2.9       ?       ? 
1 1 1   51   12   10 f    291.8    3.0    0.0000   0.0000          ?        ?   851.7878  17.2401          ?        ?      291.8        3.0       ?       ? 
1 1 1   51   12   11 o    212.2    3.5    0.0000   0.0000          ?        ?   450.7963  14.6860          ?        ?      212.2        3.5       ?       ? 
1 1 1   51   12   12 o    332.8    3.0    0.0000   0.0000          ?        ?  1108.4736  19.7942          ?        ?      332.8        3.0       ?       ? 
1 1 1   51   12   13 o    210.2    3.6    0.0000   0.0000          ?        ?   442.4955  15.3245          ?        ?      210.2        3.6       ?       ? 
1 1 1   51   12   14 o    108.5    6.5    0.0000   0.0000          ?        ?   118.1265  14.0475          ?        ?      108.5        6.5       ?       ? 
1 1 1   51   12   15 o    210.9    3.6    0.0000   0.0000          ?        ?   445.0496  15.3245          ?        ?      210.9        3.6       ?       ? 
1 1 1   51   12   16 o    186.8    4.1    0.0000   0.0000          ?        ?   349.2713  15.3245          ?        ?      186.8        4.1       ?       ? 
1 1 1   51   12   17 o    235.0    3.5    0.0000   0.0000          ?        ?   552.9597  16.6016          ?        ?      235.0        3.5       ?       ? 
1 1 1   51   12   18 o     77.2    9.5    0.0000   0.0000          ?        ?    60.0210  14.6860          ?        ?       77.2        9.5       ?       ? 
1 1 1   51   12   19 o    128.9    5.4    0.0000   0.0000          ?        ?   166.6541  14.0475          ?        ?      128.9        5.4       ?       ? 
1 1 1   51   12   20 o    187.1    4.1    0.0000   0.0000          ?        ?   350.5484  15.3245          ?        ?      187.1        4.1       ?       ? 
1 1 1   51   12   21 f    133.5    5.3    0.0000   0.0000          ?        ?   178.7861  14.0475          ?        ?      133.5        5.3       ?       ? 
1 1 1   51   12   22 o    149.5    4.9    0.0000   0.0000          ?        ?   224.1211  14.6860          ?        ?      149.5        4.9       ?       ? 
1 1 1   51   12   23 o     30.0   13.2    0.0000   0.0000          ?        ?    -3.8311  15.3245          ?        ?       30.0       13.2       ?       ? 
1 1 1   51   12   24 o    251.3    3.3    0.0000   0.0000          ?        ?   632.1364  16.6016          ?        ?      251.3        3.3       ?       ? 
1 1 1   51   12   25 o    322.3    2.9    0.0000   0.0000          ?        ?  1039.5132  18.5171          ?        ?      322.3        2.9       ?       ? 
1 1 1   51   12   26 o    339.7    3.0    0.0000   0.0000          ?        ?  1155.0856  20.4327          ?        ?      339.7        3.0       ?       ? 
1 1 1   51   12   27 o     44.1   15.1    0.0000   0.0000          ?        ?    18.5171  15.9630          ?        ?       44.1       15.1       ?       ? 
1 1 1   51   12   28 o    148.2    5.2    0.0000   0.0000          ?        ?   220.2900  15.3245          ?        ?      148.2        5.2       ?       ? 
1 1 1   51   12   29 o    400.9    2.6    0.0000   0.0000          ?        ?  1608.4359  21.0712          ?        ?      400.9        2.6       ?       ? 
1 1 1   51   12   30 o    104.5    7.3    0.0000   0.0000          ?        ?   109.8257  15.3245          ?        ?      104.5        7.3       ?       ? 
1 1 1   51   12   31 o     97.8    7.8    0.0000   0.0000          ?        ?    96.4168  15.3245          ?        ?       97.8        7.8       ?       ? 
1 1 1   51   12   32 o    180.6    4.4    0.0000   0.0000          ?        ?   326.9231  15.9630          ?        ?      180.6        4.4       ?       ? 
1 1 1   51   12   33 o    407.6    2.7    0.0000   0.0000          ?        ?  1662.7103  21.7097          ?        ?      407.6        2.7       ?       ? 
1 1 1   51   12   34 o    156.5    5.3    0.0000   0.0000          ?        ?   245.8308  16.6016          ?        ?      156.5        5.3       ?       ? 
1 1 1   51   12   35 f    197.7    4.4    0.0000   0.0000          ?        ?   392.0523  17.2401          ?        ?      197.7        4.4       ?       ? 
1 1 1   51   12   36 o     22.2   10.9    0.0000   0.0000          ?        ?   -29.3720  15.9630          ?        ?       22.2       10.9       ?       ? 
1 1 1   51   12   37 o    121.5    6.6    0.0000   0.0000          ?        ?   148.7755  15.9630          ?        ?      121.5        6.6       ?       ? 
1 1 1   51   12   38 o    244.5    3.5    0.0000   0.0000          ?        ?   598.9333  17.2401          ?        ?      244.5        3.5       ?       ? 
1 1 1   51   12   39 o    163.4    4.9    0.0000   0.0000          ?        ?   268.1791  15.9630          ?        ?      163.4        4.9       ?       ? 
1 1 1   51   12   40 o     49.8   15.2    0.0000   0.0000          ?        ?    26.1794  16.6016          ?        ?       49.8       15.2       ?       ? 
1 1 1   51   13    0 o    137.8    5.3  190.9180  14.6860   190.9180  14.6860   190.9180  14.6860      137.8      5.3      137.8        5.3     0.0     0.0 
1 1 1   51   13    1 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51   13    2 o     15.9    8.0    0.0000   0.0000          ?        ?   -40.2269  12.1319          ?        ?       15.9        8.0       ?       ? 
1 1 1   51   13    3 o    175.7    3.5    0.0000   0.0000          ?        ?   309.0445  12.1319          ?        ?      175.7        3.5       ?       ? 
1 1 1   51   13    4 o    181.1    3.3    0.0000   0.0000          ?        ?   328.2001  12.1319          ?        ?      181.1        3.3       ?       ? 
1 1 1   51   13    5 o    206.6    2.9    0.0000   0.0000          ?        ?   427.1710  12.1319          ?        ?      206.6        2.9       ?       ? 
1 1 1   51   13    6 o    239.5    2.8    0.0000   0.0000          ?        ?   574.0309  13.4090          ?        ?      239.5        2.8       ?       ? 
1 1 1   51   13    7 o     71.3    7.6    0.0000   0.0000          ?        ?    51.0817  10.8549          ?        ?       71.3        7.6       ?       ? 
1 1 1   51   13    8 o    220.3    3.2    0.0000   0.0000          ?        ?   485.9149  14.0475          ?        ?      220.3        3.2       ?       ? 
1 1 1   51   13    9 o    399.6    3.0    0.0000   0.0000          ?        ?  1597.5811  24.2638          ?        ?      399.6        3.0       ?       ? 
1 1 1   51   13   10 o    190.9    3.5    0.0000   0.0000          ?        ?   364.5958  13.4090          ?        ?      190.9        3.5       ?       ? 
1 1 1   51   13   11 o    417.7    2.9    0.0000   0.0000          ?        ?  1745.7181  24.2638          ?        ?      417.7        2.9       ?       ? 
1 1 1   51   13   12 o    310.6    3.2    0.0000   0.0000          ?        ?   965.4447  19.7942          ?        ?      310.6        3.2       ?       ? 
1 1 1   51   13   13 o    328.9    3.3    0.0000   0.0000          ?        ?  1082.9327  21.7097          ?        ?      328.9        3.3       ?       ? 
1 1 1   51   13   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51   13   15 o    135.0    5.2    0.0000   0.0000          ?        ?   182.6172  14.0475          ?        ?      135.0        5.2       ?       ? 
1 1 1   51   13   16 o    116.7    6.3    0.0000   0.0000          ?        ?   136.6436  14.6860          ?        ?      116.7        6.3       ?       ? 
1 1 1   51   13   17 o    142.3    5.2    0.0000   0.0000          ?        ?   203.0499  14.6860          ?        ?      142.3        5.2       ?       ? 
1 1 1   51   13   18 o    105.5    6.4    0.0000   0.0000          ?        ?   111.7413  13.4090          ?        ?      105.5        6.4       ?       ? 
1 1 1   51   13   19 o    220.7    3.5    0.0000   0.0000          ?        ?   487.8305  15.3245          ?        ?      220.7        3.5       ?       ? 
1 1 1   51   13   20 o    126.7    5.5    0.0000   0.0000          ?        ?   160.9075  14.0475          ?        ?      126.7        5.5       ?       ? 
1 1 1   51   13   21 o    372.0    2.7    0.0000   0.0000          ?        ?  1384.9534  20.4327          ?        ?      372.0        2.7       ?       ? 
1 1 1   51   13   22 o    387.5    2.9    0.0000   0.0000          ?        ?  1502.4414  22.3483          ?        ?      387.5        2.9       ?       ? 
1 1 1   51   13   23 o    116.7    6.3    0.0000   0.0000          ?        ?   136.6436  14.6860          ?        ?      116.7        6.3       ?       ? 
1 1 1   51   13   24 o    244.6    3.4    0.0000   0.0000          ?        ?   598.9333  16.6016          ?        ?      244.6        3.4       ?       ? 
1 1 1   51   13   25 o    169.3    4.5    0.0000   0.0000          ?        ?   287.3347  15.3245          ?        ?      169.3        4.5       ?       ? 
1 1 1   51   13   26 o    156.4    5.1    0.0000   0.0000          ?        ?   245.1923  15.9630          ?        ?      156.4        5.1       ?       ? 
1 1 1   51   13   27 o    176.8    4.7    0.0000   0.0000          ?        ?   313.5141  16.6016          ?        ?      176.8        4.7       ?       ? 
1 1 1   51   13   28 o     61.3   12.4    0.0000   0.0000          ?        ?    39.5883  14.6860          ?        ?       61.3       12.4       ?       ? 
1 1 1   51   13   29 o    148.6    5.4    0.0000   0.0000          ?        ?   221.5670  15.9630          ?        ?      148.6        5.4       ?       ? 
1 1 1   51   13   30 o    177.7    4.3    0.0000   0.0000          ?        ?   316.7067  15.3245          ?        ?      177.7        4.3       ?       ? 
1 1 1   51   13   31 o    118.7    6.7    0.0000   0.0000          ?        ?   141.7518  15.9630          ?        ?      118.7        6.7       ?       ? 
1 1 1   51   13   32 o    298.4    3.1    0.0000   0.0000          ?        ?   891.3762  18.5171          ?        ?      298.4        3.1       ?       ? 
1 1 1   51   13   33 o     96.8    7.9    0.0000   0.0000          ?        ?    94.5012  15.3245          ?        ?       96.8        7.9       ?       ? 
1 1 1   51   13   34 o    147.0    5.6    0.0000   0.0000          ?        ?   217.0974  16.6016          ?        ?      147.0        5.6       ?       ? 
1 1 1   51   13   35 o    159.7    5.0    0.0000   0.0000          ?        ?   256.0471  15.9630          ?        ?      159.7        5.0       ?       ? 
1 1 1   51   13   36 o    273.0    3.4    0.0000   0.0000          ?        ?   747.0703  18.5171          ?        ?      273.0        3.4       ?       ? 
1 1 1   51   13   37 o    201.8    4.1    0.0000   0.0000          ?        ?   408.6538  16.6016          ?        ?      201.8        4.1       ?       ? 
1 1 1   51   13   38 o     31.3   13.8    0.0000   0.0000          ?        ?    -3.1926  16.6016          ?        ?       31.3       13.8       ?       ? 
1 1 1   51   13   39 o     57.0   14.1    0.0000   0.0000          ?        ?    35.1187  15.9630          ?        ?       57.0       14.1       ?       ? 
1 1 1   51   14    0 o    249.1    6.4  622.5586  31.9261   622.5586  31.9261   622.5586  31.9261      249.1      6.4      249.1        6.4     0.0     0.0 
1 1 1   51   14    1 f    536.6    4.6    0.0000   0.0000          ?        ?  2884.2021  49.1662          ?        ?      536.6        4.6       ?       ? 
1 1 1   51   14    2 o    404.4    4.0    0.0000   0.0000          ?        ?  1637.8080  32.5646          ?        ?      404.4        4.0       ?       ? 
1 1 1   51   14    3 o    239.6    3.7    0.0000   0.0000          ?        ?   574.6694  17.8786          ?        ?      239.6        3.7       ?       ? 
1 1 1   51   14    4 o    393.1    2.8    0.0000   0.0000          ?        ?  1546.4994  22.3483          ?        ?      393.1        2.8       ?       ? 
1 1 1   51   14    5 o    187.1    3.8    0.0000   0.0000          ?        ?   350.5484  14.0475          ?        ?      187.1        3.8       ?       ? 
1 1 1   51   14    6 o    128.2    5.2    0.0000   0.0000          ?        ?   164.7386  13.4090          ?        ?      128.2        5.2       ?       ? 
1 1 1   51   14    7 o    234.6    3.5    0.0000   0.0000          ?        ?   551.0442  16.6016          ?        ?      234.6        3.5       ?       ? 
1 1 1   51   14    8 o    465.0    3.2    0.0000   0.0000          ?        ?  2163.9497  29.3720          ?        ?      465.0        3.2       ?       ? 
1 1 1   51   14    9 o    160.3    4.0    0.0000   0.0000          ?        ?   257.3242  12.7704          ?        ?      160.3        4.0       ?       ? 
1 1 1   51   14   10 o    288.9    3.0    0.0000   0.0000          ?        ?   835.1863  17.2401          ?        ?      288.9        3.0       ?       ? 
1 1 1   51   14   11 o    129.7    4.4    0.0000   0.0000          ?        ?   168.5697  11.4934          ?        ?      129.7        4.4       ?       ? 
1 1 1   51   14   12 o    242.8    3.0    0.0000   0.0000          ?        ?   589.9940  14.6860          ?        ?      242.8        3.0       ?       ? 
1 1 1   51   14   13 o    121.3    5.0    0.0000   0.0000          ?        ?   147.4985  12.1319          ?        ?      121.3        5.0       ?       ? 
1 1 1   51   14   14 o    143.9    4.4    0.0000   0.0000          ?        ?   207.5195  12.7704          ?        ?      143.9        4.4       ?       ? 
1 1 1   51   14   15 o     50.4   12.2    0.0000   0.0000          ?        ?    26.8179  12.1319          ?        ?       50.4       12.2       ?       ? 
1 1 1   51   14   16 o     62.6   10.2    0.0000   0.0000          ?        ?    39.5883  12.7704          ?        ?       62.6       10.2       ?       ? 
1 1 1   51   14   17 o    122.9    5.2    0.0000   0.0000          ?        ?   151.3296  12.7704          ?        ?      122.9        5.2       ?       ? 
1 1 1   51   14   18 o    414.7    3.0    0.0000   0.0000          ?        ?  1721.4543  24.9023          ?        ?      414.7        3.0       ?       ? 
1 1 1   51   14   19 o    302.8    3.2    0.0000   0.0000          ?        ?   917.5555  19.1556          ?        ?      302.8        3.2       ?       ? 
1 1 1   51   14   20 o    209.6    3.4    0.0000   0.0000          ?        ?   439.9414  14.0475          ?        ?      209.6        3.4       ?       ? 
1 1 1   51   14   21 o    163.4    4.5    0.0000   0.0000          ?        ?   267.5406  14.6860          ?        ?      163.4        4.5       ?       ? 
1 1 1   51   14   22 o     86.9    8.1    0.0000   0.0000          ?        ?    75.9841  14.0475          ?        ?       86.9        8.1       ?       ? 
1 1 1   51   14   23 o     62.8   12.6    0.0000   0.0000          ?        ?    41.5039  15.3245          ?        ?       62.8       12.6       ?       ? 
1 1 1   51   14   24 o     19.8    9.8    0.0000   0.0000          ?        ?   -34.4802  14.6860          ?        ?       19.8        9.8       ?       ? 
1 1 1   51   14   25 o    102.0    7.2    0.0000   0.0000          ?        ?   104.7175  14.6860          ?        ?      102.0        7.2       ?       ? 
1 1 1   51   14   26 o    352.4    2.8    0.0000   0.0000          ?        ?  1243.2015  19.7942          ?        ?      352.4        2.8       ?       ? 
1 1 1   51   14   27 o     34.6   14.1    0.0000   0.0000          ?        ?     5.1082  15.3245          ?        ?       34.6       14.1       ?       ? 
1 1 1   51   14   28 o     19.7    9.7    0.0000   0.0000          ?        ?   -31.2876  14.0475          ?        ?       19.7        9.7       ?       ? 
1 1 1   51   14   29 f    105.4    7.0    0.0000   0.0000          ?        ?   111.7413  14.6860          ?        ?      105.4        7.0       ?       ? 
1 1 1   51   14   30 o    120.6    6.4    0.0000   0.0000          ?        ?   146.2215  15.3245          ?        ?      120.6        6.4       ?       ? 
1 1 1   51   14   31 o     61.7   12.3    0.0000   0.0000          ?        ?    40.2269  14.6860          ?        ?       61.7       12.3       ?       ? 
1 1 1   51   14   32 o     44.1   14.8    0.0000   0.0000          ?        ?    19.1556  15.3245          ?        ?       44.1       14.8       ?       ? 
1 1 1   51   14   33 o     21.7   10.6    0.0000   0.0000          ?        ?   -28.7335  15.3245          ?        ?       21.7       10.6       ?       ? 
1 1 1   51   14   34 o     37.3   14.7    0.0000   0.0000          ?        ?     8.9393  15.9630          ?        ?       37.3       14.7       ?       ? 
1 1 1   51   14   35 f    272.6    3.3    0.0000   0.0000          ?        ?   744.5162  17.8786          ?        ?      272.6        3.3       ?       ? 
1 1 1   51   14   36 o    150.3    5.5    0.0000   0.0000          ?        ?   227.3137  16.6016          ?        ?      150.3        5.5       ?       ? 
1 1 1   51   14   37 o    133.7    6.0    0.0000   0.0000          ?        ?   180.0631  15.9630          ?        ?      133.7        6.0       ?       ? 
1 1 1   51   15    0 o     58.5   21.8   46.6121  23.6253    46.6121  23.6253    46.6121  23.6253       58.5     21.8       58.5       21.8     0.0     0.0 
1 1 1   51   15    1 o    184.4    5.4    0.0000   0.0000          ?        ?   340.9706  19.7942          ?        ?      184.4        5.4       ?       ? 
1 1 1   51   15    2 o     83.7   11.4    0.0000   0.0000          ?        ?    70.8759  19.1556          ?        ?       83.7       11.4       ?       ? 
1 1 1   51   15    3 o    204.0    4.9    0.0000   0.0000          ?        ?   416.9547  19.7942          ?        ?      204.0        4.9       ?       ? 
1 1 1   51   15    4 o    332.5    3.7    0.0000   0.0000          ?        ?  1107.1964  24.9023          ?        ?      332.5        3.7       ?       ? 
1 1 1   51   15    5 o    157.2    5.9    0.0000   0.0000          ?        ?   247.7464  18.5171          ?        ?      157.2        5.9       ?       ? 
1 1 1   51   15    6 o     40.6   12.7    0.0000   0.0000          ?        ?    16.6016  11.4934          ?        ?       40.6       12.7       ?       ? 
1 1 1   51   15    7 o    203.6    3.6    0.0000   0.0000          ?        ?   415.0391  14.6860          ?        ?      203.6        3.6       ?       ? 
1 1 1   51   15    8 o    312.3    3.1    0.0000   0.0000          ?        ?   976.2995  19.1556          ?        ?      312.3        3.1       ?       ? 
1 1 1   51   15    9 o    116.7    6.0    0.0000   0.0000          ?        ?   136.6436  14.0475          ?        ?      116.7        6.0       ?       ? 
1 1 1   51   15   10 o     31.6   13.5    0.0000   0.0000          ?        ?    -0.6385  15.3245          ?        ?       31.6       13.5       ?       ? 
1 1 1   51   15   11 o    344.9    3.0    0.0000   0.0000          ?        ?  1190.8428  20.4327          ?        ?      344.9        3.0       ?       ? 
1 1 1   51   15   12 o     39.2   13.1    0.0000   0.0000          ?        ?    14.6860  12.1319          ?        ?       39.2       13.1       ?       ? 
1 1 1   51   15   13 o     49.8   12.8    0.0000   0.0000          ?        ?    26.1794  12.7704          ?        ?       49.8       12.8       ?       ? 
1 1 1   51   15   14 o     16.2    8.1    0.0000   0.0000          ?        ?   -29.3720  10.8549          ?        ?       16.2        8.1       ?       ? 
1 1 1   51   15   15 o    129.2    4.9    0.0000   0.0000          ?        ?   167.2927  12.7704          ?        ?      129.2        4.9       ?       ? 
1 1 1   51   15   16 o    210.2    3.5    0.0000   0.0000          ?        ?   442.4955  14.6860          ?        ?      210.2        3.5       ?       ? 
1 1 1   51   15   17 o    141.4    4.7    0.0000   0.0000          ?        ?   200.4958  13.4090          ?        ?      141.4        4.7       ?       ? 
1 1 1   51   15   18 o    258.3    3.5    0.0000   0.0000          ?        ?   667.8936  17.8786          ?        ?      258.3        3.5       ?       ? 
1 1 1   51   15   19 o     97.6    7.5    0.0000   0.0000          ?        ?    95.7782  14.6860          ?        ?       97.6        7.5       ?       ? 
1 1 1   51   15   20 o    233.3    3.1    0.0000   0.0000          ?        ?   544.6590  14.6860          ?        ?      233.3        3.1       ?       ? 
1 1 1   51   15   21 o     28.6   12.6    0.0000   0.0000          ?        ?    -3.8311  14.0475          ?        ?       28.6       12.6       ?       ? 
1 1 1   51   15   22 o    189.8    4.0    0.0000   0.0000          ?        ?   360.7647  15.3245          ?        ?      189.8        4.0       ?       ? 
1 1 1   51   15   23 o    236.6    3.5    0.0000   0.0000          ?        ?   560.6220  16.6016          ?        ?      236.6        3.5       ?       ? 
1 1 1   51   15   24 o     30.5   13.0    0.0000   0.0000          ?        ?     0.0000  14.0475          ?        ?       30.5       13.0       ?       ? 
1 1 1   51   15   25 o     88.6    8.3    0.0000   0.0000          ?        ?    79.1767  14.6860          ?        ?       88.6        8.3       ?       ? 
1 1 1   51   15   26 o    217.0    3.7    0.0000   0.0000          ?        ?   471.8675  15.9630          ?        ?      217.0        3.7       ?       ? 
1 1 1   51   15   27 o    161.5    4.7    0.0000   0.0000          ?        ?   261.7939  15.3245          ?        ?      161.5        4.7       ?       ? 
1 1 1   51   15   28 o    187.5    4.3    0.0000   0.0000          ?        ?   352.4639  15.9630          ?        ?      187.5        4.3       ?       ? 
1 1 1   51   15   29 o    149.4    5.1    0.0000   0.0000          ?        ?   224.1211  15.3245          ?        ?      149.4        5.1       ?       ? 
1 1 1   51   15   30 o    384.1    2.8    0.0000   0.0000          ?        ?  1477.5391  21.7097          ?        ?      384.1        2.8       ?       ? 
1 1 1   51   15   31 o    233.4    3.4    0.0000   0.0000          ?        ?   545.9360  15.9630          ?        ?      233.4        3.4       ?       ? 
1 1 1   51   15   32 o    118.3    6.7    0.0000   0.0000          ?        ?   141.1133  15.9630          ?        ?      118.3        6.7       ?       ? 
1 1 1   51   15   33 o    228.3    3.5    0.0000   0.0000          ?        ?   522.3107  15.9630          ?        ?      228.3        3.5       ?       ? 
1 1 1   51   15   34 o    216.3    3.8    0.0000   0.0000          ?        ?   469.3134  16.6016          ?        ?      216.3        3.8       ?       ? 
1 1 1   51   15   35 o     56.0   14.2    0.0000   0.0000          ?        ?    33.8416  15.9630          ?        ?       56.0       14.2       ?       ? 
1 1 1   51   15   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51   16    0 o    382.8    6.2 1469.2383  47.2506  1469.2383  47.2506  1469.2383  47.2506      382.8      6.2      382.8        6.2     0.0     0.0 
1 1 1   51   16    1 o    112.5    9.4    0.0000   0.0000          ?        ?   127.7043  21.0712          ?        ?      112.5        9.4       ?       ? 
1 1 1   51   16    2 o    312.9    4.7    0.0000   0.0000          ?        ?   980.7693  29.3720          ?        ?      312.9        4.7       ?       ? 
1 1 1   51   16    3 o    216.4    5.0    0.0000   0.0000          ?        ?   469.3134  21.7097          ?        ?      216.4        5.0       ?       ? 
1 1 1   51   16    4 o    139.4    7.3    0.0000   0.0000          ?        ?   195.3876  20.4327          ?        ?      139.4        7.3       ?       ? 
1 1 1   51   16    5 o    300.6    4.1    0.0000   0.0000          ?        ?   904.7851  24.9023          ?        ?      300.6        4.1       ?       ? 
1 1 1   51   16    6 o    159.6    5.8    0.0000   0.0000          ?        ?   255.4086  18.5171          ?        ?      159.6        5.8       ?       ? 
1 1 1   51   16    7 o    197.9    5.3    0.0000   0.0000          ?        ?   392.6908  21.0712          ?        ?      197.9        5.3       ?       ? 
1 1 1   51   16    8 o     83.2    6.9    0.0000   0.0000          ?        ?    69.5989  11.4934          ?        ?       83.2        6.9       ?       ? 
1 1 1   51   16    9 o    222.5    3.6    0.0000   0.0000          ?        ?   495.4928  15.9630          ?        ?      222.5        3.6       ?       ? 
1 1 1   51   16   10 o     25.3   11.6    0.0000   0.0000          ?        ?    -9.5778  13.4090          ?        ?       25.3       11.6       ?       ? 
1 1 1   51   16   11 o     51.0   13.1    0.0000   0.0000          ?        ?    27.4564  13.4090          ?        ?       51.0       13.1       ?       ? 
1 1 1   51   16   12 o    246.4    3.6    0.0000   0.0000          ?        ?   607.8726  17.8786          ?        ?      246.4        3.6       ?       ? 
1 1 1   51   16   13 o    291.9    3.7    0.0000   0.0000          ?        ?   853.0649  21.7097          ?        ?      291.9        3.7       ?       ? 
1 1 1   51   16   14 o    128.9    5.0    0.0000   0.0000          ?        ?   166.6541  12.7704          ?        ?      128.9        5.0       ?       ? 
1 1 1   51   16   15 o    212.0    3.6    0.0000   0.0000          ?        ?   450.1577  15.3245          ?        ?      212.0        3.6       ?       ? 
1 1 1   51   16   16 o     88.0    7.6    0.0000   0.0000          ?        ?    77.8996  13.4090          ?        ?       88.0        7.6       ?       ? 
1 1 1   51   16   17 o    109.4    5.5    0.0000   0.0000          ?        ?   120.0421  12.1319          ?        ?      109.4        5.5       ?       ? 
1 1 1   51   16   18 o    372.4    3.0    0.0000   0.0000          ?        ?  1388.1460  22.3483          ?        ?      372.4        3.0       ?       ? 
1 1 1   51   16   19 o    168.8    4.4    0.0000   0.0000          ?        ?   285.4192  14.6860          ?        ?      168.8        4.4       ?       ? 
1 1 1   51   16   20 o    290.0    3.2    0.0000   0.0000          ?        ?   842.2100  18.5171          ?        ?      290.0        3.2       ?       ? 
1 1 1   51   16   21 o    154.4    4.3    0.0000   0.0000          ?        ?   238.8071  13.4090          ?        ?      154.4        4.3       ?       ? 
1 1 1   51   16   22 o    122.0    5.8    0.0000   0.0000          ?        ?   149.4141  14.0475          ?        ?      122.0        5.8       ?       ? 
1 1 1   51   16   23 o    129.1    5.4    0.0000   0.0000          ?        ?   167.2927  14.0475          ?        ?      129.1        5.4       ?       ? 
1 1 1   51   16   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51   16   25 o    195.3    4.1    0.0000   0.0000          ?        ?   382.4745  15.9630          ?        ?      195.3        4.1       ?       ? 
1 1 1   51   16   26 o     90.0    8.2    0.0000   0.0000          ?        ?    81.7308  14.6860          ?        ?       90.0        8.2       ?       ? 
1 1 1   51   16   27 o    161.3    4.7    0.0000   0.0000          ?        ?   261.1554  15.3245          ?        ?      161.3        4.7       ?       ? 
1 1 1   51   16   28 o    281.2    3.0    0.0000   0.0000          ?        ?   791.7668  16.6016          ?        ?      281.2        3.0       ?       ? 
1 1 1   51   16   29 o     43.8   14.4    0.0000   0.0000          ?        ?    19.1556  14.6860          ?        ?       43.8       14.4       ?       ? 
1 1 1   51   16   30 f    140.1    5.5    0.0000   0.0000          ?        ?   197.3032  15.3245          ?        ?      140.1        5.5       ?       ? 
1 1 1   51   16   31 o     20.4   10.0    0.0000   0.0000          ?        ?   -31.2876  14.6860          ?        ?       20.4       10.0       ?       ? 
1 1 1   51   16   32 o    136.4    5.4    0.0000   0.0000          ?        ?   187.0868  14.6860          ?        ?      136.4        5.4       ?       ? 
1 1 1   51   16   33 o     20.4   10.1    0.0000   0.0000          ?        ?   -34.4802  15.3245          ?        ?       20.4       10.1       ?       ? 
1 1 1   51   16   34 o    105.7    7.2    0.0000   0.0000          ?        ?   113.0183  15.3245          ?        ?      105.7        7.2       ?       ? 
1 1 1   51   17    0 o    129.1   11.5  171.7623  29.3720   171.7623  29.3720   171.7623  29.3720      129.1     11.5      129.1       11.5     0.0     0.0 
1 1 1   51   17    1 o    124.4    8.2    0.0000   0.0000          ?        ?   155.7993  20.4327          ?        ?      124.4        8.2       ?       ? 
1 1 1   51   17    2 o     93.7   10.6    0.0000   0.0000          ?        ?    88.7545  19.7942          ?        ?       93.7       10.6       ?       ? 
1 1 1   51   17    3 o    190.1    6.0    0.0000   0.0000          ?        ?   362.6803  22.9868          ?        ?      190.1        6.0       ?       ? 
1 1 1   51   17    4 o    116.7    8.5    0.0000   0.0000          ?        ?   137.2822  19.7942          ?        ?      116.7        8.5       ?       ? 
1 1 1   51   17    5 f     53.1   15.7    0.0000   0.0000          ?        ?    29.3720  17.8786          ?        ?       53.1       15.7       ?       ? 
1 1 1   51   17    6 o    136.9    7.2    0.0000   0.0000          ?        ?   188.3639  19.7942          ?        ?      136.9        7.2       ?       ? 
1 1 1   51   17    7 o    150.3    6.2    0.0000   0.0000          ?        ?   226.6752  18.5171          ?        ?      150.3        6.2       ?       ? 
1 1 1   51   17    8 o    240.3    5.0    0.0000   0.0000          ?        ?   579.1391  24.2638          ?        ?      240.3        5.0       ?       ? 
1 1 1   51   17    9 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   51   17   10 o     15.9    8.1    0.0000   0.0000          ?        ?   -44.6965  12.7704          ?        ?       15.9        8.1       ?       ? 
1 1 1   51   17   11 o     97.6    7.2    0.0000   0.0000          ?        ?    95.7782  14.0475          ?        ?       97.6        7.2       ?       ? 
1 1 1   51   17   12 o    181.3    4.6    0.0000   0.0000          ?        ?   329.4771  16.6016          ?        ?      181.3        4.6       ?       ? 
1 1 1   51   17   13 o    129.6    5.7    0.0000   0.0000          ?        ?   168.5697  14.6860          ?        ?      129.6        5.7       ?       ? 
1 1 1   51   17   14 o    414.6    3.7    0.0000   0.0000          ?        ?  1721.4543  30.6490          ?        ?      414.6        3.7       ?       ? 
1 1 1   51   17   15 o    130.5    6.6    0.0000   0.0000          ?        ?   171.1238  17.2401          ?        ?      130.5        6.6       ?       ? 
1 1 1   51   17   16 o    220.7    3.5    0.0000   0.0000          ?        ?   487.8305  15.3245          ?        ?      220.7        3.5       ?       ? 
1 1 1   51   17   17 o    233.2    3.7    0.0000   0.0000          ?        ?   544.6590  17.2401          ?        ?      233.2        3.7       ?       ? 
1 1 1   51   17   18 o    104.2    6.4    0.0000   0.0000          ?        ?   109.1872  13.4090          ?        ?      104.2        6.4       ?       ? 
1 1 1   51   17   19 o    163.9    4.7    0.0000   0.0000          ?        ?   269.4561  15.3245          ?        ?      163.9        4.7       ?       ? 
1 1 1   51   17   20 o    178.5    3.9    0.0000   0.0000          ?        ?   319.2608  14.0475          ?        ?      178.5        3.9       ?       ? 
1 1 1   51   17   21 o     68.7   10.2    0.0000   0.0000          ?        ?    47.8891  14.0475          ?        ?       68.7       10.2       ?       ? 
1 1 1   51   17   22 o    265.7    3.0    0.0000   0.0000          ?        ?   706.8434  15.9630          ?        ?      265.7        3.0       ?       ? 
1 1 1   51   17   23 o    202.9    3.6    0.0000   0.0000          ?        ?   412.4850  14.6860          ?        ?      202.9        3.6       ?       ? 
1 1 1   51   17   24 o    130.8    5.4    0.0000   0.0000          ?        ?   171.7623  14.0475          ?        ?      130.8        5.4       ?       ? 
1 1 1   51   17   25 o    209.1    3.7    0.0000   0.0000          ?        ?   438.0258  15.3245          ?        ?      209.1        3.7       ?       ? 
1 1 1   51   17   26 o    223.5    3.4    0.0000   0.0000          ?        ?   500.6010  15.3245          ?        ?      223.5        3.4       ?       ? 
1 1 1   51   17   27 o     41.8   14.4    0.0000   0.0000          ?        ?    16.6016  14.6860          ?        ?       41.8       14.4       ?       ? 
1 1 1   51   17   28 o     28.0   12.6    0.0000   0.0000          ?        ?    -6.3852  14.6860          ?        ?       28.0       12.6       ?       ? 
1 1 1   51   17   29 o     17.3    8.8    0.0000   0.0000          ?        ?   -54.2743  15.3245          ?        ?       17.3        8.8       ?       ? 
1 1 1   51   17   30 o    173.3    4.4    0.0000   0.0000          ?        ?   301.3822  15.3245          ?        ?      173.3        4.4       ?       ? 
1 1 1   51   17   31 o     32.2   13.7    0.0000   0.0000          ?        ?     1.2770  15.3245          ?        ?       32.2       13.7       ?       ? 
1 1 1   51   17   32 o     91.2    8.1    0.0000   0.0000          ?        ?    84.2849  14.6860          ?        ?       91.2        8.1       ?       ? 
1 1 1   51   18    0 o    165.2    8.9  276.4799  29.3720   276.4799  29.3720   276.4799  29.3720      165.2      8.9      165.2        8.9     0.0     0.0 
1 1 1   51   18    1 o    250.7    4.2    0.0000   0.0000          ?        ?   629.5823  21.0712          ?        ?      250.7        4.2       ?       ? 
1 1 1   51   18    2 o    119.5    6.9    0.0000   0.0000          ?        ?   143.6674  16.6016          ?        ?      119.5        6.9       ?       ? 
1 1 1   51   18    3 o    109.2    8.2    0.0000   0.0000          ?        ?   120.0421  17.8786          ?        ?      109.2        8.2       ?       ? 
1 1 1   51   18    4 o    101.1   10.4    0.0000   0.0000          ?        ?   103.4405  21.0712          ?        ?      101.1       10.4       ?       ? 
1 1 1   51   18    5 o    463.3    4.9    0.0000   0.0000          ?        ?  2151.8179  45.3350          ?        ?      463.3        4.9       ?       ? 
1 1 1   51   18    6 f    136.1    7.3    0.0000   0.0000          ?        ?   186.4483  19.7942          ?        ?      136.1        7.3       ?       ? 
1 1 1   51   18    7 o    136.8    7.2    0.0000   0.0000          ?        ?   188.3639  19.7942          ?        ?      136.8        7.2       ?       ? 
1 1 1   51   18    8 f    201.1    4.4    0.0000   0.0000          ?        ?   405.4612  17.8786          ?        ?      201.1        4.4       ?       ? 
1 1 1   51   18    9 o    204.1    4.8    0.0000   0.0000          ?        ?   417.5931  19.7942          ?        ?      204.1        4.8       ?       ? 
1 1 1   51   18   10 o    273.2    4.6    0.0000   0.0000          ?        ?   748.3474  24.9023          ?        ?      273.2        4.6       ?       ? 
1 1 1   51   18   11 o     36.8   13.7    0.0000   0.0000          ?        ?    10.8549  13.4090          ?        ?       36.8       13.7       ?       ? 
1 1 1   51   18   12 f    120.7    5.6    0.0000   0.0000          ?        ?   146.2215  13.4090          ?        ?      120.7        5.6       ?       ? 
1 1 1   51   18   13 o    233.0    3.8    0.0000   0.0000          ?        ?   544.0204  17.8786          ?        ?      233.0        3.8       ?       ? 
1 1 1   51   18   14 o    237.1    4.2    0.0000   0.0000          ?        ?   563.1760  19.7942          ?        ?      237.1        4.2       ?       ? 
1 1 1   51   18   15 o     73.6   10.4    0.0000   0.0000          ?        ?    54.9129  15.3245          ?        ?       73.6       10.4       ?       ? 
1 1 1   51   18   16 o     33.4   14.1    0.0000   0.0000          ?        ?     1.9156  15.9630          ?        ?       33.4       14.1       ?       ? 
1 1 1   51   18   17 o     50.3   15.6    0.0000   0.0000          ?        ?    26.1794  17.2401          ?        ?       50.3       15.6       ?       ? 
1 1 1   51   18   18 o    190.6    3.5    0.0000   0.0000          ?        ?   363.9573  13.4090          ?        ?      190.6        3.5       ?       ? 
1 1 1   51   18   19 o     46.0   11.8    0.0000   0.0000          ?        ?    22.3483  10.8549          ?        ?       46.0       11.8       ?       ? 
1 1 1   51   18   20 o    230.7    3.5    0.0000   0.0000          ?        ?   533.1656  15.9630          ?        ?      230.7        3.5       ?       ? 
1 1 1   51   18   21 o    112.1    6.3    0.0000   0.0000          ?        ?   126.4273  14.0475          ?        ?      112.1        6.3       ?       ? 
1 1 1   51   18   22 o    176.0    4.7    0.0000   0.0000          ?        ?   310.9600  16.6016          ?        ?      176.0        4.7       ?       ? 
1 1 1   51   18   23 o    275.2    3.1    0.0000   0.0000          ?        ?   758.5637  17.2401          ?        ?      275.2        3.1       ?       ? 
1 1 1   51   18   24 o    203.2    3.8    0.0000   0.0000          ?        ?   413.7620  15.3245          ?        ?      203.2        3.8       ?       ? 
1 1 1   51   18   25 o    106.2    6.6    0.0000   0.0000          ?        ?   113.6568  14.0475          ?        ?      106.2        6.6       ?       ? 
1 1 1   51   18   26 o    132.6    5.5    0.0000   0.0000          ?        ?   176.8705  14.6860          ?        ?      132.6        5.5       ?       ? 
1 1 1   51   18   27 o     21.2   10.2    0.0000   0.0000          ?        ?   -21.7097  13.4090          ?        ?       21.2       10.2       ?       ? 
1 1 1   51   18   28 o     48.9   13.3    0.0000   0.0000          ?        ?    25.5409  13.4090          ?        ?       48.9       13.3       ?       ? 
1 1 1   51   18   29 o     97.0    7.6    0.0000   0.0000          ?        ?    95.1397  14.6860          ?        ?       97.0        7.6       ?       ? 
1 1 1   51   18   30 o    152.9    4.6    0.0000   0.0000          ?        ?   234.9760  14.0475          ?        ?      152.9        4.6       ?       ? 
1 1 1   51   19    0 o    136.3    9.0  189.0024  24.2638   189.0024  24.2638   189.0024  24.2638      136.3      9.0      136.3        9.0     0.0     0.0 
1 1 1   51   19    1 o    183.3    5.2    0.0000   0.0000          ?        ?   337.1394  19.1556          ?        ?      183.3        5.2       ?       ? 
1 1 1   51   19    2 o    245.1    4.7    0.0000   0.0000          ?        ?   602.1259  22.9868          ?        ?      245.1        4.7       ?       ? 
1 1 1   51   19    3 f     31.5   14.0    0.0000   0.0000          ?        ?    -6.3852  17.8786          ?        ?       31.5       14.0       ?       ? 
1 1 1   51   19    4 o    147.1    6.9    0.0000   0.0000          ?        ?   217.7359  20.4327          ?        ?      147.1        6.9       ?       ? 
1 1 1   51   19    5 f     81.5   12.5    0.0000   0.0000          ?        ?    67.6833  20.4327          ?        ?       81.5       12.5       ?       ? 
1 1 1   51   19    6 o    187.0    5.8    0.0000   0.0000          ?        ?   351.1869  21.7097          ?        ?      187.0        5.8       ?       ? 
1 1 1   51   19    7 o    164.5    6.2    0.0000   0.0000          ?        ?   272.0102  20.4327          ?        ?      164.5        6.2       ?       ? 
1 1 1   51   19    8 o    187.5    6.0    0.0000   0.0000          ?        ?   353.1024  22.3483          ?        ?      187.5        6.0       ?       ? 
1 1 1   51   19    9 o    213.2    4.9    0.0000   0.0000          ?        ?   455.9044  21.0712          ?        ?      213.2        4.9       ?       ? 
1 1 1   51   19   10 o    284.1    4.2    0.0000   0.0000          ?        ?   809.0069  23.6253          ?        ?      284.1        4.2       ?       ? 
1 1 1   51   19   11 o    363.1    4.5    0.0000   0.0000          ?        ?  1321.7397  32.5646          ?        ?      363.1        4.5       ?       ? 
1 1 1   51   19   12 o    188.9    3.7    0.0000   0.0000          ?        ?   357.5721  14.0475          ?        ?      188.9        3.7       ?       ? 
1 1 1   51   19   13 o    200.8    4.0    0.0000   0.0000          ?        ?   404.1842  15.9630          ?        ?      200.8        4.0       ?       ? 
1 1 1   51   19   14 o    239.0    3.7    0.0000   0.0000          ?        ?   572.1154  17.8786          ?        ?      239.0        3.7       ?       ? 
1 1 1   51   19   15 o    158.7    5.0    0.0000   0.0000          ?        ?   252.8546  15.9630          ?        ?      158.7        5.0       ?       ? 
1 1 1   51   19   16 o    293.6    3.7    0.0000   0.0000          ?        ?   863.9198  21.7097          ?        ?      293.6        3.7       ?       ? 
1 1 1   51   19   17 o    340.4    3.7    0.0000   0.0000          ?        ?  1160.8323  24.9023          ?        ?      340.4        3.7       ?       ? 
1 1 1   51   19   18 o    177.4    5.6    0.0000   0.0000          ?        ?   316.0682  19.7942          ?        ?      177.4        5.6       ?       ? 
1 1 1   51   19   19 o    288.9    2.8    0.0000   0.0000          ?        ?   835.8248  15.9630          ?        ?      288.9        2.8       ?       ? 
1 1 1   51   19   20 o    341.2    2.8    0.0000   0.0000          ?        ?  1165.9406  19.1556          ?        ?      341.2        2.8       ?       ? 
1 1 1   51   19   21 o    270.4    2.8    0.0000   0.0000          ?        ?   732.3843  15.3245          ?        ?      270.4        2.8       ?       ? 
1 1 1   51   19   22 o    214.0    3.7    0.0000   0.0000          ?        ?   459.0970  15.9630          ?        ?      214.0        3.7       ?       ? 
1 1 1   51   19   23 o     84.0    8.7    0.0000   0.0000          ?        ?    71.5144  14.6860          ?        ?       84.0        8.7       ?       ? 
1 1 1   51   19   24 o    213.5    3.7    0.0000   0.0000          ?        ?   457.1815  15.9630          ?        ?      213.5        3.7       ?       ? 
1 1 1   51   19   25 o    122.1    5.8    0.0000   0.0000          ?        ?   150.0526  14.0475          ?        ?      122.1        5.8       ?       ? 
1 1 1   51   19   26 o    188.6    4.1    0.0000   0.0000          ?        ?   356.9336  15.3245          ?        ?      188.6        4.1       ?       ? 
1 1 1   51   19   27 o    138.6    5.5    0.0000   0.0000          ?        ?   193.4720  15.3245          ?        ?      138.6        5.5       ?       ? 
1 1 1   51   20    0 o    241.6    5.4  585.5243  26.1794   585.5243  26.1794   585.5243  26.1794      241.6      5.4      241.6        5.4     0.0     0.0 
1 1 1   51   20    1 o    101.6    7.9    0.0000   0.0000          ?        ?   104.0790  15.9630          ?        ?      101.6        7.9       ?       ? 
1 1 1   51   20    2 o    100.9   10.8    0.0000   0.0000          ?        ?   103.4405  21.7097          ?        ?      100.9       10.8       ?       ? 
1 1 1   51   20    3 o    492.2    4.9    0.0000   0.0000          ?        ?  2430.8518  48.5276          ?        ?      492.2        4.9       ?       ? 
1 1 1   51   20    4 o    251.6    4.9    0.0000   0.0000          ?        ?   635.3290  24.9023          ?        ?      251.6        4.9       ?       ? 
1 1 1   51   20    5 o    331.0    4.6    0.0000   0.0000          ?        ?  1098.8958  30.6490          ?        ?      331.0        4.6       ?       ? 
1 1 1   51   20    6 f     94.0    9.5    0.0000   0.0000          ?        ?    89.3930  17.8786          ?        ?       94.0        9.5       ?       ? 
1 1 1   51   20    7 o     86.5   10.3    0.0000   0.0000          ?        ?    75.9841  17.8786          ?        ?       86.5       10.3       ?       ? 
1 1 1   51   20    8 o    126.1    7.6    0.0000   0.0000          ?        ?   160.2689  19.1556          ?        ?      126.1        7.6       ?       ? 
1 1 1   51   20    9 o    105.1    9.1    0.0000   0.0000          ?        ?   111.7413  19.1556          ?        ?      105.1        9.1       ?       ? 
1 1 1   51   20   10 o    295.8    5.0    0.0000   0.0000          ?        ?   877.9672  29.3720          ?        ?      295.8        5.0       ?       ? 
1 1 1   51   20   11 o    154.3    6.4    0.0000   0.0000          ?        ?   239.4456  19.7942          ?        ?      154.3        6.4       ?       ? 
1 1 1   51   20   12 o    276.5    4.2    0.0000   0.0000          ?        ?   766.2260  22.9868          ?        ?      276.5        4.2       ?       ? 
1 1 1   51   20   13 o     29.7   12.9    0.0000   0.0000          ?        ?    -1.2770  14.0475          ?        ?       29.7       12.9       ?       ? 
1 1 1   51   20   14 o    176.8    4.3    0.0000   0.0000          ?        ?   313.5141  15.3245          ?        ?      176.8        4.3       ?       ? 
1 1 1   51   20   15 o    162.1    4.9    0.0000   0.0000          ?        ?   263.7094  15.9630          ?        ?      162.1        4.9       ?       ? 
1 1 1   51   20   16 o    213.6    3.7    0.0000   0.0000          ?        ?   457.1815  15.9630          ?        ?      213.6        3.7       ?       ? 
1 1 1   51   20   17 o    135.7    5.6    0.0000   0.0000          ?        ?   185.1713  15.3245          ?        ?      135.7        5.6       ?       ? 
1 1 1   51   20   18 o     32.6   14.0    0.0000   0.0000          ?        ?    -0.6385  16.6016          ?        ?       32.6       14.0       ?       ? 
1 1 1   51   20   19 o     98.9    8.1    0.0000   0.0000          ?        ?    98.9709  15.9630          ?        ?       98.9        8.1       ?       ? 
1 1 1   51   20   20 o    104.8    7.9    0.0000   0.0000          ?        ?   111.1028  16.6016          ?        ?      104.8        7.9       ?       ? 
1 1 1   51   20   21 o     98.5    5.8    0.0000   0.0000          ?        ?    97.6938  11.4934          ?        ?       98.5        5.8       ?       ? 
1 1 1   51   20   22 o    131.5    4.9    0.0000   0.0000          ?        ?   173.6779  12.7704          ?        ?      131.5        4.9       ?       ? 
1 1 1   51   20   23 o     89.1    7.9    0.0000   0.0000          ?        ?    80.4537  14.0475          ?        ?       89.1        7.9       ?       ? 
1 1 1   51   20   24 o     35.6   13.3    0.0000   0.0000          ?        ?    10.2163  12.7704          ?        ?       35.6       13.3       ?       ? 
1 1 1   51   20   25 o     19.1    9.4    0.0000   0.0000          ?        ?   -26.8179  12.7704          ?        ?       19.1        9.4       ?       ? 
1 1 1   51   21    0 o    187.5    7.0  354.3795  26.1794   354.3795  26.1794   354.3795  26.1794      187.5      7.0      187.5        7.0     0.0     0.0 
1 1 1   51   21    1 f    524.7    4.5    0.0000   0.0000          ?        ?  2761.6060  47.2506          ?        ?      524.7        4.5       ?       ? 
1 1 1   51   21    2 o    311.9    4.5    0.0000   0.0000          ?        ?   975.6611  28.0950          ?        ?      311.9        4.5       ?       ? 
1 1 1   51   21    3 o    246.0    4.8    0.0000   0.0000          ?        ?   607.2341  23.6253          ?        ?      246.0        4.8       ?       ? 
1 1 1   51   21    4 o    232.2    4.4    0.0000   0.0000          ?        ?   540.8278  20.4327          ?        ?      232.2        4.4       ?       ? 
1 1 1   51   21    5 o    253.5    4.7    0.0000   0.0000          ?        ?   644.9069  23.6253          ?        ?      253.5        4.7       ?       ? 
1 1 1   51   21    6 o    307.3    4.6    0.0000   0.0000          ?        ?   947.5660  28.0950          ?        ?      307.3        4.6       ?       ? 
1 1 1   51   21    7 o    216.8    5.3    0.0000   0.0000          ?        ?   471.8675  22.9868          ?        ?      216.8        5.3       ?       ? 
1 1 1   51   21    8 o    232.1    5.2    0.0000   0.0000          ?        ?   540.8278  24.2638          ?        ?      232.1        5.2       ?       ? 
1 1 1   51   21    9 o    142.9    6.7    0.0000   0.0000          ?        ?   205.6040  19.1556          ?        ?      142.9        6.7       ?       ? 
1 1 1   51   21   10 o    135.2    7.6    0.0000   0.0000          ?        ?   184.5327  20.4327          ?        ?      135.2        7.6       ?       ? 
1 1 1   51   21   11 o    124.2    9.5    0.0000   0.0000          ?        ?   156.4378  23.6253          ?        ?      124.2        9.5       ?       ? 
1 1 1   51   21   12 o    225.4    5.8    0.0000   0.0000          ?        ?   510.8173  26.1794          ?        ?      225.4        5.8       ?       ? 
1 1 1   51   21   13 o    190.9    6.9    0.0000   0.0000          ?        ?   367.1499  26.1794          ?        ?      190.9        6.9       ?       ? 
1 1 1   51   21   14 o     27.9   12.2    0.0000   0.0000          ?        ?    -1.9156  12.7704          ?        ?       27.9       12.2       ?       ? 
1 1 1   51   21   15 o     18.6    9.2    0.0000   0.0000          ?        ?   -29.3720  12.7704          ?        ?       18.6        9.2       ?       ? 
1 1 1   51   21   16 o     22.3   10.8    0.0000   0.0000          ?        ?   -22.9868  14.6860          ?        ?       22.3       10.8       ?       ? 
1 1 1   51   21   17 o    104.6    7.3    0.0000   0.0000          ?        ?   110.4642  15.3245          ?        ?      104.6        7.3       ?       ? 
1 1 1   51   21   18 o     78.1   11.4    0.0000   0.0000          ?        ?    62.5751  17.8786          ?        ?       78.1       11.4       ?       ? 
1 1 1   51   21   19 f    223.3    3.9    0.0000   0.0000          ?        ?   499.9625  17.2401          ?        ?      223.3        3.9       ?       ? 
1 1 1   51   21   20 o    292.8    3.8    0.0000   0.0000          ?        ?   860.0886  22.3483          ?        ?      292.8        3.8       ?       ? 
1 1 1   51   21   21 o    299.4    3.3    0.0000   0.0000          ?        ?   898.3999  19.7942          ?        ?      299.4        3.3       ?       ? 
1 1 1   51   21   22 o    135.3    4.2    0.0000   0.0000          ?        ?   183.8942  11.4934          ?        ?      135.3        4.2       ?       ? 
1 1 1   51   22    0 o    140.8    9.4  202.4114  26.1794   202.4114  26.1794   202.4114  26.1794      140.8      9.4      140.8        9.4     0.0     0.0 
1 1 1   51   22    1 o    377.9    4.2    0.0000   0.0000          ?        ?  1432.2040  31.9261          ?        ?      377.9        4.2       ?       ? 
1 1 1   51   22    2 o    219.8    4.9    0.0000   0.0000          ?        ?   485.2764  21.7097          ?        ?      219.8        4.9       ?       ? 
1 1 1   51   22    3 o     41.9   15.3    0.0000   0.0000          ?        ?    15.3245  16.6016          ?        ?       41.9       15.3       ?       ? 
1 1 1   51   22    4 o    216.3    5.0    0.0000   0.0000          ?        ?   469.9519  21.7097          ?        ?      216.3        5.0       ?       ? 
1 1 1   51   22    5 o    338.1    4.2    0.0000   0.0000          ?        ?  1146.7849  28.7335          ?        ?      338.1        4.2       ?       ? 
1 1 1   51   22    6 o    167.6    5.3    0.0000   0.0000          ?        ?   282.2266  17.8786          ?        ?      167.6        5.3       ?       ? 
1 1 1   51   22    7 o    169.3    5.1    0.0000   0.0000          ?        ?   287.9732  17.2401          ?        ?      169.3        5.1       ?       ? 
1 1 1   51   22    8 o     26.0   12.2    0.0000   0.0000          ?        ?   -17.8786  16.6016          ?        ?       26.0       12.2       ?       ? 
1 1 1   51   22    9 o     84.4   11.0    0.0000   0.0000          ?        ?    72.7915  18.5171          ?        ?       84.4       11.0       ?       ? 
1 1 1   51   22   10 o    161.8    6.3    0.0000   0.0000          ?        ?   263.7094  20.4327          ?        ?      161.8        6.3       ?       ? 
1 1 1   51   22   11 o    163.3    6.6    0.0000   0.0000          ?        ?   268.8176  21.7097          ?        ?      163.3        6.6       ?       ? 
1 1 1   51   22   12 o    178.3    5.7    0.0000   0.0000          ?        ?   319.8993  20.4327          ?        ?      178.3        5.7       ?       ? 
1 1 1   51   22   13 o     55.5   15.9    0.0000   0.0000          ?        ?    33.2031  18.5171          ?        ?       55.5       15.9       ?       ? 
1 1 1   51   22   14 o    308.3    4.5    0.0000   0.0000          ?        ?   953.9513  27.4564          ?        ?      308.3        4.5       ?       ? 
1 1 1   51   22   15 o    112.6    6.2    0.0000   0.0000          ?        ?   127.7043  14.0475          ?        ?      112.6        6.2       ?       ? 
1 1 1   51   22   16 o    142.2    4.7    0.0000   0.0000          ?        ?   203.0499  13.4090          ?        ?      142.2        4.7       ?       ? 
1 1 1   51   22   17 o    131.9    5.3    0.0000   0.0000          ?        ?   174.9549  14.0475          ?        ?      131.9        5.3       ?       ? 
1 1 1   51   22   18 o    124.5    5.1    0.0000   0.0000          ?        ?   155.7993  12.7704          ?        ?      124.5        5.1       ?       ? 
1 1 1   51   23    0 o     16.4   12.2  -60.0210  24.9023   -60.0210  24.9023   -60.0210  24.9023       16.4     12.2       16.4       12.2     0.0     0.0 
1 1 1   51   23    1 o     51.4   15.1    0.0000   0.0000          ?        ?    28.0950  16.6016          ?        ?       51.4       15.1       ?       ? 
1 1 1   51   23    2 o    184.5    5.4    0.0000   0.0000          ?        ?   342.2476  19.7942          ?        ?      184.5        5.4       ?       ? 
1 1 1   51   23    3 o    192.0    5.0    0.0000   0.0000          ?        ?   370.3425  19.1556          ?        ?      192.0        5.0       ?       ? 
1 1 1   51   23    4 o     94.8    9.4    0.0000   0.0000          ?        ?    91.3086  17.8786          ?        ?       94.8        9.4       ?       ? 
1 1 1   51   23    5 o    238.3    4.8    0.0000   0.0000          ?        ?   570.1998  22.9868          ?        ?      238.3        4.8       ?       ? 
1 1 1   51   23    6 o     94.1   11.2    0.0000   0.0000          ?        ?    90.6701  21.0712          ?        ?       94.1       11.2       ?       ? 
1 1 1   51   23    7 o    124.7    8.7    0.0000   0.0000          ?        ?   157.7148  21.7097          ?        ?      124.7        8.7       ?       ? 
1 1 1   51   23    8 o    181.2    6.0    0.0000   0.0000          ?        ?   330.7542  21.7097          ?        ?      181.2        6.0       ?       ? 
1 1 1   51   23    9 o    114.8    9.5    0.0000   0.0000          ?        ?   134.0895  21.7097          ?        ?      114.8        9.5       ?       ? 
1 1 1   51   23   10 o    197.9    5.3    0.0000   0.0000          ?        ?   393.9678  21.0712          ?        ?      197.9        5.3       ?       ? 
1 1 1   51   23   11 o    108.1    9.2    0.0000   0.0000          ?        ?   118.7650  19.7942          ?        ?      108.1        9.2       ?       ? 
1 1 1   51   23   12 o     65.5   14.9    0.0000   0.0000          ?        ?    46.6121  19.1556          ?        ?       65.5       14.9       ?       ? 
1 1 1   51   23   13 o    291.5    4.9    0.0000   0.0000          ?        ?   854.3420  28.7335          ?        ?      291.5        4.9       ?       ? 
1 1 1   51   24    0 o    139.9    7.6  198.5802  21.0712   198.5802  21.0712   198.5802  21.0712      139.9      7.6      139.9        7.6     0.0     0.0 
1 1 1   51   24    1 o    180.3    5.0    0.0000   0.0000          ?        ?   326.9231  17.8786          ?        ?      180.3        5.0       ?       ? 
1 1 1   51   24    2 o    140.4    5.9    0.0000   0.0000          ?        ?   198.5802  16.6016          ?        ?      140.4        5.9       ?       ? 
1 1 1   51   24    3 o     96.5    8.3    0.0000   0.0000          ?        ?    94.5012  15.9630          ?        ?       96.5        8.3       ?       ? 
1 1 1   51   24    4 o    110.5    8.1    0.0000   0.0000          ?        ?   123.8732  17.8786          ?        ?      110.5        8.1       ?       ? 
1 1 1   51   24    5 o    100.5   10.5    0.0000   0.0000          ?        ?   103.4405  21.0712          ?        ?      100.5       10.5       ?       ? 
1 1 1   51   24    6 o    304.5    5.0    0.0000   0.0000          ?        ?   932.2416  30.6490          ?        ?      304.5        5.0       ?       ? 
1 1 1   52    0    0 o     46.8   22.8   32.5646  24.9023    32.5646  24.9023    32.5646  24.9023       46.8     22.8       46.8       22.8     0.0     0.0 
1 1 1   52    0    1 o     26.4   16.2    6.3852  15.9630     6.3852  15.9630     6.3852  15.9630       26.4     16.2       26.4       16.2     0.0     0.0 
1 1 1   52    0    2 o    142.7    6.1  204.9654  17.2401   204.9654  17.2401   204.9654  17.2401      142.7      6.1      142.7        6.1     0.0     0.0 
1 1 1   52    0    3 o    107.9    8.7  118.7650  18.5171   118.7650  18.5171   118.7650  18.5171      107.9      8.7      107.9        8.7     0.0     0.0 
1 1 1   52    0    4 o    335.7    3.7 1127.6293  24.9023  1127.6293  24.9023  1127.6293  24.9023      335.7      3.7      335.7        3.7     0.0     0.0 
1 1 1   52    0    5 o    136.7    6.8  188.3639  18.5171   188.3639  18.5171   188.3639  18.5171      136.7      6.8      136.7        6.8     0.0     0.0 
1 1 1   52    0    6 o    262.8    3.9  691.5189  20.4327   691.5189  20.4327   691.5189  20.4327      262.8      3.9      262.8        3.9     0.0     0.0 
1 1 1   52    0    7 o    476.9    3.6 2275.0525  34.4802  2275.0525  34.4802  2275.0525  34.4802      476.9      3.6      476.9        3.6     0.0     0.0 
1 1 1   52    0    8 o    182.1    5.4  332.6698  19.7942   332.6698  19.7942   332.6698  19.7942      182.1      5.4      182.1        5.4     0.0     0.0 
1 1 1   52    0    9 o     83.5   11.0   73.4300  17.8786    73.4300  17.8786    73.4300  17.8786       83.5     11.0       83.5       11.0     0.0     0.0 
1 1 1   52    0   10 o    463.0    3.7 2144.7942  34.4802  2144.7942  34.4802  2144.7942  34.4802      463.0      3.7      463.0        3.7     0.0     0.0 
1 1 1   52    0   11 o    457.2    3.8 2091.1584  34.4802  2091.1584  34.4802  2091.1584  34.4802      457.2      3.8      457.2        3.8     0.0     0.0 
1 1 1   52    0   12 o    408.0    3.8 1665.2643  30.6490  1665.2643  30.6490  1665.2643  30.6490      408.0      3.8      408.0        3.8     0.0     0.0 
1 1 1   52    0   13 o    239.2    4.1  572.7539  19.7942   572.7539  19.7942   572.7539  19.7942      239.2      4.1      239.2        4.1     0.0     0.0 
1 1 1   52    0   14 o    395.0    3.8 1561.1854  30.0105  1561.1854  30.0105  1561.1854  30.0105      395.0      3.8      395.0        3.8     0.0     0.0 
1 1 1   52    0   15 o    505.9    3.9 2560.4717  39.5883  2560.4717  39.5883  2560.4717  39.5883      505.9      3.9      505.9        3.9     0.0     0.0 
1 1 1   52    0   16 o    226.9    4.8  515.9255  21.7097   515.9255  21.7097   515.9255  21.7097      226.9      4.8      226.9        4.8     0.0     0.0 
1 1 1   52    0   17 o    383.0    3.8 1467.9612  29.3720  1467.9612  29.3720  1467.9612  29.3720      383.0      3.8      383.0        3.8     0.0     0.0 
1 1 1   52    0   18 o     25.7   16.6    1.2770  19.1556     1.2770  19.1556     1.2770  19.1556       25.7     16.6       25.7       16.6     0.0     0.0 
1 1 1   52    0   19 o     17.5   12.6  -24.2638  18.5171   -24.2638  18.5171   -24.2638  18.5171       17.5     12.6       17.5       12.6     0.0     0.0 
1 1 1   52    0   20 o     18.6   13.2  -19.1556  18.5171   -19.1556  18.5171   -19.1556  18.5171       18.6     13.2       18.6       13.2     0.0     0.0 
1 1 1   52    0   21 o    461.2    3.9 2128.1924  35.7572  2128.1924  35.7572  2128.1924  35.7572      461.2      3.9      461.2        3.9     0.0     0.0 
1 1 1   52    0   22 o     14.2   10.5  -52.9973  19.7942   -52.9973  19.7942   -52.9973  19.7942       14.2     10.5       14.2       10.5     0.0     0.0 
1 1 1   52    0   23 o     14.2   10.6  -52.3588  19.7942   -52.3588  19.7942   -52.3588  19.7942       14.2     10.6       14.2       10.6     0.0     0.0 
1 1 1   52    0   24 o    279.4    4.0  781.5505  22.3483   781.5505  22.3483   781.5505  22.3483      279.4      4.0      279.4        4.0     0.0     0.0 
1 1 1   52    0   25 o     18.3   13.2  -29.3720  21.0712   -29.3720  21.0712   -29.3720  21.0712       18.3     13.2       18.3       13.2     0.0     0.0 
1 1 1   52    0   26 o    198.7    5.3  395.8834  21.0712   395.8834  21.0712   395.8834  21.0712      198.7      5.3      198.7        5.3     0.0     0.0 
1 1 1   52    0   27 o     13.6   10.1  -54.9129  19.1556   -54.9129  19.1556   -54.9129  19.1556       13.6     10.1       13.6       10.1     0.0     0.0 
1 1 1   52    0   28 o     45.8   20.5   30.6490  19.7942    30.6490  19.7942    30.6490  19.7942       45.8     20.5       45.8       20.5     0.0     0.0 
1 1 1   52    0   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   52    0   30 o    152.2    7.4  233.6989  22.3483   233.6989  22.3483   233.6989  22.3483      152.2      7.4      152.2        7.4     0.0     0.0 
1 1 1   52    0   31 o    113.1    9.4  130.8969  21.0712   130.8969  21.0712   130.8969  21.0712      113.1      9.4      113.1        9.4     0.0     0.0 
1 1 1   52    0   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   52    0   33 o     14.0   10.4  -63.2136  21.0712   -63.2136  21.0712   -63.2136  21.0712       14.0     10.4       14.0       10.4     0.0     0.0 
1 1 1   52    0   34 o    204.1    6.0  418.2317  24.2638   418.2317  24.2638   418.2317  24.2638      204.1      6.0      204.1        6.0     0.0     0.0 
1 1 1   52    0   35 o    260.5    4.9  680.0255  25.5409   680.0255  25.5409   680.0255  25.5409      260.5      4.9      260.5        4.9     0.0     0.0 
1 1 1   52    0   36 o    461.2    3.9 2128.8311  36.3957  2128.8311  36.3957  2128.8311  36.3957      461.2      3.9      461.2        3.9     0.0     0.0 
1 1 1   52    0   37 o    177.8    6.5  317.9838  22.9868   317.9838  22.9868   317.9838  22.9868      177.8      6.5      177.8        6.5     0.0     0.0 
1 1 1   52    0   38 o    493.0    3.8 2432.7673  37.0343  2432.7673  37.0343  2432.7673  37.0343      493.0      3.8      493.0        3.8     0.0     0.0 
1 1 1   52    0   39 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   52    0   40 o    237.9    5.2  567.6458  24.9023   567.6458  24.9023   567.6458  24.9023      237.9      5.2      237.9        5.2     0.0     0.0 
1 1 1   52    0   41 o    204.9    6.4  422.0628  26.1794   422.0628  26.1794   422.0628  26.1794      204.9      6.4      204.9        6.4     0.0     0.0 
1 1 1   52    0   42 o     29.2   18.9    1.9156  24.9023     1.9156  24.9023     1.9156  24.9023       29.2     18.9       29.2       18.9     0.0     0.0 
1 1 1   52    0   43 o     97.0   12.5   99.6094  23.6253    99.6094  23.6253    99.6094  23.6253       97.0     12.5       97.0       12.5     0.0     0.0 
1 1 1   52    0   44 o    389.1    4.1 1515.8503  31.9261  1515.8503  31.9261  1515.8503  31.9261      389.1      4.1      389.1        4.1     0.0     0.0 
1 1 1   52    0   45 o    180.6    7.3  328.8386  26.1794   328.8386  26.1794   328.8386  26.1794      180.6      7.3      180.6        7.3     0.0     0.0 
1 1 1   52    0   46 o    272.1    4.7  741.9621  25.5409   741.9621  25.5409   741.9621  25.5409      272.1      4.7      272.1        4.7     0.0     0.0 
1 1 1   52    0   47 o     21.8   15.2  -18.5171  22.9868   -18.5171  22.9868   -18.5171  22.9868       21.8     15.2       21.8       15.2     0.0     0.0 
1 1 1   52    0   48 o    147.7    8.5  221.5670  24.9023   221.5670  24.9023   221.5670  24.9023      147.7      8.5      147.7        8.5     0.0     0.0 
1 1 1   52    0   49 o     18.0   13.2  -49.8047  25.5409   -49.8047  25.5409   -49.8047  25.5409       18.0     13.2       18.0       13.2     0.0     0.0 
1 1 1   52    0   50 f    153.1    8.6  238.1686  26.1794   238.1686  26.1794   238.1686  26.1794      153.1      8.6      153.1        8.6     0.0     0.0 
1 1 1   52    0   51 o    182.4    6.8  335.8624  24.9023   335.8624  24.9023   335.8624  24.9023      182.4      6.8      182.4        6.8     0.0     0.0 
1 1 1   52    1    0 o    635.3    4.6 4038.6492  58.1055  4038.6492  58.1055  4038.6492  58.1055      635.3      4.6      635.3        4.6     0.0     0.0 
1 1 1   52    1    1 o    151.3    4.2    0.0000   0.0000          ?        ?   229.2293  12.7704          ?        ?      151.3        4.2       ?       ? 
1 1 1   52    1    2 o    126.8    4.5    0.0000   0.0000          ?        ?   160.9075  11.4934          ?        ?      126.8        4.5       ?       ? 
1 1 1   52    1    3 o    160.2    4.0    0.0000   0.0000          ?        ?   256.6857  12.7704          ?        ?      160.2        4.0       ?       ? 
1 1 1   52    1    4 o    102.3    5.9    0.0000   0.0000          ?        ?   104.7175  12.1319          ?        ?      102.3        5.9       ?       ? 
1 1 1   52    1    5 o    371.2    2.7    0.0000   0.0000          ?        ?  1378.5681  19.7942          ?        ?      371.2        2.7       ?       ? 
1 1 1   52    1    6 o    227.7    2.9    0.0000   0.0000          ?        ?   518.4796  13.4090          ?        ?      227.7        2.9       ?       ? 
1 1 1   52    1    7 o     90.0    6.4    0.0000   0.0000          ?        ?    81.0922  11.4934          ?        ?       90.0        6.4       ?       ? 
1 1 1   52    1    8 o    233.0    3.3    0.0000   0.0000          ?        ?   543.3819  15.3245          ?        ?      233.0        3.3       ?       ? 
1 1 1   52    1    9 o    246.2    2.9    0.0000   0.0000          ?        ?   606.5955  14.0475          ?        ?      246.2        2.9       ?       ? 
1 1 1   52    1   10 o    119.2    5.4    0.0000   0.0000          ?        ?   142.3903  12.7704          ?        ?      119.2        5.4       ?       ? 
1 1 1   52    1   11 o    210.6    3.3    0.0000   0.0000          ?        ?   443.7725  14.0475          ?        ?      210.6        3.3       ?       ? 
1 1 1   52    1   12 o    153.2    4.4    0.0000   0.0000          ?        ?   234.9760  13.4090          ?        ?      153.2        4.4       ?       ? 
1 1 1   52    1   13 o    455.2    2.9    0.0000   0.0000          ?        ?  2072.6414  26.1794          ?        ?      455.2        2.9       ?       ? 
1 1 1   52    1   14 o    336.3    2.8    0.0000   0.0000          ?        ?  1131.4603  18.5171          ?        ?      336.3        2.8       ?       ? 
1 1 1   52    1   15 o    190.2    3.7    0.0000   0.0000          ?        ?   362.0418  14.0475          ?        ?      190.2        3.7       ?       ? 
1 1 1   52    1   16 o    173.5    4.0    0.0000   0.0000          ?        ?   301.3822  14.0475          ?        ?      173.5        4.0       ?       ? 
1 1 1   52    1   17 o    438.0    3.1    0.0000   0.0000          ?        ?  1919.3960  27.4564          ?        ?      438.0        3.1       ?       ? 
1 1 1   52    1   18 o    274.8    2.9    0.0000   0.0000          ?        ?   755.3711  15.9630          ?        ?      274.8        2.9       ?       ? 
1 1 1   52    1   19 o     67.2    9.5    0.0000   0.0000          ?        ?    45.3350  12.7704          ?        ?       67.2        9.5       ?       ? 
1 1 1   52    1   20 o    289.3    3.0    0.0000   0.0000          ?        ?   837.1019  17.2401          ?        ?      289.3        3.0       ?       ? 
1 1 1   52    1   21 o     76.0    9.7    0.0000   0.0000          ?        ?    58.1055  14.6860          ?        ?       76.0        9.7       ?       ? 
1 1 1   52    1   22 o    395.3    2.7    0.0000   0.0000          ?        ?  1563.1010  21.0712          ?        ?      395.3        2.7       ?       ? 
1 1 1   52    1   23 o    230.6    3.3    0.0000   0.0000          ?        ?   531.8885  15.3245          ?        ?      230.6        3.3       ?       ? 
1 1 1   52    1   24 o    283.0    3.0    0.0000   0.0000          ?        ?   801.3447  17.2401          ?        ?      283.0        3.0       ?       ? 
1 1 1   52    1   25 o    426.4    2.5    0.0000   0.0000          ?        ?  1818.5095  21.7097          ?        ?      426.4        2.5       ?       ? 
1 1 1   52    1   26 o    314.7    2.8    0.0000   0.0000          ?        ?   990.9855  17.8786          ?        ?      314.7        2.8       ?       ? 
1 1 1   52    1   27 o     20.1    9.9    0.0000   0.0000          ?        ?   -30.0105  14.0475          ?        ?       20.1        9.9       ?       ? 
1 1 1   52    1   28 o    312.8    2.9    0.0000   0.0000          ?        ?   978.8537  17.8786          ?        ?      312.8        2.9       ?       ? 
1 1 1   52    1   29 o    267.0    3.1    0.0000   0.0000          ?        ?   713.2286  16.6016          ?        ?      267.0        3.1       ?       ? 
1 1 1   52    1   30 o    345.6    2.7    0.0000   0.0000          ?        ?  1194.6740  18.5171          ?        ?      345.6        2.7       ?       ? 
1 1 1   52    1   31 o     41.6   14.7    0.0000   0.0000          ?        ?    15.3245  15.3245          ?        ?       41.6       14.7       ?       ? 
1 1 1   52    1   32 o     56.1   13.7    0.0000   0.0000          ?        ?    33.2031  15.3245          ?        ?       56.1       13.7       ?       ? 
1 1 1   52    1   33 o    163.4    4.9    0.0000   0.0000          ?        ?   267.5406  15.9630          ?        ?      163.4        4.9       ?       ? 
1 1 1   52    1   34 o    165.7    4.8    0.0000   0.0000          ?        ?   275.2028  15.9630          ?        ?      165.7        4.8       ?       ? 
1 1 1   52    1   35 o    431.1    2.7    0.0000   0.0000          ?        ?  1859.3750  22.9868          ?        ?      431.1        2.7       ?       ? 
1 1 1   52    1   36 o    182.8    4.4    0.0000   0.0000          ?        ?   334.5853  15.9630          ?        ?      182.8        4.4       ?       ? 
1 1 1   52    1   37 o    282.2    3.2    0.0000   0.0000          ?        ?   796.8750  17.8786          ?        ?      282.2        3.2       ?       ? 
1 1 1   52    1   38 o    244.8    3.5    0.0000   0.0000          ?        ?   600.2103  17.2401          ?        ?      244.8        3.5       ?       ? 
1 1 1   52    1   39 o    178.7    4.8    0.0000   0.0000          ?        ?   319.8993  17.2401          ?        ?      178.7        4.8       ?       ? 
1 1 1   52    1   40 o     99.7    8.6    0.0000   0.0000          ?        ?   100.2479  17.2401          ?        ?       99.7        8.6       ?       ? 
1 1 1   52    1   41 o    158.6    5.2    0.0000   0.0000          ?        ?   252.2160  16.6016          ?        ?      158.6        5.2       ?       ? 
1 1 1   52    1   42 o    235.9    3.8    0.0000   0.0000          ?        ?   557.4294  17.8786          ?        ?      235.9        3.8       ?       ? 
1 1 1   52    1   43 o     21.7   10.8    0.0000   0.0000          ?        ?   -42.7809  17.8786          ?        ?       21.7       10.8       ?       ? 
1 1 1   52    1   44 o     55.9   15.5    0.0000   0.0000          ?        ?    33.2031  17.8786          ?        ?       55.9       15.5       ?       ? 
1 1 1   52    1   45 o     57.3   14.9    0.0000   0.0000          ?        ?    35.1187  17.2401          ?        ?       57.3       14.9       ?       ? 
1 1 1   52    1   46 o    176.6    4.9    0.0000   0.0000          ?        ?   312.8756  17.2401          ?        ?      176.6        4.9       ?       ? 
1 1 1   52    1   47 o     72.4   11.9    0.0000   0.0000          ?        ?    53.6358  17.2401          ?        ?       72.4       11.9       ?       ? 
1 1 1   52    1   48 o    111.9    7.7    0.0000   0.0000          ?        ?   126.4273  17.2401          ?        ?      111.9        7.7       ?       ? 
1 1 1   52    1   49 o    193.7    4.6    0.0000   0.0000          ?        ?   376.7278  17.8786          ?        ?      193.7        4.6       ?       ? 
1 1 1   52    1   50 o     62.1   13.7    0.0000   0.0000          ?        ?    41.5039  16.6016          ?        ?       62.1       13.7       ?       ? 
1 1 1   52    2    0 o     18.0   12.7  -17.8786  17.2401   -17.8786  17.2401   -17.8786  17.2401       18.0     12.7       18.0       12.7     0.0     0.0 
1 1 1   52    2    1 o    113.8    5.3    0.0000   0.0000          ?        ?   129.6199  12.1319          ?        ?      113.8        5.3       ?       ? 
1 1 1   52    2    2 o    153.4    4.2    0.0000   0.0000          ?        ?   235.6145  12.7704          ?        ?      153.4        4.2       ?       ? 
1 1 1   52    2    3 o    246.5    3.2    0.0000   0.0000          ?        ?   607.8726  15.9630          ?        ?      246.5        3.2       ?       ? 
1 1 1   52    2    4 o    256.2    2.9    0.0000   0.0000          ?        ?   656.4003  14.6860          ?        ?      256.2        2.9       ?       ? 
1 1 1   52    2    5 o    347.0    2.9    0.0000   0.0000          ?        ?  1204.8903  19.7942          ?        ?      347.0        2.9       ?       ? 
1 1 1   52    2    6 o    167.4    4.0    0.0000   0.0000          ?        ?   280.3110  13.4090          ?        ?      167.4        4.0       ?       ? 
1 1 1   52    2    7 o    523.0    2.9    0.0000   0.0000          ?        ?  2736.7036  30.0105          ?        ?      523.0        2.9       ?       ? 
1 1 1   52    2    8 o    379.6    2.6    0.0000   0.0000          ?        ?  1441.7819  19.7942          ?        ?      379.6        2.6       ?       ? 
1 1 1   52    2    9 o    463.6    2.8    0.0000   0.0000          ?        ?  2149.9023  25.5409          ?        ?      463.6        2.8       ?       ? 
1 1 1   52    2   10 o    356.9    2.9    0.0000   0.0000          ?        ?  1274.4893  20.4327          ?        ?      356.9        2.9       ?       ? 
1 1 1   52    2   11 o    657.0    3.1    0.0000   0.0000          ?        ?  4318.9604  40.8654          ?        ?      657.0        3.1       ?       ? 
1 1 1   52    2   12 o    182.5    4.0    0.0000   0.0000          ?        ?   333.3083  14.6860          ?        ?      182.5        4.0       ?       ? 
1 1 1   52    2   13 o    288.2    2.9    0.0000   0.0000          ?        ?   830.7167  16.6016          ?        ?      288.2        2.9       ?       ? 
1 1 1   52    2   14 o    232.2    3.2    0.0000   0.0000          ?        ?   539.5508  14.6860          ?        ?      232.2        3.2       ?       ? 
1 1 1   52    2   15 o    316.0    2.8    0.0000   0.0000          ?        ?   999.2863  17.8786          ?        ?      316.0        2.8       ?       ? 
1 1 1   52    2   16 o    120.8    5.8    0.0000   0.0000          ?        ?   146.2215  14.0475          ?        ?      120.8        5.8       ?       ? 
1 1 1   52    2   17 o    265.0    3.0    0.0000   0.0000          ?        ?   702.3738  15.9630          ?        ?      265.0        3.0       ?       ? 
1 1 1   52    2   18 o     18.5    9.3    0.0000   0.0000          ?        ?   -37.6728  14.0475          ?        ?       18.5        9.3       ?       ? 
1 1 1   52    2   19 o    257.9    3.0    0.0000   0.0000          ?        ?   665.3395  15.3245          ?        ?      257.9        3.0       ?       ? 
1 1 1   52    2   20 o     32.0   12.9    0.0000   0.0000          ?        ?     4.4697  12.7704          ?        ?       32.0       12.9       ?       ? 
1 1 1   52    2   21 o    156.9    4.5    0.0000   0.0000          ?        ?   246.4693  14.0475          ?        ?      156.9        4.5       ?       ? 
1 1 1   52    2   22 o     43.2   14.4    0.0000   0.0000          ?        ?    17.8786  14.6860          ?        ?       43.2       14.4       ?       ? 
1 1 1   52    2   23 o    113.7    6.2    0.0000   0.0000          ?        ?   129.6199  14.0475          ?        ?      113.7        6.2       ?       ? 
1 1 1   52    2   24 o    237.9    3.1    0.0000   0.0000          ?        ?   566.3687  14.6860          ?        ?      237.9        3.1       ?       ? 
1 1 1   52    2   25 o    139.2    5.3    0.0000   0.0000          ?        ?   194.1106  14.6860          ?        ?      139.2        5.3       ?       ? 
1 1 1   52    2   26 o    134.5    5.2    0.0000   0.0000          ?        ?   181.3401  14.0475          ?        ?      134.5        5.2       ?       ? 
1 1 1   52    2   27 o     33.8   13.8    0.0000   0.0000          ?        ?     4.4697  14.6860          ?        ?       33.8       13.8       ?       ? 
1 1 1   52    2   28 o    129.0    5.7    0.0000   0.0000          ?        ?   166.6541  14.6860          ?        ?      129.0        5.7       ?       ? 
1 1 1   52    2   29 o    256.6    3.2    0.0000   0.0000          ?        ?   658.9543  16.6016          ?        ?      256.6        3.2       ?       ? 
1 1 1   52    2   30 o    428.0    2.6    0.0000   0.0000          ?        ?  1832.5571  22.3483          ?        ?      428.0        2.6       ?       ? 
1 1 1   52    2   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   52    2   32 o     17.0    8.6    0.0000   0.0000          ?        ?   -52.3588  14.6860          ?        ?       17.0        8.6       ?       ? 
1 1 1   52    2   33 o    341.8    2.9    0.0000   0.0000          ?        ?  1169.1332  19.7942          ?        ?      341.8        2.9       ?       ? 
1 1 1   52    2   34 o    330.5    2.8    0.0000   0.0000          ?        ?  1093.1490  18.5171          ?        ?      330.5        2.8       ?       ? 
1 1 1   52    2   35 o    378.3    2.8    0.0000   0.0000          ?        ?  1432.2040  21.0712          ?        ?      378.3        2.8       ?       ? 
1 1 1   52    2   36 o    184.0    4.5    0.0000   0.0000          ?        ?   339.0550  16.6016          ?        ?      184.0        4.5       ?       ? 
1 1 1   52    2   37 o    173.6    5.2    0.0000   0.0000          ?        ?   302.0207  17.8786          ?        ?      173.6        5.2       ?       ? 
1 1 1   52    2   38 o    216.3    3.8    0.0000   0.0000          ?        ?   468.6749  16.6016          ?        ?      216.3        3.8       ?       ? 
1 1 1   52    2   39 o     46.2   15.7    0.0000   0.0000          ?        ?    20.4327  17.2401          ?        ?       46.2       15.7       ?       ? 
1 1 1   52    2   40 f    191.2    4.5    0.0000   0.0000          ?        ?   366.5114  17.2401          ?        ?      191.2        4.5       ?       ? 
1 1 1   52    2   41 o     64.6   13.3    0.0000   0.0000          ?        ?    44.0580  16.6016          ?        ?       64.6       13.3       ?       ? 
1 1 1   52    2   42 o    171.8    5.4    0.0000   0.0000          ?        ?   296.2740  18.5171          ?        ?      171.8        5.4       ?       ? 
1 1 1   52    2   43 o     45.4   15.9    0.0000   0.0000          ?        ?    19.1556  17.8786          ?        ?       45.4       15.9       ?       ? 
1 1 1   52    2   44 o    196.9    4.5    0.0000   0.0000          ?        ?   388.8597  17.8786          ?        ?      196.9        4.5       ?       ? 
1 1 1   52    2   45 o    166.3    5.2    0.0000   0.0000          ?        ?   277.7569  17.2401          ?        ?      166.3        5.2       ?       ? 
1 1 1   52    2   46 o    121.4    7.4    0.0000   0.0000          ?        ?   148.7755  17.8786          ?        ?      121.4        7.4       ?       ? 
1 1 1   52    2   47 o     22.1   10.9    0.0000   0.0000          ?        ?   -36.3957  17.2401          ?        ?       22.1       10.9       ?       ? 
1 1 1   52    2   48 o     34.8   14.5    0.0000   0.0000          ?        ?     3.8311  16.6016          ?        ?       34.8       14.5       ?       ? 
1 1 1   52    2   49 o    229.4    3.9    0.0000   0.0000          ?        ?   528.0574  17.8786          ?        ?      229.4        3.9       ?       ? 
1 1 1   52    2   50 o    223.5    4.0    0.0000   0.0000          ?        ?   501.2395  17.8786          ?        ?      223.5        4.0       ?       ? 
1 1 1   52    3    0 o    181.7    5.5  331.3927  19.7942   331.3927  19.7942   331.3927  19.7942      181.7      5.5      181.7        5.5     0.0     0.0 
1 1 1   52    3    1 o    401.6    2.8    0.0000   0.0000          ?        ?  1613.5442  22.3483          ?        ?      401.6        2.8       ?       ? 
1 1 1   52    3    2 o    240.5    3.1    0.0000   0.0000          ?        ?   578.5006  14.6860          ?        ?      240.5        3.1       ?       ? 
1 1 1   52    3    3 o    156.9    4.1    0.0000   0.0000          ?        ?   246.4693  12.7704          ?        ?      156.9        4.1       ?       ? 
1 1 1   52    3    4 o    535.3    2.9    0.0000   0.0000          ?        ?  2866.9622  31.2876          ?        ?      535.3        2.9       ?       ? 
1 1 1   52    3    5 o    314.1    2.7    0.0000   0.0000          ?        ?   987.1545  17.2401          ?        ?      314.1        2.7       ?       ? 
1 1 1   52    3    6 o    347.2    2.7    0.0000   0.0000          ?        ?  1206.1674  18.5171          ?        ?      347.2        2.7       ?       ? 
1 1 1   52    3    7 o    308.5    2.8    0.0000   0.0000          ?        ?   952.0358  17.2401          ?        ?      308.5        2.8       ?       ? 
1 1 1   52    3    8 o    339.3    2.7    0.0000   0.0000          ?        ?  1151.8929  18.5171          ?        ?      339.3        2.7       ?       ? 
1 1 1   52    3    9 o     86.7    7.0    0.0000   0.0000          ?        ?    75.3456  12.1319          ?        ?       86.7        7.0       ?       ? 
1 1 1   52    3   10 o     92.4    6.9    0.0000   0.0000          ?        ?    85.5619  12.7704          ?        ?       92.4        6.9       ?       ? 
1 1 1   52    3   11 o    387.0    2.7    0.0000   0.0000          ?        ?  1497.9718  21.0712          ?        ?      387.0        2.7       ?       ? 
1 1 1   52    3   12 o    425.2    2.7    0.0000   0.0000          ?        ?  1808.9316  22.9868          ?        ?      425.2        2.7       ?       ? 
1 1 1   52    3   13 o    391.8    2.8    0.0000   0.0000          ?        ?  1535.6445  21.7097          ?        ?      391.8        2.8       ?       ? 
1 1 1   52    3   14 o    226.2    3.2    0.0000   0.0000          ?        ?   512.0943  14.6860          ?        ?      226.2        3.2       ?       ? 
1 1 1   52    3   15 o    153.6    4.6    0.0000   0.0000          ?        ?   236.2530  14.0475          ?        ?      153.6        4.6       ?       ? 
1 1 1   52    3   16 o     98.7    6.5    0.0000   0.0000          ?        ?    97.6938  12.7704          ?        ?       98.7        6.5       ?       ? 
1 1 1   52    3   17 o    166.2    4.4    0.0000   0.0000          ?        ?   276.4799  14.6860          ?        ?      166.2        4.4       ?       ? 
1 1 1   52    3   18 f    121.9    5.2    0.0000   0.0000          ?        ?   148.7755  12.7704          ?        ?      121.9        5.2       ?       ? 
1 1 1   52    3   19 o    240.0    3.2    0.0000   0.0000          ?        ?   576.5850  15.3245          ?        ?      240.0        3.2       ?       ? 
1 1 1   52    3   20 f    240.0    3.2    0.0000   0.0000          ?        ?   576.5850  15.3245          ?        ?      240.0        3.2       ?       ? 
1 1 1   52    3   21 o    104.0    7.1    0.0000   0.0000          ?        ?   108.5487  14.6860          ?        ?      104.0        7.1       ?       ? 
1 1 1   52    3   22 o    471.1    2.8    0.0000   0.0000          ?        ?  2220.1399  26.1794          ?        ?      471.1        2.8       ?       ? 
1 1 1   52    3   23 o    257.2    3.1    0.0000   0.0000          ?        ?   662.1469  15.9630          ?        ?      257.2        3.1       ?       ? 
1 1 1   52    3   24 o    413.4    2.6    0.0000   0.0000          ?        ?  1709.9608  21.7097          ?        ?      413.4        2.6       ?       ? 
1 1 1   52    3   25 o    187.1    4.1    0.0000   0.0000          ?        ?   350.5484  15.3245          ?        ?      187.1        4.1       ?       ? 
1 1 1   52    3   26 o    213.0    3.7    0.0000   0.0000          ?        ?   453.9889  15.9630          ?        ?      213.0        3.7       ?       ? 
1 1 1   52    3   27 o    401.8    2.5    0.0000   0.0000          ?        ?  1615.4597  19.7942          ?        ?      401.8        2.5       ?       ? 
1 1 1   52    3   28 o    187.8    4.1    0.0000   0.0000          ?        ?   353.1024  15.3245          ?        ?      187.8        4.1       ?       ? 
1 1 1   52    3   29 o    307.6    2.8    0.0000   0.0000          ?        ?   946.9276  17.2401          ?        ?      307.6        2.8       ?       ? 
1 1 1   52    3   30 o    233.7    3.4    0.0000   0.0000          ?        ?   546.5745  15.9630          ?        ?      233.7        3.4       ?       ? 
1 1 1   52    3   31 o    250.3    3.3    0.0000   0.0000          ?        ?   627.0282  16.6016          ?        ?      250.3        3.3       ?       ? 
1 1 1   52    3   32 o     23.4   11.3    0.0000   0.0000          ?        ?   -22.3483  15.3245          ?        ?       23.4       11.3       ?       ? 
1 1 1   52    3   33 o    247.3    3.4    0.0000   0.0000          ?        ?   612.3422  16.6016          ?        ?      247.3        3.4       ?       ? 
1 1 1   52    3   34 o    186.9    4.4    0.0000   0.0000          ?        ?   349.9099  16.6016          ?        ?      186.9        4.4       ?       ? 
1 1 1   52    3   35 o    106.6    7.5    0.0000   0.0000          ?        ?   114.2954  15.9630          ?        ?      106.6        7.5       ?       ? 
1 1 1   52    3   36 o    303.7    2.9    0.0000   0.0000          ?        ?   923.3023  17.8786          ?        ?      303.7        2.9       ?       ? 
1 1 1   52    3   37 o    148.2    5.6    0.0000   0.0000          ?        ?   220.2900  16.6016          ?        ?      148.2        5.6       ?       ? 
1 1 1   52    3   38 o     46.6   15.1    0.0000   0.0000          ?        ?    21.7097  15.9630          ?        ?       46.6       15.1       ?       ? 
1 1 1   52    3   39 o    309.5    3.0    0.0000   0.0000          ?        ?   959.0594  18.5171          ?        ?      309.5        3.0       ?       ? 
1 1 1   52    3   40 o    122.2    6.8    0.0000   0.0000          ?        ?   150.0526  16.6016          ?        ?      122.2        6.8       ?       ? 
1 1 1   52    3   41 o     60.0   14.1    0.0000   0.0000          ?        ?    38.3113  16.6016          ?        ?       60.0       14.1       ?       ? 
1 1 1   52    3   42 o     26.4   12.4    0.0000   0.0000          ?        ?   -16.6016  16.6016          ?        ?       26.4       12.4       ?       ? 
1 1 1   52    3   43 o     34.3   14.5    0.0000   0.0000          ?        ?     1.2770  17.2401          ?        ?       34.3       14.5       ?       ? 
1 1 1   52    3   44 o    181.4    4.8    0.0000   0.0000          ?        ?   330.1157  17.2401          ?        ?      181.4        4.8       ?       ? 
1 1 1   52    3   45 o    191.1    4.8    0.0000   0.0000          ?        ?   366.5114  18.5171          ?        ?      191.1        4.8       ?       ? 
1 1 1   52    3   46 o     20.1   10.1    0.0000   0.0000          ?        ?   -47.8891  17.2401          ?        ?       20.1       10.1       ?       ? 
1 1 1   52    3   47 o     30.3   13.5    0.0000   0.0000          ?        ?    -5.7467  16.6016          ?        ?       30.3       13.5       ?       ? 
1 1 1   52    3   48 o    100.3    8.6    0.0000   0.0000          ?        ?   102.1635  17.2401          ?        ?      100.3        8.6       ?       ? 
1 1 1   52    3   49 o     49.8   15.6    0.0000   0.0000          ?        ?    26.1794  17.2401          ?        ?       49.8       15.6       ?       ? 
1 1 1   52    4    0 o    540.2    4.4 2919.9592  47.2506  2919.9592  47.2506  2919.9592  47.2506      540.2      4.4      540.2        4.4     0.0     0.0 
1 1 1   52    4    1 o    381.5    2.8    0.0000   0.0000          ?        ?  1455.8293  21.7097          ?        ?      381.5        2.8       ?       ? 
1 1 1   52    4    2 o    312.2    2.8    0.0000   0.0000          ?        ?   975.0225  17.2401          ?        ?      312.2        2.8       ?       ? 
1 1 1   52    4    3 o    544.2    3.2    0.0000   0.0000          ?        ?  2963.3789  34.4802          ?        ?      544.2        3.2       ?       ? 
1 1 1   52    4    4 o    421.8    3.0    0.0000   0.0000          ?        ?  1780.1982  25.5409          ?        ?      421.8        3.0       ?       ? 
1 1 1   52    4    5 o    175.0    3.6    0.0000   0.0000          ?        ?   306.4904  12.7704          ?        ?      175.0        3.6       ?       ? 
1 1 1   52    4    6 o    122.7    5.5    0.0000   0.0000          ?        ?   150.6911  13.4090          ?        ?      122.7        5.5       ?       ? 
1 1 1   52    4    7 o    281.5    2.9    0.0000   0.0000          ?        ?   793.0438  16.6016          ?        ?      281.5        2.9       ?       ? 
1 1 1   52    4    8 o    343.0    3.0    0.0000   0.0000          ?        ?  1176.7954  20.4327          ?        ?      343.0        3.0       ?       ? 
1 1 1   52    4    9 o    117.9    5.1    0.0000   0.0000          ?        ?   139.1977  12.1319          ?        ?      117.9        5.1       ?       ? 
1 1 1   52    4   10 o    237.8    3.0    0.0000   0.0000          ?        ?   565.7302  14.0475          ?        ?      237.8        3.0       ?       ? 
1 1 1   52    4   11 o     95.7    7.3    0.0000   0.0000          ?        ?    91.9471  14.0475          ?        ?       95.7        7.3       ?       ? 
1 1 1   52    4   12 o    337.2    2.9    0.0000   0.0000          ?        ?  1137.8455  19.7942          ?        ?      337.2        2.9       ?       ? 
1 1 1   52    4   13 o     27.3   12.2    0.0000   0.0000          ?        ?    -5.1082  13.4090          ?        ?       27.3       12.2       ?       ? 
1 1 1   52    4   14 f    107.1    6.3    0.0000   0.0000          ?        ?   114.9339  13.4090          ?        ?      107.1        6.3       ?       ? 
1 1 1   52    4   15 o    242.0    3.2    0.0000   0.0000          ?        ?   586.1629  15.3245          ?        ?      242.0        3.2       ?       ? 
1 1 1   52    4   16 o    222.1    3.2    0.0000   0.0000          ?        ?   493.5772  14.0475          ?        ?      222.1        3.2       ?       ? 
1 1 1   52    4   17 o    103.4    7.1    0.0000   0.0000          ?        ?   107.2716  14.6860          ?        ?      103.4        7.1       ?       ? 
1 1 1   52    4   18 o    150.7    4.7    0.0000   0.0000          ?        ?   227.3137  14.0475          ?        ?      150.7        4.7       ?       ? 
1 1 1   52    4   19 o    113.7    5.9    0.0000   0.0000          ?        ?   129.6199  13.4090          ?        ?      113.7        5.9       ?       ? 
1 1 1   52    4   20 o    188.0    3.9    0.0000   0.0000          ?        ?   353.7410  14.6860          ?        ?      188.0        3.9       ?       ? 
1 1 1   52    4   21 o    240.0    3.3    0.0000   0.0000          ?        ?   576.5850  15.9630          ?        ?      240.0        3.3       ?       ? 
1 1 1   52    4   22 o    263.6    3.1    0.0000   0.0000          ?        ?   695.3500  16.6016          ?        ?      263.6        3.1       ?       ? 
1 1 1   52    4   23 o    215.6    4.0    0.0000   0.0000          ?        ?   465.4823  17.2401          ?        ?      215.6        4.0       ?       ? 
1 1 1   52    4   24 o    126.5    5.6    0.0000   0.0000          ?        ?   160.2689  14.0475          ?        ?      126.5        5.6       ?       ? 
1 1 1   52    4   25 o    124.7    5.4    0.0000   0.0000          ?        ?   155.7993  13.4090          ?        ?      124.7        5.4       ?       ? 
1 1 1   52    4   26 o    432.8    2.7    0.0000   0.0000          ?        ?  1874.0609  22.9868          ?        ?      432.8        2.7       ?       ? 
1 1 1   52    4   27 o    230.5    3.6    0.0000   0.0000          ?        ?   531.8885  16.6016          ?        ?      230.5        3.6       ?       ? 
1 1 1   52    4   28 o     48.3   15.0    0.0000   0.0000          ?        ?    23.6253  15.9630          ?        ?       48.3       15.0       ?       ? 
1 1 1   52    4   29 o    244.0    3.4    0.0000   0.0000          ?        ?   595.7407  16.6016          ?        ?      244.0        3.4       ?       ? 
1 1 1   52    4   30 o    218.9    3.6    0.0000   0.0000          ?        ?   479.5297  15.9630          ?        ?      218.9        3.6       ?       ? 
1 1 1   52    4   31 o     51.2   14.0    0.0000   0.0000          ?        ?    27.4564  14.6860          ?        ?       51.2       14.0       ?       ? 
1 1 1   52    4   32 o    155.8    5.3    0.0000   0.0000          ?        ?   243.2767  16.6016          ?        ?      155.8        5.3       ?       ? 
1 1 1   52    4   33 o    178.2    4.5    0.0000   0.0000          ?        ?   317.9838  15.9630          ?        ?      178.2        4.5       ?       ? 
1 1 1   52    4   34 o    307.5    3.1    0.0000   0.0000          ?        ?   946.2890  19.1556          ?        ?      307.5        3.1       ?       ? 
1 1 1   52    4   35 o     19.3    9.7    0.0000   0.0000          ?        ?   -49.1662  16.6016          ?        ?       19.3        9.7       ?       ? 
1 1 1   52    4   36 o    154.9    5.4    0.0000   0.0000          ?        ?   240.7227  16.6016          ?        ?      154.9        5.4       ?       ? 
1 1 1   52    4   37 o    233.2    4.0    0.0000   0.0000          ?        ?   544.6590  18.5171          ?        ?      233.2        4.0       ?       ? 
1 1 1   52    4   38 o    337.2    3.0    0.0000   0.0000          ?        ?  1138.4841  20.4327          ?        ?      337.2        3.0       ?       ? 
1 1 1   52    4   39 o    270.0    3.3    0.0000   0.0000          ?        ?   729.8303  17.8786          ?        ?      270.0        3.3       ?       ? 
1 1 1   52    4   40 o     96.8    8.6    0.0000   0.0000          ?        ?    94.5012  16.6016          ?        ?       96.8        8.6       ?       ? 
1 1 1   52    4   41 o     83.6   10.3    0.0000   0.0000          ?        ?    70.8759  17.2401          ?        ?       83.6       10.3       ?       ? 
1 1 1   52    4   42 o    104.3    8.0    0.0000   0.0000          ?        ?   109.8257  16.6016          ?        ?      104.3        8.0       ?       ? 
1 1 1   52    4   43 o     97.3    8.5    0.0000   0.0000          ?        ?    95.7782  16.6016          ?        ?       97.3        8.5       ?       ? 
1 1 1   52    4   44 o    272.3    3.4    0.0000   0.0000          ?        ?   742.6006  18.5171          ?        ?      272.3        3.4       ?       ? 
1 1 1   52    4   45 o     18.6    9.4    0.0000   0.0000          ?        ?   -54.2743  16.6016          ?        ?       18.6        9.4       ?       ? 
1 1 1   52    4   46 o     59.1   14.2    0.0000   0.0000          ?        ?    37.6728  16.6016          ?        ?       59.1       14.2       ?       ? 
1 1 1   52    4   47 o     24.7   11.9    0.0000   0.0000          ?        ?   -24.9023  17.2401          ?        ?       24.7       11.9       ?       ? 
1 1 1   52    4   48 o     98.4    8.8    0.0000   0.0000          ?        ?    98.3323  17.2401          ?        ?       98.4        8.8       ?       ? 
1 1 1   52    5    0 o     26.5   16.6    4.4697  17.8786     4.4697  17.8786     4.4697  17.8786       26.5     16.6       26.5       16.6     0.0     0.0 
1 1 1   52    5    1 o     90.3    7.1    0.0000   0.0000          ?        ?    81.7308  12.7704          ?        ?       90.3        7.1       ?       ? 
1 1 1   52    5    2 o    257.4    3.3    0.0000   0.0000          ?        ?   662.7855  17.2401          ?        ?      257.4        3.3       ?       ? 
1 1 1   52    5    3 o     59.2   10.6    0.0000   0.0000          ?        ?    36.3957  12.1319          ?        ?       59.2       10.6       ?       ? 
1 1 1   52    5    4 o    413.4    3.2    0.0000   0.0000          ?        ?  1709.9608  26.1794          ?        ?      413.4        3.2       ?       ? 
1 1 1   52    5    5 o    211.8    3.5    0.0000   0.0000          ?        ?   448.8807  14.6860          ?        ?      211.8        3.5       ?       ? 
1 1 1   52    5    6 o    203.8    3.4    0.0000   0.0000          ?        ?   415.6776  14.0475          ?        ?      203.8        3.4       ?       ? 
1 1 1   52    5    7 o    446.4    3.1    0.0000   0.0000          ?        ?  1993.4646  27.4564          ?        ?      446.4        3.1       ?       ? 
1 1 1   52    5    8 o    199.1    3.5    0.0000   0.0000          ?        ?   396.5219  14.0475          ?        ?      199.1        3.5       ?       ? 
1 1 1   52    5    9 o    401.6    2.9    0.0000   0.0000          ?        ?  1613.5442  22.9868          ?        ?      401.6        2.9       ?       ? 
1 1 1   52    5   10 o    109.4    6.1    0.0000   0.0000          ?        ?   120.0421  13.4090          ?        ?      109.4        6.1       ?       ? 
1 1 1   52    5   11 o     27.7   12.2    0.0000   0.0000          ?        ?    -4.4697  13.4090          ?        ?       27.7       12.2       ?       ? 
1 1 1   52    5   12 o    162.1    4.1    0.0000   0.0000          ?        ?   263.0709  13.4090          ?        ?      162.1        4.1       ?       ? 
1 1 1   52    5   13 o     39.6   13.5    0.0000   0.0000          ?        ?    14.6860  12.7704          ?        ?       39.6       13.5       ?       ? 
1 1 1   52    5   14 o    355.1    2.9    0.0000   0.0000          ?        ?  1261.7188  20.4327          ?        ?      355.1        2.9       ?       ? 
1 1 1   52    5   15 o    273.1    3.4    0.0000   0.0000          ?        ?   746.4318  18.5171          ?        ?      273.1        3.4       ?       ? 
1 1 1   52    5   16 o    314.2    2.9    0.0000   0.0000          ?        ?   987.7929  18.5171          ?        ?      314.2        2.9       ?       ? 
1 1 1   52    5   17 o     43.7   13.8    0.0000   0.0000          ?        ?    19.1556  13.4090          ?        ?       43.7       13.8       ?       ? 
1 1 1   52    5   18 o    178.6    4.5    0.0000   0.0000          ?        ?   319.2608  15.9630          ?        ?      178.6        4.5       ?       ? 
1 1 1   52    5   19 o    423.6    2.8    0.0000   0.0000          ?        ?  1795.5229  23.6253          ?        ?      423.6        2.8       ?       ? 
1 1 1   52    5   20 o    218.5    3.5    0.0000   0.0000          ?        ?   477.6142  15.3245          ?        ?      218.5        3.5       ?       ? 
1 1 1   52    5   21 o    440.5    2.8    0.0000   0.0000          ?        ?  1941.7443  24.2638          ?        ?      440.5        2.8       ?       ? 
1 1 1   52    5   22 o    154.4    4.8    0.0000   0.0000          ?        ?   238.8071  14.6860          ?        ?      154.4        4.8       ?       ? 
1 1 1   52    5   23 o     45.0   14.1    0.0000   0.0000          ?        ?    20.4327  14.0475          ?        ?       45.0       14.1       ?       ? 
1 1 1   52    5   24 o    423.6    2.7    0.0000   0.0000          ?        ?  1794.8843  22.9868          ?        ?      423.6        2.7       ?       ? 
1 1 1   52    5   25 o     22.2   10.7    0.0000   0.0000          ?        ?   -24.2638  14.6860          ?        ?       22.2       10.7       ?       ? 
1 1 1   52    5   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   52    5   27 o    513.4    2.7    0.0000   0.0000          ?        ?  2637.7329  27.4564          ?        ?      513.4        2.7       ?       ? 
1 1 1   52    5   28 o    248.9    3.3    0.0000   0.0000          ?        ?   620.0045  16.6016          ?        ?      248.9        3.3       ?       ? 
1 1 1   52    5   29 o    193.5    4.0    0.0000   0.0000          ?        ?   374.8122  15.3245          ?        ?      193.5        4.0       ?       ? 
1 1 1   52    5   30 o    255.8    3.5    0.0000   0.0000          ?        ?   655.1232  17.8786          ?        ?      255.8        3.5       ?       ? 
1 1 1   52    5   31 o     46.8   14.3    0.0000   0.0000          ?        ?    22.3483  14.6860          ?        ?       46.8       14.3       ?       ? 
1 1 1   52    5   32 o    233.2    3.6    0.0000   0.0000          ?        ?   544.6590  16.6016          ?        ?      233.2        3.6       ?       ? 
1 1 1   52    5   33 o    361.8    2.7    0.0000   0.0000          ?        ?  1309.6079  19.7942          ?        ?      361.8        2.7       ?       ? 
1 1 1   52    5   34 o     50.1   14.5    0.0000   0.0000          ?        ?    26.1794  15.3245          ?        ?       50.1       14.5       ?       ? 
1 1 1   52    5   35 o    240.9    3.7    0.0000   0.0000          ?        ?   581.0547  17.8786          ?        ?      240.9        3.7       ?       ? 
1 1 1   52    5   36 o    168.2    4.7    0.0000   0.0000          ?        ?   283.5036  15.9630          ?        ?      168.2        4.7       ?       ? 
1 1 1   52    5   37 o    178.4    4.8    0.0000   0.0000          ?        ?   319.2608  17.2401          ?        ?      178.4        4.8       ?       ? 
1 1 1   52    5   38 o    165.6    5.2    0.0000   0.0000          ?        ?   275.2028  17.2401          ?        ?      165.6        5.2       ?       ? 
1 1 1   52    5   39 o     23.8   11.6    0.0000   0.0000          ?        ?   -28.7335  17.2401          ?        ?       23.8       11.6       ?       ? 
1 1 1   52    5   40 o    192.7    4.3    0.0000   0.0000          ?        ?   372.2581  16.6016          ?        ?      192.7        4.3       ?       ? 
1 1 1   52    5   41 o    364.3    2.8    0.0000   0.0000          ?        ?  1328.7635  20.4327          ?        ?      364.3        2.8       ?       ? 
1 1 1   52    5   42 o    175.0    4.7    0.0000   0.0000          ?        ?   307.1289  16.6016          ?        ?      175.0        4.7       ?       ? 
1 1 1   52    5   43 o    101.5    8.2    0.0000   0.0000          ?        ?   104.0790  16.6016          ?        ?      101.5        8.2       ?       ? 
1 1 1   52    5   44 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   52    5   45 o    138.4    5.8    0.0000   0.0000          ?        ?   192.8335  15.9630          ?        ?      138.4        5.8       ?       ? 
1 1 1   52    5   46 o    258.7    3.5    0.0000   0.0000          ?        ?   671.0862  17.8786          ?        ?      258.7        3.5       ?       ? 
1 1 1   52    5   47 o    149.6    6.0    0.0000   0.0000          ?        ?   225.3981  17.8786          ?        ?      149.6        6.0       ?       ? 
1 1 1   52    6    0 o    185.9    5.3  346.7172  19.7942   346.7172  19.7942   346.7172  19.7942      185.9      5.3      185.9        5.3     0.0     0.0 
1 1 1   52    6    1 o    405.0    2.8    0.0000   0.0000          ?        ?  1641.0006  22.3483          ?        ?      405.0        2.8       ?       ? 
1 1 1   52    6    2 o    426.8    2.8    0.0000   0.0000          ?        ?  1822.3407  24.2638          ?        ?      426.8        2.8       ?       ? 
1 1 1   52    6    3 o    167.5    3.8    0.0000   0.0000          ?        ?   280.9495  12.7704          ?        ?      167.5        3.8       ?       ? 
1 1 1   52    6    4 o    243.9    3.0    0.0000   0.0000          ?        ?   595.1021  14.6860          ?        ?      243.9        3.0       ?       ? 
1 1 1   52    6    5 o    370.4    2.8    0.0000   0.0000          ?        ?  1372.8215  21.0712          ?        ?      370.4        2.8       ?       ? 
1 1 1   52    6    6 o     63.7   10.0    0.0000   0.0000          ?        ?    40.8654  12.7704          ?        ?       63.7       10.0       ?       ? 
1 1 1   52    6    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   52    6    8 o    252.2    3.2    0.0000   0.0000          ?        ?   636.6060  15.9630          ?        ?      252.2        3.2       ?       ? 
1 1 1   52    6    9 o    280.6    3.1    0.0000   0.0000          ?        ?   787.9357  17.2401          ?        ?      280.6        3.1       ?       ? 
1 1 1   52    6   10 o    183.7    4.0    0.0000   0.0000          ?        ?   337.7780  14.6860          ?        ?      183.7        4.0       ?       ? 
1 1 1   52    6   11 o    292.8    2.7    0.0000   0.0000          ?        ?   857.5345  15.9630          ?        ?      292.8        2.7       ?       ? 
1 1 1   52    6   12 o    349.6    3.1    0.0000   0.0000          ?        ?  1222.7689  21.7097          ?        ?      349.6        3.1       ?       ? 
1 1 1   52    6   13 o    293.2    3.0    0.0000   0.0000          ?        ?   860.0886  17.8786          ?        ?      293.2        3.0       ?       ? 
1 1 1   52    6   14 o    276.9    2.9    0.0000   0.0000          ?        ?   766.8644  15.9630          ?        ?      276.9        2.9       ?       ? 
1 1 1   52    6   15 o    252.0    3.2    0.0000   0.0000          ?        ?   635.3290  15.9630          ?        ?      252.0        3.2       ?       ? 
1 1 1   52    6   16 o    269.8    3.0    0.0000   0.0000          ?        ?   728.5532  15.9630          ?        ?      269.8        3.0       ?       ? 
1 1 1   52    6   17 o     98.0    7.2    0.0000   0.0000          ?        ?    96.4168  14.0475          ?        ?       98.0        7.2       ?       ? 
1 1 1   52    6   18 o     41.0   13.8    0.0000   0.0000          ?        ?    15.9630  13.4090          ?        ?       41.0       13.8       ?       ? 
1 1 1   52    6   19 o    196.0    3.7    0.0000   0.0000          ?        ?   384.3900  14.6860          ?        ?      196.0        3.7       ?       ? 
1 1 1   52    6   20 o     21.1   10.3    0.0000   0.0000          ?        ?   -25.5409  14.0475          ?        ?       21.1       10.3       ?       ? 
1 1 1   52    6   21 o    137.8    4.9    0.0000   0.0000          ?        ?   190.2794  13.4090          ?        ?      137.8        4.9       ?       ? 
1 1 1   52    6   22 o    220.5    3.6    0.0000   0.0000          ?        ?   486.5535  15.9630          ?        ?      220.5        3.6       ?       ? 
1 1 1   52    6   23 o     78.5    9.0    0.0000   0.0000          ?        ?    61.9366  14.0475          ?        ?       78.5        9.0       ?       ? 
1 1 1   52    6   24 o    243.6    3.1    0.0000   0.0000          ?        ?   593.8251  15.3245          ?        ?      243.6        3.1       ?       ? 
1 1 1   52    6   25 o     33.8   13.8    0.0000   0.0000          ?        ?     4.4697  14.6860          ?        ?       33.8       13.8       ?       ? 
1 1 1   52    6   26 o     22.7   10.9    0.0000   0.0000          ?        ?   -22.3483  14.6860          ?        ?       22.7       10.9       ?       ? 
1 1 1   52    6   27 o     96.0    8.0    0.0000   0.0000          ?        ?    92.5856  15.3245          ?        ?       96.0        8.0       ?       ? 
1 1 1   52    6   28 o    421.5    2.7    0.0000   0.0000          ?        ?  1777.6442  22.3483          ?        ?      421.5        2.7       ?       ? 
1 1 1   52    6   29 o     57.1   14.1    0.0000   0.0000          ?        ?    34.4802  15.9630          ?        ?       57.1       14.1       ?       ? 
1 1 1   52    6   30 o    138.2    5.5    0.0000   0.0000          ?        ?   191.5565  15.3245          ?        ?      138.2        5.5       ?       ? 
1 1 1   52    6   31 o    294.4    3.3    0.0000   0.0000          ?        ?   867.7509  19.1556          ?        ?      294.4        3.3       ?       ? 
1 1 1   52    6   32 o    156.0    4.9    0.0000   0.0000          ?        ?   243.9153  15.3245          ?        ?      156.0        4.9       ?       ? 
1 1 1   52    6   33 o    233.8    3.6    0.0000   0.0000          ?        ?   547.2130  16.6016          ?        ?      233.8        3.6       ?       ? 
1 1 1   52    6   34 o    143.6    5.8    0.0000   0.0000          ?        ?   206.8810  16.6016          ?        ?      143.6        5.8       ?       ? 
1 1 1   52    6   35 o    383.7    2.7    0.0000   0.0000          ?        ?  1473.7079  21.0712          ?        ?      383.7        2.7       ?       ? 
1 1 1   52    6   36 o     75.3   10.6    0.0000   0.0000          ?        ?    57.4669  15.9630          ?        ?       75.3       10.6       ?       ? 
1 1 1   52    6   37 o    105.6    7.6    0.0000   0.0000          ?        ?   112.3798  15.9630          ?        ?      105.6        7.6       ?       ? 
1 1 1   52    6   38 o    376.1    2.7    0.0000   0.0000          ?        ?  1415.6024  20.4327          ?        ?      376.1        2.7       ?       ? 
1 1 1   52    6   39 o    214.5    4.0    0.0000   0.0000          ?        ?   461.0126  17.2401          ?        ?      214.5        4.0       ?       ? 
1 1 1   52    6   40 o    234.1    3.7    0.0000   0.0000          ?        ?   549.1286  17.2401          ?        ?      234.1        3.7       ?       ? 
1 1 1   52    6   41 o    202.6    4.4    0.0000   0.0000          ?        ?   411.8464  17.8786          ?        ?      202.6        4.4       ?       ? 
1 1 1   52    6   42 o     76.7   11.2    0.0000   0.0000          ?        ?    60.0210  17.2401          ?        ?       76.7       11.2       ?       ? 
1 1 1   52    6   43 o     19.0    9.6    0.0000   0.0000          ?        ?   -51.0817  16.6016          ?        ?       19.0        9.6       ?       ? 
1 1 1   52    6   44 o    128.6    6.7    0.0000   0.0000          ?        ?   166.6541  17.2401          ?        ?      128.6        6.7       ?       ? 
1 1 1   52    6   45 o    202.4    4.4    0.0000   0.0000          ?        ?   411.2079  17.8786          ?        ?      202.4        4.4       ?       ? 
1 1 1   52    6   46 o     20.8   10.3    0.0000   0.0000          ?        ?   -39.5883  16.6016          ?        ?       20.8       10.3       ?       ? 
1 1 1   52    7    0 o    219.5    4.4  482.7224  19.1556   482.7224  19.1556   482.7224  19.1556      219.5      4.4      219.5        4.4     0.0     0.0 
1 1 1   52    7    1 o    234.9    3.3    0.0000   0.0000          ?        ?   552.3212  15.3245          ?        ?      234.9        3.3       ?       ? 
1 1 1   52    7    2 o    280.4    2.7    0.0000   0.0000          ?        ?   786.6586  15.3245          ?        ?      280.4        2.7       ?       ? 
1 1 1   52    7    3 o    394.3    2.8    0.0000   0.0000          ?        ?  1555.4387  22.3483          ?        ?      394.3        2.8       ?       ? 
1 1 1   52    7    4 o    276.9    2.7    0.0000   0.0000          ?        ?   766.8644  14.6860          ?        ?      276.9        2.7       ?       ? 
1 1 1   52    7    5 o     20.2    9.8    0.0000   0.0000          ?        ?   -22.9868  12.7704          ?        ?       20.2        9.8       ?       ? 
1 1 1   52    7    6 o    213.3    3.4    0.0000   0.0000          ?        ?   455.2659  14.6860          ?        ?      213.3        3.4       ?       ? 
1 1 1   52    7    7 o    137.4    4.6    0.0000   0.0000          ?        ?   189.0024  12.7704          ?        ?      137.4        4.6       ?       ? 
1 1 1   52    7    8 o    181.1    3.7    0.0000   0.0000          ?        ?   328.2001  13.4090          ?        ?      181.1        3.7       ?       ? 
1 1 1   52    7    9 o    173.7    3.9    0.0000   0.0000          ?        ?   302.0207  13.4090          ?        ?      173.7        3.9       ?       ? 
1 1 1   52    7   10 o     39.5   13.8    0.0000   0.0000          ?        ?    14.0475  13.4090          ?        ?       39.5       13.8       ?       ? 
1 1 1   52    7   11 o     15.7    8.0    0.0000   0.0000          ?        ?   -46.6121  12.7704          ?        ?       15.7        8.0       ?       ? 
1 1 1   52    7   12 o    189.7    3.7    0.0000   0.0000          ?        ?   360.1262  14.0475          ?        ?      189.7        3.7       ?       ? 
1 1 1   52    7   13 o    271.5    2.9    0.0000   0.0000          ?        ?   737.4925  15.9630          ?        ?      271.5        2.9       ?       ? 
1 1 1   52    7   14 o    369.8    3.2    0.0000   0.0000          ?        ?  1368.3518  23.6253          ?        ?      369.8        3.2       ?       ? 
1 1 1   52    7   15 o    230.1    3.6    0.0000   0.0000          ?        ?   529.9730  16.6016          ?        ?      230.1        3.6       ?       ? 
1 1 1   52    7   16 o    195.0    3.9    0.0000   0.0000          ?        ?   380.5589  15.3245          ?        ?      195.0        3.9       ?       ? 
1 1 1   52    7   17 o    286.0    3.5    0.0000   0.0000          ?        ?   818.5847  19.7942          ?        ?      286.0        3.5       ?       ? 
1 1 1   52    7   18 o    175.1    4.2    0.0000   0.0000          ?        ?   307.1289  14.6860          ?        ?      175.1        4.2       ?       ? 
1 1 1   52    7   19 o    418.1    2.8    0.0000   0.0000          ?        ?  1748.9106  23.6253          ?        ?      418.1        2.8       ?       ? 
1 1 1   52    7   20 o    316.2    2.8    0.0000   0.0000          ?        ?  1000.5634  17.8786          ?        ?      316.2        2.8       ?       ? 
1 1 1   52    7   21 o     97.7    7.2    0.0000   0.0000          ?        ?    95.7782  14.0475          ?        ?       97.7        7.2       ?       ? 
1 1 1   52    7   22 o     46.7   14.0    0.0000   0.0000          ?        ?    22.3483  14.0475          ?        ?       46.7       14.0       ?       ? 
1 1 1   52    7   23 o     17.9    9.0    0.0000   0.0000          ?        ?   -50.4432  15.3245          ?        ?       17.9        9.0       ?       ? 
1 1 1   52    7   24 o    383.2    2.7    0.0000   0.0000          ?        ?  1469.2383  20.4327          ?        ?      383.2        2.7       ?       ? 
1 1 1   52    7   25 o    140.7    5.4    0.0000   0.0000          ?        ?   198.5802  15.3245          ?        ?      140.7        5.4       ?       ? 
1 1 1   52    7   26 o    101.2    7.6    0.0000   0.0000          ?        ?   102.8020  15.3245          ?        ?      101.2        7.6       ?       ? 
1 1 1   52    7   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   52    7   28 o    416.5    2.6    0.0000   0.0000          ?        ?  1736.1403  21.7097          ?        ?      416.5        2.6       ?       ? 
1 1 1   52    7   29 o    224.6    3.8    0.0000   0.0000          ?        ?   505.0706  17.2401          ?        ?      224.6        3.8       ?       ? 
1 1 1   52    7   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   52    7   31 o    114.2    6.7    0.0000   0.0000          ?        ?   130.8969  15.3245          ?        ?      114.2        6.7       ?       ? 
1 1 1   52    7   32 o    273.3    3.2    0.0000   0.0000          ?        ?   747.7088  17.2401          ?        ?      273.3        3.2       ?       ? 
1 1 1   52    7   33 f    209.3    4.1    0.0000   0.0000          ?        ?   438.6643  17.2401          ?        ?      209.3        4.1       ?       ? 
1 1 1   52    7   34 o    244.7    3.7    0.0000   0.0000          ?        ?   599.5718  17.8786          ?        ?      244.7        3.7       ?       ? 
1 1 1   52    7   35 o    113.5    7.0    0.0000   0.0000          ?        ?   129.6199  15.9630          ?        ?      113.5        7.0       ?       ? 
1 1 1   52    7   36 o    288.5    3.1    0.0000   0.0000          ?        ?   833.2708  17.8786          ?        ?      288.5        3.1       ?       ? 
1 1 1   52    7   37 o    250.7    3.6    0.0000   0.0000          ?        ?   629.5823  17.8786          ?        ?      250.7        3.6       ?       ? 
1 1 1   52    7   38 o    239.6    3.6    0.0000   0.0000          ?        ?   575.3080  17.2401          ?        ?      239.6        3.6       ?       ? 
1 1 1   52    7   39 o    152.3    5.4    0.0000   0.0000          ?        ?   233.0604  16.6016          ?        ?      152.3        5.4       ?       ? 
1 1 1   52    7   40 o    194.5    4.4    0.0000   0.0000          ?        ?   379.2819  17.2401          ?        ?      194.5        4.4       ?       ? 
1 1 1   52    7   41 o     21.7   10.7    0.0000   0.0000          ?        ?   -35.1187  16.6016          ?        ?       21.7       10.7       ?       ? 
1 1 1   52    7   42 f     57.7   14.0    0.0000   0.0000          ?        ?    35.7572  15.9630          ?        ?       57.7       14.0       ?       ? 
1 1 1   52    7   43 o    124.8    6.7    0.0000   0.0000          ?        ?   157.0763  16.6016          ?        ?      124.8        6.7       ?       ? 
1 1 1   52    7   44 o     86.3   10.0    0.0000   0.0000          ?        ?    75.9841  17.2401          ?        ?       86.3       10.0       ?       ? 
1 1 1   52    7   45 o     58.4   14.8    0.0000   0.0000          ?        ?    37.0343  17.2401          ?        ?       58.4       14.8       ?       ? 
1 1 1   52    8    0 o    336.8    5.0 1135.9299  33.8416  1135.9299  33.8416  1135.9299  33.8416      336.8      5.0      336.8        5.0     0.0     0.0 
1 1 1   52    8    1 o    292.0    3.2    0.0000   0.0000          ?        ?   853.0649  18.5171          ?        ?      292.0        3.2       ?       ? 
1 1 1   52    8    2 f    220.4    3.5    0.0000   0.0000          ?        ?   485.9149  15.3245          ?        ?      220.4        3.5       ?       ? 
1 1 1   52    8    3 f    522.9    3.2    0.0000   0.0000          ?        ?  2735.4265  33.2031          ?        ?      522.9        3.2       ?       ? 
1 1 1   52    8    4 o    170.0    3.9    0.0000   0.0000          ?        ?   289.2503  13.4090          ?        ?      170.0        3.9       ?       ? 
1 1 1   52    8    5 f    101.9    6.6    0.0000   0.0000          ?        ?   104.0790  13.4090          ?        ?      101.9        6.6       ?       ? 
1 1 1   52    8    6 o    387.3    3.1    0.0000   0.0000          ?        ?  1501.1644  24.2638          ?        ?      387.3        3.1       ?       ? 
1 1 1   52    8    7 o    535.8    3.1    0.0000   0.0000          ?        ?  2872.7087  33.2031          ?        ?      535.8        3.1       ?       ? 
1 1 1   52    8    8 o    219.9    3.8    0.0000   0.0000          ?        ?   483.9994  16.6016          ?        ?      219.9        3.8       ?       ? 
1 1 1   52    8    9 o     80.5    7.9    0.0000   0.0000          ?        ?    65.1292  12.7704          ?        ?       80.5        7.9       ?       ? 
1 1 1   52    8   10 o    327.7    2.9    0.0000   0.0000          ?        ?  1074.6320  19.1556          ?        ?      327.7        2.9       ?       ? 
1 1 1   52    8   11 o    167.1    4.0    0.0000   0.0000          ?        ?   279.6725  13.4090          ?        ?      167.1        4.0       ?       ? 
1 1 1   52    8   12 o    394.1    2.9    0.0000   0.0000          ?        ?  1554.1616  22.9868          ?        ?      394.1        2.9       ?       ? 
1 1 1   52    8   13 o    121.6    5.5    0.0000   0.0000          ?        ?   148.1370  13.4090          ?        ?      121.6        5.5       ?       ? 
1 1 1   52    8   14 o    382.4    2.9    0.0000   0.0000          ?        ?  1463.4916  22.3483          ?        ?      382.4        2.9       ?       ? 
1 1 1   52    8   15 o    127.5    5.3    0.0000   0.0000          ?        ?   162.8230  13.4090          ?        ?      127.5        5.3       ?       ? 
1 1 1   52    8   16 o    249.7    3.2    0.0000   0.0000          ?        ?   623.8356  15.9630          ?        ?      249.7        3.2       ?       ? 
1 1 1   52    8   17 o     36.7   14.4    0.0000   0.0000          ?        ?     8.3008  15.3245          ?        ?       36.7       14.4       ?       ? 
1 1 1   52    8   18 o     37.0   13.7    0.0000   0.0000          ?        ?    10.8549  13.4090          ?        ?       37.0       13.7       ?       ? 
1 1 1   52    8   19 o    118.1    6.2    0.0000   0.0000          ?        ?   139.8362  14.6860          ?        ?      118.1        6.2       ?       ? 
1 1 1   52    8   20 o    453.8    2.7    0.0000   0.0000          ?        ?  2060.5093  24.2638          ?        ?      453.8        2.7       ?       ? 
1 1 1   52    8   21 o    484.2    2.8    0.0000   0.0000          ?        ?  2345.9285  26.8179          ?        ?      484.2        2.8       ?       ? 
1 1 1   52    8   22 o    389.8    2.9    0.0000   0.0000          ?        ?  1520.3201  22.9868          ?        ?      389.8        2.9       ?       ? 
1 1 1   52    8   23 o     95.6    8.7    0.0000   0.0000          ?        ?    91.9471  16.6016          ?        ?       95.6        8.7       ?       ? 
1 1 1   52    8   24 o    295.3    3.0    0.0000   0.0000          ?        ?   872.8591  17.8786          ?        ?      295.3        3.0       ?       ? 
1 1 1   52    8   25 o    328.8    2.8    0.0000   0.0000          ?        ?  1081.6556  18.5171          ?        ?      328.8        2.8       ?       ? 
1 1 1   52    8   26 o     58.2   13.9    0.0000   0.0000          ?        ?    35.7572  15.9630          ?        ?       58.2       13.9       ?       ? 
1 1 1   52    8   27 o    200.9    4.1    0.0000   0.0000          ?        ?   404.1842  16.6016          ?        ?      200.9        4.1       ?       ? 
1 1 1   52    8   28 o     18.7    9.4    0.0000   0.0000          ?        ?   -44.6965  15.3245          ?        ?       18.7        9.4       ?       ? 
1 1 1   52    8   29 o     25.3   11.9    0.0000   0.0000          ?        ?   -15.9630  15.3245          ?        ?       25.3       11.9       ?       ? 
1 1 1   52    8   30 o    328.6    2.9    0.0000   0.0000          ?        ?  1081.0171  19.1556          ?        ?      328.6        2.9       ?       ? 
1 1 1   52    8   31 o    133.7    6.0    0.0000   0.0000          ?        ?   179.4246  15.9630          ?        ?      133.7        6.0       ?       ? 
1 1 1   52    8   32 o     54.9   14.4    0.0000   0.0000          ?        ?    31.9261  15.9630          ?        ?       54.9       14.4       ?       ? 
1 1 1   52    8   33 o    166.2    5.0    0.0000   0.0000          ?        ?   277.1184  16.6016          ?        ?      166.2        5.0       ?       ? 
1 1 1   52    8   34 o    196.4    4.1    0.0000   0.0000          ?        ?   386.3056  15.9630          ?        ?      196.4        4.1       ?       ? 
1 1 1   52    8   35 o     20.6   10.2    0.0000   0.0000          ?        ?   -33.8416  15.3245          ?        ?       20.6       10.2       ?       ? 
1 1 1   52    8   36 o    198.1    4.4    0.0000   0.0000          ?        ?   393.3293  17.2401          ?        ?      198.1        4.4       ?       ? 
1 1 1   52    8   37 o    234.9    3.7    0.0000   0.0000          ?        ?   552.9597  17.2401          ?        ?      234.9        3.7       ?       ? 
1 1 1   52    8   38 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   52    8   39 o     92.9    9.3    0.0000   0.0000          ?        ?    87.4775  17.2401          ?        ?       92.9        9.3       ?       ? 
1 1 1   52    8   40 o    100.5    8.3    0.0000   0.0000          ?        ?   102.1635  16.6016          ?        ?      100.5        8.3       ?       ? 
1 1 1   52    8   41 o    110.7    7.5    0.0000   0.0000          ?        ?   123.8732  16.6016          ?        ?      110.7        7.5       ?       ? 
1 1 1   52    8   42 o     31.4   13.8    0.0000   0.0000          ?        ?    -3.1926  16.6016          ?        ?       31.4       13.8       ?       ? 
1 1 1   52    8   43 o    142.7    5.8    0.0000   0.0000          ?        ?   204.9654  16.6016          ?        ?      142.7        5.8       ?       ? 
1 1 1   52    9    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   52    9    1 o     65.2   10.3    0.0000   0.0000          ?        ?    42.7809  13.4090          ?        ?       65.2       10.3       ?       ? 
1 1 1   52    9    2 o    210.3    3.5    0.0000   0.0000          ?        ?   442.4955  14.6860          ?        ?      210.3        3.5       ?       ? 
1 1 1   52    9    3 o    152.1    4.4    0.0000   0.0000          ?        ?   231.7833  13.4090          ?        ?      152.1        4.4       ?       ? 
1 1 1   52    9    4 o    396.8    2.9    0.0000   0.0000          ?        ?  1575.2328  22.9868          ?        ?      396.8        2.9       ?       ? 
1 1 1   52    9    5 o    198.9    3.2    0.0000   0.0000          ?        ?   395.8834  12.7704          ?        ?      198.9        3.2       ?       ? 
1 1 1   52    9    6 o    371.7    3.0    0.0000   0.0000          ?        ?  1382.3993  22.3483          ?        ?      371.7        3.0       ?       ? 
1 1 1   52    9    7 o    166.2    4.2    0.0000   0.0000          ?        ?   276.4799  14.0475          ?        ?      166.2        4.2       ?       ? 
1 1 1   52    9    8 o    105.6    6.0    0.0000   0.0000          ?        ?   111.7413  12.7704          ?        ?      105.6        6.0       ?       ? 
1 1 1   52    9    9 o    122.9    5.5    0.0000   0.0000          ?        ?   151.3296  13.4090          ?        ?      122.9        5.5       ?       ? 
1 1 1   52    9   10 o    286.5    3.1    0.0000   0.0000          ?        ?   821.1389  17.8786          ?        ?      286.5        3.1       ?       ? 
1 1 1   52    9   11 o    162.3    4.1    0.0000   0.0000          ?        ?   263.7094  13.4090          ?        ?      162.3        4.1       ?       ? 
1 1 1   52    9   12 o    260.4    3.4    0.0000   0.0000          ?        ?   678.7485  17.8786          ?        ?      260.4        3.4       ?       ? 
1 1 1   52    9   13 o    154.6    5.0    0.0000   0.0000          ?        ?   239.4456  15.3245          ?        ?      154.6        5.0       ?       ? 
1 1 1   52    9   14 f    282.9    3.0    0.0000   0.0000          ?        ?   800.7061  17.2401          ?        ?      282.9        3.0       ?       ? 
1 1 1   52    9   15 o     44.8   13.7    0.0000   0.0000          ?        ?    20.4327  13.4090          ?        ?       44.8       13.7       ?       ? 
1 1 1   52    9   16 o    271.5    3.2    0.0000   0.0000          ?        ?   737.4925  17.2401          ?        ?      271.5        3.2       ?       ? 
1 1 1   52    9   17 o    237.5    3.4    0.0000   0.0000          ?        ?   564.4531  15.9630          ?        ?      237.5        3.4       ?       ? 
1 1 1   52    9   18 o    180.3    4.1    0.0000   0.0000          ?        ?   325.6460  14.6860          ?        ?      180.3        4.1       ?       ? 
1 1 1   52    9   19 o    178.9    4.1    0.0000   0.0000          ?        ?   320.5379  14.6860          ?        ?      178.9        4.1       ?       ? 
1 1 1   52    9   20 o    206.9    4.0    0.0000   0.0000          ?        ?   428.4480  16.6016          ?        ?      206.9        4.0       ?       ? 
1 1 1   52    9   21 o     36.6   14.1    0.0000   0.0000          ?        ?     8.9393  14.6860          ?        ?       36.6       14.1       ?       ? 
1 1 1   52    9   22 o    310.6    3.2    0.0000   0.0000          ?        ?   965.4447  19.7942          ?        ?      310.6        3.2       ?       ? 
1 1 1   52    9   23 o    169.4    4.3    0.0000   0.0000          ?        ?   287.3347  14.6860          ?        ?      169.4        4.3       ?       ? 
1 1 1   52    9   24 o    208.3    3.5    0.0000   0.0000          ?        ?   434.1947  14.6860          ?        ?      208.3        3.5       ?       ? 
1 1 1   52    9   25 o    517.8    2.6    0.0000   0.0000          ?        ?  2683.0679  26.8179          ?        ?      517.8        2.6       ?       ? 
1 1 1   52    9   26 o    387.6    2.8    0.0000   0.0000          ?        ?  1503.7184  21.7097          ?        ?      387.6        2.8       ?       ? 
1 1 1   52    9   27 o    154.1    5.2    0.0000   0.0000          ?        ?   238.1686  15.9630          ?        ?      154.1        5.2       ?       ? 
1 1 1   52    9   28 o    247.3    3.4    0.0000   0.0000          ?        ?   612.3422  16.6016          ?        ?      247.3        3.4       ?       ? 
1 1 1   52    9   29 o    390.4    2.8    0.0000   0.0000          ?        ?  1525.4281  21.7097          ?        ?      390.4        2.8       ?       ? 
1 1 1   52    9   30 o     23.7   11.4    0.0000   0.0000          ?        ?   -23.6253  15.9630          ?        ?       23.7       11.4       ?       ? 
1 1 1   52    9   31 o    216.1    4.1    0.0000   0.0000          ?        ?   468.0364  17.8786          ?        ?      216.1        4.1       ?       ? 
1 1 1   52    9   32 o     72.8   10.5    0.0000   0.0000          ?        ?    53.6358  15.3245          ?        ?       72.8       10.5       ?       ? 
1 1 1   52    9   33 o    147.0    5.9    0.0000   0.0000          ?        ?   217.0974  17.2401          ?        ?      147.0        5.9       ?       ? 
1 1 1   52    9   34 o    205.7    4.0    0.0000   0.0000          ?        ?   423.9784  16.6016          ?        ?      205.7        4.0       ?       ? 
1 1 1   52    9   35 f     31.4   13.5    0.0000   0.0000          ?        ?    -0.6385  15.3245          ?        ?       31.4       13.5       ?       ? 
1 1 1   52    9   36 o    124.2    6.7    0.0000   0.0000          ?        ?   155.1608  16.6016          ?        ?      124.2        6.7       ?       ? 
1 1 1   52    9   37 o    304.8    3.2    0.0000   0.0000          ?        ?   930.3260  19.7942          ?        ?      304.8        3.2       ?       ? 
1 1 1   52    9   38 o     87.6    9.8    0.0000   0.0000          ?        ?    77.8996  17.2401          ?        ?       87.6        9.8       ?       ? 
1 1 1   52    9   39 o     70.6   11.8    0.0000   0.0000          ?        ?    51.0817  16.6016          ?        ?       70.6       11.8       ?       ? 
1 1 1   52    9   40 o     54.0   14.5    0.0000   0.0000          ?        ?    31.2876  15.9630          ?        ?       54.0       14.5       ?       ? 
1 1 1   52    9   41 o    224.5    4.0    0.0000   0.0000          ?        ?   505.7091  17.8786          ?        ?      224.5        4.0       ?       ? 
1 1 1   52    9   42 o     33.8   14.1    0.0000   0.0000          ?        ?     3.1926  15.9630          ?        ?       33.8       14.1       ?       ? 
1 1 1   52   10    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   52   10    1 o     30.9   12.5    0.0000   0.0000          ?        ?     3.8311  12.1319          ?        ?       30.9       12.5       ?       ? 
1 1 1   52   10    2 o    250.6    2.9    0.0000   0.0000          ?        ?   628.3053  14.6860          ?        ?      250.6        2.9       ?       ? 
1 1 1   52   10    3 o    248.5    3.0    0.0000   0.0000          ?        ?   618.0889  14.6860          ?        ?      248.5        3.0       ?       ? 
1 1 1   52   10    4 o    330.2    2.8    0.0000   0.0000          ?        ?  1091.2334  18.5171          ?        ?      330.2        2.8       ?       ? 
1 1 1   52   10    5 o    181.6    3.9    0.0000   0.0000          ?        ?   330.1157  14.0475          ?        ?      181.6        3.9       ?       ? 
1 1 1   52   10    6 o    411.5    3.3    0.0000   0.0000          ?        ?  1694.6364  27.4564          ?        ?      411.5        3.3       ?       ? 
1 1 1   52   10    7 o    256.6    3.2    0.0000   0.0000          ?        ?   658.9543  16.6016          ?        ?      256.6        3.2       ?       ? 
1 1 1   52   10    8 o     22.3   10.5    0.0000   0.0000          ?        ?   -13.4090  12.1319          ?        ?       22.3       10.5       ?       ? 
1 1 1   52   10    9 o    305.8    2.9    0.0000   0.0000          ?        ?   935.4342  17.8786          ?        ?      305.8        2.9       ?       ? 
1 1 1   52   10   10 o    147.0    4.3    0.0000   0.0000          ?        ?   216.4588  12.7704          ?        ?      147.0        4.3       ?       ? 
1 1 1   52   10   11 o    321.4    3.0    0.0000   0.0000          ?        ?  1033.7665  19.1556          ?        ?      321.4        3.0       ?       ? 
1 1 1   52   10   12 o    294.4    3.5    0.0000   0.0000          ?        ?   867.7509  20.4327          ?        ?      294.4        3.5       ?       ? 
1 1 1   52   10   13 o    305.4    3.4    0.0000   0.0000          ?        ?   933.5186  21.0712          ?        ?      305.4        3.4       ?       ? 
1 1 1   52   10   14 o     35.6   13.6    0.0000   0.0000          ?        ?     8.9393  13.4090          ?        ?       35.6       13.6       ?       ? 
1 1 1   52   10   15 f    191.2    3.8    0.0000   0.0000          ?        ?   365.8729  14.6860          ?        ?      191.2        3.8       ?       ? 
1 1 1   52   10   16 o    303.3    3.1    0.0000   0.0000          ?        ?   920.7482  18.5171          ?        ?      303.3        3.1       ?       ? 
1 1 1   52   10   17 o    190.7    3.9    0.0000   0.0000          ?        ?   363.9573  14.6860          ?        ?      190.7        3.9       ?       ? 
1 1 1   52   10   18 o    145.0    5.1    0.0000   0.0000          ?        ?   210.7121  14.6860          ?        ?      145.0        5.1       ?       ? 
1 1 1   52   10   19 o    248.6    3.6    0.0000   0.0000          ?        ?   618.7275  17.8786          ?        ?      248.6        3.6       ?       ? 
1 1 1   52   10   20 o    114.2    6.1    0.0000   0.0000          ?        ?   130.8969  14.0475          ?        ?      114.2        6.1       ?       ? 
1 1 1   52   10   21 o    342.2    3.0    0.0000   0.0000          ?        ?  1171.6871  20.4327          ?        ?      342.2        3.0       ?       ? 
1 1 1   52   10   22 o    182.9    4.2    0.0000   0.0000          ?        ?   335.2238  15.3245          ?        ?      182.9        4.2       ?       ? 
1 1 1   52   10   23 o    238.9    3.6    0.0000   0.0000          ?        ?   571.4769  17.2401          ?        ?      238.9        3.6       ?       ? 
1 1 1   52   10   24 o    110.2    6.7    0.0000   0.0000          ?        ?   121.9576  14.6860          ?        ?      110.2        6.7       ?       ? 
1 1 1   52   10   25 o    147.8    5.0    0.0000   0.0000          ?        ?   219.0129  14.6860          ?        ?      147.8        5.0       ?       ? 
1 1 1   52   10   26 o     74.6   10.3    0.0000   0.0000          ?        ?    56.1899  15.3245          ?        ?       74.6       10.3       ?       ? 
1 1 1   52   10   27 o     23.9   11.5    0.0000   0.0000          ?        ?   -22.9868  15.9630          ?        ?       23.9       11.5       ?       ? 
1 1 1   52   10   28 o     57.1   13.1    0.0000   0.0000          ?        ?    34.4802  14.6860          ?        ?       57.1       13.1       ?       ? 
1 1 1   52   10   29 o     17.5    8.9    0.0000   0.0000          ?        ?   -58.1055  15.9630          ?        ?       17.5        8.9       ?       ? 
1 1 1   52   10   30 o     76.1   10.9    0.0000   0.0000          ?        ?    58.7440  16.6016          ?        ?       76.1       10.9       ?       ? 
1 1 1   52   10   31 o    126.1    6.1    0.0000   0.0000          ?        ?   159.6304  15.3245          ?        ?      126.1        6.1       ?       ? 
1 1 1   52   10   32 o    144.4    5.5    0.0000   0.0000          ?        ?   209.4351  15.9630          ?        ?      144.4        5.5       ?       ? 
1 1 1   52   10   33 o    176.3    4.7    0.0000   0.0000          ?        ?   311.5985  16.6016          ?        ?      176.3        4.7       ?       ? 
1 1 1   52   10   34 o     21.0   10.4    0.0000   0.0000          ?        ?   -38.9498  16.6016          ?        ?       21.0       10.4       ?       ? 
1 1 1   52   10   35 o    197.7    4.4    0.0000   0.0000          ?        ?   392.0523  17.2401          ?        ?      197.7        4.4       ?       ? 
1 1 1   52   10   36 o    209.5    4.3    0.0000   0.0000          ?        ?   439.9414  17.8786          ?        ?      209.5        4.3       ?       ? 
1 1 1   52   10   37 o    150.8    5.5    0.0000   0.0000          ?        ?   228.5907  16.6016          ?        ?      150.8        5.5       ?       ? 
1 1 1   52   10   38 o     85.4    9.3    0.0000   0.0000          ?        ?    74.0685  15.9630          ?        ?       85.4        9.3       ?       ? 
1 1 1   52   10   39 o    172.3    5.0    0.0000   0.0000          ?        ?   298.1896  17.2401          ?        ?      172.3        5.0       ?       ? 
1 1 1   52   10   40 o    240.2    3.7    0.0000   0.0000          ?        ?   578.5006  17.8786          ?        ?      240.2        3.7       ?       ? 
1 1 1   52   10   41 f    187.7    4.4    0.0000   0.0000          ?        ?   353.7410  16.6016          ?        ?      187.7        4.4       ?       ? 
1 1 1   52   11    0 o    222.0    4.0  493.5772  17.8786   493.5772  17.8786   493.5772  17.8786      222.0      4.0      222.0        4.0     0.0     0.0 
1 1 1   52   11    1 o     93.7    6.1    0.0000   0.0000          ?        ?    88.1160  11.4934          ?        ?       93.7        6.1       ?       ? 
1 1 1   52   11    2 o    301.0    3.1    0.0000   0.0000          ?        ?   906.7007  18.5171          ?        ?      301.0        3.1       ?       ? 
1 1 1   52   11    3 o    328.6    2.9    0.0000   0.0000          ?        ?  1080.3785  19.1556          ?        ?      328.6        2.9       ?       ? 
1 1 1   52   11    4 o    457.8    3.1    0.0000   0.0000          ?        ?  2097.5435  28.7335          ?        ?      457.8        3.1       ?       ? 
1 1 1   52   11    5 o    184.7    3.5    0.0000   0.0000          ?        ?   341.6091  12.7704          ?        ?      184.7        3.5       ?       ? 
1 1 1   52   11    6 o    160.7    3.8    0.0000   0.0000          ?        ?   258.6013  12.1319          ?        ?      160.7        3.8       ?       ? 
1 1 1   52   11    7 o    264.1    3.0    0.0000   0.0000          ?        ?   697.9042  15.9630          ?        ?      264.1        3.0       ?       ? 
1 1 1   52   11    8 o    409.0    3.0    0.0000   0.0000          ?        ?  1674.2037  24.9023          ?        ?      409.0        3.0       ?       ? 
1 1 1   52   11    9 o    119.2    5.4    0.0000   0.0000          ?        ?   142.3903  12.7704          ?        ?      119.2        5.4       ?       ? 
1 1 1   52   11   10 o    491.2    3.2    0.0000   0.0000          ?        ?  2414.8889  31.2876          ?        ?      491.2        3.2       ?       ? 
1 1 1   52   11   11 o    271.7    3.1    0.0000   0.0000          ?        ?   738.7695  16.6016          ?        ?      271.7        3.1       ?       ? 
1 1 1   52   11   12 o    197.9    3.7    0.0000   0.0000          ?        ?   392.0523  14.6860          ?        ?      197.9        3.7       ?       ? 
1 1 1   52   11   13 o    309.7    3.4    0.0000   0.0000          ?        ?   960.3365  21.0712          ?        ?      309.7        3.4       ?       ? 
1 1 1   52   11   14 o    379.4    3.2    0.0000   0.0000          ?        ?  1440.5049  24.2638          ?        ?      379.4        3.2       ?       ? 
1 1 1   52   11   15 o     29.9   12.9    0.0000   0.0000          ?        ?    -1.2770  14.0475          ?        ?       29.9       12.9       ?       ? 
1 1 1   52   11   16 o    273.1    3.3    0.0000   0.0000          ?        ?   746.4318  17.8786          ?        ?      273.1        3.3       ?       ? 
1 1 1   52   11   17 o    147.4    4.8    0.0000   0.0000          ?        ?   217.7359  14.0475          ?        ?      147.4        4.8       ?       ? 
1 1 1   52   11   18 o    100.8    7.3    0.0000   0.0000          ?        ?   102.1635  14.6860          ?        ?      100.8        7.3       ?       ? 
1 1 1   52   11   19 o     53.4   14.6    0.0000   0.0000          ?        ?    30.0105  15.9630          ?        ?       53.4       14.6       ?       ? 
1 1 1   52   11   20 o    188.8    3.7    0.0000   0.0000          ?        ?   356.9336  14.0475          ?        ?      188.8        3.7       ?       ? 
1 1 1   52   11   21 o     17.4    8.8    0.0000   0.0000          ?        ?   -53.6358  15.3245          ?        ?       17.4        8.8       ?       ? 
1 1 1   52   11   22 o     29.9   12.9    0.0000   0.0000          ?        ?    -1.2770  14.0475          ?        ?       29.9       12.9       ?       ? 
1 1 1   52   11   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   52   11   24 o     97.9    7.2    0.0000   0.0000          ?        ?    96.4168  14.0475          ?        ?       97.9        7.2       ?       ? 
1 1 1   52   11   25 o    106.6    6.9    0.0000   0.0000          ?        ?   114.2954  14.6860          ?        ?      106.6        6.9       ?       ? 
1 1 1   52   11   26 o    222.3    3.4    0.0000   0.0000          ?        ?   494.8542  15.3245          ?        ?      222.3        3.4       ?       ? 
1 1 1   52   11   27 o    338.7    2.7    0.0000   0.0000          ?        ?  1148.0619  18.5171          ?        ?      338.7        2.7       ?       ? 
1 1 1   52   11   28 o    185.6    4.6    0.0000   0.0000          ?        ?   345.4402  17.2401          ?        ?      185.6        4.6       ?       ? 
1 1 1   52   11   29 f    187.3    4.6    0.0000   0.0000          ?        ?   351.8254  17.2401          ?        ?      187.3        4.6       ?       ? 
1 1 1   52   11   30 o    388.7    2.7    0.0000   0.0000          ?        ?  1512.6577  21.0712          ?        ?      388.7        2.7       ?       ? 
1 1 1   52   11   31 o    207.7    4.0    0.0000   0.0000          ?        ?   432.2791  16.6016          ?        ?      207.7        4.0       ?       ? 
1 1 1   52   11   32 o    210.6    3.8    0.0000   0.0000          ?        ?   444.4110  15.9630          ?        ?      210.6        3.8       ?       ? 
1 1 1   52   11   33 o    176.2    4.7    0.0000   0.0000          ?        ?   311.5985  16.6016          ?        ?      176.2        4.7       ?       ? 
1 1 1   52   11   34 o     93.3    8.9    0.0000   0.0000          ?        ?    88.1160  16.6016          ?        ?       93.3        8.9       ?       ? 
1 1 1   52   11   35 o    113.1    7.3    0.0000   0.0000          ?        ?   128.9814  16.6016          ?        ?      113.1        7.3       ?       ? 
1 1 1   52   11   36 f    299.7    3.1    0.0000   0.0000          ?        ?   899.6769  18.5171          ?        ?      299.7        3.1       ?       ? 
1 1 1   52   11   37 o    290.5    3.2    0.0000   0.0000          ?        ?   845.4026  18.5171          ?        ?      290.5        3.2       ?       ? 
1 1 1   52   11   38 o    134.2    6.2    0.0000   0.0000          ?        ?   181.3401  16.6016          ?        ?      134.2        6.2       ?       ? 
1 1 1   52   11   39 o     25.9   12.1    0.0000   0.0000          ?        ?   -13.4090  15.3245          ?        ?       25.9       12.1       ?       ? 
1 1 1   52   12    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   52   12    1 o    197.4    3.4    0.0000   0.0000          ?        ?   390.1367  13.4090          ?        ?      197.4        3.4       ?       ? 
1 1 1   52   12    2 o     34.0   12.0    0.0000   0.0000          ?        ?    10.2163  10.2163          ?        ?       34.0       12.0       ?       ? 
1 1 1   52   12    3 o    122.1    4.4    0.0000   0.0000          ?        ?   149.4141  10.8549          ?        ?      122.1        4.4       ?       ? 
1 1 1   52   12    4 o    139.2    4.1    0.0000   0.0000          ?        ?   194.1106  11.4934          ?        ?      139.2        4.1       ?       ? 
1 1 1   52   12    5 o    257.5    2.9    0.0000   0.0000          ?        ?   663.4240  14.6860          ?        ?      257.5        2.9       ?       ? 
1 1 1   52   12    6 o     35.5   13.3    0.0000   0.0000          ?        ?     9.5778  12.7704          ?        ?       35.5       13.3       ?       ? 
1 1 1   52   12    7 o     16.3    8.2    0.0000   0.0000          ?        ?   -42.1424  12.7704          ?        ?       16.3        8.2       ?       ? 
1 1 1   52   12    8 o    331.4    2.9    0.0000   0.0000          ?        ?  1098.8958  19.1556          ?        ?      331.4        2.9       ?       ? 
1 1 1   52   12    9 o    307.2    2.9    0.0000   0.0000          ?        ?   944.3735  17.8786          ?        ?      307.2        2.9       ?       ? 
1 1 1   52   12   10 f    231.3    3.6    0.0000   0.0000          ?        ?   535.7197  16.6016          ?        ?      231.3        3.6       ?       ? 
1 1 1   52   12   11 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   52   12   12 o    196.6    3.9    0.0000   0.0000          ?        ?   386.9441  15.3245          ?        ?      196.6        3.9       ?       ? 
1 1 1   52   12   13 o    278.6    3.1    0.0000   0.0000          ?        ?   777.0808  17.2401          ?        ?      278.6        3.1       ?       ? 
1 1 1   52   12   14 o    172.2    4.1    0.0000   0.0000          ?        ?   296.9126  14.0475          ?        ?      172.2        4.1       ?       ? 
1 1 1   52   12   15 o    244.2    3.3    0.0000   0.0000          ?        ?   597.0177  15.9630          ?        ?      244.2        3.3       ?       ? 
1 1 1   52   12   16 o    290.5    3.3    0.0000   0.0000          ?        ?   844.7642  19.1556          ?        ?      290.5        3.3       ?       ? 
1 1 1   52   12   17 o     78.8    8.9    0.0000   0.0000          ?        ?    62.5751  14.0475          ?        ?       78.8        8.9       ?       ? 
1 1 1   52   12   18 o     73.4    9.6    0.0000   0.0000          ?        ?    54.2743  14.0475          ?        ?       73.4        9.6       ?       ? 
1 1 1   52   12   19 o    128.1    5.7    0.0000   0.0000          ?        ?   164.7386  14.6860          ?        ?      128.1        5.7       ?       ? 
1 1 1   52   12   20 o     54.9   13.5    0.0000   0.0000          ?        ?    31.9261  14.6860          ?        ?       54.9       13.5       ?       ? 
1 1 1   52   12   21 o     99.5    7.4    0.0000   0.0000          ?        ?    99.6094  14.6860          ?        ?       99.5        7.4       ?       ? 
1 1 1   52   12   22 o     42.2   14.1    0.0000   0.0000          ?        ?    17.2401  14.0475          ?        ?       42.2       14.1       ?       ? 
1 1 1   52   12   23 o    263.3    3.0    0.0000   0.0000          ?        ?   694.0730  15.9630          ?        ?      263.3        3.0       ?       ? 
1 1 1   52   12   24 o    126.1    5.6    0.0000   0.0000          ?        ?   159.6304  14.0475          ?        ?      126.1        5.6       ?       ? 
1 1 1   52   12   25 o    126.6    5.8    0.0000   0.0000          ?        ?   160.9075  14.6860          ?        ?      126.6        5.8       ?       ? 
1 1 1   52   12   26 o    265.7    3.5    0.0000   0.0000          ?        ?   706.8434  18.5171          ?        ?      265.7        3.5       ?       ? 
1 1 1   52   12   27 o    317.5    3.0    0.0000   0.0000          ?        ?  1008.8642  19.1556          ?        ?      317.5        3.0       ?       ? 
1 1 1   52   12   28 o    164.9    5.0    0.0000   0.0000          ?        ?   272.6487  16.6016          ?        ?      164.9        5.0       ?       ? 
1 1 1   52   12   29 o     49.4   14.5    0.0000   0.0000          ?        ?    25.5409  15.3245          ?        ?       49.4       14.5       ?       ? 
1 1 1   52   12   30 o    132.0    5.6    0.0000   0.0000          ?        ?   174.9549  14.6860          ?        ?      132.0        5.6       ?       ? 
1 1 1   52   12   31 o    206.5    3.9    0.0000   0.0000          ?        ?   427.1710  15.9630          ?        ?      206.5        3.9       ?       ? 
1 1 1   52   12   32 o     45.7   14.8    0.0000   0.0000          ?        ?    21.0712  15.3245          ?        ?       45.7       14.8       ?       ? 
1 1 1   52   12   33 o    128.2    6.0    0.0000   0.0000          ?        ?   165.3771  15.3245          ?        ?      128.2        6.0       ?       ? 
1 1 1   52   12   34 o    158.3    5.0    0.0000   0.0000          ?        ?   251.5775  15.9630          ?        ?      158.3        5.0       ?       ? 
1 1 1   52   12   35 o    188.1    4.6    0.0000   0.0000          ?        ?   355.0180  17.2401          ?        ?      188.1        4.6       ?       ? 
1 1 1   52   12   36 o    172.3    4.8    0.0000   0.0000          ?        ?   298.1896  16.6016          ?        ?      172.3        4.8       ?       ? 
1 1 1   52   12   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   52   12   38 o     71.8   11.6    0.0000   0.0000          ?        ?    52.9973  16.6016          ?        ?       71.8       11.6       ?       ? 
1 1 1   52   13    0 o     99.3    6.8  100.2479  13.4090   100.2479  13.4090   100.2479  13.4090       99.3      6.8       99.3        6.8     0.0     0.0 
1 1 1   52   13    1 o    374.8    3.1    0.0000   0.0000          ?        ?  1406.0247  22.9868          ?        ?      374.8        3.1       ?       ? 
1 1 1   52   13    2 o    113.2    4.8    0.0000   0.0000          ?        ?   128.3428  10.8549          ?        ?      113.2        4.8       ?       ? 
1 1 1   52   13    3 o    239.8    3.1    0.0000   0.0000          ?        ?   575.3080  14.6860          ?        ?      239.8        3.1       ?       ? 
1 1 1   52   13    4 o    378.5    3.1    0.0000   0.0000          ?        ?  1433.4811  23.6253          ?        ?      378.5        3.1       ?       ? 
1 1 1   52   13    5 o    313.2    2.9    0.0000   0.0000          ?        ?   981.4077  17.8786          ?        ?      313.2        2.9       ?       ? 
1 1 1   52   13    6 o    172.4    3.3    0.0000   0.0000          ?        ?   297.5511  11.4934          ?        ?      172.4        3.3       ?       ? 
1 1 1   52   13    7 o    290.2    3.0    0.0000   0.0000          ?        ?   842.8486  17.2401          ?        ?      290.2        3.0       ?       ? 
1 1 1   52   13    8 o    191.0    3.3    0.0000   0.0000          ?        ?   365.2344  12.7704          ?        ?      191.0        3.3       ?       ? 
1 1 1   52   13    9 o    136.0    4.5    0.0000   0.0000          ?        ?   185.1713  12.1319          ?        ?      136.0        4.5       ?       ? 
1 1 1   52   13   10 o    120.0    5.1    0.0000   0.0000          ?        ?   144.3059  12.1319          ?        ?      120.0        5.1       ?       ? 
1 1 1   52   13   11 o    502.3    3.5    0.0000   0.0000          ?        ?  2525.9917  35.1187          ?        ?      502.3        3.5       ?       ? 
1 1 1   52   13   12 o    277.6    3.1    0.0000   0.0000          ?        ?   771.3342  17.2401          ?        ?      277.6        3.1       ?       ? 
1 1 1   52   13   13 o     76.4    8.4    0.0000   0.0000          ?        ?    58.7440  12.7704          ?        ?       76.4        8.4       ?       ? 
1 1 1   52   13   14 o     87.0    7.3    0.0000   0.0000          ?        ?    75.9841  12.7704          ?        ?       87.0        7.3       ?       ? 
1 1 1   52   13   15 o    255.2    3.4    0.0000   0.0000          ?        ?   651.9305  17.2401          ?        ?      255.2        3.4       ?       ? 
1 1 1   52   13   16 o     27.4   12.4    0.0000   0.0000          ?        ?    -8.3008  14.6860          ?        ?       27.4       12.4       ?       ? 
1 1 1   52   13   17 o     64.1   10.5    0.0000   0.0000          ?        ?    41.5039  13.4090          ?        ?       64.1       10.5       ?       ? 
1 1 1   52   13   18 o     23.9   11.4    0.0000   0.0000          ?        ?   -20.4327  15.3245          ?        ?       23.9       11.4       ?       ? 
1 1 1   52   13   19 f    105.7    6.9    0.0000   0.0000          ?        ?   112.3798  14.6860          ?        ?      105.7        6.9       ?       ? 
1 1 1   52   13   20 o    210.2    3.9    0.0000   0.0000          ?        ?   442.4955  16.6016          ?        ?      210.2        3.9       ?       ? 
1 1 1   52   13   21 o    153.9    4.8    0.0000   0.0000          ?        ?   237.5300  14.6860          ?        ?      153.9        4.8       ?       ? 
1 1 1   52   13   22 o    260.3    3.2    0.0000   0.0000          ?        ?   678.1099  16.6016          ?        ?      260.3        3.2       ?       ? 
1 1 1   52   13   23 o    214.7    3.6    0.0000   0.0000          ?        ?   461.6512  15.3245          ?        ?      214.7        3.6       ?       ? 
1 1 1   52   13   24 o     58.6   13.4    0.0000   0.0000          ?        ?    36.3957  15.3245          ?        ?       58.6       13.4       ?       ? 
1 1 1   52   13   25 o     92.1    8.3    0.0000   0.0000          ?        ?    85.5619  15.3245          ?        ?       92.1        8.3       ?       ? 
1 1 1   52   13   26 o    177.0    4.5    0.0000   0.0000          ?        ?   314.1526  15.9630          ?        ?      177.0        4.5       ?       ? 
1 1 1   52   13   27 o     84.1    8.7    0.0000   0.0000          ?        ?    71.5144  14.6860          ?        ?       84.1        8.7       ?       ? 
1 1 1   52   13   28 o     41.8   14.7    0.0000   0.0000          ?        ?    15.9630  15.3245          ?        ?       41.8       14.7       ?       ? 
1 1 1   52   13   29 o    261.0    3.4    0.0000   0.0000          ?        ?   682.5797  17.8786          ?        ?      261.0        3.4       ?       ? 
1 1 1   52   13   30 o     82.6    8.9    0.0000   0.0000          ?        ?    68.9603  14.6860          ?        ?       82.6        8.9       ?       ? 
1 1 1   52   13   31 o    290.2    3.1    0.0000   0.0000          ?        ?   843.4871  17.8786          ?        ?      290.2        3.1       ?       ? 
1 1 1   52   13   32 o     96.1    7.6    0.0000   0.0000          ?        ?    93.2242  14.6860          ?        ?       96.1        7.6       ?       ? 
1 1 1   52   13   33 o     26.2   12.1    0.0000   0.0000          ?        ?   -10.8549  14.6860          ?        ?       26.2       12.1       ?       ? 
1 1 1   52   13   34 o     25.8   12.1    0.0000   0.0000          ?        ?   -15.9630  15.9630          ?        ?       25.8       12.1       ?       ? 
1 1 1   52   13   35 o    147.0    5.2    0.0000   0.0000          ?        ?   217.0974  15.3245          ?        ?      147.0        5.2       ?       ? 
1 1 1   52   13   36 o    143.1    5.8    0.0000   0.0000          ?        ?   206.2425  16.6016          ?        ?      143.1        5.8       ?       ? 
1 1 1   52   14    0 o    229.3    6.4  528.0574  29.3720   528.0574  29.3720   528.0574  29.3720      229.3      6.4      229.3        6.4     0.0     0.0 
1 1 1   52   14    1 o    441.9    3.8    0.0000   0.0000          ?        ?  1955.1533  33.8416          ?        ?      441.9        3.8       ?       ? 
1 1 1   52   14    2 o    316.7    3.9    0.0000   0.0000          ?        ?  1004.3945  24.9023          ?        ?      316.7        3.9       ?       ? 
1 1 1   52   14    3 o    502.9    3.9    0.0000   0.0000          ?        ?  2533.0154  39.5883          ?        ?      502.9        3.9       ?       ? 
1 1 1   52   14    4 o    207.8    3.7    0.0000   0.0000          ?        ?   432.2791  15.3245          ?        ?      207.8        3.7       ?       ? 
1 1 1   52   14    5 o    106.1    6.3    0.0000   0.0000          ?        ?   113.0183  13.4090          ?        ?      106.1        6.3       ?       ? 
1 1 1   52   14    6 o    234.5    3.7    0.0000   0.0000          ?        ?   550.4056  17.2401          ?        ?      234.5        3.7       ?       ? 
1 1 1   52   14    7 o    298.7    3.7    0.0000   0.0000          ?        ?   893.2917  22.3483          ?        ?      298.7        3.7       ?       ? 
1 1 1   52   14    8 o    149.4    4.3    0.0000   0.0000          ?        ?   223.4826  12.7704          ?        ?      149.4        4.3       ?       ? 
1 1 1   52   14    9 o     68.0    8.9    0.0000   0.0000          ?        ?    46.6121  12.1319          ?        ?       68.0        8.9       ?       ? 
1 1 1   52   14   10 o    314.3    3.0    0.0000   0.0000          ?        ?   988.4315  19.1556          ?        ?      314.3        3.0       ?       ? 
1 1 1   52   14   11 f    141.5    4.1    0.0000   0.0000          ?        ?   200.4958  11.4934          ?        ?      141.5        4.1       ?       ? 
1 1 1   52   14   12 o    171.1    3.7    0.0000   0.0000          ?        ?   293.0815  12.7704          ?        ?      171.1        3.7       ?       ? 
1 1 1   52   14   13 o    326.3    3.1    0.0000   0.0000          ?        ?  1065.6925  20.4327          ?        ?      326.3        3.1       ?       ? 
1 1 1   52   14   14 o    151.4    4.6    0.0000   0.0000          ?        ?   229.8678  14.0475          ?        ?      151.4        4.6       ?       ? 
1 1 1   52   14   15 o    198.8    3.9    0.0000   0.0000          ?        ?   395.8834  15.3245          ?        ?      198.8        3.9       ?       ? 
1 1 1   52   14   16 o    146.1    4.8    0.0000   0.0000          ?        ?   213.9047  14.0475          ?        ?      146.1        4.8       ?       ? 
1 1 1   52   14   17 o     26.1   12.0    0.0000   0.0000          ?        ?   -11.4934  14.6860          ?        ?       26.1       12.0       ?       ? 
1 1 1   52   14   18 o    212.6    3.8    0.0000   0.0000          ?        ?   452.7119  15.9630          ?        ?      212.6        3.8       ?       ? 
1 1 1   52   14   19 o    235.0    3.4    0.0000   0.0000          ?        ?   552.9597  15.9630          ?        ?      235.0        3.4       ?       ? 
1 1 1   52   14   20 o     17.7    8.9    0.0000   0.0000          ?        ?   -46.6121  14.6860          ?        ?       17.7        8.9       ?       ? 
1 1 1   52   14   21 o    151.0    4.7    0.0000   0.0000          ?        ?   228.5907  14.0475          ?        ?      151.0        4.7       ?       ? 
1 1 1   52   14   22 o    154.7    5.0    0.0000   0.0000          ?        ?   240.0841  15.3245          ?        ?      154.7        5.0       ?       ? 
1 1 1   52   14   23 o    178.5    4.1    0.0000   0.0000          ?        ?   319.2608  14.6860          ?        ?      178.5        4.1       ?       ? 
1 1 1   52   14   24 o     71.0    9.9    0.0000   0.0000          ?        ?    51.0817  14.0475          ?        ?       71.0        9.9       ?       ? 
1 1 1   52   14   25 o     65.4   10.7    0.0000   0.0000          ?        ?    43.4195  14.0475          ?        ?       65.4       10.7       ?       ? 
1 1 1   52   14   26 o    112.7    6.2    0.0000   0.0000          ?        ?   127.7043  14.0475          ?        ?      112.7        6.2       ?       ? 
1 1 1   52   14   27 o    263.0    3.3    0.0000   0.0000          ?        ?   692.7960  17.2401          ?        ?      263.0        3.3       ?       ? 
1 1 1   52   14   28 f     70.3   11.3    0.0000   0.0000          ?        ?    50.4432  15.9630          ?        ?       70.3       11.3       ?       ? 
1 1 1   52   14   29 o     47.2   14.7    0.0000   0.0000          ?        ?    22.9868  15.3245          ?        ?       47.2       14.7       ?       ? 
1 1 1   52   14   30 o    111.8    6.6    0.0000   0.0000          ?        ?   125.7888  14.6860          ?        ?      111.8        6.6       ?       ? 
1 1 1   52   14   31 o    134.5    5.7    0.0000   0.0000          ?        ?   181.9787  15.3245          ?        ?      134.5        5.7       ?       ? 
1 1 1   52   14   32 o    273.5    3.2    0.0000   0.0000          ?        ?   749.6244  17.2401          ?        ?      273.5        3.2       ?       ? 
1 1 1   52   14   33 o    120.2    6.1    0.0000   0.0000          ?        ?   145.5829  14.6860          ?        ?      120.2        6.1       ?       ? 
1 1 1   52   14   34 o    163.2    4.7    0.0000   0.0000          ?        ?   267.5406  15.3245          ?        ?      163.2        4.7       ?       ? 
1 1 1   52   14   35 o     85.3    9.4    0.0000   0.0000          ?        ?    74.0685  15.9630          ?        ?       85.3        9.4       ?       ? 
1 1 1   52   15    0 o    289.1    5.5  837.7404  31.9261   837.7404  31.9261   837.7404  31.9261      289.1      5.5      289.1        5.5     0.0     0.0 
1 1 1   52   15    1 o    366.4    3.8    0.0000   0.0000          ?        ?  1344.0880  28.0950          ?        ?      366.4        3.8       ?       ? 
1 1 1   52   15    2 o    180.9    5.1    0.0000   0.0000          ?        ?   328.2001  18.5171          ?        ?      180.9        5.1       ?       ? 
1 1 1   52   15    3 o    247.4    4.0    0.0000   0.0000          ?        ?   612.9808  19.7942          ?        ?      247.4        4.0       ?       ? 
1 1 1   52   15    4 o    428.5    3.8    0.0000   0.0000          ?        ?  1838.3037  32.5646          ?        ?      428.5        3.8       ?       ? 
1 1 1   52   15    5 o    255.6    4.6    0.0000   0.0000          ?        ?   654.4847  23.6253          ?        ?      255.6        4.6       ?       ? 
1 1 1   52   15    6 o    284.7    3.5    0.0000   0.0000          ?        ?   811.5610  19.7942          ?        ?      284.7        3.5       ?       ? 
1 1 1   52   15    7 o     52.1   12.9    0.0000   0.0000          ?        ?    28.7335  13.4090          ?        ?       52.1       12.9       ?       ? 
1 1 1   52   15    8 o    252.3    3.5    0.0000   0.0000          ?        ?   637.2446  17.8786          ?        ?      252.3        3.5       ?       ? 
1 1 1   52   15    9 o    181.7    4.2    0.0000   0.0000          ?        ?   330.7542  15.3245          ?        ?      181.7        4.2       ?       ? 
1 1 1   52   15   10 o    272.5    3.5    0.0000   0.0000          ?        ?   743.2392  19.1556          ?        ?      272.5        3.5       ?       ? 
1 1 1   52   15   11 o     80.1    6.8    0.0000   0.0000          ?        ?    64.4907  10.8549          ?        ?       80.1        6.8       ?       ? 
1 1 1   52   15   12 o    163.6    3.7    0.0000   0.0000          ?        ?   268.1791  12.1319          ?        ?      163.6        3.7       ?       ? 
1 1 1   52   15   13 o    411.2    3.1    0.0000   0.0000          ?        ?  1692.7208  25.5409          ?        ?      411.2        3.1       ?       ? 
1 1 1   52   15   14 o    193.8    3.3    0.0000   0.0000          ?        ?   376.0892  12.7704          ?        ?      193.8        3.3       ?       ? 
1 1 1   52   15   15 o    184.7    3.5    0.0000   0.0000          ?        ?   341.6091  12.7704          ?        ?      184.7        3.5       ?       ? 
1 1 1   52   15   16 o    114.7    5.8    0.0000   0.0000          ?        ?   132.1740  13.4090          ?        ?      114.7        5.8       ?       ? 
1 1 1   52   15   17 o    164.2    4.3    0.0000   0.0000          ?        ?   270.0946  14.0475          ?        ?      164.2        4.3       ?       ? 
1 1 1   52   15   18 o    286.5    3.0    0.0000   0.0000          ?        ?   821.7773  17.2401          ?        ?      286.5        3.0       ?       ? 
1 1 1   52   15   19 o    152.0    4.8    0.0000   0.0000          ?        ?   231.7833  14.6860          ?        ?      152.0        4.8       ?       ? 
1 1 1   52   15   20 o    194.6    3.8    0.0000   0.0000          ?        ?   379.2819  14.6860          ?        ?      194.6        3.8       ?       ? 
1 1 1   52   15   21 o    205.7    3.7    0.0000   0.0000          ?        ?   423.9784  15.3245          ?        ?      205.7        3.7       ?       ? 
1 1 1   52   15   22 o    261.7    3.2    0.0000   0.0000          ?        ?   685.7722  16.6016          ?        ?      261.7        3.2       ?       ? 
1 1 1   52   15   23 o    341.5    2.9    0.0000   0.0000          ?        ?  1167.8560  19.7942          ?        ?      341.5        2.9       ?       ? 
1 1 1   52   15   24 o    251.7    3.4    0.0000   0.0000          ?        ?   634.6905  17.2401          ?        ?      251.7        3.4       ?       ? 
1 1 1   52   15   25 o    251.1    3.4    0.0000   0.0000          ?        ?   631.4979  17.2401          ?        ?      251.1        3.4       ?       ? 
1 1 1   52   15   26 o    145.9    5.3    0.0000   0.0000          ?        ?   213.9047  15.3245          ?        ?      145.9        5.3       ?       ? 
1 1 1   52   15   27 o    208.3    3.8    0.0000   0.0000          ?        ?   434.8332  15.9630          ?        ?      208.3        3.8       ?       ? 
1 1 1   52   15   28 o    119.1    6.7    0.0000   0.0000          ?        ?   143.0288  15.9630          ?        ?      119.1        6.7       ?       ? 
1 1 1   52   15   29 f     36.6   13.9    0.0000   0.0000          ?        ?    10.2163  14.0475          ?        ?       36.6       13.9       ?       ? 
1 1 1   52   15   30 o     97.1    7.2    0.0000   0.0000          ?        ?    95.1397  14.0475          ?        ?       97.1        7.2       ?       ? 
1 1 1   52   15   31 o    284.7    3.0    0.0000   0.0000          ?        ?   812.1995  17.2401          ?        ?      284.7        3.0       ?       ? 
1 1 1   52   15   32 o     89.4    8.6    0.0000   0.0000          ?        ?    81.0922  15.3245          ?        ?       89.4        8.6       ?       ? 
1 1 1   52   15   33 o    339.4    2.8    0.0000   0.0000          ?        ?  1153.8086  19.1556          ?        ?      339.4        2.8       ?       ? 
1 1 1   52   16    0 o    164.1    8.8  272.6487  28.7335   272.6487  28.7335   272.6487  28.7335      164.1      8.8      164.1        8.8     0.0     0.0 
1 1 1   52   16    1 o    161.8    6.9    0.0000   0.0000          ?        ?   263.0709  22.3483          ?        ?      161.8        6.9       ?       ? 
1 1 1   52   16    2 o    184.9    5.7    0.0000   0.0000          ?        ?   342.8861  21.0712          ?        ?      184.9        5.7       ?       ? 
1 1 1   52   16    3 o    307.8    4.0    0.0000   0.0000          ?        ?   948.8432  24.9023          ?        ?      307.8        4.0       ?       ? 
1 1 1   52   16    4 o     96.7    9.6    0.0000   0.0000          ?        ?    94.5012  18.5171          ?        ?       96.7        9.6       ?       ? 
1 1 1   52   16    5 o    184.4    5.0    0.0000   0.0000          ?        ?   340.9706  18.5171          ?        ?      184.4        5.0       ?       ? 
1 1 1   52   16    6 o    239.9    4.5    0.0000   0.0000          ?        ?   576.5850  21.7097          ?        ?      239.9        4.5       ?       ? 
1 1 1   52   16    7 o    309.9    4.0    0.0000   0.0000          ?        ?   962.2521  24.9023          ?        ?      309.9        4.0       ?       ? 
1 1 1   52   16    8 o    202.0    3.6    0.0000   0.0000          ?        ?   408.6538  14.6860          ?        ?      202.0        3.6       ?       ? 
1 1 1   52   16    9 o    124.6    5.6    0.0000   0.0000          ?        ?   155.7993  14.0475          ?        ?      124.6        5.6       ?       ? 
1 1 1   52   16   10 o    209.1    4.3    0.0000   0.0000          ?        ?   438.0258  17.8786          ?        ?      209.1        4.3       ?       ? 
1 1 1   52   16   11 o    173.0    5.0    0.0000   0.0000          ?        ?   300.1052  17.2401          ?        ?      173.0        5.0       ?       ? 
1 1 1   52   16   12 o    222.9    4.3    0.0000   0.0000          ?        ?   498.0469  19.1556          ?        ?      222.9        4.3       ?       ? 
1 1 1   52   16   13 o    196.0    4.7    0.0000   0.0000          ?        ?   385.0285  18.5171          ?        ?      196.0        4.7       ?       ? 
1 1 1   52   16   14 o     66.5    9.1    0.0000   0.0000          ?        ?    44.6965  12.1319          ?        ?       66.5        9.1       ?       ? 
1 1 1   52   16   15 o    136.1    4.9    0.0000   0.0000          ?        ?   185.8098  13.4090          ?        ?      136.1        4.9       ?       ? 
1 1 1   52   16   16 o     49.7   12.8    0.0000   0.0000          ?        ?    26.1794  12.7704          ?        ?       49.7       12.8       ?       ? 
1 1 1   52   16   17 o    134.4    5.7    0.0000   0.0000          ?        ?   181.3401  15.3245          ?        ?      134.4        5.7       ?       ? 
1 1 1   52   16   18 f    188.6    3.9    0.0000   0.0000          ?        ?   356.2951  14.6860          ?        ?      188.6        3.9       ?       ? 
1 1 1   52   16   19 f    193.6    3.8    0.0000   0.0000          ?        ?   375.4507  14.6860          ?        ?      193.6        3.8       ?       ? 
1 1 1   52   16   20 o     50.8   13.1    0.0000   0.0000          ?        ?    27.4564  13.4090          ?        ?       50.8       13.1       ?       ? 
1 1 1   52   16   21 o    209.9    3.5    0.0000   0.0000          ?        ?   441.2184  14.6860          ?        ?      209.9        3.5       ?       ? 
1 1 1   52   16   22 o    202.6    3.8    0.0000   0.0000          ?        ?   411.2079  15.3245          ?        ?      202.6        3.8       ?       ? 
1 1 1   52   16   23 o    199.1    3.8    0.0000   0.0000          ?        ?   397.1605  15.3245          ?        ?      199.1        3.8       ?       ? 
1 1 1   52   16   24 o    320.5    2.8    0.0000   0.0000          ?        ?  1028.6583  17.8786          ?        ?      320.5        2.8       ?       ? 
1 1 1   52   16   25 o     94.1    7.5    0.0000   0.0000          ?        ?    89.3930  14.0475          ?        ?       94.1        7.5       ?       ? 
1 1 1   52   16   26 o     89.2    8.2    0.0000   0.0000          ?        ?    80.4537  14.6860          ?        ?       89.2        8.2       ?       ? 
1 1 1   52   16   27 o    260.6    3.1    0.0000   0.0000          ?        ?   680.0255  15.9630          ?        ?      260.6        3.1       ?       ? 
1 1 1   52   16   28 o    295.8    3.0    0.0000   0.0000          ?        ?   876.6902  17.8786          ?        ?      295.8        3.0       ?       ? 
1 1 1   52   16   29 o    146.4    4.8    0.0000   0.0000          ?        ?   215.1818  14.0475          ?        ?      146.4        4.8       ?       ? 
1 1 1   52   16   30 o     52.3   14.3    0.0000   0.0000          ?        ?    29.3720  15.3245          ?        ?       52.3       14.3       ?       ? 
1 1 1   52   16   31 o    123.8    6.2    0.0000   0.0000          ?        ?   154.5222  15.3245          ?        ?      123.8        6.2       ?       ? 
1 1 1   52   17    0 o     56.1   26.4   47.8891  33.2031    47.8891  33.2031    47.8891  33.2031       56.1     26.4       56.1       26.4     0.0     0.0 
1 1 1   52   17    1 o    185.9    5.7    0.0000   0.0000          ?        ?   346.7172  21.0712          ?        ?      185.9        5.7       ?       ? 
1 1 1   52   17    2 o    154.6    6.2    0.0000   0.0000          ?        ?   240.0841  19.1556          ?        ?      154.6        6.2       ?       ? 
1 1 1   52   17    3 o    286.4    4.6    0.0000   0.0000          ?        ?   822.4159  26.1794          ?        ?      286.4        4.6       ?       ? 
1 1 1   52   17    4 o    357.8    4.8    0.0000   0.0000          ?        ?  1283.4285  34.4802          ?        ?      357.8        4.8       ?       ? 
1 1 1   52   17    5 o    204.8    5.1    0.0000   0.0000          ?        ?   420.7858  21.0712          ?        ?      204.8        5.1       ?       ? 
1 1 1   52   17    6 o    120.3    9.3    0.0000   0.0000          ?        ?   146.2215  22.3483          ?        ?      120.3        9.3       ?       ? 
1 1 1   52   17    7 o    107.2    9.5    0.0000   0.0000          ?        ?   116.2109  20.4327          ?        ?      107.2        9.5       ?       ? 
1 1 1   52   17    8 o    101.2    9.5    0.0000   0.0000          ?        ?   103.4405  19.1556          ?        ?      101.2        9.5       ?       ? 
1 1 1   52   17    9 o    133.1    7.2    0.0000   0.0000          ?        ?   178.1475  19.1556          ?        ?      133.1        7.2       ?       ? 
1 1 1   52   17   10 o    148.5    4.5    0.0000   0.0000          ?        ?   220.9285  13.4090          ?        ?      148.5        4.5       ?       ? 
1 1 1   52   17   11 o    497.6    3.5    0.0000   0.0000          ?        ?  2479.3794  34.4802          ?        ?      497.6        3.5       ?       ? 
1 1 1   52   17   12 o    221.8    4.3    0.0000   0.0000          ?        ?   492.9387  19.1556          ?        ?      221.8        4.3       ?       ? 
1 1 1   52   17   13 f    427.5    3.8    0.0000   0.0000          ?        ?  1830.6416  32.5646          ?        ?      427.5        3.8       ?       ? 
1 1 1   52   17   14 o    176.6    4.7    0.0000   0.0000          ?        ?   312.8756  16.6016          ?        ?      176.6        4.7       ?       ? 
1 1 1   52   17   15 o     24.1   11.5    0.0000   0.0000          ?        ?   -22.3483  15.9630          ?        ?       24.1       11.5       ?       ? 
1 1 1   52   17   16 o    135.9    4.9    0.0000   0.0000          ?        ?   185.1713  13.4090          ?        ?      135.9        4.9       ?       ? 
1 1 1   52   17   17 o     21.4   10.5    0.0000   0.0000          ?        ?   -26.8179  14.6860          ?        ?       21.4       10.5       ?       ? 
1 1 1   52   17   18 o     84.6    7.9    0.0000   0.0000          ?        ?    72.1529  13.4090          ?        ?       84.6        7.9       ?       ? 
1 1 1   52   17   19 o    133.1    5.8    0.0000   0.0000          ?        ?   178.1475  15.3245          ?        ?      133.1        5.8       ?       ? 
1 1 1   52   17   20 o    215.2    4.0    0.0000   0.0000          ?        ?   464.2052  17.2401          ?        ?      215.2        4.0       ?       ? 
1 1 1   52   17   21 o     90.3    7.8    0.0000   0.0000          ?        ?    82.3693  14.0475          ?        ?       90.3        7.8       ?       ? 
1 1 1   52   17   22 o     89.0    7.2    0.0000   0.0000          ?        ?    79.8152  12.7704          ?        ?       89.0        7.2       ?       ? 
1 1 1   52   17   23 o    232.1    3.2    0.0000   0.0000          ?        ?   539.5508  14.6860          ?        ?      232.1        3.2       ?       ? 
1 1 1   52   17   24 o    121.1    5.8    0.0000   0.0000          ?        ?   147.4985  14.0475          ?        ?      121.1        5.8       ?       ? 
1 1 1   52   17   25 f     39.9   14.1    0.0000   0.0000          ?        ?    14.6860  14.0475          ?        ?       39.9       14.1       ?       ? 
1 1 1   52   17   26 o    259.8    3.2    0.0000   0.0000          ?        ?   676.1944  16.6016          ?        ?      259.8        3.2       ?       ? 
1 1 1   52   17   27 o     24.2   11.4    0.0000   0.0000          ?        ?   -16.6016  14.6860          ?        ?       24.2       11.4       ?       ? 
1 1 1   52   17   28 o     55.1   13.0    0.0000   0.0000          ?        ?    32.5646  14.0475          ?        ?       55.1       13.0       ?       ? 
1 1 1   52   17   29 o    175.8    4.2    0.0000   0.0000          ?        ?   310.3215  14.6860          ?        ?      175.8        4.2       ?       ? 
1 1 1   52   18    0 o     21.1   15.2  -41.5039  28.7335   -41.5039  28.7335   -41.5039  28.7335       21.1     15.2       21.1       15.2     0.0     0.0 
1 1 1   52   18    1 o     32.4   14.6    0.0000   0.0000          ?        ?    -8.9393  19.7942          ?        ?       32.4       14.6       ?       ? 
1 1 1   52   18    2 o     23.3   11.4    0.0000   0.0000          ?        ?   -34.4802  17.8786          ?        ?       23.3       11.4       ?       ? 
1 1 1   52   18    3 o     90.0   11.3    0.0000   0.0000          ?        ?    82.3693  20.4327          ?        ?       90.0       11.3       ?       ? 
1 1 1   52   18    4 o    321.2    5.3    0.0000   0.0000          ?        ?  1035.0436  33.8416          ?        ?      321.2        5.3       ?       ? 
1 1 1   52   18    5 o    167.8    5.9    0.0000   0.0000          ?        ?   282.8651  19.7942          ?        ?      167.8        5.9       ?       ? 
1 1 1   52   18    6 o    115.3    8.0    0.0000   0.0000          ?        ?   134.0895  18.5171          ?        ?      115.3        8.0       ?       ? 
1 1 1   52   18    7 o    118.3    7.8    0.0000   0.0000          ?        ?   141.1133  18.5171          ?        ?      118.3        7.8       ?       ? 
1 1 1   52   18    8 o    184.5    5.4    0.0000   0.0000          ?        ?   341.6091  19.7942          ?        ?      184.5        5.4       ?       ? 
1 1 1   52   18    9 f     61.4   14.7    0.0000   0.0000          ?        ?    40.2269  17.8786          ?        ?       61.4       14.7       ?       ? 
1 1 1   52   18   10 o     96.6    9.9    0.0000   0.0000          ?        ?    94.5012  19.1556          ?        ?       96.6        9.9       ?       ? 
1 1 1   52   18   11 o    181.8    4.6    0.0000   0.0000          ?        ?   331.3927  16.6016          ?        ?      181.8        4.6       ?       ? 
1 1 1   52   18   12 f    153.3    4.8    0.0000   0.0000          ?        ?   235.6145  14.6860          ?        ?      153.3        4.8       ?       ? 
1 1 1   52   18   13 o     21.0   10.2    0.0000   0.0000          ?        ?   -22.3483  13.4090          ?        ?       21.0       10.2       ?       ? 
1 1 1   52   18   14 f    147.1    5.2    0.0000   0.0000          ?        ?   217.0974  15.3245          ?        ?      147.1        5.2       ?       ? 
1 1 1   52   18   15 o    214.3    4.3    0.0000   0.0000          ?        ?   460.3741  18.5171          ?        ?      214.3        4.3       ?       ? 
1 1 1   52   18   16 o    230.0    4.7    0.0000   0.0000          ?        ?   530.6115  21.7097          ?        ?      230.0        4.7       ?       ? 
1 1 1   52   18   17 o    257.8    4.8    0.0000   0.0000          ?        ?   667.2551  24.9023          ?        ?      257.8        4.8       ?       ? 
1 1 1   52   18   18 f    138.0    4.2    0.0000   0.0000          ?        ?   190.9180  11.4934          ?        ?      138.0        4.2       ?       ? 
1 1 1   52   18   19 o    169.1    3.8    0.0000   0.0000          ?        ?   286.6962  12.7704          ?        ?      169.1        3.8       ?       ? 
1 1 1   52   18   20 o    127.3    5.3    0.0000   0.0000          ?        ?   162.8230  13.4090          ?        ?      127.3        5.3       ?       ? 
1 1 1   52   18   21 f    209.9    3.8    0.0000   0.0000          ?        ?   441.8569  15.9630          ?        ?      209.9        3.8       ?       ? 
1 1 1   52   18   22 o     68.2    9.4    0.0000   0.0000          ?        ?    47.2506  12.7704          ?        ?       68.2        9.4       ?       ? 
1 1 1   52   18   23 o    128.5    5.5    0.0000   0.0000          ?        ?   166.0156  14.0475          ?        ?      128.5        5.5       ?       ? 
1 1 1   52   18   24 o     74.3    9.5    0.0000   0.0000          ?        ?    56.1899  14.0475          ?        ?       74.3        9.5       ?       ? 
1 1 1   52   18   25 o    130.9    5.6    0.0000   0.0000          ?        ?   172.4008  14.6860          ?        ?      130.9        5.6       ?       ? 
1 1 1   52   18   26 o     77.2    9.1    0.0000   0.0000          ?        ?    60.6596  14.0475          ?        ?       77.2        9.1       ?       ? 
1 1 1   52   19    0 o    142.2    9.7  206.2425  27.4564   206.2425  27.4564   206.2425  27.4564      142.2      9.7      142.2        9.7     0.0     0.0 
1 1 1   52   19    1 o    284.8    4.8    0.0000   0.0000          ?        ?   813.4766  27.4564          ?        ?      284.8        4.8       ?       ? 
1 1 1   52   19    2 o    229.7    5.0    0.0000   0.0000          ?        ?   529.3344  22.9868          ?        ?      229.7        5.0       ?       ? 
1 1 1   52   19    3 o    287.8    4.9    0.0000   0.0000          ?        ?   830.7167  28.0950          ?        ?      287.8        4.9       ?       ? 
1 1 1   52   19    4 o    264.5    4.6    0.0000   0.0000          ?        ?   701.7353  24.2638          ?        ?      264.5        4.6       ?       ? 
1 1 1   52   19    5 o    162.3    6.3    0.0000   0.0000          ?        ?   264.9865  20.4327          ?        ?      162.3        6.3       ?       ? 
1 1 1   52   19    6 o    102.7    8.7    0.0000   0.0000          ?        ?   106.6331  17.8786          ?        ?      102.7        8.7       ?       ? 
1 1 1   52   19    7 o     45.2   16.4    0.0000   0.0000          ?        ?    17.8786  19.1556          ?        ?       45.2       16.4       ?       ? 
1 1 1   52   19    8 o     30.2   13.8    0.0000   0.0000          ?        ?   -11.4934  18.5171          ?        ?       30.2       13.8       ?       ? 
1 1 1   52   19    9 o     28.4   13.4    0.0000   0.0000          ?        ?   -21.0712  19.7942          ?        ?       28.4       13.4       ?       ? 
1 1 1   52   19   10 o     30.8   14.3    0.0000   0.0000          ?        ?   -17.2401  21.0712          ?        ?       30.8       14.3       ?       ? 
1 1 1   52   19   11 o    111.6    8.0    0.0000   0.0000          ?        ?   125.7888  17.8786          ?        ?      111.6        8.0       ?       ? 
1 1 1   52   19   12 o    190.0    4.4    0.0000   0.0000          ?        ?   362.0418  16.6016          ?        ?      190.0        4.4       ?       ? 
1 1 1   52   19   13 o     65.3   10.8    0.0000   0.0000          ?        ?    43.4195  14.0475          ?        ?       65.3       10.8       ?       ? 
1 1 1   52   19   14 o     95.0    8.4    0.0000   0.0000          ?        ?    91.3086  15.9630          ?        ?       95.0        8.4       ?       ? 
1 1 1   52   19   15 o    151.5    5.3    0.0000   0.0000          ?        ?   230.5063  15.9630          ?        ?      151.5        5.3       ?       ? 
1 1 1   52   19   16 o    143.4    6.0    0.0000   0.0000          ?        ?   206.8810  17.2401          ?        ?      143.4        6.0       ?       ? 
1 1 1   52   19   17 o     96.9    8.9    0.0000   0.0000          ?        ?    95.1397  17.2401          ?        ?       96.9        8.9       ?       ? 
1 1 1   52   19   18 o    199.9    4.6    0.0000   0.0000          ?        ?   400.9916  18.5171          ?        ?      199.9        4.6       ?       ? 
1 1 1   52   19   19 o    154.2    5.2    0.0000   0.0000          ?        ?   238.8071  15.9630          ?        ?      154.2        5.2       ?       ? 
1 1 1   52   19   20 o     26.0   11.3    0.0000   0.0000          ?        ?    -1.2770  10.8549          ?        ?       26.0       11.3       ?       ? 
1 1 1   52   19   21 o    266.2    3.0    0.0000   0.0000          ?        ?   710.0360  15.9630          ?        ?      266.2        3.0       ?       ? 
1 1 1   52   19   22 o     77.8    8.2    0.0000   0.0000          ?        ?    61.2981  12.7704          ?        ?       77.8        8.2       ?       ? 
1 1 1   52   19   23 o    246.3    3.0    0.0000   0.0000          ?        ?   607.8726  14.6860          ?        ?      246.3        3.0       ?       ? 
1 1 1   52   19   24 o    106.7    6.6    0.0000   0.0000          ?        ?   114.9339  14.0475          ?        ?      106.7        6.6       ?       ? 
1 1 1   52   20    0 o    257.4    6.5  665.9781  33.2031   665.9781  33.2031   665.9781  33.2031      257.4      6.5      257.4        6.5     0.0     0.0 
1 1 1   52   20    1 o    376.1    4.0    0.0000   0.0000          ?        ?  1418.1566  30.0105          ?        ?      376.1        4.0       ?       ? 
1 1 1   52   20    2 o    187.3    5.6    0.0000   0.0000          ?        ?   352.4639  21.0712          ?        ?      187.3        5.6       ?       ? 
1 1 1   52   20    3 o     65.3   15.8    0.0000   0.0000          ?        ?    45.9736  20.4327          ?        ?       65.3       15.8       ?       ? 
1 1 1   52   20    4 o    327.9    3.9    0.0000   0.0000          ?        ?  1077.8246  25.5409          ?        ?      327.9        3.9       ?       ? 
1 1 1   52   20    5 o     91.5    9.8    0.0000   0.0000          ?        ?    84.9234  17.8786          ?        ?       91.5        9.8       ?       ? 
1 1 1   52   20    6 o     81.1   11.0    0.0000   0.0000          ?        ?    67.0448  17.8786          ?        ?       81.1       11.0       ?       ? 
1 1 1   52   20    7 o    114.4    8.1    0.0000   0.0000          ?        ?   132.1740  18.5171          ?        ?      114.4        8.1       ?       ? 
1 1 1   52   20    8 o    119.5    8.0    0.0000   0.0000          ?        ?   144.3059  19.1556          ?        ?      119.5        8.0       ?       ? 
1 1 1   52   20    9 o    203.8    5.0    0.0000   0.0000          ?        ?   416.9547  20.4327          ?        ?      203.8        5.0       ?       ? 
1 1 1   52   20   10 o    136.0    7.3    0.0000   0.0000          ?        ?   186.4483  19.7942          ?        ?      136.0        7.3       ?       ? 
1 1 1   52   20   11 o    196.6    5.8    0.0000   0.0000          ?        ?   388.8597  22.9868          ?        ?      196.6        5.8       ?       ? 
1 1 1   52   20   12 o     57.1   15.7    0.0000   0.0000          ?        ?    35.1187  18.5171          ?        ?       57.1       15.7       ?       ? 
1 1 1   52   20   13 o    172.3    6.9    0.0000   0.0000          ?        ?   299.4666  23.6253          ?        ?      172.3        6.9       ?       ? 
1 1 1   52   20   14 o    150.1    4.7    0.0000   0.0000          ?        ?   226.0367  14.0475          ?        ?      150.1        4.7       ?       ? 
1 1 1   52   20   15 o    140.3    5.5    0.0000   0.0000          ?        ?   197.9417  15.3245          ?        ?      140.3        5.5       ?       ? 
1 1 1   52   20   16 o    122.5    6.8    0.0000   0.0000          ?        ?   151.3296  16.6016          ?        ?      122.5        6.8       ?       ? 
1 1 1   52   20   17 o     88.5    9.7    0.0000   0.0000          ?        ?    79.8152  17.2401          ?        ?       88.5        9.7       ?       ? 
1 1 1   52   20   18 o     57.7   13.0    0.0000   0.0000          ?        ?    35.7572  14.6860          ?        ?       57.7       13.0       ?       ? 
1 1 1   52   20   19 o    107.4    8.0    0.0000   0.0000          ?        ?   116.8494  17.2401          ?        ?      107.4        8.0       ?       ? 
1 1 1   52   20   20 o    165.3    5.0    0.0000   0.0000          ?        ?   274.5643  16.6016          ?        ?      165.3        5.0       ?       ? 
1 1 1   52   21    0 o    222.4    6.3  497.4084  28.0950   497.4084  28.0950   497.4084  28.0950      222.4      6.3      222.4        6.3     0.0     0.0 
1 1 1   52   21    1 o    180.1    6.0    0.0000   0.0000          ?        ?   326.2845  21.7097          ?        ?      180.1        6.0       ?       ? 
1 1 1   52   21    2 o    188.3    5.6    0.0000   0.0000          ?        ?   356.2951  21.0712          ?        ?      188.3        5.6       ?       ? 
1 1 1   52   21    3 o    110.7    9.5    0.0000   0.0000          ?        ?   124.5117  21.0712          ?        ?      110.7        9.5       ?       ? 
1 1 1   52   21    4 o    301.7    4.3    0.0000   0.0000          ?        ?   913.0859  26.1794          ?        ?      301.7        4.3       ?       ? 
1 1 1   52   21    5 o    218.9    4.4    0.0000   0.0000          ?        ?   480.8068  19.1556          ?        ?      218.9        4.4       ?       ? 
1 1 1   52   21    6 o    212.2    4.8    0.0000   0.0000          ?        ?   452.0733  20.4327          ?        ?      212.2        4.8       ?       ? 
1 1 1   52   21    7 o     58.6   15.2    0.0000   0.0000          ?        ?    37.0343  17.8786          ?        ?       58.6       15.2       ?       ? 
1 1 1   52   21    8 o    188.9    5.7    0.0000   0.0000          ?        ?   358.8492  21.7097          ?        ?      188.9        5.7       ?       ? 
1 1 1   52   21    9 o    216.4    5.8    0.0000   0.0000          ?        ?   471.2290  24.9023          ?        ?      216.4        5.8       ?       ? 
1 1 1   52   21   10 o    282.5    5.3    0.0000   0.0000          ?        ?   801.9832  30.0105          ?        ?      282.5        5.3       ?       ? 
1 1 1   52   21   11 o    204.3    5.8    0.0000   0.0000          ?        ?   420.1472  23.6253          ?        ?      204.3        5.8       ?       ? 
1 1 1   52   21   12 o    108.1    9.5    0.0000   0.0000          ?        ?   118.7650  20.4327          ?        ?      108.1        9.5       ?       ? 
1 1 1   52   21   13 o     73.7   13.9    0.0000   0.0000          ?        ?    58.1055  19.7942          ?        ?       73.7       13.9       ?       ? 
1 1 1   52   21   14 o    105.1    9.4    0.0000   0.0000          ?        ?   112.3798  19.7942          ?        ?      105.1        9.4       ?       ? 
1 1 1   52   21   15 o    242.6    3.4    0.0000   0.0000          ?        ?   589.9940  16.6016          ?        ?      242.6        3.4       ?       ? 
1 1 1   52   21   16 o    226.4    3.7    0.0000   0.0000          ?        ?   514.0099  16.6016          ?        ?      226.4        3.7       ?       ? 
1 1 1   52   21   17 o     79.7    8.4    0.0000   0.0000          ?        ?    64.4907  13.4090          ?        ?       79.7        8.4       ?       ? 
1 1 1   52   22    0 o     82.3   17.7   77.8996  25.5409    77.8996  25.5409    77.8996  25.5409       82.3     17.7       82.3       17.7     0.0     0.0 
1 1 1   52   22    1 o    269.5    4.4    0.0000   0.0000          ?        ?   729.1917  23.6253          ?        ?      269.5        4.4       ?       ? 
1 1 1   52   22    2 o    141.5    6.5    0.0000   0.0000          ?        ?   201.7728  18.5171          ?        ?      141.5        6.5       ?       ? 
1 1 1   52   22    3 o    111.6    8.6    0.0000   0.0000          ?        ?   126.4273  19.1556          ?        ?      111.6        8.6       ?       ? 
1 1 1   52   22    4 o    227.1    5.1    0.0000   0.0000          ?        ?   518.4796  22.9868          ?        ?      227.1        5.1       ?       ? 
1 1 1   52   22    5 o     34.6   14.7    0.0000   0.0000          ?        ?     1.2770  17.8786          ?        ?       34.6       14.7       ?       ? 
1 1 1   52   22    6 o     30.5   13.5    0.0000   0.0000          ?        ?    -5.1082  16.6016          ?        ?       30.5       13.5       ?       ? 
1 1 1   52   22    7 o    140.1    6.4    0.0000   0.0000          ?        ?   197.9417  17.8786          ?        ?      140.1        6.4       ?       ? 
1 1 1   52   22    8 o    129.7    6.6    0.0000   0.0000          ?        ?   169.8468  17.2401          ?        ?      129.7        6.6       ?       ? 
1 1 1   52   22    9 o     50.4   16.5    0.0000   0.0000          ?        ?    26.1794  19.1556          ?        ?       50.4       16.5       ?       ? 
1 1 1   52   22   10 o    178.3    6.1    0.0000   0.0000          ?        ?   320.5379  21.7097          ?        ?      178.3        6.1       ?       ? 
1 1 1   52   22   11 o    128.0    7.7    0.0000   0.0000          ?        ?   166.0156  19.7942          ?        ?      128.0        7.7       ?       ? 
1 1 1   52   22   12 o    227.6    5.0    0.0000   0.0000          ?        ?   521.0336  22.9868          ?        ?      227.6        5.0       ?       ? 
1 1 1   53    0    0 o     93.0   14.0   90.6701  24.9023    90.6701  24.9023    90.6701  24.9023       93.0     14.0       93.0       14.0     0.0     0.0 
1 1 1   53    0    1 o    251.4    4.2  632.7749  21.0712   632.7749  21.0712   632.7749  21.0712      251.4      4.2      251.4        4.2     0.0     0.0 
1 1 1   53    0    2 o     81.5   10.6   67.6833  17.2401    67.6833  17.2401    67.6833  17.2401       81.5     10.6       81.5       10.6     0.0     0.0 
1 1 1   53    0    3 o    279.3    4.1  780.9120  22.9868   780.9120  22.9868   780.9120  22.9868      279.3      4.1      279.3        4.1     0.0     0.0 
1 1 1   53    0    4 f     27.2   16.4    7.6623  15.9630     7.6623  15.9630     7.6623  15.9630       27.2     16.4       27.2       16.4     0.0     0.0 
1 1 1   53    0    5 o     88.4    9.6   81.0922  16.6016    81.0922  16.6016    81.0922  16.6016       88.4      9.6       88.4        9.6     0.0     0.0 
1 1 1   53    0    6 o    211.5    4.7  448.2422  19.7942   448.2422  19.7942   448.2422  19.7942      211.5      4.7      211.5        4.7     0.0     0.0 
1 1 1   53    0    7 o    166.3    6.0  277.7569  19.7942   277.7569  19.7942   277.7569  19.7942      166.3      6.0      166.3        6.0     0.0     0.0 
1 1 1   53    0    8 f    663.3    4.5 4401.9683  59.3825  4401.9683  59.3825  4401.9683  59.3825      663.3      4.5      663.3        4.5     0.0     0.0 
1 1 1   53    0    9 o    155.7    6.4  243.9153  19.7942   243.9153  19.7942   243.9153  19.7942      155.7      6.4      155.7        6.4     0.0     0.0 
1 1 1   53    0   10 o    287.9    3.9  829.4396  22.3483   829.4396  22.3483   829.4396  22.3483      287.9      3.9      287.9        3.9     0.0     0.0 
1 1 1   53    0   11 o    157.6    6.1  249.6619  19.1556   249.6619  19.1556   249.6619  19.1556      157.6      6.1      157.6        6.1     0.0     0.0 
1 1 1   53    0   12 o     12.5    9.3  -52.9973  17.2401   -52.9973  17.2401   -52.9973  17.2401       12.5      9.3       12.5        9.3     0.0     0.0 
1 1 1   53    0   13 o     89.3   11.0   83.6463  19.1556    83.6463  19.1556    83.6463  19.1556       89.3     11.0       89.3       11.0     0.0     0.0 
1 1 1   53    0   14 o    235.0    4.5  552.9597  21.0712   552.9597  21.0712   552.9597  21.0712      235.0      4.5      235.0        4.5     0.0     0.0 
1 1 1   53    0   15 o    139.9    7.8  197.9417  21.7097   197.9417  21.7097   197.9417  21.7097      139.9      7.8      139.9        7.8     0.0     0.0 
1 1 1   53    0   16 o    665.7    4.7 4434.5327  61.9366  4434.5327  61.9366  4434.5327  61.9366      665.7      4.7      665.7        4.7     0.0     0.0 
1 1 1   53    0   17 o    253.9    4.7  645.5453  23.6253   645.5453  23.6253   645.5453  23.6253      253.9      4.7      253.9        4.7     0.0     0.0 
1 1 1   53    0   18 o    219.1    4.5  480.8068  19.7942   480.8068  19.7942   480.8068  19.7942      219.1      4.5      219.1        4.5     0.0     0.0 
1 1 1   53    0   19 o    155.2    7.0  242.6382  21.7097   242.6382  21.7097   242.6382  21.7097      155.2      7.0      155.2        7.0     0.0     0.0 
1 1 1   53    0   20 o    179.2    6.1  322.4534  21.7097   322.4534  21.7097   322.4534  21.7097      179.2      6.1      179.2        6.1     0.0     0.0 
1 1 1   53    0   21 o    205.7    4.8  423.9784  19.7942   423.9784  19.7942   423.9784  19.7942      205.7      4.8      205.7        4.8     0.0     0.0 
1 1 1   53    0   22 o     97.3   11.4   98.9709  21.7097    98.9709  21.7097    98.9709  21.7097       97.3     11.4       97.3       11.4     0.0     0.0 
1 1 1   53    0   23 o    473.1    3.6 2239.9338  33.8416  2239.9338  33.8416  2239.9338  33.8416      473.1      3.6      473.1        3.6     0.0     0.0 
1 1 1   53    0   24 o    203.8    4.7  416.3161  19.1556   416.3161  19.1556   416.3161  19.1556      203.8      4.7      203.8        4.7     0.0     0.0 
1 1 1   53    0   25 o     68.4   18.4   56.1899  21.7097    56.1899  21.7097    56.1899  21.7097       68.4     18.4       68.4       18.4     0.0     0.0 
1 1 1   53    0   26 o    182.2    6.0  333.3083  21.7097   333.3083  21.7097   333.3083  21.7097      182.2      6.0      182.2        6.0     0.0     0.0 
1 1 1   53    0   27 o    325.2    3.9 1058.6688  25.5409  1058.6688  25.5409  1058.6688  25.5409      325.2      3.9      325.2        3.9     0.0     0.0 
1 1 1   53    0   28 o    201.0    5.6  405.4612  22.3483   405.4612  22.3483   405.4612  22.3483      201.0      5.6      201.0        5.6     0.0     0.0 
1 1 1   53    0   29 o    368.5    3.8 1358.7740  28.0950  1358.7740  28.0950  1358.7740  28.0950      368.5      3.8      368.5        3.8     0.0     0.0 
1 1 1   53    0   30 o    513.0    3.6 2633.2632  37.0343  2633.2632  37.0343  2633.2632  37.0343      513.0      3.6      513.0        3.6     0.0     0.0 
1 1 1   53    0   31 o     89.6   12.9   83.6463  22.3483    83.6463  22.3483    83.6463  22.3483       89.6     12.9       89.6       12.9     0.0     0.0 
1 1 1   53    0   32 o    526.5    3.8 2774.3765  39.5883  2774.3765  39.5883  2774.3765  39.5883      526.5      3.8      526.5        3.8     0.0     0.0 
1 1 1   53    0   33 o    275.1    4.5  757.9252  24.9023   757.9252  24.9023   757.9252  24.9023      275.1      4.5      275.1        4.5     0.0     0.0 
1 1 1   53    0   34 o     23.1   15.9  -12.1319  22.3483   -12.1319  22.3483   -12.1319  22.3483       23.1     15.9       23.1       15.9     0.0     0.0 
1 1 1   53    0   35 o    107.4   10.9  119.4035  22.9868   119.4035  22.9868   119.4035  22.9868      107.4     10.9      107.4       10.9     0.0     0.0 
1 1 1   53    0   36 f    276.0    4.6  763.0333  25.5409   763.0333  25.5409   763.0333  25.5409      276.0      4.6      276.0        4.6     0.0     0.0 
1 1 1   53    0   37 o    109.3   10.4  123.2347  22.3483   123.2347  22.3483   123.2347  22.3483      109.3     10.4      109.3       10.4     0.0     0.0 
1 1 1   53    0   38 o    298.5    4.6  892.6533  27.4564   892.6533  27.4564   892.6533  27.4564      298.5      4.6      298.5        4.6     0.0     0.0 
1 1 1   53    0   39 o    130.1    9.2  172.4008  23.6253   172.4008  23.6253   172.4008  23.6253      130.1      9.2      130.1        9.2     0.0     0.0 
1 1 1   53    0   40 o    346.7    4.0 1203.6133  27.4564  1203.6133  27.4564  1203.6133  27.4564      346.7      4.0      346.7        4.0     0.0     0.0 
1 1 1   53    0   41 f     16.5   12.2  -56.8284  24.2638   -56.8284  24.2638   -56.8284  24.2638       16.5     12.2       16.5       12.2     0.0     0.0 
1 1 1   53    0   42 o     39.4   22.0   22.3483  25.5409    22.3483  25.5409    22.3483  25.5409       39.4     22.0       39.4       22.0     0.0     0.0 
1 1 1   53    0   43 o    304.6    4.6  929.6875  28.0950   929.6875  28.0950   929.6875  28.0950      304.6      4.6      304.6        4.6     0.0     0.0 
1 1 1   53    0   44 o     19.1   13.8  -36.3957  24.2638   -36.3957  24.2638   -36.3957  24.2638       19.1     13.8       19.1       13.8     0.0     0.0 
1 1 1   53    0   45 o     19.1   13.8  -36.3957  24.2638   -36.3957  24.2638   -36.3957  24.2638       19.1     13.8       19.1       13.8     0.0     0.0 
1 1 1   53    0   46 o     24.5   16.7   -9.5778  23.6253    -9.5778  23.6253    -9.5778  23.6253       24.5     16.7       24.5       16.7     0.0     0.0 
1 1 1   53    0   47 o     88.7   13.2   83.0078  22.3483    83.0078  22.3483    83.0078  22.3483       88.7     13.2       88.7       13.2     0.0     0.0 
1 1 1   53    0   48 o     21.3   15.2  -28.0950  25.5409   -28.0950  25.5409   -28.0950  25.5409       21.3     15.2       21.3       15.2     0.0     0.0 
1 1 1   53    0   49 o    114.9   11.0  137.2822  24.9023   137.2822  24.9023   137.2822  24.9023      114.9     11.0      114.9       11.0     0.0     0.0 
1 1 1   53    0   50 o     41.4   22.6   26.1794  26.1794    26.1794  26.1794    26.1794  26.1794       41.4     22.6       41.4       22.6     0.0     0.0 
1 1 1   53    1    0 o    123.9    7.0  155.1608  17.2401   155.1608  17.2401   155.1608  17.2401      123.9      7.0      123.9        7.0     0.0     0.0 
1 1 1   53    1    1 o    274.8    3.1    0.0000   0.0000          ?        ?   755.3711  17.2401          ?        ?      274.8        3.1       ?       ? 
1 1 1   53    1    2 o    188.9    3.5    0.0000   0.0000          ?        ?   356.9336  13.4090          ?        ?      188.9        3.5       ?       ? 
1 1 1   53    1    3 o    177.2    3.6    0.0000   0.0000          ?        ?   314.1526  12.7704          ?        ?      177.2        3.6       ?       ? 
1 1 1   53    1    4 o    138.8    4.4    0.0000   0.0000          ?        ?   192.8335  12.1319          ?        ?      138.8        4.4       ?       ? 
1 1 1   53    1    5 o    201.1    3.5    0.0000   0.0000          ?        ?   404.8227  14.0475          ?        ?      201.1        3.5       ?       ? 
1 1 1   53    1    6 o     98.8    5.8    0.0000   0.0000          ?        ?    97.6938  11.4934          ?        ?       98.8        5.8       ?       ? 
1 1 1   53    1    7 o     95.5    6.4    0.0000   0.0000          ?        ?    91.3086  12.1319          ?        ?       95.5        6.4       ?       ? 
1 1 1   53    1    8 o    284.8    2.9    0.0000   0.0000          ?        ?   811.5610  16.6016          ?        ?      284.8        2.9       ?       ? 
1 1 1   53    1    9 o    221.4    3.3    0.0000   0.0000          ?        ?   490.3846  14.6860          ?        ?      221.4        3.3       ?       ? 
1 1 1   53    1   10 o    289.0    2.8    0.0000   0.0000          ?        ?   835.8248  15.9630          ?        ?      289.0        2.8       ?       ? 
1 1 1   53    1   11 o    235.8    3.3    0.0000   0.0000          ?        ?   556.1523  15.3245          ?        ?      235.8        3.3       ?       ? 
1 1 1   53    1   12 o    266.8    3.0    0.0000   0.0000          ?        ?   711.9516  15.9630          ?        ?      266.8        3.0       ?       ? 
1 1 1   53    1   13 o    213.0    3.3    0.0000   0.0000          ?        ?   453.9889  14.0475          ?        ?      213.0        3.3       ?       ? 
1 1 1   53    1   14 o    271.7    3.2    0.0000   0.0000          ?        ?   738.7695  17.2401          ?        ?      271.7        3.2       ?       ? 
1 1 1   53    1   15 f    105.9    6.3    0.0000   0.0000          ?        ?   112.3798  13.4090          ?        ?      105.9        6.3       ?       ? 
1 1 1   53    1   16 o    171.3    4.5    0.0000   0.0000          ?        ?   293.7199  15.3245          ?        ?      171.3        4.5       ?       ? 
1 1 1   53    1   17 o    163.1    4.9    0.0000   0.0000          ?        ?   266.2635  15.9630          ?        ?      163.1        4.9       ?       ? 
1 1 1   53    1   18 o    395.8    2.7    0.0000   0.0000          ?        ?  1567.5706  21.0712          ?        ?      395.8        2.7       ?       ? 
1 1 1   53    1   19 o    256.5    3.4    0.0000   0.0000          ?        ?   658.3158  17.2401          ?        ?      256.5        3.4       ?       ? 
1 1 1   53    1   20 o    270.2    3.3    0.0000   0.0000          ?        ?   730.4688  17.8786          ?        ?      270.2        3.3       ?       ? 
1 1 1   53    1   21 o    173.9    4.2    0.0000   0.0000          ?        ?   302.6593  14.6860          ?        ?      173.9        4.2       ?       ? 
1 1 1   53    1   22 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   53    1   23 o    125.7    6.1    0.0000   0.0000          ?        ?   158.3534  15.3245          ?        ?      125.7        6.1       ?       ? 
1 1 1   53    1   24 o    235.2    3.1    0.0000   0.0000          ?        ?   553.5982  14.6860          ?        ?      235.2        3.1       ?       ? 
1 1 1   53    1   25 o    164.1    4.1    0.0000   0.0000          ?        ?   269.4561  13.4090          ?        ?      164.1        4.1       ?       ? 
1 1 1   53    1   26 o    318.4    2.8    0.0000   0.0000          ?        ?  1014.6108  17.8786          ?        ?      318.4        2.8       ?       ? 
1 1 1   53    1   27 o     45.3   14.4    0.0000   0.0000          ?        ?    20.4327  14.6860          ?        ?       45.3       14.4       ?       ? 
1 1 1   53    1   28 o    395.3    2.7    0.0000   0.0000          ?        ?  1563.1010  21.0712          ?        ?      395.3        2.7       ?       ? 
1 1 1   53    1   29 o    217.8    3.8    0.0000   0.0000          ?        ?   475.0601  16.6016          ?        ?      217.8        3.8       ?       ? 
1 1 1   53    1   30 o     34.6   14.3    0.0000   0.0000          ?        ?     3.8311  15.9630          ?        ?       34.6       14.3       ?       ? 
1 1 1   53    1   31 o    181.2    4.2    0.0000   0.0000          ?        ?   328.8386  15.3245          ?        ?      181.2        4.2       ?       ? 
1 1 1   53    1   32 f    177.1    4.7    0.0000   0.0000          ?        ?   314.1526  16.6016          ?        ?      177.1        4.7       ?       ? 
1 1 1   53    1   33 o    161.8    5.1    0.0000   0.0000          ?        ?   262.4324  16.6016          ?        ?      161.8        5.1       ?       ? 
1 1 1   53    1   34 f    522.7    2.7    0.0000   0.0000          ?        ?  2733.5112  28.0950          ?        ?      522.7        2.7       ?       ? 
1 1 1   53    1   35 o    199.3    4.3    0.0000   0.0000          ?        ?   397.7990  17.2401          ?        ?      199.3        4.3       ?       ? 
1 1 1   53    1   36 o     20.4   10.0    0.0000   0.0000          ?        ?   -31.9261  14.6860          ?        ?       20.4       10.0       ?       ? 
1 1 1   53    1   37 o    186.0    4.6    0.0000   0.0000          ?        ?   346.7172  17.2401          ?        ?      186.0        4.6       ?       ? 
1 1 1   53    1   38 o    137.9    5.6    0.0000   0.0000          ?        ?   190.9180  15.3245          ?        ?      137.9        5.6       ?       ? 
1 1 1   53    1   39 o     26.4   12.4    0.0000   0.0000          ?        ?   -19.1556  17.2401          ?        ?       26.4       12.4       ?       ? 
1 1 1   53    1   40 o     49.4   15.6    0.0000   0.0000          ?        ?    24.9023  17.2401          ?        ?       49.4       15.6       ?       ? 
1 1 1   53    1   41 o     26.3   12.5    0.0000   0.0000          ?        ?   -21.7097  17.8786          ?        ?       26.3       12.5       ?       ? 
1 1 1   53    1   42 o     97.6    9.5    0.0000   0.0000          ?        ?    96.4168  18.5171          ?        ?       97.6        9.5       ?       ? 
1 1 1   53    1   43 o    195.9    4.6    0.0000   0.0000          ?        ?   385.0285  17.8786          ?        ?      195.9        4.6       ?       ? 
1 1 1   53    1   44 o     58.8   15.1    0.0000   0.0000          ?        ?    37.0343  17.8786          ?        ?       58.8       15.1       ?       ? 
1 1 1   53    1   45 o    191.9    4.8    0.0000   0.0000          ?        ?   369.7040  18.5171          ?        ?      191.9        4.8       ?       ? 
1 1 1   53    1   46 o     43.6   15.6    0.0000   0.0000          ?        ?    17.2401  17.2401          ?        ?       43.6       15.6       ?       ? 
1 1 1   53    1   47 o    109.5    8.2    0.0000   0.0000          ?        ?   121.3191  17.8786          ?        ?      109.5        8.2       ?       ? 
1 1 1   53    1   48 o    106.5    8.1    0.0000   0.0000          ?        ?   114.9339  17.2401          ?        ?      106.5        8.1       ?       ? 
1 1 1   53    1   49 f     26.3   12.5    0.0000   0.0000          ?        ?   -21.0712  17.8786          ?        ?       26.3       12.5       ?       ? 
1 1 1   53    2    0 o    160.4    6.0  258.6013  19.1556   258.6013  19.1556   258.6013  19.1556      160.4      6.0      160.4        6.0     0.0     0.0 
1 1 1   53    2    1 o     31.6   12.4    0.0000   0.0000          ?        ?     5.7467  11.4934          ?        ?       31.6       12.4       ?       ? 
1 1 1   53    2    2 o    150.9    4.4    0.0000   0.0000          ?        ?   227.9522  13.4090          ?        ?      150.9        4.4       ?       ? 
1 1 1   53    2    3 o    567.0    3.0    0.0000   0.0000          ?        ?  3216.2334  33.8416          ?        ?      567.0        3.0       ?       ? 
1 1 1   53    2    4 o    183.2    3.8    0.0000   0.0000          ?        ?   335.8624  14.0475          ?        ?      183.2        3.8       ?       ? 
1 1 1   53    2    5 o    243.6    3.0    0.0000   0.0000          ?        ?   593.8251  14.6860          ?        ?      243.6        3.0       ?       ? 
1 1 1   53    2    6 o    125.5    5.1    0.0000   0.0000          ?        ?   157.7148  12.7704          ?        ?      125.5        5.1       ?       ? 
1 1 1   53    2    7 o    342.9    2.9    0.0000   0.0000          ?        ?  1176.1569  19.7942          ?        ?      342.9        2.9       ?       ? 
1 1 1   53    2    8 o    473.4    2.8    0.0000   0.0000          ?        ?  2242.4880  26.8179          ?        ?      473.4        2.8       ?       ? 
1 1 1   53    2    9 o    406.5    2.9    0.0000   0.0000          ?        ?  1653.1324  23.6253          ?        ?      406.5        2.9       ?       ? 
1 1 1   53    2   10 o    124.5    5.1    0.0000   0.0000          ?        ?   155.1608  12.7704          ?        ?      124.5        5.1       ?       ? 
1 1 1   53    2   11 o    172.8    4.2    0.0000   0.0000          ?        ?   298.8281  14.6860          ?        ?      172.8        4.2       ?       ? 
1 1 1   53    2   12 o    184.4    4.0    0.0000   0.0000          ?        ?   340.3320  14.6860          ?        ?      184.4        4.0       ?       ? 
1 1 1   53    2   13 f     59.7   11.1    0.0000   0.0000          ?        ?    37.0343  12.7704          ?        ?       59.7       11.1       ?       ? 
1 1 1   53    2   14 o    273.5    3.0    0.0000   0.0000          ?        ?   748.3474  16.6016          ?        ?      273.5        3.0       ?       ? 
1 1 1   53    2   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   53    2   16 o    118.1    5.7    0.0000   0.0000          ?        ?   139.8362  13.4090          ?        ?      118.1        5.7       ?       ? 
1 1 1   53    2   17 o     19.5    9.7    0.0000   0.0000          ?        ?   -36.3957  14.6860          ?        ?       19.5        9.7       ?       ? 
1 1 1   53    2   18 o    281.2    3.5    0.0000   0.0000          ?        ?   791.1283  19.7942          ?        ?      281.2        3.5       ?       ? 
1 1 1   53    2   19 o    151.7    4.4    0.0000   0.0000          ?        ?   230.5063  13.4090          ?        ?      151.7        4.4       ?       ? 
1 1 1   53    2   20 o    522.8    2.8    0.0000   0.0000          ?        ?  2734.7881  29.3720          ?        ?      522.8        2.8       ?       ? 
1 1 1   53    2   21 o    255.4    3.5    0.0000   0.0000          ?        ?   652.5691  17.8786          ?        ?      255.4        3.5       ?       ? 
1 1 1   53    2   22 o    207.2    3.7    0.0000   0.0000          ?        ?   429.7251  15.3245          ?        ?      207.2        3.7       ?       ? 
1 1 1   53    2   23 o     67.6   10.4    0.0000   0.0000          ?        ?    45.9736  14.0475          ?        ?       67.6       10.4       ?       ? 
1 1 1   53    2   24 o    141.2    5.2    0.0000   0.0000          ?        ?   199.8573  14.6860          ?        ?      141.2        5.2       ?       ? 
1 1 1   53    2   25 o    187.1    3.9    0.0000   0.0000          ?        ?   350.5484  14.6860          ?        ?      187.1        3.9       ?       ? 
1 1 1   53    2   26 o     83.6    8.4    0.0000   0.0000          ?        ?    70.2374  14.0475          ?        ?       83.6        8.4       ?       ? 
1 1 1   53    2   27 o    100.6    7.3    0.0000   0.0000          ?        ?   101.5249  14.6860          ?        ?      100.6        7.3       ?       ? 
1 1 1   53    2   28 o    103.4    7.1    0.0000   0.0000          ?        ?   107.2716  14.6860          ?        ?      103.4        7.1       ?       ? 
1 1 1   53    2   29 o    163.8    4.5    0.0000   0.0000          ?        ?   268.8176  14.6860          ?        ?      163.8        4.5       ?       ? 
1 1 1   53    2   30 o     17.2    8.7    0.0000   0.0000          ?        ?   -55.5514  15.3245          ?        ?       17.2        8.7       ?       ? 
1 1 1   53    2   31 o    178.4    4.5    0.0000   0.0000          ?        ?   318.6223  15.9630          ?        ?      178.4        4.5       ?       ? 
1 1 1   53    2   32 o    234.2    3.5    0.0000   0.0000          ?        ?   549.1286  16.6016          ?        ?      234.2        3.5       ?       ? 
1 1 1   53    2   33 o    126.6    6.3    0.0000   0.0000          ?        ?   160.9075  15.9630          ?        ?      126.6        6.3       ?       ? 
1 1 1   53    2   34 o     18.6    9.4    0.0000   0.0000          ?        ?   -45.3350  15.3245          ?        ?       18.6        9.4       ?       ? 
1 1 1   53    2   35 o     85.0    9.0    0.0000   0.0000          ?        ?    72.7915  15.3245          ?        ?       85.0        9.0       ?       ? 
1 1 1   53    2   36 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   53    2   37 o     54.4   14.4    0.0000   0.0000          ?        ?    31.2876  15.9630          ?        ?       54.4       14.4       ?       ? 
1 1 1   53    2   38 o    254.8    3.4    0.0000   0.0000          ?        ?   650.0150  17.2401          ?        ?      254.8        3.4       ?       ? 
1 1 1   53    2   39 o    247.6    3.7    0.0000   0.0000          ?        ?   614.2578  18.5171          ?        ?      247.6        3.7       ?       ? 
1 1 1   53    2   40 o    147.0    5.9    0.0000   0.0000          ?        ?   217.0974  17.2401          ?        ?      147.0        5.9       ?       ? 
1 1 1   53    2   41 o    166.6    5.0    0.0000   0.0000          ?        ?   278.3954  16.6016          ?        ?      166.6        5.0       ?       ? 
1 1 1   53    2   42 o    225.1    4.0    0.0000   0.0000          ?        ?   507.6247  17.8786          ?        ?      225.1        4.0       ?       ? 
1 1 1   53    2   43 o     20.5   10.2    0.0000   0.0000          ?        ?   -45.9736  17.2401          ?        ?       20.5       10.2       ?       ? 
1 1 1   53    2   44 o     94.2    9.5    0.0000   0.0000          ?        ?    90.0316  17.8786          ?        ?       94.2        9.5       ?       ? 
1 1 1   53    2   45 o    106.3    8.1    0.0000   0.0000          ?        ?   114.2954  17.2401          ?        ?      106.3        8.1       ?       ? 
1 1 1   53    2   46 o    115.2    7.5    0.0000   0.0000          ?        ?   134.0895  17.2401          ?        ?      115.2        7.5       ?       ? 
1 1 1   53    2   47 o     40.5   15.4    0.0000   0.0000          ?        ?    12.7704  17.2401          ?        ?       40.5       15.4       ?       ? 
1 1 1   53    2   48 o     86.3    9.6    0.0000   0.0000          ?        ?    75.9841  16.6016          ?        ?       86.3        9.6       ?       ? 
1 1 1   53    3    0 f    192.3    5.0  370.9810  19.1556   370.9810  19.1556   370.9810  19.1556      192.3      5.0      192.3        5.0     0.0     0.0 
1 1 1   53    3    1 o    360.0    2.7    0.0000   0.0000          ?        ?  1296.1989  19.7942          ?        ?      360.0        2.7       ?       ? 
1 1 1   53    3    2 o    272.9    2.8    0.0000   0.0000          ?        ?   745.1547  15.3245          ?        ?      272.9        2.8       ?       ? 
1 1 1   53    3    3 o    286.0    3.0    0.0000   0.0000          ?        ?   818.5847  17.2401          ?        ?      286.0        3.0       ?       ? 
1 1 1   53    3    4 o    298.1    2.9    0.0000   0.0000          ?        ?   888.8221  17.2401          ?        ?      298.1        2.9       ?       ? 
1 1 1   53    3    5 o     31.3   12.6    0.0000   0.0000          ?        ?     4.4697  12.1319          ?        ?       31.3       12.6       ?       ? 
1 1 1   53    3    6 o    193.7    3.5    0.0000   0.0000          ?        ?   375.4507  13.4090          ?        ?      193.7        3.5       ?       ? 
1 1 1   53    3    7 o     82.1    7.8    0.0000   0.0000          ?        ?    67.6833  12.7704          ?        ?       82.1        7.8       ?       ? 
1 1 1   53    3    8 o    270.5    3.2    0.0000   0.0000          ?        ?   732.3843  17.2401          ?        ?      270.5        3.2       ?       ? 
1 1 1   53    3    9 o    348.8    2.7    0.0000   0.0000          ?        ?  1217.0222  19.1556          ?        ?      348.8        2.7       ?       ? 
1 1 1   53    3   10 o    214.9    3.3    0.0000   0.0000          ?        ?   462.2897  14.0475          ?        ?      214.9        3.3       ?       ? 
1 1 1   53    3   11 o    383.5    2.9    0.0000   0.0000          ?        ?  1471.7924  22.3483          ?        ?      383.5        2.9       ?       ? 
1 1 1   53    3   12 o    236.0    3.2    0.0000   0.0000          ?        ?   557.4294  15.3245          ?        ?      236.0        3.2       ?       ? 
1 1 1   53    3   13 o     16.8    8.5    0.0000   0.0000          ?        ?   -44.0580  13.4090          ?        ?       16.8        8.5       ?       ? 
1 1 1   53    3   14 o    144.2    4.9    0.0000   0.0000          ?        ?   208.1580  14.0475          ?        ?      144.2        4.9       ?       ? 
1 1 1   53    3   15 o    273.7    3.1    0.0000   0.0000          ?        ?   749.6244  17.2401          ?        ?      273.7        3.1       ?       ? 
1 1 1   53    3   16 o    191.0    3.5    0.0000   0.0000          ?        ?   365.2344  13.4090          ?        ?      191.0        3.5       ?       ? 
1 1 1   53    3   17 o    232.1    3.2    0.0000   0.0000          ?        ?   538.9123  14.6860          ?        ?      232.1        3.2       ?       ? 
1 1 1   53    3   18 o    231.5    3.4    0.0000   0.0000          ?        ?   536.3582  15.9630          ?        ?      231.5        3.4       ?       ? 
1 1 1   53    3   19 o    220.8    3.5    0.0000   0.0000          ?        ?   487.8305  15.3245          ?        ?      220.8        3.5       ?       ? 
1 1 1   53    3   20 o    153.4    4.8    0.0000   0.0000          ?        ?   235.6145  14.6860          ?        ?      153.4        4.8       ?       ? 
1 1 1   53    3   21 o    217.9    3.7    0.0000   0.0000          ?        ?   475.0601  15.9630          ?        ?      217.9        3.7       ?       ? 
1 1 1   53    3   22 o    312.4    2.9    0.0000   0.0000          ?        ?   976.2995  17.8786          ?        ?      312.4        2.9       ?       ? 
1 1 1   53    3   23 o    119.7    5.9    0.0000   0.0000          ?        ?   143.6674  14.0475          ?        ?      119.7        5.9       ?       ? 
1 1 1   53    3   24 o    263.2    3.2    0.0000   0.0000          ?        ?   693.4344  16.6016          ?        ?      263.2        3.2       ?       ? 
1 1 1   53    3   25 o    238.6    3.3    0.0000   0.0000          ?        ?   569.5613  15.9630          ?        ?      238.6        3.3       ?       ? 
1 1 1   53    3   26 o    209.5    3.7    0.0000   0.0000          ?        ?   439.3029  15.3245          ?        ?      209.5        3.7       ?       ? 
1 1 1   53    3   27 o    231.5    3.4    0.0000   0.0000          ?        ?   536.3582  15.9630          ?        ?      231.5        3.4       ?       ? 
1 1 1   53    3   28 o    230.8    3.5    0.0000   0.0000          ?        ?   533.1656  15.9630          ?        ?      230.8        3.5       ?       ? 
1 1 1   53    3   29 o     28.2   12.6    0.0000   0.0000          ?        ?    -6.3852  14.6860          ?        ?       28.2       12.6       ?       ? 
1 1 1   53    3   30 o     35.1   14.2    0.0000   0.0000          ?        ?     5.7467  15.3245          ?        ?       35.1       14.2       ?       ? 
1 1 1   53    3   31 o    218.7    3.8    0.0000   0.0000          ?        ?   478.8912  16.6016          ?        ?      218.7        3.8       ?       ? 
1 1 1   53    3   32 o     29.6   13.2    0.0000   0.0000          ?        ?    -6.3852  15.9630          ?        ?       29.6       13.2       ?       ? 
1 1 1   53    3   33 o     79.5   10.0    0.0000   0.0000          ?        ?    63.8522  15.9630          ?        ?       79.5       10.0       ?       ? 
1 1 1   53    3   34 o    280.6    3.1    0.0000   0.0000          ?        ?   787.9357  17.2401          ?        ?      280.6        3.1       ?       ? 
1 1 1   53    3   35 o    168.6    4.7    0.0000   0.0000          ?        ?   284.7806  15.9630          ?        ?      168.6        4.7       ?       ? 
1 1 1   53    3   36 o    351.8    2.9    0.0000   0.0000          ?        ?  1238.7319  20.4327          ?        ?      351.8        2.9       ?       ? 
1 1 1   53    3   37 o    129.3    6.2    0.0000   0.0000          ?        ?   167.9312  15.9630          ?        ?      129.3        6.2       ?       ? 
1 1 1   53    3   38 o    217.3    4.0    0.0000   0.0000          ?        ?   473.1445  17.2401          ?        ?      217.3        4.0       ?       ? 
1 1 1   53    3   39 o    199.2    4.5    0.0000   0.0000          ?        ?   397.7990  17.8786          ?        ?      199.2        4.5       ?       ? 
1 1 1   53    3   40 o     29.9   13.4    0.0000   0.0000          ?        ?    -7.0237  16.6016          ?        ?       29.9       13.4       ?       ? 
1 1 1   53    3   41 o     24.6   11.8    0.0000   0.0000          ?        ?   -22.9868  16.6016          ?        ?       24.6       11.8       ?       ? 
1 1 1   53    3   42 o    134.7    6.4    0.0000   0.0000          ?        ?   182.6172  17.2401          ?        ?      134.7        6.4       ?       ? 
1 1 1   53    3   43 o    301.2    3.2    0.0000   0.0000          ?        ?   908.6163  19.1556          ?        ?      301.2        3.2       ?       ? 
1 1 1   53    3   44 o    102.4    8.1    0.0000   0.0000          ?        ?   105.9946  16.6016          ?        ?      102.4        8.1       ?       ? 
1 1 1   53    3   45 o     33.5   14.5    0.0000   0.0000          ?        ?    -1.2770  17.8786          ?        ?       33.5       14.5       ?       ? 
1 1 1   53    3   46 o    177.7    5.2    0.0000   0.0000          ?        ?   317.3452  18.5171          ?        ?      177.7        5.2       ?       ? 
1 1 1   53    3   47 o     52.9   15.4    0.0000   0.0000          ?        ?    30.0105  17.2401          ?        ?       52.9       15.4       ?       ? 
1 1 1   53    4    0 o    175.9    5.1  310.3215  17.8786   310.3215  17.8786   310.3215  17.8786      175.9      5.1      175.9        5.1     0.0     0.0 
1 1 1   53    4    1 o    165.2    4.3    0.0000   0.0000          ?        ?   273.2873  14.0475          ?        ?      165.2        4.3       ?       ? 
1 1 1   53    4    2 o     40.4   13.1    0.0000   0.0000          ?        ?    15.9630  12.1319          ?        ?       40.4       13.1       ?       ? 
1 1 1   53    4    3 o     86.3    7.0    0.0000   0.0000          ?        ?    74.7070  12.1319          ?        ?       86.3        7.0       ?       ? 
1 1 1   53    4    4 o    153.0    4.4    0.0000   0.0000          ?        ?   234.3374  13.4090          ?        ?      153.0        4.4       ?       ? 
1 1 1   53    4    5 o    180.6    3.9    0.0000   0.0000          ?        ?   326.2845  14.0475          ?        ?      180.6        3.9       ?       ? 
1 1 1   53    4    6 o    284.5    2.8    0.0000   0.0000          ?        ?   809.6454  15.9630          ?        ?      284.5        2.8       ?       ? 
1 1 1   53    4    7 f    214.8    3.3    0.0000   0.0000          ?        ?   461.6512  14.0475          ?        ?      214.8        3.3       ?       ? 
1 1 1   53    4    8 o    140.1    4.8    0.0000   0.0000          ?        ?   196.6647  13.4090          ?        ?      140.1        4.8       ?       ? 
1 1 1   53    4    9 o    262.4    3.0    0.0000   0.0000          ?        ?   688.9648  15.9630          ?        ?      262.4        3.0       ?       ? 
1 1 1   53    4   10 o    247.4    3.2    0.0000   0.0000          ?        ?   612.3422  15.9630          ?        ?      247.4        3.2       ?       ? 
1 1 1   53    4   11 o     62.6   12.2    0.0000   0.0000          ?        ?    40.8654  14.6860          ?        ?       62.6       12.2       ?       ? 
1 1 1   53    4   12 o    132.4    5.1    0.0000   0.0000          ?        ?   175.5934  13.4090          ?        ?      132.4        5.1       ?       ? 
1 1 1   53    4   13 o    280.6    3.0    0.0000   0.0000          ?        ?   787.9357  16.6016          ?        ?      280.6        3.0       ?       ? 
1 1 1   53    4   14 o    446.4    2.9    0.0000   0.0000          ?        ?  1994.1029  25.5409          ?        ?      446.4        2.9       ?       ? 
1 1 1   53    4   15 o    125.7    5.3    0.0000   0.0000          ?        ?   158.3534  13.4090          ?        ?      125.7        5.3       ?       ? 
1 1 1   53    4   16 o    201.7    3.8    0.0000   0.0000          ?        ?   407.3768  15.3245          ?        ?      201.7        3.8       ?       ? 
1 1 1   53    4   17 o    222.2    3.7    0.0000   0.0000          ?        ?   494.2158  16.6016          ?        ?      222.2        3.7       ?       ? 
1 1 1   53    4   18 o    281.7    3.3    0.0000   0.0000          ?        ?   794.3209  18.5171          ?        ?      281.7        3.3       ?       ? 
1 1 1   53    4   19 o    285.2    2.9    0.0000   0.0000          ?        ?   814.1151  16.6016          ?        ?      285.2        2.9       ?       ? 
1 1 1   53    4   20 o    242.5    3.4    0.0000   0.0000          ?        ?   588.7169  16.6016          ?        ?      242.5        3.4       ?       ? 
1 1 1   53    4   21 o     96.0    7.6    0.0000   0.0000          ?        ?    92.5856  14.6860          ?        ?       96.0        7.6       ?       ? 
1 1 1   53    4   22 o    217.7    3.5    0.0000   0.0000          ?        ?   474.4216  15.3245          ?        ?      217.7        3.5       ?       ? 
1 1 1   53    4   23 o    196.1    4.2    0.0000   0.0000          ?        ?   385.0285  16.6016          ?        ?      196.1        4.2       ?       ? 
1 1 1   53    4   24 o     96.7    7.9    0.0000   0.0000          ?        ?    93.8627  15.3245          ?        ?       96.7        7.9       ?       ? 
1 1 1   53    4   25 o    189.1    4.1    0.0000   0.0000          ?        ?   358.2106  15.3245          ?        ?      189.1        4.1       ?       ? 
1 1 1   53    4   26 o    122.8    6.0    0.0000   0.0000          ?        ?   151.3296  14.6860          ?        ?      122.8        6.0       ?       ? 
1 1 1   53    4   27 o    158.0    5.1    0.0000   0.0000          ?        ?   250.3005  15.9630          ?        ?      158.0        5.1       ?       ? 
1 1 1   53    4   28 o     68.9   11.1    0.0000   0.0000          ?        ?    47.8891  15.3245          ?        ?       68.9       11.1       ?       ? 
1 1 1   53    4   29 o     70.2   11.4    0.0000   0.0000          ?        ?    49.8047  15.9630          ?        ?       70.2       11.4       ?       ? 
1 1 1   53    4   30 o    128.1    6.0    0.0000   0.0000          ?        ?   164.7386  15.3245          ?        ?      128.1        6.0       ?       ? 
1 1 1   53    4   31 o    266.1    3.1    0.0000   0.0000          ?        ?   708.7590  16.6016          ?        ?      266.1        3.1       ?       ? 
1 1 1   53    4   32 o     27.3   12.6    0.0000   0.0000          ?        ?   -12.1319  15.9630          ?        ?       27.3       12.6       ?       ? 
1 1 1   53    4   33 o    126.1    6.3    0.0000   0.0000          ?        ?   159.6304  15.9630          ?        ?      126.1        6.3       ?       ? 
1 1 1   53    4   34 o     39.2   14.6    0.0000   0.0000          ?        ?    12.1319  15.3245          ?        ?       39.2       14.6       ?       ? 
1 1 1   53    4   35 o    331.8    2.9    0.0000   0.0000          ?        ?  1102.0884  19.1556          ?        ?      331.8        2.9       ?       ? 
1 1 1   53    4   36 o    102.0    7.8    0.0000   0.0000          ?        ?   104.7175  15.9630          ?        ?      102.0        7.8       ?       ? 
1 1 1   53    4   37 o    143.8    5.8    0.0000   0.0000          ?        ?   207.5195  16.6016          ?        ?      143.8        5.8       ?       ? 
1 1 1   53    4   38 o    226.9    3.9    0.0000   0.0000          ?        ?   515.9255  17.8786          ?        ?      226.9        3.9       ?       ? 
1 1 1   53    4   39 o    206.4    4.2    0.0000   0.0000          ?        ?   427.1710  17.2401          ?        ?      206.4        4.2       ?       ? 
1 1 1   53    4   40 o    134.8    6.2    0.0000   0.0000          ?        ?   182.6172  16.6016          ?        ?      134.8        6.2       ?       ? 
1 1 1   53    4   41 o    114.8    7.2    0.0000   0.0000          ?        ?   132.8125  16.6016          ?        ?      114.8        7.2       ?       ? 
1 1 1   53    4   42 o    311.1    3.1    0.0000   0.0000          ?        ?   969.2759  19.1556          ?        ?      311.1        3.1       ?       ? 
1 1 1   53    4   43 o     34.5   14.6    0.0000   0.0000          ?        ?     1.9156  17.2401          ?        ?       34.5       14.6       ?       ? 
1 1 1   53    4   44 o     26.3   12.4    0.0000   0.0000          ?        ?   -19.1556  17.2401          ?        ?       26.3       12.4       ?       ? 
1 1 1   53    4   45 o    213.0    4.2    0.0000   0.0000          ?        ?   455.2659  17.8786          ?        ?      213.0        4.2       ?       ? 
1 1 1   53    4   46 o     21.6   10.7    0.0000   0.0000          ?        ?   -38.9498  17.2401          ?        ?       21.6       10.7       ?       ? 
1 1 1   53    5    0 o    403.3    4.8 1628.2301  38.3113  1628.2301  38.3113  1628.2301  38.3113      403.3      4.8      403.3        4.8     0.0     0.0 
1 1 1   53    5    1 o    149.4    4.5    0.0000   0.0000          ?        ?   223.4826  13.4090          ?        ?      149.4        4.5       ?       ? 
1 1 1   53    5    2 f    372.9    3.0    0.0000   0.0000          ?        ?  1391.3386  22.3483          ?        ?      372.9        3.0       ?       ? 
1 1 1   53    5    3 o    182.5    3.8    0.0000   0.0000          ?        ?   333.3083  14.0475          ?        ?      182.5        3.8       ?       ? 
1 1 1   53    5    4 o    102.5    6.2    0.0000   0.0000          ?        ?   105.3561  12.7704          ?        ?      102.5        6.2       ?       ? 
1 1 1   53    5    5 o    206.5    3.4    0.0000   0.0000          ?        ?   426.5325  14.0475          ?        ?      206.5        3.4       ?       ? 
1 1 1   53    5    6 o    261.1    3.3    0.0000   0.0000          ?        ?   681.9411  17.2401          ?        ?      261.1        3.3       ?       ? 
1 1 1   53    5    7 o    243.6    3.3    0.0000   0.0000          ?        ?   593.8251  15.9630          ?        ?      243.6        3.3       ?       ? 
1 1 1   53    5    8 o     19.7    9.6    0.0000   0.0000          ?        ?   -24.9023  12.7704          ?        ?       19.7        9.6       ?       ? 
1 1 1   53    5    9 o     86.6    7.7    0.0000   0.0000          ?        ?    75.3456  13.4090          ?        ?       86.6        7.7       ?       ? 
1 1 1   53    5   10 o    163.7    3.9    0.0000   0.0000          ?        ?   268.1791  12.7704          ?        ?      163.7        3.9       ?       ? 
1 1 1   53    5   11 o    429.3    2.8    0.0000   0.0000          ?        ?  1844.0504  24.2638          ?        ?      429.3        2.8       ?       ? 
1 1 1   53    5   12 o    395.6    3.1    0.0000   0.0000          ?        ?  1565.6550  24.9023          ?        ?      395.6        3.1       ?       ? 
1 1 1   53    5   13 o    264.9    3.1    0.0000   0.0000          ?        ?   702.3738  16.6016          ?        ?      264.9        3.1       ?       ? 
1 1 1   53    5   14 o    242.4    3.4    0.0000   0.0000          ?        ?   588.0784  16.6016          ?        ?      242.4        3.4       ?       ? 
1 1 1   53    5   15 o     32.2   13.1    0.0000   0.0000          ?        ?     3.8311  13.4090          ?        ?       32.2       13.1       ?       ? 
1 1 1   53    5   16 o    311.2    3.0    0.0000   0.0000          ?        ?   969.2759  18.5171          ?        ?      311.2        3.0       ?       ? 
1 1 1   53    5   17 o    185.9    4.3    0.0000   0.0000          ?        ?   346.0787  15.9630          ?        ?      185.9        4.3       ?       ? 
1 1 1   53    5   18 o    241.5    3.4    0.0000   0.0000          ?        ?   583.6088  16.6016          ?        ?      241.5        3.4       ?       ? 
1 1 1   53    5   19 o    197.1    4.0    0.0000   0.0000          ?        ?   388.8597  15.9630          ?        ?      197.1        4.0       ?       ? 
1 1 1   53    5   20 o    344.6    2.8    0.0000   0.0000          ?        ?  1188.2888  19.1556          ?        ?      344.6        2.8       ?       ? 
1 1 1   53    5   21 f    214.8    3.4    0.0000   0.0000          ?        ?   461.6512  14.6860          ?        ?      214.8        3.4       ?       ? 
1 1 1   53    5   22 o    215.6    3.6    0.0000   0.0000          ?        ?   465.4823  15.3245          ?        ?      215.6        3.6       ?       ? 
1 1 1   53    5   23 o    300.4    3.1    0.0000   0.0000          ?        ?   902.8696  18.5171          ?        ?      300.4        3.1       ?       ? 
1 1 1   53    5   24 o     18.6    9.3    0.0000   0.0000          ?        ?   -41.5039  14.6860          ?        ?       18.6        9.3       ?       ? 
1 1 1   53    5   25 o    150.6    4.9    0.0000   0.0000          ?        ?   227.3137  14.6860          ?        ?      150.6        4.9       ?       ? 
1 1 1   53    5   26 o    311.5    3.0    0.0000   0.0000          ?        ?   971.1914  18.5171          ?        ?      311.5        3.0       ?       ? 
1 1 1   53    5   27 o    146.3    5.2    0.0000   0.0000          ?        ?   214.5433  15.3245          ?        ?      146.3        5.2       ?       ? 
1 1 1   53    5   28 o    315.7    2.8    0.0000   0.0000          ?        ?   997.3708  17.8786          ?        ?      315.7        2.8       ?       ? 
1 1 1   53    5   29 o    115.0    6.7    0.0000   0.0000          ?        ?   132.8125  15.3245          ?        ?      115.0        6.7       ?       ? 
1 1 1   53    5   30 o    243.3    3.7    0.0000   0.0000          ?        ?   592.5481  17.8786          ?        ?      243.3        3.7       ?       ? 
1 1 1   53    5   31 o     97.2    8.2    0.0000   0.0000          ?        ?    95.1397  15.9630          ?        ?       97.2        8.2       ?       ? 
1 1 1   53    5   32 o    239.4    3.6    0.0000   0.0000          ?        ?   574.0309  17.2401          ?        ?      239.4        3.6       ?       ? 
1 1 1   53    5   33 o    195.5    4.2    0.0000   0.0000          ?        ?   383.1130  16.6016          ?        ?      195.5        4.2       ?       ? 
1 1 1   53    5   34 o     45.6   15.1    0.0000   0.0000          ?        ?    20.4327  15.9630          ?        ?       45.6       15.1       ?       ? 
1 1 1   53    5   35 o    149.4    5.6    0.0000   0.0000          ?        ?   224.1211  16.6016          ?        ?      149.4        5.6       ?       ? 
1 1 1   53    5   36 o     18.5    9.3    0.0000   0.0000          ?        ?   -50.4432  15.9630          ?        ?       18.5        9.3       ?       ? 
1 1 1   53    5   37 f     51.9   15.5    0.0000   0.0000          ?        ?    28.0950  17.2401          ?        ?       51.9       15.5       ?       ? 
1 1 1   53    5   38 o    133.8    6.2    0.0000   0.0000          ?        ?   180.0631  16.6016          ?        ?      133.8        6.2       ?       ? 
1 1 1   53    5   39 o     32.7   13.9    0.0000   0.0000          ?        ?     0.6385  15.9630          ?        ?       32.7       13.9       ?       ? 
1 1 1   53    5   40 o     51.5   14.7    0.0000   0.0000          ?        ?    28.0950  15.9630          ?        ?       51.5       14.7       ?       ? 
1 1 1   53    5   41 o     44.9   15.1    0.0000   0.0000          ?        ?    19.7942  15.9630          ?        ?       44.9       15.1       ?       ? 
1 1 1   53    5   42 o     34.5   14.4    0.0000   0.0000          ?        ?     3.1926  16.6016          ?        ?       34.5       14.4       ?       ? 
1 1 1   53    5   43 o     20.7   10.3    0.0000   0.0000          ?        ?   -40.2269  16.6016          ?        ?       20.7       10.3       ?       ? 
1 1 1   53    5   44 o     38.8   15.0    0.0000   0.0000          ?        ?    10.8549  16.6016          ?        ?       38.8       15.0       ?       ? 
1 1 1   53    5   45 o     21.5   10.6    0.0000   0.0000          ?        ?   -35.7572  16.6016          ?        ?       21.5       10.6       ?       ? 
1 1 1   53    6    0 o    234.5    4.8  551.0442  22.3483   551.0442  22.3483   551.0442  22.3483      234.5      4.8      234.5        4.8     0.0     0.0 
1 1 1   53    6    1 o    119.7    5.6    0.0000   0.0000          ?        ?   143.6674  13.4090          ?        ?      119.7        5.6       ?       ? 
1 1 1   53    6    2 o    282.7    3.2    0.0000   0.0000          ?        ?   799.4291  17.8786          ?        ?      282.7        3.2       ?       ? 
1 1 1   53    6    3 o     95.1    6.7    0.0000   0.0000          ?        ?    90.6701  12.7704          ?        ?       95.1        6.7       ?       ? 
1 1 1   53    6    4 o    179.7    3.9    0.0000   0.0000          ?        ?   323.0919  14.0475          ?        ?      179.7        3.9       ?       ? 
1 1 1   53    6    5 o    305.2    2.9    0.0000   0.0000          ?        ?   932.2416  17.8786          ?        ?      305.2        2.9       ?       ? 
1 1 1   53    6    6 o    197.4    3.6    0.0000   0.0000          ?        ?   390.1367  14.0475          ?        ?      197.4        3.6       ?       ? 
1 1 1   53    6    7 o    291.0    3.0    0.0000   0.0000          ?        ?   847.3182  17.2401          ?        ?      291.0        3.0       ?       ? 
1 1 1   53    6    8 o    243.7    3.3    0.0000   0.0000          ?        ?   594.4636  15.9630          ?        ?      243.7        3.3       ?       ? 
1 1 1   53    6    9 o    330.2    3.1    0.0000   0.0000          ?        ?  1091.2334  20.4327          ?        ?      330.2        3.1       ?       ? 
1 1 1   53    6   10 o    316.5    3.0    0.0000   0.0000          ?        ?  1002.4789  19.1556          ?        ?      316.5        3.0       ?       ? 
1 1 1   53    6   11 f    204.6    3.6    0.0000   0.0000          ?        ?   418.8702  14.6860          ?        ?      204.6        3.6       ?       ? 
1 1 1   53    6   12 o    365.8    3.0    0.0000   0.0000          ?        ?  1338.9799  21.7097          ?        ?      365.8        3.0       ?       ? 
1 1 1   53    6   13 o    128.0    5.7    0.0000   0.0000          ?        ?   164.1001  14.6860          ?        ?      128.0        5.7       ?       ? 
1 1 1   53    6   14 o    229.3    3.2    0.0000   0.0000          ?        ?   526.1418  14.6860          ?        ?      229.3        3.2       ?       ? 
1 1 1   53    6   15 o     66.1   10.6    0.0000   0.0000          ?        ?    44.0580  14.0475          ?        ?       66.1       10.6       ?       ? 
1 1 1   53    6   16 o    194.6    3.9    0.0000   0.0000          ?        ?   379.2819  15.3245          ?        ?      194.6        3.9       ?       ? 
1 1 1   53    6   17 f     60.5   12.6    0.0000   0.0000          ?        ?    38.3113  14.6860          ?        ?       60.5       12.6       ?       ? 
1 1 1   53    6   18 o    240.1    3.6    0.0000   0.0000          ?        ?   577.2236  17.2401          ?        ?      240.1        3.6       ?       ? 
1 1 1   53    6   19 o    192.8    4.0    0.0000   0.0000          ?        ?   372.2581  15.3245          ?        ?      192.8        4.0       ?       ? 
1 1 1   53    6   20 o    381.3    2.6    0.0000   0.0000          ?        ?  1454.5522  19.7942          ?        ?      381.3        2.6       ?       ? 
1 1 1   53    6   21 o    129.2    5.4    0.0000   0.0000          ?        ?   167.2927  14.0475          ?        ?      129.2        5.4       ?       ? 
1 1 1   53    6   22 o    264.1    3.3    0.0000   0.0000          ?        ?   697.9042  17.2401          ?        ?      264.1        3.3       ?       ? 
1 1 1   53    6   23 o    351.3    2.6    0.0000   0.0000          ?        ?  1234.9008  18.5171          ?        ?      351.3        2.6       ?       ? 
1 1 1   53    6   24 o    210.7    3.9    0.0000   0.0000          ?        ?   444.4110  16.6016          ?        ?      210.7        3.9       ?       ? 
1 1 1   53    6   25 o    215.6    3.7    0.0000   0.0000          ?        ?   465.4823  15.9630          ?        ?      215.6        3.7       ?       ? 
1 1 1   53    6   26 o    387.2    2.8    0.0000   0.0000          ?        ?  1500.5259  21.7097          ?        ?      387.2        2.8       ?       ? 
1 1 1   53    6   27 o     88.7    9.0    0.0000   0.0000          ?        ?    79.1767  15.9630          ?        ?       88.7        9.0       ?       ? 
1 1 1   53    6   28 o    415.1    2.7    0.0000   0.0000          ?        ?  1724.0084  22.3483          ?        ?      415.1        2.7       ?       ? 
1 1 1   53    6   29 o     67.4   10.9    0.0000   0.0000          ?        ?    45.9736  14.6860          ?        ?       67.4       10.9       ?       ? 
1 1 1   53    6   30 o    235.1    3.5    0.0000   0.0000          ?        ?   553.5982  16.6016          ?        ?      235.1        3.5       ?       ? 
1 1 1   53    6   31 o    336.2    2.8    0.0000   0.0000          ?        ?  1131.4603  19.1556          ?        ?      336.2        2.8       ?       ? 
1 1 1   53    6   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   53    6   33 o    134.1    6.2    0.0000   0.0000          ?        ?   180.7016  16.6016          ?        ?      134.1        6.2       ?       ? 
1 1 1   53    6   34 o    106.0    7.5    0.0000   0.0000          ?        ?   113.0183  15.9630          ?        ?      106.0        7.5       ?       ? 
1 1 1   53    6   35 o     74.4   10.7    0.0000   0.0000          ?        ?    56.1899  15.9630          ?        ?       74.4       10.7       ?       ? 
1 1 1   53    6   36 o     29.7   13.1    0.0000   0.0000          ?        ?    -4.4697  15.3245          ?        ?       29.7       13.1       ?       ? 
1 1 1   53    6   37 o    158.5    5.4    0.0000   0.0000          ?        ?   252.2160  17.2401          ?        ?      158.5        5.4       ?       ? 
1 1 1   53    6   38 o    253.2    3.5    0.0000   0.0000          ?        ?   642.3527  17.8786          ?        ?      253.2        3.5       ?       ? 
1 1 1   53    6   39 o    161.5    5.1    0.0000   0.0000          ?        ?   261.7939  16.6016          ?        ?      161.5        5.1       ?       ? 
1 1 1   53    6   40 o    107.3    7.4    0.0000   0.0000          ?        ?   116.2109  15.9630          ?        ?      107.3        7.4       ?       ? 
1 1 1   53    6   41 o    122.2    7.1    0.0000   0.0000          ?        ?   150.6911  17.2401          ?        ?      122.2        7.1       ?       ? 
1 1 1   53    6   42 o     41.5   15.0    0.0000   0.0000          ?        ?    15.3245  15.9630          ?        ?       41.5       15.0       ?       ? 
1 1 1   53    6   43 o     40.5   14.9    0.0000   0.0000          ?        ?    14.0475  15.9630          ?        ?       40.5       14.9       ?       ? 
1 1 1   53    6   44 o    195.5    4.4    0.0000   0.0000          ?        ?   383.7515  17.2401          ?        ?      195.5        4.4       ?       ? 
1 1 1   53    7    0 o    321.9    4.1 1036.9591  26.1794  1036.9591  26.1794  1036.9591  26.1794      321.9      4.1      321.9        4.1     0.0     0.0 
1 1 1   53    7    1 o    159.9    4.0    0.0000   0.0000          ?        ?   256.0471  12.7704          ?        ?      159.9        4.0       ?       ? 
1 1 1   53    7    2 o    415.3    2.7    0.0000   0.0000          ?        ?  1725.9238  22.3483          ?        ?      415.3        2.7       ?       ? 
1 1 1   53    7    3 o    130.5    5.1    0.0000   0.0000          ?        ?   170.4853  13.4090          ?        ?      130.5        5.1       ?       ? 
1 1 1   53    7    4 o     28.1   12.1    0.0000   0.0000          ?        ?    -0.6385  12.1319          ?        ?       28.1       12.1       ?       ? 
1 1 1   53    7    5 f    221.9    3.6    0.0000   0.0000          ?        ?   492.9387  15.9630          ?        ?      221.9        3.6       ?       ? 
1 1 1   53    7    6 o     20.1    9.9    0.0000   0.0000          ?        ?   -33.2031  14.6860          ?        ?       20.1        9.9       ?       ? 
1 1 1   53    7    7 o     21.1   10.2    0.0000   0.0000          ?        ?   -19.7942  12.7704          ?        ?       21.1       10.2       ?       ? 
1 1 1   53    7    8 o    238.3    3.3    0.0000   0.0000          ?        ?   568.2842  15.9630          ?        ?      238.3        3.3       ?       ? 
1 1 1   53    7    9 o    505.8    3.1    0.0000   0.0000          ?        ?  2559.8333  31.2876          ?        ?      505.8        3.1       ?       ? 
1 1 1   53    7   10 o    248.8    3.2    0.0000   0.0000          ?        ?   619.3660  15.9630          ?        ?      248.8        3.2       ?       ? 
1 1 1   53    7   11 o    302.6    3.2    0.0000   0.0000          ?        ?   916.2786  19.1556          ?        ?      302.6        3.2       ?       ? 
1 1 1   53    7   12 o    265.4    3.4    0.0000   0.0000          ?        ?   704.9279  17.8786          ?        ?      265.4        3.4       ?       ? 
1 1 1   53    7   13 o    209.0    3.8    0.0000   0.0000          ?        ?   437.3873  15.9630          ?        ?      209.0        3.8       ?       ? 
1 1 1   53    7   14 o     73.9    9.5    0.0000   0.0000          ?        ?    54.9129  14.0475          ?        ?       73.9        9.5       ?       ? 
1 1 1   53    7   15 o    182.8    3.8    0.0000   0.0000          ?        ?   334.5853  14.0475          ?        ?      182.8        3.8       ?       ? 
1 1 1   53    7   16 o    176.0    4.2    0.0000   0.0000          ?        ?   310.3215  14.6860          ?        ?      176.0        4.2       ?       ? 
1 1 1   53    7   17 o    331.2    3.3    0.0000   0.0000          ?        ?  1097.6187  21.7097          ?        ?      331.2        3.3       ?       ? 
1 1 1   53    7   18 o    247.3    3.6    0.0000   0.0000          ?        ?   612.3422  17.8786          ?        ?      247.3        3.6       ?       ? 
1 1 1   53    7   19 o    213.7    3.6    0.0000   0.0000          ?        ?   457.1815  15.3245          ?        ?      213.7        3.6       ?       ? 
1 1 1   53    7   20 f    179.1    3.9    0.0000   0.0000          ?        ?   321.1764  14.0475          ?        ?      179.1        3.9       ?       ? 
1 1 1   53    7   21 o    147.8    5.0    0.0000   0.0000          ?        ?   219.0129  14.6860          ?        ?      147.8        5.0       ?       ? 
1 1 1   53    7   22 o    184.5    4.3    0.0000   0.0000          ?        ?   340.9706  15.9630          ?        ?      184.5        4.3       ?       ? 
1 1 1   53    7   23 o    114.5    6.7    0.0000   0.0000          ?        ?   131.5355  15.3245          ?        ?      114.5        6.7       ?       ? 
1 1 1   53    7   24 o    220.6    3.5    0.0000   0.0000          ?        ?   487.1920  15.3245          ?        ?      220.6        3.5       ?       ? 
1 1 1   53    7   25 f    346.4    3.0    0.0000   0.0000          ?        ?  1201.0592  21.0712          ?        ?      346.4        3.0       ?       ? 
1 1 1   53    7   26 o    400.1    2.8    0.0000   0.0000          ?        ?  1602.0508  22.3483          ?        ?      400.1        2.8       ?       ? 
1 1 1   53    7   27 o    111.6    6.9    0.0000   0.0000          ?        ?   125.1502  15.3245          ?        ?      111.6        6.9       ?       ? 
1 1 1   53    7   28 o    423.3    2.6    0.0000   0.0000          ?        ?  1792.9686  22.3483          ?        ?      423.3        2.6       ?       ? 
1 1 1   53    7   29 o    148.0    5.4    0.0000   0.0000          ?        ?   219.6514  15.9630          ?        ?      148.0        5.4       ?       ? 
1 1 1   53    7   30 o    365.8    2.9    0.0000   0.0000          ?        ?  1338.9799  21.0712          ?        ?      365.8        2.9       ?       ? 
1 1 1   53    7   31 o     73.6   10.8    0.0000   0.0000          ?        ?    54.9129  15.9630          ?        ?       73.6       10.8       ?       ? 
1 1 1   53    7   32 o    127.6    6.3    0.0000   0.0000          ?        ?   163.4615  15.9630          ?        ?      127.6        6.3       ?       ? 
1 1 1   53    7   33 o    255.4    3.4    0.0000   0.0000          ?        ?   653.2076  17.2401          ?        ?      255.4        3.4       ?       ? 
1 1 1   53    7   34 o    147.5    5.6    0.0000   0.0000          ?        ?   218.3744  16.6016          ?        ?      147.5        5.6       ?       ? 
1 1 1   53    7   35 o    117.1    6.5    0.0000   0.0000          ?        ?   137.9207  15.3245          ?        ?      117.1        6.5       ?       ? 
1 1 1   53    7   36 f     89.2    9.3    0.0000   0.0000          ?        ?    80.4537  16.6016          ?        ?       89.2        9.3       ?       ? 
1 1 1   53    7   37 o    154.8    5.4    0.0000   0.0000          ?        ?   240.7227  16.6016          ?        ?      154.8        5.4       ?       ? 
1 1 1   53    7   38 o     40.3   15.2    0.0000   0.0000          ?        ?    12.7704  16.6016          ?        ?       40.3       15.2       ?       ? 
1 1 1   53    7   39 o    123.9    6.4    0.0000   0.0000          ?        ?   154.5222  15.9630          ?        ?      123.9        6.4       ?       ? 
1 1 1   53    7   40 o     90.8    9.1    0.0000   0.0000          ?        ?    83.6463  16.6016          ?        ?       90.8        9.1       ?       ? 
1 1 1   53    7   41 o    170.8    4.9    0.0000   0.0000          ?        ?   293.0815  16.6016          ?        ?      170.8        4.9       ?       ? 
1 1 1   53    7   42 o    117.9    7.0    0.0000   0.0000          ?        ?   140.4748  16.6016          ?        ?      117.9        7.0       ?       ? 
1 1 1   53    7   43 o     25.3   12.0    0.0000   0.0000          ?        ?   -19.7942  16.6016          ?        ?       25.3       12.0       ?       ? 
1 1 1   53    8    0 f    184.3    5.7  340.9706  21.0712   340.9706  21.0712   340.9706  21.0712      184.3      5.7      184.3        5.7     0.0     0.0 
1 1 1   53    8    1 o    342.4    2.7    0.0000   0.0000          ?        ?  1172.9642  18.5171          ?        ?      342.4        2.7       ?       ? 
1 1 1   53    8    2 o    339.9    2.8    0.0000   0.0000          ?        ?  1155.7241  19.1556          ?        ?      339.9        2.8       ?       ? 
1 1 1   53    8    3 o    410.5    3.1    0.0000   0.0000          ?        ?  1686.3357  25.5409          ?        ?      410.5        3.1       ?       ? 
1 1 1   53    8    4 o    179.0    3.7    0.0000   0.0000          ?        ?   320.5379  13.4090          ?        ?      179.0        3.7       ?       ? 
1 1 1   53    8    5 o    302.5    3.0    0.0000   0.0000          ?        ?   915.6400  17.8786          ?        ?      302.5        3.0       ?       ? 
1 1 1   53    8    6 o     41.0   13.1    0.0000   0.0000          ?        ?    16.6016  12.1319          ?        ?       41.0       13.1       ?       ? 
1 1 1   53    8    7 o     29.6   12.3    0.0000   0.0000          ?        ?     1.9156  12.1319          ?        ?       29.6       12.3       ?       ? 
1 1 1   53    8    8 o    169.6    4.1    0.0000   0.0000          ?        ?   287.9732  14.0475          ?        ?      169.6        4.1       ?       ? 
1 1 1   53    8    9 o    244.6    3.4    0.0000   0.0000          ?        ?   598.9333  16.6016          ?        ?      244.6        3.4       ?       ? 
1 1 1   53    8   10 o    107.1    5.7    0.0000   0.0000          ?        ?   114.9339  12.1319          ?        ?      107.1        5.7       ?       ? 
1 1 1   53    8   11 o    188.5    4.1    0.0000   0.0000          ?        ?   355.6566  15.3245          ?        ?      188.5        4.1       ?       ? 
1 1 1   53    8   12 o    139.2    5.5    0.0000   0.0000          ?        ?   194.1106  15.3245          ?        ?      139.2        5.5       ?       ? 
1 1 1   53    8   13 o    378.1    3.1    0.0000   0.0000          ?        ?  1430.9270  23.6253          ?        ?      378.1        3.1       ?       ? 
1 1 1   53    8   14 o    334.2    3.0    0.0000   0.0000          ?        ?  1117.4128  19.7942          ?        ?      334.2        3.0       ?       ? 
1 1 1   53    8   15 o    236.5    3.5    0.0000   0.0000          ?        ?   559.9835  16.6016          ?        ?      236.5        3.5       ?       ? 
1 1 1   53    8   16 o     89.1    8.2    0.0000   0.0000          ?        ?    79.8152  14.6860          ?        ?       89.1        8.2       ?       ? 
1 1 1   53    8   17 o    212.5    3.8    0.0000   0.0000          ?        ?   452.0733  15.9630          ?        ?      212.5        3.8       ?       ? 
1 1 1   53    8   18 o    213.6    3.6    0.0000   0.0000          ?        ?   456.5430  15.3245          ?        ?      213.6        3.6       ?       ? 
1 1 1   53    8   19 o     28.7   12.6    0.0000   0.0000          ?        ?    -3.8311  14.0475          ?        ?       28.7       12.6       ?       ? 
1 1 1   53    8   20 o    160.5    4.6    0.0000   0.0000          ?        ?   257.9627  14.6860          ?        ?      160.5        4.6       ?       ? 
1 1 1   53    8   21 o     81.2    9.4    0.0000   0.0000          ?        ?    66.4062  15.3245          ?        ?       81.2        9.4       ?       ? 
1 1 1   53    8   22 o     47.0   14.7    0.0000   0.0000          ?        ?    22.3483  15.3245          ?        ?       47.0       14.7       ?       ? 
1 1 1   53    8   23 o     35.3   14.4    0.0000   0.0000          ?        ?     5.1082  15.9630          ?        ?       35.3       14.4       ?       ? 
1 1 1   53    8   24 o    236.2    3.5    0.0000   0.0000          ?        ?   558.7064  16.6016          ?        ?      236.2        3.5       ?       ? 
1 1 1   53    8   25 o     45.4   14.8    0.0000   0.0000          ?        ?    20.4327  15.3245          ?        ?       45.4       14.8       ?       ? 
1 1 1   53    8   26 o    202.5    3.8    0.0000   0.0000          ?        ?   410.5694  15.3245          ?        ?      202.5        3.8       ?       ? 
1 1 1   53    8   27 o     28.6   12.8    0.0000   0.0000          ?        ?    -7.0237  15.3245          ?        ?       28.6       12.8       ?       ? 
1 1 1   53    8   28 o    289.0    3.1    0.0000   0.0000          ?        ?   835.8248  17.8786          ?        ?      289.0        3.1       ?       ? 
1 1 1   53    8   29 o     35.8   14.3    0.0000   0.0000          ?        ?     7.0237  15.3245          ?        ?       35.8       14.3       ?       ? 
1 1 1   53    8   30 o    185.1    4.7    0.0000   0.0000          ?        ?   343.5246  17.2401          ?        ?      185.1        4.7       ?       ? 
1 1 1   53    8   31 o    256.4    3.4    0.0000   0.0000          ?        ?   658.3158  17.2401          ?        ?      256.4        3.4       ?       ? 
1 1 1   53    8   32 o    236.6    3.8    0.0000   0.0000          ?        ?   560.6220  17.8786          ?        ?      236.6        3.8       ?       ? 
1 1 1   53    8   33 o     78.9   10.9    0.0000   0.0000          ?        ?    63.2136  17.2401          ?        ?       78.9       10.9       ?       ? 
1 1 1   53    8   34 o    192.0    4.3    0.0000   0.0000          ?        ?   369.7040  16.6016          ?        ?      192.0        4.3       ?       ? 
1 1 1   53    8   35 o    123.9    6.4    0.0000   0.0000          ?        ?   154.5222  15.9630          ?        ?      123.9        6.4       ?       ? 
1 1 1   53    8   36 o    170.7    5.1    0.0000   0.0000          ?        ?   292.4429  17.2401          ?        ?      170.7        5.1       ?       ? 
1 1 1   53    8   37 o     23.1   11.2    0.0000   0.0000          ?        ?   -28.7335  16.6016          ?        ?       23.1       11.2       ?       ? 
1 1 1   53    8   38 o    110.0    7.0    0.0000   0.0000          ?        ?   121.9576  15.3245          ?        ?      110.0        7.0       ?       ? 
1 1 1   53    8   39 o     76.7   10.4    0.0000   0.0000          ?        ?    60.0210  15.9630          ?        ?       76.7       10.4       ?       ? 
1 1 1   53    8   40 o    132.7    6.3    0.0000   0.0000          ?        ?   177.5090  16.6016          ?        ?      132.7        6.3       ?       ? 
1 1 1   53    8   41 o     24.1   11.6    0.0000   0.0000          ?        ?   -24.2638  16.6016          ?        ?       24.1       11.6       ?       ? 
1 1 1   53    9    0 o    479.5    4.4 2301.2319  42.1424  2301.2319  42.1424  2301.2319  42.1424      479.5      4.4      479.5        4.4     0.0     0.0 
1 1 1   53    9    1 o    369.0    3.0    0.0000   0.0000          ?        ?  1362.6051  22.3483          ?        ?      369.0        3.0       ?       ? 
1 1 1   53    9    2 o    251.5    3.3    0.0000   0.0000          ?        ?   632.7749  16.6016          ?        ?      251.5        3.3       ?       ? 
1 1 1   53    9    3 o    334.9    3.1    0.0000   0.0000          ?        ?  1122.5210  20.4327          ?        ?      334.9        3.1       ?       ? 
1 1 1   53    9    4 o    308.3    2.9    0.0000   0.0000          ?        ?   950.7587  17.8786          ?        ?      308.3        2.9       ?       ? 
1 1 1   53    9    5 o    373.1    3.2    0.0000   0.0000          ?        ?  1393.2542  23.6253          ?        ?      373.1        3.2       ?       ? 
1 1 1   53    9    6 o    238.7    3.7    0.0000   0.0000          ?        ?   570.1998  17.8786          ?        ?      238.7        3.7       ?       ? 
1 1 1   53    9    7 o    454.5    3.2    0.0000   0.0000          ?        ?  2066.8945  28.7335          ?        ?      454.5        3.2       ?       ? 
1 1 1   53    9    8 o    220.6    3.3    0.0000   0.0000          ?        ?   487.1920  14.6860          ?        ?      220.6        3.3       ?       ? 
1 1 1   53    9    9 o    141.7    5.2    0.0000   0.0000          ?        ?   201.1343  14.6860          ?        ?      141.7        5.2       ?       ? 
1 1 1   53    9   10 o     42.9   14.1    0.0000   0.0000          ?        ?    17.8786  14.0475          ?        ?       42.9       14.1       ?       ? 
1 1 1   53    9   11 f    123.9    5.7    0.0000   0.0000          ?        ?   153.8837  14.0475          ?        ?      123.9        5.7       ?       ? 
1 1 1   53    9   12 o    209.0    3.7    0.0000   0.0000          ?        ?   437.3873  15.3245          ?        ?      209.0        3.7       ?       ? 
1 1 1   53    9   13 o    128.0    5.5    0.0000   0.0000          ?        ?   164.1001  14.0475          ?        ?      128.0        5.5       ?       ? 
1 1 1   53    9   14 o    458.4    2.9    0.0000   0.0000          ?        ?  2102.6516  26.8179          ?        ?      458.4        2.9       ?       ? 
1 1 1   53    9   15 o    108.8    6.5    0.0000   0.0000          ?        ?   118.7650  14.0475          ?        ?      108.8        6.5       ?       ? 
1 1 1   53    9   16 o    253.8    3.6    0.0000   0.0000          ?        ?   644.9069  18.5171          ?        ?      253.8        3.6       ?       ? 
1 1 1   53    9   17 o    289.1    3.2    0.0000   0.0000          ?        ?   836.4633  18.5171          ?        ?      289.1        3.2       ?       ? 
1 1 1   53    9   18 o    119.1    6.4    0.0000   0.0000          ?        ?   142.3903  15.3245          ?        ?      119.1        6.4       ?       ? 
1 1 1   53    9   19 o    128.2    5.5    0.0000   0.0000          ?        ?   164.7386  14.0475          ?        ?      128.2        5.5       ?       ? 
1 1 1   53    9   20 o    104.6    7.0    0.0000   0.0000          ?        ?   109.8257  14.6860          ?        ?      104.6        7.0       ?       ? 
1 1 1   53    9   21 o     61.3   12.9    0.0000   0.0000          ?        ?    39.5883  15.3245          ?        ?       61.3       12.9       ?       ? 
1 1 1   53    9   22 o     62.8   13.1    0.0000   0.0000          ?        ?    41.5039  15.9630          ?        ?       62.8       13.1       ?       ? 
1 1 1   53    9   23 o    255.3    3.3    0.0000   0.0000          ?        ?   652.5691  16.6016          ?        ?      255.3        3.3       ?       ? 
1 1 1   53    9   24 o     84.6    9.1    0.0000   0.0000          ?        ?    72.1529  15.3245          ?        ?       84.6        9.1       ?       ? 
1 1 1   53    9   25 o    178.5    4.3    0.0000   0.0000          ?        ?   319.2608  15.3245          ?        ?      178.5        4.3       ?       ? 
1 1 1   53    9   26 o     43.9   14.8    0.0000   0.0000          ?        ?    18.5171  15.3245          ?        ?       43.9       14.8       ?       ? 
1 1 1   53    9   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   53    9   28 o    199.1    4.2    0.0000   0.0000          ?        ?   397.1605  16.6016          ?        ?      199.1        4.2       ?       ? 
1 1 1   53    9   29 o    454.5    2.7    0.0000   0.0000          ?        ?  2067.5330  24.2638          ?        ?      454.5        2.7       ?       ? 
1 1 1   53    9   30 o    243.8    3.5    0.0000   0.0000          ?        ?   595.1021  17.2401          ?        ?      243.8        3.5       ?       ? 
1 1 1   53    9   31 o    109.1    7.9    0.0000   0.0000          ?        ?   120.0421  17.2401          ?        ?      109.1        7.9       ?       ? 
1 1 1   53    9   32 o    270.8    3.2    0.0000   0.0000          ?        ?   734.2999  17.2401          ?        ?      270.8        3.2       ?       ? 
1 1 1   53    9   33 o    195.7    4.2    0.0000   0.0000          ?        ?   383.7515  16.6016          ?        ?      195.7        4.2       ?       ? 
1 1 1   53    9   34 o    285.7    3.2    0.0000   0.0000          ?        ?   817.3077  18.5171          ?        ?      285.7        3.2       ?       ? 
1 1 1   53    9   35 o    314.8    2.9    0.0000   0.0000          ?        ?   992.2626  18.5171          ?        ?      314.8        2.9       ?       ? 
1 1 1   53    9   36 o    160.7    5.2    0.0000   0.0000          ?        ?   259.2398  16.6016          ?        ?      160.7        5.2       ?       ? 
1 1 1   53    9   37 o    126.9    6.3    0.0000   0.0000          ?        ?   162.1845  15.9630          ?        ?      126.9        6.3       ?       ? 
1 1 1   53    9   38 o    225.4    3.7    0.0000   0.0000          ?        ?   509.5403  16.6016          ?        ?      225.4        3.7       ?       ? 
1 1 1   53    9   39 o    281.7    3.2    0.0000   0.0000          ?        ?   794.9594  17.8786          ?        ?      281.7        3.2       ?       ? 
1 1 1   53    9   40 o    147.1    5.6    0.0000   0.0000          ?        ?   217.7359  16.6016          ?        ?      147.1        5.6       ?       ? 
1 1 1   53   10    0 o    253.5    4.4  643.6298  22.3483   643.6298  22.3483   643.6298  22.3483      253.5      4.4      253.5        4.4     0.0     0.0 
1 1 1   53   10    1 o    192.3    3.7    0.0000   0.0000          ?        ?   370.3425  14.0475          ?        ?      192.3        3.7       ?       ? 
1 1 1   53   10    2 o    233.6    3.0    0.0000   0.0000          ?        ?   545.9360  14.0475          ?        ?      233.6        3.0       ?       ? 
1 1 1   53   10    3 o    222.5    3.7    0.0000   0.0000          ?        ?   495.4928  16.6016          ?        ?      222.5        3.7       ?       ? 
1 1 1   53   10    4 o    326.4    3.1    0.0000   0.0000          ?        ?  1066.3312  20.4327          ?        ?      326.4        3.1       ?       ? 
1 1 1   53   10    5 o    423.5    3.2    0.0000   0.0000          ?        ?  1794.8843  27.4564          ?        ?      423.5        3.2       ?       ? 
1 1 1   53   10    6 o    268.3    3.0    0.0000   0.0000          ?        ?   720.2524  15.9630          ?        ?      268.3        3.0       ?       ? 
1 1 1   53   10    7 o    283.1    3.0    0.0000   0.0000          ?        ?   801.9832  17.2401          ?        ?      283.1        3.0       ?       ? 
1 1 1   53   10    8 f    231.6    3.4    0.0000   0.0000          ?        ?   536.9967  15.9630          ?        ?      231.6        3.4       ?       ? 
1 1 1   53   10    9 o    245.9    3.2    0.0000   0.0000          ?        ?   605.3185  15.9630          ?        ?      245.9        3.2       ?       ? 
1 1 1   53   10   10 o    165.9    4.8    0.0000   0.0000          ?        ?   275.8413  15.9630          ?        ?      165.9        4.8       ?       ? 
1 1 1   53   10   11 o     18.1    9.0    0.0000   0.0000          ?        ?   -40.2269  14.0475          ?        ?       18.1        9.0       ?       ? 
1 1 1   53   10   12 o    142.6    4.9    0.0000   0.0000          ?        ?   203.6884  14.0475          ?        ?      142.6        4.9       ?       ? 
1 1 1   53   10   13 o    237.6    3.1    0.0000   0.0000          ?        ?   565.0916  14.6860          ?        ?      237.6        3.1       ?       ? 
1 1 1   53   10   14 o    341.9    3.1    0.0000   0.0000          ?        ?  1169.7716  21.0712          ?        ?      341.9        3.1       ?       ? 
1 1 1   53   10   15 f    378.5    3.0    0.0000   0.0000          ?        ?  1434.1196  22.9868          ?        ?      378.5        3.0       ?       ? 
1 1 1   53   10   16 o    152.7    4.6    0.0000   0.0000          ?        ?   233.6989  14.0475          ?        ?      152.7        4.6       ?       ? 
1 1 1   53   10   17 o    160.8    5.0    0.0000   0.0000          ?        ?   259.2398  15.9630          ?        ?      160.8        5.0       ?       ? 
1 1 1   53   10   18 o    288.2    3.2    0.0000   0.0000          ?        ?   831.3552  18.5171          ?        ?      288.2        3.2       ?       ? 
1 1 1   53   10   19 o    390.1    3.0    0.0000   0.0000          ?        ?  1522.8740  23.6253          ?        ?      390.1        3.0       ?       ? 
1 1 1   53   10   20 o    268.4    3.3    0.0000   0.0000          ?        ?   720.8909  17.8786          ?        ?      268.4        3.3       ?       ? 
1 1 1   53   10   21 o    303.9    2.8    0.0000   0.0000          ?        ?   924.5793  17.2401          ?        ?      303.9        2.8       ?       ? 
1 1 1   53   10   22 o     92.2    8.0    0.0000   0.0000          ?        ?    85.5619  14.6860          ?        ?       92.2        8.0       ?       ? 
1 1 1   53   10   23 o    105.7    6.9    0.0000   0.0000          ?        ?   112.3798  14.6860          ?        ?      105.7        6.9       ?       ? 
1 1 1   53   10   24 o    251.1    3.3    0.0000   0.0000          ?        ?   631.4979  16.6016          ?        ?      251.1        3.3       ?       ? 
1 1 1   53   10   25 o     94.9    8.1    0.0000   0.0000          ?        ?    90.6701  15.3245          ?        ?       94.9        8.1       ?       ? 
1 1 1   53   10   26 o    163.6    4.7    0.0000   0.0000          ?        ?   268.1791  15.3245          ?        ?      163.6        4.7       ?       ? 
1 1 1   53   10   27 o    303.3    3.1    0.0000   0.0000          ?        ?   920.7482  18.5171          ?        ?      303.3        3.1       ?       ? 
1 1 1   53   10   28 o    353.9    2.9    0.0000   0.0000          ?        ?  1254.0564  20.4327          ?        ?      353.9        2.9       ?       ? 
1 1 1   53   10   29 o     36.7   14.6    0.0000   0.0000          ?        ?     7.6623  15.9630          ?        ?       36.7       14.6       ?       ? 
1 1 1   53   10   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   53   10   31 o     17.5    8.9    0.0000   0.0000          ?        ?   -57.4669  15.9630          ?        ?       17.5        8.9       ?       ? 
1 1 1   53   10   32 f    176.8    4.5    0.0000   0.0000          ?        ?   313.5141  15.9630          ?        ?      176.8        4.5       ?       ? 
1 1 1   53   10   33 o     99.0    8.1    0.0000   0.0000          ?        ?    98.9709  15.9630          ?        ?       99.0        8.1       ?       ? 
1 1 1   53   10   34 o    233.4    3.8    0.0000   0.0000          ?        ?   545.9360  17.8786          ?        ?      233.4        3.8       ?       ? 
1 1 1   53   10   35 o    329.5    2.9    0.0000   0.0000          ?        ?  1087.4023  19.1556          ?        ?      329.5        2.9       ?       ? 
1 1 1   53   10   36 o     74.1   11.2    0.0000   0.0000          ?        ?    56.1899  16.6016          ?        ?       74.1       11.2       ?       ? 
1 1 1   53   10   37 o    157.4    5.3    0.0000   0.0000          ?        ?   249.0234  16.6016          ?        ?      157.4        5.3       ?       ? 
1 1 1   53   10   38 o    317.6    3.0    0.0000   0.0000          ?        ?  1010.7797  19.1556          ?        ?      317.6        3.0       ?       ? 
1 1 1   53   10   39 o    183.9    4.5    0.0000   0.0000          ?        ?   339.6935  16.6016          ?        ?      183.9        4.5       ?       ? 
1 1 1   53   11    0 o    142.0    5.9  203.0499  16.6016   203.0499  16.6016   203.0499  16.6016      142.0      5.9      142.0        5.9     0.0     0.0 
1 1 1   53   11    1 o    210.0    3.3    0.0000   0.0000          ?        ?   441.2184  14.0475          ?        ?      210.0        3.3       ?       ? 
1 1 1   53   11    2 o    136.9    4.4    0.0000   0.0000          ?        ?   187.7254  12.1319          ?        ?      136.9        4.4       ?       ? 
1 1 1   53   11    3 o    234.1    3.3    0.0000   0.0000          ?        ?   548.4901  15.3245          ?        ?      234.1        3.3       ?       ? 
1 1 1   53   11    4 o    243.3    3.1    0.0000   0.0000          ?        ?   592.5481  15.3245          ?        ?      243.3        3.1       ?       ? 
1 1 1   53   11    5 o    429.0    3.1    0.0000   0.0000          ?        ?  1841.4963  26.8179          ?        ?      429.0        3.1       ?       ? 
1 1 1   53   11    6 o    124.9    5.1    0.0000   0.0000          ?        ?   156.4378  12.7704          ?        ?      124.9        5.1       ?       ? 
1 1 1   53   11    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   53   11    8 o     49.3   12.8    0.0000   0.0000          ?        ?    25.5409  12.7704          ?        ?       49.3       12.8       ?       ? 
1 1 1   53   11    9 o    310.0    3.0    0.0000   0.0000          ?        ?   961.6136  18.5171          ?        ?      310.0        3.0       ?       ? 
1 1 1   53   11   10 o    415.0    2.8    0.0000   0.0000          ?        ?  1723.3699  23.6253          ?        ?      415.0        2.8       ?       ? 
1 1 1   53   11   11 o    345.3    3.1    0.0000   0.0000          ?        ?  1193.3969  21.7097          ?        ?      345.3        3.1       ?       ? 
1 1 1   53   11   12 o    194.0    3.8    0.0000   0.0000          ?        ?   376.7278  14.6860          ?        ?      194.0        3.8       ?       ? 
1 1 1   53   11   13 o    178.5    4.3    0.0000   0.0000          ?        ?   319.2608  15.3245          ?        ?      178.5        4.3       ?       ? 
1 1 1   53   11   14 o    133.1    5.3    0.0000   0.0000          ?        ?   177.5090  14.0475          ?        ?      133.1        5.3       ?       ? 
1 1 1   53   11   15 o    259.8    3.1    0.0000   0.0000          ?        ?   675.5559  15.9630          ?        ?      259.8        3.1       ?       ? 
1 1 1   53   11   16 o    237.0    3.5    0.0000   0.0000          ?        ?   562.5375  16.6016          ?        ?      237.0        3.5       ?       ? 
1 1 1   53   11   17 o    271.1    3.3    0.0000   0.0000          ?        ?   735.5769  17.8786          ?        ?      271.1        3.3       ?       ? 
1 1 1   53   11   18 o    146.3    4.8    0.0000   0.0000          ?        ?   214.5433  14.0475          ?        ?      146.3        4.8       ?       ? 
1 1 1   53   11   19 o    160.0    4.8    0.0000   0.0000          ?        ?   256.6857  15.3245          ?        ?      160.0        4.8       ?       ? 
1 1 1   53   11   20 o     26.7   12.4    0.0000   0.0000          ?        ?   -14.0475  15.9630          ?        ?       26.7       12.4       ?       ? 
1 1 1   53   11   21 o    159.2    4.8    0.0000   0.0000          ?        ?   254.1316  15.3245          ?        ?      159.2        4.8       ?       ? 
1 1 1   53   11   22 f    176.7    4.5    0.0000   0.0000          ?        ?   312.8756  15.9630          ?        ?      176.7        4.5       ?       ? 
1 1 1   53   11   23 o    271.5    3.2    0.0000   0.0000          ?        ?   738.1310  17.2401          ?        ?      271.5        3.2       ?       ? 
1 1 1   53   11   24 o    215.6    3.7    0.0000   0.0000          ?        ?   465.4823  15.9630          ?        ?      215.6        3.7       ?       ? 
1 1 1   53   11   25 o     86.4    9.2    0.0000   0.0000          ?        ?    75.3456  15.9630          ?        ?       86.4        9.2       ?       ? 
1 1 1   53   11   26 o    220.4    3.8    0.0000   0.0000          ?        ?   486.5535  16.6016          ?        ?      220.4        3.8       ?       ? 
1 1 1   53   11   27 o    240.5    3.5    0.0000   0.0000          ?        ?   579.1391  16.6016          ?        ?      240.5        3.5       ?       ? 
1 1 1   53   11   28 o     28.7   13.0    0.0000   0.0000          ?        ?    -8.3008  15.9630          ?        ?       28.7       13.0       ?       ? 
1 1 1   53   11   29 f    171.3    4.8    0.0000   0.0000          ?        ?   294.3585  16.6016          ?        ?      171.3        4.8       ?       ? 
1 1 1   53   11   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   53   11   31 f    145.3    5.5    0.0000   0.0000          ?        ?   211.9892  15.9630          ?        ?      145.3        5.5       ?       ? 
1 1 1   53   11   32 o    178.2    4.5    0.0000   0.0000          ?        ?   318.6223  15.9630          ?        ?      178.2        4.5       ?       ? 
1 1 1   53   11   33 o     53.5   14.5    0.0000   0.0000          ?        ?    30.6490  15.9630          ?        ?       53.5       14.5       ?       ? 
1 1 1   53   11   34 o    218.1    3.8    0.0000   0.0000          ?        ?   476.9756  16.6016          ?        ?      218.1        3.8       ?       ? 
1 1 1   53   11   35 o     78.7   10.5    0.0000   0.0000          ?        ?    63.2136  16.6016          ?        ?       78.7       10.5       ?       ? 
1 1 1   53   11   36 o     47.5   14.7    0.0000   0.0000          ?        ?    23.6253  15.3245          ?        ?       47.5       14.7       ?       ? 
1 1 1   53   11   37 o    379.3    2.7    0.0000   0.0000          ?        ?  1440.5049  20.4327          ?        ?      379.3        2.7       ?       ? 
1 1 1   53   12    0 o    403.5    4.2 1630.1458  33.8416  1630.1458  33.8416  1630.1458  33.8416      403.5      4.2      403.5        4.2     0.0     0.0 
1 1 1   53   12    1 o    241.9    3.0    0.0000   0.0000          ?        ?   585.5243  14.6860          ?        ?      241.9        3.0       ?       ? 
1 1 1   53   12    2 o    370.1    2.9    0.0000   0.0000          ?        ?  1370.9059  21.7097          ?        ?      370.1        2.9       ?       ? 
1 1 1   53   12    3 o    101.3    5.0    0.0000   0.0000          ?        ?   102.8020  10.2163          ?        ?      101.3        5.0       ?       ? 
1 1 1   53   12    4 o    385.3    2.9    0.0000   0.0000          ?        ?  1485.8398  22.3483          ?        ?      385.3        2.9       ?       ? 
1 1 1   53   12    5 o    271.8    2.9    0.0000   0.0000          ?        ?   739.4081  15.9630          ?        ?      271.8        2.9       ?       ? 
1 1 1   53   12    6 o    301.2    3.2    0.0000   0.0000          ?        ?   907.9777  19.1556          ?        ?      301.2        3.2       ?       ? 
1 1 1   53   12    7 o    409.3    3.0    0.0000   0.0000          ?        ?  1676.7578  24.2638          ?        ?      409.3        3.0       ?       ? 
1 1 1   53   12    8 o    317.1    3.1    0.0000   0.0000          ?        ?  1006.3101  19.7942          ?        ?      317.1        3.1       ?       ? 
1 1 1   53   12    9 o    131.9    5.1    0.0000   0.0000          ?        ?   174.3164  13.4090          ?        ?      131.9        5.1       ?       ? 
1 1 1   53   12   10 o    124.7    5.1    0.0000   0.0000          ?        ?   155.7993  12.7704          ?        ?      124.7        5.1       ?       ? 
1 1 1   53   12   11 o    378.0    2.9    0.0000   0.0000          ?        ?  1429.6499  21.7097          ?        ?      378.0        2.9       ?       ? 
1 1 1   53   12   12 o     55.2   11.4    0.0000   0.0000          ?        ?    31.9261  12.1319          ?        ?       55.2       11.4       ?       ? 
1 1 1   53   12   13 o     89.1    7.5    0.0000   0.0000          ?        ?    79.8152  13.4090          ?        ?       89.1        7.5       ?       ? 
1 1 1   53   12   14 o    178.0    3.9    0.0000   0.0000          ?        ?   317.3452  14.0475          ?        ?      178.0        3.9       ?       ? 
1 1 1   53   12   15 o    278.5    3.2    0.0000   0.0000          ?        ?   776.4423  17.8786          ?        ?      278.5        3.2       ?       ? 
1 1 1   53   12   16 o     89.8    7.8    0.0000   0.0000          ?        ?    81.0922  14.0475          ?        ?       89.8        7.8       ?       ? 
1 1 1   53   12   17 o    197.8    3.9    0.0000   0.0000          ?        ?   392.0523  15.3245          ?        ?      197.8        3.9       ?       ? 
1 1 1   53   12   18 o    202.0    4.0    0.0000   0.0000          ?        ?   408.6538  15.9630          ?        ?      202.0        4.0       ?       ? 
1 1 1   53   12   19 o    170.6    4.5    0.0000   0.0000          ?        ?   291.8044  15.3245          ?        ?      170.6        4.5       ?       ? 
1 1 1   53   12   20 o    200.2    4.1    0.0000   0.0000          ?        ?   401.6301  16.6016          ?        ?      200.2        4.1       ?       ? 
1 1 1   53   12   21 o    157.6    4.9    0.0000   0.0000          ?        ?   249.0234  15.3245          ?        ?      157.6        4.9       ?       ? 
1 1 1   53   12   22 o     28.8   12.9    0.0000   0.0000          ?        ?    -6.3852  15.3245          ?        ?       28.8       12.9       ?       ? 
1 1 1   53   12   23 o     19.8    9.8    0.0000   0.0000          ?        ?   -34.4802  14.6860          ?        ?       19.8        9.8       ?       ? 
1 1 1   53   12   24 o     66.8   11.0    0.0000   0.0000          ?        ?    45.3350  14.6860          ?        ?       66.8       11.0       ?       ? 
1 1 1   53   12   25 o     74.1    9.9    0.0000   0.0000          ?        ?    55.5514  14.6860          ?        ?       74.1        9.9       ?       ? 
1 1 1   53   12   26 o    262.0    3.4    0.0000   0.0000          ?        ?   687.6877  17.8786          ?        ?      262.0        3.4       ?       ? 
1 1 1   53   12   27 o    126.0    6.6    0.0000   0.0000          ?        ?   159.6304  16.6016          ?        ?      126.0        6.6       ?       ? 
1 1 1   53   12   28 o    372.1    2.8    0.0000   0.0000          ?        ?  1386.2305  21.0712          ?        ?      372.1        2.8       ?       ? 
1 1 1   53   12   29 o    127.3    6.0    0.0000   0.0000          ?        ?   162.8230  15.3245          ?        ?      127.3        6.0       ?       ? 
1 1 1   53   12   30 o    267.1    3.2    0.0000   0.0000          ?        ?   714.5057  17.2401          ?        ?      267.1        3.2       ?       ? 
1 1 1   53   12   31 o    164.0    4.7    0.0000   0.0000          ?        ?   270.0946  15.3245          ?        ?      164.0        4.7       ?       ? 
1 1 1   53   12   32 o     46.1   14.7    0.0000   0.0000          ?        ?    21.7097  15.3245          ?        ?       46.1       14.7       ?       ? 
1 1 1   53   12   33 o    162.5    4.7    0.0000   0.0000          ?        ?   264.9865  15.3245          ?        ?      162.5        4.7       ?       ? 
1 1 1   53   12   34 o    177.4    4.5    0.0000   0.0000          ?        ?   316.0682  15.9630          ?        ?      177.4        4.5       ?       ? 
1 1 1   53   12   35 o     65.1   13.2    0.0000   0.0000          ?        ?    45.3350  16.6016          ?        ?       65.1       13.2       ?       ? 
1 1 1   53   12   36 o    228.2    3.8    0.0000   0.0000          ?        ?   522.3107  17.2401          ?        ?      228.2        3.8       ?       ? 
1 1 1   53   13    0 o    125.5    6.1  158.9919  15.3245   158.9919  15.3245   158.9919  15.3245      125.5      6.1      125.5        6.1     0.0     0.0 
1 1 1   53   13    1 o    195.3    3.3    0.0000   0.0000          ?        ?   381.8359  12.7704          ?        ?      195.3        3.3       ?       ? 
1 1 1   53   13    2 o    159.9    3.8    0.0000   0.0000          ?        ?   256.0471  12.1319          ?        ?      159.9        3.8       ?       ? 
1 1 1   53   13    3 o     42.3   12.2    0.0000   0.0000          ?        ?    18.5171  10.8549          ?        ?       42.3       12.2       ?       ? 
1 1 1   53   13    4 o    248.8    3.7    0.0000   0.0000          ?        ?   620.0045  18.5171          ?        ?      248.8        3.7       ?       ? 
1 1 1   53   13    5 o    372.8    3.3    0.0000   0.0000          ?        ?  1391.3386  24.9023          ?        ?      372.8        3.3       ?       ? 
1 1 1   53   13    6 o    351.3    2.9    0.0000   0.0000          ?        ?  1234.9008  20.4327          ?        ?      351.3        2.9       ?       ? 
1 1 1   53   13    7 o    122.9    4.7    0.0000   0.0000          ?        ?   151.3296  11.4934          ?        ?      122.9        4.7       ?       ? 
1 1 1   53   13    8 o     66.6    8.6    0.0000   0.0000          ?        ?    44.6965  11.4934          ?        ?       66.6        8.6       ?       ? 
1 1 1   53   13    9 o    262.7    3.3    0.0000   0.0000          ?        ?   690.8804  17.2401          ?        ?      262.7        3.3       ?       ? 
1 1 1   53   13   10 o    239.2    3.5    0.0000   0.0000          ?        ?   572.7539  16.6016          ?        ?      239.2        3.5       ?       ? 
1 1 1   53   13   11 o    214.3    3.6    0.0000   0.0000          ?        ?   459.7356  15.3245          ?        ?      214.3        3.6       ?       ? 
1 1 1   53   13   12 o    218.1    3.8    0.0000   0.0000          ?        ?   476.3371  16.6016          ?        ?      218.1        3.8       ?       ? 
1 1 1   53   13   13 o    139.6    5.0    0.0000   0.0000          ?        ?   195.3876  14.0475          ?        ?      139.6        5.0       ?       ? 
1 1 1   53   13   14 o    310.5    3.3    0.0000   0.0000          ?        ?   965.4447  20.4327          ?        ?      310.5        3.3       ?       ? 
1 1 1   53   13   15 o    237.9    3.9    0.0000   0.0000          ?        ?   567.0072  18.5171          ?        ?      237.9        3.9       ?       ? 
1 1 1   53   13   16 o    143.2    5.4    0.0000   0.0000          ?        ?   205.6040  15.3245          ?        ?      143.2        5.4       ?       ? 
1 1 1   53   13   17 o    116.4    6.3    0.0000   0.0000          ?        ?   136.0051  14.6860          ?        ?      116.4        6.3       ?       ? 
1 1 1   53   13   18 o    193.7    4.1    0.0000   0.0000          ?        ?   376.0892  15.9630          ?        ?      193.7        4.1       ?       ? 
1 1 1   53   13   19 o    270.8    3.4    0.0000   0.0000          ?        ?   734.2999  18.5171          ?        ?      270.8        3.4       ?       ? 
1 1 1   53   13   20 o    200.1    4.0    0.0000   0.0000          ?        ?   400.9916  15.9630          ?        ?      200.1        4.0       ?       ? 
1 1 1   53   13   21 o    132.3    5.6    0.0000   0.0000          ?        ?   175.5934  14.6860          ?        ?      132.3        5.6       ?       ? 
1 1 1   53   13   22 o    135.1    5.4    0.0000   0.0000          ?        ?   183.2557  14.6860          ?        ?      135.1        5.4       ?       ? 
1 1 1   53   13   23 o    194.4    3.9    0.0000   0.0000          ?        ?   378.6433  15.3245          ?        ?      194.4        3.9       ?       ? 
1 1 1   53   13   24 o    130.0    5.6    0.0000   0.0000          ?        ?   169.8468  14.6860          ?        ?      130.0        5.6       ?       ? 
1 1 1   53   13   25 o    197.9    4.0    0.0000   0.0000          ?        ?   392.6908  15.9630          ?        ?      197.9        4.0       ?       ? 
1 1 1   53   13   26 o     48.7   14.2    0.0000   0.0000          ?        ?    24.9023  14.6860          ?        ?       48.7       14.2       ?       ? 
1 1 1   53   13   27 o     97.4    8.2    0.0000   0.0000          ?        ?    95.7782  15.9630          ?        ?       97.4        8.2       ?       ? 
1 1 1   53   13   28 o    245.4    3.4    0.0000   0.0000          ?        ?   603.4030  16.6016          ?        ?      245.4        3.4       ?       ? 
1 1 1   53   13   29 o     75.6    9.7    0.0000   0.0000          ?        ?    58.1055  14.6860          ?        ?       75.6        9.7       ?       ? 
1 1 1   53   13   30 o     19.6    9.7    0.0000   0.0000          ?        ?   -35.1187  14.6860          ?        ?       19.6        9.7       ?       ? 
1 1 1   53   13   31 f     27.6   12.7    0.0000   0.0000          ?        ?   -10.8549  15.9630          ?        ?       27.6       12.7       ?       ? 
1 1 1   53   13   32 o    119.4    6.4    0.0000   0.0000          ?        ?   143.6674  15.3245          ?        ?      119.4        6.4       ?       ? 
1 1 1   53   13   33 o     74.6   10.3    0.0000   0.0000          ?        ?    56.8284  15.3245          ?        ?       74.6       10.3       ?       ? 
1 1 1   53   13   34 f    311.3    3.0    0.0000   0.0000          ?        ?   971.1914  18.5171          ?        ?      311.3        3.0       ?       ? 
1 1 1   53   14    0 o     18.1   13.2  -40.8654  23.6253   -40.8654  23.6253   -40.8654  23.6253       18.1     13.2       18.1       13.2     0.0     0.0 
1 1 1   53   14    1 o     26.1   12.5    0.0000   0.0000          ?        ?   -28.0950  19.1556          ?        ?       26.1       12.5       ?       ? 
1 1 1   53   14    2 o     65.0   14.2    0.0000   0.0000          ?        ?    44.6965  17.8786          ?        ?       65.0       14.2       ?       ? 
1 1 1   53   14    3 o    170.3    4.3    0.0000   0.0000          ?        ?   290.5273  14.6860          ?        ?      170.3        4.3       ?       ? 
1 1 1   53   14    4 o    205.3    3.6    0.0000   0.0000          ?        ?   422.0628  14.6860          ?        ?      205.3        3.6       ?       ? 
1 1 1   53   14    5 o    107.0    6.0    0.0000   0.0000          ?        ?   114.9339  12.7704          ?        ?      107.0        6.0       ?       ? 
1 1 1   53   14    6 f    137.5    5.1    0.0000   0.0000          ?        ?   189.6409  14.0475          ?        ?      137.5        5.1       ?       ? 
1 1 1   53   14    7 o     33.5   13.5    0.0000   0.0000          ?        ?     5.1082  14.0475          ?        ?       33.5       13.5       ?       ? 
1 1 1   53   14    8 o    194.9    4.3    0.0000   0.0000          ?        ?   380.5589  16.6016          ?        ?      194.9        4.3       ?       ? 
1 1 1   53   14    9 o     18.6    9.3    0.0000   0.0000          ?        ?   -37.0343  14.0475          ?        ?       18.6        9.3       ?       ? 
1 1 1   53   14   10 o    273.9    3.3    0.0000   0.0000          ?        ?   750.9014  17.8786          ?        ?      273.9        3.3       ?       ? 
1 1 1   53   14   11 f    181.0    3.9    0.0000   0.0000          ?        ?   328.2001  14.0475          ?        ?      181.0        3.9       ?       ? 
1 1 1   53   14   12 o    201.9    3.5    0.0000   0.0000          ?        ?   408.0153  14.0475          ?        ?      201.9        3.5       ?       ? 
1 1 1   53   14   13 o     81.6    7.4    0.0000   0.0000          ?        ?    67.0448  12.1319          ?        ?       81.6        7.4       ?       ? 
1 1 1   53   14   14 o    359.5    3.0    0.0000   0.0000          ?        ?  1293.6449  21.7097          ?        ?      359.5        3.0       ?       ? 
1 1 1   53   14   15 o    190.3    4.0    0.0000   0.0000          ?        ?   362.6803  15.3245          ?        ?      190.3        4.0       ?       ? 
1 1 1   53   14   16 o    121.5    5.8    0.0000   0.0000          ?        ?   148.1370  14.0475          ?        ?      121.5        5.8       ?       ? 
1 1 1   53   14   17 o    284.4    3.3    0.0000   0.0000          ?        ?   809.6454  18.5171          ?        ?      284.4        3.3       ?       ? 
1 1 1   53   14   18 o    345.7    3.2    0.0000   0.0000          ?        ?  1196.5895  22.3483          ?        ?      345.7        3.2       ?       ? 
1 1 1   53   14   19 o    122.2    6.3    0.0000   0.0000          ?        ?   150.0526  15.3245          ?        ?      122.2        6.3       ?       ? 
1 1 1   53   14   20 o    223.4    3.6    0.0000   0.0000          ?        ?   499.9625  15.9630          ?        ?      223.4        3.6       ?       ? 
1 1 1   53   14   21 o    136.3    4.9    0.0000   0.0000          ?        ?   186.4483  13.4090          ?        ?      136.3        4.9       ?       ? 
1 1 1   53   14   22 o    160.0    4.6    0.0000   0.0000          ?        ?   256.6857  14.6860          ?        ?      160.0        4.6       ?       ? 
1 1 1   53   14   23 o     23.9   11.3    0.0000   0.0000          ?        ?   -17.8786  14.6860          ?        ?       23.9       11.3       ?       ? 
1 1 1   53   14   24 o    289.2    3.2    0.0000   0.0000          ?        ?   837.7404  18.5171          ?        ?      289.2        3.2       ?       ? 
1 1 1   53   14   25 o    138.9    6.0    0.0000   0.0000          ?        ?   194.1106  16.6016          ?        ?      138.9        6.0       ?       ? 
1 1 1   53   14   26 o    200.6    3.8    0.0000   0.0000          ?        ?   403.5457  15.3245          ?        ?      200.6        3.8       ?       ? 
1 1 1   53   14   27 o     39.8   14.6    0.0000   0.0000          ?        ?    13.4090  15.3245          ?        ?       39.8       14.6       ?       ? 
1 1 1   53   14   28 o    136.6    5.6    0.0000   0.0000          ?        ?   187.7254  15.3245          ?        ?      136.6        5.6       ?       ? 
1 1 1   53   14   29 o    219.9    3.6    0.0000   0.0000          ?        ?   484.6379  15.9630          ?        ?      219.9        3.6       ?       ? 
1 1 1   53   14   30 o    105.2    7.0    0.0000   0.0000          ?        ?   111.7413  14.6860          ?        ?      105.2        7.0       ?       ? 
1 1 1   53   14   31 o     43.2   14.4    0.0000   0.0000          ?        ?    18.5171  14.6860          ?        ?       43.2       14.4       ?       ? 
1 1 1   53   14   32 o    107.8    7.1    0.0000   0.0000          ?        ?   117.4880  15.3245          ?        ?      107.8        7.1       ?       ? 
1 1 1   53   15    0 f    265.7    7.0  709.3975  37.0343   709.3975  37.0343   709.3975  37.0343      265.7      7.0      265.7        7.0     0.0     0.0 
1 1 1   53   15    1 o    307.1    4.4    0.0000   0.0000          ?        ?   945.0120  26.8179          ?        ?      307.1        4.4       ?       ? 
1 1 1   53   15    2 o    257.0    4.7    0.0000   0.0000          ?        ?   662.1469  24.2638          ?        ?      257.0        4.7       ?       ? 
1 1 1   53   15    3 o    164.2    6.4    0.0000   0.0000          ?        ?   270.7332  21.0712          ?        ?      164.2        6.4       ?       ? 
1 1 1   53   15    4 o     96.7    9.9    0.0000   0.0000          ?        ?    94.5012  19.1556          ?        ?       96.7        9.9       ?       ? 
1 1 1   53   15    5 o    351.9    4.2    0.0000   0.0000          ?        ?  1240.6476  29.3720          ?        ?      351.9        4.2       ?       ? 
1 1 1   53   15    6 o    128.6    5.5    0.0000   0.0000          ?        ?   166.0156  14.0475          ?        ?      128.6        5.5       ?       ? 
1 1 1   53   15    7 o     98.3    6.5    0.0000   0.0000          ?        ?    97.0553  12.7704          ?        ?       98.3        6.5       ?       ? 
1 1 1   53   15    8 o    268.2    3.3    0.0000   0.0000          ?        ?   720.2524  17.8786          ?        ?      268.2        3.3       ?       ? 
1 1 1   53   15    9 o    325.7    3.5    0.0000   0.0000          ?        ?  1062.5000  22.9868          ?        ?      325.7        3.5       ?       ? 
1 1 1   53   15   10 o    152.0    5.0    0.0000   0.0000          ?        ?   231.7833  15.3245          ?        ?      152.0        5.0       ?       ? 
1 1 1   53   15   11 o    137.9    5.6    0.0000   0.0000          ?        ?   190.9180  15.3245          ?        ?      137.9        5.6       ?       ? 
1 1 1   53   15   12 o    332.8    3.1    0.0000   0.0000          ?        ?  1108.4736  20.4327          ?        ?      332.8        3.1       ?       ? 
1 1 1   53   15   13 f     66.0    9.7    0.0000   0.0000          ?        ?    44.0580  12.7704          ?        ?       66.0        9.7       ?       ? 
1 1 1   53   15   14 o     44.1   13.7    0.0000   0.0000          ?        ?    19.7942  13.4090          ?        ?       44.1       13.7       ?       ? 
1 1 1   53   15   15 o     91.5    7.0    0.0000   0.0000          ?        ?    84.2849  12.7704          ?        ?       91.5        7.0       ?       ? 
1 1 1   53   15   16 o    252.1    3.2    0.0000   0.0000          ?        ?   636.6060  15.9630          ?        ?      252.1        3.2       ?       ? 
1 1 1   53   15   17 o    218.3    3.8    0.0000   0.0000          ?        ?   477.6142  16.6016          ?        ?      218.3        3.8       ?       ? 
1 1 1   53   15   18 o    152.6    4.8    0.0000   0.0000          ?        ?   233.6989  14.6860          ?        ?      152.6        4.8       ?       ? 
1 1 1   53   15   19 o     36.8   13.7    0.0000   0.0000          ?        ?    10.8549  13.4090          ?        ?       36.8       13.7       ?       ? 
1 1 1   53   15   20 o    195.1    3.6    0.0000   0.0000          ?        ?   381.1974  14.0475          ?        ?      195.1        3.6       ?       ? 
1 1 1   53   15   21 o    127.3    5.8    0.0000   0.0000          ?        ?   162.8230  14.6860          ?        ?      127.3        5.8       ?       ? 
1 1 1   53   15   22 o     33.3   13.5    0.0000   0.0000          ?        ?     5.1082  14.0475          ?        ?       33.3       13.5       ?       ? 
1 1 1   53   15   23 o    172.4    4.4    0.0000   0.0000          ?        ?   298.1896  15.3245          ?        ?      172.4        4.4       ?       ? 
1 1 1   53   15   24 o    168.7    4.5    0.0000   0.0000          ?        ?   285.4192  15.3245          ?        ?      168.7        4.5       ?       ? 
1 1 1   53   15   25 o    105.9    6.9    0.0000   0.0000          ?        ?   113.0183  14.6860          ?        ?      105.9        6.9       ?       ? 
1 1 1   53   15   26 o    154.5    4.5    0.0000   0.0000          ?        ?   239.4456  14.0475          ?        ?      154.5        4.5       ?       ? 
1 1 1   53   15   27 o    140.1    5.0    0.0000   0.0000          ?        ?   197.3032  14.0475          ?        ?      140.1        5.0       ?       ? 
1 1 1   53   15   28 o    149.3    5.1    0.0000   0.0000          ?        ?   224.1211  15.3245          ?        ?      149.3        5.1       ?       ? 
1 1 1   53   15   29 o     20.0    9.9    0.0000   0.0000          ?        ?   -33.2031  14.6860          ?        ?       20.0        9.9       ?       ? 
1 1 1   53   15   30 o     21.8   10.6    0.0000   0.0000          ?        ?   -24.9023  14.6860          ?        ?       21.8       10.6       ?       ? 
1 1 1   53   16    0 o     17.7   13.0  -49.8047  24.9023   -49.8047  24.9023   -49.8047  24.9023       17.7     13.0       17.7       13.0     0.0     0.0 
1 1 1   53   16    1 o    109.3    9.3    0.0000   0.0000          ?        ?   120.6806  20.4327          ?        ?      109.3        9.3       ?       ? 
1 1 1   53   16    2 o    290.6    4.7    0.0000   0.0000          ?        ?   846.6797  27.4564          ?        ?      290.6        4.7       ?       ? 
1 1 1   53   16    3 o    127.2    7.3    0.0000   0.0000          ?        ?   162.8230  18.5171          ?        ?      127.2        7.3       ?       ? 
1 1 1   53   16    4 o    276.4    4.0    0.0000   0.0000          ?        ?   765.5875  22.3483          ?        ?      276.4        4.0       ?       ? 
1 1 1   53   16    5 o    107.3    9.2    0.0000   0.0000          ?        ?   116.2109  19.7942          ?        ?      107.3        9.2       ?       ? 
1 1 1   53   16    6 o    216.1    4.6    0.0000   0.0000          ?        ?   468.0364  19.7942          ?        ?      216.1        4.6       ?       ? 
1 1 1   53   16    7 o     58.5   15.9    0.0000   0.0000          ?        ?    36.3957  19.1556          ?        ?       58.5       15.9       ?       ? 
1 1 1   53   16    8 o    149.5    5.1    0.0000   0.0000          ?        ?   224.1211  15.3245          ?        ?      149.5        5.1       ?       ? 
1 1 1   53   16    9 o    283.1    3.5    0.0000   0.0000          ?        ?   802.6216  19.7942          ?        ?      283.1        3.5       ?       ? 
1 1 1   53   16   10 f    325.5    3.4    0.0000   0.0000          ?        ?  1061.2229  22.3483          ?        ?      325.5        3.4       ?       ? 
1 1 1   53   16   11 o    148.2    5.2    0.0000   0.0000          ?        ?   220.2900  15.3245          ?        ?      148.2        5.2       ?       ? 
1 1 1   53   16   12 o    186.8    4.6    0.0000   0.0000          ?        ?   349.9099  17.2401          ?        ?      186.8        4.6       ?       ? 
1 1 1   53   16   13 o    224.1    4.7    0.0000   0.0000          ?        ?   503.7936  21.0712          ?        ?      224.1        4.7       ?       ? 
1 1 1   53   16   14 o    164.4    5.4    0.0000   0.0000          ?        ?   271.3717  17.8786          ?        ?      164.4        5.4       ?       ? 
1 1 1   53   16   15 o    112.8    5.4    0.0000   0.0000          ?        ?   127.7043  12.1319          ?        ?      112.8        5.4       ?       ? 
1 1 1   53   16   16 o     29.4   12.5    0.0000   0.0000          ?        ?     0.6385  12.7704          ?        ?       29.4       12.5       ?       ? 
1 1 1   53   16   17 o    117.4    6.3    0.0000   0.0000          ?        ?   138.5592  14.6860          ?        ?      117.4        6.3       ?       ? 
1 1 1   53   16   18 o    146.0    5.0    0.0000   0.0000          ?        ?   213.9047  14.6860          ?        ?      146.0        5.0       ?       ? 
1 1 1   53   16   19 o    138.1    5.1    0.0000   0.0000          ?        ?   191.5565  14.0475          ?        ?      138.1        5.1       ?       ? 
1 1 1   53   16   20 o    198.9    3.7    0.0000   0.0000          ?        ?   396.5219  14.6860          ?        ?      198.9        3.7       ?       ? 
1 1 1   53   16   21 o    238.2    3.4    0.0000   0.0000          ?        ?   568.2842  15.9630          ?        ?      238.2        3.4       ?       ? 
1 1 1   53   16   22 o    174.3    4.0    0.0000   0.0000          ?        ?   304.5748  14.0475          ?        ?      174.3        4.0       ?       ? 
1 1 1   53   16   23 o    164.5    4.3    0.0000   0.0000          ?        ?   271.3717  14.0475          ?        ?      164.5        4.3       ?       ? 
1 1 1   53   16   24 o    232.7    3.4    0.0000   0.0000          ?        ?   542.7434  15.9630          ?        ?      232.7        3.4       ?       ? 
1 1 1   53   16   25 o    145.9    5.3    0.0000   0.0000          ?        ?   213.9047  15.3245          ?        ?      145.9        5.3       ?       ? 
1 1 1   53   16   26 o    208.5    4.0    0.0000   0.0000          ?        ?   436.1103  16.6016          ?        ?      208.5        4.0       ?       ? 
1 1 1   53   16   27 o    242.9    3.3    0.0000   0.0000          ?        ?   591.2710  15.9630          ?        ?      242.9        3.3       ?       ? 
1 1 1   53   16   28 o    166.8    4.8    0.0000   0.0000          ?        ?   279.6725  15.9630          ?        ?      166.8        4.8       ?       ? 
1 1 1   53   17    0 o    245.3    7.2  605.3185  35.1187   605.3185  35.1187   605.3185  35.1187      245.3      7.2      245.3        7.2     0.0     0.0 
1 1 1   53   17    1 o     79.2   11.7    0.0000   0.0000          ?        ?    63.8522  18.5171          ?        ?       79.2       11.7       ?       ? 
1 1 1   53   17    2 o    100.9    8.9    0.0000   0.0000          ?        ?   102.8020  17.8786          ?        ?      100.9        8.9       ?       ? 
1 1 1   53   17    3 o    139.6    7.1    0.0000   0.0000          ?        ?   196.0261  19.7942          ?        ?      139.6        7.1       ?       ? 
1 1 1   53   17    4 o     28.3   13.2    0.0000   0.0000          ?        ?   -17.2401  18.5171          ?        ?       28.3       13.2       ?       ? 
1 1 1   53   17    5 o    174.8    6.0    0.0000   0.0000          ?        ?   307.1289  21.0712          ?        ?      174.8        6.0       ?       ? 
1 1 1   53   17    6 o     88.0   10.5    0.0000   0.0000          ?        ?    78.5382  18.5171          ?        ?       88.0       10.5       ?       ? 
1 1 1   53   17    7 o     99.8    9.6    0.0000   0.0000          ?        ?   100.8864  19.1556          ?        ?       99.8        9.6       ?       ? 
1 1 1   53   17    8 f     80.9   13.4    0.0000   0.0000          ?        ?    67.0448  21.7097          ?        ?       80.9       13.4       ?       ? 
1 1 1   53   17    9 o    125.0    8.4    0.0000   0.0000          ?        ?   157.7148  21.0712          ?        ?      125.0        8.4       ?       ? 
1 1 1   53   17   10 o     17.8    8.9    0.0000   0.0000          ?        ?   -29.3720  12.1319          ?        ?       17.8        8.9       ?       ? 
1 1 1   53   17   11 o     55.8   13.3    0.0000   0.0000          ?        ?    33.2031  14.6860          ?        ?       55.8       13.3       ?       ? 
1 1 1   53   17   12 o    206.0    4.2    0.0000   0.0000          ?        ?   425.2554  17.2401          ?        ?      206.0        4.2       ?       ? 
1 1 1   53   17   13 o    342.2    3.6    0.0000   0.0000          ?        ?  1172.9642  24.9023          ?        ?      342.2        3.6       ?       ? 
1 1 1   53   17   14 o    143.9    5.5    0.0000   0.0000          ?        ?   208.1580  15.9630          ?        ?      143.9        5.5       ?       ? 
1 1 1   53   17   15 o    184.2    4.7    0.0000   0.0000          ?        ?   340.3320  17.2401          ?        ?      184.2        4.7       ?       ? 
1 1 1   53   17   16 o    133.7    6.7    0.0000   0.0000          ?        ?   180.0631  17.8786          ?        ?      133.7        6.7       ?       ? 
1 1 1   53   17   17 o     95.5    6.7    0.0000   0.0000          ?        ?    91.9471  12.7704          ?        ?       95.5        6.7       ?       ? 
1 1 1   53   17   18 o    214.9    4.0    0.0000   0.0000          ?        ?   462.9282  17.2401          ?        ?      214.9        4.0       ?       ? 
1 1 1   53   17   19 o     96.1    7.6    0.0000   0.0000          ?        ?    93.2242  14.6860          ?        ?       96.1        7.6       ?       ? 
1 1 1   53   17   20 o    135.0    5.9    0.0000   0.0000          ?        ?   183.2557  15.9630          ?        ?      135.0        5.9       ?       ? 
1 1 1   53   17   21 o    106.5    6.6    0.0000   0.0000          ?        ?   114.2954  14.0475          ?        ?      106.5        6.6       ?       ? 
1 1 1   53   17   22 o    231.6    3.3    0.0000   0.0000          ?        ?   537.6352  15.3245          ?        ?      231.6        3.3       ?       ? 
1 1 1   53   17   23 o     59.5   12.2    0.0000   0.0000          ?        ?    37.6728  14.0475          ?        ?       59.5       12.2       ?       ? 
1 1 1   53   17   24 o     52.3   13.4    0.0000   0.0000          ?        ?    29.3720  14.0475          ?        ?       52.3       13.4       ?       ? 
1 1 1   53   17   25 f     99.0    6.8    0.0000   0.0000          ?        ?    98.9709  13.4090          ?        ?       99.0        6.8       ?       ? 
1 1 1   53   18    0 o    300.6    7.1  908.6163  42.7809   908.6163  42.7809   908.6163  42.7809      300.6      7.1      300.6        7.1     0.0     0.0 
1 1 1   53   18    1 o     99.4   10.0    0.0000   0.0000          ?        ?   100.2479  19.7942          ?        ?       99.4       10.0       ?       ? 
1 1 1   53   18    2 o    118.6    7.3    0.0000   0.0000          ?        ?   141.7518  17.2401          ?        ?      118.6        7.3       ?       ? 
1 1 1   53   18    3 o     66.8   15.2    0.0000   0.0000          ?        ?    47.8891  19.7942          ?        ?       66.8       15.2       ?       ? 
1 1 1   53   18    4 o    257.4    4.8    0.0000   0.0000          ?        ?   664.7010  24.9023          ?        ?      257.4        4.8       ?       ? 
1 1 1   53   18    5 o    167.4    6.1    0.0000   0.0000          ?        ?   281.5880  20.4327          ?        ?      167.4        6.1       ?       ? 
1 1 1   53   18    6 o    105.6    9.7    0.0000   0.0000          ?        ?   113.0183  20.4327          ?        ?      105.6        9.7       ?       ? 
1 1 1   53   18    7 o    113.0   10.2    0.0000   0.0000          ?        ?   129.6199  22.9868          ?        ?      113.0       10.2       ?       ? 
1 1 1   53   18    8 o    268.0    4.8    0.0000   0.0000          ?        ?   720.8909  25.5409          ?        ?      268.0        4.8       ?       ? 
1 1 1   53   18    9 o    287.7    4.7    0.0000   0.0000          ?        ?   830.7167  26.8179          ?        ?      287.7        4.7       ?       ? 
1 1 1   53   18   10 f    161.5    6.1    0.0000   0.0000          ?        ?   262.4324  19.7942          ?        ?      161.5        6.1       ?       ? 
1 1 1   53   18   11 o    146.8    5.0    0.0000   0.0000          ?        ?   216.4588  14.6860          ?        ?      146.8        5.0       ?       ? 
1 1 1   53   18   12 o     26.8   12.0    0.0000   0.0000          ?        ?    -5.7467  13.4090          ?        ?       26.8       12.0       ?       ? 
1 1 1   53   18   13 o    101.0    7.3    0.0000   0.0000          ?        ?   102.8020  14.6860          ?        ?      101.0        7.3       ?       ? 
1 1 1   53   18   14 o    109.7    6.7    0.0000   0.0000          ?        ?   121.3191  14.6860          ?        ?      109.7        6.7       ?       ? 
1 1 1   53   18   15 o     90.9    8.4    0.0000   0.0000          ?        ?    83.6463  15.3245          ?        ?       90.9        8.4       ?       ? 
1 1 1   53   18   16 o     21.6   10.7    0.0000   0.0000          ?        ?   -38.9498  17.2401          ?        ?       21.6       10.7       ?       ? 
1 1 1   53   18   17 o     20.1   10.1    0.0000   0.0000          ?        ?   -61.2981  19.1556          ?        ?       20.1       10.1       ?       ? 
1 1 1   53   18   18 o    133.0    4.1    0.0000   0.0000          ?        ?   177.5090  10.8549          ?        ?      133.0        4.1       ?       ? 
1 1 1   53   18   19 o    245.4    3.3    0.0000   0.0000          ?        ?   603.4030  15.9630          ?        ?      245.4        3.3       ?       ? 
1 1 1   53   18   20 o    219.2    3.5    0.0000   0.0000          ?        ?   481.4453  15.3245          ?        ?      219.2        3.5       ?       ? 
1 1 1   53   18   21 o    258.8    3.3    0.0000   0.0000          ?        ?   671.0862  17.2401          ?        ?      258.8        3.3       ?       ? 
1 1 1   53   18   22 o    143.7    5.1    0.0000   0.0000          ?        ?   207.5195  14.6860          ?        ?      143.7        5.1       ?       ? 
1 1 1   53   19    0 o     46.9   23.1   33.8416  25.5409    33.8416  25.5409    33.8416  25.5409       46.9     23.1       46.9       23.1     0.0     0.0 
1 1 1   53   19    1 f    171.2    6.3    0.0000   0.0000          ?        ?   294.9970  21.7097          ?        ?      171.2        6.3       ?       ? 
1 1 1   53   19    2 o     27.9   12.9    0.0000   0.0000          ?        ?   -14.0475  17.2401          ?        ?       27.9       12.9       ?       ? 
1 1 1   53   19    3 o    157.3    6.3    0.0000   0.0000          ?        ?   249.0234  19.7942          ?        ?      157.3        6.3       ?       ? 
1 1 1   53   19    4 o     82.9   11.9    0.0000   0.0000          ?        ?    70.2374  19.7942          ?        ?       82.9       11.9       ?       ? 
1 1 1   53   19    5 o    195.4    5.6    0.0000   0.0000          ?        ?   383.7515  21.7097          ?        ?      195.4        5.6       ?       ? 
1 1 1   53   19    6 f    127.0    7.3    0.0000   0.0000          ?        ?   162.8230  18.5171          ?        ?      127.0        7.3       ?       ? 
1 1 1   53   19    7 o     81.3   11.8    0.0000   0.0000          ?        ?    67.6833  19.1556          ?        ?       81.3       11.8       ?       ? 
1 1 1   53   19    8 o     92.6   10.7    0.0000   0.0000          ?        ?    87.4775  19.7942          ?        ?       92.6       10.7       ?       ? 
1 1 1   53   19    9 o    109.3    9.6    0.0000   0.0000          ?        ?   121.3191  21.0712          ?        ?      109.3        9.6       ?       ? 
1 1 1   53   19   10 o     93.3   10.6    0.0000   0.0000          ?        ?    88.7545  19.7942          ?        ?       93.3       10.6       ?       ? 
1 1 1   53   19   11 o    322.7    4.2    0.0000   0.0000          ?        ?  1044.6215  26.8179          ?        ?      322.7        4.2       ?       ? 
1 1 1   53   19   12 o     64.9   14.6    0.0000   0.0000          ?        ?    45.3350  18.5171          ?        ?       64.9       14.6       ?       ? 
1 1 1   53   19   13 o    102.3    5.9    0.0000   0.0000          ?        ?   105.3561  12.1319          ?        ?      102.3        5.9       ?       ? 
1 1 1   53   19   14 o    332.1    3.5    0.0000   0.0000          ?        ?  1105.2810  22.9868          ?        ?      332.1        3.5       ?       ? 
1 1 1   53   19   15 o    142.0    5.8    0.0000   0.0000          ?        ?   203.0499  16.6016          ?        ?      142.0        5.8       ?       ? 
1 1 1   53   19   16 o    223.2    4.4    0.0000   0.0000          ?        ?   499.9625  19.7942          ?        ?      223.2        4.4       ?       ? 
1 1 1   53   19   17 o    234.5    4.2    0.0000   0.0000          ?        ?   551.6827  19.7942          ?        ?      234.5        4.2       ?       ? 
1 1 1   53   19   18 o     33.4   14.3    0.0000   0.0000          ?        ?     0.0000  17.2401          ?        ?       33.4       14.3       ?       ? 
1 1 1   53   19   19 o    203.6    4.4    0.0000   0.0000          ?        ?   416.3161  17.8786          ?        ?      203.6        4.4       ?       ? 
1 1 1   53   20    0 o    374.1    6.7 1406.6632  50.4432  1406.6632  50.4432  1406.6632  50.4432      374.1      6.7      374.1        6.7     0.0     0.0 
1 1 1   53   20    1 o    119.9    8.3    0.0000   0.0000          ?        ?   145.5829  19.7942          ?        ?      119.9        8.3       ?       ? 
1 1 1   53   20    2 o    231.5    4.8    0.0000   0.0000          ?        ?   538.2737  22.3483          ?        ?      231.5        4.8       ?       ? 
1 1 1   53   20    3 o    151.5    6.3    0.0000   0.0000          ?        ?   231.1448  19.1556          ?        ?      151.5        6.3       ?       ? 
1 1 1   53   20    4 o     33.9   14.8    0.0000   0.0000          ?        ?    -3.1926  19.1556          ?        ?       33.9       14.8       ?       ? 
1 1 1   53   20    5 o    138.7    8.3    0.0000   0.0000          ?        ?   194.7491  22.9868          ?        ?      138.7        8.3       ?       ? 
1 1 1   53   20    6 o    222.0    5.5    0.0000   0.0000          ?        ?   495.4928  24.2638          ?        ?      222.0        5.5       ?       ? 
1 1 1   53   20    7 o     36.1   14.8    0.0000   0.0000          ?        ?     5.1082  17.2401          ?        ?       36.1       14.8       ?       ? 
1 1 1   53   20    8 o    158.2    6.3    0.0000   0.0000          ?        ?   252.2160  19.7942          ?        ?      158.2        6.3       ?       ? 
1 1 1   53   20    9 o     63.3   15.3    0.0000   0.0000          ?        ?    43.4195  19.1556          ?        ?       63.3       15.3       ?       ? 
1 1 1   53   20   10 o     34.6   14.7    0.0000   0.0000          ?        ?     1.2770  17.8786          ?        ?       34.6       14.7       ?       ? 
1 1 1   53   20   11 o    155.0    7.2    0.0000   0.0000          ?        ?   242.6382  22.3483          ?        ?      155.0        7.2       ?       ? 
1 1 1   53   20   12 o    112.4    9.1    0.0000   0.0000          ?        ?   128.3428  20.4327          ?        ?      112.4        9.1       ?       ? 
1 1 1   53   20   13 o     89.8   13.5    0.0000   0.0000          ?        ?    83.6463  24.2638          ?        ?       89.8       13.5       ?       ? 
1 1 1   53   20   14 o     57.9   12.0    0.0000   0.0000          ?        ?    35.7572  13.4090          ?        ?       57.9       12.0       ?       ? 
1 1 1   53   20   15 o     48.8   13.8    0.0000   0.0000          ?        ?    25.5409  14.0475          ?        ?       48.8       13.8       ?       ? 
1 1 1   53   21    0 o     82.5   20.6   81.7308  29.3720    81.7308  29.3720    81.7308  29.3720       82.5     20.6       82.5       20.6     0.0     0.0 
1 1 1   53   21    1 o    186.8    5.6    0.0000   0.0000          ?        ?   351.1869  21.0712          ?        ?      186.8        5.6       ?       ? 
1 1 1   53   21    2 o     25.0   11.9    0.0000   0.0000          ?        ?   -21.0712  16.6016          ?        ?       25.0       11.9       ?       ? 
1 1 1   53   21    3 o     26.9   12.4    0.0000   0.0000          ?        ?   -10.8549  15.3245          ?        ?       26.9       12.4       ?       ? 
1 1 1   53   21    4 o    115.9    7.7    0.0000   0.0000          ?        ?   136.0051  17.8786          ?        ?      115.9        7.7       ?       ? 
1 1 1   53   21    5 o    328.3    4.1    0.0000   0.0000          ?        ?  1081.6556  26.8179          ?        ?      328.3        4.1       ?       ? 
1 1 1   53   21    6 o    178.8    5.7    0.0000   0.0000          ?        ?   321.8149  20.4327          ?        ?      178.8        5.7       ?       ? 
1 1 1   53   21    7 o     79.8   10.4    0.0000   0.0000          ?        ?    65.1292  16.6016          ?        ?       79.8       10.4       ?       ? 
1 1 1   53   21    8 o    162.8    5.9    0.0000   0.0000          ?        ?   266.9020  19.1556          ?        ?      162.8        5.9       ?       ? 
1 1 1   53   21    9 o     53.3   15.3    0.0000   0.0000          ?        ?    30.6490  17.2401          ?        ?       53.3       15.3       ?       ? 
1 1 1   54    0    0 o    536.5    6.0 2880.3711  63.8522  2880.3711  63.8522  2880.3711  63.8522      536.5      6.0      536.5        6.0     0.0     0.0 
1 1 1   54    0    1 o     89.2    9.5   82.3693  16.6016    82.3693  16.6016    82.3693  16.6016       89.2      9.5       89.2        9.5     0.0     0.0 
1 1 1   54    0    2 o     15.4   11.3  -33.2031  17.8786   -33.2031  17.8786   -33.2031  17.8786       15.4     11.3       15.4       11.3     0.0     0.0 
1 1 1   54    0    3 o     62.9   15.9   46.6121  17.2401    46.6121  17.2401    46.6121  17.2401       62.9     15.9       62.9       15.9     0.0     0.0 
1 1 1   54    0    4 o    431.4    3.9 1862.5676  33.8416  1862.5676  33.8416  1862.5676  33.8416      431.4      3.9      431.4        3.9     0.0     0.0 
1 1 1   54    0    5 o    160.4    5.8  258.6013  18.5171   258.6013  18.5171   258.6013  18.5171      160.4      5.8      160.4        5.8     0.0     0.0 
1 1 1   54    0    6 o    191.0    5.2  365.8729  19.7942   365.8729  19.7942   365.8729  19.7942      191.0      5.2      191.0        5.2     0.0     0.0 
1 1 1   54    0    7 o     71.0   14.2   56.1899  17.8786    56.1899  17.8786    56.1899  17.8786       71.0     14.2       71.0       14.2     0.0     0.0 
1 1 1   54    0    8 o    123.8    7.3  155.1608  17.8786   155.1608  17.8786   155.1608  17.8786      123.8      7.3      123.8        7.3     0.0     0.0 
1 1 1   54    0    9 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   54    0   10 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   54    0   11 o     52.0   18.3   35.7572  17.2401    35.7572  17.2401    35.7572  17.2401       52.0     18.3       52.0       18.3     0.0     0.0 
1 1 1   54    0   12 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   54    0   13 o    113.7    8.2  131.5355  18.5171   131.5355  18.5171   131.5355  18.5171      113.7      8.2      113.7        8.2     0.0     0.0 
1 1 1   54    0   14 o    321.5    4.0 1034.4050  25.5409  1034.4050  25.5409  1034.4050  25.5409      321.5      4.0      321.5        4.0     0.0     0.0 
1 1 1   54    0   15 o    528.9    4.8 2799.9172  50.4432  2799.9172  50.4432  2799.9172  50.4432      528.9      4.8      528.9        4.8     0.0     0.0 
1 1 1   54    0   16 o    299.5    3.8  897.7615  22.9868   897.7615  22.9868   897.7615  22.9868      299.5      3.8      299.5        3.8     0.0     0.0 
1 1 1   54    0   17 o    324.7    3.6 1054.8376  23.6253  1054.8376  23.6253  1054.8376  23.6253      324.7      3.6      324.7        3.6     0.0     0.0 
1 1 1   54    0   18 o    155.2    7.0  242.6382  21.7097   242.6382  21.7097   242.6382  21.7097      155.2      7.0      155.2        7.0     0.0     0.0 
1 1 1   54    0   19 f    287.3    3.8  826.2469  21.7097   826.2469  21.7097   826.2469  21.7097      287.3      3.8      287.3        3.8     0.0     0.0 
1 1 1   54    0   20 o    505.4    3.8 2556.0020  38.3113  2556.0020  38.3113  2556.0020  38.3113      505.4      3.8      505.4        3.8     0.0     0.0 
1 1 1   54    0   21 o    359.1    3.8 1290.4523  27.4564  1290.4523  27.4564  1290.4523  27.4564      359.1      3.8      359.1        3.8     0.0     0.0 
1 1 1   54    0   22 o    197.1    4.9  389.4982  19.1556   389.4982  19.1556   389.4982  19.1556      197.1      4.9      197.1        4.9     0.0     0.0 
1 1 1   54    0   23 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   54    0   24 o     15.5   11.5  -55.5514  22.3483   -55.5514  22.3483   -55.5514  22.3483       15.5     11.5       15.5       11.5     0.0     0.0 
1 1 1   54    0   25 o     13.5   10.1  -68.9603  21.0712   -68.9603  21.0712   -68.9603  21.0712       13.5     10.1       13.5       10.1     0.0     0.0 
1 1 1   54    0   26 o     74.9   14.2   61.9366  19.1556    61.9366  19.1556    61.9366  19.1556       74.9     14.2       74.9       14.2     0.0     0.0 
1 1 1   54    0   27 o     14.3   10.6  -56.1899  20.4327   -56.1899  20.4327   -56.1899  20.4327       14.3     10.6       14.3       10.6     0.0     0.0 
1 1 1   54    0   28 o    115.5    9.8  136.6436  22.3483   136.6436  22.3483   136.6436  22.3483      115.5      9.8      115.5        9.8     0.0     0.0 
1 1 1   54    0   29 o    987.9    5.1 9769.3809 101.5249  9769.3809 101.5249  9769.3809 101.5249      987.9      5.1      987.9        5.1     0.0     0.0 
1 1 1   54    0   30 o    506.8    4.1 2570.6880  41.5039  2570.6880  41.5039  2570.6880  41.5039      506.8      4.1      506.8        4.1     0.0     0.0 
1 1 1   54    0   31 o    258.3    4.7  668.5321  24.2638   668.5321  24.2638   668.5321  24.2638      258.3      4.7      258.3        4.7     0.0     0.0 
1 1 1   54    0   32 o    583.4    3.8 3405.8745  44.6965  3405.8745  44.6965  3405.8745  44.6965      583.4      3.8      583.4        3.8     0.0     0.0 
1 1 1   54    0   33 o    656.9    4.0 4318.3218  52.3588  4318.3218  52.3588  4318.3218  52.3588      656.9      4.0      656.9        4.0     0.0     0.0 
1 1 1   54    0   34 o    125.8    9.5  161.5460  23.6253   161.5460  23.6253   161.5460  23.6253      125.8      9.5      125.8        9.5     0.0     0.0 
1 1 1   54    0   35 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   54    0   36 o     15.7   11.6  -57.4669  22.9868   -57.4669  22.9868   -57.4669  22.9868       15.7     11.6       15.7       11.6     0.0     0.0 
1 1 1   54    0   37 o     87.0   13.6   80.4537  22.3483    80.4537  22.3483    80.4537  22.3483       87.0     13.6       87.0       13.6     0.0     0.0 
1 1 1   54    0   38 o    104.5   11.9  114.2954  24.2638   114.2954  24.2638   114.2954  24.2638      104.5     11.9      104.5       11.9     0.0     0.0 
1 1 1   54    0   39 o    158.1    8.1  252.8546  25.5409   252.8546  25.5409   252.8546  25.5409      158.1      8.1      158.1        8.1     0.0     0.0 
1 1 1   54    0   40 o    260.9    4.9  682.5797  25.5409   682.5797  25.5409   682.5797  25.5409      260.9      4.9      260.9        4.9     0.0     0.0 
1 1 1   54    0   41 o    130.3    9.9  173.6779  25.5409   173.6779  25.5409   173.6779  25.5409      130.3      9.9      130.3        9.9     0.0     0.0 
1 1 1   54    0   42 o     38.0   21.9   19.7942  26.1794    19.7942  26.1794    19.7942  26.1794       38.0     21.9       38.0       21.9     0.0     0.0 
1 1 1   54    0   43 o    142.3    8.4  205.6040  23.6253   205.6040  23.6253   205.6040  23.6253      142.3      8.4      142.3        8.4     0.0     0.0 
1 1 1   54    0   44 f     24.7   16.7   -8.9393  23.6253    -8.9393  23.6253    -8.9393  23.6253       24.7     16.7       24.7       16.7     0.0     0.0 
1 1 1   54    0   45 o    314.0    4.3  987.7929  26.8179   987.7929  26.8179   987.7929  26.8179      314.0      4.3      314.0        4.3     0.0     0.0 
1 1 1   54    0   46 o     26.1   17.3   -3.1926  22.9868    -3.1926  22.9868    -3.1926  22.9868       26.1     17.3       26.1       17.3     0.0     0.0 
1 1 1   54    0   47 o     87.9   14.4   83.6463  23.6253    83.6463  23.6253    83.6463  23.6253       87.9     14.4       87.9       14.4     0.0     0.0 
1 1 1   54    0   48 o     27.7   18.2   -0.6385  24.2638    -0.6385  24.2638    -0.6385  24.2638       27.7     18.2       27.7       18.2     0.0     0.0 
1 1 1   54    1    0 o    107.2    8.7  117.4880  18.5171   117.4880  18.5171   117.4880  18.5171      107.2      8.7      107.2        8.7     0.0     0.0 
1 1 1   54    1    1 o    254.5    3.1    0.0000   0.0000          ?        ?   648.0994  15.9630          ?        ?      254.5        3.1       ?       ? 
1 1 1   54    1    2 o    393.4    2.6    0.0000   0.0000          ?        ?  1548.4149  20.4327          ?        ?      393.4        2.6       ?       ? 
1 1 1   54    1    3 o    326.8    2.9    0.0000   0.0000          ?        ?  1068.2467  19.1556          ?        ?      326.8        2.9       ?       ? 
1 1 1   54    1    4 o    333.5    3.0    0.0000   0.0000          ?        ?  1112.9432  19.7942          ?        ?      333.5        3.0       ?       ? 
1 1 1   54    1    5 o    179.1    3.6    0.0000   0.0000          ?        ?   321.1764  12.7704          ?        ?      179.1        3.6       ?       ? 
1 1 1   54    1    6 o    153.4    4.0    0.0000   0.0000          ?        ?   235.6145  12.1319          ?        ?      153.4        4.0       ?       ? 
1 1 1   54    1    7 o    150.7    4.2    0.0000   0.0000          ?        ?   227.3137  12.7704          ?        ?      150.7        4.2       ?       ? 
1 1 1   54    1    8 o    316.0    2.7    0.0000   0.0000          ?        ?   999.2863  17.2401          ?        ?      316.0        2.7       ?       ? 
1 1 1   54    1    9 o    135.3    5.0    0.0000   0.0000          ?        ?   183.2557  13.4090          ?        ?      135.3        5.0       ?       ? 
1 1 1   54    1   10 o    497.9    2.9    0.0000   0.0000          ?        ?  2480.6565  29.3720          ?        ?      497.9        2.9       ?       ? 
1 1 1   54    1   11 o    463.8    2.8    0.0000   0.0000          ?        ?  2152.4565  26.1794          ?        ?      463.8        2.8       ?       ? 
1 1 1   54    1   12 o    396.6    2.7    0.0000   0.0000          ?        ?  1573.9558  21.7097          ?        ?      396.6        2.7       ?       ? 
1 1 1   54    1   13 o    116.2    5.8    0.0000   0.0000          ?        ?   135.3666  13.4090          ?        ?      116.2        5.8       ?       ? 
1 1 1   54    1   14 o    443.3    3.0    0.0000   0.0000          ?        ?  1966.0081  26.1794          ?        ?      443.3        3.0       ?       ? 
1 1 1   54    1   15 o    495.6    2.9    0.0000   0.0000          ?        ?  2457.0312  28.7335          ?        ?      495.6        2.9       ?       ? 
1 1 1   54    1   16 o    377.2    3.0    0.0000   0.0000          ?        ?  1423.9032  22.3483          ?        ?      377.2        3.0       ?       ? 
1 1 1   54    1   17 o    277.9    3.3    0.0000   0.0000          ?        ?   772.6111  18.5171          ?        ?      277.9        3.3       ?       ? 
1 1 1   54    1   18 o    268.3    3.1    0.0000   0.0000          ?        ?   720.2524  16.6016          ?        ?      268.3        3.1       ?       ? 
1 1 1   54    1   19 o    284.2    3.0    0.0000   0.0000          ?        ?   808.3683  17.2401          ?        ?      284.2        3.0       ?       ? 
1 1 1   54    1   20 o     36.7   14.1    0.0000   0.0000          ?        ?     8.9393  14.6860          ?        ?       36.7       14.1       ?       ? 
1 1 1   54    1   21 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   54    1   22 o     27.4   12.5    0.0000   0.0000          ?        ?   -10.2163  15.3245          ?        ?       27.4       12.5       ?       ? 
1 1 1   54    1   23 o    108.2    6.5    0.0000   0.0000          ?        ?   117.4880  14.0475          ?        ?      108.2        6.5       ?       ? 
1 1 1   54    1   24 o    218.8    3.4    0.0000   0.0000          ?        ?   478.8912  14.6860          ?        ?      218.8        3.4       ?       ? 
1 1 1   54    1   25 o     21.1   10.3    0.0000   0.0000          ?        ?   -28.7335  14.6860          ?        ?       21.1       10.3       ?       ? 
1 1 1   54    1   26 o    173.5    4.4    0.0000   0.0000          ?        ?   301.3822  15.3245          ?        ?      173.5        4.4       ?       ? 
1 1 1   54    1   27 o    167.5    4.4    0.0000   0.0000          ?        ?   280.9495  14.6860          ?        ?      167.5        4.4       ?       ? 
1 1 1   54    1   28 o    218.1    3.5    0.0000   0.0000          ?        ?   476.3371  15.3245          ?        ?      218.1        3.5       ?       ? 
1 1 1   54    1   29 o    138.2    5.5    0.0000   0.0000          ?        ?   191.5565  15.3245          ?        ?      138.2        5.5       ?       ? 
1 1 1   54    1   30 o    141.0    5.7    0.0000   0.0000          ?        ?   199.2188  15.9630          ?        ?      141.0        5.7       ?       ? 
1 1 1   54    1   31 o     49.2   14.9    0.0000   0.0000          ?        ?    24.9023  15.9630          ?        ?       49.2       14.9       ?       ? 
1 1 1   54    1   32 o    709.9    2.9    0.0000   0.0000          ?        ?  5043.0439  40.8654          ?        ?      709.9        2.9       ?       ? 
1 1 1   54    1   33 o     66.2   13.0    0.0000   0.0000          ?        ?    45.9736  16.6016          ?        ?       66.2       13.0       ?       ? 
1 1 1   54    1   34 o     98.6    7.8    0.0000   0.0000          ?        ?    97.6938  15.3245          ?        ?       98.6        7.8       ?       ? 
1 1 1   54    1   35 o    103.6    7.7    0.0000   0.0000          ?        ?   107.9102  15.9630          ?        ?      103.6        7.7       ?       ? 
1 1 1   54    1   36 o    172.8    4.8    0.0000   0.0000          ?        ?   299.4666  16.6016          ?        ?      172.8        4.8       ?       ? 
1 1 1   54    1   37 o     62.8   12.6    0.0000   0.0000          ?        ?    41.5039  15.3245          ?        ?       62.8       12.6       ?       ? 
1 1 1   54    1   38 o    301.9    3.1    0.0000   0.0000          ?        ?   912.4474  18.5171          ?        ?      301.9        3.1       ?       ? 
1 1 1   54    1   39 o    121.6    6.8    0.0000   0.0000          ?        ?   148.7755  16.6016          ?        ?      121.6        6.8       ?       ? 
1 1 1   54    1   40 o    189.3    4.7    0.0000   0.0000          ?        ?   359.4877  17.8786          ?        ?      189.3        4.7       ?       ? 
1 1 1   54    1   41 o     23.9   11.7    0.0000   0.0000          ?        ?   -31.2876  17.8786          ?        ?       23.9       11.7       ?       ? 
1 1 1   54    1   42 o    201.7    4.3    0.0000   0.0000          ?        ?   408.0153  17.2401          ?        ?      201.7        4.3       ?       ? 
1 1 1   54    1   43 o    147.2    5.9    0.0000   0.0000          ?        ?   217.7359  17.2401          ?        ?      147.2        5.9       ?       ? 
1 1 1   54    1   44 o    145.6    5.9    0.0000   0.0000          ?        ?   213.2662  17.2401          ?        ?      145.6        5.9       ?       ? 
1 1 1   54    1   45 o    191.2    4.7    0.0000   0.0000          ?        ?   367.1499  17.8786          ?        ?      191.2        4.7       ?       ? 
1 1 1   54    1   46 o    142.0    6.1    0.0000   0.0000          ?        ?   203.0499  17.2401          ?        ?      142.0        6.1       ?       ? 
1 1 1   54    1   47 o     70.2   12.8    0.0000   0.0000          ?        ?    52.3588  17.2401          ?        ?       70.2       12.8       ?       ? 
1 1 1   54    2    0 o    372.5    4.3 1388.7845  31.9261  1388.7845  31.9261  1388.7845  31.9261      372.5      4.3      372.5        4.3     0.0     0.0 
1 1 1   54    2    1 o     97.8    6.2    0.0000   0.0000          ?        ?    95.7782  12.1319          ?        ?       97.8        6.2       ?       ? 
1 1 1   54    2    2 f    163.9    4.1    0.0000   0.0000          ?        ?   268.8176  13.4090          ?        ?      163.9        4.1       ?       ? 
1 1 1   54    2    3 o    239.8    3.2    0.0000   0.0000          ?        ?   575.3080  15.3245          ?        ?      239.8        3.2       ?       ? 
1 1 1   54    2    4 o    328.6    2.7    0.0000   0.0000          ?        ?  1080.3785  17.8786          ?        ?      328.6        2.7       ?       ? 
1 1 1   54    2    5 f    103.5    5.9    0.0000   0.0000          ?        ?   107.2716  12.1319          ?        ?      103.5        5.9       ?       ? 
1 1 1   54    2    6 f     32.6   12.8    0.0000   0.0000          ?        ?     6.3852  12.1319          ?        ?       32.6       12.8       ?       ? 
1 1 1   54    2    7 o    318.0    2.8    0.0000   0.0000          ?        ?  1011.4182  17.8786          ?        ?      318.0        2.8       ?       ? 
1 1 1   54    2    8 o    106.5    6.6    0.0000   0.0000          ?        ?   113.6568  14.0475          ?        ?      106.5        6.6       ?       ? 
1 1 1   54    2    9 o    398.3    2.8    0.0000   0.0000          ?        ?  1587.3647  22.3483          ?        ?      398.3        2.8       ?       ? 
1 1 1   54    2   10 o    194.7    3.8    0.0000   0.0000          ?        ?   379.2819  14.6860          ?        ?      194.7        3.8       ?       ? 
1 1 1   54    2   11 o    183.0    4.0    0.0000   0.0000          ?        ?   335.2238  14.6860          ?        ?      183.0        4.0       ?       ? 
1 1 1   54    2   12 o    319.8    2.9    0.0000   0.0000          ?        ?  1023.5502  18.5171          ?        ?      319.8        2.9       ?       ? 
1 1 1   54    2   13 o    419.3    2.9    0.0000   0.0000          ?        ?  1759.1271  24.2638          ?        ?      419.3        2.9       ?       ? 
1 1 1   54    2   14 o    449.5    3.0    0.0000   0.0000          ?        ?  2021.5594  26.8179          ?        ?      449.5        3.0       ?       ? 
1 1 1   54    2   15 o    346.5    3.1    0.0000   0.0000          ?        ?  1201.0592  21.7097          ?        ?      346.5        3.1       ?       ? 
1 1 1   54    2   16 o     68.5    9.8    0.0000   0.0000          ?        ?    47.2506  13.4090          ?        ?       68.5        9.8       ?       ? 
1 1 1   54    2   17 o    473.8    3.0    0.0000   0.0000          ?        ?  2246.3191  28.7335          ?        ?      473.8        3.0       ?       ? 
1 1 1   54    2   18 o    276.0    3.1    0.0000   0.0000          ?        ?   762.3948  17.2401          ?        ?      276.0        3.1       ?       ? 
1 1 1   54    2   19 o    127.7    5.7    0.0000   0.0000          ?        ?   163.4615  14.6860          ?        ?      127.7        5.7       ?       ? 
1 1 1   54    2   20 o    223.8    3.4    0.0000   0.0000          ?        ?   501.2395  15.3245          ?        ?      223.8        3.4       ?       ? 
1 1 1   54    2   21 o    508.2    2.8    0.0000   0.0000          ?        ?  2584.0972  28.7335          ?        ?      508.2        2.8       ?       ? 
1 1 1   54    2   22 o     36.2   14.1    0.0000   0.0000          ?        ?     8.3008  14.6860          ?        ?       36.2       14.1       ?       ? 
1 1 1   54    2   23 o    186.8    4.3    0.0000   0.0000          ?        ?   349.2713  15.9630          ?        ?      186.8        4.3       ?       ? 
1 1 1   54    2   24 o    195.3    3.9    0.0000   0.0000          ?        ?   381.8359  15.3245          ?        ?      195.3        3.9       ?       ? 
1 1 1   54    2   25 o    169.4    4.3    0.0000   0.0000          ?        ?   287.3347  14.6860          ?        ?      169.4        4.3       ?       ? 
1 1 1   54    2   26 o     21.1   10.3    0.0000   0.0000          ?        ?   -28.7335  14.6860          ?        ?       21.1       10.3       ?       ? 
1 1 1   54    2   27 o    247.5    3.5    0.0000   0.0000          ?        ?   612.9808  17.2401          ?        ?      247.5        3.5       ?       ? 
1 1 1   54    2   28 o    216.2    3.7    0.0000   0.0000          ?        ?   468.0364  15.9630          ?        ?      216.2        3.7       ?       ? 
1 1 1   54    2   29 o    389.1    2.7    0.0000   0.0000          ?        ?  1514.5732  21.0712          ?        ?      389.1        2.7       ?       ? 
1 1 1   54    2   30 o    314.5    2.8    0.0000   0.0000          ?        ?   989.7085  17.8786          ?        ?      314.5        2.8       ?       ? 
1 1 1   54    2   31 o    388.0    2.7    0.0000   0.0000          ?        ?  1506.2725  21.0712          ?        ?      388.0        2.7       ?       ? 
1 1 1   54    2   32 o    265.2    3.4    0.0000   0.0000          ?        ?   704.2894  17.8786          ?        ?      265.2        3.4       ?       ? 
1 1 1   54    2   33 o    315.5    2.9    0.0000   0.0000          ?        ?   996.0938  18.5171          ?        ?      315.5        2.9       ?       ? 
1 1 1   54    2   34 o     37.2   14.6    0.0000   0.0000          ?        ?     8.3008  15.9630          ?        ?       37.2       14.6       ?       ? 
1 1 1   54    2   35 o    180.8    4.6    0.0000   0.0000          ?        ?   327.5616  16.6016          ?        ?      180.8        4.6       ?       ? 
1 1 1   54    2   36 o    274.8    3.4    0.0000   0.0000          ?        ?   756.0096  18.5171          ?        ?      274.8        3.4       ?       ? 
1 1 1   54    2   37 o    210.5    3.9    0.0000   0.0000          ?        ?   443.7725  16.6016          ?        ?      210.5        3.9       ?       ? 
1 1 1   54    2   38 o    168.7    5.1    0.0000   0.0000          ?        ?   285.4192  17.2401          ?        ?      168.7        5.1       ?       ? 
1 1 1   54    2   39 o     24.4   11.8    0.0000   0.0000          ?        ?   -26.1794  17.2401          ?        ?       24.4       11.8       ?       ? 
1 1 1   54    2   40 o     30.4   13.8    0.0000   0.0000          ?        ?    -8.9393  17.8786          ?        ?       30.4       13.8       ?       ? 
1 1 1   54    2   41 o    103.7    8.3    0.0000   0.0000          ?        ?   108.5487  17.2401          ?        ?      103.7        8.3       ?       ? 
1 1 1   54    2   42 o     72.4   11.9    0.0000   0.0000          ?        ?    53.6358  17.2401          ?        ?       72.4       11.9       ?       ? 
1 1 1   54    2   43 o    138.2    6.2    0.0000   0.0000          ?        ?   192.1950  17.2401          ?        ?      138.2        6.2       ?       ? 
1 1 1   54    2   44 o    251.0    3.8    0.0000   0.0000          ?        ?   631.4979  19.1556          ?        ?      251.0        3.8       ?       ? 
1 1 1   54    2   45 o    173.3    5.3    0.0000   0.0000          ?        ?   302.0207  18.5171          ?        ?      173.3        5.3       ?       ? 
1 1 1   54    2   46 o     20.3   10.2    0.0000   0.0000          ?        ?   -50.4432  17.8786          ?        ?       20.3       10.2       ?       ? 
1 1 1   54    3    0 o    331.6    3.9 1100.8113  25.5409  1100.8113  25.5409  1100.8113  25.5409      331.6      3.9      331.6        3.9     0.0     0.0 
1 1 1   54    3    1 o     78.6    7.7    0.0000   0.0000          ?        ?    61.9366  12.1319          ?        ?       78.6        7.7       ?       ? 
1 1 1   54    3    2 o    201.6    3.5    0.0000   0.0000          ?        ?   406.7383  14.0475          ?        ?      201.6        3.5       ?       ? 
1 1 1   54    3    3 o    142.6    4.3    0.0000   0.0000          ?        ?   203.6884  12.1319          ?        ?      142.6        4.3       ?       ? 
1 1 1   54    3    4 o    137.6    4.4    0.0000   0.0000          ?        ?   189.6409  12.1319          ?        ?      137.6        4.4       ?       ? 
1 1 1   54    3    5 o    261.9    3.2    0.0000   0.0000          ?        ?   686.4108  16.6016          ?        ?      261.9        3.2       ?       ? 
1 1 1   54    3    6 o     70.4    9.1    0.0000   0.0000          ?        ?    49.8047  12.7704          ?        ?       70.4        9.1       ?       ? 
1 1 1   54    3    7 o    272.1    3.1    0.0000   0.0000          ?        ?   740.6851  16.6016          ?        ?      272.1        3.1       ?       ? 
1 1 1   54    3    8 o     68.5    9.8    0.0000   0.0000          ?        ?    47.2506  13.4090          ?        ?       68.5        9.8       ?       ? 
1 1 1   54    3    9 o    454.0    2.9    0.0000   0.0000          ?        ?  2062.4248  26.1794          ?        ?      454.0        2.9       ?       ? 
1 1 1   54    3   10 o    332.2    2.9    0.0000   0.0000          ?        ?  1104.0039  19.1556          ?        ?      332.2        2.9       ?       ? 
1 1 1   54    3   11 o    333.9    3.0    0.0000   0.0000          ?        ?  1115.4973  19.7942          ?        ?      333.9        3.0       ?       ? 
1 1 1   54    3   12 o    236.4    3.5    0.0000   0.0000          ?        ?   559.3449  16.6016          ?        ?      236.4        3.5       ?       ? 
1 1 1   54    3   13 o    669.9    3.3    0.0000   0.0000          ?        ?  4490.0840  44.0580          ?        ?      669.9        3.3       ?       ? 
1 1 1   54    3   14 o    408.2    2.9    0.0000   0.0000          ?        ?  1667.1801  23.6253          ?        ?      408.2        2.9       ?       ? 
1 1 1   54    3   15 o    126.0    5.6    0.0000   0.0000          ?        ?   158.9919  14.0475          ?        ?      126.0        5.6       ?       ? 
1 1 1   54    3   16 o    246.1    3.2    0.0000   0.0000          ?        ?   605.9570  15.9630          ?        ?      246.1        3.2       ?       ? 
1 1 1   54    3   17 o    319.2    2.8    0.0000   0.0000          ?        ?  1019.7190  17.8786          ?        ?      319.2        2.8       ?       ? 
1 1 1   54    3   18 o    287.1    3.4    0.0000   0.0000          ?        ?   824.9699  19.7942          ?        ?      287.1        3.4       ?       ? 
1 1 1   54    3   19 o    234.6    3.8    0.0000   0.0000          ?        ?   551.0442  17.8786          ?        ?      234.6        3.8       ?       ? 
1 1 1   54    3   20 o     19.8    9.8    0.0000   0.0000          ?        ?   -31.2876  14.0475          ?        ?       19.8        9.8       ?       ? 
1 1 1   54    3   21 o    125.2    5.6    0.0000   0.0000          ?        ?   157.0763  14.0475          ?        ?      125.2        5.6       ?       ? 
1 1 1   54    3   22 o    447.2    2.9    0.0000   0.0000          ?        ?  2001.1267  25.5409          ?        ?      447.2        2.9       ?       ? 
1 1 1   54    3   23 o     34.6   14.3    0.0000   0.0000          ?        ?     3.8311  15.9630          ?        ?       34.6       14.3       ?       ? 
1 1 1   54    3   24 o    240.4    3.5    0.0000   0.0000          ?        ?   578.5006  16.6016          ?        ?      240.4        3.5       ?       ? 
1 1 1   54    3   25 f     18.4    9.3    0.0000   0.0000          ?        ?   -46.6121  15.3245          ?        ?       18.4        9.3       ?       ? 
1 1 1   54    3   26 o    296.3    3.0    0.0000   0.0000          ?        ?   878.6058  17.8786          ?        ?      296.3        3.0       ?       ? 
1 1 1   54    3   27 o    166.5    4.6    0.0000   0.0000          ?        ?   277.7569  15.3245          ?        ?      166.5        4.6       ?       ? 
1 1 1   54    3   28 o    189.3    4.4    0.0000   0.0000          ?        ?   358.8492  16.6016          ?        ?      189.3        4.4       ?       ? 
1 1 1   54    3   29 o    240.1    3.3    0.0000   0.0000          ?        ?   577.2236  15.9630          ?        ?      240.1        3.3       ?       ? 
1 1 1   54    3   30 o    311.1    2.9    0.0000   0.0000          ?        ?   968.6373  17.8786          ?        ?      311.1        2.9       ?       ? 
1 1 1   54    3   31 o    245.8    3.4    0.0000   0.0000          ?        ?   604.6799  16.6016          ?        ?      245.8        3.4       ?       ? 
1 1 1   54    3   32 o    318.5    2.9    0.0000   0.0000          ?        ?  1015.2494  18.5171          ?        ?      318.5        2.9       ?       ? 
1 1 1   54    3   33 o     59.7   13.2    0.0000   0.0000          ?        ?    37.6728  15.3245          ?        ?       59.7       13.2       ?       ? 
1 1 1   54    3   34 o     64.8   12.3    0.0000   0.0000          ?        ?    44.0580  15.3245          ?        ?       64.8       12.3       ?       ? 
1 1 1   54    3   35 o    152.6    5.4    0.0000   0.0000          ?        ?   233.6989  16.6016          ?        ?      152.6        5.4       ?       ? 
1 1 1   54    3   36 o    133.9    6.0    0.0000   0.0000          ?        ?   180.0631  15.9630          ?        ?      133.9        6.0       ?       ? 
1 1 1   54    3   37 o     57.4   14.5    0.0000   0.0000          ?        ?    35.1187  16.6016          ?        ?       57.4       14.5       ?       ? 
1 1 1   54    3   38 o    100.9    8.5    0.0000   0.0000          ?        ?   102.8020  17.2401          ?        ?      100.9        8.5       ?       ? 
1 1 1   54    3   39 o    184.5    4.7    0.0000   0.0000          ?        ?   341.6091  17.2401          ?        ?      184.5        4.7       ?       ? 
1 1 1   54    3   40 o     80.9    9.9    0.0000   0.0000          ?        ?    66.4062  15.9630          ?        ?       80.9        9.9       ?       ? 
1 1 1   54    3   41 o    135.7    6.1    0.0000   0.0000          ?        ?   185.1713  16.6016          ?        ?      135.7        6.1       ?       ? 
1 1 1   54    3   42 o     99.2    8.4    0.0000   0.0000          ?        ?    99.6094  16.6016          ?        ?       99.2        8.4       ?       ? 
1 1 1   54    3   43 o    111.0    7.5    0.0000   0.0000          ?        ?   124.5117  16.6016          ?        ?      111.0        7.5       ?       ? 
1 1 1   54    3   44 o     36.9   14.8    0.0000   0.0000          ?        ?     7.6623  16.6016          ?        ?       36.9       14.8       ?       ? 
1 1 1   54    3   45 o     18.2    9.2    0.0000   0.0000          ?        ?   -61.9366  17.2401          ?        ?       18.2        9.2       ?       ? 
1 1 1   54    4    0 o    102.8    9.5  108.5487  19.1556   108.5487  19.1556   108.5487  19.1556      102.8      9.5      102.8        9.5     0.0     0.0 
1 1 1   54    4    1 o    192.7    3.6    0.0000   0.0000          ?        ?   371.6196  14.0475          ?        ?      192.7        3.6       ?       ? 
1 1 1   54    4    2 o    166.6    4.0    0.0000   0.0000          ?        ?   277.7569  13.4090          ?        ?      166.6        4.0       ?       ? 
1 1 1   54    4    3 o    352.0    2.8    0.0000   0.0000          ?        ?  1239.3705  19.7942          ?        ?      352.0        2.8       ?       ? 
1 1 1   54    4    4 o    186.1    3.8    0.0000   0.0000          ?        ?   346.7172  14.0475          ?        ?      186.1        3.8       ?       ? 
1 1 1   54    4    5 f    207.5    3.5    0.0000   0.0000          ?        ?   431.0021  14.6860          ?        ?      207.5        3.5       ?       ? 
1 1 1   54    4    6 o    100.0    6.7    0.0000   0.0000          ?        ?   100.2479  13.4090          ?        ?      100.0        6.7       ?       ? 
1 1 1   54    4    7 o     48.8   12.9    0.0000   0.0000          ?        ?    24.9023  12.7704          ?        ?       48.8       12.9       ?       ? 
1 1 1   54    4    8 o    186.3    3.9    0.0000   0.0000          ?        ?   347.3558  14.6860          ?        ?      186.3        3.9       ?       ? 
1 1 1   54    4    9 o    174.6    4.4    0.0000   0.0000          ?        ?   305.2133  15.3245          ?        ?      174.6        4.4       ?       ? 
1 1 1   54    4   10 o     72.2    8.8    0.0000   0.0000          ?        ?    52.3588  12.7704          ?        ?       72.2        8.8       ?       ? 
1 1 1   54    4   11 o    205.7    3.7    0.0000   0.0000          ?        ?   423.3398  15.3245          ?        ?      205.7        3.7       ?       ? 
1 1 1   54    4   12 o    148.9    5.1    0.0000   0.0000          ?        ?   222.2055  15.3245          ?        ?      148.9        5.1       ?       ? 
1 1 1   54    4   13 o    250.0    3.6    0.0000   0.0000          ?        ?   625.7512  17.8786          ?        ?      250.0        3.6       ?       ? 
1 1 1   54    4   14 o    282.6    3.3    0.0000   0.0000          ?        ?   799.4291  18.5171          ?        ?      282.6        3.3       ?       ? 
1 1 1   54    4   15 o    372.0    3.1    0.0000   0.0000          ?        ?  1384.9534  22.9868          ?        ?      372.0        3.1       ?       ? 
1 1 1   54    4   16 o    479.8    2.9    0.0000   0.0000          ?        ?  2303.1477  27.4564          ?        ?      479.8        2.9       ?       ? 
1 1 1   54    4   17 o    214.8    3.6    0.0000   0.0000          ?        ?   461.6512  15.3245          ?        ?      214.8        3.6       ?       ? 
1 1 1   54    4   18 o     80.4    9.5    0.0000   0.0000          ?        ?    65.1292  15.3245          ?        ?       80.4        9.5       ?       ? 
1 1 1   54    4   19 o     24.2   11.6    0.0000   0.0000          ?        ?   -22.3483  15.9630          ?        ?       24.2       11.6       ?       ? 
1 1 1   54    4   20 o    160.3    4.6    0.0000   0.0000          ?        ?   257.3242  14.6860          ?        ?      160.3        4.6       ?       ? 
1 1 1   54    4   21 o     36.1   13.8    0.0000   0.0000          ?        ?     8.9393  14.0475          ?        ?       36.1       13.8       ?       ? 
1 1 1   54    4   22 o     61.3   13.4    0.0000   0.0000          ?        ?    39.5883  15.9630          ?        ?       61.3       13.4       ?       ? 
1 1 1   54    4   23 o    195.6    3.9    0.0000   0.0000          ?        ?   383.1130  15.3245          ?        ?      195.6        3.9       ?       ? 
1 1 1   54    4   24 o    196.8    3.7    0.0000   0.0000          ?        ?   387.5826  14.6860          ?        ?      196.8        3.7       ?       ? 
1 1 1   54    4   25 o    125.9    5.8    0.0000   0.0000          ?        ?   158.9919  14.6860          ?        ?      125.9        5.8       ?       ? 
1 1 1   54    4   26 f    118.6    6.5    0.0000   0.0000          ?        ?   141.1133  15.3245          ?        ?      118.6        6.5       ?       ? 
1 1 1   54    4   27 o    319.4    2.8    0.0000   0.0000          ?        ?  1020.9960  17.8786          ?        ?      319.4        2.8       ?       ? 
1 1 1   54    4   28 o    288.3    3.0    0.0000   0.0000          ?        ?   831.9937  17.2401          ?        ?      288.3        3.0       ?       ? 
1 1 1   54    4   29 o    333.8    2.9    0.0000   0.0000          ?        ?  1114.8588  19.1556          ?        ?      333.8        2.9       ?       ? 
1 1 1   54    4   30 o    229.1    3.5    0.0000   0.0000          ?        ?   525.5033  15.9630          ?        ?      229.1        3.5       ?       ? 
1 1 1   54    4   31 o    124.0    6.4    0.0000   0.0000          ?        ?   154.5222  15.9630          ?        ?      124.0        6.4       ?       ? 
1 1 1   54    4   32 o    151.2    5.3    0.0000   0.0000          ?        ?   229.2293  15.9630          ?        ?      151.2        5.3       ?       ? 
1 1 1   54    4   33 o     57.0   14.1    0.0000   0.0000          ?        ?    34.4802  15.9630          ?        ?       57.0       14.1       ?       ? 
1 1 1   54    4   34 o    207.7    4.2    0.0000   0.0000          ?        ?   432.2791  17.2401          ?        ?      207.7        4.2       ?       ? 
1 1 1   54    4   35 o    253.9    3.4    0.0000   0.0000          ?        ?   645.5453  17.2401          ?        ?      253.9        3.4       ?       ? 
1 1 1   54    4   36 o    139.0    5.7    0.0000   0.0000          ?        ?   194.1106  15.9630          ?        ?      139.0        5.7       ?       ? 
1 1 1   54    4   37 o     46.7   15.4    0.0000   0.0000          ?        ?    21.7097  16.6016          ?        ?       46.7       15.4       ?       ? 
1 1 1   54    4   38 o     51.7   15.1    0.0000   0.0000          ?        ?    28.0950  16.6016          ?        ?       51.7       15.1       ?       ? 
1 1 1   54    4   39 f     92.7    8.6    0.0000   0.0000          ?        ?    86.8389  15.9630          ?        ?       92.7        8.6       ?       ? 
1 1 1   54    4   40 f     57.8   14.0    0.0000   0.0000          ?        ?    35.7572  15.9630          ?        ?       57.8       14.0       ?       ? 
1 1 1   54    4   41 o    172.3    5.2    0.0000   0.0000          ?        ?   298.1896  17.8786          ?        ?      172.3        5.2       ?       ? 
1 1 1   54    4   42 o     91.5    9.1    0.0000   0.0000          ?        ?    84.9234  16.6016          ?        ?       91.5        9.1       ?       ? 
1 1 1   54    4   43 o    103.7    8.6    0.0000   0.0000          ?        ?   109.1872  17.8786          ?        ?      103.7        8.6       ?       ? 
1 1 1   54    4   44 o     41.7   15.3    0.0000   0.0000          ?        ?    15.3245  16.6016          ?        ?       41.7       15.3       ?       ? 
1 1 1   54    5    0 f    173.6    6.1  302.6593  21.0712   302.6593  21.0712   302.6593  21.0712      173.6      6.1      173.6        6.1     0.0     0.0 
1 1 1   54    5    1 o     47.6   13.0    0.0000   0.0000          ?        ?    23.6253  12.7704          ?        ?       47.6       13.0       ?       ? 
1 1 1   54    5    2 o    114.0    5.6    0.0000   0.0000          ?        ?   130.2584  12.7704          ?        ?      114.0        5.6       ?       ? 
1 1 1   54    5    3 o    195.5    3.4    0.0000   0.0000          ?        ?   382.4745  13.4090          ?        ?      195.5        3.4       ?       ? 
1 1 1   54    5    4 o    301.0    3.2    0.0000   0.0000          ?        ?   906.7007  19.1556          ?        ?      301.0        3.2       ?       ? 
1 1 1   54    5    5 o    318.5    2.9    0.0000   0.0000          ?        ?  1015.2494  18.5171          ?        ?      318.5        2.9       ?       ? 
1 1 1   54    5    6 o    215.1    3.4    0.0000   0.0000          ?        ?   462.9282  14.6860          ?        ?      215.1        3.4       ?       ? 
1 1 1   54    5    7 o    292.6    3.2    0.0000   0.0000          ?        ?   856.8960  18.5171          ?        ?      292.6        3.2       ?       ? 
1 1 1   54    5    8 o    320.8    2.8    0.0000   0.0000          ?        ?  1029.9354  17.8786          ?        ?      320.8        2.8       ?       ? 
1 1 1   54    5    9 f    209.3    3.8    0.0000   0.0000          ?        ?   438.6643  15.9630          ?        ?      209.3        3.8       ?       ? 
1 1 1   54    5   10 o    155.7    4.5    0.0000   0.0000          ?        ?   242.6382  14.0475          ?        ?      155.7        4.5       ?       ? 
1 1 1   54    5   11 f    211.0    3.6    0.0000   0.0000          ?        ?   445.6881  15.3245          ?        ?      211.0        3.6       ?       ? 
1 1 1   54    5   12 o     73.9    9.9    0.0000   0.0000          ?        ?    54.9129  14.6860          ?        ?       73.9        9.9       ?       ? 
1 1 1   54    5   13 o    198.2    3.5    0.0000   0.0000          ?        ?   393.3293  14.0475          ?        ?      198.2        3.5       ?       ? 
1 1 1   54    5   14 o    163.7    4.3    0.0000   0.0000          ?        ?   268.1791  14.0475          ?        ?      163.7        4.3       ?       ? 
1 1 1   54    5   15 o    215.9    3.8    0.0000   0.0000          ?        ?   466.7593  16.6016          ?        ?      215.9        3.8       ?       ? 
1 1 1   54    5   16 o    111.7    6.0    0.0000   0.0000          ?        ?   125.1502  13.4090          ?        ?      111.7        6.0       ?       ? 
1 1 1   54    5   17 o    193.3    4.0    0.0000   0.0000          ?        ?   374.1737  15.3245          ?        ?      193.3        4.0       ?       ? 
1 1 1   54    5   18 o    270.0    3.4    0.0000   0.0000          ?        ?   729.8303  18.5171          ?        ?      270.0        3.4       ?       ? 
1 1 1   54    5   19 o    361.1    3.0    0.0000   0.0000          ?        ?  1304.4998  21.7097          ?        ?      361.1        3.0       ?       ? 
1 1 1   54    5   20 o    138.9    5.5    0.0000   0.0000          ?        ?   193.4720  15.3245          ?        ?      138.9        5.5       ?       ? 
1 1 1   54    5   21 o    191.7    3.7    0.0000   0.0000          ?        ?   367.7885  14.0475          ?        ?      191.7        3.7       ?       ? 
1 1 1   54    5   22 o    131.6    5.6    0.0000   0.0000          ?        ?   173.6779  14.6860          ?        ?      131.6        5.6       ?       ? 
1 1 1   54    5   23 o    167.5    4.6    0.0000   0.0000          ?        ?   280.9495  15.3245          ?        ?      167.5        4.6       ?       ? 
1 1 1   54    5   24 o    121.8    6.3    0.0000   0.0000          ?        ?   148.7755  15.3245          ?        ?      121.8        6.3       ?       ? 
1 1 1   54    5   25 o     85.4    9.3    0.0000   0.0000          ?        ?    73.4300  15.9630          ?        ?       85.4        9.3       ?       ? 
1 1 1   54    5   26 o    221.2    3.8    0.0000   0.0000          ?        ?   489.7461  16.6016          ?        ?      221.2        3.8       ?       ? 
1 1 1   54    5   27 o    570.5    3.0    0.0000   0.0000          ?        ?  3257.0989  33.8416          ?        ?      570.5        3.0       ?       ? 
1 1 1   54    5   28 o    278.8    3.3    0.0000   0.0000          ?        ?   778.3578  18.5171          ?        ?      278.8        3.3       ?       ? 
1 1 1   54    5   29 o    243.9    3.4    0.0000   0.0000          ?        ?   595.7407  16.6016          ?        ?      243.9        3.4       ?       ? 
1 1 1   54    5   30 o    127.1    6.3    0.0000   0.0000          ?        ?   162.1845  15.9630          ?        ?      127.1        6.3       ?       ? 
1 1 1   54    5   31 f     25.9   12.0    0.0000   0.0000          ?        ?   -12.1319  14.6860          ?        ?       25.9       12.0       ?       ? 
1 1 1   54    5   32 o    289.8    3.2    0.0000   0.0000          ?        ?   840.9330  18.5171          ?        ?      289.8        3.2       ?       ? 
1 1 1   54    5   33 o     77.0   10.4    0.0000   0.0000          ?        ?    60.0210  15.9630          ?        ?       77.0       10.4       ?       ? 
1 1 1   54    5   34 o    256.5    3.2    0.0000   0.0000          ?        ?   658.9543  16.6016          ?        ?      256.5        3.2       ?       ? 
1 1 1   54    5   35 o     26.6   12.4    0.0000   0.0000          ?        ?   -14.0475  15.9630          ?        ?       26.6       12.4       ?       ? 
1 1 1   54    5   36 o     98.7    8.1    0.0000   0.0000          ?        ?    98.3323  15.9630          ?        ?       98.7        8.1       ?       ? 
1 1 1   54    5   37 o     23.4   11.4    0.0000   0.0000          ?        ?   -27.4564  16.6016          ?        ?       23.4       11.4       ?       ? 
1 1 1   54    5   38 o     23.2   11.2    0.0000   0.0000          ?        ?   -25.5409  15.9630          ?        ?       23.2       11.2       ?       ? 
1 1 1   54    5   39 o     72.1   11.1    0.0000   0.0000          ?        ?    52.9973  15.9630          ?        ?       72.1       11.1       ?       ? 
1 1 1   54    5   40 o    191.6    4.5    0.0000   0.0000          ?        ?   368.4270  17.2401          ?        ?      191.6        4.5       ?       ? 
1 1 1   54    5   41 f    127.9    6.5    0.0000   0.0000          ?        ?   164.7386  16.6016          ?        ?      127.9        6.5       ?       ? 
1 1 1   54    5   42 o    332.9    3.0    0.0000   0.0000          ?        ?  1110.3890  19.7942          ?        ?      332.9        3.0       ?       ? 
1 1 1   54    5   43 o     81.7   10.6    0.0000   0.0000          ?        ?    68.3218  17.2401          ?        ?       81.7       10.6       ?       ? 
1 1 1   54    6    0 o     24.3   15.8    0.0000  17.8786     0.0000  17.8786     0.0000  17.8786       24.3     15.8       24.3       15.8     0.0     0.0 
1 1 1   54    6    1 o    125.7    5.6    0.0000   0.0000          ?        ?   158.3534  14.0475          ?        ?      125.7        5.6       ?       ? 
1 1 1   54    6    2 o    131.7    5.1    0.0000   0.0000          ?        ?   173.6779  13.4090          ?        ?      131.7        5.1       ?       ? 
1 1 1   54    6    3 o    330.8    3.1    0.0000   0.0000          ?        ?  1095.0646  20.4327          ?        ?      330.8        3.1       ?       ? 
1 1 1   54    6    4 o    124.4    5.6    0.0000   0.0000          ?        ?   155.1608  14.0475          ?        ?      124.4        5.6       ?       ? 
1 1 1   54    6    5 o     90.9    7.4    0.0000   0.0000          ?        ?    83.0078  13.4090          ?        ?       90.9        7.4       ?       ? 
1 1 1   54    6    6 o    407.5    3.2    0.0000   0.0000          ?        ?  1661.4333  26.1794          ?        ?      407.5        3.2       ?       ? 
1 1 1   54    6    7 o     96.1    7.0    0.0000   0.0000          ?        ?    92.5856  13.4090          ?        ?       96.1        7.0       ?       ? 
1 1 1   54    6    8 o    328.9    3.0    0.0000   0.0000          ?        ?  1082.2942  19.7942          ?        ?      328.9        3.0       ?       ? 
1 1 1   54    6    9 o    227.9    3.2    0.0000   0.0000          ?        ?   519.7566  14.6860          ?        ?      227.9        3.2       ?       ? 
1 1 1   54    6   10 o    240.3    3.3    0.0000   0.0000          ?        ?   577.8621  15.9630          ?        ?      240.3        3.3       ?       ? 
1 1 1   54    6   11 o    413.8    2.9    0.0000   0.0000          ?        ?  1713.1534  24.2638          ?        ?      413.8        2.9       ?       ? 
1 1 1   54    6   12 o    136.9    4.9    0.0000   0.0000          ?        ?   187.7254  13.4090          ?        ?      136.9        4.9       ?       ? 
1 1 1   54    6   13 o    154.4    4.3    0.0000   0.0000          ?        ?   238.8071  13.4090          ?        ?      154.4        4.3       ?       ? 
1 1 1   54    6   14 o     40.8   14.1    0.0000   0.0000          ?        ?    15.3245  14.0475          ?        ?       40.8       14.1       ?       ? 
1 1 1   54    6   15 o    156.9    4.7    0.0000   0.0000          ?        ?   246.4693  14.6860          ?        ?      156.9        4.7       ?       ? 
1 1 1   54    6   16 o    341.7    3.2    0.0000   0.0000          ?        ?  1168.4946  21.7097          ?        ?      341.7        3.2       ?       ? 
1 1 1   54    6   17 o    197.4    4.2    0.0000   0.0000          ?        ?   390.1367  16.6016          ?        ?      197.4        4.2       ?       ? 
1 1 1   54    6   18 o    243.4    3.5    0.0000   0.0000          ?        ?   593.1866  17.2401          ?        ?      243.4        3.5       ?       ? 
1 1 1   54    6   19 o    253.3    3.4    0.0000   0.0000          ?        ?   642.3527  17.2401          ?        ?      253.3        3.4       ?       ? 
1 1 1   54    6   20 o     81.2    8.6    0.0000   0.0000          ?        ?    66.4062  14.0475          ?        ?       81.2        8.6       ?       ? 
1 1 1   54    6   21 o     64.5   12.3    0.0000   0.0000          ?        ?    43.4195  15.3245          ?        ?       64.5       12.3       ?       ? 
1 1 1   54    6   22 o    173.8    4.6    0.0000   0.0000          ?        ?   302.6593  15.9630          ?        ?      173.8        4.6       ?       ? 
1 1 1   54    6   23 o    419.8    2.7    0.0000   0.0000          ?        ?  1763.5968  22.9868          ?        ?      419.8        2.7       ?       ? 
1 1 1   54    6   24 o    154.4    5.0    0.0000   0.0000          ?        ?   238.8071  15.3245          ?        ?      154.4        5.0       ?       ? 
1 1 1   54    6   25 o    214.6    3.7    0.0000   0.0000          ?        ?   461.0126  15.9630          ?        ?      214.6        3.7       ?       ? 
1 1 1   54    6   26 o    109.3    7.3    0.0000   0.0000          ?        ?   120.0421  15.9630          ?        ?      109.3        7.3       ?       ? 
1 1 1   54    6   27 o    513.6    2.7    0.0000   0.0000          ?        ?  2640.2869  28.0950          ?        ?      513.6        2.7       ?       ? 
1 1 1   54    6   28 o    301.8    3.1    0.0000   0.0000          ?        ?   911.8089  18.5171          ?        ?      301.8        3.1       ?       ? 
1 1 1   54    6   29 f     81.1    9.4    0.0000   0.0000          ?        ?    66.4062  15.3245          ?        ?       81.1        9.4       ?       ? 
1 1 1   54    6   30 o    264.3    3.4    0.0000   0.0000          ?        ?   699.1812  17.8786          ?        ?      264.3        3.4       ?       ? 
1 1 1   54    6   31 o    223.0    3.7    0.0000   0.0000          ?        ?   498.0469  16.6016          ?        ?      223.0        3.7       ?       ? 
1 1 1   54    6   32 o     45.3   14.8    0.0000   0.0000          ?        ?    20.4327  15.3245          ?        ?       45.3       14.8       ?       ? 
1 1 1   54    6   33 o     82.2    9.3    0.0000   0.0000          ?        ?    68.3218  15.3245          ?        ?       82.2        9.3       ?       ? 
1 1 1   54    6   34 o    207.4    4.0    0.0000   0.0000          ?        ?   431.0021  16.6016          ?        ?      207.4        4.0       ?       ? 
1 1 1   54    6   35 o     89.5    9.3    0.0000   0.0000          ?        ?    81.0922  16.6016          ?        ?       89.5        9.3       ?       ? 
1 1 1   54    6   36 o    148.8    5.4    0.0000   0.0000          ?        ?   222.2055  15.9630          ?        ?      148.8        5.4       ?       ? 
1 1 1   54    6   37 o     71.2   11.2    0.0000   0.0000          ?        ?    51.7203  15.9630          ?        ?       71.2       11.2       ?       ? 
1 1 1   54    6   38 o    147.4    5.4    0.0000   0.0000          ?        ?   218.3744  15.9630          ?        ?      147.4        5.4       ?       ? 
1 1 1   54    6   39 o    129.1    6.4    0.0000   0.0000          ?        ?   167.9312  16.6016          ?        ?      129.1        6.4       ?       ? 
1 1 1   54    6   40 o    277.2    3.1    0.0000   0.0000          ?        ?   770.0571  17.2401          ?        ?      277.2        3.1       ?       ? 
1 1 1   54    6   41 o     93.8    8.8    0.0000   0.0000          ?        ?    89.3930  16.6016          ?        ?       93.8        8.8       ?       ? 
1 1 1   54    6   42 o     26.0   12.3    0.0000   0.0000          ?        ?   -19.7942  17.2401          ?        ?       26.0       12.3       ?       ? 
1 1 1   54    7    0 o     16.9   12.2  -24.9023  17.8786   -24.9023  17.8786   -24.9023  17.8786       16.9     12.2       16.9       12.2     0.0     0.0 
1 1 1   54    7    1 o    107.7    5.6    0.0000   0.0000          ?        ?   116.2109  12.1319          ?        ?      107.7        5.6       ?       ? 
1 1 1   54    7    2 o    437.0    3.1    0.0000   0.0000          ?        ?  1911.0951  26.8179          ?        ?      437.0        3.1       ?       ? 
1 1 1   54    7    3 o    313.6    3.2    0.0000   0.0000          ?        ?   983.9619  19.7942          ?        ?      313.6        3.2       ?       ? 
1 1 1   54    7    4 o    197.3    3.7    0.0000   0.0000          ?        ?   389.4982  14.6860          ?        ?      197.3        3.7       ?       ? 
1 1 1   54    7    5 o     76.9    8.3    0.0000   0.0000          ?        ?    59.3825  12.7704          ?        ?       76.9        8.3       ?       ? 
1 1 1   54    7    6 o    223.5    3.9    0.0000   0.0000          ?        ?   499.9625  17.2401          ?        ?      223.5        3.9       ?       ? 
1 1 1   54    7    7 o    157.7    4.5    0.0000   0.0000          ?        ?   249.0234  14.0475          ?        ?      157.7        4.5       ?       ? 
1 1 1   54    7    8 o    239.4    3.2    0.0000   0.0000          ?        ?   573.3925  15.3245          ?        ?      239.4        3.2       ?       ? 
1 1 1   54    7    9 o     82.8    8.5    0.0000   0.0000          ?        ?    68.9603  14.0475          ?        ?       82.8        8.5       ?       ? 
1 1 1   54    7   10 o     91.2    8.0    0.0000   0.0000          ?        ?    83.6463  14.6860          ?        ?       91.2        8.0       ?       ? 
1 1 1   54    7   11 o    197.6    4.0    0.0000   0.0000          ?        ?   390.7752  15.9630          ?        ?      197.6        4.0       ?       ? 
1 1 1   54    7   12 o    152.1    4.8    0.0000   0.0000          ?        ?   231.7833  14.6860          ?        ?      152.1        4.8       ?       ? 
1 1 1   54    7   13 o    256.6    3.2    0.0000   0.0000          ?        ?   658.9543  16.6016          ?        ?      256.6        3.2       ?       ? 
1 1 1   54    7   14 o     51.1   13.1    0.0000   0.0000          ?        ?    27.4564  13.4090          ?        ?       51.1       13.1       ?       ? 
1 1 1   54    7   15 o    270.2    3.3    0.0000   0.0000          ?        ?   730.4688  17.8786          ?        ?      270.2        3.3       ?       ? 
1 1 1   54    7   16 o    262.0    3.2    0.0000   0.0000          ?        ?   687.0493  16.6016          ?        ?      262.0        3.2       ?       ? 
1 1 1   54    7   17 o     35.0   14.0    0.0000   0.0000          ?        ?     6.3852  14.6860          ?        ?       35.0       14.0       ?       ? 
1 1 1   54    7   18 o     38.8   14.6    0.0000   0.0000          ?        ?    11.4934  15.3245          ?        ?       38.8       14.6       ?       ? 
1 1 1   54    7   19 o    137.3    5.6    0.0000   0.0000          ?        ?   189.0024  15.3245          ?        ?      137.3        5.6       ?       ? 
1 1 1   54    7   20 o    231.2    3.5    0.0000   0.0000          ?        ?   535.0811  15.9630          ?        ?      231.2        3.5       ?       ? 
1 1 1   54    7   21 o    251.9    3.3    0.0000   0.0000          ?        ?   635.3290  16.6016          ?        ?      251.9        3.3       ?       ? 
1 1 1   54    7   22 o    328.7    3.2    0.0000   0.0000          ?        ?  1081.6556  21.0712          ?        ?      328.7        3.2       ?       ? 
1 1 1   54    7   23 o     37.3   14.9    0.0000   0.0000          ?        ?     7.6623  16.6016          ?        ?       37.3       14.9       ?       ? 
1 1 1   54    7   24 o     90.8    8.4    0.0000   0.0000          ?        ?    83.0078  15.3245          ?        ?       90.8        8.4       ?       ? 
1 1 1   54    7   25 o    328.8    2.9    0.0000   0.0000          ?        ?  1082.2942  19.1556          ?        ?      328.8        2.9       ?       ? 
1 1 1   54    7   26 o    111.9    7.1    0.0000   0.0000          ?        ?   125.7888  15.9630          ?        ?      111.9        7.1       ?       ? 
1 1 1   54    7   27 o     73.2   10.9    0.0000   0.0000          ?        ?    54.2743  15.9630          ?        ?       73.2       10.9       ?       ? 
1 1 1   54    7   28 o    182.7    4.5    0.0000   0.0000          ?        ?   334.5853  16.6016          ?        ?      182.7        4.5       ?       ? 
1 1 1   54    7   29 o    120.4    6.6    0.0000   0.0000          ?        ?   145.5829  15.9630          ?        ?      120.4        6.6       ?       ? 
1 1 1   54    7   30 o    340.3    2.8    0.0000   0.0000          ?        ?  1158.9167  19.1556          ?        ?      340.3        2.8       ?       ? 
1 1 1   54    7   31 o     64.0   13.4    0.0000   0.0000          ?        ?    43.4195  16.6016          ?        ?       64.0       13.4       ?       ? 
1 1 1   54    7   32 o    332.1    2.9    0.0000   0.0000          ?        ?  1104.0039  19.1556          ?        ?      332.1        2.9       ?       ? 
1 1 1   54    7   33 o    186.6    4.6    0.0000   0.0000          ?        ?   349.2713  17.2401          ?        ?      186.6        4.6       ?       ? 
1 1 1   54    7   34 o    139.7    5.9    0.0000   0.0000          ?        ?   196.0261  16.6016          ?        ?      139.7        5.9       ?       ? 
1 1 1   54    7   35 o    115.9    7.2    0.0000   0.0000          ?        ?   135.3666  16.6016          ?        ?      115.9        7.2       ?       ? 
1 1 1   54    7   36 o     50.4   14.8    0.0000   0.0000          ?        ?    26.8179  15.9630          ?        ?       50.4       14.8       ?       ? 
1 1 1   54    7   37 o    237.0    3.6    0.0000   0.0000          ?        ?   563.1760  17.2401          ?        ?      237.0        3.6       ?       ? 
1 1 1   54    7   38 o     54.0   14.5    0.0000   0.0000          ?        ?    31.2876  15.9630          ?        ?       54.0       14.5       ?       ? 
1 1 1   54    7   39 o    219.2    3.9    0.0000   0.0000          ?        ?   482.0838  17.2401          ?        ?      219.2        3.9       ?       ? 
1 1 1   54    7   40 o     36.0   14.5    0.0000   0.0000          ?        ?     7.0237  15.9630          ?        ?       36.0       14.5       ?       ? 
1 1 1   54    8    0 o    168.5    5.9  285.4192  19.7942   285.4192  19.7942   285.4192  19.7942      168.5      5.9      168.5        5.9     0.0     0.0 
1 1 1   54    8    1 o    388.0    3.0    0.0000   0.0000          ?        ?  1506.2725  23.6253          ?        ?      388.0        3.0       ?       ? 
1 1 1   54    8    2 o    122.9    5.5    0.0000   0.0000          ?        ?   151.3296  13.4090          ?        ?      122.9        5.5       ?       ? 
1 1 1   54    8    3 o    207.4    3.5    0.0000   0.0000          ?        ?   430.3636  14.6860          ?        ?      207.4        3.5       ?       ? 
1 1 1   54    8    4 o    110.9    5.8    0.0000   0.0000          ?        ?   123.2347  12.7704          ?        ?      110.9        5.8       ?       ? 
1 1 1   54    8    5 o    283.1    3.5    0.0000   0.0000          ?        ?   801.9832  19.7942          ?        ?      283.1        3.5       ?       ? 
1 1 1   54    8    6 o    206.7    3.9    0.0000   0.0000          ?        ?   427.8095  15.9630          ?        ?      206.7        3.9       ?       ? 
1 1 1   54    8    7 o    189.2    3.7    0.0000   0.0000          ?        ?   358.2106  14.0475          ?        ?      189.2        3.7       ?       ? 
1 1 1   54    8    8 o    380.2    3.0    0.0000   0.0000          ?        ?  1446.2515  22.9868          ?        ?      380.2        3.0       ?       ? 
1 1 1   54    8    9 o    174.8    4.4    0.0000   0.0000          ?        ?   305.8519  15.3245          ?        ?      174.8        4.4       ?       ? 
1 1 1   54    8   10 o    239.4    3.2    0.0000   0.0000          ?        ?   573.3925  15.3245          ?        ?      239.4        3.2       ?       ? 
1 1 1   54    8   11 o    221.0    3.6    0.0000   0.0000          ?        ?   489.1075  15.9630          ?        ?      221.0        3.6       ?       ? 
1 1 1   54    8   12 o    131.9    5.8    0.0000   0.0000          ?        ?   174.3164  15.3245          ?        ?      131.9        5.8       ?       ? 
1 1 1   54    8   13 o    283.1    3.2    0.0000   0.0000          ?        ?   801.9832  17.8786          ?        ?      283.1        3.2       ?       ? 
1 1 1   54    8   14 o    179.4    4.1    0.0000   0.0000          ?        ?   322.4534  14.6860          ?        ?      179.4        4.1       ?       ? 
1 1 1   54    8   15 o    146.9    5.4    0.0000   0.0000          ?        ?   216.4588  15.9630          ?        ?      146.9        5.4       ?       ? 
1 1 1   54    8   16 o    289.7    3.3    0.0000   0.0000          ?        ?   840.2945  19.1556          ?        ?      289.7        3.3       ?       ? 
1 1 1   54    8   17 o     92.6    7.9    0.0000   0.0000          ?        ?    86.2004  14.6860          ?        ?       92.6        7.9       ?       ? 
1 1 1   54    8   18 o     35.6   13.8    0.0000   0.0000          ?        ?     8.3008  14.0475          ?        ?       35.6       13.8       ?       ? 
1 1 1   54    8   19 o     54.4   13.1    0.0000   0.0000          ?        ?    31.2876  14.0475          ?        ?       54.4       13.1       ?       ? 
1 1 1   54    8   20 o    299.1    3.2    0.0000   0.0000          ?        ?   895.2073  19.1556          ?        ?      299.1        3.2       ?       ? 
1 1 1   54    8   21 o    198.0    4.2    0.0000   0.0000          ?        ?   392.6908  16.6016          ?        ?      198.0        4.2       ?       ? 
1 1 1   54    8   22 o    331.4    3.1    0.0000   0.0000          ?        ?  1099.5342  20.4327          ?        ?      331.4        3.1       ?       ? 
1 1 1   54    8   23 o    411.1    3.0    0.0000   0.0000          ?        ?  1691.4437  24.2638          ?        ?      411.1        3.0       ?       ? 
1 1 1   54    8   24 o    225.3    3.5    0.0000   0.0000          ?        ?   508.2632  15.9630          ?        ?      225.3        3.5       ?       ? 
1 1 1   54    8   25 o    339.3    2.9    0.0000   0.0000          ?        ?  1152.5315  19.7942          ?        ?      339.3        2.9       ?       ? 
1 1 1   54    8   26 o    133.9    5.7    0.0000   0.0000          ?        ?   180.0631  15.3245          ?        ?      133.9        5.7       ?       ? 
1 1 1   54    8   27 o     70.5   11.3    0.0000   0.0000          ?        ?    50.4432  15.9630          ?        ?       70.5       11.3       ?       ? 
1 1 1   54    8   28 o    498.2    2.8    0.0000   0.0000          ?        ?  2483.8491  27.4564          ?        ?      498.2        2.8       ?       ? 
1 1 1   54    8   29 o    205.4    4.0    0.0000   0.0000          ?        ?   422.7013  16.6016          ?        ?      205.4        4.0       ?       ? 
1 1 1   54    8   30 f    227.5    3.9    0.0000   0.0000          ?        ?   518.4796  17.8786          ?        ?      227.5        3.9       ?       ? 
1 1 1   54    8   31 o    223.5    3.7    0.0000   0.0000          ?        ?   500.6010  16.6016          ?        ?      223.5        3.7       ?       ? 
1 1 1   54    8   32 o    149.8    5.8    0.0000   0.0000          ?        ?   225.3981  17.2401          ?        ?      149.8        5.8       ?       ? 
1 1 1   54    8   33 o     69.9   11.4    0.0000   0.0000          ?        ?    49.8047  15.9630          ?        ?       69.9       11.4       ?       ? 
1 1 1   54    8   34 o    102.4    8.1    0.0000   0.0000          ?        ?   105.9946  16.6016          ?        ?      102.4        8.1       ?       ? 
1 1 1   54    8   35 o    110.5    7.5    0.0000   0.0000          ?        ?   123.2347  16.6016          ?        ?      110.5        7.5       ?       ? 
1 1 1   54    8   36 o    454.4    2.7    0.0000   0.0000          ?        ?  2067.5330  24.9023          ?        ?      454.4        2.7       ?       ? 
1 1 1   54    8   37 o    218.8    3.9    0.0000   0.0000          ?        ?   480.1682  17.2401          ?        ?      218.8        3.9       ?       ? 
1 1 1   54    8   38 o    224.4    3.7    0.0000   0.0000          ?        ?   505.0706  16.6016          ?        ?      224.4        3.7       ?       ? 
1 1 1   54    8   39 o    175.4    4.9    0.0000   0.0000          ?        ?   309.0445  17.2401          ?        ?      175.4        4.9       ?       ? 
1 1 1   54    9    0 o    209.8    5.2  441.2184  21.7097   441.2184  21.7097   441.2184  21.7097      209.8      5.2      209.8        5.2     0.0     0.0 
1 1 1   54    9    1 o    110.9    5.5    0.0000   0.0000          ?        ?   123.2347  12.1319          ?        ?      110.9        5.5       ?       ? 
1 1 1   54    9    2 o    175.0    4.0    0.0000   0.0000          ?        ?   306.4904  14.0475          ?        ?      175.0        4.0       ?       ? 
1 1 1   54    9    3 o     23.3   10.9    0.0000   0.0000          ?        ?   -12.7704  12.7704          ?        ?       23.3       10.9       ?       ? 
1 1 1   54    9    4 o     93.4    6.5    0.0000   0.0000          ?        ?    87.4775  12.1319          ?        ?       93.4        6.5       ?       ? 
1 1 1   54    9    5 f    115.3    6.4    0.0000   0.0000          ?        ?   133.4510  14.6860          ?        ?      115.3        6.4       ?       ? 
1 1 1   54    9    6 o    249.4    3.3    0.0000   0.0000          ?        ?   622.5586  16.6016          ?        ?      249.4        3.3       ?       ? 
1 1 1   54    9    7 o     17.0    8.6    0.0000   0.0000          ?        ?   -37.6728  12.7704          ?        ?       17.0        8.6       ?       ? 
1 1 1   54    9    8 o    105.5    6.7    0.0000   0.0000          ?        ?   111.7413  14.0475          ?        ?      105.5        6.7       ?       ? 
1 1 1   54    9    9 o    119.7    5.6    0.0000   0.0000          ?        ?   143.6674  13.4090          ?        ?      119.7        5.6       ?       ? 
1 1 1   54    9   10 o    217.0    3.5    0.0000   0.0000          ?        ?   471.2290  15.3245          ?        ?      217.0        3.5       ?       ? 
1 1 1   54    9   11 o     50.5   12.7    0.0000   0.0000          ?        ?    26.8179  12.7704          ?        ?       50.5       12.7       ?       ? 
1 1 1   54    9   12 o    242.5    3.3    0.0000   0.0000          ?        ?   588.7169  15.9630          ?        ?      242.5        3.3       ?       ? 
1 1 1   54    9   13 o     32.0   13.3    0.0000   0.0000          ?        ?     2.5541  14.0475          ?        ?       32.0       13.3       ?       ? 
1 1 1   54    9   14 o    235.6    3.7    0.0000   0.0000          ?        ?   555.5138  17.2401          ?        ?      235.6        3.7       ?       ? 
1 1 1   54    9   15 o    168.2    4.7    0.0000   0.0000          ?        ?   283.5036  15.9630          ?        ?      168.2        4.7       ?       ? 
1 1 1   54    9   16 o    128.6    6.5    0.0000   0.0000          ?        ?   166.0156  16.6016          ?        ?      128.6        6.5       ?       ? 
1 1 1   54    9   17 o    107.9    6.5    0.0000   0.0000          ?        ?   116.8494  14.0475          ?        ?      107.9        6.5       ?       ? 
1 1 1   54    9   18 o    100.8    7.3    0.0000   0.0000          ?        ?   102.1635  14.6860          ?        ?      100.8        7.3       ?       ? 
1 1 1   54    9   19 o    158.8    4.8    0.0000   0.0000          ?        ?   252.8546  15.3245          ?        ?      158.8        4.8       ?       ? 
1 1 1   54    9   20 o    233.9    3.5    0.0000   0.0000          ?        ?   547.8516  16.6016          ?        ?      233.9        3.5       ?       ? 
1 1 1   54    9   21 o    269.1    3.2    0.0000   0.0000          ?        ?   724.7220  17.2401          ?        ?      269.1        3.2       ?       ? 
1 1 1   54    9   22 o    239.6    3.5    0.0000   0.0000          ?        ?   574.6694  16.6016          ?        ?      239.6        3.5       ?       ? 
1 1 1   54    9   23 o    349.2    2.8    0.0000   0.0000          ?        ?  1220.2148  19.7942          ?        ?      349.2        2.8       ?       ? 
1 1 1   54    9   24 f    310.7    3.0    0.0000   0.0000          ?        ?   966.0833  18.5171          ?        ?      310.7        3.0       ?       ? 
1 1 1   54    9   25 o     52.1   14.3    0.0000   0.0000          ?        ?    28.7335  15.3245          ?        ?       52.1       14.3       ?       ? 
1 1 1   54    9   26 f    283.1    3.0    0.0000   0.0000          ?        ?   802.6216  17.2401          ?        ?      283.1        3.0       ?       ? 
1 1 1   54    9   27 o    182.2    4.4    0.0000   0.0000          ?        ?   332.6698  15.9630          ?        ?      182.2        4.4       ?       ? 
1 1 1   54    9   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   54    9   29 o     17.6    8.9    0.0000   0.0000          ?        ?   -56.8284  15.9630          ?        ?       17.6        8.9       ?       ? 
1 1 1   54    9   30 o    255.4    3.5    0.0000   0.0000          ?        ?   653.2076  17.8786          ?        ?      255.4        3.5       ?       ? 
1 1 1   54    9   31 o     40.3   14.9    0.0000   0.0000          ?        ?    13.4090  15.9630          ?        ?       40.3       14.9       ?       ? 
1 1 1   54    9   32 o    206.7    4.0    0.0000   0.0000          ?        ?   428.4480  16.6016          ?        ?      206.7        4.0       ?       ? 
1 1 1   54    9   33 o     74.6   11.1    0.0000   0.0000          ?        ?    56.8284  16.6016          ?        ?       74.6       11.1       ?       ? 
1 1 1   54    9   34 o     30.7   13.4    0.0000   0.0000          ?        ?    -1.9156  15.3245          ?        ?       30.7       13.4       ?       ? 
1 1 1   54    9   35 o    165.5    4.8    0.0000   0.0000          ?        ?   275.2028  15.9630          ?        ?      165.5        4.8       ?       ? 
1 1 1   54    9   36 o    115.3    6.6    0.0000   0.0000          ?        ?   134.0895  15.3245          ?        ?      115.3        6.6       ?       ? 
1 1 1   54    9   37 o     20.4   10.1    0.0000   0.0000          ?        ?   -38.3113  15.9630          ?        ?       20.4       10.1       ?       ? 
1 1 1   54    9   38 o    181.1    4.6    0.0000   0.0000          ?        ?   329.4771  16.6016          ?        ?      181.1        4.6       ?       ? 
1 1 1   54   10    0 o    172.9    6.7  300.7437  22.9868   300.7437  22.9868   300.7437  22.9868      172.9      6.7      172.9        6.7     0.0     0.0 
1 1 1   54   10    1 o    387.4    3.2    0.0000   0.0000          ?        ?  1501.8029  24.9023          ?        ?      387.4        3.2       ?       ? 
1 1 1   54   10    2 o     78.5    7.7    0.0000   0.0000          ?        ?    61.9366  12.1319          ?        ?       78.5        7.7       ?       ? 
1 1 1   54   10    3 o    379.7    3.0    0.0000   0.0000          ?        ?  1443.0588  22.9868          ?        ?      379.7        3.0       ?       ? 
1 1 1   54   10    4 o    113.4    5.6    0.0000   0.0000          ?        ?   128.9814  12.7704          ?        ?      113.4        5.6       ?       ? 
1 1 1   54   10    5 o    167.7    4.2    0.0000   0.0000          ?        ?   281.5880  14.0475          ?        ?      167.7        4.2       ?       ? 
1 1 1   54   10    6 o    157.5    4.7    0.0000   0.0000          ?        ?   248.3849  14.6860          ?        ?      157.5        4.7       ?       ? 
1 1 1   54   10    7 o    373.6    3.2    0.0000   0.0000          ?        ?  1397.0853  23.6253          ?        ?      373.6        3.2       ?       ? 
1 1 1   54   10    8 o    179.4    4.3    0.0000   0.0000          ?        ?   322.4534  15.3245          ?        ?      179.4        4.3       ?       ? 
1 1 1   54   10    9 o     18.9    9.3    0.0000   0.0000          ?        ?   -28.0950  12.7704          ?        ?       18.9        9.3       ?       ? 
1 1 1   54   10   10 o    125.9    5.6    0.0000   0.0000          ?        ?   158.9919  14.0475          ?        ?      125.9        5.6       ?       ? 
1 1 1   54   10   11 o    181.2    4.2    0.0000   0.0000          ?        ?   328.8386  15.3245          ?        ?      181.2        4.2       ?       ? 
1 1 1   54   10   12 o     45.3   13.7    0.0000   0.0000          ?        ?    21.0712  13.4090          ?        ?       45.3       13.7       ?       ? 
1 1 1   54   10   13 o    177.5    4.3    0.0000   0.0000          ?        ?   315.4297  15.3245          ?        ?      177.5        4.3       ?       ? 
1 1 1   54   10   14 f    132.1    5.6    0.0000   0.0000          ?        ?   174.9549  14.6860          ?        ?      132.1        5.6       ?       ? 
1 1 1   54   10   15 o    291.8    3.3    0.0000   0.0000          ?        ?   852.4264  19.1556          ?        ?      291.8        3.3       ?       ? 
1 1 1   54   10   16 o     68.4   10.3    0.0000   0.0000          ?        ?    47.2506  14.0475          ?        ?       68.4       10.3       ?       ? 
1 1 1   54   10   17 o    174.9    4.4    0.0000   0.0000          ?        ?   306.4904  15.3245          ?        ?      174.9        4.4       ?       ? 
1 1 1   54   10   18 o    176.0    4.4    0.0000   0.0000          ?        ?   310.3215  15.3245          ?        ?      176.0        4.4       ?       ? 
1 1 1   54   10   19 o    172.7    4.3    0.0000   0.0000          ?        ?   298.8281  14.6860          ?        ?      172.7        4.3       ?       ? 
1 1 1   54   10   20 o    231.4    3.4    0.0000   0.0000          ?        ?   536.3582  15.9630          ?        ?      231.4        3.4       ?       ? 
1 1 1   54   10   21 o    224.3    3.8    0.0000   0.0000          ?        ?   503.7936  17.2401          ?        ?      224.3        3.8       ?       ? 
1 1 1   54   10   22 o    137.2    5.6    0.0000   0.0000          ?        ?   189.0024  15.3245          ?        ?      137.2        5.6       ?       ? 
1 1 1   54   10   23 o    133.7    5.5    0.0000   0.0000          ?        ?   179.4246  14.6860          ?        ?      133.7        5.5       ?       ? 
1 1 1   54   10   24 o     56.4   13.7    0.0000   0.0000          ?        ?    33.8416  15.3245          ?        ?       56.4       13.7       ?       ? 
1 1 1   54   10   25 o    162.4    4.7    0.0000   0.0000          ?        ?   264.3480  15.3245          ?        ?      162.4        4.7       ?       ? 
1 1 1   54   10   26 o    162.3    4.9    0.0000   0.0000          ?        ?   264.3480  15.9630          ?        ?      162.3        4.9       ?       ? 
1 1 1   54   10   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   54   10   28 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   54   10   29 o    125.2    6.1    0.0000   0.0000          ?        ?   157.7148  15.3245          ?        ?      125.2        6.1       ?       ? 
1 1 1   54   10   30 o    126.5    6.3    0.0000   0.0000          ?        ?   160.9075  15.9630          ?        ?      126.5        6.3       ?       ? 
1 1 1   54   10   31 o    340.7    2.8    0.0000   0.0000          ?        ?  1162.1094  19.1556          ?        ?      340.7        2.8       ?       ? 
1 1 1   54   10   32 o    110.5    7.5    0.0000   0.0000          ?        ?   123.2347  16.6016          ?        ?      110.5        7.5       ?       ? 
1 1 1   54   10   33 o     97.3    7.9    0.0000   0.0000          ?        ?    95.7782  15.3245          ?        ?       97.3        7.9       ?       ? 
1 1 1   54   10   34 o     20.1   10.0    0.0000   0.0000          ?        ?   -36.3957  15.3245          ?        ?       20.1       10.0       ?       ? 
1 1 1   54   10   35 o     33.1   13.7    0.0000   0.0000          ?        ?     3.8311  14.6860          ?        ?       33.1       13.7       ?       ? 
1 1 1   54   10   36 o    117.7    6.5    0.0000   0.0000          ?        ?   139.8362  15.3245          ?        ?      117.7        6.5       ?       ? 
1 1 1   54   11    0 o    303.2    4.4  920.7482  26.8179   920.7482  26.8179   920.7482  26.8179      303.2      4.4      303.2        4.4     0.0     0.0 
1 1 1   54   11    1 o    136.4    4.2    0.0000   0.0000          ?        ?   186.4483  11.4934          ?        ?      136.4        4.2       ?       ? 
1 1 1   54   11    2 o    118.6    5.4    0.0000   0.0000          ?        ?   141.1133  12.7704          ?        ?      118.6        5.4       ?       ? 
1 1 1   54   11    3 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   54   11    4 o     27.7   11.8    0.0000   0.0000          ?        ?     0.0000  11.4934          ?        ?       27.7       11.8       ?       ? 
1 1 1   54   11    5 o     88.4    7.2    0.0000   0.0000          ?        ?    78.5382  12.7704          ?        ?       88.4        7.2       ?       ? 
1 1 1   54   11    6 o    143.0    4.9    0.0000   0.0000          ?        ?   204.9654  14.0475          ?        ?      143.0        4.9       ?       ? 
1 1 1   54   11    7 o    136.6    5.1    0.0000   0.0000          ?        ?   187.0868  14.0475          ?        ?      136.6        5.1       ?       ? 
1 1 1   54   11    8 o    135.2    5.0    0.0000   0.0000          ?        ?   183.2557  13.4090          ?        ?      135.2        5.0       ?       ? 
1 1 1   54   11    9 o     35.0   13.0    0.0000   0.0000          ?        ?     9.5778  12.1319          ?        ?       35.0       13.0       ?       ? 
1 1 1   54   11   10 o     51.1   14.0    0.0000   0.0000          ?        ?    27.4564  14.6860          ?        ?       51.1       14.0       ?       ? 
1 1 1   54   11   11 o    426.0    3.7    0.0000   0.0000          ?        ?  1817.2325  31.2876          ?        ?      426.0        3.7       ?       ? 
1 1 1   54   11   12 o    245.6    3.8    0.0000   0.0000          ?        ?   604.0414  18.5171          ?        ?      245.6        3.8       ?       ? 
1 1 1   54   11   13 o    156.6    4.7    0.0000   0.0000          ?        ?   245.8308  14.6860          ?        ?      156.6        4.7       ?       ? 
1 1 1   54   11   14 o    221.4    3.7    0.0000   0.0000          ?        ?   491.0231  16.6016          ?        ?      221.4        3.7       ?       ? 
1 1 1   54   11   15 o     38.8   13.8    0.0000   0.0000          ?        ?    13.4090  13.4090          ?        ?       38.8       13.8       ?       ? 
1 1 1   54   11   16 o    191.6    4.0    0.0000   0.0000          ?        ?   367.7885  15.3245          ?        ?      191.6        4.0       ?       ? 
1 1 1   54   11   17 o    133.3    5.5    0.0000   0.0000          ?        ?   178.1475  14.6860          ?        ?      133.3        5.5       ?       ? 
1 1 1   54   11   18 o    142.9    5.8    0.0000   0.0000          ?        ?   204.9654  16.6016          ?        ?      142.9        5.8       ?       ? 
1 1 1   54   11   19 o    167.8    4.9    0.0000   0.0000          ?        ?   282.2266  16.6016          ?        ?      167.8        4.9       ?       ? 
1 1 1   54   11   20 o    360.1    2.9    0.0000   0.0000          ?        ?  1298.1145  21.0712          ?        ?      360.1        2.9       ?       ? 
1 1 1   54   11   21 o     76.6    9.6    0.0000   0.0000          ?        ?    59.3825  14.6860          ?        ?       76.6        9.6       ?       ? 
1 1 1   54   11   22 o    285.6    3.2    0.0000   0.0000          ?        ?   816.6692  18.5171          ?        ?      285.6        3.2       ?       ? 
1 1 1   54   11   23 o    154.1    5.0    0.0000   0.0000          ?        ?   238.1686  15.3245          ?        ?      154.1        5.0       ?       ? 
1 1 1   54   11   24 o    386.6    2.7    0.0000   0.0000          ?        ?  1496.0562  21.0712          ?        ?      386.6        2.7       ?       ? 
1 1 1   54   11   25 o    177.0    4.5    0.0000   0.0000          ?        ?   314.1526  15.9630          ?        ?      177.0        4.5       ?       ? 
1 1 1   54   11   26 o    204.8    3.9    0.0000   0.0000          ?        ?   420.1472  15.9630          ?        ?      204.8        3.9       ?       ? 
1 1 1   54   11   27 o    116.8    6.8    0.0000   0.0000          ?        ?   137.2822  15.9630          ?        ?      116.8        6.8       ?       ? 
1 1 1   54   11   28 o    178.9    4.5    0.0000   0.0000          ?        ?   321.1764  15.9630          ?        ?      178.9        4.5       ?       ? 
1 1 1   54   11   29 o     99.3    8.0    0.0000   0.0000          ?        ?    99.6094  15.9630          ?        ?       99.3        8.0       ?       ? 
1 1 1   54   11   30 o     18.2    9.2    0.0000   0.0000          ?        ?   -47.8891  15.3245          ?        ?       18.2        9.2       ?       ? 
1 1 1   54   11   31 o     54.5   14.0    0.0000   0.0000          ?        ?    31.9261  15.3245          ?        ?       54.5       14.0       ?       ? 
1 1 1   54   11   32 o    104.6    7.3    0.0000   0.0000          ?        ?   110.4642  15.3245          ?        ?      104.6        7.3       ?       ? 
1 1 1   54   11   33 o    188.1    4.4    0.0000   0.0000          ?        ?   355.0180  16.6016          ?        ?      188.1        4.4       ?       ? 
1 1 1   54   11   34 o     27.1   12.4    0.0000   0.0000          ?        ?   -10.2163  15.3245          ?        ?       27.1       12.4       ?       ? 
1 1 1   54   11   35 o     52.7   14.6    0.0000   0.0000          ?        ?    30.0105  15.9630          ?        ?       52.7       14.6       ?       ? 
1 1 1   54   12    0 o    209.6    4.7  440.5799  19.7942   440.5799  19.7942   440.5799  19.7942      209.6      4.7      209.6        4.7     0.0     0.0 
1 1 1   54   12    1 o    128.2    4.5    0.0000   0.0000          ?        ?   164.7386  11.4934          ?        ?      128.2        4.5       ?       ? 
1 1 1   54   12    2 o    170.3    3.7    0.0000   0.0000          ?        ?   290.5273  12.7704          ?        ?      170.3        3.7       ?       ? 
1 1 1   54   12    3 o    103.4    5.2    0.0000   0.0000          ?        ?   107.2716  10.8549          ?        ?      103.4        5.2       ?       ? 
1 1 1   54   12    4 o     57.6   10.4    0.0000   0.0000          ?        ?    34.4802  11.4934          ?        ?       57.6       10.4       ?       ? 
1 1 1   54   12    5 f     75.1    8.1    0.0000   0.0000          ?        ?    56.8284  12.1319          ?        ?       75.1        8.1       ?       ? 
1 1 1   54   12    6 o    293.5    3.4    0.0000   0.0000          ?        ?   862.6428  19.7942          ?        ?      293.5        3.4       ?       ? 
1 1 1   54   12    7 o    139.6    5.0    0.0000   0.0000          ?        ?   195.3876  14.0475          ?        ?      139.6        5.0       ?       ? 
1 1 1   54   12    8 o    164.4    4.1    0.0000   0.0000          ?        ?   270.7332  13.4090          ?        ?      164.4        4.1       ?       ? 
1 1 1   54   12    9 o    322.6    3.0    0.0000   0.0000          ?        ?  1041.4288  19.1556          ?        ?      322.6        3.0       ?       ? 
1 1 1   54   12   10 o     64.1    9.5    0.0000   0.0000          ?        ?    41.5039  12.1319          ?        ?       64.1        9.5       ?       ? 
1 1 1   54   12   11 o    174.7    4.0    0.0000   0.0000          ?        ?   305.8519  14.0475          ?        ?      174.7        4.0       ?       ? 
1 1 1   54   12   12 o     38.3   13.7    0.0000   0.0000          ?        ?    12.7704  13.4090          ?        ?       38.3       13.7       ?       ? 
1 1 1   54   12   13 o    159.6    4.8    0.0000   0.0000          ?        ?   255.4086  15.3245          ?        ?      159.6        4.8       ?       ? 
1 1 1   54   12   14 o     33.1   13.5    0.0000   0.0000          ?        ?     4.4697  14.0475          ?        ?       33.1       13.5       ?       ? 
1 1 1   54   12   15 o     23.0   10.9    0.0000   0.0000          ?        ?   -15.9630  13.4090          ?        ?       23.0       10.9       ?       ? 
1 1 1   54   12   16 o    209.7    4.0    0.0000   0.0000          ?        ?   440.5799  16.6016          ?        ?      209.7        4.0       ?       ? 
1 1 1   54   12   17 o     22.3   10.8    0.0000   0.0000          ?        ?   -23.6253  14.6860          ?        ?       22.3       10.8       ?       ? 
1 1 1   54   12   18 o     25.2   11.9    0.0000   0.0000          ?        ?   -18.5171  15.9630          ?        ?       25.2       11.9       ?       ? 
1 1 1   54   12   19 o    155.7    5.7    0.0000   0.0000          ?        ?   243.2767  17.8786          ?        ?      155.7        5.7       ?       ? 
1 1 1   54   12   20 o    103.6    7.1    0.0000   0.0000          ?        ?   107.9102  14.6860          ?        ?      103.6        7.1       ?       ? 
1 1 1   54   12   21 o    145.8    5.5    0.0000   0.0000          ?        ?   213.2662  15.9630          ?        ?      145.8        5.5       ?       ? 
1 1 1   54   12   22 o     77.4    9.5    0.0000   0.0000          ?        ?    60.6596  14.6860          ?        ?       77.4        9.5       ?       ? 
1 1 1   54   12   23 o     26.5   12.1    0.0000   0.0000          ?        ?    -8.3008  14.0475          ?        ?       26.5       12.1       ?       ? 
1 1 1   54   12   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   54   12   25 o    115.7    6.3    0.0000   0.0000          ?        ?   134.7281  14.6860          ?        ?      115.7        6.3       ?       ? 
1 1 1   54   12   26 o     24.7   11.8    0.0000   0.0000          ?        ?   -19.7942  15.9630          ?        ?       24.7       11.8       ?       ? 
1 1 1   54   12   27 o    214.9    3.9    0.0000   0.0000          ?        ?   462.9282  16.6016          ?        ?      214.9        3.9       ?       ? 
1 1 1   54   12   28 o     51.4   14.8    0.0000   0.0000          ?        ?    28.0950  15.9630          ?        ?       51.4       14.8       ?       ? 
1 1 1   54   12   29 o    149.3    5.3    0.0000   0.0000          ?        ?   224.1211  15.9630          ?        ?      149.3        5.3       ?       ? 
1 1 1   54   12   30 o    259.1    3.2    0.0000   0.0000          ?        ?   672.3633  16.6016          ?        ?      259.1        3.2       ?       ? 
1 1 1   54   12   31 o    266.9    3.2    0.0000   0.0000          ?        ?   713.8672  17.2401          ?        ?      266.9        3.2       ?       ? 
1 1 1   54   12   32 o    143.2    5.4    0.0000   0.0000          ?        ?   206.2425  15.3245          ?        ?      143.2        5.4       ?       ? 
1 1 1   54   12   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   54   13    0 o    452.0    4.9 2046.4618  44.0580  2046.4618  44.0580  2046.4618  44.0580      452.0      4.9      452.0        4.9     0.0     0.0 
1 1 1   54   13    1 o    176.1    5.1    0.0000   0.0000          ?        ?   310.9600  17.8786          ?        ?      176.1        5.1       ?       ? 
1 1 1   54   13    2 o    246.2    3.1    0.0000   0.0000          ?        ?   606.5955  15.3245          ?        ?      246.2        3.1       ?       ? 
1 1 1   54   13    3 o     57.9   11.4    0.0000   0.0000          ?        ?    35.1187  12.7704          ?        ?       57.9       11.4       ?       ? 
1 1 1   54   13    4 o    171.4    4.3    0.0000   0.0000          ?        ?   294.3585  14.6860          ?        ?      171.4        4.3       ?       ? 
1 1 1   54   13    5 o     27.8   12.6    0.0000   0.0000          ?        ?    -8.9393  15.3245          ?        ?       27.8       12.6       ?       ? 
1 1 1   54   13    6 o    159.4    4.4    0.0000   0.0000          ?        ?   254.7701  14.0475          ?        ?      159.4        4.4       ?       ? 
1 1 1   54   13    7 o    121.0    4.7    0.0000   0.0000          ?        ?   146.8600  11.4934          ?        ?      121.0        4.7       ?       ? 
1 1 1   54   13    8 o     75.1    7.6    0.0000   0.0000          ?        ?    56.8284  11.4934          ?        ?       75.1        7.6       ?       ? 
1 1 1   54   13    9 o     17.3    8.6    0.0000   0.0000          ?        ?   -31.9261  12.1319          ?        ?       17.3        8.6       ?       ? 
1 1 1   54   13   10 o    248.3    3.2    0.0000   0.0000          ?        ?   617.4504  15.9630          ?        ?      248.3        3.2       ?       ? 
1 1 1   54   13   11 o    137.1    4.9    0.0000   0.0000          ?        ?   188.3639  13.4090          ?        ?      137.1        4.9       ?       ? 
1 1 1   54   13   12 o    120.7    5.3    0.0000   0.0000          ?        ?   146.2215  12.7704          ?        ?      120.7        5.3       ?       ? 
1 1 1   54   13   13 o    323.0    3.4    0.0000   0.0000          ?        ?  1044.6215  21.7097          ?        ?      323.0        3.4       ?       ? 
1 1 1   54   13   14 o     96.3    7.0    0.0000   0.0000          ?        ?    93.2242  13.4090          ?        ?       96.3        7.0       ?       ? 
1 1 1   54   13   15 o    201.3    4.0    0.0000   0.0000          ?        ?   406.0997  15.9630          ?        ?      201.3        4.0       ?       ? 
1 1 1   54   13   16 o    143.4    5.3    0.0000   0.0000          ?        ?   206.2425  15.3245          ?        ?      143.4        5.3       ?       ? 
1 1 1   54   13   17 o     32.0   13.1    0.0000   0.0000          ?        ?     3.8311  13.4090          ?        ?       32.0       13.1       ?       ? 
1 1 1   54   13   18 o    220.8    3.9    0.0000   0.0000          ?        ?   488.4691  17.2401          ?        ?      220.8        3.9       ?       ? 
1 1 1   54   13   19 o    203.7    3.9    0.0000   0.0000          ?        ?   415.6776  15.9630          ?        ?      203.7        3.9       ?       ? 
1 1 1   54   13   20 o     58.1   12.4    0.0000   0.0000          ?        ?    35.7572  14.0475          ?        ?       58.1       12.4       ?       ? 
1 1 1   54   13   21 o    232.4    3.6    0.0000   0.0000          ?        ?   540.8278  16.6016          ?        ?      232.4        3.6       ?       ? 
1 1 1   54   13   22 o    169.6    4.7    0.0000   0.0000          ?        ?   288.6118  15.9630          ?        ?      169.6        4.7       ?       ? 
1 1 1   54   13   23 o    297.8    2.9    0.0000   0.0000          ?        ?   888.1836  17.2401          ?        ?      297.8        2.9       ?       ? 
1 1 1   54   13   24 o    284.9    3.0    0.0000   0.0000          ?        ?   812.8381  17.2401          ?        ?      284.9        3.0       ?       ? 
1 1 1   54   13   25 o    138.5    5.5    0.0000   0.0000          ?        ?   192.8335  15.3245          ?        ?      138.5        5.5       ?       ? 
1 1 1   54   13   26 o     23.1   11.2    0.0000   0.0000          ?        ?   -25.5409  15.9630          ?        ?       23.1       11.2       ?       ? 
1 1 1   54   13   27 o    253.3    3.4    0.0000   0.0000          ?        ?   642.9913  17.2401          ?        ?      253.3        3.4       ?       ? 
1 1 1   54   13   28 o    215.9    3.7    0.0000   0.0000          ?        ?   467.3978  15.9630          ?        ?      215.9        3.7       ?       ? 
1 1 1   54   13   29 o     96.0    8.0    0.0000   0.0000          ?        ?    93.2242  15.3245          ?        ?       96.0        8.0       ?       ? 
1 1 1   54   13   30 o    125.4    6.1    0.0000   0.0000          ?        ?   158.3534  15.3245          ?        ?      125.4        6.1       ?       ? 
1 1 1   54   13   31 o    172.9    4.4    0.0000   0.0000          ?        ?   300.1052  15.3245          ?        ?      172.9        4.4       ?       ? 
1 1 1   54   14    0 o     83.9   19.2   81.7308  28.0950    81.7308  28.0950    81.7308  28.0950       83.9     19.2       83.9       19.2     0.0     0.0 
1 1 1   54   14    1 o    271.7    4.5    0.0000   0.0000          ?        ?   740.0466  24.2638          ?        ?      271.7        4.5       ?       ? 
1 1 1   54   14    2 o     54.1   16.0    0.0000   0.0000          ?        ?    30.6490  18.5171          ?        ?       54.1       16.0       ?       ? 
1 1 1   54   14    3 f    267.8    4.5    0.0000   0.0000          ?        ?   718.9753  24.2638          ?        ?      267.8        4.5       ?       ? 
1 1 1   54   14    4 o    118.1    4.9    0.0000   0.0000          ?        ?   139.8362  11.4934          ?        ?      118.1        4.9       ?       ? 
1 1 1   54   14    5 o    185.5    4.0    0.0000   0.0000          ?        ?   344.8017  14.6860          ?        ?      185.5        4.0       ?       ? 
1 1 1   54   14    6 o    138.9    5.1    0.0000   0.0000          ?        ?   193.4720  14.0475          ?        ?      138.9        5.1       ?       ? 
1 1 1   54   14    7 o    260.6    3.3    0.0000   0.0000          ?        ?   680.0255  17.2401          ?        ?      260.6        3.3       ?       ? 
1 1 1   54   14    8 o    442.2    3.5    0.0000   0.0000          ?        ?  1958.3459  30.6490          ?        ?      442.2        3.5       ?       ? 
1 1 1   54   14    9 o    208.7    3.5    0.0000   0.0000          ?        ?   436.1103  14.6860          ?        ?      208.7        3.5       ?       ? 
1 1 1   54   14   10 o    301.6    3.4    0.0000   0.0000          ?        ?   911.1703  20.4327          ?        ?      301.6        3.4       ?       ? 
1 1 1   54   14   11 o    253.7    3.1    0.0000   0.0000          ?        ?   644.2683  15.9630          ?        ?      253.7        3.1       ?       ? 
1 1 1   54   14   12 f    228.3    3.2    0.0000   0.0000          ?        ?   521.6721  14.6860          ?        ?      228.3        3.2       ?       ? 
1 1 1   54   14   13 f    112.2    5.7    0.0000   0.0000          ?        ?   126.4273  12.7704          ?        ?      112.2        5.7       ?       ? 
1 1 1   54   14   14 f    142.3    4.5    0.0000   0.0000          ?        ?   203.0499  12.7704          ?        ?      142.3        4.5       ?       ? 
1 1 1   54   14   15 o    273.7    3.3    0.0000   0.0000          ?        ?   750.2629  17.8786          ?        ?      273.7        3.3       ?       ? 
1 1 1   54   14   16 o     75.8    9.3    0.0000   0.0000          ?        ?    58.1055  14.0475          ?        ?       75.8        9.3       ?       ? 
1 1 1   54   14   17 o    206.3    3.7    0.0000   0.0000          ?        ?   426.5325  15.3245          ?        ?      206.3        3.7       ?       ? 
1 1 1   54   14   18 o     93.5    7.2    0.0000   0.0000          ?        ?    88.1160  13.4090          ?        ?       93.5        7.2       ?       ? 
1 1 1   54   14   19 o    338.4    2.9    0.0000   0.0000          ?        ?  1146.7849  19.7942          ?        ?      338.4        2.9       ?       ? 
1 1 1   54   14   20 o     63.6   12.5    0.0000   0.0000          ?        ?    42.7809  15.3245          ?        ?       63.6       12.5       ?       ? 
1 1 1   54   14   21 o    265.5    3.4    0.0000   0.0000          ?        ?   706.2049  17.8786          ?        ?      265.5        3.4       ?       ? 
1 1 1   54   14   22 o    118.2    6.2    0.0000   0.0000          ?        ?   140.4748  14.6860          ?        ?      118.2        6.2       ?       ? 
1 1 1   54   14   23 o    224.6    3.6    0.0000   0.0000          ?        ?   505.7091  15.9630          ?        ?      224.6        3.6       ?       ? 
1 1 1   54   14   24 o    328.0    2.9    0.0000   0.0000          ?        ?  1077.1859  19.1556          ?        ?      328.0        2.9       ?       ? 
1 1 1   54   14   25 o    142.1    5.4    0.0000   0.0000          ?        ?   203.0499  15.3245          ?        ?      142.1        5.4       ?       ? 
1 1 1   54   14   26 o    104.3    7.0    0.0000   0.0000          ?        ?   109.8257  14.6860          ?        ?      104.3        7.0       ?       ? 
1 1 1   54   14   27 o    287.0    3.1    0.0000   0.0000          ?        ?   824.9699  17.8786          ?        ?      287.0        3.1       ?       ? 
1 1 1   54   14   28 o    179.8    4.3    0.0000   0.0000          ?        ?   324.3690  15.3245          ?        ?      179.8        4.3       ?       ? 
1 1 1   54   14   29 o     28.6   12.8    0.0000   0.0000          ?        ?    -6.3852  15.3245          ?        ?       28.6       12.8       ?       ? 
1 1 1   54   15    0 o    354.7    8.0 1264.9114  56.8284  1264.9114  56.8284  1264.9114  56.8284      354.7      8.0      354.7        8.0     0.0     0.0 
1 1 1   54   15    1 o    501.9    5.4    0.0000   0.0000          ?        ?  2527.9070  54.2743          ?        ?      501.9        5.4       ?       ? 
1 1 1   54   15    2 o    172.4    8.0    0.0000   0.0000          ?        ?   299.4666  27.4564          ?        ?      172.4        8.0       ?       ? 
1 1 1   54   15    3 o    108.8   10.6    0.0000   0.0000          ?        ?   120.0421  22.9868          ?        ?      108.8       10.6       ?       ? 
1 1 1   54   15    4 o    178.4    6.3    0.0000   0.0000          ?        ?   319.8993  22.3483          ?        ?      178.4        6.3       ?       ? 
1 1 1   54   15    5 f     70.8   15.7    0.0000   0.0000          ?        ?    53.6358  21.7097          ?        ?       70.8       15.7       ?       ? 
1 1 1   54   15    6 o    180.7    4.9    0.0000   0.0000          ?        ?   327.5616  17.8786          ?        ?      180.7        4.9       ?       ? 
1 1 1   54   15    7 o     67.4    9.9    0.0000   0.0000          ?        ?    45.9736  13.4090          ?        ?       67.4        9.9       ?       ? 
1 1 1   54   15    8 o     82.3    8.5    0.0000   0.0000          ?        ?    68.3218  14.0475          ?        ?       82.3        8.5       ?       ? 
1 1 1   54   15    9 o     94.9    7.4    0.0000   0.0000          ?        ?    90.6701  14.0475          ?        ?       94.9        7.4       ?       ? 
1 1 1   54   15   10 o    117.7    6.5    0.0000   0.0000          ?        ?   139.1977  15.3245          ?        ?      117.7        6.5       ?       ? 
1 1 1   54   15   11 o    175.9    4.9    0.0000   0.0000          ?        ?   310.3215  17.2401          ?        ?      175.9        4.9       ?       ? 
1 1 1   54   15   12 o    281.3    3.5    0.0000   0.0000          ?        ?   792.4053  19.7942          ?        ?      281.3        3.5       ?       ? 
1 1 1   54   15   13 f    305.4    3.3    0.0000   0.0000          ?        ?   934.1572  20.4327          ?        ?      305.4        3.3       ?       ? 
1 1 1   54   15   14 o    113.8    6.2    0.0000   0.0000          ?        ?   130.2584  14.0475          ?        ?      113.8        6.2       ?       ? 
1 1 1   54   15   15 o    225.4    3.4    0.0000   0.0000          ?        ?   508.9017  15.3245          ?        ?      225.4        3.4       ?       ? 
1 1 1   54   15   16 o     86.5    7.4    0.0000   0.0000          ?        ?    75.3456  12.7704          ?        ?       86.5        7.4       ?       ? 
1 1 1   54   15   17 o    188.0    4.1    0.0000   0.0000          ?        ?   354.3795  15.3245          ?        ?      188.0        4.1       ?       ? 
1 1 1   54   15   18 o    159.0    4.4    0.0000   0.0000          ?        ?   253.4931  14.0475          ?        ?      159.0        4.4       ?       ? 
1 1 1   54   15   19 o    159.9    4.8    0.0000   0.0000          ?        ?   256.6857  15.3245          ?        ?      159.9        4.8       ?       ? 
1 1 1   54   15   20 o    187.6    4.3    0.0000   0.0000          ?        ?   353.1024  15.9630          ?        ?      187.6        4.3       ?       ? 
1 1 1   54   15   21 o    345.9    3.0    0.0000   0.0000          ?        ?  1198.5051  21.0712          ?        ?      345.9        3.0       ?       ? 
1 1 1   54   15   22 o    118.4    5.9    0.0000   0.0000          ?        ?   141.1133  14.0475          ?        ?      118.4        5.9       ?       ? 
1 1 1   54   15   23 o    184.6    4.0    0.0000   0.0000          ?        ?   341.6091  14.6860          ?        ?      184.6        4.0       ?       ? 
1 1 1   54   15   24 o     34.0   13.6    0.0000   0.0000          ?        ?     6.3852  14.0475          ?        ?       34.0       13.6       ?       ? 
1 1 1   54   15   25 o    239.9    3.3    0.0000   0.0000          ?        ?   576.5850  15.9630          ?        ?      239.9        3.3       ?       ? 
1 1 1   54   15   26 o     51.1   13.5    0.0000   0.0000          ?        ?    28.0950  14.0475          ?        ?       51.1       13.5       ?       ? 
1 1 1   54   15   27 f    122.1    5.8    0.0000   0.0000          ?        ?   150.0526  14.0475          ?        ?      122.1        5.8       ?       ? 
1 1 1   54   16    0 o     68.3   24.9   63.8522  31.2876    63.8522  31.2876    63.8522  31.2876       68.3     24.9       68.3       24.9     0.0     0.0 
1 1 1   54   16    1 o    294.9    5.7    0.0000   0.0000          ?        ?   873.4976  33.8416          ?        ?      294.9        5.7       ?       ? 
1 1 1   54   16    2 o    144.0    8.4    0.0000   0.0000          ?        ?   209.4351  24.2638          ?        ?      144.0        8.4       ?       ? 
1 1 1   54   16    3 o    215.8    5.3    0.0000   0.0000          ?        ?   467.3978  22.9868          ?        ?      215.8        5.3       ?       ? 
1 1 1   54   16    4 o    125.5    8.1    0.0000   0.0000          ?        ?   158.9919  20.4327          ?        ?      125.5        8.1       ?       ? 
1 1 1   54   16    5 o     28.3   13.2    0.0000   0.0000          ?        ?   -17.2401  18.5171          ?        ?       28.3       13.2       ?       ? 
1 1 1   54   16    6 o    123.3    7.5    0.0000   0.0000          ?        ?   153.2452  18.5171          ?        ?      123.3        7.5       ?       ? 
1 1 1   54   16    7 o    128.5    7.9    0.0000   0.0000          ?        ?   166.6541  20.4327          ?        ?      128.5        7.9       ?       ? 
1 1 1   54   16    8 f     27.5   12.2    0.0000   0.0000          ?        ?    -4.4697  13.4090          ?        ?       27.5       12.2       ?       ? 
1 1 1   54   16    9 o    112.1    6.3    0.0000   0.0000          ?        ?   126.4273  14.0475          ?        ?      112.1        6.3       ?       ? 
1 1 1   54   16   10 o     23.9   11.3    0.0000   0.0000          ?        ?   -15.3245  14.0475          ?        ?       23.9       11.3       ?       ? 
1 1 1   54   16   11 o     32.1   13.5    0.0000   0.0000          ?        ?     1.9156  14.6860          ?        ?       32.1       13.5       ?       ? 
1 1 1   54   16   12 o    132.1    6.5    0.0000   0.0000          ?        ?   175.5934  17.2401          ?        ?      132.1        6.5       ?       ? 
1 1 1   54   16   13 o    171.2    5.2    0.0000   0.0000          ?        ?   294.3585  17.8786          ?        ?      171.2        5.2       ?       ? 
1 1 1   54   16   14 o    373.2    3.7    0.0000   0.0000          ?        ?  1395.8083  27.4564          ?        ?      373.2        3.7       ?       ? 
1 1 1   54   16   15 o     73.3    8.3    0.0000   0.0000          ?        ?    54.2743  12.1319          ?        ?       73.3        8.3       ?       ? 
1 1 1   54   16   16 o     31.7   12.9    0.0000   0.0000          ?        ?     4.4697  12.7704          ?        ?       31.7       12.9       ?       ? 
1 1 1   54   16   17 f    100.0    7.3    0.0000   0.0000          ?        ?   100.8864  14.6860          ?        ?      100.0        7.3       ?       ? 
1 1 1   54   16   18 o     90.6    7.7    0.0000   0.0000          ?        ?    83.0078  14.0475          ?        ?       90.6        7.7       ?       ? 
1 1 1   54   16   19 o     24.4   11.2    0.0000   0.0000          ?        ?    -9.5778  12.7704          ?        ?       24.4       11.2       ?       ? 
1 1 1   54   16   20 o     27.2   12.3    0.0000   0.0000          ?        ?    -6.3852  14.0475          ?        ?       27.2       12.3       ?       ? 
1 1 1   54   16   21 o    111.4    6.9    0.0000   0.0000          ?        ?   125.1502  15.3245          ?        ?      111.4        6.9       ?       ? 
1 1 1   54   16   22 o    120.6    5.6    0.0000   0.0000          ?        ?   146.2215  13.4090          ?        ?      120.6        5.6       ?       ? 
1 1 1   54   16   23 o     45.9   13.2    0.0000   0.0000          ?        ?    22.3483  12.7704          ?        ?       45.9       13.2       ?       ? 
1 1 1   54   16   24 o    216.1    3.4    0.0000   0.0000          ?        ?   468.0364  14.6860          ?        ?      216.1        3.4       ?       ? 
1 1 1   54   17    0 o     26.0   18.3  -32.5646  35.1187   -32.5646  35.1187   -32.5646  35.1187       26.0     18.3       26.0       18.3     0.0     0.0 
1 1 1   54   17    1 o    120.5    8.5    0.0000   0.0000          ?        ?   146.8600  20.4327          ?        ?      120.5        8.5       ?       ? 
1 1 1   54   17    2 o    301.7    5.0    0.0000   0.0000          ?        ?   913.7245  30.0105          ?        ?      301.7        5.0       ?       ? 
1 1 1   54   17    3 o     95.8   10.3    0.0000   0.0000          ?        ?    93.2242  19.7942          ?        ?       95.8       10.3       ?       ? 
1 1 1   54   17    4 o    119.1    7.8    0.0000   0.0000          ?        ?   143.0288  18.5171          ?        ?      119.1        7.8       ?       ? 
1 1 1   54   17    5 o    267.4    4.8    0.0000   0.0000          ?        ?   717.6983  25.5409          ?        ?      267.4        4.8       ?       ? 
1 1 1   54   17    6 o     99.7    9.6    0.0000   0.0000          ?        ?   100.8864  19.1556          ?        ?       99.7        9.6       ?       ? 
1 1 1   54   17    7 o    165.8    6.4    0.0000   0.0000          ?        ?   276.4799  21.0712          ?        ?      165.8        6.4       ?       ? 
1 1 1   54   17    8 o    125.7    9.4    0.0000   0.0000          ?        ?   160.2689  23.6253          ?        ?      125.7        9.4       ?       ? 
1 1 1   54   17    9 o    147.0    7.0    0.0000   0.0000          ?        ?   217.7359  20.4327          ?        ?      147.0        7.0       ?       ? 
1 1 1   54   17   10 o    273.3    3.7    0.0000   0.0000          ?        ?   748.3474  20.4327          ?        ?      273.3        3.7       ?       ? 
1 1 1   54   17   11 o    179.1    4.1    0.0000   0.0000          ?        ?   321.8149  14.6860          ?        ?      179.1        4.1       ?       ? 
1 1 1   54   17   12 o     70.3   11.4    0.0000   0.0000          ?        ?    50.4432  15.9630          ?        ?       70.3       11.4       ?       ? 
1 1 1   54   17   13 o    115.6    6.9    0.0000   0.0000          ?        ?   134.7281  15.9630          ?        ?      115.6        6.9       ?       ? 
1 1 1   54   17   14 o    137.9    6.5    0.0000   0.0000          ?        ?   191.5565  17.8786          ?        ?      137.9        6.5       ?       ? 
1 1 1   54   17   15 o    166.2    5.4    0.0000   0.0000          ?        ?   277.7569  17.8786          ?        ?      166.2        5.4       ?       ? 
1 1 1   54   17   16 o     19.6    9.9    0.0000   0.0000          ?        ?   -51.0817  17.2401          ?        ?       19.6        9.9       ?       ? 
1 1 1   54   17   17 o     28.2   12.1    0.0000   0.0000          ?        ?     0.0000  12.1319          ?        ?       28.2       12.1       ?       ? 
1 1 1   54   17   18 o    171.2    4.7    0.0000   0.0000          ?        ?   294.3585  15.9630          ?        ?      171.2        4.7       ?       ? 
1 1 1   54   17   19 o    170.6    5.1    0.0000   0.0000          ?        ?   292.4429  17.2401          ?        ?      170.6        5.1       ?       ? 
1 1 1   54   17   20 o    132.6    5.3    0.0000   0.0000          ?        ?   176.8705  14.0475          ?        ?      132.6        5.3       ?       ? 
1 1 1   54   17   21 o     19.7    9.7    0.0000   0.0000          ?        ?   -27.4564  13.4090          ?        ?       19.7        9.7       ?       ? 
1 1 1   54   18    0 o     92.9   18.1   97.0553  30.0105    97.0553  30.0105    97.0553  30.0105       92.9     18.1       92.9       18.1     0.0     0.0 
1 1 1   54   18    1 o    255.3    5.0    0.0000   0.0000          ?        ?   654.4847  25.5409          ?        ?      255.3        5.0       ?       ? 
1 1 1   54   18    2 o    188.2    5.1    0.0000   0.0000          ?        ?   355.6566  19.1556          ?        ?      188.2        5.1       ?       ? 
1 1 1   54   18    3 o    145.0    6.8    0.0000   0.0000          ?        ?   211.9892  19.7942          ?        ?      145.0        6.8       ?       ? 
1 1 1   54   18    4 o    188.5    5.9    0.0000   0.0000          ?        ?   357.5721  22.3483          ?        ?      188.5        5.9       ?       ? 
1 1 1   54   18    5 o     64.6   16.7    0.0000   0.0000          ?        ?    45.3350  21.7097          ?        ?       64.6       16.7       ?       ? 
1 1 1   54   18    6 o    131.0    8.3    0.0000   0.0000          ?        ?   173.6779  21.7097          ?        ?      131.0        8.3       ?       ? 
1 1 1   54   18    7 o    107.3    9.2    0.0000   0.0000          ?        ?   116.8494  19.7942          ?        ?      107.3        9.2       ?       ? 
1 1 1   54   18    8 o     62.0   15.1    0.0000   0.0000          ?        ?    41.5039  18.5171          ?        ?       62.0       15.1       ?       ? 
1 1 1   54   18    9 o    143.8    7.3    0.0000   0.0000          ?        ?   208.7966  21.0712          ?        ?      143.8        7.3       ?       ? 
1 1 1   54   18   10 f    197.6    5.7    0.0000   0.0000          ?        ?   392.6908  22.3483          ?        ?      197.6        5.7       ?       ? 
1 1 1   54   18   11 o    107.9    9.2    0.0000   0.0000          ?        ?   118.1265  19.7942          ?        ?      107.9        9.2       ?       ? 
1 1 1   54   18   12 o     75.4    8.0    0.0000   0.0000          ?        ?    57.4669  12.1319          ?        ?       75.4        8.0       ?       ? 
1 1 1   54   18   13 o    169.6    4.3    0.0000   0.0000          ?        ?   288.6118  14.6860          ?        ?      169.6        4.3       ?       ? 
1 1 1   54   18   14 o    145.2    5.3    0.0000   0.0000          ?        ?   211.9892  15.3245          ?        ?      145.2        5.3       ?       ? 
1 1 1   54   18   15 o    131.8    7.3    0.0000   0.0000          ?        ?   175.5934  19.1556          ?        ?      131.8        7.3       ?       ? 
1 1 1   54   18   16 o    244.7    4.3    0.0000   0.0000          ?        ?   600.8488  21.0712          ?        ?      244.7        4.3       ?       ? 
1 1 1   54   18   17 o    211.4    4.5    0.0000   0.0000          ?        ?   448.8807  19.1556          ?        ?      211.4        4.5       ?       ? 
1 1 1   54   18   18 o    167.8    5.7    0.0000   0.0000          ?        ?   283.5036  19.1556          ?        ?      167.8        5.7       ?       ? 
1 1 1   54   19    0 o    270.8    6.4  737.4925  34.4802   737.4925  34.4802   737.4925  34.4802      270.8      6.4      270.8        6.4     0.0     0.0 
1 1 1   54   19    1 o    190.8    5.4    0.0000   0.0000          ?        ?   365.8729  20.4327          ?        ?      190.8        5.4       ?       ? 
1 1 1   54   19    2 o    258.9    4.7    0.0000   0.0000          ?        ?   673.0018  24.2638          ?        ?      258.9        4.7       ?       ? 
1 1 1   54   19    3 o     61.8   16.3    0.0000   0.0000          ?        ?    41.5039  20.4327          ?        ?       61.8       16.3       ?       ? 
1 1 1   54   19    4 o    209.2    6.4    0.0000   0.0000          ?        ?   441.2184  26.8179          ?        ?      209.2        6.4       ?       ? 
1 1 1   54   19    5 o    122.1   11.0    0.0000   0.0000          ?        ?   152.6067  26.8179          ?        ?      122.1       11.0       ?       ? 
1 1 1   54   19    6 o    174.4    5.3    0.0000   0.0000          ?        ?   305.8519  18.5171          ?        ?      174.4        5.3       ?       ? 
1 1 1   54   19    7 o    173.9    5.1    0.0000   0.0000          ?        ?   303.9363  17.8786          ?        ?      173.9        5.1       ?       ? 
1 1 1   54   19    8 o     39.5   16.2    0.0000   0.0000          ?        ?     7.0237  20.4327          ?        ?       39.5       16.2       ?       ? 
1 1 1   54   19    9 o     30.2   13.9    0.0000   0.0000          ?        ?   -12.7704  19.1556          ?        ?       30.2       13.9       ?       ? 
1 1 1   54   19   10 o     34.1   15.0    0.0000   0.0000          ?        ?    -3.8311  19.7942          ?        ?       34.1       15.0       ?       ? 
1 1 1   54   19   11 o    189.6    5.9    0.0000   0.0000          ?        ?   362.0418  22.3483          ?        ?      189.6        5.9       ?       ? 
1 1 1   54   19   12 o     95.0   12.4    0.0000   0.0000          ?        ?    93.2242  23.6253          ?        ?       95.0       12.4       ?       ? 
1 1 1   54   19   13 o     70.5    8.6    0.0000   0.0000          ?        ?    50.4432  12.1319          ?        ?       70.5        8.6       ?       ? 
1 1 1   54   20    0 o     42.7   23.0   28.0950  26.8179    28.0950  26.8179    28.0950  26.8179       42.7     23.0       42.7       23.0     0.0     0.0 
1 1 1   54   20    1 o    110.0    8.1    0.0000   0.0000          ?        ?   122.5962  17.8786          ?        ?      110.0        8.1       ?       ? 
1 1 1   54   20    2 o    141.0    6.3    0.0000   0.0000          ?        ?   200.4958  17.8786          ?        ?      141.0        6.3       ?       ? 
1 1 1   54   20    3 o     73.0   11.8    0.0000   0.0000          ?        ?    54.9129  17.2401          ?        ?       73.0       11.8       ?       ? 
1 1 1   54   20    4 o     83.7   11.8    0.0000   0.0000          ?        ?    72.1529  19.7942          ?        ?       83.7       11.8       ?       ? 
1 1 1   54   20    5 o     80.4   16.1    0.0000   0.0000          ?        ?    70.2374  24.9023          ?        ?       80.4       16.1       ?       ? 
1 1 1   54   20    6 o    107.5    8.9    0.0000   0.0000          ?        ?   117.4880  19.1556          ?        ?      107.5        8.9       ?       ? 
1 1 1   55    0    0 o    156.3    8.2  246.4693  25.5409   246.4693  25.5409   246.4693  25.5409      156.3      8.2      156.3        8.2     0.0     0.0 
1 1 1   55    0    1 o    165.0    5.6  273.2873  18.5171   273.2873  18.5171   273.2873  18.5171      165.0      5.6      165.0        5.6     0.0     0.0 
1 1 1   55    0    2 o     99.7    9.1  102.1635  17.8786   102.1635  17.8786   102.1635  17.8786       99.7      9.1       99.7        9.1     0.0     0.0 
1 1 1   55    0    3 o     76.6   13.2   63.2136  18.5171    63.2136  18.5171    63.2136  18.5171       76.6     13.2       76.6       13.2     0.0     0.0 
1 1 1   55    0    4 o    173.5    6.3  302.6593  21.7097   302.6593  21.7097   302.6593  21.7097      173.5      6.3      173.5        6.3     0.0     0.0 
1 1 1   55    0    5 o     13.1    9.7  -47.8891  17.2401   -47.8891  17.2401   -47.8891  17.2401       13.1      9.7       13.1        9.7     0.0     0.0 
1 1 1   55    0    6 o    262.2    4.1  688.3264  21.7097   688.3264  21.7097   688.3264  21.7097      262.2      4.1      262.2        4.1     0.0     0.0 
1 1 1   55    0    7 o     48.7   19.6   33.2031  18.5171    33.2031  18.5171    33.2031  18.5171       48.7     19.6       48.7       19.6     0.0     0.0 
1 1 1   55    0    8 o    131.5    6.6  174.3164  17.2401   174.3164  17.2401   174.3164  17.2401      131.5      6.6      131.5        6.6     0.0     0.0 
1 1 1   55    0    9 o    402.3    4.4 1619.9293  35.1187  1619.9293  35.1187  1619.9293  35.1187      402.3      4.4      402.3        4.4     0.0     0.0 
1 1 1   55    0   10 o    388.0    4.0 1506.9110  30.6490  1506.9110  30.6490  1506.9110  30.6490      388.0      4.0      388.0        4.0     0.0     0.0 
1 1 1   55    0   11 o    266.2    4.4  709.3975  23.6253   709.3975  23.6253   709.3975  23.6253      266.2      4.4      266.2        4.4     0.0     0.0 
1 1 1   55    0   12 o     16.8   12.1  -30.6490  19.1556   -30.6490  19.1556   -30.6490  19.1556       16.8     12.1       16.8       12.1     0.0     0.0 
1 1 1   55    0   13 o    213.8    5.2  458.4586  22.3483   458.4586  22.3483   458.4586  22.3483      213.8      5.2      213.8        5.2     0.0     0.0 
1 1 1   55    0   14 o     13.3    9.9  -66.4062  20.4327   -66.4062  20.4327   -66.4062  20.4327       13.3      9.9       13.3        9.9     0.0     0.0 
1 1 1   55    0   15 o     14.1   10.5  -75.3456  22.9868   -75.3456  22.9868   -75.3456  22.9868       14.1     10.5       14.1       10.5     0.0     0.0 
1 1 1   55    0   16 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   55    0   17 o    123.0    7.3  153.2452  17.8786   153.2452  17.8786   153.2452  17.8786      123.0      7.3      123.0        7.3     0.0     0.0 
1 1 1   55    0   18 f    233.4    5.3  545.9360  24.9023   545.9360  24.9023   545.9360  24.9023      233.4      5.3      233.4        5.3     0.0     0.0 
1 1 1   55    0   19 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   55    0   20 o     13.6   10.1  -58.7440  19.7942   -58.7440  19.7942   -58.7440  19.7942       13.6     10.1       13.6       10.1     0.0     0.0 
1 1 1   55    0   21 o    126.9    8.4  163.4615  21.0712   163.4615  21.0712   163.4615  21.0712      126.9      8.4      126.9        8.4     0.0     0.0 
1 1 1   55    0   22 o     15.3   11.2  -43.4195  19.7942   -43.4195  19.7942   -43.4195  19.7942       15.3     11.2       15.3       11.2     0.0     0.0 
1 1 1   55    0   23 o     22.3   15.1   -7.6623  19.1556    -7.6623  19.1556    -7.6623  19.1556       22.3     15.1       22.3       15.1     0.0     0.0 
1 1 1   55    0   24 o    209.1    5.4  438.6643  22.3483   438.6643  22.3483   438.6643  22.3483      209.1      5.4      209.1        5.4     0.0     0.0 
1 1 1   55    0   25 o     27.9   17.5    5.1082  19.7942     5.1082  19.7942     5.1082  19.7942       27.9     17.5       27.9       17.5     0.0     0.0 
1 1 1   55    0   26 o    221.3    4.9  491.0231  21.7097   491.0231  21.7097   491.0231  21.7097      221.3      4.9      221.3        4.9     0.0     0.0 
1 1 1   55    0   27 o     33.1   19.2   14.0475  20.4327    14.0475  20.4327    14.0475  20.4327       33.1     19.2       33.1       19.2     0.0     0.0 
1 1 1   55    0   28 o    186.9    5.5  350.5484  20.4327   350.5484  20.4327   350.5484  20.4327      186.9      5.5      186.9        5.5     0.0     0.0 
1 1 1   55    0   29 o    270.7    4.6  734.2999  24.9023   734.2999  24.9023   734.2999  24.9023      270.7      4.6      270.7        4.6     0.0     0.0 
1 1 1   55    0   30 o    179.4    6.8  323.7305  24.2638   323.7305  24.2638   323.7305  24.2638      179.4      6.8      179.4        6.8     0.0     0.0 
1 1 1   55    0   31 o    155.2    7.4  243.2767  22.9868   243.2767  22.9868   243.2767  22.9868      155.2      7.4      155.2        7.4     0.0     0.0 
1 1 1   55    0   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   55    0   33 o    118.1   10.7  143.6674  24.9023   143.6674  24.9023   143.6674  24.9023      118.1     10.7      118.1       10.7     0.0     0.0 
1 1 1   55    0   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   55    0   35 o     72.6   17.8   61.9366  22.3483    61.9366  22.3483    61.9366  22.3483       72.6     17.8       72.6       17.8     0.0     0.0 
1 1 1   55    0   36 o    104.9   11.8  114.9339  24.2638   114.9339  24.2638   114.9339  24.2638      104.9     11.8      104.9       11.8     0.0     0.0 
1 1 1   55    0   37 f    153.5    7.5  238.1686  22.9868   238.1686  22.9868   238.1686  22.9868      153.5      7.5      153.5        7.5     0.0     0.0 
1 1 1   55    0   38 o     20.8   14.8  -24.9023  23.6253   -24.9023  23.6253   -24.9023  23.6253       20.8     14.8       20.8       14.8     0.0     0.0 
1 1 1   55    0   39 o     15.5   11.5  -67.0448  24.2638   -67.0448  24.2638   -67.0448  24.2638       15.5     11.5       15.5       11.5     0.0     0.0 
1 1 1   55    0   40 o     72.1   19.0   62.5751  23.6253    62.5751  23.6253    62.5751  23.6253       72.1     19.0       72.1       19.0     0.0     0.0 
1 1 1   55    0   41 o    381.1    4.3 1455.1908  32.5646  1455.1908  32.5646  1455.1908  32.5646      381.1      4.3      381.1        4.3     0.0     0.0 
1 1 1   55    0   42 o     38.1   21.7   20.4327  25.5409    20.4327  25.5409    20.4327  25.5409       38.1     21.7       38.1       21.7     0.0     0.0 
1 1 1   55    0   43 o     20.8   14.9  -28.7335  24.9023   -28.7335  24.9023   -28.7335  24.9023       20.8     14.9       20.8       14.9     0.0     0.0 
1 1 1   55    0   44 o    146.0    8.4  216.4588  24.2638   216.4588  24.2638   216.4588  24.2638      146.0      8.4      146.0        8.4     0.0     0.0 
1 1 1   55    0   45 o     15.7   11.6  -68.3218  24.9023   -68.3218  24.9023   -68.3218  24.9023       15.7     11.6       15.7       11.6     0.0     0.0 
1 1 1   55    0   46 o     16.7   12.3  -50.4432  23.6253   -50.4432  23.6253   -50.4432  23.6253       16.7     12.3       16.7       12.3     0.0     0.0 
1 1 1   55    1    0 o    307.2    4.2  945.0120  25.5409   945.0120  25.5409   945.0120  25.5409      307.2      4.2      307.2        4.2     0.0     0.0 
1 1 1   55    1    1 o    318.6    2.9    0.0000   0.0000          ?        ?  1015.8879  18.5171          ?        ?      318.6        2.9       ?       ? 
1 1 1   55    1    2 o    176.3    3.8    0.0000   0.0000          ?        ?   310.9600  13.4090          ?        ?      176.3        3.8       ?       ? 
1 1 1   55    1    3 o     45.3   13.3    0.0000   0.0000          ?        ?    21.0712  12.7704          ?        ?       45.3       13.3       ?       ? 
1 1 1   55    1    4 o    166.4    4.2    0.0000   0.0000          ?        ?   277.1184  14.0475          ?        ?      166.4        4.2       ?       ? 
1 1 1   55    1    5 o    395.5    2.8    0.0000   0.0000          ?        ?  1565.0166  22.3483          ?        ?      395.5        2.8       ?       ? 
1 1 1   55    1    6 o     86.7    7.4    0.0000   0.0000          ?        ?    75.3456  12.7704          ?        ?       86.7        7.4       ?       ? 
1 1 1   55    1    7 f     71.7    8.9    0.0000   0.0000          ?        ?    51.7203  12.7704          ?        ?       71.7        8.9       ?       ? 
1 1 1   55    1    8 o    156.7    4.5    0.0000   0.0000          ?        ?   245.8308  14.0475          ?        ?      156.7        4.5       ?       ? 
1 1 1   55    1    9 o    158.7    4.2    0.0000   0.0000          ?        ?   252.2160  13.4090          ?        ?      158.7        4.2       ?       ? 
1 1 1   55    1   10 o    382.9    3.0    0.0000   0.0000          ?        ?  1466.6842  22.9868          ?        ?      382.9        3.0       ?       ? 
1 1 1   55    1   11 o    402.4    2.9    0.0000   0.0000          ?        ?  1619.9293  22.9868          ?        ?      402.4        2.9       ?       ? 
1 1 1   55    1   12 f     47.1   13.5    0.0000   0.0000          ?        ?    22.9868  13.4090          ?        ?       47.1       13.5       ?       ? 
1 1 1   55    1   13 o    226.6    3.7    0.0000   0.0000          ?        ?   514.0099  16.6016          ?        ?      226.6        3.7       ?       ? 
1 1 1   55    1   14 o    279.6    3.1    0.0000   0.0000          ?        ?   782.1890  17.2401          ?        ?      279.6        3.1       ?       ? 
1 1 1   55    1   15 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   55    1   16 o     19.0    9.6    0.0000   0.0000          ?        ?   -51.7203  16.6016          ?        ?       19.0        9.6       ?       ? 
1 1 1   55    1   17 o    106.7    7.2    0.0000   0.0000          ?        ?   114.2954  15.3245          ?        ?      106.7        7.2       ?       ? 
1 1 1   55    1   18 o    269.9    3.2    0.0000   0.0000          ?        ?   729.1917  17.2401          ?        ?      269.9        3.2       ?       ? 
1 1 1   55    1   19 o    281.6    3.5    0.0000   0.0000          ?        ?   793.6824  19.7942          ?        ?      281.6        3.5       ?       ? 
1 1 1   55    1   20 o    283.3    2.8    0.0000   0.0000          ?        ?   803.2603  15.9630          ?        ?      283.3        2.8       ?       ? 
1 1 1   55    1   21 o    301.9    3.0    0.0000   0.0000          ?        ?   911.8089  17.8786          ?        ?      301.9        3.0       ?       ? 
1 1 1   55    1   22 o    307.0    3.0    0.0000   0.0000          ?        ?   943.0964  18.5171          ?        ?      307.0        3.0       ?       ? 
1 1 1   55    1   23 o    133.5    5.7    0.0000   0.0000          ?        ?   178.7861  15.3245          ?        ?      133.5        5.7       ?       ? 
1 1 1   55    1   24 o     44.8   13.7    0.0000   0.0000          ?        ?    20.4327  13.4090          ?        ?       44.8       13.7       ?       ? 
1 1 1   55    1   25 o    160.5    4.8    0.0000   0.0000          ?        ?   257.9627  15.3245          ?        ?      160.5        4.8       ?       ? 
1 1 1   55    1   26 o    263.3    3.2    0.0000   0.0000          ?        ?   694.0730  16.6016          ?        ?      263.3        3.2       ?       ? 
1 1 1   55    1   27 o    370.0    2.8    0.0000   0.0000          ?        ?  1369.6289  20.4327          ?        ?      370.0        2.8       ?       ? 
1 1 1   55    1   28 o    236.1    3.5    0.0000   0.0000          ?        ?   558.0679  16.6016          ?        ?      236.1        3.5       ?       ? 
1 1 1   55    1   29 f    219.4    3.8    0.0000   0.0000          ?        ?   482.0838  16.6016          ?        ?      219.4        3.8       ?       ? 
1 1 1   55    1   30 o    181.4    4.4    0.0000   0.0000          ?        ?   329.4771  15.9630          ?        ?      181.4        4.4       ?       ? 
1 1 1   55    1   31 o    109.3    7.3    0.0000   0.0000          ?        ?   120.0421  15.9630          ?        ?      109.3        7.3       ?       ? 
1 1 1   55    1   32 o    282.4    3.3    0.0000   0.0000          ?        ?   798.1520  18.5171          ?        ?      282.4        3.3       ?       ? 
1 1 1   55    1   33 o    262.2    3.4    0.0000   0.0000          ?        ?   688.3264  17.8786          ?        ?      262.2        3.4       ?       ? 
1 1 1   55    1   34 o    141.1    5.7    0.0000   0.0000          ?        ?   199.8573  15.9630          ?        ?      141.1        5.7       ?       ? 
1 1 1   55    1   35 o    173.9    4.8    0.0000   0.0000          ?        ?   303.2978  16.6016          ?        ?      173.9        4.8       ?       ? 
1 1 1   55    1   36 o     21.6   10.6    0.0000   0.0000          ?        ?   -32.5646  15.9630          ?        ?       21.6       10.6       ?       ? 
1 1 1   55    1   37 o    178.4    4.8    0.0000   0.0000          ?        ?   319.2608  17.2401          ?        ?      178.4        4.8       ?       ? 
1 1 1   55    1   38 o    276.7    3.3    0.0000   0.0000          ?        ?   766.8644  18.5171          ?        ?      276.7        3.3       ?       ? 
1 1 1   55    1   39 o     51.2   15.2    0.0000   0.0000          ?        ?    27.4564  16.6016          ?        ?       51.2       15.2       ?       ? 
1 1 1   55    1   40 o     37.4   15.2    0.0000   0.0000          ?        ?     6.3852  17.8786          ?        ?       37.4       15.2       ?       ? 
1 1 1   55    1   41 o     42.0   15.3    0.0000   0.0000          ?        ?    15.3245  16.6016          ?        ?       42.0       15.3       ?       ? 
1 1 1   55    1   42 o    133.3    6.2    0.0000   0.0000          ?        ?   178.7861  16.6016          ?        ?      133.3        6.2       ?       ? 
1 1 1   55    1   43 o    131.5    6.8    0.0000   0.0000          ?        ?   174.3164  17.8786          ?        ?      131.5        6.8       ?       ? 
1 1 1   55    1   44 o    162.1    5.7    0.0000   0.0000          ?        ?   264.3480  18.5171          ?        ?      162.1        5.7       ?       ? 
1 1 1   55    1   45 o     22.3   10.9    0.0000   0.0000          ?        ?   -31.9261  16.6016          ?        ?       22.3       10.9       ?       ? 
1 1 1   55    2    0 f     23.8   15.4    0.6385  16.6016     0.6385  16.6016     0.6385  16.6016       23.8     15.4       23.8       15.4     0.0     0.0 
1 1 1   55    2    1 o     30.1   12.4    0.0000   0.0000          ?        ?     2.5541  12.1319          ?        ?       30.1       12.4       ?       ? 
1 1 1   55    2    2 o    138.3    4.6    0.0000   0.0000          ?        ?   191.5565  12.7704          ?        ?      138.3        4.6       ?       ? 
1 1 1   55    2    3 o    315.8    2.9    0.0000   0.0000          ?        ?   998.0093  18.5171          ?        ?      315.8        2.9       ?       ? 
1 1 1   55    2    4 o    104.1    6.1    0.0000   0.0000          ?        ?   108.5487  12.7704          ?        ?      104.1        6.1       ?       ? 
1 1 1   55    2    5 o    518.9    3.0    0.0000   0.0000          ?        ?  2694.5613  31.2876          ?        ?      518.9        3.0       ?       ? 
1 1 1   55    2    6 o    406.2    2.8    0.0000   0.0000          ?        ?  1650.5784  22.3483          ?        ?      406.2        2.8       ?       ? 
1 1 1   55    2    7 o    131.9    4.8    0.0000   0.0000          ?        ?   174.3164  12.7704          ?        ?      131.9        4.8       ?       ? 
1 1 1   55    2    8 o    144.2    4.4    0.0000   0.0000          ?        ?   208.1580  12.7704          ?        ?      144.2        4.4       ?       ? 
1 1 1   55    2    9 o    400.0    2.9    0.0000   0.0000          ?        ?  1600.7737  22.9868          ?        ?      400.0        2.9       ?       ? 
1 1 1   55    2   10 o     31.0   13.1    0.0000   0.0000          ?        ?     0.6385  14.0475          ?        ?       31.0       13.1       ?       ? 
1 1 1   55    2   11 f    118.1    5.4    0.0000   0.0000          ?        ?   139.8362  12.7704          ?        ?      118.1        5.4       ?       ? 
1 1 1   55    2   12 o    197.1    3.7    0.0000   0.0000          ?        ?   388.8597  14.6860          ?        ?      197.1        3.7       ?       ? 
1 1 1   55    2   13 o    125.7    5.6    0.0000   0.0000          ?        ?   158.3534  14.0475          ?        ?      125.7        5.6       ?       ? 
1 1 1   55    2   14 o    177.3    4.1    0.0000   0.0000          ?        ?   314.7912  14.6860          ?        ?      177.3        4.1       ?       ? 
1 1 1   55    2   15 o     17.0    8.6    0.0000   0.0000          ?        ?   -42.7809  13.4090          ?        ?       17.0        8.6       ?       ? 
1 1 1   55    2   16 o     42.6   14.7    0.0000   0.0000          ?        ?    16.6016  15.3245          ?        ?       42.6       14.7       ?       ? 
1 1 1   55    2   17 o     62.8   14.1    0.0000   0.0000          ?        ?    41.5039  17.2401          ?        ?       62.8       14.1       ?       ? 
1 1 1   55    2   18 o    170.0    4.3    0.0000   0.0000          ?        ?   289.2503  14.6860          ?        ?      170.0        4.3       ?       ? 
1 1 1   55    2   19 o    127.7    5.8    0.0000   0.0000          ?        ?   163.4615  14.6860          ?        ?      127.7        5.8       ?       ? 
1 1 1   55    2   20 o    291.4    3.1    0.0000   0.0000          ?        ?   849.8723  17.8786          ?        ?      291.4        3.1       ?       ? 
1 1 1   55    2   21 o    271.6    3.2    0.0000   0.0000          ?        ?   738.1310  17.2401          ?        ?      271.6        3.2       ?       ? 
1 1 1   55    2   22 o    114.2    6.4    0.0000   0.0000          ?        ?   130.8969  14.6860          ?        ?      114.2        6.4       ?       ? 
1 1 1   55    2   23 o    291.9    3.0    0.0000   0.0000          ?        ?   852.4264  17.2401          ?        ?      291.9        3.0       ?       ? 
1 1 1   55    2   24 o     53.4   14.1    0.0000   0.0000          ?        ?    30.0105  15.3245          ?        ?       53.4       14.1       ?       ? 
1 1 1   55    2   25 o     80.8    8.7    0.0000   0.0000          ?        ?    65.7677  14.0475          ?        ?       80.8        8.7       ?       ? 
1 1 1   55    2   26 o    212.2    3.9    0.0000   0.0000          ?        ?   450.7963  16.6016          ?        ?      212.2        3.9       ?       ? 
1 1 1   55    2   27 o    205.5    3.7    0.0000   0.0000          ?        ?   422.7013  15.3245          ?        ?      205.5        3.7       ?       ? 
1 1 1   55    2   28 o    403.7    2.7    0.0000   0.0000          ?        ?  1630.7842  21.7097          ?        ?      403.7        2.7       ?       ? 
1 1 1   55    2   29 o    172.3    4.6    0.0000   0.0000          ?        ?   297.5511  15.9630          ?        ?      172.3        4.6       ?       ? 
1 1 1   55    2   30 f     18.0    9.1    0.0000   0.0000          ?        ?   -54.2743  15.9630          ?        ?       18.0        9.1       ?       ? 
1 1 1   55    2   31 o     97.2    8.5    0.0000   0.0000          ?        ?    95.1397  16.6016          ?        ?       97.2        8.5       ?       ? 
1 1 1   55    2   32 o    159.2    5.0    0.0000   0.0000          ?        ?   254.1316  15.9630          ?        ?      159.2        5.0       ?       ? 
1 1 1   55    2   33 o    311.8    3.0    0.0000   0.0000          ?        ?   973.1069  18.5171          ?        ?      311.8        3.0       ?       ? 
1 1 1   55    2   34 o    143.6    5.8    0.0000   0.0000          ?        ?   206.8810  16.6016          ?        ?      143.6        5.8       ?       ? 
1 1 1   55    2   35 o    145.9    5.9    0.0000   0.0000          ?        ?   213.9047  17.2401          ?        ?      145.9        5.9       ?       ? 
1 1 1   55    2   36 o    229.9    3.7    0.0000   0.0000          ?        ?   529.3344  17.2401          ?        ?      229.9        3.7       ?       ? 
1 1 1   55    2   37 o     28.5   12.9    0.0000   0.0000          ?        ?    -8.9393  15.9630          ?        ?       28.5       12.9       ?       ? 
1 1 1   55    2   38 o     85.2    9.4    0.0000   0.0000          ?        ?    73.4300  15.9630          ?        ?       85.2        9.4       ?       ? 
1 1 1   55    2   39 o    161.1    5.4    0.0000   0.0000          ?        ?   260.5168  17.2401          ?        ?      161.1        5.4       ?       ? 
1 1 1   55    2   40 o     79.2   10.5    0.0000   0.0000          ?        ?    63.8522  16.6016          ?        ?       79.2       10.5       ?       ? 
1 1 1   55    2   41 o     21.7   10.7    0.0000   0.0000          ?        ?   -35.1187  16.6016          ?        ?       21.7       10.7       ?       ? 
1 1 1   55    2   42 o     61.1   14.3    0.0000   0.0000          ?        ?    40.2269  17.2401          ?        ?       61.1       14.3       ?       ? 
1 1 1   55    2   43 o    150.5    5.5    0.0000   0.0000          ?        ?   227.9522  16.6016          ?        ?      150.5        5.5       ?       ? 
1 1 1   55    2   44 o     21.1   10.5    0.0000   0.0000          ?        ?   -41.5039  17.2401          ?        ?       21.1       10.5       ?       ? 
1 1 1   55    3    0 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   55    3    1 o    111.5    5.7    0.0000   0.0000          ?        ?   124.5117  12.7704          ?        ?      111.5        5.7       ?       ? 
1 1 1   55    3    2 o    371.4    3.1    0.0000   0.0000          ?        ?  1379.8452  22.9868          ?        ?      371.4        3.1       ?       ? 
1 1 1   55    3    3 o    208.6    3.4    0.0000   0.0000          ?        ?   435.4717  14.0475          ?        ?      208.6        3.4       ?       ? 
1 1 1   55    3    4 o    107.4    5.9    0.0000   0.0000          ?        ?   115.5724  12.7704          ?        ?      107.4        5.9       ?       ? 
1 1 1   55    3    5 o    486.5    3.2    0.0000   0.0000          ?        ?  2368.2766  31.2876          ?        ?      486.5        3.2       ?       ? 
1 1 1   55    3    6 o    348.0    3.2    0.0000   0.0000          ?        ?  1211.9141  22.3483          ?        ?      348.0        3.2       ?       ? 
1 1 1   55    3    7 o    257.1    3.2    0.0000   0.0000          ?        ?   661.5084  16.6016          ?        ?      257.1        3.2       ?       ? 
1 1 1   55    3    8 o    343.3    3.0    0.0000   0.0000          ?        ?  1179.3494  20.4327          ?        ?      343.3        3.0       ?       ? 
1 1 1   55    3    9 o    160.3    4.2    0.0000   0.0000          ?        ?   257.3242  13.4090          ?        ?      160.3        4.2       ?       ? 
1 1 1   55    3   10 o     76.9    8.7    0.0000   0.0000          ?        ?    59.3825  13.4090          ?        ?       76.9        8.7       ?       ? 
1 1 1   55    3   11 o    187.1    4.1    0.0000   0.0000          ?        ?   350.5484  15.3245          ?        ?      187.1        4.1       ?       ? 
1 1 1   55    3   12 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   55    3   13 o     64.6   11.8    0.0000   0.0000          ?        ?    43.4195  14.6860          ?        ?       64.6       11.8       ?       ? 
1 1 1   55    3   14 o    161.3    4.9    0.0000   0.0000          ?        ?   260.5168  15.9630          ?        ?      161.3        4.9       ?       ? 
1 1 1   55    3   15 o    277.7    3.3    0.0000   0.0000          ?        ?   771.9727  18.5171          ?        ?      277.7        3.3       ?       ? 
1 1 1   55    3   16 o    140.5    5.5    0.0000   0.0000          ?        ?   197.9417  15.3245          ?        ?      140.5        5.5       ?       ? 
1 1 1   55    3   17 o    252.5    3.2    0.0000   0.0000          ?        ?   637.8831  15.9630          ?        ?      252.5        3.2       ?       ? 
1 1 1   55    3   18 o    224.3    3.6    0.0000   0.0000          ?        ?   503.7936  15.9630          ?        ?      224.3        3.6       ?       ? 
1 1 1   55    3   19 o    248.3    3.3    0.0000   0.0000          ?        ?   616.8119  16.6016          ?        ?      248.3        3.3       ?       ? 
1 1 1   55    3   20 o    165.4    4.4    0.0000   0.0000          ?        ?   273.9258  14.6860          ?        ?      165.4        4.4       ?       ? 
1 1 1   55    3   21 o    262.9    3.2    0.0000   0.0000          ?        ?   691.5189  16.6016          ?        ?      262.9        3.2       ?       ? 
1 1 1   55    3   22 o    400.0    2.8    0.0000   0.0000          ?        ?  1600.7737  22.3483          ?        ?      400.0        2.8       ?       ? 
1 1 1   55    3   23 o    181.0    4.6    0.0000   0.0000          ?        ?   328.2001  16.6016          ?        ?      181.0        4.6       ?       ? 
1 1 1   55    3   24 o     60.3   13.1    0.0000   0.0000          ?        ?    38.3113  15.3245          ?        ?       60.3       13.1       ?       ? 
1 1 1   55    3   25 o    260.6    3.4    0.0000   0.0000          ?        ?   680.0255  17.8786          ?        ?      260.6        3.4       ?       ? 
1 1 1   55    3   26 o    129.1    6.2    0.0000   0.0000          ?        ?   167.2927  15.9630          ?        ?      129.1        6.2       ?       ? 
1 1 1   55    3   27 o    104.8    7.6    0.0000   0.0000          ?        ?   110.4642  15.9630          ?        ?      104.8        7.6       ?       ? 
1 1 1   55    3   28 o    128.4    6.0    0.0000   0.0000          ?        ?   165.3771  15.3245          ?        ?      128.4        6.0       ?       ? 
1 1 1   55    3   29 f    184.5    4.5    0.0000   0.0000          ?        ?   340.9706  16.6016          ?        ?      184.5        4.5       ?       ? 
1 1 1   55    3   30 o     19.8    9.9    0.0000   0.0000          ?        ?   -38.3113  15.3245          ?        ?       19.8        9.9       ?       ? 
1 1 1   55    3   31 o    183.4    4.4    0.0000   0.0000          ?        ?   337.1394  15.9630          ?        ?      183.4        4.4       ?       ? 
1 1 1   55    3   32 o    240.5    3.7    0.0000   0.0000          ?        ?   579.1391  17.8786          ?        ?      240.5        3.7       ?       ? 
1 1 1   55    3   33 o    280.4    3.2    0.0000   0.0000          ?        ?   787.2972  17.8786          ?        ?      280.4        3.2       ?       ? 
1 1 1   55    3   34 o    118.5    6.7    0.0000   0.0000          ?        ?   141.1133  15.9630          ?        ?      118.5        6.7       ?       ? 
1 1 1   55    3   35 o     22.3   10.9    0.0000   0.0000          ?        ?   -29.3720  15.9630          ?        ?       22.3       10.9       ?       ? 
1 1 1   55    3   36 o     18.9    9.5    0.0000   0.0000          ?        ?   -47.2506  15.9630          ?        ?       18.9        9.5       ?       ? 
1 1 1   55    3   37 o     36.2   14.5    0.0000   0.0000          ?        ?     7.0237  15.9630          ?        ?       36.2       14.5       ?       ? 
1 1 1   55    3   38 o     20.9   10.4    0.0000   0.0000          ?        ?   -43.4195  17.2401          ?        ?       20.9       10.4       ?       ? 
1 1 1   55    3   39 o    192.4    4.6    0.0000   0.0000          ?        ?   371.6196  17.8786          ?        ?      192.4        4.6       ?       ? 
1 1 1   55    3   40 o    211.7    4.2    0.0000   0.0000          ?        ?   449.5192  17.8786          ?        ?      211.7        4.2       ?       ? 
1 1 1   55    3   41 o     57.6   14.9    0.0000   0.0000          ?        ?    35.7572  17.2401          ?        ?       57.6       14.9       ?       ? 
1 1 1   55    3   42 o    190.9    4.3    0.0000   0.0000          ?        ?   365.8729  16.6016          ?        ?      190.9        4.3       ?       ? 
1 1 1   55    3   43 o    215.8    4.0    0.0000   0.0000          ?        ?   467.3978  17.2401          ?        ?      215.8        4.0       ?       ? 
1 1 1   55    4    0 o    259.6    4.7  674.9174  24.2638   674.9174  24.2638   674.9174  24.2638      259.6      4.7      259.6        4.7     0.0     0.0 
1 1 1   55    4    1 o    204.9    4.1    0.0000   0.0000          ?        ?   420.1472  16.6016          ?        ?      204.9        4.1       ?       ? 
1 1 1   55    4    2 o     24.1   11.2    0.0000   0.0000          ?        ?   -10.8549  12.7704          ?        ?       24.1       11.2       ?       ? 
1 1 1   55    4    3 o    139.0    4.8    0.0000   0.0000          ?        ?   193.4720  13.4090          ?        ?      139.0        4.8       ?       ? 
1 1 1   55    4    4 o    269.8    3.1    0.0000   0.0000          ?        ?   728.5532  16.6016          ?        ?      269.8        3.1       ?       ? 
1 1 1   55    4    5 o    398.3    3.0    0.0000   0.0000          ?        ?  1587.3647  23.6253          ?        ?      398.3        3.0       ?       ? 
1 1 1   55    4    6 o    424.4    3.1    0.0000   0.0000          ?        ?  1801.9081  26.1794          ?        ?      424.4        3.1       ?       ? 
1 1 1   55    4    7 o    411.2    3.1    0.0000   0.0000          ?        ?  1692.0823  25.5409          ?        ?      411.2        3.1       ?       ? 
1 1 1   55    4    8 o    124.7    5.6    0.0000   0.0000          ?        ?   155.7993  14.0475          ?        ?      124.7        5.6       ?       ? 
1 1 1   55    4    9 o    286.5    3.2    0.0000   0.0000          ?        ?   821.1389  18.5171          ?        ?      286.5        3.2       ?       ? 
1 1 1   55    4   10 o    430.3    2.8    0.0000   0.0000          ?        ?  1852.9899  24.2638          ?        ?      430.3        2.8       ?       ? 
1 1 1   55    4   11 o    306.8    3.1    0.0000   0.0000          ?        ?   941.8194  19.1556          ?        ?      306.8        3.1       ?       ? 
1 1 1   55    4   12 o    662.4    3.5    0.0000   0.0000          ?        ?  4391.7515  46.6121          ?        ?      662.4        3.5       ?       ? 
1 1 1   55    4   13 f    315.5    2.9    0.0000   0.0000          ?        ?   996.0938  18.5171          ?        ?      315.5        2.9       ?       ? 
1 1 1   55    4   14 o    252.1    3.5    0.0000   0.0000          ?        ?   635.9675  17.8786          ?        ?      252.1        3.5       ?       ? 
1 1 1   55    4   15 o    109.4    7.0    0.0000   0.0000          ?        ?   120.0421  15.3245          ?        ?      109.4        7.0       ?       ? 
1 1 1   55    4   16 o    170.2    4.1    0.0000   0.0000          ?        ?   289.8888  14.0475          ?        ?      170.2        4.1       ?       ? 
1 1 1   55    4   17 o    243.6    3.4    0.0000   0.0000          ?        ?   593.8251  16.6016          ?        ?      243.6        3.4       ?       ? 
1 1 1   55    4   18 o    315.5    3.1    0.0000   0.0000          ?        ?   996.0938  19.7942          ?        ?      315.5        3.1       ?       ? 
1 1 1   55    4   19 o    254.3    3.5    0.0000   0.0000          ?        ?   647.4609  17.8786          ?        ?      254.3        3.5       ?       ? 
1 1 1   55    4   20 o    314.7    3.0    0.0000   0.0000          ?        ?   990.9855  19.1556          ?        ?      314.7        3.0       ?       ? 
1 1 1   55    4   21 o    131.4    5.6    0.0000   0.0000          ?        ?   173.0394  14.6860          ?        ?      131.4        5.6       ?       ? 
1 1 1   55    4   22 f     63.2   13.5    0.0000   0.0000          ?        ?    42.1424  16.6016          ?        ?       63.2       13.5       ?       ? 
1 1 1   55    4   23 o     34.3   14.2    0.0000   0.0000          ?        ?     3.1926  15.9630          ?        ?       34.3       14.2       ?       ? 
1 1 1   55    4   24 o    245.1    3.5    0.0000   0.0000          ?        ?   601.4874  17.2401          ?        ?      245.1        3.5       ?       ? 
1 1 1   55    4   25 o    217.2    3.8    0.0000   0.0000          ?        ?   472.5060  16.6016          ?        ?      217.2        3.8       ?       ? 
1 1 1   55    4   26 o    332.9    3.0    0.0000   0.0000          ?        ?  1109.1121  19.7942          ?        ?      332.9        3.0       ?       ? 
1 1 1   55    4   27 o    160.6    5.0    0.0000   0.0000          ?        ?   258.6013  15.9630          ?        ?      160.6        5.0       ?       ? 
1 1 1   55    4   28 o    193.4    4.0    0.0000   0.0000          ?        ?   374.8122  15.3245          ?        ?      193.4        4.0       ?       ? 
1 1 1   55    4   29 o    165.1    4.8    0.0000   0.0000          ?        ?   273.2873  15.9630          ?        ?      165.1        4.8       ?       ? 
1 1 1   55    4   30 o     63.7   13.0    0.0000   0.0000          ?        ?    42.7809  15.9630          ?        ?       63.7       13.0       ?       ? 
1 1 1   55    4   31 o    257.3    3.4    0.0000   0.0000          ?        ?   662.7855  17.2401          ?        ?      257.3        3.4       ?       ? 
1 1 1   55    4   32 f    481.0    2.7    0.0000   0.0000          ?        ?  2315.2795  25.5409          ?        ?      481.0        2.7       ?       ? 
1 1 1   55    4   33 o    273.8    3.3    0.0000   0.0000          ?        ?   750.9014  17.8786          ?        ?      273.8        3.3       ?       ? 
1 1 1   55    4   34 o     84.9    9.0    0.0000   0.0000          ?        ?    72.7915  15.3245          ?        ?       84.9        9.0       ?       ? 
1 1 1   55    4   35 o    217.1    4.0    0.0000   0.0000          ?        ?   472.5060  17.2401          ?        ?      217.1        4.0       ?       ? 
1 1 1   55    4   36 o     19.2    9.6    0.0000   0.0000          ?        ?   -45.9736  15.9630          ?        ?       19.2        9.6       ?       ? 
1 1 1   55    4   37 f     27.0   12.6    0.0000   0.0000          ?        ?   -14.6860  16.6016          ?        ?       27.0       12.6       ?       ? 
1 1 1   55    4   38 o    157.2    5.5    0.0000   0.0000          ?        ?   248.3849  17.2401          ?        ?      157.2        5.5       ?       ? 
1 1 1   55    4   39 o     60.8   13.5    0.0000   0.0000          ?        ?    39.5883  15.9630          ?        ?       60.8       13.5       ?       ? 
1 1 1   55    4   40 o     30.8   13.5    0.0000   0.0000          ?        ?    -3.1926  15.9630          ?        ?       30.8       13.5       ?       ? 
1 1 1   55    4   41 o    179.7    4.8    0.0000   0.0000          ?        ?   324.3690  17.2401          ?        ?      179.7        4.8       ?       ? 
1 1 1   55    4   42 o     95.8    8.7    0.0000   0.0000          ?        ?    93.2242  16.6016          ?        ?       95.8        8.7       ?       ? 
1 1 1   55    5    0 o    375.3    4.5 1409.8557  33.8416  1409.8557  33.8416  1409.8557  33.8416      375.3      4.5      375.3        4.5     0.0     0.0 
1 1 1   55    5    1 o    222.1    3.6    0.0000   0.0000          ?        ?   493.5772  15.9630          ?        ?      222.1        3.6       ?       ? 
1 1 1   55    5    2 o    188.5    3.7    0.0000   0.0000          ?        ?   355.6566  14.0475          ?        ?      188.5        3.7       ?       ? 
1 1 1   55    5    3 o     58.6   11.3    0.0000   0.0000          ?        ?    35.7572  12.7704          ?        ?       58.6       11.3       ?       ? 
1 1 1   55    5    4 o    246.3    3.4    0.0000   0.0000          ?        ?   607.2341  16.6016          ?        ?      246.3        3.4       ?       ? 
1 1 1   55    5    5 o    186.3    3.9    0.0000   0.0000          ?        ?   347.3558  14.6860          ?        ?      186.3        3.9       ?       ? 
1 1 1   55    5    6 o    174.8    4.0    0.0000   0.0000          ?        ?   305.8519  14.0475          ?        ?      174.8        4.0       ?       ? 
1 1 1   55    5    7 o    162.5    4.3    0.0000   0.0000          ?        ?   264.3480  14.0475          ?        ?      162.5        4.3       ?       ? 
1 1 1   55    5    8 f    154.4    5.0    0.0000   0.0000          ?        ?   238.8071  15.3245          ?        ?      154.4        5.0       ?       ? 
1 1 1   55    5    9 o    207.5    3.8    0.0000   0.0000          ?        ?   431.0021  15.9630          ?        ?      207.5        3.8       ?       ? 
1 1 1   55    5   10 o    186.1    4.1    0.0000   0.0000          ?        ?   346.7172  15.3245          ?        ?      186.1        4.1       ?       ? 
1 1 1   55    5   11 o     69.4    9.7    0.0000   0.0000          ?        ?    48.5276  13.4090          ?        ?       69.4        9.7       ?       ? 
1 1 1   55    5   12 o    271.6    3.1    0.0000   0.0000          ?        ?   738.1310  16.6016          ?        ?      271.6        3.1       ?       ? 
1 1 1   55    5   13 o    286.9    3.0    0.0000   0.0000          ?        ?   823.6929  17.2401          ?        ?      286.9        3.0       ?       ? 
1 1 1   55    5   14 o    215.6    3.6    0.0000   0.0000          ?        ?   465.4823  15.3245          ?        ?      215.6        3.6       ?       ? 
1 1 1   55    5   15 o    184.9    4.3    0.0000   0.0000          ?        ?   342.2476  15.9630          ?        ?      184.9        4.3       ?       ? 
1 1 1   55    5   16 o    361.6    3.0    0.0000   0.0000          ?        ?  1308.3308  21.7097          ?        ?      361.6        3.0       ?       ? 
1 1 1   55    5   17 o    189.8    3.7    0.0000   0.0000          ?        ?   360.7647  14.0475          ?        ?      189.8        3.7       ?       ? 
1 1 1   55    5   18 o     19.8    9.9    0.0000   0.0000          ?        ?   -38.3113  15.3245          ?        ?       19.8        9.9       ?       ? 
1 1 1   55    5   19 o     19.2    9.6    0.0000   0.0000          ?        ?   -42.1424  15.3245          ?        ?       19.2        9.6       ?       ? 
1 1 1   55    5   20 o    200.7    4.5    0.0000   0.0000          ?        ?   403.5457  17.8786          ?        ?      200.7        4.5       ?       ? 
1 1 1   55    5   21 o    107.6    6.8    0.0000   0.0000          ?        ?   116.2109  14.6860          ?        ?      107.6        6.8       ?       ? 
1 1 1   55    5   22 f     46.6   14.0    0.0000   0.0000          ?        ?    22.3483  14.0475          ?        ?       46.6       14.0       ?       ? 
1 1 1   55    5   23 o     19.8    9.8    0.0000   0.0000          ?        ?   -34.4802  14.6860          ?        ?       19.8        9.8       ?       ? 
1 1 1   55    5   24 o    158.8    4.8    0.0000   0.0000          ?        ?   252.8546  15.3245          ?        ?      158.8        4.8       ?       ? 
1 1 1   55    5   25 o    230.5    3.6    0.0000   0.0000          ?        ?   531.8885  16.6016          ?        ?      230.5        3.6       ?       ? 
1 1 1   55    5   26 o    203.4    3.9    0.0000   0.0000          ?        ?   414.4005  15.9630          ?        ?      203.4        3.9       ?       ? 
1 1 1   55    5   27 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   55    5   28 o    138.6    6.0    0.0000   0.0000          ?        ?   192.8335  16.6016          ?        ?      138.6        6.0       ?       ? 
1 1 1   55    5   29 o     72.7   11.4    0.0000   0.0000          ?        ?    53.6358  16.6016          ?        ?       72.7       11.4       ?       ? 
1 1 1   55    5   30 o    162.8    4.7    0.0000   0.0000          ?        ?   265.6250  15.3245          ?        ?      162.8        4.7       ?       ? 
1 1 1   55    5   31 o     87.9    8.7    0.0000   0.0000          ?        ?    77.8996  15.3245          ?        ?       87.9        8.7       ?       ? 
1 1 1   55    5   32 o     18.5    9.3    0.0000   0.0000          ?        ?   -45.9736  15.3245          ?        ?       18.5        9.3       ?       ? 
1 1 1   55    5   33 o    217.4    4.0    0.0000   0.0000          ?        ?   473.7830  17.2401          ?        ?      217.4        4.0       ?       ? 
1 1 1   55    5   34 o     34.8   14.3    0.0000   0.0000          ?        ?     4.4697  15.9630          ?        ?       34.8       14.3       ?       ? 
1 1 1   55    5   35 o     24.4   11.7    0.0000   0.0000          ?        ?   -21.0712  15.9630          ?        ?       24.4       11.7       ?       ? 
1 1 1   55    5   36 o    163.6    5.3    0.0000   0.0000          ?        ?   268.8176  17.2401          ?        ?      163.6        5.3       ?       ? 
1 1 1   55    5   37 o     34.9   14.5    0.0000   0.0000          ?        ?     3.8311  16.6016          ?        ?       34.9       14.5       ?       ? 
1 1 1   55    5   38 o    122.0    6.8    0.0000   0.0000          ?        ?   150.0526  16.6016          ?        ?      122.0        6.8       ?       ? 
1 1 1   55    5   39 o    146.0    5.7    0.0000   0.0000          ?        ?   214.5433  16.6016          ?        ?      146.0        5.7       ?       ? 
1 1 1   55    5   40 f    272.9    3.3    0.0000   0.0000          ?        ?   746.4318  17.8786          ?        ?      272.9        3.3       ?       ? 
1 1 1   55    5   41 o     35.1   14.5    0.0000   0.0000          ?        ?     4.4697  16.6016          ?        ?       35.1       14.5       ?       ? 
1 1 1   55    6    0 o    336.2    4.4 1131.4603  29.3720  1131.4603  29.3720  1131.4603  29.3720      336.2      4.4      336.2        4.4     0.0     0.0 
1 1 1   55    6    1 o    144.6    4.9    0.0000   0.0000          ?        ?   209.4351  14.0475          ?        ?      144.6        4.9       ?       ? 
1 1 1   55    6    2 o    185.2    4.1    0.0000   0.0000          ?        ?   343.5246  15.3245          ?        ?      185.2        4.1       ?       ? 
1 1 1   55    6    3 o    122.3    5.7    0.0000   0.0000          ?        ?   150.0526  14.0475          ?        ?      122.3        5.7       ?       ? 
1 1 1   55    6    4 o     20.3   10.0    0.0000   0.0000          ?        ?   -28.7335  14.0475          ?        ?       20.3       10.0       ?       ? 
1 1 1   55    6    5 o     26.9   11.9    0.0000   0.0000          ?        ?    -4.4697  12.7704          ?        ?       26.9       11.9       ?       ? 
1 1 1   55    6    6 f    181.8    3.7    0.0000   0.0000          ?        ?   330.7542  13.4090          ?        ?      181.8        3.7       ?       ? 
1 1 1   55    6    7 o    147.9    4.5    0.0000   0.0000          ?        ?   219.0129  13.4090          ?        ?      147.9        4.5       ?       ? 
1 1 1   55    6    8 o    127.5    5.5    0.0000   0.0000          ?        ?   162.8230  14.0475          ?        ?      127.5        5.5       ?       ? 
1 1 1   55    6    9 o    245.2    3.8    0.0000   0.0000          ?        ?   602.1259  18.5171          ?        ?      245.2        3.8       ?       ? 
1 1 1   55    6   10 o    108.2    6.2    0.0000   0.0000          ?        ?   117.4880  13.4090          ?        ?      108.2        6.2       ?       ? 
1 1 1   55    6   11 o    134.5    5.5    0.0000   0.0000          ?        ?   181.3401  14.6860          ?        ?      134.5        5.5       ?       ? 
1 1 1   55    6   12 o     23.2   11.1    0.0000   0.0000          ?        ?   -17.8786  14.0475          ?        ?       23.2       11.1       ?       ? 
1 1 1   55    6   13 o    171.5    4.1    0.0000   0.0000          ?        ?   294.3585  14.0475          ?        ?      171.5        4.1       ?       ? 
1 1 1   55    6   14 o    127.1    6.3    0.0000   0.0000          ?        ?   162.1845  15.9630          ?        ?      127.1        6.3       ?       ? 
1 1 1   55    6   15 o    461.4    3.1    0.0000   0.0000          ?        ?  2130.7468  28.7335          ?        ?      461.4        3.1       ?       ? 
1 1 1   55    6   16 o    253.0    3.3    0.0000   0.0000          ?        ?   640.4372  16.6016          ?        ?      253.0        3.3       ?       ? 
1 1 1   55    6   17 o     82.4    9.3    0.0000   0.0000          ?        ?    68.3218  15.3245          ?        ?       82.4        9.3       ?       ? 
1 1 1   55    6   18 o     23.6   11.2    0.0000   0.0000          ?        ?   -19.1556  14.6860          ?        ?       23.6       11.2       ?       ? 
1 1 1   55    6   19 o    126.6    6.6    0.0000   0.0000          ?        ?   160.9075  16.6016          ?        ?      126.6        6.6       ?       ? 
1 1 1   55    6   20 o    118.0    6.8    0.0000   0.0000          ?        ?   139.8362  15.9630          ?        ?      118.0        6.8       ?       ? 
1 1 1   55    6   21 o     53.9   14.1    0.0000   0.0000          ?        ?    30.6490  15.3245          ?        ?       53.9       14.1       ?       ? 
1 1 1   55    6   22 o    170.8    4.7    0.0000   0.0000          ?        ?   292.4429  15.9630          ?        ?      170.8        4.7       ?       ? 
1 1 1   55    6   23 o    158.8    4.8    0.0000   0.0000          ?        ?   252.8546  15.3245          ?        ?      158.8        4.8       ?       ? 
1 1 1   55    6   24 o    172.3    4.4    0.0000   0.0000          ?        ?   297.5511  15.3245          ?        ?      172.3        4.4       ?       ? 
1 1 1   55    6   25 o    131.1    5.8    0.0000   0.0000          ?        ?   172.4008  15.3245          ?        ?      131.1        5.8       ?       ? 
1 1 1   55    6   26 o    225.1    3.8    0.0000   0.0000          ?        ?   507.6247  17.2401          ?        ?      225.1        3.8       ?       ? 
1 1 1   55    6   27 o    114.4    6.7    0.0000   0.0000          ?        ?   131.5355  15.3245          ?        ?      114.4        6.7       ?       ? 
1 1 1   55    6   28 o     80.7    9.5    0.0000   0.0000          ?        ?    65.7677  15.3245          ?        ?       80.7        9.5       ?       ? 
1 1 1   55    6   29 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   55    6   30 o     24.1   11.5    0.0000   0.0000          ?        ?   -19.7942  15.3245          ?        ?       24.1       11.5       ?       ? 
1 1 1   55    6   31 o    279.4    3.2    0.0000   0.0000          ?        ?   781.5505  17.8786          ?        ?      279.4        3.2       ?       ? 
1 1 1   55    6   32 o    202.2    4.1    0.0000   0.0000          ?        ?   409.9309  16.6016          ?        ?      202.2        4.1       ?       ? 
1 1 1   55    6   33 o    285.1    3.1    0.0000   0.0000          ?        ?   814.1151  17.8786          ?        ?      285.1        3.1       ?       ? 
1 1 1   55    6   34 o    183.3    4.7    0.0000   0.0000          ?        ?   337.1394  17.2401          ?        ?      183.3        4.7       ?       ? 
1 1 1   55    6   35 o    211.6    4.1    0.0000   0.0000          ?        ?   448.8807  17.2401          ?        ?      211.6        4.1       ?       ? 
1 1 1   55    6   36 o    111.1    7.2    0.0000   0.0000          ?        ?   124.5117  15.9630          ?        ?      111.1        7.2       ?       ? 
1 1 1   55    6   37 o    229.2    3.8    0.0000   0.0000          ?        ?   526.7803  17.2401          ?        ?      229.2        3.8       ?       ? 
1 1 1   55    6   38 o    142.2    6.1    0.0000   0.0000          ?        ?   203.6884  17.2401          ?        ?      142.2        6.1       ?       ? 
1 1 1   55    6   39 o    118.8    6.7    0.0000   0.0000          ?        ?   142.3903  15.9630          ?        ?      118.8        6.7       ?       ? 
1 1 1   55    6   40 o     35.4   14.6    0.0000   0.0000          ?        ?     5.1082  16.6016          ?        ?       35.4       14.6       ?       ? 
1 1 1   55    7    0 o    113.3    9.7  131.5355  21.7097   131.5355  21.7097   131.5355  21.7097      113.3      9.7      113.3        9.7     0.0     0.0 
1 1 1   55    7    1 o    309.2    3.7    0.0000   0.0000          ?        ?   957.1439  22.9868          ?        ?      309.2        3.7       ?       ? 
1 1 1   55    7    2 o     72.1    9.7    0.0000   0.0000          ?        ?    52.3588  14.0475          ?        ?       72.1        9.7       ?       ? 
1 1 1   55    7    3 o    128.2    5.7    0.0000   0.0000          ?        ?   164.7386  14.6860          ?        ?      128.2        5.7       ?       ? 
1 1 1   55    7    4 o     96.7    7.3    0.0000   0.0000          ?        ?    93.8627  14.0475          ?        ?       96.7        7.3       ?       ? 
1 1 1   55    7    5 o    310.3    3.2    0.0000   0.0000          ?        ?   963.5291  19.7942          ?        ?      310.3        3.2       ?       ? 
1 1 1   55    7    6 o    206.9    4.0    0.0000   0.0000          ?        ?   428.4480  16.6016          ?        ?      206.9        4.0       ?       ? 
1 1 1   55    7    7 o    194.0    4.1    0.0000   0.0000          ?        ?   376.7278  15.9630          ?        ?      194.0        4.1       ?       ? 
1 1 1   55    7    8 f    237.4    3.8    0.0000   0.0000          ?        ?   564.4531  17.8786          ?        ?      237.4        3.8       ?       ? 
1 1 1   55    7    9 o    119.4    6.4    0.0000   0.0000          ?        ?   143.0288  15.3245          ?        ?      119.4        6.4       ?       ? 
1 1 1   55    7   10 o    383.2    3.2    0.0000   0.0000          ?        ?  1469.2383  24.2638          ?        ?      383.2        3.2       ?       ? 
1 1 1   55    7   11 f    219.9    3.5    0.0000   0.0000          ?        ?   483.9994  15.3245          ?        ?      219.9        3.5       ?       ? 
1 1 1   55    7   12 o    143.7    4.9    0.0000   0.0000          ?        ?   206.8810  14.0475          ?        ?      143.7        4.9       ?       ? 
1 1 1   55    7   13 o     99.6    7.7    0.0000   0.0000          ?        ?    99.6094  15.3245          ?        ?       99.6        7.7       ?       ? 
1 1 1   55    7   14 o    243.9    3.7    0.0000   0.0000          ?        ?   595.7407  17.8786          ?        ?      243.9        3.7       ?       ? 
1 1 1   55    7   15 o    223.6    3.7    0.0000   0.0000          ?        ?   500.6010  16.6016          ?        ?      223.6        3.7       ?       ? 
1 1 1   55    7   16 o    227.3    4.1    0.0000   0.0000          ?        ?   517.2025  18.5171          ?        ?      227.3        4.1       ?       ? 
1 1 1   55    7   17 o     58.8   12.8    0.0000   0.0000          ?        ?    36.3957  14.6860          ?        ?       58.8       12.8       ?       ? 
1 1 1   55    7   18 o    218.8    3.9    0.0000   0.0000          ?        ?   479.5297  17.2401          ?        ?      218.8        3.9       ?       ? 
1 1 1   55    7   19 o    110.5    6.4    0.0000   0.0000          ?        ?   122.5962  14.0475          ?        ?      110.5        6.4       ?       ? 
1 1 1   55    7   20 o    299.9    3.0    0.0000   0.0000          ?        ?   900.3155  17.8786          ?        ?      299.9        3.0       ?       ? 
1 1 1   55    7   21 o    254.8    3.1    0.0000   0.0000          ?        ?   650.0150  15.9630          ?        ?      254.8        3.1       ?       ? 
1 1 1   55    7   22 o    519.3    3.0    0.0000   0.0000          ?        ?  2699.0310  30.6490          ?        ?      519.3        3.0       ?       ? 
1 1 1   55    7   23 o    138.4    5.5    0.0000   0.0000          ?        ?   192.1950  15.3245          ?        ?      138.4        5.5       ?       ? 
1 1 1   55    7   24 o    143.4    5.3    0.0000   0.0000          ?        ?   206.2425  15.3245          ?        ?      143.4        5.3       ?       ? 
1 1 1   55    7   25 o    115.5    6.6    0.0000   0.0000          ?        ?   134.0895  15.3245          ?        ?      115.5        6.6       ?       ? 
1 1 1   55    7   26 o     33.3   13.7    0.0000   0.0000          ?        ?     3.8311  14.6860          ?        ?       33.3       13.7       ?       ? 
1 1 1   55    7   27 o    249.6    3.3    0.0000   0.0000          ?        ?   623.8356  16.6016          ?        ?      249.6        3.3       ?       ? 
1 1 1   55    7   28 o    117.7    6.5    0.0000   0.0000          ?        ?   139.1977  15.3245          ?        ?      117.7        6.5       ?       ? 
1 1 1   55    7   29 o     99.7    8.0    0.0000   0.0000          ?        ?   100.2479  15.9630          ?        ?       99.7        8.0       ?       ? 
1 1 1   55    7   30 o    281.0    3.2    0.0000   0.0000          ?        ?   790.4898  17.8786          ?        ?      281.0        3.2       ?       ? 
1 1 1   55    7   31 f     93.4    8.9    0.0000   0.0000          ?        ?    88.1160  16.6016          ?        ?       93.4        8.9       ?       ? 
1 1 1   55    7   32 o     38.1   14.0    0.0000   0.0000          ?        ?    12.1319  14.0475          ?        ?       38.1       14.0       ?       ? 
1 1 1   55    7   33 o     19.4    9.7    0.0000   0.0000          ?        ?   -44.0580  15.9630          ?        ?       19.4        9.7       ?       ? 
1 1 1   55    7   34 o    144.5    5.7    0.0000   0.0000          ?        ?   210.0736  16.6016          ?        ?      144.5        5.7       ?       ? 
1 1 1   55    7   35 o    165.0    5.0    0.0000   0.0000          ?        ?   273.2873  16.6016          ?        ?      165.0        5.0       ?       ? 
1 1 1   55    7   36 o    202.5    4.1    0.0000   0.0000          ?        ?   411.2079  16.6016          ?        ?      202.5        4.1       ?       ? 
1 1 1   55    7   37 o    137.7    6.0    0.0000   0.0000          ?        ?   190.9180  16.6016          ?        ?      137.7        6.0       ?       ? 
1 1 1   55    7   38 o    259.5    3.4    0.0000   0.0000          ?        ?   674.9174  17.8786          ?        ?      259.5        3.4       ?       ? 
1 1 1   55    8    0 o     23.4   15.6   -3.1926  18.5171    -3.1926  18.5171    -3.1926  18.5171       23.4     15.6       23.4       15.6     0.0     0.0 
1 1 1   55    8    1 o    128.2    5.5    0.0000   0.0000          ?        ?   164.7386  14.0475          ?        ?      128.2        5.5       ?       ? 
1 1 1   55    8    2 o    118.3    6.5    0.0000   0.0000          ?        ?   140.4748  15.3245          ?        ?      118.3        6.5       ?       ? 
1 1 1   55    8    3 o    153.6    4.4    0.0000   0.0000          ?        ?   236.2530  13.4090          ?        ?      153.6        4.4       ?       ? 
1 1 1   55    8    4 o    309.0    3.0    0.0000   0.0000          ?        ?   955.2284  18.5171          ?        ?      309.0        3.0       ?       ? 
1 1 1   55    8    5 o    277.7    3.2    0.0000   0.0000          ?        ?   771.9727  17.8786          ?        ?      277.7        3.2       ?       ? 
1 1 1   55    8    6 o    189.3    3.5    0.0000   0.0000          ?        ?   358.8492  13.4090          ?        ?      189.3        3.5       ?       ? 
1 1 1   55    8    7 o    383.8    3.2    0.0000   0.0000          ?        ?  1474.3464  24.2638          ?        ?      383.8        3.2       ?       ? 
1 1 1   55    8    8 o     77.6    8.6    0.0000   0.0000          ?        ?    60.6596  13.4090          ?        ?       77.6        8.6       ?       ? 
1 1 1   55    8    9 o    117.5    6.0    0.0000   0.0000          ?        ?   138.5592  14.0475          ?        ?      117.5        6.0       ?       ? 
1 1 1   55    8   10 o    161.9    4.5    0.0000   0.0000          ?        ?   262.4324  14.6860          ?        ?      161.9        4.5       ?       ? 
1 1 1   55    8   11 o    219.2    3.5    0.0000   0.0000          ?        ?   480.8068  15.3245          ?        ?      219.2        3.5       ?       ? 
1 1 1   55    8   12 o    417.7    3.1    0.0000   0.0000          ?        ?  1746.3567  26.1794          ?        ?      417.7        3.1       ?       ? 
1 1 1   55    8   13 o    130.4    6.1    0.0000   0.0000          ?        ?   170.4853  15.9630          ?        ?      130.4        6.1       ?       ? 
1 1 1   55    8   14 o    282.9    3.4    0.0000   0.0000          ?        ?   801.3447  19.1556          ?        ?      282.9        3.4       ?       ? 
1 1 1   55    8   15 o    189.9    4.2    0.0000   0.0000          ?        ?   361.4032  15.9630          ?        ?      189.9        4.2       ?       ? 
1 1 1   55    8   16 o    292.3    3.5    0.0000   0.0000          ?        ?   855.6190  20.4327          ?        ?      292.3        3.5       ?       ? 
1 1 1   55    8   17 o    273.9    3.5    0.0000   0.0000          ?        ?   750.9014  19.1556          ?        ?      273.9        3.5       ?       ? 
1 1 1   55    8   18 o    119.6    6.1    0.0000   0.0000          ?        ?   143.6674  14.6860          ?        ?      119.6        6.1       ?       ? 
1 1 1   55    8   19 o    135.4    5.4    0.0000   0.0000          ?        ?   183.8942  14.6860          ?        ?      135.4        5.4       ?       ? 
1 1 1   55    8   20 o    295.2    3.0    0.0000   0.0000          ?        ?   872.2206  17.8786          ?        ?      295.2        3.0       ?       ? 
1 1 1   55    8   21 o    397.9    2.6    0.0000   0.0000          ?        ?  1584.1722  21.0712          ?        ?      397.9        2.6       ?       ? 
1 1 1   55    8   22 o    302.6    3.2    0.0000   0.0000          ?        ?   916.9171  19.1556          ?        ?      302.6        3.2       ?       ? 
1 1 1   55    8   23 o    212.0    3.9    0.0000   0.0000          ?        ?   450.1577  16.6016          ?        ?      212.0        3.9       ?       ? 
1 1 1   55    8   24 o    316.0    3.2    0.0000   0.0000          ?        ?   999.9249  20.4327          ?        ?      316.0        3.2       ?       ? 
1 1 1   55    8   25 o     74.0   10.8    0.0000   0.0000          ?        ?    55.5514  15.9630          ?        ?       74.0       10.8       ?       ? 
1 1 1   55    8   26 o    320.3    2.8    0.0000   0.0000          ?        ?  1026.7428  17.8786          ?        ?      320.3        2.8       ?       ? 
1 1 1   55    8   27 o    140.6    5.7    0.0000   0.0000          ?        ?   198.5802  15.9630          ?        ?      140.6        5.7       ?       ? 
1 1 1   55    8   28 o    229.2    3.5    0.0000   0.0000          ?        ?   526.1418  15.9630          ?        ?      229.2        3.5       ?       ? 
1 1 1   55    8   29 o    247.4    3.2    0.0000   0.0000          ?        ?   612.9808  15.9630          ?        ?      247.4        3.2       ?       ? 
1 1 1   55    8   30 o    267.4    3.3    0.0000   0.0000          ?        ?   716.4213  17.8786          ?        ?      267.4        3.3       ?       ? 
1 1 1   55    8   31 o     26.0   12.2    0.0000   0.0000          ?        ?   -17.8786  16.6016          ?        ?       26.0       12.2       ?       ? 
1 1 1   55    8   32 o    145.9    5.7    0.0000   0.0000          ?        ?   213.9047  16.6016          ?        ?      145.9        5.7       ?       ? 
1 1 1   55    8   33 o    216.4    3.8    0.0000   0.0000          ?        ?   469.3134  16.6016          ?        ?      216.4        3.8       ?       ? 
1 1 1   55    8   34 o    109.1    7.0    0.0000   0.0000          ?        ?   120.0421  15.3245          ?        ?      109.1        7.0       ?       ? 
1 1 1   55    8   35 o    185.0    4.3    0.0000   0.0000          ?        ?   343.5246  15.9630          ?        ?      185.0        4.3       ?       ? 
1 1 1   55    8   36 o    103.0    7.8    0.0000   0.0000          ?        ?   107.2716  15.9630          ?        ?      103.0        7.8       ?       ? 
1 1 1   55    8   37 o     21.1   10.4    0.0000   0.0000          ?        ?   -34.4802  15.9630          ?        ?       21.1       10.4       ?       ? 
1 1 1   55    9    0 o    141.4    5.7  201.1343  15.9630   201.1343  15.9630   201.1343  15.9630      141.4      5.7      141.4        5.7     0.0     0.0 
1 1 1   55    9    1 o    198.7    3.7    0.0000   0.0000          ?        ?   395.2449  14.6860          ?        ?      198.7        3.7       ?       ? 
1 1 1   55    9    2 o    203.6    3.4    0.0000   0.0000          ?        ?   415.0391  14.0475          ?        ?      203.6        3.4       ?       ? 
1 1 1   55    9    3 o    159.7    4.0    0.0000   0.0000          ?        ?   255.4086  12.7704          ?        ?      159.7        4.0       ?       ? 
1 1 1   55    9    4 o     33.4   12.3    0.0000   0.0000          ?        ?     8.9393  10.8549          ?        ?       33.4       12.3       ?       ? 
1 1 1   55    9    5 o    181.6    4.0    0.0000   0.0000          ?        ?   330.1157  14.6860          ?        ?      181.6        4.0       ?       ? 
1 1 1   55    9    6 o    146.1    4.8    0.0000   0.0000          ?        ?   213.9047  14.0475          ?        ?      146.1        4.8       ?       ? 
1 1 1   55    9    7 o    234.5    3.3    0.0000   0.0000          ?        ?   550.4056  15.3245          ?        ?      234.5        3.3       ?       ? 
1 1 1   55    9    8 o    161.9    4.3    0.0000   0.0000          ?        ?   262.4324  14.0475          ?        ?      161.9        4.3       ?       ? 
1 1 1   55    9    9 f    350.4    3.4    0.0000   0.0000          ?        ?  1229.1542  23.6253          ?        ?      350.4        3.4       ?       ? 
1 1 1   55    9   10 o    145.0    4.6    0.0000   0.0000          ?        ?   210.7121  13.4090          ?        ?      145.0        4.6       ?       ? 
1 1 1   55    9   11 o    218.2    3.8    0.0000   0.0000          ?        ?   476.9756  16.6016          ?        ?      218.2        3.8       ?       ? 
1 1 1   55    9   12 o    177.3    4.1    0.0000   0.0000          ?        ?   314.7912  14.6860          ?        ?      177.3        4.1       ?       ? 
1 1 1   55    9   13 o    290.4    3.3    0.0000   0.0000          ?        ?   844.1255  19.1556          ?        ?      290.4        3.3       ?       ? 
1 1 1   55    9   14 o    263.9    3.5    0.0000   0.0000          ?        ?   697.2656  18.5171          ?        ?      263.9        3.5       ?       ? 
1 1 1   55    9   15 o     85.7    8.6    0.0000   0.0000          ?        ?    74.0685  14.6860          ?        ?       85.7        8.6       ?       ? 
1 1 1   55    9   16 o    243.8    3.7    0.0000   0.0000          ?        ?   595.1021  17.8786          ?        ?      243.8        3.7       ?       ? 
1 1 1   55    9   17 o    122.2    6.8    0.0000   0.0000          ?        ?   150.0526  16.6016          ?        ?      122.2        6.8       ?       ? 
1 1 1   55    9   18 o    212.3    4.1    0.0000   0.0000          ?        ?   451.4348  17.2401          ?        ?      212.3        4.1       ?       ? 
1 1 1   55    9   19 f     78.7    9.7    0.0000   0.0000          ?        ?    62.5751  15.3245          ?        ?       78.7        9.7       ?       ? 
1 1 1   55    9   20 o    179.9    4.4    0.0000   0.0000          ?        ?   324.3690  15.9630          ?        ?      179.9        4.4       ?       ? 
1 1 1   55    9   21 o    198.9    4.3    0.0000   0.0000          ?        ?   396.5219  17.2401          ?        ?      198.9        4.3       ?       ? 
1 1 1   55    9   22 o    154.3    5.2    0.0000   0.0000          ?        ?   238.8071  15.9630          ?        ?      154.3        5.2       ?       ? 
1 1 1   55    9   23 o    246.2    3.6    0.0000   0.0000          ?        ?   607.2341  17.8786          ?        ?      246.2        3.6       ?       ? 
1 1 1   55    9   24 o     80.6    9.9    0.0000   0.0000          ?        ?    65.7677  15.9630          ?        ?       80.6        9.9       ?       ? 
1 1 1   55    9   25 o     49.4   14.5    0.0000   0.0000          ?        ?    25.5409  15.3245          ?        ?       49.4       14.5       ?       ? 
1 1 1   55    9   26 o    250.1    3.4    0.0000   0.0000          ?        ?   626.3897  17.2401          ?        ?      250.1        3.4       ?       ? 
1 1 1   55    9   27 o    269.1    3.1    0.0000   0.0000          ?        ?   725.3605  16.6016          ?        ?      269.1        3.1       ?       ? 
1 1 1   55    9   28 o    208.9    3.8    0.0000   0.0000          ?        ?   437.3873  15.9630          ?        ?      208.9        3.8       ?       ? 
1 1 1   55    9   29 o    364.1    2.7    0.0000   0.0000          ?        ?  1327.4865  19.7942          ?        ?      364.1        2.7       ?       ? 
1 1 1   55    9   30 o     80.1   10.0    0.0000   0.0000          ?        ?    65.1292  15.9630          ?        ?       80.1       10.0       ?       ? 
1 1 1   55    9   31 o     32.9   14.0    0.0000   0.0000          ?        ?     1.2770  15.9630          ?        ?       32.9       14.0       ?       ? 
1 1 1   55    9   32 o     51.9   14.7    0.0000   0.0000          ?        ?    28.7335  15.9630          ?        ?       51.9       14.7       ?       ? 
1 1 1   55    9   33 o    132.7    6.5    0.0000   0.0000          ?        ?   177.5090  17.2401          ?        ?      132.7        6.5       ?       ? 
1 1 1   55    9   34 o    128.4    6.2    0.0000   0.0000          ?        ?   166.0156  15.9630          ?        ?      128.4        6.2       ?       ? 
1 1 1   55    9   35 o     34.3   14.0    0.0000   0.0000          ?        ?     5.1082  15.3245          ?        ?       34.3       14.0       ?       ? 
1 1 1   55   10    0 o    150.7    6.2  228.5907  18.5171   228.5907  18.5171   228.5907  18.5171      150.7      6.2      150.7        6.2     0.0     0.0 
1 1 1   55   10    1 f    131.7    4.6    0.0000   0.0000          ?        ?   173.6779  12.1319          ?        ?      131.7        4.6       ?       ? 
1 1 1   55   10    2 o    184.7    3.8    0.0000   0.0000          ?        ?   341.6091  14.0475          ?        ?      184.7        3.8       ?       ? 
1 1 1   55   10    3 o     25.4   11.5    0.0000   0.0000          ?        ?    -7.6623  12.7704          ?        ?       25.4       11.5       ?       ? 
1 1 1   55   10    4 o     67.5    9.5    0.0000   0.0000          ?        ?    45.9736  12.7704          ?        ?       67.5        9.5       ?       ? 
1 1 1   55   10    5 o     16.5    8.3    0.0000   0.0000          ?        ?   -36.3957  12.1319          ?        ?       16.5        8.3       ?       ? 
1 1 1   55   10    6 o    124.7    5.1    0.0000   0.0000          ?        ?   155.7993  12.7704          ?        ?      124.7        5.1       ?       ? 
1 1 1   55   10    7 o    207.8    3.7    0.0000   0.0000          ?        ?   432.2791  15.3245          ?        ?      207.8        3.7       ?       ? 
1 1 1   55   10    8 o    227.7    3.5    0.0000   0.0000          ?        ?   519.1181  15.9630          ?        ?      227.7        3.5       ?       ? 
1 1 1   55   10    9 o    460.9    3.4    0.0000   0.0000          ?        ?  2126.9155  31.2876          ?        ?      460.9        3.4       ?       ? 
1 1 1   55   10   10 o    337.0    3.3    0.0000   0.0000          ?        ?  1137.2070  22.3483          ?        ?      337.0        3.3       ?       ? 
1 1 1   55   10   11 f    177.1    4.5    0.0000   0.0000          ?        ?   314.1526  15.9630          ?        ?      177.1        4.5       ?       ? 
1 1 1   55   10   12 o    177.4    4.5    0.0000   0.0000          ?        ?   315.4297  15.9630          ?        ?      177.4        4.5       ?       ? 
1 1 1   55   10   13 o    138.7    5.1    0.0000   0.0000          ?        ?   192.8335  14.0475          ?        ?      138.7        5.1       ?       ? 
1 1 1   55   10   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   55   10   15 o    119.8    6.9    0.0000   0.0000          ?        ?   144.3059  16.6016          ?        ?      119.8        6.9       ?       ? 
1 1 1   55   10   16 o     80.2   10.3    0.0000   0.0000          ?        ?    65.1292  16.6016          ?        ?       80.2       10.3       ?       ? 
1 1 1   55   10   17 o    251.1    3.6    0.0000   0.0000          ?        ?   631.4979  17.8786          ?        ?      251.1        3.6       ?       ? 
1 1 1   55   10   18 o    124.6    5.6    0.0000   0.0000          ?        ?   155.7993  14.0475          ?        ?      124.6        5.6       ?       ? 
1 1 1   55   10   19 o     32.9   13.6    0.0000   0.0000          ?        ?     3.1926  14.6860          ?        ?       32.9       13.6       ?       ? 
1 1 1   55   10   20 o    110.7    6.6    0.0000   0.0000          ?        ?   123.2347  14.6860          ?        ?      110.7        6.6       ?       ? 
1 1 1   55   10   21 o    238.5    3.6    0.0000   0.0000          ?        ?   569.5613  17.2401          ?        ?      238.5        3.6       ?       ? 
1 1 1   55   10   22 o     48.4   14.6    0.0000   0.0000          ?        ?    24.2638  15.3245          ?        ?       48.4       14.6       ?       ? 
1 1 1   55   10   23 o     24.2   11.5    0.0000   0.0000          ?        ?   -19.1556  15.3245          ?        ?       24.2       11.5       ?       ? 
1 1 1   55   10   24 o    153.8    5.4    0.0000   0.0000          ?        ?   237.5300  16.6016          ?        ?      153.8        5.4       ?       ? 
1 1 1   55   10   25 o    202.6    3.9    0.0000   0.0000          ?        ?   411.2079  15.9630          ?        ?      202.6        3.9       ?       ? 
1 1 1   55   10   26 o    209.1    3.5    0.0000   0.0000          ?        ?   438.0258  14.6860          ?        ?      209.1        3.5       ?       ? 
1 1 1   55   10   27 o    152.8    5.0    0.0000   0.0000          ?        ?   234.3374  15.3245          ?        ?      152.8        5.0       ?       ? 
1 1 1   55   10   28 o     53.5   14.1    0.0000   0.0000          ?        ?    30.6490  15.3245          ?        ?       53.5       14.1       ?       ? 
1 1 1   55   10   29 o     28.3   12.6    0.0000   0.0000          ?        ?    -5.7467  14.6860          ?        ?       28.3       12.6       ?       ? 
1 1 1   55   10   30 o    294.4    3.0    0.0000   0.0000          ?        ?   868.3894  17.8786          ?        ?      294.4        3.0       ?       ? 
1 1 1   55   10   31 o    164.4    4.9    0.0000   0.0000          ?        ?   271.3717  15.9630          ?        ?      164.4        4.9       ?       ? 
1 1 1   55   10   32 o    180.1    4.4    0.0000   0.0000          ?        ?   325.6460  15.9630          ?        ?      180.1        4.4       ?       ? 
1 1 1   55   10   33 o     19.0    9.5    0.0000   0.0000          ?        ?   -38.3113  14.6860          ?        ?       19.0        9.5       ?       ? 
1 1 1   55   10   34 o    280.2    3.2    0.0000   0.0000          ?        ?   786.6586  17.8786          ?        ?      280.2        3.2       ?       ? 
1 1 1   55   11    0 o     88.0   10.4   81.0922  17.8786    81.0922  17.8786    81.0922  17.8786       88.0     10.4       88.0       10.4     0.0     0.0 
1 1 1   55   11    1 o    360.1    2.9    0.0000   0.0000          ?        ?  1298.1145  21.0712          ?        ?      360.1        2.9       ?       ? 
1 1 1   55   11    2 o    135.2    5.4    0.0000   0.0000          ?        ?   183.2557  14.6860          ?        ?      135.2        5.4       ?       ? 
1 1 1   55   11    3 o    204.2    3.8    0.0000   0.0000          ?        ?   417.5931  15.3245          ?        ?      204.2        3.8       ?       ? 
1 1 1   55   11    4 o     63.6   10.0    0.0000   0.0000          ?        ?    40.8654  12.7704          ?        ?       63.6       10.0       ?       ? 
1 1 1   55   11    5 o    127.4    5.0    0.0000   0.0000          ?        ?   162.8230  12.7704          ?        ?      127.4        5.0       ?       ? 
1 1 1   55   11    6 o    188.6    3.9    0.0000   0.0000          ?        ?   356.2951  14.6860          ?        ?      188.6        3.9       ?       ? 
1 1 1   55   11    7 o    173.6    4.2    0.0000   0.0000          ?        ?   302.0207  14.6860          ?        ?      173.6        4.2       ?       ? 
1 1 1   55   11    8 o     18.3    9.0    0.0000   0.0000          ?        ?   -27.4564  12.1319          ?        ?       18.3        9.0       ?       ? 
1 1 1   55   11    9 o    187.2    4.3    0.0000   0.0000          ?        ?   351.1869  15.9630          ?        ?      187.2        4.3       ?       ? 
1 1 1   55   11   10 o    474.0    3.6    0.0000   0.0000          ?        ?  2249.5117  33.8416          ?        ?      474.0        3.6       ?       ? 
1 1 1   55   11   11 f    215.2    3.6    0.0000   0.0000          ?        ?   463.5667  15.3245          ?        ?      215.2        3.6       ?       ? 
1 1 1   55   11   12 o    225.6    3.5    0.0000   0.0000          ?        ?   509.5403  15.9630          ?        ?      225.6        3.5       ?       ? 
1 1 1   55   11   13 o    216.8    3.5    0.0000   0.0000          ?        ?   470.5904  15.3245          ?        ?      216.8        3.5       ?       ? 
1 1 1   55   11   14 o    426.3    3.1    0.0000   0.0000          ?        ?  1819.1481  26.1794          ?        ?      426.3        3.1       ?       ? 
1 1 1   55   11   15 o    198.3    4.2    0.0000   0.0000          ?        ?   393.9678  16.6016          ?        ?      198.3        4.2       ?       ? 
1 1 1   55   11   16 o    314.2    3.7    0.0000   0.0000          ?        ?   989.0699  22.9868          ?        ?      314.2        3.7       ?       ? 
1 1 1   55   11   17 o    148.8    5.6    0.0000   0.0000          ?        ?   222.2055  16.6016          ?        ?      148.8        5.6       ?       ? 
1 1 1   55   11   18 o    305.1    3.3    0.0000   0.0000          ?        ?   932.2416  20.4327          ?        ?      305.1        3.3       ?       ? 
1 1 1   55   11   19 o    190.6    4.2    0.0000   0.0000          ?        ?   363.9573  15.9630          ?        ?      190.6        4.2       ?       ? 
1 1 1   55   11   20 o    109.2    7.3    0.0000   0.0000          ?        ?   120.0421  15.9630          ?        ?      109.2        7.3       ?       ? 
1 1 1   55   11   21 o    108.6    7.1    0.0000   0.0000          ?        ?   118.7650  15.3245          ?        ?      108.6        7.1       ?       ? 
1 1 1   55   11   22 o     49.8   14.1    0.0000   0.0000          ?        ?    26.1794  14.6860          ?        ?       49.8       14.1       ?       ? 
1 1 1   55   11   23 o     42.9   14.4    0.0000   0.0000          ?        ?    17.8786  14.6860          ?        ?       42.9       14.4       ?       ? 
1 1 1   55   11   24 o     21.3   10.5    0.0000   0.0000          ?        ?   -30.6490  15.3245          ?        ?       21.3       10.5       ?       ? 
1 1 1   55   11   25 o    179.8    4.4    0.0000   0.0000          ?        ?   324.3690  15.9630          ?        ?      179.8        4.4       ?       ? 
1 1 1   55   11   26 o     27.5   12.4    0.0000   0.0000          ?        ?    -7.6623  14.6860          ?        ?       27.5       12.4       ?       ? 
1 1 1   55   11   27 o     38.0   14.5    0.0000   0.0000          ?        ?    10.8549  15.3245          ?        ?       38.0       14.5       ?       ? 
1 1 1   55   11   28 o     23.8   11.4    0.0000   0.0000          ?        ?   -20.4327  15.3245          ?        ?       23.8       11.4       ?       ? 
1 1 1   55   11   29 o    224.9    3.8    0.0000   0.0000          ?        ?   506.9862  17.2401          ?        ?      224.9        3.8       ?       ? 
1 1 1   55   11   30 f    143.4    5.3    0.0000   0.0000          ?        ?   206.8810  15.3245          ?        ?      143.4        5.3       ?       ? 
1 1 1   55   11   31 o     35.5   14.2    0.0000   0.0000          ?        ?     7.0237  15.3245          ?        ?       35.5       14.2       ?       ? 
1 1 1   55   11   32 o    222.3    3.6    0.0000   0.0000          ?        ?   495.4928  15.9630          ?        ?      222.3        3.6       ?       ? 
1 1 1   55   12    0 o    227.2    4.4  517.2025  19.7942   517.2025  19.7942   517.2025  19.7942      227.2      4.4      227.2        4.4     0.0     0.0 
1 1 1   55   12    1 o    182.5    3.3    0.0000   0.0000          ?        ?   333.3083  12.1319          ?        ?      182.5        3.3       ?       ? 
1 1 1   55   12    2 o     81.7    6.6    0.0000   0.0000          ?        ?    67.0448  10.8549          ?        ?       81.7        6.6       ?       ? 
1 1 1   55   12    3 o    167.8    4.0    0.0000   0.0000          ?        ?   282.2266  13.4090          ?        ?      167.8        4.0       ?       ? 
1 1 1   55   12    4 o    250.5    3.1    0.0000   0.0000          ?        ?   628.3053  15.3245          ?        ?      250.5        3.1       ?       ? 
1 1 1   55   12    5 o    125.9    5.3    0.0000   0.0000          ?        ?   158.9919  13.4090          ?        ?      125.9        5.3       ?       ? 
1 1 1   55   12    6 o    267.9    3.1    0.0000   0.0000          ?        ?   718.3369  16.6016          ?        ?      267.9        3.1       ?       ? 
1 1 1   55   12    7 o    187.7    3.9    0.0000   0.0000          ?        ?   353.1024  14.6860          ?        ?      187.7        3.9       ?       ? 
1 1 1   55   12    8 o     56.3   11.2    0.0000   0.0000          ?        ?    33.2031  12.1319          ?        ?       56.3       11.2       ?       ? 
1 1 1   55   12    9 o    216.0    3.5    0.0000   0.0000          ?        ?   467.3978  15.3245          ?        ?      216.0        3.5       ?       ? 
1 1 1   55   12   10 o     82.3    8.1    0.0000   0.0000          ?        ?    68.3218  13.4090          ?        ?       82.3        8.1       ?       ? 
1 1 1   55   12   11 o    133.5    5.0    0.0000   0.0000          ?        ?   178.7861  13.4090          ?        ?      133.5        5.0       ?       ? 
1 1 1   55   12   12 o    145.1    5.5    0.0000   0.0000          ?        ?   211.3506  15.9630          ?        ?      145.1        5.5       ?       ? 
1 1 1   55   12   13 o     57.2   12.1    0.0000   0.0000          ?        ?    34.4802  13.4090          ?        ?       57.2       12.1       ?       ? 
1 1 1   55   12   14 f    204.5    3.6    0.0000   0.0000          ?        ?   418.8702  14.6860          ?        ?      204.5        3.6       ?       ? 
1 1 1   55   12   15 o     90.8    7.7    0.0000   0.0000          ?        ?    83.0078  14.0475          ?        ?       90.8        7.7       ?       ? 
1 1 1   55   12   16 f    184.3    4.3    0.0000   0.0000          ?        ?   340.3320  15.9630          ?        ?      184.3        4.3       ?       ? 
1 1 1   55   12   17 o    262.5    3.5    0.0000   0.0000          ?        ?   690.2419  18.5171          ?        ?      262.5        3.5       ?       ? 
1 1 1   55   12   18 o     33.5   13.9    0.0000   0.0000          ?        ?     3.1926  15.3245          ?        ?       33.5       13.9       ?       ? 
1 1 1   55   12   19 o    120.0    6.6    0.0000   0.0000          ?        ?   144.9444  15.9630          ?        ?      120.0        6.6       ?       ? 
1 1 1   55   12   20 o    229.9    3.6    0.0000   0.0000          ?        ?   529.3344  16.6016          ?        ?      229.9        3.6       ?       ? 
1 1 1   55   12   21 o     81.1    8.3    0.0000   0.0000          ?        ?    66.4062  13.4090          ?        ?       81.1        8.3       ?       ? 
1 1 1   55   12   22 o     26.0   11.8    0.0000   0.0000          ?        ?    -7.6623  13.4090          ?        ?       26.0       11.8       ?       ? 
1 1 1   55   12   23 o    157.5    4.9    0.0000   0.0000          ?        ?   249.0234  15.3245          ?        ?      157.5        4.9       ?       ? 
1 1 1   55   12   24 o    244.1    3.5    0.0000   0.0000          ?        ?   597.0177  17.2401          ?        ?      244.1        3.5       ?       ? 
1 1 1   55   12   25 o    191.5    4.0    0.0000   0.0000          ?        ?   367.7885  15.3245          ?        ?      191.5        4.0       ?       ? 
1 1 1   55   12   26 o    264.9    3.4    0.0000   0.0000          ?        ?   703.0123  17.8786          ?        ?      264.9        3.4       ?       ? 
1 1 1   55   12   27 o    312.5    3.1    0.0000   0.0000          ?        ?   978.2151  19.1556          ?        ?      312.5        3.1       ?       ? 
1 1 1   55   12   28 o     52.3   14.7    0.0000   0.0000          ?        ?    29.3720  15.9630          ?        ?       52.3       14.7       ?       ? 
1 1 1   55   12   29 o     76.3   10.0    0.0000   0.0000          ?        ?    59.3825  15.3245          ?        ?       76.3       10.0       ?       ? 
1 1 1   55   12   30 o    117.7    6.5    0.0000   0.0000          ?        ?   139.8362  15.3245          ?        ?      117.7        6.5       ?       ? 
1 1 1   55   13    0 o    443.5    4.5 1969.8392  39.5883  1969.8392  39.5883  1969.8392  39.5883      443.5      4.5      443.5        4.5     0.0     0.0 
1 1 1   55   13    1 o    143.7    3.8    0.0000   0.0000          ?        ?   206.8810  10.8549          ?        ?      143.7        3.8       ?       ? 
1 1 1   55   13    2 o    186.0    4.1    0.0000   0.0000          ?        ?   346.7172  15.3245          ?        ?      186.0        4.1       ?       ? 
1 1 1   55   13    3 o    278.2    3.6    0.0000   0.0000          ?        ?   775.1653  19.7942          ?        ?      278.2        3.6       ?       ? 
1 1 1   55   13    4 o    176.5    4.3    0.0000   0.0000          ?        ?   312.2371  15.3245          ?        ?      176.5        4.3       ?       ? 
1 1 1   55   13    5 o    159.8    4.8    0.0000   0.0000          ?        ?   256.0471  15.3245          ?        ?      159.8        4.8       ?       ? 
1 1 1   55   13    6 o     29.8   12.9    0.0000   0.0000          ?        ?    -1.2770  14.0475          ?        ?       29.8       12.9       ?       ? 
1 1 1   55   13    7 o    125.1    5.4    0.0000   0.0000          ?        ?   157.0763  13.4090          ?        ?      125.1        5.4       ?       ? 
1 1 1   55   13    8 o    289.4    3.2    0.0000   0.0000          ?        ?   838.3789  18.5171          ?        ?      289.4        3.2       ?       ? 
1 1 1   55   13    9 o    163.2    3.7    0.0000   0.0000          ?        ?   266.9020  12.1319          ?        ?      163.2        3.7       ?       ? 
1 1 1   55   13   10 o    154.6    4.3    0.0000   0.0000          ?        ?   239.4456  13.4090          ?        ?      154.6        4.3       ?       ? 
1 1 1   55   13   11 o     62.5    9.7    0.0000   0.0000          ?        ?    39.5883  12.1319          ?        ?       62.5        9.7       ?       ? 
1 1 1   55   13   12 o    258.1    3.5    0.0000   0.0000          ?        ?   667.2551  17.8786          ?        ?      258.1        3.5       ?       ? 
1 1 1   55   13   13 o     92.1    8.0    0.0000   0.0000          ?        ?    85.5619  14.6860          ?        ?       92.1        8.0       ?       ? 
1 1 1   55   13   14 o    112.4    6.8    0.0000   0.0000          ?        ?   127.0658  15.3245          ?        ?      112.4        6.8       ?       ? 
1 1 1   55   13   15 o    120.6    5.8    0.0000   0.0000          ?        ?   146.2215  14.0475          ?        ?      120.6        5.8       ?       ? 
1 1 1   55   13   16 o    167.6    4.2    0.0000   0.0000          ?        ?   281.5880  14.0475          ?        ?      167.6        4.2       ?       ? 
1 1 1   55   13   17 o    191.9    4.0    0.0000   0.0000          ?        ?   369.0655  15.3245          ?        ?      191.9        4.0       ?       ? 
1 1 1   55   13   18 o    376.9    3.0    0.0000   0.0000          ?        ?  1422.6262  22.3483          ?        ?      376.9        3.0       ?       ? 
1 1 1   55   13   19 o    160.8    4.6    0.0000   0.0000          ?        ?   259.2398  14.6860          ?        ?      160.8        4.6       ?       ? 
1 1 1   55   13   20 o    181.1    4.2    0.0000   0.0000          ?        ?   328.8386  15.3245          ?        ?      181.1        4.2       ?       ? 
1 1 1   55   13   21 o    196.3    4.1    0.0000   0.0000          ?        ?   386.3056  15.9630          ?        ?      196.3        4.1       ?       ? 
1 1 1   55   13   22 o    132.2    5.6    0.0000   0.0000          ?        ?   175.5934  14.6860          ?        ?      132.2        5.6       ?       ? 
1 1 1   55   13   23 o     68.5   11.2    0.0000   0.0000          ?        ?    47.8891  15.3245          ?        ?       68.5       11.2       ?       ? 
1 1 1   55   13   24 o    222.4    3.9    0.0000   0.0000          ?        ?   496.1313  17.2401          ?        ?      222.4        3.9       ?       ? 
1 1 1   55   13   25 o    164.2    4.9    0.0000   0.0000          ?        ?   270.7332  15.9630          ?        ?      164.2        4.9       ?       ? 
1 1 1   55   13   26 o    142.1    5.6    0.0000   0.0000          ?        ?   203.0499  15.9630          ?        ?      142.1        5.6       ?       ? 
1 1 1   55   13   27 o     68.8   11.1    0.0000   0.0000          ?        ?    48.5276  15.3245          ?        ?       68.8       11.1       ?       ? 
1 1 1   55   13   28 o    167.4    4.6    0.0000   0.0000          ?        ?   281.5880  15.3245          ?        ?      167.4        4.6       ?       ? 
1 1 1   55   14    0 o     18.3   13.4  -53.6358  26.8179   -53.6358  26.8179   -53.6358  26.8179       18.3     13.4       18.3       13.4     0.0     0.0 
1 1 1   55   14    1 o     24.6   12.1    0.0000   0.0000          ?        ?   -47.2506  21.7097          ?        ?       24.6       12.1       ?       ? 
1 1 1   55   14    2 o    103.5   10.2    0.0000   0.0000          ?        ?   108.5487  21.0712          ?        ?      103.5       10.2       ?       ? 
1 1 1   55   14    3 o    132.5    8.0    0.0000   0.0000          ?        ?   176.8705  21.0712          ?        ?      132.5        8.0       ?       ? 
1 1 1   55   14    4 o    444.4    4.0    0.0000   0.0000          ?        ?  1979.4170  35.7572          ?        ?      444.4        4.0       ?       ? 
1 1 1   55   14    5 o    267.2    3.5    0.0000   0.0000          ?        ?   715.1442  18.5171          ?        ?      267.2        3.5       ?       ? 
1 1 1   55   14    6 o     88.6    7.9    0.0000   0.0000          ?        ?    79.1767  14.0475          ?        ?       88.6        7.9       ?       ? 
1 1 1   55   14    7 o    163.5    4.7    0.0000   0.0000          ?        ?   268.1791  15.3245          ?        ?      163.5        4.7       ?       ? 
1 1 1   55   14    8 o    382.0    3.7    0.0000   0.0000          ?        ?  1462.2145  28.0950          ?        ?      382.0        3.7       ?       ? 
1 1 1   55   14    9 o    127.7    4.8    0.0000   0.0000          ?        ?   163.4615  12.1319          ?        ?      127.7        4.8       ?       ? 
1 1 1   55   14   10 o    158.8    4.2    0.0000   0.0000          ?        ?   252.8546  13.4090          ?        ?      158.8        4.2       ?       ? 
1 1 1   55   14   11 o    194.4    3.9    0.0000   0.0000          ?        ?   378.6433  15.3245          ?        ?      194.4        3.9       ?       ? 
1 1 1   55   14   12 o    210.8    3.2    0.0000   0.0000          ?        ?   445.0496  13.4090          ?        ?      210.8        3.2       ?       ? 
1 1 1   55   14   13 o    192.8    3.6    0.0000   0.0000          ?        ?   372.2581  14.0475          ?        ?      192.8        3.6       ?       ? 
1 1 1   55   14   14 o     33.0   13.1    0.0000   0.0000          ?        ?     6.3852  12.7704          ?        ?       33.0       13.1       ?       ? 
1 1 1   55   14   15 o    167.8    4.2    0.0000   0.0000          ?        ?   282.2266  14.0475          ?        ?      167.8        4.2       ?       ? 
1 1 1   55   14   16 o     94.2    7.1    0.0000   0.0000          ?        ?    89.3930  13.4090          ?        ?       94.2        7.1       ?       ? 
1 1 1   55   14   17 o     77.9    8.2    0.0000   0.0000          ?        ?    61.2981  12.7704          ?        ?       77.9        8.2       ?       ? 
1 1 1   55   14   18 o     26.0   11.9    0.0000   0.0000          ?        ?    -9.5778  14.0475          ?        ?       26.0       11.9       ?       ? 
1 1 1   55   14   19 o    152.1    5.0    0.0000   0.0000          ?        ?   232.4219  15.3245          ?        ?      152.1        5.0       ?       ? 
1 1 1   55   14   20 o     94.1    7.5    0.0000   0.0000          ?        ?    89.3930  14.0475          ?        ?       94.1        7.5       ?       ? 
1 1 1   55   14   21 o    130.2    5.4    0.0000   0.0000          ?        ?   170.4853  14.0475          ?        ?      130.2        5.4       ?       ? 
1 1 1   55   14   22 o    131.6    5.6    0.0000   0.0000          ?        ?   174.3164  14.6860          ?        ?      131.6        5.6       ?       ? 
1 1 1   55   14   23 f    163.6    4.9    0.0000   0.0000          ?        ?   268.8176  15.9630          ?        ?      163.6        4.9       ?       ? 
1 1 1   55   14   24 o     21.3   10.4    0.0000   0.0000          ?        ?   -26.8179  14.6860          ?        ?       21.3       10.4       ?       ? 
1 1 1   55   14   25 o     41.0   14.7    0.0000   0.0000          ?        ?    15.3245  15.3245          ?        ?       41.0       14.7       ?       ? 
1 1 1   55   14   26 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   55   15    0 o    163.7    9.8  272.6487  31.9261   272.6487  31.9261   272.6487  31.9261      163.7      9.8      163.7        9.8     0.0     0.0 
1 1 1   55   15    1 o    200.9    6.5    0.0000   0.0000          ?        ?   406.0997  26.1794          ?        ?      200.9        6.5       ?       ? 
1 1 1   55   15    2 o    272.1    5.0    0.0000   0.0000          ?        ?   743.2392  27.4564          ?        ?      272.1        5.0       ?       ? 
1 1 1   55   15    3 o    281.5    4.8    0.0000   0.0000          ?        ?   794.9594  26.8179          ?        ?      281.5        4.8       ?       ? 
1 1 1   55   15    4 o     35.1   15.2    0.0000   0.0000          ?        ?    -1.9156  19.7942          ?        ?       35.1       15.2       ?       ? 
1 1 1   55   15    5 o     41.4   16.8    0.0000   0.0000          ?        ?     8.3008  21.7097          ?        ?       41.4       16.8       ?       ? 
1 1 1   55   15    6 o    249.4    3.3    0.0000   0.0000          ?        ?   623.1971  16.6016          ?        ?      249.4        3.3       ?       ? 
1 1 1   55   15    7 o     90.8    6.7    0.0000   0.0000          ?        ?    83.0078  12.1319          ?        ?       90.8        6.7       ?       ? 
1 1 1   55   15    8 o    248.9    3.5    0.0000   0.0000          ?        ?   620.6430  17.2401          ?        ?      248.9        3.5       ?       ? 
1 1 1   55   15    9 o    219.6    4.2    0.0000   0.0000          ?        ?   483.3608  18.5171          ?        ?      219.6        4.2       ?       ? 
1 1 1   55   15   10 o     34.7   13.9    0.0000   0.0000          ?        ?     6.3852  14.6860          ?        ?       34.7       13.9       ?       ? 
1 1 1   55   15   11 o     37.0   14.6    0.0000   0.0000          ?        ?     8.3008  15.9630          ?        ?       37.0       14.6       ?       ? 
1 1 1   55   15   12 o    121.3    6.6    0.0000   0.0000          ?        ?   148.1370  15.9630          ?        ?      121.3        6.6       ?       ? 
1 1 1   55   15   13 o    170.8    3.7    0.0000   0.0000          ?        ?   292.4429  12.7704          ?        ?      170.8        3.7       ?       ? 
1 1 1   55   15   14 o    141.1    5.0    0.0000   0.0000          ?        ?   199.8573  14.0475          ?        ?      141.1        5.0       ?       ? 
1 1 1   55   15   15 o    244.2    3.7    0.0000   0.0000          ?        ?   597.6562  17.8786          ?        ?      244.2        3.7       ?       ? 
1 1 1   55   15   16 o     65.8   10.2    0.0000   0.0000          ?        ?    44.0580  13.4090          ?        ?       65.8       10.2       ?       ? 
1 1 1   55   15   17 o    231.7    3.6    0.0000   0.0000          ?        ?   538.2737  16.6016          ?        ?      231.7        3.6       ?       ? 
1 1 1   55   15   18 f     76.1    9.2    0.0000   0.0000          ?        ?    58.7440  14.0475          ?        ?       76.1        9.2       ?       ? 
1 1 1   55   15   19 o     85.9    7.8    0.0000   0.0000          ?        ?    74.7070  13.4090          ?        ?       85.9        7.8       ?       ? 
1 1 1   55   15   20 o     27.6   12.1    0.0000   0.0000          ?        ?    -2.5541  12.7704          ?        ?       27.6       12.1       ?       ? 
1 1 1   55   15   21 o     29.6   12.5    0.0000   0.0000          ?        ?     1.2770  12.7704          ?        ?       29.6       12.5       ?       ? 
1 1 1   55   15   22 o    213.7    3.6    0.0000   0.0000          ?        ?   457.8200  15.3245          ?        ?      213.7        3.6       ?       ? 
1 1 1   55   15   23 o    164.8    4.5    0.0000   0.0000          ?        ?   272.6487  14.6860          ?        ?      164.8        4.5       ?       ? 
1 1 1   55   16    0 o    202.6    8.7  415.0391  35.1187   415.0391  35.1187   415.0391  35.1187      202.6      8.7      202.6        8.7     0.0     0.0 
1 1 1   55   16    1 o    218.2    5.3    0.0000   0.0000          ?        ?   478.2527  22.9868          ?        ?      218.2        5.3       ?       ? 
1 1 1   55   16    2 o     90.7   14.4    0.0000   0.0000          ?        ?    84.9234  26.1794          ?        ?       90.7       14.4       ?       ? 
1 1 1   55   16    3 o    299.1    4.8    0.0000   0.0000          ?        ?   897.7615  28.7335          ?        ?      299.1        4.8       ?       ? 
1 1 1   55   16    4 o    120.7    7.4    0.0000   0.0000          ?        ?   146.8600  17.8786          ?        ?      120.7        7.4       ?       ? 
1 1 1   55   16    5 o     83.6   12.2    0.0000   0.0000          ?        ?    71.5144  20.4327          ?        ?       83.6       12.2       ?       ? 
1 1 1   55   16    6 o     51.5   17.6    0.0000   0.0000          ?        ?    26.1794  21.7097          ?        ?       51.5       17.6       ?       ? 
1 1 1   55   16    7 o    109.2    8.8    0.0000   0.0000          ?        ?   120.6806  19.1556          ?        ?      109.2        8.8       ?       ? 
1 1 1   55   16    8 o    180.5    6.0    0.0000   0.0000          ?        ?   327.5616  21.7097          ?        ?      180.5        6.0       ?       ? 
1 1 1   55   16    9 o    322.6    3.1    0.0000   0.0000          ?        ?  1042.0673  19.7942          ?        ?      322.6        3.1       ?       ? 
1 1 1   55   16   10 o    226.1    3.5    0.0000   0.0000          ?        ?   512.0943  15.9630          ?        ?      226.1        3.5       ?       ? 
1 1 1   55   16   11 o    179.9    4.8    0.0000   0.0000          ?        ?   325.0075  17.2401          ?        ?      179.9        4.8       ?       ? 
1 1 1   55   16   12 o    121.4    7.1    0.0000   0.0000          ?        ?   148.7755  17.2401          ?        ?      121.4        7.1       ?       ? 
1 1 1   55   16   13 o    106.0    8.1    0.0000   0.0000          ?        ?   113.6568  17.2401          ?        ?      106.0        8.1       ?       ? 
1 1 1   55   16   14 o    158.0    5.5    0.0000   0.0000          ?        ?   250.9390  17.2401          ?        ?      158.0        5.5       ?       ? 
1 1 1   55   16   15 o    215.8    3.6    0.0000   0.0000          ?        ?   466.7593  15.3245          ?        ?      215.8        3.6       ?       ? 
1 1 1   55   16   16 o    183.3    4.0    0.0000   0.0000          ?        ?   337.1394  14.6860          ?        ?      183.3        4.0       ?       ? 
1 1 1   55   16   17 o    133.5    5.7    0.0000   0.0000          ?        ?   179.4246  15.3245          ?        ?      133.5        5.7       ?       ? 
1 1 1   55   16   18 o     63.1   11.6    0.0000   0.0000          ?        ?    42.1424  14.0475          ?        ?       63.1       11.6       ?       ? 
1 1 1   55   16   19 f    165.3    3.7    0.0000   0.0000          ?        ?   273.9258  12.1319          ?        ?      165.3        3.7       ?       ? 
1 1 1   55   16   20 o     47.0   12.6    0.0000   0.0000          ?        ?    23.6253  12.1319          ?        ?       47.0       12.6       ?       ? 
1 1 1   55   17    0 o    306.4    8.7  946.9276  52.9973   946.9276  52.9973   946.9276  52.9973      306.4      8.7      306.4        8.7     0.0     0.0 
1 1 1   55   17    1 o    187.6    5.4    0.0000   0.0000          ?        ?   353.7410  20.4327          ?        ?      187.6        5.4       ?       ? 
1 1 1   55   17    2 o    156.4    6.7    0.0000   0.0000          ?        ?   246.4693  21.0712          ?        ?      156.4        6.7       ?       ? 
1 1 1   55   17    3 o    224.5    6.5    0.0000   0.0000          ?        ?   507.6247  29.3720          ?        ?      224.5        6.5       ?       ? 
1 1 1   55   17    4 o    120.5    8.2    0.0000   0.0000          ?        ?   146.8600  19.7942          ?        ?      120.5        8.2       ?       ? 
1 1 1   55   17    5 o     43.0   16.6    0.0000   0.0000          ?        ?    13.4090  20.4327          ?        ?       43.0       16.6       ?       ? 
1 1 1   55   17    6 o    154.3    6.6    0.0000   0.0000          ?        ?   240.0841  20.4327          ?        ?      154.3        6.6       ?       ? 
1 1 1   55   17    7 o    158.1    6.1    0.0000   0.0000          ?        ?   251.5775  19.1556          ?        ?      158.1        6.1       ?       ? 
1 1 1   55   17    8 o     96.0   10.3    0.0000   0.0000          ?        ?    93.8627  19.7942          ?        ?       96.0       10.3       ?       ? 
1 1 1   55   17    9 o    226.8    5.6    0.0000   0.0000          ?        ?   517.2025  25.5409          ?        ?      226.8        5.6       ?       ? 
1 1 1   55   17   10 o    200.5    4.3    0.0000   0.0000          ?        ?   403.5457  17.2401          ?        ?      200.5        4.3       ?       ? 
1 1 1   55   17   11 o     30.6   12.5    0.0000   0.0000          ?        ?     3.8311  12.1319          ?        ?       30.6       12.5       ?       ? 
1 1 1   55   17   12 o    176.9    4.1    0.0000   0.0000          ?        ?   314.1526  14.6860          ?        ?      176.9        4.1       ?       ? 
1 1 1   55   17   13 o    356.8    4.0    0.0000   0.0000          ?        ?  1277.0432  28.7335          ?        ?      356.8        4.0       ?       ? 
1 1 1   55   17   14 o    326.0    4.6    0.0000   0.0000          ?        ?  1067.6082  30.0105          ?        ?      326.0        4.6       ?       ? 
1 1 1   55   17   15 o     82.9   10.4    0.0000   0.0000          ?        ?    70.2374  17.2401          ?        ?       82.9       10.4       ?       ? 
1 1 1   55   17   16 o     51.8   15.5    0.0000   0.0000          ?        ?    28.7335  17.2401          ?        ?       51.8       15.5       ?       ? 
1 1 1   55   18    0 o     63.9   26.3   60.0210  33.2031    60.0210  33.2031    60.0210  33.2031       63.9     26.3       63.9       26.3     0.0     0.0 
1 1 1   55   18    1 o     27.4   12.9    0.0000   0.0000          ?        ?   -19.7942  18.5171          ?        ?       27.4       12.9       ?       ? 
1 1 1   55   18    2 o     21.8   10.8    0.0000   0.0000          ?        ?   -45.3350  18.5171          ?        ?       21.8       10.8       ?       ? 
1 1 1   55   18    3 o     50.6   15.9    0.0000   0.0000          ?        ?    26.8179  17.8786          ?        ?       50.6       15.9       ?       ? 
1 1 1   55   18    4 o    240.1    4.9    0.0000   0.0000          ?        ?   579.1391  23.6253          ?        ?      240.1        4.9       ?       ? 
1 1 1   55   18    5 o    175.6    5.5    0.0000   0.0000          ?        ?   310.3215  19.1556          ?        ?      175.6        5.5       ?       ? 
1 1 1   55   18    6 o    150.0    7.2    0.0000   0.0000          ?        ?   227.3137  21.7097          ?        ?      150.0        7.2       ?       ? 
1 1 1   55   18    7 o     74.9   14.2    0.0000   0.0000          ?        ?    60.0210  20.4327          ?        ?       74.9       14.2       ?       ? 
1 1 1   55   18    8 o     51.9   16.8    0.0000   0.0000          ?        ?    28.0950  19.7942          ?        ?       51.9       16.8       ?       ? 
1 1 1   55   18    9 o     86.4   11.5    0.0000   0.0000          ?        ?    76.6226  19.7942          ?        ?       86.4       11.5       ?       ? 
1 1 1   55   18   10 o    319.8    4.5    0.0000   0.0000          ?        ?  1027.3812  28.7335          ?        ?      319.8        4.5       ?       ? 
1 1 1   55   18   11 f    133.3    7.7    0.0000   0.0000          ?        ?   180.0631  20.4327          ?        ?      133.3        7.7       ?       ? 
1 1 1   56    0    0 o    183.9    7.7  340.3320  28.0950   340.3320  28.0950   340.3320  28.0950      183.9      7.7      183.9        7.7     0.0     0.0 
1 1 1   56    0    1 o    237.4    4.3  564.4531  20.4327   564.4531  20.4327   564.4531  20.4327      237.4      4.3      237.4        4.3     0.0     0.0 
1 1 1   56    0    2 o    430.0    4.4 1850.4355  37.6728  1850.4355  37.6728  1850.4355  37.6728      430.0      4.4      430.0        4.4     0.0     0.0 
1 1 1   56    0    3 o    294.4    4.0  867.7509  23.6253   867.7509  23.6253   867.7509  23.6253      294.4      4.0      294.4        4.0     0.0     0.0 
1 1 1   56    0    4 o    704.1    5.9 4963.8672  83.6463  4963.8672  83.6463  4963.8672  83.6463      704.1      5.9      704.1        5.9     0.0     0.0 
1 1 1   56    0    5 o    246.7    4.7  609.7881  22.9868   609.7881  22.9868   609.7881  22.9868      246.7      4.7      246.7        4.7     0.0     0.0 
1 1 1   56    0    6 o    466.0    4.1 2172.8889  38.3113  2172.8889  38.3113  2172.8889  38.3113      466.0      4.1      466.0        4.1     0.0     0.0 
1 1 1   56    0    7 f    117.1    8.0  139.1977  18.5171   139.1977  18.5171   139.1977  18.5171      117.1      8.0      117.1        8.0     0.0     0.0 
1 1 1   56    0    8 o    329.6    4.1 1087.4023  26.8179  1087.4023  26.8179  1087.4023  26.8179      329.6      4.1      329.6        4.1     0.0     0.0 
1 1 1   56    0    9 o    262.7    5.1  691.5189  26.8179   691.5189  26.8179   691.5189  26.8179      262.7      5.1      262.7        5.1     0.0     0.0 
1 1 1   56    0   10 o    748.7    5.5 5611.9668  81.7308  5611.9668  81.7308  5611.9668  81.7308      748.7      5.5      748.7        5.5     0.0     0.0 
1 1 1   56    0   11 o    200.4    5.7  402.9071  22.9868   402.9071  22.9868   402.9071  22.9868      200.4      5.7      200.4        5.7     0.0     0.0 
1 1 1   56    0   12 o    163.2    6.7  268.1791  21.7097   268.1791  21.7097   268.1791  21.7097      163.2      6.7      163.2        6.7     0.0     0.0 
1 1 1   56    0   13 o    310.6    5.5  966.7217  33.8416   966.7217  33.8416   966.7217  33.8416      310.6      5.5      310.6        5.5     0.0     0.0 
1 1 1   56    0   14 o    169.0    6.8  287.3347  22.9868   287.3347  22.9868   287.3347  22.9868      169.0      6.8      169.0        6.8     0.0     0.0 
1 1 1   56    0   15 o    446.1    4.7 1992.1875  41.5039  1992.1875  41.5039  1992.1875  41.5039      446.1      4.7      446.1        4.7     0.0     0.0 
1 1 1   56    0   16 o    145.9    7.7  215.1818  22.3483   215.1818  22.3483   215.1818  22.3483      145.9      7.7      145.9        7.7     0.0     0.0 
1 1 1   56    0   17 o    170.9    6.6  293.7199  22.3483   293.7199  22.3483   293.7199  22.3483      170.9      6.6      170.9        6.6     0.0     0.0 
1 1 1   56    0   18 o    278.3    4.2  775.8038  23.6253   775.8038  23.6253   775.8038  23.6253      278.3      4.2      278.3        4.2     0.0     0.0 
1 1 1   56    0   19 o    258.7    4.4  670.4477  22.9868   670.4477  22.9868   670.4477  22.9868      258.7      4.4      258.7        4.4     0.0     0.0 
1 1 1   56    0   20 o     16.2   11.8  -33.8416  19.1556   -33.8416  19.1556   -33.8416  19.1556       16.2     11.8       16.2       11.8     0.0     0.0 
1 1 1   56    0   21 o     17.7   12.7  -30.6490  20.4327   -30.6490  20.4327   -30.6490  20.4327       17.7     12.7       17.7       12.7     0.0     0.0 
1 1 1   56    0   22 f     51.1   20.2   36.3957  19.7942    36.3957  19.7942    36.3957  19.7942       51.1     20.2       51.1       20.2     0.0     0.0 
1 1 1   56    0   23 o     88.2   12.2   80.4537  21.0712    80.4537  21.0712    80.4537  21.0712       88.2     12.2       88.2       12.2     0.0     0.0 
1 1 1   56    0   24 o     46.5   21.1   31.9261  21.0712    31.9261  21.0712    31.9261  21.0712       46.5     21.1       46.5       21.1     0.0     0.0 
1 1 1   56    0   25 o     66.6   18.8   54.2743  21.7097    54.2743  21.7097    54.2743  21.7097       66.6     18.8       66.6       18.8     0.0     0.0 
1 1 1   56    0   26 o    243.2    4.7  592.5481  22.9868   592.5481  22.9868   592.5481  22.9868      243.2      4.7      243.2        4.7     0.0     0.0 
1 1 1   56    0   27 o    118.6    9.0  143.6674  21.0712   143.6674  21.0712   143.6674  21.0712      118.6      9.0      118.6        9.0     0.0     0.0 
1 1 1   56    0   28 o    152.8    7.3  235.6145  22.3483   235.6145  22.3483   235.6145  22.3483      152.8      7.3      152.8        7.3     0.0     0.0 
1 1 1   56    0   29 o     48.9   21.7   35.1187  22.3483    35.1187  22.3483    35.1187  22.3483       48.9     21.7       48.9       21.7     0.0     0.0 
1 1 1   56    0   30 o     26.4   17.4   -1.9156  22.3483    -1.9156  22.3483    -1.9156  22.3483       26.4     17.4       26.4       17.4     0.0     0.0 
1 1 1   56    0   31 o    248.4    5.1  618.7275  25.5409   618.7275  25.5409   618.7275  25.5409      248.4      5.1      248.4        5.1     0.0     0.0 
1 1 1   56    0   32 o    470.3    3.9 2213.7546  36.3957  2213.7546  36.3957  2213.7546  36.3957      470.3      3.9      470.3        3.9     0.0     0.0 
1 1 1   56    0   33 o     17.6   12.8  -33.2031  21.0712   -33.2031  21.0712   -33.2031  21.0712       17.6     12.8       17.6       12.8     0.0     0.0 
1 1 1   56    0   34 o    154.6    7.3  241.3612  22.3483   241.3612  22.3483   241.3612  22.3483      154.6      7.3      154.6        7.3     0.0     0.0 
1 1 1   56    0   35 o     15.5   11.5  -62.5751  23.6253   -62.5751  23.6253   -62.5751  23.6253       15.5     11.5       15.5       11.5     0.0     0.0 
1 1 1   56    0   36 f    251.2    4.7  632.7749  23.6253   632.7749  23.6253   632.7749  23.6253      251.2      4.7      251.2        4.7     0.0     0.0 
1 1 1   56    0   37 o    297.5    4.5  886.9065  26.8179   886.9065  26.8179   886.9065  26.8179      297.5      4.5      297.5        4.5     0.0     0.0 
1 1 1   56    0   38 o    255.0    5.0  651.9305  25.5409   651.9305  25.5409   651.9305  25.5409      255.0      5.0      255.0        5.0     0.0     0.0 
1 1 1   56    0   39 o     53.4   21.9   40.8654  22.9868    40.8654  22.9868    40.8654  22.9868       53.4     21.9       53.4       21.9     0.0     0.0 
1 1 1   56    0   40 o    243.8    5.2  596.3792  25.5409   596.3792  25.5409   596.3792  25.5409      243.8      5.2      243.8        5.2     0.0     0.0 
1 1 1   56    0   41 f     73.9   18.0   64.4907  22.9868    64.4907  22.9868    64.4907  22.9868       73.9     18.0       73.9       18.0     0.0     0.0 
1 1 1   56    0   42 o     28.6   18.4    2.5541  23.6253     2.5541  23.6253     2.5541  23.6253       28.6     18.4       28.6       18.4     0.0     0.0 
1 1 1   56    0   43 o    106.9   11.9  120.0421  24.9023   120.0421  24.9023   120.0421  24.9023      106.9     11.9      106.9       11.9     0.0     0.0 
1 1 1   56    0   44 o     24.4   16.6   -9.5778  23.6253    -9.5778  23.6253    -9.5778  23.6253       24.4     16.6       24.4       16.6     0.0     0.0 
1 1 1   56    1    0 o    237.3    5.0  564.4531  23.6253   564.4531  23.6253   564.4531  23.6253      237.3      5.0      237.3        5.0     0.0     0.0 
1 1 1   56    1    1 o    190.0    3.5    0.0000   0.0000          ?        ?   361.4032  13.4090          ?        ?      190.0        3.5       ?       ? 
1 1 1   56    1    2 o    224.2    3.4    0.0000   0.0000          ?        ?   503.1551  15.3245          ?        ?      224.2        3.4       ?       ? 
1 1 1   56    1    3 o     89.5    7.5    0.0000   0.0000          ?        ?    80.4537  13.4090          ?        ?       89.5        7.5       ?       ? 
1 1 1   56    1    4 o    341.7    2.8    0.0000   0.0000          ?        ?  1168.4946  19.1556          ?        ?      341.7        2.8       ?       ? 
1 1 1   56    1    5 o    286.3    3.3    0.0000   0.0000          ?        ?   820.5003  19.1556          ?        ?      286.3        3.3       ?       ? 
1 1 1   56    1    6 o    385.7    3.0    0.0000   0.0000          ?        ?  1488.3939  22.9868          ?        ?      385.7        3.0       ?       ? 
1 1 1   56    1    7 o    117.6    5.7    0.0000   0.0000          ?        ?   138.5592  13.4090          ?        ?      117.6        5.7       ?       ? 
1 1 1   56    1    8 f    171.3    4.5    0.0000   0.0000          ?        ?   293.7199  15.3245          ?        ?      171.3        4.5       ?       ? 
1 1 1   56    1    9 o    337.8    3.1    0.0000   0.0000          ?        ?  1141.6766  21.0712          ?        ?      337.8        3.1       ?       ? 
1 1 1   56    1   10 o    394.0    2.9    0.0000   0.0000          ?        ?  1552.8845  22.9868          ?        ?      394.0        2.9       ?       ? 
1 1 1   56    1   11 o    364.8    3.2    0.0000   0.0000          ?        ?  1331.3176  22.9868          ?        ?      364.8        3.2       ?       ? 
1 1 1   56    1   12 o    312.8    3.2    0.0000   0.0000          ?        ?   978.8537  19.7942          ?        ?      312.8        3.2       ?       ? 
1 1 1   56    1   13 o    104.6    6.7    0.0000   0.0000          ?        ?   109.8257  14.0475          ?        ?      104.6        6.7       ?       ? 
1 1 1   56    1   14 o    286.8    2.8    0.0000   0.0000          ?        ?   823.0543  15.9630          ?        ?      286.8        2.8       ?       ? 
1 1 1   56    1   15 o    200.1    4.5    0.0000   0.0000          ?        ?   400.9916  17.8786          ?        ?      200.1        4.5       ?       ? 
1 1 1   56    1   16 o    118.9    6.4    0.0000   0.0000          ?        ?   141.7518  15.3245          ?        ?      118.9        6.4       ?       ? 
1 1 1   56    1   17 o    286.4    3.5    0.0000   0.0000          ?        ?   821.1389  19.7942          ?        ?      286.4        3.5       ?       ? 
1 1 1   56    1   18 o    207.2    4.0    0.0000   0.0000          ?        ?   429.7251  16.6016          ?        ?      207.2        4.0       ?       ? 
1 1 1   56    1   19 o    283.6    3.4    0.0000   0.0000          ?        ?   805.1758  19.1556          ?        ?      283.6        3.4       ?       ? 
1 1 1   56    1   20 o    169.0    4.0    0.0000   0.0000          ?        ?   286.0577  13.4090          ?        ?      169.0        4.0       ?       ? 
1 1 1   56    1   21 o    116.4    6.9    0.0000   0.0000          ?        ?   136.0051  15.9630          ?        ?      116.4        6.9       ?       ? 
1 1 1   56    1   22 o    164.2    4.7    0.0000   0.0000          ?        ?   270.0946  15.3245          ?        ?      164.2        4.7       ?       ? 
1 1 1   56    1   23 o     82.8    8.5    0.0000   0.0000          ?        ?    68.9603  14.0475          ?        ?       82.8        8.5       ?       ? 
1 1 1   56    1   24 o    157.1    4.7    0.0000   0.0000          ?        ?   247.1079  14.6860          ?        ?      157.1        4.7       ?       ? 
1 1 1   56    1   25 o    114.7    7.0    0.0000   0.0000          ?        ?   132.1740  15.9630          ?        ?      114.7        7.0       ?       ? 
1 1 1   56    1   26 o    116.9    6.6    0.0000   0.0000          ?        ?   137.2822  15.3245          ?        ?      116.9        6.6       ?       ? 
1 1 1   56    1   27 o    185.9    4.1    0.0000   0.0000          ?        ?   346.0787  15.3245          ?        ?      185.9        4.1       ?       ? 
1 1 1   56    1   28 o    166.1    4.6    0.0000   0.0000          ?        ?   276.4799  15.3245          ?        ?      166.1        4.6       ?       ? 
1 1 1   56    1   29 f    104.5    7.3    0.0000   0.0000          ?        ?   109.8257  15.3245          ?        ?      104.5        7.3       ?       ? 
1 1 1   56    1   30 o    304.4    3.0    0.0000   0.0000          ?        ?   927.7720  18.5171          ?        ?      304.4        3.0       ?       ? 
1 1 1   56    1   31 o    382.7    2.8    0.0000   0.0000          ?        ?  1466.0457  21.0712          ?        ?      382.7        2.8       ?       ? 
1 1 1   56    1   32 o    311.5    3.0    0.0000   0.0000          ?        ?   971.1914  18.5171          ?        ?      311.5        3.0       ?       ? 
1 1 1   56    1   33 o    158.0    5.1    0.0000   0.0000          ?        ?   250.3005  15.9630          ?        ?      158.0        5.1       ?       ? 
1 1 1   56    1   34 o     17.8    9.0    0.0000   0.0000          ?        ?   -60.6596  16.6016          ?        ?       17.8        9.0       ?       ? 
1 1 1   56    1   35 o     33.7   14.3    0.0000   0.0000          ?        ?     1.2770  16.6016          ?        ?       33.7       14.3       ?       ? 
1 1 1   56    1   36 o    119.8    6.7    0.0000   0.0000          ?        ?   144.3059  15.9630          ?        ?      119.8        6.7       ?       ? 
1 1 1   56    1   37 o    311.1    3.1    0.0000   0.0000          ?        ?   969.2759  19.1556          ?        ?      311.1        3.1       ?       ? 
1 1 1   56    1   38 o    261.2    3.4    0.0000   0.0000          ?        ?   683.2181  17.8786          ?        ?      261.2        3.4       ?       ? 
1 1 1   56    1   39 o    109.6    7.6    0.0000   0.0000          ?        ?   121.3191  16.6016          ?        ?      109.6        7.6       ?       ? 
1 1 1   56    1   40 o     45.8   15.7    0.0000   0.0000          ?        ?    20.4327  17.2401          ?        ?       45.8       15.7       ?       ? 
1 1 1   56    1   41 o    202.8    4.3    0.0000   0.0000          ?        ?   412.4850  17.2401          ?        ?      202.8        4.3       ?       ? 
1 1 1   56    1   42 o     23.0   11.3    0.0000   0.0000          ?        ?   -31.9261  17.2401          ?        ?       23.0       11.3       ?       ? 
1 1 1   56    1   43 o     54.9   15.2    0.0000   0.0000          ?        ?    32.5646  17.2401          ?        ?       54.9       15.2       ?       ? 
1 1 1   56    2    0 o     44.2   19.1   28.0950  17.2401    28.0950  17.2401    28.0950  17.2401       44.2     19.1       44.2       19.1     0.0     0.0 
1 1 1   56    2    1 o    102.5    6.2    0.0000   0.0000          ?        ?   105.3561  12.7704          ?        ?      102.5        6.2       ?       ? 
1 1 1   56    2    2 o    330.1    3.0    0.0000   0.0000          ?        ?  1089.9564  19.7942          ?        ?      330.1        3.0       ?       ? 
1 1 1   56    2    3 f    458.5    3.1    0.0000   0.0000          ?        ?  2103.2903  28.7335          ?        ?      458.5        3.1       ?       ? 
1 1 1   56    2    4 o    160.1    4.2    0.0000   0.0000          ?        ?   256.6857  13.4090          ?        ?      160.1        4.2       ?       ? 
1 1 1   56    2    5 o    366.4    3.2    0.0000   0.0000          ?        ?  1343.4495  23.6253          ?        ?      366.4        3.2       ?       ? 
1 1 1   56    2    6 o    283.4    3.2    0.0000   0.0000          ?        ?   803.8987  17.8786          ?        ?      283.4        3.2       ?       ? 
1 1 1   56    2    7 o    353.6    2.8    0.0000   0.0000          ?        ?  1250.8638  19.7942          ?        ?      353.6        2.8       ?       ? 
1 1 1   56    2    8 o    273.9    3.4    0.0000   0.0000          ?        ?   750.9014  18.5171          ?        ?      273.9        3.4       ?       ? 
1 1 1   56    2    9 o     60.5   12.6    0.0000   0.0000          ?        ?    38.3113  14.6860          ?        ?       60.5       12.6       ?       ? 
1 1 1   56    2   10 o    239.2    3.2    0.0000   0.0000          ?        ?   572.7539  15.3245          ?        ?      239.2        3.2       ?       ? 
1 1 1   56    2   11 o    164.6    4.5    0.0000   0.0000          ?        ?   271.3717  14.6860          ?        ?      164.6        4.5       ?       ? 
1 1 1   56    2   12 f    555.9    3.2    0.0000   0.0000          ?        ?  3092.9988  35.7572          ?        ?      555.9        3.2       ?       ? 
1 1 1   56    2   13 o    126.9    6.3    0.0000   0.0000          ?        ?   161.5460  15.9630          ?        ?      126.9        6.3       ?       ? 
1 1 1   56    2   14 o    122.1    6.0    0.0000   0.0000          ?        ?   149.4141  14.6860          ?        ?      122.1        6.0       ?       ? 
1 1 1   56    2   15 o     89.5    7.8    0.0000   0.0000          ?        ?    80.4537  14.0475          ?        ?       89.5        7.8       ?       ? 
1 1 1   56    2   16 o     34.2   14.4    0.0000   0.0000          ?        ?     1.9156  16.6016          ?        ?       34.2       14.4       ?       ? 
1 1 1   56    2   17 o    155.4    4.9    0.0000   0.0000          ?        ?   241.9997  15.3245          ?        ?      155.4        4.9       ?       ? 
1 1 1   56    2   18 o    341.2    2.8    0.0000   0.0000          ?        ?  1164.6635  19.1556          ?        ?      341.2        2.8       ?       ? 
1 1 1   56    2   19 o     50.1   14.1    0.0000   0.0000          ?        ?    26.1794  14.6860          ?        ?       50.1       14.1       ?       ? 
1 1 1   56    2   20 o    266.9    3.3    0.0000   0.0000          ?        ?   713.2286  17.8786          ?        ?      266.9        3.3       ?       ? 
1 1 1   56    2   21 o     82.0    9.0    0.0000   0.0000          ?        ?    67.6833  14.6860          ?        ?       82.0        9.0       ?       ? 
1 1 1   56    2   22 o    219.4    3.6    0.0000   0.0000          ?        ?   482.0838  15.9630          ?        ?      219.4        3.6       ?       ? 
1 1 1   56    2   23 o    219.0    3.8    0.0000   0.0000          ?        ?   480.1682  16.6016          ?        ?      219.0        3.8       ?       ? 
1 1 1   56    2   24 o    245.9    3.4    0.0000   0.0000          ?        ?   605.3185  16.6016          ?        ?      245.9        3.4       ?       ? 
1 1 1   56    2   25 o     77.6    9.1    0.0000   0.0000          ?        ?    60.6596  14.0475          ?        ?       77.6        9.1       ?       ? 
1 1 1   56    2   26 o     19.1    9.6    0.0000   0.0000          ?        ?   -42.1424  15.3245          ?        ?       19.1        9.6       ?       ? 
1 1 1   56    2   27 o     85.7    8.9    0.0000   0.0000          ?        ?    74.0685  15.3245          ?        ?       85.7        8.9       ?       ? 
1 1 1   56    2   28 o     19.5    9.7    0.0000   0.0000          ?        ?   -40.2269  15.3245          ?        ?       19.5        9.7       ?       ? 
1 1 1   56    2   29 o    108.7    6.8    0.0000   0.0000          ?        ?   118.7650  14.6860          ?        ?      108.7        6.8       ?       ? 
1 1 1   56    2   30 o    426.1    2.6    0.0000   0.0000          ?        ?  1817.2325  22.3483          ?        ?      426.1        2.6       ?       ? 
1 1 1   56    2   31 o    114.9    6.9    0.0000   0.0000          ?        ?   132.8125  15.9630          ?        ?      114.9        6.9       ?       ? 
1 1 1   56    2   32 o     23.7   11.4    0.0000   0.0000          ?        ?   -21.0712  15.3245          ?        ?       23.7       11.4       ?       ? 
1 1 1   56    2   33 o     21.0   10.4    0.0000   0.0000          ?        ?   -35.7572  15.9630          ?        ?       21.0       10.4       ?       ? 
1 1 1   56    2   34 o    184.4    4.5    0.0000   0.0000          ?        ?   340.9706  16.6016          ?        ?      184.4        4.5       ?       ? 
1 1 1   56    2   35 o    166.6    5.0    0.0000   0.0000          ?        ?   278.3954  16.6016          ?        ?      166.6        5.0       ?       ? 
1 1 1   56    2   36 o    122.9    6.8    0.0000   0.0000          ?        ?   151.9681  16.6016          ?        ?      122.9        6.8       ?       ? 
1 1 1   56    2   37 o    323.8    3.1    0.0000   0.0000          ?        ?  1049.7295  19.7942          ?        ?      323.8        3.1       ?       ? 
1 1 1   56    2   38 o    240.3    3.7    0.0000   0.0000          ?        ?   578.5006  17.8786          ?        ?      240.3        3.7       ?       ? 
1 1 1   56    2   39 o    183.4    4.7    0.0000   0.0000          ?        ?   337.7780  17.2401          ?        ?      183.4        4.7       ?       ? 
1 1 1   56    2   40 o     96.5    8.9    0.0000   0.0000          ?        ?    94.5012  17.2401          ?        ?       96.5        8.9       ?       ? 
1 1 1   56    2   41 o    135.8    6.1    0.0000   0.0000          ?        ?   185.8098  16.6016          ?        ?      135.8        6.1       ?       ? 
1 1 1   56    2   42 o     97.7    8.8    0.0000   0.0000          ?        ?    97.0553  17.2401          ?        ?       97.7        8.8       ?       ? 
1 1 1   56    3    0 o    244.1    4.7  597.0177  22.9868   597.0177  22.9868   597.0177  22.9868      244.1      4.7      244.1        4.7     0.0     0.0 
1 1 1   56    3    1 o    597.6    3.5    0.0000   0.0000          ?        ?  3574.4441  42.1424          ?        ?      597.6        3.5       ?       ? 
1 1 1   56    3    2 o    319.7    3.0    0.0000   0.0000          ?        ?  1022.9116  19.1556          ?        ?      319.7        3.0       ?       ? 
1 1 1   56    3    3 o    267.9    3.1    0.0000   0.0000          ?        ?   718.3369  16.6016          ?        ?      267.9        3.1       ?       ? 
1 1 1   56    3    4 o    335.9    3.2    0.0000   0.0000          ?        ?  1128.9062  21.7097          ?        ?      335.9        3.2       ?       ? 
1 1 1   56    3    5 o    270.9    3.1    0.0000   0.0000          ?        ?   734.2999  16.6016          ?        ?      270.9        3.1       ?       ? 
1 1 1   56    3    6 o    345.3    3.1    0.0000   0.0000          ?        ?  1192.7584  21.0712          ?        ?      345.3        3.1       ?       ? 
1 1 1   56    3    7 o    184.7    4.0    0.0000   0.0000          ?        ?   341.6091  14.6860          ?        ?      184.7        4.0       ?       ? 
1 1 1   56    3    8 f    178.4    4.3    0.0000   0.0000          ?        ?   318.6223  15.3245          ?        ?      178.4        4.3       ?       ? 
1 1 1   56    3    9 o    184.2    4.2    0.0000   0.0000          ?        ?   339.6935  15.3245          ?        ?      184.2        4.2       ?       ? 
1 1 1   56    3   10 o    124.1    6.2    0.0000   0.0000          ?        ?   154.5222  15.3245          ?        ?      124.1        6.2       ?       ? 
1 1 1   56    3   11 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   56    3   12 o    185.9    4.5    0.0000   0.0000          ?        ?   346.0787  16.6016          ?        ?      185.9        4.5       ?       ? 
1 1 1   56    3   13 o    204.4    3.9    0.0000   0.0000          ?        ?   418.2317  15.9630          ?        ?      204.4        3.9       ?       ? 
1 1 1   56    3   14 o    404.2    3.3    0.0000   0.0000          ?        ?  1635.2539  26.8179          ?        ?      404.2        3.3       ?       ? 
1 1 1   56    3   15 o    136.4    5.6    0.0000   0.0000          ?        ?   186.4483  15.3245          ?        ?      136.4        5.6       ?       ? 
1 1 1   56    3   16 o    230.2    3.6    0.0000   0.0000          ?        ?   530.6115  16.6016          ?        ?      230.2        3.6       ?       ? 
1 1 1   56    3   17 o     37.8   14.9    0.0000   0.0000          ?        ?     8.3008  16.6016          ?        ?       37.8       14.9       ?       ? 
1 1 1   56    3   18 o    130.9    5.6    0.0000   0.0000          ?        ?   171.7623  14.6860          ?        ?      130.9        5.6       ?       ? 
1 1 1   56    3   19 o    189.5    4.2    0.0000   0.0000          ?        ?   359.4877  15.9630          ?        ?      189.5        4.2       ?       ? 
1 1 1   56    3   20 o    218.3    3.7    0.0000   0.0000          ?        ?   476.9756  15.9630          ?        ?      218.3        3.7       ?       ? 
1 1 1   56    3   21 o     55.0   13.4    0.0000   0.0000          ?        ?    31.9261  14.6860          ?        ?       55.0       13.4       ?       ? 
1 1 1   56    3   22 o    173.4    4.8    0.0000   0.0000          ?        ?   301.3822  16.6016          ?        ?      173.4        4.8       ?       ? 
1 1 1   56    3   23 o     69.8   10.5    0.0000   0.0000          ?        ?    49.1662  14.6860          ?        ?       69.8       10.5       ?       ? 
1 1 1   56    3   24 o     16.5    8.3    0.0000   0.0000          ?        ?   -45.9736  13.4090          ?        ?       16.5        8.3       ?       ? 
1 1 1   56    3   25 o     32.2   13.8    0.0000   0.0000          ?        ?    -0.6385  15.9630          ?        ?       32.2       13.8       ?       ? 
1 1 1   56    3   26 o    289.6    3.1    0.0000   0.0000          ?        ?   839.6559  17.8786          ?        ?      289.6        3.1       ?       ? 
1 1 1   56    3   27 o    194.1    4.4    0.0000   0.0000          ?        ?   377.3663  17.2401          ?        ?      194.1        4.4       ?       ? 
1 1 1   56    3   28 o    137.2    5.8    0.0000   0.0000          ?        ?   189.0024  15.9630          ?        ?      137.2        5.8       ?       ? 
1 1 1   56    3   29 f    279.8    3.1    0.0000   0.0000          ?        ?   783.4660  17.2401          ?        ?      279.8        3.1       ?       ? 
1 1 1   56    3   30 o     95.2    8.4    0.0000   0.0000          ?        ?    91.3086  15.9630          ?        ?       95.2        8.4       ?       ? 
1 1 1   56    3   31 o     83.0    9.2    0.0000   0.0000          ?        ?    69.5989  15.3245          ?        ?       83.0        9.2       ?       ? 
1 1 1   56    3   32 f     17.9    9.0    0.0000   0.0000          ?        ?   -50.4432  15.3245          ?        ?       17.9        9.0       ?       ? 
1 1 1   56    3   33 f     24.8   11.8    0.0000   0.0000          ?        ?   -19.7942  15.9630          ?        ?       24.8       11.8       ?       ? 
1 1 1   56    3   34 o    111.5    7.2    0.0000   0.0000          ?        ?   125.1502  15.9630          ?        ?      111.5        7.2       ?       ? 
1 1 1   56    3   35 o    249.6    3.3    0.0000   0.0000          ?        ?   623.8356  16.6016          ?        ?      249.6        3.3       ?       ? 
1 1 1   56    3   36 o    175.3    4.7    0.0000   0.0000          ?        ?   308.4059  16.6016          ?        ?      175.3        4.7       ?       ? 
1 1 1   56    3   37 o    228.3    3.8    0.0000   0.0000          ?        ?   522.3107  17.2401          ?        ?      228.3        3.8       ?       ? 
1 1 1   56    3   38 o    139.8    6.2    0.0000   0.0000          ?        ?   196.6647  17.2401          ?        ?      139.8        6.2       ?       ? 
1 1 1   56    3   39 o    183.1    4.7    0.0000   0.0000          ?        ?   336.5009  17.2401          ?        ?      183.1        4.7       ?       ? 
1 1 1   56    3   40 o     23.9   11.5    0.0000   0.0000          ?        ?   -22.3483  15.9630          ?        ?       23.9       11.5       ?       ? 
1 1 1   56    3   41 o    147.7    5.8    0.0000   0.0000          ?        ?   219.6514  17.2401          ?        ?      147.7        5.8       ?       ? 
1 1 1   56    4    0 o    241.9    4.6  586.1629  22.3483   586.1629  22.3483   586.1629  22.3483      241.9      4.6      241.9        4.6     0.0     0.0 
1 1 1   56    4    1 o    149.2    4.5    0.0000   0.0000          ?        ?   222.8441  13.4090          ?        ?      149.2        4.5       ?       ? 
1 1 1   56    4    2 o    400.4    3.2    0.0000   0.0000          ?        ?  1604.6049  25.5409          ?        ?      400.4        3.2       ?       ? 
1 1 1   56    4    3 o    140.1    4.8    0.0000   0.0000          ?        ?   196.6647  13.4090          ?        ?      140.1        4.8       ?       ? 
1 1 1   56    4    4 o     69.0    9.3    0.0000   0.0000          ?        ?    47.8891  12.7704          ?        ?       69.0        9.3       ?       ? 
1 1 1   56    4    5 o    140.6    5.0    0.0000   0.0000          ?        ?   197.9417  14.0475          ?        ?      140.6        5.0       ?       ? 
1 1 1   56    4    6 o    371.0    3.1    0.0000   0.0000          ?        ?  1377.2911  22.9868          ?        ?      371.0        3.1       ?       ? 
1 1 1   56    4    7 o    117.0    6.3    0.0000   0.0000          ?        ?   137.2822  14.6860          ?        ?      117.0        6.3       ?       ? 
1 1 1   56    4    8 o    385.3    3.1    0.0000   0.0000          ?        ?  1485.8398  24.2638          ?        ?      385.3        3.1       ?       ? 
1 1 1   56    4    9 o    438.4    3.3    0.0000   0.0000          ?        ?  1923.8656  28.7335          ?        ?      438.4        3.3       ?       ? 
1 1 1   56    4   10 o    167.7    4.6    0.0000   0.0000          ?        ?   281.5880  15.3245          ?        ?      167.7        4.6       ?       ? 
1 1 1   56    4   11 o    432.9    3.1    0.0000   0.0000          ?        ?  1875.3381  26.8179          ?        ?      432.9        3.1       ?       ? 
1 1 1   56    4   12 o    250.4    3.4    0.0000   0.0000          ?        ?   627.6667  17.2401          ?        ?      250.4        3.4       ?       ? 
1 1 1   56    4   13 o    309.4    3.2    0.0000   0.0000          ?        ?   957.7824  19.7942          ?        ?      309.4        3.2       ?       ? 
1 1 1   56    4   14 o    343.4    3.3    0.0000   0.0000          ?        ?  1179.9880  22.9868          ?        ?      343.4        3.3       ?       ? 
1 1 1   56    4   15 o    307.0    3.2    0.0000   0.0000          ?        ?   943.0964  19.7942          ?        ?      307.0        3.2       ?       ? 
1 1 1   56    4   16 o    101.8    6.9    0.0000   0.0000          ?        ?   104.0790  14.0475          ?        ?      101.8        6.9       ?       ? 
1 1 1   56    4   17 o    127.7    5.5    0.0000   0.0000          ?        ?   163.4615  14.0475          ?        ?      127.7        5.5       ?       ? 
1 1 1   56    4   18 o    220.4    4.3    0.0000   0.0000          ?        ?   486.5535  19.1556          ?        ?      220.4        4.3       ?       ? 
1 1 1   56    4   19 o     57.7   13.5    0.0000   0.0000          ?        ?    35.1187  15.3245          ?        ?       57.7       13.5       ?       ? 
1 1 1   56    4   20 o    283.9    3.4    0.0000   0.0000          ?        ?   807.0914  19.1556          ?        ?      283.9        3.4       ?       ? 
1 1 1   56    4   21 o     26.9   12.3    0.0000   0.0000          ?        ?    -9.5778  14.6860          ?        ?       26.9       12.3       ?       ? 
1 1 1   56    4   22 o    135.2    5.2    0.0000   0.0000          ?        ?   183.2557  14.0475          ?        ?      135.2        5.2       ?       ? 
1 1 1   56    4   23 o    129.9    5.9    0.0000   0.0000          ?        ?   169.2082  15.3245          ?        ?      129.9        5.9       ?       ? 
1 1 1   56    4   24 o    308.1    2.9    0.0000   0.0000          ?        ?   950.1202  17.8786          ?        ?      308.1        2.9       ?       ? 
1 1 1   56    4   25 o    143.4    5.3    0.0000   0.0000          ?        ?   206.2425  15.3245          ?        ?      143.4        5.3       ?       ? 
1 1 1   56    4   26 o    127.1    6.0    0.0000   0.0000          ?        ?   162.1845  15.3245          ?        ?      127.1        6.0       ?       ? 
1 1 1   56    4   27 o     30.9   13.4    0.0000   0.0000          ?        ?    -1.9156  15.3245          ?        ?       30.9       13.4       ?       ? 
1 1 1   56    4   28 o     19.7    9.8    0.0000   0.0000          ?        ?   -38.9498  15.3245          ?        ?       19.7        9.8       ?       ? 
1 1 1   56    4   29 o    176.3    4.5    0.0000   0.0000          ?        ?   311.5985  15.9630          ?        ?      176.3        4.5       ?       ? 
1 1 1   56    4   30 o    508.8    2.6    0.0000   0.0000          ?        ?  2591.1206  26.8179          ?        ?      508.8        2.6       ?       ? 
1 1 1   56    4   31 o    268.1    3.3    0.0000   0.0000          ?        ?   719.6138  17.8786          ?        ?      268.1        3.3       ?       ? 
1 1 1   56    4   32 o    211.5    3.9    0.0000   0.0000          ?        ?   448.2422  16.6016          ?        ?      211.5        3.9       ?       ? 
1 1 1   56    4   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   56    4   34 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   56    4   35 o    177.9    4.5    0.0000   0.0000          ?        ?   317.3452  15.9630          ?        ?      177.9        4.5       ?       ? 
1 1 1   56    4   36 o     70.3   11.4    0.0000   0.0000          ?        ?    50.4432  15.9630          ?        ?       70.3       11.4       ?       ? 
1 1 1   56    4   37 o    197.3    4.4    0.0000   0.0000          ?        ?   390.7752  17.2401          ?        ?      197.3        4.4       ?       ? 
1 1 1   56    4   38 o    303.3    3.3    0.0000   0.0000          ?        ?   922.0252  19.7942          ?        ?      303.3        3.3       ?       ? 
1 1 1   56    4   39 o    307.4    3.0    0.0000   0.0000          ?        ?   946.9276  18.5171          ?        ?      307.4        3.0       ?       ? 
1 1 1   56    4   40 o    102.9    8.1    0.0000   0.0000          ?        ?   107.2716  16.6016          ?        ?      102.9        8.1       ?       ? 
1 1 1   56    5    0 o     13.2    9.8  -54.2743  18.5171   -54.2743  18.5171   -54.2743  18.5171       13.2      9.8       13.2        9.8     0.0     0.0 
1 1 1   56    5    1 o    154.8    5.2    0.0000   0.0000          ?        ?   240.0841  15.9630          ?        ?      154.8        5.2       ?       ? 
1 1 1   56    5    2 o     87.0    8.1    0.0000   0.0000          ?        ?    75.9841  14.0475          ?        ?       87.0        8.1       ?       ? 
1 1 1   56    5    3 o    227.3    3.8    0.0000   0.0000          ?        ?   517.2025  17.2401          ?        ?      227.3        3.8       ?       ? 
1 1 1   56    5    4 o    325.4    3.2    0.0000   0.0000          ?        ?  1059.9459  21.0712          ?        ?      325.4        3.2       ?       ? 
1 1 1   56    5    5 o    240.5    3.5    0.0000   0.0000          ?        ?   579.1391  16.6016          ?        ?      240.5        3.5       ?       ? 
1 1 1   56    5    6 o    232.5    4.1    0.0000   0.0000          ?        ?   541.4664  19.1556          ?        ?      232.5        4.1       ?       ? 
1 1 1   56    5    7 o    222.3    4.0    0.0000   0.0000          ?        ?   494.8542  17.8786          ?        ?      222.3        4.0       ?       ? 
1 1 1   56    5    8 o     92.3    7.6    0.0000   0.0000          ?        ?    85.5619  14.0475          ?        ?       92.3        7.6       ?       ? 
1 1 1   56    5    9 o    338.5    3.2    0.0000   0.0000          ?        ?  1146.7849  21.7097          ?        ?      338.5        3.2       ?       ? 
1 1 1   56    5   10 o    165.2    4.4    0.0000   0.0000          ?        ?   273.2873  14.6860          ?        ?      165.2        4.4       ?       ? 
1 1 1   56    5   11 o    299.0    3.1    0.0000   0.0000          ?        ?   894.5688  18.5171          ?        ?      299.0        3.1       ?       ? 
1 1 1   56    5   12 o    201.2    3.8    0.0000   0.0000          ?        ?   405.4612  15.3245          ?        ?      201.2        3.8       ?       ? 
1 1 1   56    5   13 o     39.3   14.3    0.0000   0.0000          ?        ?    12.7704  14.6860          ?        ?       39.3       14.3       ?       ? 
1 1 1   56    5   14 o    165.5    5.0    0.0000   0.0000          ?        ?   274.5643  16.6016          ?        ?      165.5        5.0       ?       ? 
1 1 1   56    5   15 o    100.2    7.3    0.0000   0.0000          ?        ?   100.8864  14.6860          ?        ?      100.2        7.3       ?       ? 
1 1 1   56    5   16 o    291.3    3.3    0.0000   0.0000          ?        ?   849.2338  19.1556          ?        ?      291.3        3.3       ?       ? 
1 1 1   56    5   17 o    300.3    3.3    0.0000   0.0000          ?        ?   902.8696  19.7942          ?        ?      300.3        3.3       ?       ? 
1 1 1   56    5   18 o    247.5    3.2    0.0000   0.0000          ?        ?   612.9808  15.9630          ?        ?      247.5        3.2       ?       ? 
1 1 1   56    5   19 o     58.2   13.0    0.0000   0.0000          ?        ?    35.7572  14.6860          ?        ?       58.2       13.0       ?       ? 
1 1 1   56    5   20 o     64.1   13.8    0.0000   0.0000          ?        ?    43.4195  17.2401          ?        ?       64.1       13.8       ?       ? 
1 1 1   56    5   21 f     18.2    9.2    0.0000   0.0000          ?        ?   -43.4195  14.6860          ?        ?       18.2        9.2       ?       ? 
1 1 1   56    5   22 o    103.0    7.4    0.0000   0.0000          ?        ?   106.6331  15.3245          ?        ?      103.0        7.4       ?       ? 
1 1 1   56    5   23 o    196.9    4.2    0.0000   0.0000          ?        ?   388.2211  16.6016          ?        ?      196.9        4.2       ?       ? 
1 1 1   56    5   24 o    125.8    6.1    0.0000   0.0000          ?        ?   158.9919  15.3245          ?        ?      125.8        6.1       ?       ? 
1 1 1   56    5   25 o    129.8    6.1    0.0000   0.0000          ?        ?   169.2082  15.9630          ?        ?      129.8        6.1       ?       ? 
1 1 1   56    5   26 o     71.4   10.7    0.0000   0.0000          ?        ?    51.7203  15.3245          ?        ?       71.4       10.7       ?       ? 
1 1 1   56    5   27 o    223.8    3.9    0.0000   0.0000          ?        ?   501.8780  17.2401          ?        ?      223.8        3.9       ?       ? 
1 1 1   56    5   28 o    173.6    4.2    0.0000   0.0000          ?        ?   302.0207  14.6860          ?        ?      173.6        4.2       ?       ? 
1 1 1   56    5   29 o    240.6    3.4    0.0000   0.0000          ?        ?   579.7776  16.6016          ?        ?      240.6        3.4       ?       ? 
1 1 1   56    5   30 o    249.3    3.3    0.0000   0.0000          ?        ?   622.5586  16.6016          ?        ?      249.3        3.3       ?       ? 
1 1 1   56    5   31 o     75.7   10.1    0.0000   0.0000          ?        ?    58.1055  15.3245          ?        ?       75.7       10.1       ?       ? 
1 1 1   56    5   32 o    152.8    5.0    0.0000   0.0000          ?        ?   234.3374  15.3245          ?        ?      152.8        5.0       ?       ? 
1 1 1   56    5   33 o    210.4    3.9    0.0000   0.0000          ?        ?   443.7725  16.6016          ?        ?      210.4        3.9       ?       ? 
1 1 1   56    5   34 o     92.7    8.3    0.0000   0.0000          ?        ?    86.8389  15.3245          ?        ?       92.7        8.3       ?       ? 
1 1 1   56    5   35 o     95.9    8.7    0.0000   0.0000          ?        ?    93.2242  16.6016          ?        ?       95.9        8.7       ?       ? 
1 1 1   56    5   36 o    208.4    4.1    0.0000   0.0000          ?        ?   435.4717  17.2401          ?        ?      208.4        4.1       ?       ? 
1 1 1   56    5   37 o    103.9    7.7    0.0000   0.0000          ?        ?   109.1872  15.9630          ?        ?      103.9        7.7       ?       ? 
1 1 1   56    5   38 o    111.6    7.2    0.0000   0.0000          ?        ?   125.7888  15.9630          ?        ?      111.6        7.2       ?       ? 
1 1 1   56    5   39 o    126.9    6.0    0.0000   0.0000          ?        ?   162.1845  15.3245          ?        ?      126.9        6.0       ?       ? 
1 1 1   56    6    0 o    526.4    5.3 2775.0151  56.1899  2775.0151  56.1899  2775.0151  56.1899      526.4      5.3      526.4        5.3     0.0     0.0 
1 1 1   56    6    1 o    196.1    3.9    0.0000   0.0000          ?        ?   385.0285  15.3245          ?        ?      196.1        3.9       ?       ? 
1 1 1   56    6    2 o    170.1    4.1    0.0000   0.0000          ?        ?   289.8888  14.0475          ?        ?      170.1        4.1       ?       ? 
1 1 1   56    6    3 o    528.3    3.6    0.0000   0.0000          ?        ?  2793.5322  38.3113          ?        ?      528.3        3.6       ?       ? 
1 1 1   56    6    4 o    303.0    3.2    0.0000   0.0000          ?        ?   918.8326  19.1556          ?        ?      303.0        3.2       ?       ? 
1 1 1   56    6    5 o    293.4    3.2    0.0000   0.0000          ?        ?   861.3657  18.5171          ?        ?      293.4        3.2       ?       ? 
1 1 1   56    6    6 f    154.6    4.5    0.0000   0.0000          ?        ?   239.4456  14.0475          ?        ?      154.6        4.5       ?       ? 
1 1 1   56    6    7 o    387.5    3.0    0.0000   0.0000          ?        ?  1502.4414  23.6253          ?        ?      387.5        3.0       ?       ? 
1 1 1   56    6    8 o    429.2    3.3    0.0000   0.0000          ?        ?  1844.0504  28.0950          ?        ?      429.2        3.3       ?       ? 
1 1 1   56    6    9 o    358.7    3.0    0.0000   0.0000          ?        ?  1287.8981  21.7097          ?        ?      358.7        3.0       ?       ? 
1 1 1   56    6   10 o    182.1    3.9    0.0000   0.0000          ?        ?   332.0312  14.0475          ?        ?      182.1        3.9       ?       ? 
1 1 1   56    6   11 o    119.4    5.9    0.0000   0.0000          ?        ?   143.0288  14.0475          ?        ?      119.4        5.9       ?       ? 
1 1 1   56    6   12 o    178.5    4.3    0.0000   0.0000          ?        ?   319.2608  15.3245          ?        ?      178.5        4.3       ?       ? 
1 1 1   56    6   13 o    266.0    3.4    0.0000   0.0000          ?        ?   708.1205  17.8786          ?        ?      266.0        3.4       ?       ? 
1 1 1   56    6   14 o    142.1    5.4    0.0000   0.0000          ?        ?   202.4114  15.3245          ?        ?      142.1        5.4       ?       ? 
1 1 1   56    6   15 o    115.9    6.3    0.0000   0.0000          ?        ?   134.7281  14.6860          ?        ?      115.9        6.3       ?       ? 
1 1 1   56    6   16 o     23.9   11.4    0.0000   0.0000          ?        ?   -17.8786  14.6860          ?        ?       23.9       11.4       ?       ? 
1 1 1   56    6   17 o    146.3    4.8    0.0000   0.0000          ?        ?   214.5433  14.0475          ?        ?      146.3        4.8       ?       ? 
1 1 1   56    6   18 o     37.4   14.2    0.0000   0.0000          ?        ?    10.2163  14.6860          ?        ?       37.4       14.2       ?       ? 
1 1 1   56    6   19 o     41.8   15.3    0.0000   0.0000          ?        ?    14.6860  16.6016          ?        ?       41.8       15.3       ?       ? 
1 1 1   56    6   20 o     91.8    8.3    0.0000   0.0000          ?        ?    84.9234  15.3245          ?        ?       91.8        8.3       ?       ? 
1 1 1   56    6   21 o    201.3    4.3    0.0000   0.0000          ?        ?   406.0997  17.2401          ?        ?      201.3        4.3       ?       ? 
1 1 1   56    6   22 o     26.6   12.4    0.0000   0.0000          ?        ?   -14.0475  15.9630          ?        ?       26.6       12.4       ?       ? 
1 1 1   56    6   23 o    152.0    5.3    0.0000   0.0000          ?        ?   231.7833  15.9630          ?        ?      152.0        5.3       ?       ? 
1 1 1   56    6   24 o    153.5    5.2    0.0000   0.0000          ?        ?   236.2530  15.9630          ?        ?      153.5        5.2       ?       ? 
1 1 1   56    6   25 o    100.1    7.7    0.0000   0.0000          ?        ?   100.8864  15.3245          ?        ?      100.1        7.7       ?       ? 
1 1 1   56    6   26 o    147.1    5.4    0.0000   0.0000          ?        ?   217.0974  15.9630          ?        ?      147.1        5.4       ?       ? 
1 1 1   56    6   27 o    277.3    3.2    0.0000   0.0000          ?        ?   770.0571  17.8786          ?        ?      277.3        3.2       ?       ? 
1 1 1   56    6   28 o    190.9    4.3    0.0000   0.0000          ?        ?   365.2344  16.6016          ?        ?      190.9        4.3       ?       ? 
1 1 1   56    6   29 o    239.5    3.7    0.0000   0.0000          ?        ?   574.6694  17.8786          ?        ?      239.5        3.7       ?       ? 
1 1 1   56    6   30 o     28.6   13.0    0.0000   0.0000          ?        ?   -10.2163  16.6016          ?        ?       28.6       13.0       ?       ? 
1 1 1   56    6   31 o    159.5    4.8    0.0000   0.0000          ?        ?   255.4086  15.3245          ?        ?      159.5        4.8       ?       ? 
1 1 1   56    6   32 o    104.7    7.3    0.0000   0.0000          ?        ?   110.4642  15.3245          ?        ?      104.7        7.3       ?       ? 
1 1 1   56    6   33 o     90.2    8.5    0.0000   0.0000          ?        ?    82.3693  15.3245          ?        ?       90.2        8.5       ?       ? 
1 1 1   56    6   34 o    131.6    5.8    0.0000   0.0000          ?        ?   174.3164  15.3245          ?        ?      131.6        5.8       ?       ? 
1 1 1   56    6   35 o    180.7    4.4    0.0000   0.0000          ?        ?   327.5616  15.9630          ?        ?      180.7        4.4       ?       ? 
1 1 1   56    6   36 o    196.2    4.4    0.0000   0.0000          ?        ?   386.3056  17.2401          ?        ?      196.2        4.4       ?       ? 
1 1 1   56    6   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   56    7    0 f    388.2    4.8 1508.8267  37.0343  1508.8267  37.0343  1508.8267  37.0343      388.2      4.8      388.2        4.8     0.0     0.0 
1 1 1   56    7    1 o    123.1    5.4    0.0000   0.0000          ?        ?   151.9681  13.4090          ?        ?      123.1        5.4       ?       ? 
1 1 1   56    7    2 o    204.1    3.8    0.0000   0.0000          ?        ?   416.9547  15.3245          ?        ?      204.1        3.8       ?       ? 
1 1 1   56    7    3 o    258.4    3.2    0.0000   0.0000          ?        ?   668.5321  16.6016          ?        ?      258.4        3.2       ?       ? 
1 1 1   56    7    4 o     22.4   10.7    0.0000   0.0000          ?        ?   -17.8786  13.4090          ?        ?       22.4       10.7       ?       ? 
1 1 1   56    7    5 o    145.5    4.6    0.0000   0.0000          ?        ?   211.9892  13.4090          ?        ?      145.5        4.6       ?       ? 
1 1 1   56    7    6 o    257.1    3.4    0.0000   0.0000          ?        ?   661.5084  17.2401          ?        ?      257.1        3.4       ?       ? 
1 1 1   56    7    7 o     41.1   14.4    0.0000   0.0000          ?        ?    15.3245  14.6860          ?        ?       41.1       14.4       ?       ? 
1 1 1   56    7    8 o    148.7    4.5    0.0000   0.0000          ?        ?   221.5670  13.4090          ?        ?      148.7        4.5       ?       ? 
1 1 1   56    7    9 o     54.5   12.6    0.0000   0.0000          ?        ?    31.2876  13.4090          ?        ?       54.5       12.6       ?       ? 
1 1 1   56    7   10 o    167.1    4.6    0.0000   0.0000          ?        ?   279.6725  15.3245          ?        ?      167.1        4.6       ?       ? 
1 1 1   56    7   11 o    291.2    3.3    0.0000   0.0000          ?        ?   848.5952  19.1556          ?        ?      291.2        3.3       ?       ? 
1 1 1   56    7   12 o    244.6    3.5    0.0000   0.0000          ?        ?   598.9333  17.2401          ?        ?      244.6        3.5       ?       ? 
1 1 1   56    7   13 o    148.7    5.2    0.0000   0.0000          ?        ?   221.5670  15.3245          ?        ?      148.7        5.2       ?       ? 
1 1 1   56    7   14 o    119.9    6.4    0.0000   0.0000          ?        ?   144.3059  15.3245          ?        ?      119.9        6.4       ?       ? 
1 1 1   56    7   15 o    165.3    4.8    0.0000   0.0000          ?        ?   273.9258  15.9630          ?        ?      165.3        4.8       ?       ? 
1 1 1   56    7   16 o    138.6    6.5    0.0000   0.0000          ?        ?   192.8335  17.8786          ?        ?      138.6        6.5       ?       ? 
1 1 1   56    7   17 o    325.8    3.4    0.0000   0.0000          ?        ?  1062.5000  22.3483          ?        ?      325.8        3.4       ?       ? 
1 1 1   56    7   18 o    157.2    5.1    0.0000   0.0000          ?        ?   247.7464  15.9630          ?        ?      157.2        5.1       ?       ? 
1 1 1   56    7   19 o    135.1    5.9    0.0000   0.0000          ?        ?   183.2557  15.9630          ?        ?      135.1        5.9       ?       ? 
1 1 1   56    7   20 o    119.0    7.0    0.0000   0.0000          ?        ?   142.3903  16.6016          ?        ?      119.0        7.0       ?       ? 
1 1 1   56    7   21 o     60.1   13.6    0.0000   0.0000          ?        ?    38.3113  15.9630          ?        ?       60.1       13.6       ?       ? 
1 1 1   56    7   22 o     32.8   14.1    0.0000   0.0000          ?        ?    -0.6385  16.6016          ?        ?       32.8       14.1       ?       ? 
1 1 1   56    7   23 o    329.9    3.1    0.0000   0.0000          ?        ?  1089.3180  20.4327          ?        ?      329.9        3.1       ?       ? 
1 1 1   56    7   24 o    131.3    5.8    0.0000   0.0000          ?        ?   173.0394  15.3245          ?        ?      131.3        5.8       ?       ? 
1 1 1   56    7   25 o     89.7    8.2    0.0000   0.0000          ?        ?    81.0922  14.6860          ?        ?       89.7        8.2       ?       ? 
1 1 1   56    7   26 o     21.4   10.5    0.0000   0.0000          ?        ?   -26.8179  14.6860          ?        ?       21.4       10.5       ?       ? 
1 1 1   56    7   27 o    155.5    5.1    0.0000   0.0000          ?        ?   242.6382  15.9630          ?        ?      155.5        5.1       ?       ? 
1 1 1   56    7   28 o    118.2    6.5    0.0000   0.0000          ?        ?   140.4748  15.3245          ?        ?      118.2        6.5       ?       ? 
1 1 1   56    7   29 o    175.8    4.9    0.0000   0.0000          ?        ?   310.3215  17.2401          ?        ?      175.8        4.9       ?       ? 
1 1 1   56    7   30 o    143.7    5.3    0.0000   0.0000          ?        ?   207.5195  15.3245          ?        ?      143.7        5.3       ?       ? 
1 1 1   56    7   31 o    183.7    4.3    0.0000   0.0000          ?        ?   338.4165  15.9630          ?        ?      183.7        4.3       ?       ? 
1 1 1   56    7   32 o    267.6    3.1    0.0000   0.0000          ?        ?   717.0598  16.6016          ?        ?      267.6        3.1       ?       ? 
1 1 1   56    7   33 o    191.5    4.3    0.0000   0.0000          ?        ?   367.7885  16.6016          ?        ?      191.5        4.3       ?       ? 
1 1 1   56    7   34 o    154.6    5.2    0.0000   0.0000          ?        ?   240.0841  15.9630          ?        ?      154.6        5.2       ?       ? 
1 1 1   56    7   35 o     36.2   14.7    0.0000   0.0000          ?        ?     6.3852  16.6016          ?        ?       36.2       14.7       ?       ? 
1 1 1   56    7   36 o    182.2    4.4    0.0000   0.0000          ?        ?   333.3083  15.9630          ?        ?      182.2        4.4       ?       ? 
1 1 1   56    8    0 o     24.6   15.9    0.6385  17.8786     0.6385  17.8786     0.6385  17.8786       24.6     15.9       24.6       15.9     0.0     0.0 
1 1 1   56    8    1 o    189.8    4.0    0.0000   0.0000          ?        ?   360.7647  15.3245          ?        ?      189.8        4.0       ?       ? 
1 1 1   56    8    2 o    271.9    3.4    0.0000   0.0000          ?        ?   740.0466  18.5171          ?        ?      271.9        3.4       ?       ? 
1 1 1   56    8    3 o    189.8    3.9    0.0000   0.0000          ?        ?   360.7647  14.6860          ?        ?      189.8        3.9       ?       ? 
1 1 1   56    8    4 o     29.2   12.6    0.0000   0.0000          ?        ?    -1.2770  13.4090          ?        ?       29.2       12.6       ?       ? 
1 1 1   56    8    5 o    212.8    3.9    0.0000   0.0000          ?        ?   453.3503  16.6016          ?        ?      212.8        3.9       ?       ? 
1 1 1   56    8    6 o    345.2    3.1    0.0000   0.0000          ?        ?  1192.7584  21.0712          ?        ?      345.2        3.1       ?       ? 
1 1 1   56    8    7 o    234.9    3.3    0.0000   0.0000          ?        ?   552.3212  15.3245          ?        ?      234.9        3.3       ?       ? 
1 1 1   56    8    8 o    348.5    3.4    0.0000   0.0000          ?        ?  1215.7451  23.6253          ?        ?      348.5        3.4       ?       ? 
1 1 1   56    8    9 o    296.8    3.7    0.0000   0.0000          ?        ?   881.7984  21.7097          ?        ?      296.8        3.7       ?       ? 
1 1 1   56    8   10 o    117.8    6.0    0.0000   0.0000          ?        ?   139.1977  14.0475          ?        ?      117.8        6.0       ?       ? 
1 1 1   56    8   11 o     78.8    8.5    0.0000   0.0000          ?        ?    62.5751  13.4090          ?        ?       78.8        8.5       ?       ? 
1 1 1   56    8   12 o     75.5    9.3    0.0000   0.0000          ?        ?    57.4669  14.0475          ?        ?       75.5        9.3       ?       ? 
1 1 1   56    8   13 f    136.6    5.6    0.0000   0.0000          ?        ?   187.0868  15.3245          ?        ?      136.6        5.6       ?       ? 
1 1 1   56    8   14 o    212.8    3.8    0.0000   0.0000          ?        ?   453.3503  15.9630          ?        ?      212.8        3.8       ?       ? 
1 1 1   56    8   15 o     30.2   13.1    0.0000   0.0000          ?        ?    -1.9156  14.6860          ?        ?       30.2       13.1       ?       ? 
1 1 1   56    8   16 f    266.5    3.6    0.0000   0.0000          ?        ?   711.3131  19.1556          ?        ?      266.5        3.6       ?       ? 
1 1 1   56    8   17 o    119.0    6.7    0.0000   0.0000          ?        ?   142.3903  15.9630          ?        ?      119.0        6.7       ?       ? 
1 1 1   56    8   18 f    127.8    6.5    0.0000   0.0000          ?        ?   164.1001  16.6016          ?        ?      127.8        6.5       ?       ? 
1 1 1   56    8   19 o    196.6    3.7    0.0000   0.0000          ?        ?   386.9441  14.6860          ?        ?      196.6        3.7       ?       ? 
1 1 1   56    8   20 o    277.9    3.2    0.0000   0.0000          ?        ?   773.2497  17.8786          ?        ?      277.9        3.2       ?       ? 
1 1 1   56    8   21 o     74.1   10.3    0.0000   0.0000          ?        ?    55.5514  15.3245          ?        ?       74.1       10.3       ?       ? 
1 1 1   56    8   22 o    289.8    3.2    0.0000   0.0000          ?        ?   840.9330  18.5171          ?        ?      289.8        3.2       ?       ? 
1 1 1   56    8   23 o     94.8    8.8    0.0000   0.0000          ?        ?    90.6701  16.6016          ?        ?       94.8        8.8       ?       ? 
1 1 1   56    8   24 o    124.4    6.9    0.0000   0.0000          ?        ?   155.7993  17.2401          ?        ?      124.4        6.9       ?       ? 
1 1 1   56    8   25 o    124.7    6.7    0.0000   0.0000          ?        ?   156.4378  16.6016          ?        ?      124.7        6.7       ?       ? 
1 1 1   56    8   26 o    156.5    5.1    0.0000   0.0000          ?        ?   245.8308  15.9630          ?        ?      156.5        5.1       ?       ? 
1 1 1   56    8   27 f    148.6    5.2    0.0000   0.0000          ?        ?   221.5670  15.3245          ?        ?      148.6        5.2       ?       ? 
1 1 1   56    8   28 o     25.4   11.9    0.0000   0.0000          ?        ?   -15.3245  15.3245          ?        ?       25.4       11.9       ?       ? 
1 1 1   56    8   29 o    231.2    3.7    0.0000   0.0000          ?        ?   535.7197  17.2401          ?        ?      231.2        3.7       ?       ? 
1 1 1   56    8   30 o    174.0    4.6    0.0000   0.0000          ?        ?   303.9363  15.9630          ?        ?      174.0        4.6       ?       ? 
1 1 1   56    8   31 o     92.7    7.9    0.0000   0.0000          ?        ?    86.8389  14.6860          ?        ?       92.7        7.9       ?       ? 
1 1 1   56    8   32 o     66.7   12.9    0.0000   0.0000          ?        ?    47.2506  16.6016          ?        ?       66.7       12.9       ?       ? 
1 1 1   56    8   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   56    8   34 o    255.3    3.3    0.0000   0.0000          ?        ?   653.2076  16.6016          ?        ?      255.3        3.3       ?       ? 
1 1 1   56    9    0 o    113.0    8.6  130.2584  19.1556   130.2584  19.1556   130.2584  19.1556      113.0      8.6      113.0        8.6     0.0     0.0 
1 1 1   56    9    1 o    291.9    3.4    0.0000   0.0000          ?        ?   853.0649  19.7942          ?        ?      291.9        3.4       ?       ? 
1 1 1   56    9    2 o    222.3    3.4    0.0000   0.0000          ?        ?   494.8542  15.3245          ?        ?      222.3        3.4       ?       ? 
1 1 1   56    9    3 o    112.0    5.4    0.0000   0.0000          ?        ?   125.7888  12.1319          ?        ?      112.0        5.4       ?       ? 
1 1 1   56    9    4 o    121.5    5.3    0.0000   0.0000          ?        ?   148.1370  12.7704          ?        ?      121.5        5.3       ?       ? 
1 1 1   56    9    5 o    180.8    4.2    0.0000   0.0000          ?        ?   327.5616  15.3245          ?        ?      180.8        4.2       ?       ? 
1 1 1   56    9    6 o    124.3    5.9    0.0000   0.0000          ?        ?   155.1608  14.6860          ?        ?      124.3        5.9       ?       ? 
1 1 1   56    9    7 o     85.4    7.8    0.0000   0.0000          ?        ?    73.4300  13.4090          ?        ?       85.4        7.8       ?       ? 
1 1 1   56    9    8 o    131.4    5.3    0.0000   0.0000          ?        ?   173.0394  14.0475          ?        ?      131.4        5.3       ?       ? 
1 1 1   56    9    9 o    301.0    3.4    0.0000   0.0000          ?        ?   907.3393  20.4327          ?        ?      301.0        3.4       ?       ? 
1 1 1   56    9   10 o    290.6    3.6    0.0000   0.0000          ?        ?   845.4026  21.0712          ?        ?      290.6        3.6       ?       ? 
1 1 1   56    9   11 o    213.9    4.6    0.0000   0.0000          ?        ?   458.4586  19.7942          ?        ?      213.9        4.6       ?       ? 
1 1 1   56    9   12 o     21.8   10.6    0.0000   0.0000          ?        ?   -25.5409  14.6860          ?        ?       21.8       10.6       ?       ? 
1 1 1   56    9   13 o    118.3    5.9    0.0000   0.0000          ?        ?   140.4748  14.0475          ?        ?      118.3        5.9       ?       ? 
1 1 1   56    9   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   56    9   15 o     69.8    9.6    0.0000   0.0000          ?        ?    49.1662  13.4090          ?        ?       69.8        9.6       ?       ? 
1 1 1   56    9   16 o     40.9   15.0    0.0000   0.0000          ?        ?    14.0475  15.9630          ?        ?       40.9       15.0       ?       ? 
1 1 1   56    9   17 o    196.2    4.2    0.0000   0.0000          ?        ?   385.6671  16.6016          ?        ?      196.2        4.2       ?       ? 
1 1 1   56    9   18 o     74.9   10.7    0.0000   0.0000          ?        ?    56.8284  15.9630          ?        ?       74.9       10.7       ?       ? 
1 1 1   56    9   19 o    184.4    4.5    0.0000   0.0000          ?        ?   340.9706  16.6016          ?        ?      184.4        4.5       ?       ? 
1 1 1   56    9   20 o    152.2    5.2    0.0000   0.0000          ?        ?   232.4219  15.9630          ?        ?      152.2        5.2       ?       ? 
1 1 1   56    9   21 o    403.1    2.9    0.0000   0.0000          ?        ?  1626.3146  23.6253          ?        ?      403.1        2.9       ?       ? 
1 1 1   56    9   22 o    213.3    4.0    0.0000   0.0000          ?        ?   455.9044  17.2401          ?        ?      213.3        4.0       ?       ? 
1 1 1   56    9   23 o    251.2    3.9    0.0000   0.0000          ?        ?   632.1364  19.7942          ?        ?      251.2        3.9       ?       ? 
1 1 1   56    9   24 o    135.8    5.6    0.0000   0.0000          ?        ?   185.1713  15.3245          ?        ?      135.8        5.6       ?       ? 
1 1 1   56    9   25 o    225.9    3.5    0.0000   0.0000          ?        ?   511.4558  15.9630          ?        ?      225.9        3.5       ?       ? 
1 1 1   56    9   26 o    257.8    3.5    0.0000   0.0000          ?        ?   665.9781  17.8786          ?        ?      257.8        3.5       ?       ? 
1 1 1   56    9   27 o    145.0    5.5    0.0000   0.0000          ?        ?   211.3506  15.9630          ?        ?      145.0        5.5       ?       ? 
1 1 1   56    9   28 o    128.9    6.2    0.0000   0.0000          ?        ?   167.2927  15.9630          ?        ?      128.9        6.2       ?       ? 
1 1 1   56    9   29 o    117.5    6.5    0.0000   0.0000          ?        ?   139.1977  15.3245          ?        ?      117.5        6.5       ?       ? 
1 1 1   56    9   30 o     62.4   12.7    0.0000   0.0000          ?        ?    41.5039  15.3245          ?        ?       62.4       12.7       ?       ? 
1 1 1   56    9   31 o    143.6    5.6    0.0000   0.0000          ?        ?   207.5195  15.9630          ?        ?      143.6        5.6       ?       ? 
1 1 1   56    9   32 o     85.7    9.3    0.0000   0.0000          ?        ?    74.7070  15.9630          ?        ?       85.7        9.3       ?       ? 
1 1 1   56    9   33 o     88.2    9.0    0.0000   0.0000          ?        ?    79.1767  15.9630          ?        ?       88.2        9.0       ?       ? 
1 1 1   56   10    0 o     28.6   17.0    9.5778  16.6016     9.5778  16.6016     9.5778  16.6016       28.6     17.0       28.6       17.0     0.0     0.0 
1 1 1   56   10    1 o     88.8    6.8    0.0000   0.0000          ?        ?    79.1767  12.1319          ?        ?       88.8        6.8       ?       ? 
1 1 1   56   10    2 o    147.6    4.8    0.0000   0.0000          ?        ?   218.3744  14.0475          ?        ?      147.6        4.8       ?       ? 
1 1 1   56   10    3 o    233.6    3.4    0.0000   0.0000          ?        ?   546.5745  15.9630          ?        ?      233.6        3.4       ?       ? 
1 1 1   56   10    4 o    106.4    6.3    0.0000   0.0000          ?        ?   113.6568  13.4090          ?        ?      106.4        6.3       ?       ? 
1 1 1   56   10    5 o    326.2    3.0    0.0000   0.0000          ?        ?  1065.0541  19.7942          ?        ?      326.2        3.0       ?       ? 
1 1 1   56   10    6 o    266.0    3.6    0.0000   0.0000          ?        ?   708.7590  19.1556          ?        ?      266.0        3.6       ?       ? 
1 1 1   56   10    7 o    234.7    3.5    0.0000   0.0000          ?        ?   551.6827  16.6016          ?        ?      234.7        3.5       ?       ? 
1 1 1   56   10    8 o    381.0    3.4    0.0000   0.0000          ?        ?  1453.2753  26.1794          ?        ?      381.0        3.4       ?       ? 
1 1 1   56   10    9 o    124.3    5.6    0.0000   0.0000          ?        ?   155.1608  14.0475          ?        ?      124.3        5.6       ?       ? 
1 1 1   56   10   10 o    129.6    5.2    0.0000   0.0000          ?        ?   168.5697  13.4090          ?        ?      129.6        5.2       ?       ? 
1 1 1   56   10   11 o    176.9    4.5    0.0000   0.0000          ?        ?   313.5141  15.9630          ?        ?      176.9        4.5       ?       ? 
1 1 1   56   10   12 o     65.0   10.8    0.0000   0.0000          ?        ?    42.7809  14.0475          ?        ?       65.0       10.8       ?       ? 
1 1 1   56   10   13 o     82.3    8.5    0.0000   0.0000          ?        ?    68.3218  14.0475          ?        ?       82.3        8.5       ?       ? 
1 1 1   56   10   14 o    365.8    3.3    0.0000   0.0000          ?        ?  1339.6184  24.2638          ?        ?      365.8        3.3       ?       ? 
1 1 1   56   10   15 o    190.7    4.5    0.0000   0.0000          ?        ?   364.5958  17.2401          ?        ?      190.7        4.5       ?       ? 
1 1 1   56   10   16 o    345.5    3.1    0.0000   0.0000          ?        ?  1195.3125  21.7097          ?        ?      345.5        3.1       ?       ? 
1 1 1   56   10   17 o     71.8   10.7    0.0000   0.0000          ?        ?    52.3588  15.3245          ?        ?       71.8       10.7       ?       ? 
1 1 1   56   10   18 o    184.4    4.7    0.0000   0.0000          ?        ?   340.9706  17.2401          ?        ?      184.4        4.7       ?       ? 
1 1 1   56   10   19 o     83.4    8.4    0.0000   0.0000          ?        ?    70.2374  14.0475          ?        ?       83.4        8.4       ?       ? 
1 1 1   56   10   20 o    114.0    7.0    0.0000   0.0000          ?        ?   130.8969  15.9630          ?        ?      114.0        7.0       ?       ? 
1 1 1   56   10   21 o    209.5    4.0    0.0000   0.0000          ?        ?   439.9414  16.6016          ?        ?      209.5        4.0       ?       ? 
1 1 1   56   10   22 o    225.5    3.7    0.0000   0.0000          ?        ?   509.5403  16.6016          ?        ?      225.5        3.7       ?       ? 
1 1 1   56   10   23 o    266.5    3.4    0.0000   0.0000          ?        ?   711.3131  17.8786          ?        ?      266.5        3.4       ?       ? 
1 1 1   56   10   24 o     48.8   14.6    0.0000   0.0000          ?        ?    24.9023  15.3245          ?        ?       48.8       14.6       ?       ? 
1 1 1   56   10   25 o     29.2   12.9    0.0000   0.0000          ?        ?    -3.8311  14.6860          ?        ?       29.2       12.9       ?       ? 
1 1 1   56   10   26 o    244.5    3.7    0.0000   0.0000          ?        ?   598.9333  17.8786          ?        ?      244.5        3.7       ?       ? 
1 1 1   56   10   27 o    172.2    4.4    0.0000   0.0000          ?        ?   297.5511  15.3245          ?        ?      172.2        4.4       ?       ? 
1 1 1   56   10   28 o    356.6    2.8    0.0000   0.0000          ?        ?  1273.2120  19.7942          ?        ?      356.6        2.8       ?       ? 
1 1 1   56   10   29 o     98.6    7.8    0.0000   0.0000          ?        ?    98.3323  15.3245          ?        ?       98.6        7.8       ?       ? 
1 1 1   56   10   30 f    153.3    5.2    0.0000   0.0000          ?        ?   236.2530  15.9630          ?        ?      153.3        5.2       ?       ? 
1 1 1   56   10   31 o     91.8    8.7    0.0000   0.0000          ?        ?    85.5619  15.9630          ?        ?       91.8        8.7       ?       ? 
1 1 1   56   11    0 o     18.9   13.2  -15.9630  17.8786   -15.9630  17.8786   -15.9630  17.8786       18.9     13.2       18.9       13.2     0.0     0.0 
1 1 1   56   11    1 o    128.4    4.7    0.0000   0.0000          ?        ?   165.3771  12.1319          ?        ?      128.4        4.7       ?       ? 
1 1 1   56   11    2 o    118.9    5.4    0.0000   0.0000          ?        ?   141.7518  12.7704          ?        ?      118.9        5.4       ?       ? 
1 1 1   56   11    3 o    261.7    3.3    0.0000   0.0000          ?        ?   685.7722  17.2401          ?        ?      261.7        3.3       ?       ? 
1 1 1   56   11    4 o    126.9    5.0    0.0000   0.0000          ?        ?   161.5460  12.7704          ?        ?      126.9        5.0       ?       ? 
1 1 1   56   11    5 o     34.4   13.9    0.0000   0.0000          ?        ?     5.7467  14.6860          ?        ?       34.4       13.9       ?       ? 
1 1 1   56   11    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   56   11    7 o     90.5    6.7    0.0000   0.0000          ?        ?    82.3693  12.1319          ?        ?       90.5        6.7       ?       ? 
1 1 1   56   11    8 o    259.3    3.8    0.0000   0.0000          ?        ?   673.6403  19.7942          ?        ?      259.3        3.8       ?       ? 
1 1 1   56   11    9 o    222.0    3.9    0.0000   0.0000          ?        ?   493.5772  17.2401          ?        ?      222.0        3.9       ?       ? 
1 1 1   56   11   10 o     17.2    8.7    0.0000   0.0000          ?        ?   -45.3350  14.0475          ?        ?       17.2        8.7       ?       ? 
1 1 1   56   11   11 o     39.7   14.1    0.0000   0.0000          ?        ?    14.0475  14.0475          ?        ?       39.7       14.1       ?       ? 
1 1 1   56   11   12 o    220.4    3.6    0.0000   0.0000          ?        ?   486.5535  15.9630          ?        ?      220.4        3.6       ?       ? 
1 1 1   56   11   13 f    114.1    6.4    0.0000   0.0000          ?        ?   130.8969  14.6860          ?        ?      114.1        6.4       ?       ? 
1 1 1   56   11   14 o    126.5    6.3    0.0000   0.0000          ?        ?   160.9075  15.9630          ?        ?      126.5        6.3       ?       ? 
1 1 1   56   11   15 o     57.0   13.1    0.0000   0.0000          ?        ?    34.4802  14.6860          ?        ?       57.0       13.1       ?       ? 
1 1 1   56   11   16 o    338.3    3.5    0.0000   0.0000          ?        ?  1146.1464  23.6253          ?        ?      338.3        3.5       ?       ? 
1 1 1   56   11   17 o    228.4    3.9    0.0000   0.0000          ?        ?   522.9492  17.8786          ?        ?      228.4        3.9       ?       ? 
1 1 1   56   11   18 o    236.9    3.9    0.0000   0.0000          ?        ?   562.5375  18.5171          ?        ?      236.9        3.9       ?       ? 
1 1 1   56   11   19 o    161.9    5.1    0.0000   0.0000          ?        ?   263.0709  16.6016          ?        ?      161.9        5.1       ?       ? 
1 1 1   56   11   20 o    161.9    4.9    0.0000   0.0000          ?        ?   263.0709  15.9630          ?        ?      161.9        4.9       ?       ? 
1 1 1   56   11   21 o     91.0    8.1    0.0000   0.0000          ?        ?    83.6463  14.6860          ?        ?       91.0        8.1       ?       ? 
1 1 1   56   11   22 o     36.4   14.3    0.0000   0.0000          ?        ?     8.3008  15.3245          ?        ?       36.4       14.3       ?       ? 
1 1 1   56   11   23 o    185.7    4.8    0.0000   0.0000          ?        ?   346.0787  17.8786          ?        ?      185.7        4.8       ?       ? 
1 1 1   56   11   24 o    149.4    4.9    0.0000   0.0000          ?        ?   224.1211  14.6860          ?        ?      149.4        4.9       ?       ? 
1 1 1   56   11   25 o    189.3    4.4    0.0000   0.0000          ?        ?   359.4877  16.6016          ?        ?      189.3        4.4       ?       ? 
1 1 1   56   11   26 o    124.6    6.4    0.0000   0.0000          ?        ?   156.4378  15.9630          ?        ?      124.6        6.4       ?       ? 
1 1 1   56   11   27 o    108.2    7.1    0.0000   0.0000          ?        ?   118.1265  15.3245          ?        ?      108.2        7.1       ?       ? 
1 1 1   56   11   28 o    168.0    4.8    0.0000   0.0000          ?        ?   283.5036  15.9630          ?        ?      168.0        4.8       ?       ? 
1 1 1   56   11   29 o     19.9    9.9    0.0000   0.0000          ?        ?   -37.0343  15.3245          ?        ?       19.9        9.9       ?       ? 
1 1 1   56   12    0 o    159.9    6.0  257.3242  19.1556   257.3242  19.1556   257.3242  19.1556      159.9      6.0      159.9        6.0     0.0     0.0 
1 1 1   56   12    1 o     65.5    9.3    0.0000   0.0000          ?        ?    43.4195  12.1319          ?        ?       65.5        9.3       ?       ? 
1 1 1   56   12    2 o    200.1    3.5    0.0000   0.0000          ?        ?   400.9916  14.0475          ?        ?      200.1        3.5       ?       ? 
1 1 1   56   12    3 o    287.9    3.2    0.0000   0.0000          ?        ?   830.0781  18.5171          ?        ?      287.9        3.2       ?       ? 
1 1 1   56   12    4 f     82.8    6.9    0.0000   0.0000          ?        ?    68.9603  11.4934          ?        ?       82.8        6.9       ?       ? 
1 1 1   56   12    5 o    171.2    4.1    0.0000   0.0000          ?        ?   293.7199  14.0475          ?        ?      171.2        4.1       ?       ? 
1 1 1   56   12    6 o    134.9    4.7    0.0000   0.0000          ?        ?   182.6172  12.7704          ?        ?      134.9        4.7       ?       ? 
1 1 1   56   12    7 o    234.7    3.4    0.0000   0.0000          ?        ?   551.6827  15.9630          ?        ?      234.7        3.4       ?       ? 
1 1 1   56   12    8 o     91.9    7.0    0.0000   0.0000          ?        ?    84.9234  12.7704          ?        ?       91.9        7.0       ?       ? 
1 1 1   56   12    9 o     66.9    9.5    0.0000   0.0000          ?        ?    45.3350  12.7704          ?        ?       66.9        9.5       ?       ? 
1 1 1   56   12   10 o    160.8    4.6    0.0000   0.0000          ?        ?   259.2398  14.6860          ?        ?      160.8        4.6       ?       ? 
1 1 1   56   12   11 o     50.3   13.2    0.0000   0.0000          ?        ?    26.8179  13.4090          ?        ?       50.3       13.2       ?       ? 
1 1 1   56   12   12 o     91.4    7.7    0.0000   0.0000          ?        ?    84.2849  14.0475          ?        ?       91.4        7.7       ?       ? 
1 1 1   56   12   13 o    179.4    4.1    0.0000   0.0000          ?        ?   322.4534  14.6860          ?        ?      179.4        4.1       ?       ? 
1 1 1   56   12   14 o     81.9    8.2    0.0000   0.0000          ?        ?    67.6833  13.4090          ?        ?       81.9        8.2       ?       ? 
1 1 1   56   12   15 o    134.5    6.2    0.0000   0.0000          ?        ?   181.9787  16.6016          ?        ?      134.5        6.2       ?       ? 
1 1 1   56   12   16 o    112.7    6.5    0.0000   0.0000          ?        ?   127.7043  14.6860          ?        ?      112.7        6.5       ?       ? 
1 1 1   56   12   17 o    173.9    4.8    0.0000   0.0000          ?        ?   303.2978  16.6016          ?        ?      173.9        4.8       ?       ? 
1 1 1   56   12   18 f    188.1    4.6    0.0000   0.0000          ?        ?   355.0180  17.2401          ?        ?      188.1        4.6       ?       ? 
1 1 1   56   12   19 o    132.6    6.3    0.0000   0.0000          ?        ?   176.8705  16.6016          ?        ?      132.6        6.3       ?       ? 
1 1 1   56   12   20 o    185.4    4.0    0.0000   0.0000          ?        ?   344.8017  14.6860          ?        ?      185.4        4.0       ?       ? 
1 1 1   56   12   21 f     22.5   10.7    0.0000   0.0000          ?        ?   -17.2401  13.4090          ?        ?       22.5       10.7       ?       ? 
1 1 1   56   12   22 o     29.8   13.2    0.0000   0.0000          ?        ?    -3.8311  15.3245          ?        ?       29.8       13.2       ?       ? 
1 1 1   56   12   23 o    219.1    3.9    0.0000   0.0000          ?        ?   481.4453  17.2401          ?        ?      219.1        3.9       ?       ? 
1 1 1   56   12   24 o     18.4    9.2    0.0000   0.0000          ?        ?   -37.6728  14.0475          ?        ?       18.4        9.2       ?       ? 
1 1 1   56   12   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   56   12   26 o    115.7    7.2    0.0000   0.0000          ?        ?   135.3666  16.6016          ?        ?      115.7        7.2       ?       ? 
1 1 1   56   12   27 o     32.2   13.7    0.0000   0.0000          ?        ?     1.2770  15.3245          ?        ?       32.2       13.7       ?       ? 
1 1 1   56   13    0 o    352.6    5.3 1246.3942  37.6728  1246.3942  37.6728  1246.3942  37.6728      352.6      5.3      352.6        5.3     0.0     0.0 
1 1 1   56   13    1 o    162.6    4.1    0.0000   0.0000          ?        ?   264.9865  13.4090          ?        ?      162.6        4.1       ?       ? 
1 1 1   56   13    2 o    456.8    4.1    0.0000   0.0000          ?        ?  2091.1584  37.6728          ?        ?      456.8        4.1       ?       ? 
1 1 1   56   13    3 o    206.2    4.5    0.0000   0.0000          ?        ?   426.5325  18.5171          ?        ?      206.2        4.5       ?       ? 
1 1 1   56   13    4 o    150.2    5.5    0.0000   0.0000          ?        ?   226.6752  16.6016          ?        ?      150.2        5.5       ?       ? 
1 1 1   56   13    5 o    117.6    7.1    0.0000   0.0000          ?        ?   139.1977  16.6016          ?        ?      117.6        7.1       ?       ? 
1 1 1   56   13    6 o    199.8    4.8    0.0000   0.0000          ?        ?   400.3531  19.1556          ?        ?      199.8        4.8       ?       ? 
1 1 1   56   13    7 o    232.9    3.4    0.0000   0.0000          ?        ?   543.3819  15.9630          ?        ?      232.9        3.4       ?       ? 
1 1 1   56   13    8 o    242.5    3.0    0.0000   0.0000          ?        ?   588.7169  14.6860          ?        ?      242.5        3.0       ?       ? 
1 1 1   56   13    9 o    228.8    3.1    0.0000   0.0000          ?        ?   524.2263  14.0475          ?        ?      228.8        3.1       ?       ? 
1 1 1   56   13   10 o    204.9    3.6    0.0000   0.0000          ?        ?   420.7858  14.6860          ?        ?      204.9        3.6       ?       ? 
1 1 1   56   13   11 o    160.6    4.2    0.0000   0.0000          ?        ?   258.6013  13.4090          ?        ?      160.6        4.2       ?       ? 
1 1 1   56   13   12 o    112.7    5.9    0.0000   0.0000          ?        ?   127.7043  13.4090          ?        ?      112.7        5.9       ?       ? 
1 1 1   56   13   13 o    234.2    3.8    0.0000   0.0000          ?        ?   549.7671  17.8786          ?        ?      234.2        3.8       ?       ? 
1 1 1   56   13   14 o    108.4    6.2    0.0000   0.0000          ?        ?   118.1265  13.4090          ?        ?      108.4        6.2       ?       ? 
1 1 1   56   13   15 o     97.2    6.9    0.0000   0.0000          ?        ?    95.1397  13.4090          ?        ?       97.2        6.9       ?       ? 
1 1 1   56   13   16 o    275.6    3.0    0.0000   0.0000          ?        ?   760.4792  16.6016          ?        ?      275.6        3.0       ?       ? 
1 1 1   56   13   17 f    232.7    3.7    0.0000   0.0000          ?        ?   542.7434  17.2401          ?        ?      232.7        3.7       ?       ? 
1 1 1   56   13   18 o     60.8   13.5    0.0000   0.0000          ?        ?    39.5883  15.9630          ?        ?       60.8       13.5       ?       ? 
1 1 1   56   13   19 o     74.6   10.7    0.0000   0.0000          ?        ?    56.8284  15.9630          ?        ?       74.6       10.7       ?       ? 
1 1 1   56   13   20 o     23.2   11.1    0.0000   0.0000          ?        ?   -19.7942  14.6860          ?        ?       23.2       11.1       ?       ? 
1 1 1   56   13   21 o     72.2    9.3    0.0000   0.0000          ?        ?    52.9973  13.4090          ?        ?       72.2        9.3       ?       ? 
1 1 1   56   13   22 o     28.9   12.4    0.0000   0.0000          ?        ?     0.0000  12.7704          ?        ?       28.9       12.4       ?       ? 
1 1 1   56   13   23 o    157.6    5.1    0.0000   0.0000          ?        ?   249.6619  15.9630          ?        ?      157.6        5.1       ?       ? 
1 1 1   56   13   24 o    123.1    6.0    0.0000   0.0000          ?        ?   152.6067  14.6860          ?        ?      123.1        6.0       ?       ? 
1 1 1   56   14    0 o    398.4    5.8 1592.4729  45.9736  1592.4729  45.9736  1592.4729  45.9736      398.4      5.8      398.4        5.8     0.0     0.0 
1 1 1   56   14    1 o    158.4    8.5    0.0000   0.0000          ?        ?   253.4931  26.8179          ?        ?      158.4        8.5       ?       ? 
1 1 1   56   14    2 o    225.6    5.2    0.0000   0.0000          ?        ?   510.8173  23.6253          ?        ?      225.6        5.2       ?       ? 
1 1 1   56   14    3 o    101.4    8.8    0.0000   0.0000          ?        ?   104.0790  17.8786          ?        ?      101.4        8.8       ?       ? 
1 1 1   56   14    4 o    169.4    4.5    0.0000   0.0000          ?        ?   287.9732  15.3245          ?        ?      169.4        4.5       ?       ? 
1 1 1   56   14    5 o     17.4    8.8    0.0000   0.0000          ?        ?   -44.0580  14.0475          ?        ?       17.4        8.8       ?       ? 
1 1 1   56   14    6 o    181.3    4.1    0.0000   0.0000          ?        ?   329.4771  14.6860          ?        ?      181.3        4.1       ?       ? 
1 1 1   56   14    7 o    220.3    4.2    0.0000   0.0000          ?        ?   486.5535  18.5171          ?        ?      220.3        4.2       ?       ? 
1 1 1   56   14    8 o    171.9    5.6    0.0000   0.0000          ?        ?   296.9126  19.1556          ?        ?      171.9        5.6       ?       ? 
1 1 1   56   14    9 o     21.1   10.4    0.0000   0.0000          ?        ?   -35.1187  15.9630          ?        ?       21.1       10.4       ?       ? 
1 1 1   56   14   10 o     33.8   12.6    0.0000   0.0000          ?        ?     8.9393  11.4934          ?        ?       33.8       12.6       ?       ? 
1 1 1   56   14   11 o     74.6    8.1    0.0000   0.0000          ?        ?    56.1899  12.1319          ?        ?       74.6        8.1       ?       ? 
1 1 1   56   14   12 o    146.2    4.8    0.0000   0.0000          ?        ?   214.5433  14.0475          ?        ?      146.2        4.8       ?       ? 
1 1 1   56   14   13 o     18.5    9.0    0.0000   0.0000          ?        ?   -16.6016  10.2163          ?        ?       18.5        9.0       ?       ? 
1 1 1   56   14   14 o     90.4    7.1    0.0000   0.0000          ?        ?    82.3693  12.7704          ?        ?       90.4        7.1       ?       ? 
1 1 1   56   14   15 o     88.5    7.6    0.0000   0.0000          ?        ?    79.1767  13.4090          ?        ?       88.5        7.6       ?       ? 
1 1 1   56   14   16 o     71.3    9.4    0.0000   0.0000          ?        ?    51.7203  13.4090          ?        ?       71.3        9.4       ?       ? 
1 1 1   56   14   17 o    130.5    5.4    0.0000   0.0000          ?        ?   171.1238  14.0475          ?        ?      130.5        5.4       ?       ? 
1 1 1   56   14   18 o     83.2    8.4    0.0000   0.0000          ?        ?    70.2374  14.0475          ?        ?       83.2        8.4       ?       ? 
1 1 1   56   14   19 f     98.0    7.5    0.0000   0.0000          ?        ?    97.0553  14.6860          ?        ?       98.0        7.5       ?       ? 
1 1 1   56   14   20 o    166.7    4.8    0.0000   0.0000          ?        ?   279.0340  15.9630          ?        ?      166.7        4.8       ?       ? 
1 1 1   56   14   21 o    159.4    4.8    0.0000   0.0000          ?        ?   255.4086  15.3245          ?        ?      159.4        4.8       ?       ? 
1 1 1   56   15    0 f    212.8    8.6  457.8200  36.3957   457.8200  36.3957   457.8200  36.3957      212.8      8.6      212.8        8.6     0.0     0.0 
1 1 1   56   15    1 o     58.2   15.6    0.0000   0.0000          ?        ?    36.3957  18.5171          ?        ?       58.2       15.6       ?       ? 
1 1 1   56   15    2 o     22.7   11.3    0.0000   0.0000          ?        ?   -54.9129  21.0712          ?        ?       22.7       11.3       ?       ? 
1 1 1   56   15    3 o     34.0   15.0    0.0000   0.0000          ?        ?    -4.4697  19.7942          ?        ?       34.0       15.0       ?       ? 
1 1 1   56   15    4 o     52.3   16.1    0.0000   0.0000          ?        ?    28.7335  18.5171          ?        ?       52.3       16.1       ?       ? 
1 1 1   56   15    5 o     66.4   14.4    0.0000   0.0000          ?        ?    47.2506  18.5171          ?        ?       66.4       14.4       ?       ? 
1 1 1   56   15    6 o    118.2    9.2    0.0000   0.0000          ?        ?   141.7518  21.7097          ?        ?      118.2        9.2       ?       ? 
1 1 1   56   15    7 o    126.3    5.6    0.0000   0.0000          ?        ?   160.2689  14.0475          ?        ?      126.3        5.6       ?       ? 
1 1 1   56   15    8 o     25.2   11.6    0.0000   0.0000          ?        ?    -9.5778  13.4090          ?        ?       25.2       11.6       ?       ? 
1 1 1   56   15    9 o    133.3    6.0    0.0000   0.0000          ?        ?   178.7861  15.9630          ?        ?      133.3        6.0       ?       ? 
1 1 1   56   15   10 o    130.6    6.4    0.0000   0.0000          ?        ?   171.7623  16.6016          ?        ?      130.6        6.4       ?       ? 
1 1 1   56   15   11 o     99.3    7.4    0.0000   0.0000          ?        ?    99.6094  14.6860          ?        ?       99.3        7.4       ?       ? 
1 1 1   56   15   12 o    103.2    8.4    0.0000   0.0000          ?        ?   107.9102  17.2401          ?        ?      103.2        8.4       ?       ? 
1 1 1   56   15   13 o     40.0   13.1    0.0000   0.0000          ?        ?    15.9630  12.1319          ?        ?       40.0       13.1       ?       ? 
1 1 1   56   15   14 o     27.1   12.1    0.0000   0.0000          ?        ?    -5.1082  13.4090          ?        ?       27.1       12.1       ?       ? 
1 1 1   56   15   15 o    103.6    7.4    0.0000   0.0000          ?        ?   108.5487  15.3245          ?        ?      103.6        7.4       ?       ? 
1 1 1   56   15   16 o    256.4    3.2    0.0000   0.0000          ?        ?   658.9543  16.6016          ?        ?      256.4        3.2       ?       ? 
1 1 1   56   15   17 o     38.8   13.1    0.0000   0.0000          ?        ?    14.6860  12.1319          ?        ?       38.8       13.1       ?       ? 
1 1 1   56   15   18 o    211.9    3.5    0.0000   0.0000          ?        ?   450.1577  14.6860          ?        ?      211.9        3.5       ?       ? 
1 1 1   56   16    0 o    157.9    9.6  254.1316  30.0105   254.1316  30.0105   254.1316  30.0105      157.9      9.6      157.9        9.6     0.0     0.0 
1 1 1   56   16    1 o    149.5    6.6    0.0000   0.0000          ?        ?   225.3981  19.7942          ?        ?      149.5        6.6       ?       ? 
1 1 1   56   16    2 o    188.5    6.6    0.0000   0.0000          ?        ?   358.2106  24.9023          ?        ?      188.5        6.6       ?       ? 
1 1 1   56   16    3 o    303.0    5.8    0.0000   0.0000          ?        ?   923.9408  35.1187          ?        ?      303.0        5.8       ?       ? 
1 1 1   56   16    4 o    191.1    5.2    0.0000   0.0000          ?        ?   367.1499  19.7942          ?        ?      191.1        5.2       ?       ? 
1 1 1   56   16    5 o    115.9   12.1    0.0000   0.0000          ?        ?   137.9207  28.0950          ?        ?      115.9       12.1       ?       ? 
1 1 1   56   16    6 o     44.8   17.0    0.0000   0.0000          ?        ?    15.9630  21.0712          ?        ?       44.8       17.0       ?       ? 
1 1 1   56   16    7 o    140.2    7.3    0.0000   0.0000          ?        ?   198.5802  20.4327          ?        ?      140.2        7.3       ?       ? 
1 1 1   56   16    8 o    116.9    8.7    0.0000   0.0000          ?        ?   138.5592  20.4327          ?        ?      116.9        8.7       ?       ? 
1 1 1   56   16    9 o     66.4    8.7    0.0000   0.0000          ?        ?    44.6965  11.4934          ?        ?       66.4        8.7       ?       ? 
1 1 1   56   16   10 o     58.7   11.3    0.0000   0.0000          ?        ?    36.3957  12.7704          ?        ?       58.7       11.3       ?       ? 
1 1 1   56   16   11 o     34.0   14.0    0.0000   0.0000          ?        ?     4.4697  15.3245          ?        ?       34.0       14.0       ?       ? 
1 1 1   56   16   12 o     95.3    8.0    0.0000   0.0000          ?        ?    91.9471  15.3245          ?        ?       95.3        8.0       ?       ? 
1 1 1   56   16   13 o    127.1    6.0    0.0000   0.0000          ?        ?   162.8230  15.3245          ?        ?      127.1        6.0       ?       ? 
1 1 1   56   16   14 o    176.0    5.1    0.0000   0.0000          ?        ?   311.5985  17.8786          ?        ?      176.0        5.1       ?       ? 
1 1 1   56   17    0 o     22.7   16.1  -28.7335  28.0950   -28.7335  28.0950   -28.7335  28.0950       22.7     16.1       22.7       16.1     0.0     0.0 
1 1 1   56   17    1 o     23.4   11.4    0.0000   0.0000          ?        ?   -33.2031  17.8786          ?        ?       23.4       11.4       ?       ? 
1 1 1   56   17    2 o    195.2    5.7    0.0000   0.0000          ?        ?   383.7515  22.3483          ?        ?      195.2        5.7       ?       ? 
1 1 1   56   17    3 o    235.6    5.6    0.0000   0.0000          ?        ?   558.7064  26.1794          ?        ?      235.6        5.6       ?       ? 
1 1 1   56   17    4 o    153.5    7.9    0.0000   0.0000          ?        ?   238.8071  24.2638          ?        ?      153.5        7.9       ?       ? 
1 1 1   56   17    5 o     37.4   15.7    0.0000   0.0000          ?        ?     3.8311  19.7942          ?        ?       37.4       15.7       ?       ? 
1 1 1   56   17    6 o     27.2   12.8    0.0000   0.0000          ?        ?   -17.8786  17.8786          ?        ?       27.2       12.8       ?       ? 
1 1 1   56   17    7 o     80.2   12.3    0.0000   0.0000          ?        ?    66.4062  19.7942          ?        ?       80.2       12.3       ?       ? 
1 1 1   56   17    8 o    211.6    5.0    0.0000   0.0000          ?        ?   450.1577  21.0712          ?        ?      211.6        5.0       ?       ? 
1 1 1   57    0    0 o    275.9    6.8  763.0333  37.6728   763.0333  37.6728   763.0333  37.6728      275.9      6.8      275.9        6.8     0.0     0.0 
1 1 1   57    0    1 o    415.7    4.0 1729.1165  33.2031  1729.1165  33.2031  1729.1165  33.2031      415.7      4.0      415.7        4.0     0.0     0.0 
1 1 1   57    0    2 o    139.6    6.9  196.6647  19.1556   196.6647  19.1556   196.6647  19.1556      139.6      6.9      139.6        6.9     0.0     0.0 
1 1 1   57    0    3 o    322.2    4.5 1039.5132  28.7335  1039.5132  28.7335  1039.5132  28.7335      322.2      4.5      322.2        4.5     0.0     0.0 
1 1 1   57    0    4 o    297.0    4.4  883.0754  26.1794   883.0754  26.1794   883.0754  26.1794      297.0      4.4      297.0        4.4     0.0     0.0 
1 1 1   57    0    5 o     18.5   13.1  -19.7942  18.5171   -19.7942  18.5171   -19.7942  18.5171       18.5     13.1       18.5       13.1     0.0     0.0 
1 1 1   57    0    6 o    130.6    7.4  172.4008  19.1556   172.4008  19.1556   172.4008  19.1556      130.6      7.4      130.6        7.4     0.0     0.0 
1 1 1   57    0    7 o    303.1    4.1  919.4711  24.9023   919.4711  24.9023   919.4711  24.9023      303.1      4.1      303.1        4.1     0.0     0.0 
1 1 1   57    0    8 o    426.2    4.6 1818.5095  39.5883  1818.5095  39.5883  1818.5095  39.5883      426.2      4.6      426.2        4.6     0.0     0.0 
1 1 1   57    0    9 o    194.9    5.7  381.1974  22.3483   381.1974  22.3483   381.1974  22.3483      194.9      5.7      194.9        5.7     0.0     0.0 
1 1 1   57    0   10 o    209.3    5.3  439.3029  22.3483   439.3029  22.3483   439.3029  22.3483      209.3      5.3      209.3        5.3     0.0     0.0 
1 1 1   57    0   11 o    460.5    4.2 2122.4458  38.9498  2122.4458  38.9498  2122.4458  38.9498      460.5      4.2      460.5        4.2     0.0     0.0 
1 1 1   57    0   12 o    234.8    4.8  552.3212  22.3483   552.3212  22.3483   552.3212  22.3483      234.8      4.8      234.8        4.8     0.0     0.0 
1 1 1   57    0   13 o     13.7   10.2  -70.8759  21.7097   -70.8759  21.7097   -70.8759  21.7097       13.7     10.2       13.7       10.2     0.0     0.0 
1 1 1   57    0   14 o     13.7   10.2  -58.1055  19.7942   -58.1055  19.7942   -58.1055  19.7942       13.7     10.2       13.7       10.2     0.0     0.0 
1 1 1   57    0   15 o     16.0   11.8  -47.8891  21.7097   -47.8891  21.7097   -47.8891  21.7097       16.0     11.8       16.0       11.8     0.0     0.0 
1 1 1   57    0   16 o    195.4    6.6  383.7515  25.5409   383.7515  25.5409   383.7515  25.5409      195.4      6.6      195.4        6.6     0.0     0.0 
1 1 1   57    0   17 f     36.3   20.6   17.8786  22.9868    17.8786  22.9868    17.8786  22.9868       36.3     20.6       36.3       20.6     0.0     0.0 
1 1 1   57    0   18 f     16.7   12.2  -39.5883  21.0712   -39.5883  21.0712   -39.5883  21.0712       16.7     12.2       16.7       12.2     0.0     0.0 
1 1 1   57    0   19 o     92.9   10.5   90.0316  19.1556    90.0316  19.1556    90.0316  19.1556       92.9     10.5       92.9       10.5     0.0     0.0 
1 1 1   57    0   20 o    391.8    4.4 1536.9215  34.4802  1536.9215  34.4802  1536.9215  34.4802      391.8      4.4      391.8        4.4     0.0     0.0 
1 1 1   57    0   21 o    147.1    7.2  218.3744  21.0712   218.3744  21.0712   218.3744  21.0712      147.1      7.2      147.1        7.2     0.0     0.0 
1 1 1   57    0   22 o    164.3    5.8  271.3717  19.1556   271.3717  19.1556   271.3717  19.1556      164.3      5.8      164.3        5.8     0.0     0.0 
1 1 1   57    0   23 o    154.4    7.5  240.7227  22.9868   240.7227  22.9868   240.7227  22.9868      154.4      7.5      154.4        7.5     0.0     0.0 
1 1 1   57    0   24 o     64.2   18.9   51.0817  21.0712    51.0817  21.0712    51.0817  21.0712       64.2     18.9       64.2       18.9     0.0     0.0 
1 1 1   57    0   25 o    313.9    4.4  986.5159  27.4564   986.5159  27.4564   986.5159  27.4564      313.9      4.4      313.9        4.4     0.0     0.0 
1 1 1   57    0   26 o     18.9   13.6  -30.6490  22.3483   -30.6490  22.3483   -30.6490  22.3483       18.9     13.6       18.9       13.6     0.0     0.0 
1 1 1   57    0   27 o     29.2   18.4    5.1082  22.3483     5.1082  22.3483     5.1082  22.3483       29.2     18.4       29.2       18.4     0.0     0.0 
1 1 1   57    0   28 o    242.6    5.0  589.9940  24.2638   589.9940  24.2638   589.9940  24.2638      242.6      5.0      242.6        5.0     0.0     0.0 
1 1 1   57    0   29 o     32.6   19.6   12.1319  22.3483    12.1319  22.3483    12.1319  22.3483       32.6     19.6       32.6       19.6     0.0     0.0 
1 1 1   57    0   30 o    380.9    3.9 1452.6367  29.3720  1452.6367  29.3720  1452.6367  29.3720      380.9      3.9      380.9        3.9     0.0     0.0 
1 1 1   57    0   31 o    116.6    9.4  139.1977  21.7097   139.1977  21.7097   139.1977  21.7097      116.6      9.4      116.6        9.4     0.0     0.0 
1 1 1   57    0   32 o    192.2    6.3  371.6196  24.2638   371.6196  24.2638   371.6196  24.2638      192.2      6.3      192.2        6.3     0.0     0.0 
1 1 1   57    0   33 o     19.2   13.8  -28.7335  22.3483   -28.7335  22.3483   -28.7335  22.3483       19.2     13.8       19.2       13.8     0.0     0.0 
1 1 1   57    0   34 o    114.2    9.9  134.0895  22.3483   134.0895  22.3483   134.0895  22.3483      114.2      9.9      114.2        9.9     0.0     0.0 
1 1 1   57    0   35 o    227.3    5.3  518.4796  24.2638   518.4796  24.2638   518.4796  24.2638      227.3      5.3      227.3        5.3     0.0     0.0 
1 1 1   57    0   36 o    173.5    6.8  303.2978  23.6253   303.2978  23.6253   303.2978  23.6253      173.5      6.8      173.5        6.8     0.0     0.0 
1 1 1   57    0   37 o    113.8   10.8  134.0895  24.2638   134.0895  24.2638   134.0895  24.2638      113.8     10.8      113.8       10.8     0.0     0.0 
1 1 1   57    0   38 o    317.5    4.2 1010.1412  26.8179  1010.1412  26.8179  1010.1412  26.8179      317.5      4.2      317.5        4.2     0.0     0.0 
1 1 1   57    0   39 o     17.4   12.7  -42.7809  22.9868   -42.7809  22.9868   -42.7809  22.9868       17.4     12.7       17.4       12.7     0.0     0.0 
1 1 1   57    0   40 o    182.9    6.5  337.1394  23.6253   337.1394  23.6253   337.1394  23.6253      182.9      6.5      182.9        6.5     0.0     0.0 
1 1 1   57    0   41 o    147.5    8.3  220.9285  24.2638   220.9285  24.2638   220.9285  24.2638      147.5      8.3      147.5        8.3     0.0     0.0 
1 1 1   57    0   42 o     84.5   16.0   79.8152  24.2638    79.8152  24.2638    79.8152  24.2638       84.5     16.0       84.5       16.0     0.0     0.0 
1 1 1   57    1    0 o    242.8    4.6  590.6325  22.3483   590.6325  22.3483   590.6325  22.3483      242.8      4.6      242.8        4.6     0.0     0.0 
1 1 1   57    1    1 o    386.8    3.1    0.0000   0.0000          ?        ?  1496.6947  23.6253          ?        ?      386.8        3.1       ?       ? 
1 1 1   57    1    2 o    262.4    3.0    0.0000   0.0000          ?        ?   688.9648  15.9630          ?        ?      262.4        3.0       ?       ? 
1 1 1   57    1    3 o    334.9    3.0    0.0000   0.0000          ?        ?  1122.5210  19.7942          ?        ?      334.9        3.0       ?       ? 
1 1 1   57    1    4 o    282.8    3.2    0.0000   0.0000          ?        ?   800.0676  17.8786          ?        ?      282.8        3.2       ?       ? 
1 1 1   57    1    5 o    325.4    2.9    0.0000   0.0000          ?        ?  1059.3074  19.1556          ?        ?      325.4        2.9       ?       ? 
1 1 1   57    1    6 o     22.6   10.8    0.0000   0.0000          ?        ?   -17.2401  13.4090          ?        ?       22.6       10.8       ?       ? 
1 1 1   57    1    7 o     69.4    9.7    0.0000   0.0000          ?        ?    48.5276  13.4090          ?        ?       69.4        9.7       ?       ? 
1 1 1   57    1    8 o    210.9    3.6    0.0000   0.0000          ?        ?   445.0496  15.3245          ?        ?      210.9        3.6       ?       ? 
1 1 1   57    1    9 o     28.0   12.3    0.0000   0.0000          ?        ?    -3.8311  13.4090          ?        ?       28.0       12.3       ?       ? 
1 1 1   57    1   10 o    102.1    7.5    0.0000   0.0000          ?        ?   104.7175  15.3245          ?        ?      102.1        7.5       ?       ? 
1 1 1   57    1   11 o     58.4   12.4    0.0000   0.0000          ?        ?    35.7572  14.0475          ?        ?       58.4       12.4       ?       ? 
1 1 1   57    1   12 o    313.8    3.0    0.0000   0.0000          ?        ?   985.2389  18.5171          ?        ?      313.8        3.0       ?       ? 
1 1 1   57    1   13 o    198.4    4.0    0.0000   0.0000          ?        ?   393.9678  15.9630          ?        ?      198.4        4.0       ?       ? 
1 1 1   57    1   14 o    524.6    3.4    0.0000   0.0000          ?        ?  2753.9436  35.7572          ?        ?      524.6        3.4       ?       ? 
1 1 1   57    1   15 o    279.7    3.5    0.0000   0.0000          ?        ?   782.8275  19.7942          ?        ?      279.7        3.5       ?       ? 
1 1 1   57    1   16 o    316.1    3.5    0.0000   0.0000          ?        ?   999.9249  22.3483          ?        ?      316.1        3.5       ?       ? 
1 1 1   57    1   17 o    329.1    3.9    0.0000   0.0000          ?        ?  1084.2097  25.5409          ?        ?      329.1        3.9       ?       ? 
1 1 1   57    1   18 o    161.0    5.0    0.0000   0.0000          ?        ?   259.8783  15.9630          ?        ?      161.0        5.0       ?       ? 
1 1 1   57    1   19 o    142.1    5.2    0.0000   0.0000          ?        ?   202.4114  14.6860          ?        ?      142.1        5.2       ?       ? 
1 1 1   57    1   20 o     75.9   10.1    0.0000   0.0000          ?        ?    58.1055  15.3245          ?        ?       75.9       10.1       ?       ? 
1 1 1   57    1   21 o    231.9    3.4    0.0000   0.0000          ?        ?   538.2737  15.9630          ?        ?      231.9        3.4       ?       ? 
1 1 1   57    1   22 o    251.5    3.4    0.0000   0.0000          ?        ?   633.4135  17.2401          ?        ?      251.5        3.4       ?       ? 
1 1 1   57    1   23 o    275.2    3.4    0.0000   0.0000          ?        ?   757.9252  18.5171          ?        ?      275.2        3.4       ?       ? 
1 1 1   57    1   24 o    111.6    6.9    0.0000   0.0000          ?        ?   125.1502  15.3245          ?        ?      111.6        6.9       ?       ? 
1 1 1   57    1   25 o    218.1    3.8    0.0000   0.0000          ?        ?   476.3371  16.6016          ?        ?      218.1        3.8       ?       ? 
1 1 1   57    1   26 o     67.8   11.3    0.0000   0.0000          ?        ?    46.6121  15.3245          ?        ?       67.8       11.3       ?       ? 
1 1 1   57    1   27 o    188.2    4.2    0.0000   0.0000          ?        ?   355.0180  15.9630          ?        ?      188.2        4.2       ?       ? 
1 1 1   57    1   28 o    111.9    6.6    0.0000   0.0000          ?        ?   125.7888  14.6860          ?        ?      111.9        6.6       ?       ? 
1 1 1   57    1   29 o    273.1    3.2    0.0000   0.0000          ?        ?   746.4318  17.2401          ?        ?      273.1        3.2       ?       ? 
1 1 1   57    1   30 o    139.1    5.7    0.0000   0.0000          ?        ?   194.1106  15.9630          ?        ?      139.1        5.7       ?       ? 
1 1 1   57    1   31 o     63.3   12.6    0.0000   0.0000          ?        ?    42.1424  15.3245          ?        ?       63.3       12.6       ?       ? 
1 1 1   57    1   32 o    182.2    4.2    0.0000   0.0000          ?        ?   332.6698  15.3245          ?        ?      182.2        4.2       ?       ? 
1 1 1   57    1   33 o     58.9   14.2    0.0000   0.0000          ?        ?    37.0343  16.6016          ?        ?       58.9       14.2       ?       ? 
1 1 1   57    1   34 f    194.5    4.3    0.0000   0.0000          ?        ?   379.2819  16.6016          ?        ?      194.5        4.3       ?       ? 
1 1 1   57    1   35 o     71.8   10.7    0.0000   0.0000          ?        ?    52.3588  15.3245          ?        ?       71.8       10.7       ?       ? 
1 1 1   57    1   36 f    288.9    3.2    0.0000   0.0000          ?        ?   835.8248  18.5171          ?        ?      288.9        3.2       ?       ? 
1 1 1   57    1   37 o     96.9    8.9    0.0000   0.0000          ?        ?    95.1397  17.2401          ?        ?       96.9        8.9       ?       ? 
1 1 1   57    1   38 o    193.6    4.5    0.0000   0.0000          ?        ?   376.0892  17.2401          ?        ?      193.6        4.5       ?       ? 
1 1 1   57    1   39 o    123.3    6.7    0.0000   0.0000          ?        ?   153.2452  16.6016          ?        ?      123.3        6.7       ?       ? 
1 1 1   57    1   40 o    171.7    4.8    0.0000   0.0000          ?        ?   296.2740  16.6016          ?        ?      171.7        4.8       ?       ? 
1 1 1   57    1   41 o     62.1   13.7    0.0000   0.0000          ?        ?    41.5039  16.6016          ?        ?       62.1       13.7       ?       ? 
1 1 1   57    2    0 o     50.9   18.9   35.1187  17.8786    35.1187  17.8786    35.1187  17.8786       50.9     18.9       50.9       18.9     0.0     0.0 
1 1 1   57    2    1 o    151.3    4.6    0.0000   0.0000          ?        ?   229.2293  14.0475          ?        ?      151.3        4.6       ?       ? 
1 1 1   57    2    2 o    163.6    4.5    0.0000   0.0000          ?        ?   268.1791  14.6860          ?        ?      163.6        4.5       ?       ? 
1 1 1   57    2    3 o    130.9    5.1    0.0000   0.0000          ?        ?   171.7623  13.4090          ?        ?      130.9        5.1       ?       ? 
1 1 1   57    2    4 o    325.1    2.9    0.0000   0.0000          ?        ?  1057.3918  19.1556          ?        ?      325.1        2.9       ?       ? 
1 1 1   57    2    5 o    227.6    3.5    0.0000   0.0000          ?        ?   518.4796  15.9630          ?        ?      227.6        3.5       ?       ? 
1 1 1   57    2    6 o    409.6    3.1    0.0000   0.0000          ?        ?  1679.3119  25.5409          ?        ?      409.6        3.1       ?       ? 
1 1 1   57    2    7 o    327.1    3.2    0.0000   0.0000          ?        ?  1070.8008  21.0712          ?        ?      327.1        3.2       ?       ? 
1 1 1   57    2    8 o    253.3    3.4    0.0000   0.0000          ?        ?   642.3527  17.2401          ?        ?      253.3        3.4       ?       ? 
1 1 1   57    2    9 o    163.1    4.3    0.0000   0.0000          ?        ?   266.2635  14.0475          ?        ?      163.1        4.3       ?       ? 
1 1 1   57    2   10 o    190.1    4.4    0.0000   0.0000          ?        ?   362.0418  16.6016          ?        ?      190.1        4.4       ?       ? 
1 1 1   57    2   11 o    491.7    3.4    0.0000   0.0000          ?        ?  2419.9971  33.2031          ?        ?      491.7        3.4       ?       ? 
1 1 1   57    2   12 o    278.1    3.8    0.0000   0.0000          ?        ?   774.5267  21.0712          ?        ?      278.1        3.8       ?       ? 
1 1 1   57    2   13 o    356.0    3.0    0.0000   0.0000          ?        ?  1268.1040  21.7097          ?        ?      356.0        3.0       ?       ? 
1 1 1   57    2   14 o    149.8    5.1    0.0000   0.0000          ?        ?   224.7596  15.3245          ?        ?      149.8        5.1       ?       ? 
1 1 1   57    2   15 o     97.0    7.9    0.0000   0.0000          ?        ?    94.5012  15.3245          ?        ?       97.0        7.9       ?       ? 
1 1 1   57    2   16 o    151.4    5.7    0.0000   0.0000          ?        ?   229.8678  17.2401          ?        ?      151.4        5.7       ?       ? 
1 1 1   57    2   17 o    279.6    3.5    0.0000   0.0000          ?        ?   782.8275  19.7942          ?        ?      279.6        3.5       ?       ? 
1 1 1   57    2   18 o    364.1    3.0    0.0000   0.0000          ?        ?  1326.8479  21.7097          ?        ?      364.1        3.0       ?       ? 
1 1 1   57    2   19 o    123.3    6.2    0.0000   0.0000          ?        ?   152.6067  15.3245          ?        ?      123.3        6.2       ?       ? 
1 1 1   57    2   20 o    256.0    3.2    0.0000   0.0000          ?        ?   655.7617  16.6016          ?        ?      256.0        3.2       ?       ? 
1 1 1   57    2   21 o    250.5    3.3    0.0000   0.0000          ?        ?   628.3053  16.6016          ?        ?      250.5        3.3       ?       ? 
1 1 1   57    2   22 o    206.0    4.3    0.0000   0.0000          ?        ?   425.2554  17.8786          ?        ?      206.0        4.3       ?       ? 
1 1 1   57    2   23 o    331.8    3.3    0.0000   0.0000          ?        ?  1102.0884  21.7097          ?        ?      331.8        3.3       ?       ? 
1 1 1   57    2   24 o    231.3    3.7    0.0000   0.0000          ?        ?   535.7197  17.2401          ?        ?      231.3        3.7       ?       ? 
1 1 1   57    2   25 o    193.4    4.1    0.0000   0.0000          ?        ?   374.8122  15.9630          ?        ?      193.4        4.1       ?       ? 
1 1 1   57    2   26 o     53.3   14.6    0.0000   0.0000          ?        ?    30.0105  15.9630          ?        ?       53.3       14.6       ?       ? 
1 1 1   57    2   27 o     75.3   10.6    0.0000   0.0000          ?        ?    57.4669  15.9630          ?        ?       75.3       10.6       ?       ? 
1 1 1   57    2   28 o    194.7    4.1    0.0000   0.0000          ?        ?   379.9204  15.9630          ?        ?      194.7        4.1       ?       ? 
1 1 1   57    2   29 o     73.2   10.5    0.0000   0.0000          ?        ?    54.2743  15.3245          ?        ?       73.2       10.5       ?       ? 
1 1 1   57    2   30 o    101.3    7.9    0.0000   0.0000          ?        ?   103.4405  15.9630          ?        ?      101.3        7.9       ?       ? 
1 1 1   57    2   31 o    168.9    5.1    0.0000   0.0000          ?        ?   286.0577  17.2401          ?        ?      168.9        5.1       ?       ? 
1 1 1   57    2   32 o    224.7    3.8    0.0000   0.0000          ?        ?   505.7091  17.2401          ?        ?      224.7        3.8       ?       ? 
1 1 1   57    2   33 o     51.5   14.4    0.0000   0.0000          ?        ?    28.0950  15.3245          ?        ?       51.5       14.4       ?       ? 
1 1 1   57    2   34 o    138.7    6.0    0.0000   0.0000          ?        ?   193.4720  16.6016          ?        ?      138.7        6.0       ?       ? 
1 1 1   57    2   35 f    134.5    6.2    0.0000   0.0000          ?        ?   181.9787  16.6016          ?        ?      134.5        6.2       ?       ? 
1 1 1   57    2   36 o    145.0    5.5    0.0000   0.0000          ?        ?   211.3506  15.9630          ?        ?      145.0        5.5       ?       ? 
1 1 1   57    2   37 o     83.9    9.9    0.0000   0.0000          ?        ?    71.5144  16.6016          ?        ?       83.9        9.9       ?       ? 
1 1 1   57    2   38 o    341.0    2.9    0.0000   0.0000          ?        ?  1164.6635  19.7942          ?        ?      341.0        2.9       ?       ? 
1 1 1   57    2   39 o    200.4    4.3    0.0000   0.0000          ?        ?   402.9071  17.2401          ?        ?      200.4        4.3       ?       ? 
1 1 1   57    2   40 o     64.9   13.7    0.0000   0.0000          ?        ?    45.3350  17.2401          ?        ?       64.9       13.7       ?       ? 
1 1 1   57    3    0 o     74.9   14.2   61.9366  19.1556    61.9366  19.1556    61.9366  19.1556       74.9     14.2       74.9       14.2     0.0     0.0 
1 1 1   57    3    1 o    130.7    5.6    0.0000   0.0000          ?        ?   171.1238  14.6860          ?        ?      130.7        5.6       ?       ? 
1 1 1   57    3    2 o     35.6   13.8    0.0000   0.0000          ?        ?     8.3008  14.0475          ?        ?       35.6       13.8       ?       ? 
1 1 1   57    3    3 o    161.7    4.5    0.0000   0.0000          ?        ?   261.7939  14.6860          ?        ?      161.7        4.5       ?       ? 
1 1 1   57    3    4 o    382.7    3.3    0.0000   0.0000          ?        ?  1465.4071  24.9023          ?        ?      382.7        3.3       ?       ? 
1 1 1   57    3    5 o    113.7    5.9    0.0000   0.0000          ?        ?   129.6199  13.4090          ?        ?      113.7        5.9       ?       ? 
1 1 1   57    3    6 o    176.2    4.0    0.0000   0.0000          ?        ?   310.9600  14.0475          ?        ?      176.2        4.0       ?       ? 
1 1 1   57    3    7 o    308.4    3.4    0.0000   0.0000          ?        ?   952.0358  21.0712          ?        ?      308.4        3.4       ?       ? 
1 1 1   57    3    8 o    211.4    3.9    0.0000   0.0000          ?        ?   447.6036  16.6016          ?        ?      211.4        3.9       ?       ? 
1 1 1   57    3    9 o    174.6    4.6    0.0000   0.0000          ?        ?   305.2133  15.9630          ?        ?      174.6        4.6       ?       ? 
1 1 1   57    3   10 o    315.0    3.5    0.0000   0.0000          ?        ?   993.5397  22.3483          ?        ?      315.0        3.5       ?       ? 
1 1 1   57    3   11 o    363.3    3.0    0.0000   0.0000          ?        ?  1321.1012  21.7097          ?        ?      363.3        3.0       ?       ? 
1 1 1   57    3   12 o    297.6    3.2    0.0000   0.0000          ?        ?   886.2681  19.1556          ?        ?      297.6        3.2       ?       ? 
1 1 1   57    3   13 o    361.6    3.1    0.0000   0.0000          ?        ?  1308.3308  22.3483          ?        ?      361.6        3.1       ?       ? 
1 1 1   57    3   14 o    316.3    3.1    0.0000   0.0000          ?        ?  1001.2019  19.7942          ?        ?      316.3        3.1       ?       ? 
1 1 1   57    3   15 o    223.2    4.1    0.0000   0.0000          ?        ?   498.6854  18.5171          ?        ?      223.2        4.1       ?       ? 
1 1 1   57    3   16 o    151.0    5.3    0.0000   0.0000          ?        ?   228.5907  15.9630          ?        ?      151.0        5.3       ?       ? 
1 1 1   57    3   17 o    195.9    4.1    0.0000   0.0000          ?        ?   384.3900  15.9630          ?        ?      195.9        4.1       ?       ? 
1 1 1   57    3   18 o    123.1    6.2    0.0000   0.0000          ?        ?   151.9681  15.3245          ?        ?      123.1        6.2       ?       ? 
1 1 1   57    3   19 o    133.0    5.5    0.0000   0.0000          ?        ?   177.5090  14.6860          ?        ?      133.0        5.5       ?       ? 
1 1 1   57    3   20 o     32.3   13.5    0.0000   0.0000          ?        ?     1.9156  14.6860          ?        ?       32.3       13.5       ?       ? 
1 1 1   57    3   21 o    341.8    3.1    0.0000   0.0000          ?        ?  1169.1332  21.0712          ?        ?      341.8        3.1       ?       ? 
1 1 1   57    3   22 o    185.4    4.1    0.0000   0.0000          ?        ?   344.1632  15.3245          ?        ?      185.4        4.1       ?       ? 
1 1 1   57    3   23 o    166.6    5.0    0.0000   0.0000          ?        ?   278.3954  16.6016          ?        ?      166.6        5.0       ?       ? 
1 1 1   57    3   24 o    322.3    3.0    0.0000   0.0000          ?        ?  1039.5132  19.1556          ?        ?      322.3        3.0       ?       ? 
1 1 1   57    3   25 o    198.8    4.0    0.0000   0.0000          ?        ?   395.8834  15.9630          ?        ?      198.8        4.0       ?       ? 
1 1 1   57    3   26 f    142.3    5.4    0.0000   0.0000          ?        ?   203.0499  15.3245          ?        ?      142.3        5.4       ?       ? 
1 1 1   57    3   27 o     81.8    9.8    0.0000   0.0000          ?        ?    67.6833  15.9630          ?        ?       81.8        9.8       ?       ? 
1 1 1   57    3   28 o     55.4   13.9    0.0000   0.0000          ?        ?    32.5646  15.3245          ?        ?       55.4       13.9       ?       ? 
1 1 1   57    3   29 o    281.0    3.1    0.0000   0.0000          ?        ?   790.4898  17.2401          ?        ?      281.0        3.1       ?       ? 
1 1 1   57    3   30 o     54.2   14.0    0.0000   0.0000          ?        ?    31.2876  15.3245          ?        ?       54.2       14.0       ?       ? 
1 1 1   57    3   31 o    104.7    7.6    0.0000   0.0000          ?        ?   110.4642  15.9630          ?        ?      104.7        7.6       ?       ? 
1 1 1   57    3   32 o     73.9   11.2    0.0000   0.0000          ?        ?    55.5514  16.6016          ?        ?       73.9       11.2       ?       ? 
1 1 1   57    3   33 o     72.6   11.0    0.0000   0.0000          ?        ?    53.6358  15.9630          ?        ?       72.6       11.0       ?       ? 
1 1 1   57    3   34 o    234.1    3.5    0.0000   0.0000          ?        ?   549.1286  16.6016          ?        ?      234.1        3.5       ?       ? 
1 1 1   57    3   35 o     94.3    8.5    0.0000   0.0000          ?        ?    90.0316  15.9630          ?        ?       94.3        8.5       ?       ? 
1 1 1   57    3   36 o    156.0    5.3    0.0000   0.0000          ?        ?   244.5538  16.6016          ?        ?      156.0        5.3       ?       ? 
1 1 1   57    3   37 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   57    3   38 o     91.0    9.5    0.0000   0.0000          ?        ?    84.2849  17.2401          ?        ?       91.0        9.5       ?       ? 
1 1 1   57    3   39 o    171.7    5.0    0.0000   0.0000          ?        ?   296.2740  17.2401          ?        ?      171.7        5.0       ?       ? 
1 1 1   57    4    0 o    195.1    5.1  381.8359  19.7942   381.8359  19.7942   381.8359  19.7942      195.1      5.1      195.1        5.1     0.0     0.0 
1 1 1   57    4    1 o    143.9    4.9    0.0000   0.0000          ?        ?   207.5195  14.0475          ?        ?      143.9        4.9       ?       ? 
1 1 1   57    4    2 o    104.3    6.7    0.0000   0.0000          ?        ?   109.1872  14.0475          ?        ?      104.3        6.7       ?       ? 
1 1 1   57    4    3 o    186.8    3.9    0.0000   0.0000          ?        ?   349.2713  14.6860          ?        ?      186.8        3.9       ?       ? 
1 1 1   57    4    4 o    117.8    6.0    0.0000   0.0000          ?        ?   139.1977  14.0475          ?        ?      117.8        6.0       ?       ? 
1 1 1   57    4    5 o    192.6    4.1    0.0000   0.0000          ?        ?   371.6196  15.9630          ?        ?      192.6        4.1       ?       ? 
1 1 1   57    4    6 o    246.8    3.2    0.0000   0.0000          ?        ?   609.7881  15.9630          ?        ?      246.8        3.2       ?       ? 
1 1 1   57    4    7 o    328.5    3.2    0.0000   0.0000          ?        ?  1079.7401  21.0712          ?        ?      328.5        3.2       ?       ? 
1 1 1   57    4    8 o     67.0   10.5    0.0000   0.0000          ?        ?    45.3350  14.0475          ?        ?       67.0       10.5       ?       ? 
1 1 1   57    4    9 o    146.3    5.0    0.0000   0.0000          ?        ?   214.5433  14.6860          ?        ?      146.3        5.0       ?       ? 
1 1 1   57    4   10 o    231.9    3.6    0.0000   0.0000          ?        ?   538.2737  16.6016          ?        ?      231.9        3.6       ?       ? 
1 1 1   57    4   11 o    215.6    4.4    0.0000   0.0000          ?        ?   465.4823  19.1556          ?        ?      215.6        4.4       ?       ? 
1 1 1   57    4   12 o    180.5    4.6    0.0000   0.0000          ?        ?   326.2845  16.6016          ?        ?      180.5        4.6       ?       ? 
1 1 1   57    4   13 o    132.8    5.8    0.0000   0.0000          ?        ?   176.8705  15.3245          ?        ?      132.8        5.8       ?       ? 
1 1 1   57    4   14 o    185.7    4.0    0.0000   0.0000          ?        ?   345.4402  14.6860          ?        ?      185.7        4.0       ?       ? 
1 1 1   57    4   15 o    210.4    3.8    0.0000   0.0000          ?        ?   443.1340  15.9630          ?        ?      210.4        3.8       ?       ? 
1 1 1   57    4   16 o    184.1    4.3    0.0000   0.0000          ?        ?   339.6935  15.9630          ?        ?      184.1        4.3       ?       ? 
1 1 1   57    4   17 o    313.5    3.2    0.0000   0.0000          ?        ?   983.9619  19.7942          ?        ?      313.5        3.2       ?       ? 
1 1 1   57    4   18 o    330.4    3.2    0.0000   0.0000          ?        ?  1092.5105  21.0712          ?        ?      330.4        3.2       ?       ? 
1 1 1   57    4   19 o    156.6    4.9    0.0000   0.0000          ?        ?   245.8308  15.3245          ?        ?      156.6        4.9       ?       ? 
1 1 1   57    4   20 o    125.9    6.1    0.0000   0.0000          ?        ?   158.9919  15.3245          ?        ?      125.9        6.1       ?       ? 
1 1 1   57    4   21 o     47.9   14.6    0.0000   0.0000          ?        ?    23.6253  15.3245          ?        ?       47.9       14.6       ?       ? 
1 1 1   57    4   22 o     87.2    8.8    0.0000   0.0000          ?        ?    76.6226  15.3245          ?        ?       87.2        8.8       ?       ? 
1 1 1   57    4   23 o    137.9    5.8    0.0000   0.0000          ?        ?   190.9180  15.9630          ?        ?      137.9        5.8       ?       ? 
1 1 1   57    4   24 o    297.4    3.1    0.0000   0.0000          ?        ?   885.6295  18.5171          ?        ?      297.4        3.1       ?       ? 
1 1 1   57    4   25 o    224.1    3.6    0.0000   0.0000          ?        ?   503.1551  15.9630          ?        ?      224.1        3.6       ?       ? 
1 1 1   57    4   26 o     17.5    8.8    0.0000   0.0000          ?        ?   -52.9973  15.3245          ?        ?       17.5        8.8       ?       ? 
1 1 1   57    4   27 o     65.2   12.2    0.0000   0.0000          ?        ?    44.6965  15.3245          ?        ?       65.2       12.2       ?       ? 
1 1 1   57    4   28 o    145.5    5.7    0.0000   0.0000          ?        ?   212.6277  16.6016          ?        ?      145.5        5.7       ?       ? 
1 1 1   57    4   29 f     36.5   14.4    0.0000   0.0000          ?        ?     8.3008  15.3245          ?        ?       36.5       14.4       ?       ? 
1 1 1   57    4   30 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   57    4   31 o    174.3    4.6    0.0000   0.0000          ?        ?   304.5748  15.9630          ?        ?      174.3        4.6       ?       ? 
1 1 1   57    4   32 o     87.4    8.8    0.0000   0.0000          ?        ?    77.2611  15.3245          ?        ?       87.4        8.8       ?       ? 
1 1 1   57    4   33 o     31.7   13.6    0.0000   0.0000          ?        ?     0.0000  15.3245          ?        ?       31.7       13.6       ?       ? 
1 1 1   57    4   34 o     63.5   12.5    0.0000   0.0000          ?        ?    42.7809  15.3245          ?        ?       63.5       12.5       ?       ? 
1 1 1   57    4   35 o     75.9   10.5    0.0000   0.0000          ?        ?    58.7440  15.9630          ?        ?       75.9       10.5       ?       ? 
1 1 1   57    4   36 o     84.2    9.5    0.0000   0.0000          ?        ?    72.1529  15.9630          ?        ?       84.2        9.5       ?       ? 
1 1 1   57    4   37 o    102.6    8.1    0.0000   0.0000          ?        ?   106.6331  16.6016          ?        ?      102.6        8.1       ?       ? 
1 1 1   57    4   38 o    121.7    6.6    0.0000   0.0000          ?        ?   149.4141  15.9630          ?        ?      121.7        6.6       ?       ? 
1 1 1   57    5    0 o    204.1    5.0  417.5931  20.4327   417.5931  20.4327   417.5931  20.4327      204.1      5.0      204.1        5.0     0.0     0.0 
1 1 1   57    5    1 o    300.7    3.3    0.0000   0.0000          ?        ?   904.7851  19.7942          ?        ?      300.7        3.3       ?       ? 
1 1 1   57    5    2 o    207.8    3.8    0.0000   0.0000          ?        ?   432.2791  15.9630          ?        ?      207.8        3.8       ?       ? 
1 1 1   57    5    3 o    161.9    4.5    0.0000   0.0000          ?        ?   262.4324  14.6860          ?        ?      161.9        4.5       ?       ? 
1 1 1   57    5    4 o    279.7    3.3    0.0000   0.0000          ?        ?   782.8275  18.5171          ?        ?      279.7        3.3       ?       ? 
1 1 1   57    5    5 o    266.4    3.5    0.0000   0.0000          ?        ?   710.6746  18.5171          ?        ?      266.4        3.5       ?       ? 
1 1 1   57    5    6 o    268.4    3.3    0.0000   0.0000          ?        ?   720.8909  17.8786          ?        ?      268.4        3.3       ?       ? 
1 1 1   57    5    7 o    156.8    4.7    0.0000   0.0000          ?        ?   246.4693  14.6860          ?        ?      156.8        4.7       ?       ? 
1 1 1   57    5    8 o    113.9    6.2    0.0000   0.0000          ?        ?   130.2584  14.0475          ?        ?      113.9        6.2       ?       ? 
1 1 1   57    5    9 o    313.6    3.2    0.0000   0.0000          ?        ?   984.6003  19.7942          ?        ?      313.6        3.2       ?       ? 
1 1 1   57    5   10 o    278.3    3.2    0.0000   0.0000          ?        ?   775.1653  17.8786          ?        ?      278.3        3.2       ?       ? 
1 1 1   57    5   11 o    149.5    5.6    0.0000   0.0000          ?        ?   224.1211  16.6016          ?        ?      149.5        5.6       ?       ? 
1 1 1   57    5   12 o     99.9    7.0    0.0000   0.0000          ?        ?   100.2479  14.0475          ?        ?       99.9        7.0       ?       ? 
1 1 1   57    5   13 o    238.8    3.7    0.0000   0.0000          ?        ?   570.8383  17.8786          ?        ?      238.8        3.7       ?       ? 
1 1 1   57    5   14 o    239.2    3.6    0.0000   0.0000          ?        ?   572.7539  17.2401          ?        ?      239.2        3.6       ?       ? 
1 1 1   57    5   15 o    373.0    3.1    0.0000   0.0000          ?        ?  1392.6157  22.9868          ?        ?      373.0        3.1       ?       ? 
1 1 1   57    5   16 o    444.1    2.9    0.0000   0.0000          ?        ?  1974.3090  26.1794          ?        ?      444.1        2.9       ?       ? 
1 1 1   57    5   17 o    233.6    3.8    0.0000   0.0000          ?        ?   546.5745  17.8786          ?        ?      233.6        3.8       ?       ? 
1 1 1   57    5   18 o    150.1    5.5    0.0000   0.0000          ?        ?   226.0367  16.6016          ?        ?      150.1        5.5       ?       ? 
1 1 1   57    5   19 o     56.0   15.1    0.0000   0.0000          ?        ?    33.2031  17.2401          ?        ?       56.0       15.1       ?       ? 
1 1 1   57    5   20 o     43.1   15.3    0.0000   0.0000          ?        ?    16.6016  16.6016          ?        ?       43.1       15.3       ?       ? 
1 1 1   57    5   21 o    136.9    6.3    0.0000   0.0000          ?        ?   188.3639  17.2401          ?        ?      136.9        6.3       ?       ? 
1 1 1   57    5   22 o    212.1    3.9    0.0000   0.0000          ?        ?   450.7963  16.6016          ?        ?      212.1        3.9       ?       ? 
1 1 1   57    5   23 o    138.6    5.8    0.0000   0.0000          ?        ?   192.8335  15.9630          ?        ?      138.6        5.8       ?       ? 
1 1 1   57    5   24 o     84.1    9.1    0.0000   0.0000          ?        ?    71.5144  15.3245          ?        ?       84.1        9.1       ?       ? 
1 1 1   57    5   25 o    382.6    2.8    0.0000   0.0000          ?        ?  1465.4071  21.0712          ?        ?      382.6        2.8       ?       ? 
1 1 1   57    5   26 o     86.0    8.5    0.0000   0.0000          ?        ?    74.7070  14.6860          ?        ?       86.0        8.5       ?       ? 
1 1 1   57    5   27 o     90.3    8.8    0.0000   0.0000          ?        ?    82.3693  15.9630          ?        ?       90.3        8.8       ?       ? 
1 1 1   57    5   28 o    277.4    3.2    0.0000   0.0000          ?        ?   770.6956  17.8786          ?        ?      277.4        3.2       ?       ? 
1 1 1   57    5   29 o    127.7    6.2    0.0000   0.0000          ?        ?   164.1001  15.9630          ?        ?      127.7        6.2       ?       ? 
1 1 1   57    5   30 o    213.4    3.7    0.0000   0.0000          ?        ?   456.5430  15.9630          ?        ?      213.4        3.7       ?       ? 
1 1 1   57    5   31 o     78.1    9.8    0.0000   0.0000          ?        ?    61.9366  15.3245          ?        ?       78.1        9.8       ?       ? 
1 1 1   57    5   32 f    186.2    4.5    0.0000   0.0000          ?        ?   347.9943  16.6016          ?        ?      186.2        4.5       ?       ? 
1 1 1   57    5   33 o     21.5   10.5    0.0000   0.0000          ?        ?   -29.3720  15.3245          ?        ?       21.5       10.5       ?       ? 
1 1 1   57    5   34 f     95.3    8.4    0.0000   0.0000          ?        ?    91.9471  15.9630          ?        ?       95.3        8.4       ?       ? 
1 1 1   57    5   35 o     79.6    9.6    0.0000   0.0000          ?        ?    64.4907  15.3245          ?        ?       79.6        9.6       ?       ? 
1 1 1   57    5   36 o     49.7   15.2    0.0000   0.0000          ?        ?    26.1794  16.6016          ?        ?       49.7       15.2       ?       ? 
1 1 1   57    6    0 o    234.7    5.4  552.3212  25.5409   552.3212  25.5409   552.3212  25.5409      234.7      5.4      234.7        5.4     0.0     0.0 
1 1 1   57    6    1 f    129.2    5.4    0.0000   0.0000          ?        ?   167.2927  14.0475          ?        ?      129.2        5.4       ?       ? 
1 1 1   57    6    2 o     49.9   13.2    0.0000   0.0000          ?        ?    26.1794  13.4090          ?        ?       49.9       13.2       ?       ? 
1 1 1   57    6    3 o     19.1    9.5    0.0000   0.0000          ?        ?   -30.6490  13.4090          ?        ?       19.1        9.5       ?       ? 
1 1 1   57    6    4 o    130.7    4.9    0.0000   0.0000          ?        ?   171.1238  12.7704          ?        ?      130.7        4.9       ?       ? 
1 1 1   57    6    5 o    265.9    3.0    0.0000   0.0000          ?        ?   707.4820  15.9630          ?        ?      265.9        3.0       ?       ? 
1 1 1   57    6    6 o    307.6    3.3    0.0000   0.0000          ?        ?   946.9276  20.4327          ?        ?      307.6        3.3       ?       ? 
1 1 1   57    6    7 o    217.2    3.7    0.0000   0.0000          ?        ?   472.5060  15.9630          ?        ?      217.2        3.7       ?       ? 
1 1 1   57    6    8 o    214.3    3.6    0.0000   0.0000          ?        ?   459.7356  15.3245          ?        ?      214.3        3.6       ?       ? 
1 1 1   57    6    9 o     48.4   15.3    0.0000   0.0000          ?        ?    23.6253  16.6016          ?        ?       48.4       15.3       ?       ? 
1 1 1   57    6   10 o    254.6    3.4    0.0000   0.0000          ?        ?   648.7380  17.2401          ?        ?      254.6        3.4       ?       ? 
1 1 1   57    6   11 o     96.6    7.3    0.0000   0.0000          ?        ?    93.8627  14.0475          ?        ?       96.6        7.3       ?       ? 
1 1 1   57    6   12 o    186.7    4.4    0.0000   0.0000          ?        ?   349.2713  16.6016          ?        ?      186.7        4.4       ?       ? 
1 1 1   57    6   13 o     39.2   14.8    0.0000   0.0000          ?        ?    11.4934  15.9630          ?        ?       39.2       14.8       ?       ? 
1 1 1   57    6   14 o    232.3    3.6    0.0000   0.0000          ?        ?   540.1893  16.6016          ?        ?      232.3        3.6       ?       ? 
1 1 1   57    6   15 o    139.8    5.3    0.0000   0.0000          ?        ?   196.0261  14.6860          ?        ?      139.8        5.3       ?       ? 
1 1 1   57    6   16 o    161.6    5.1    0.0000   0.0000          ?        ?   261.7939  16.6016          ?        ?      161.6        5.1       ?       ? 
1 1 1   57    6   17 o    113.3    7.0    0.0000   0.0000          ?        ?   128.9814  15.9630          ?        ?      113.3        7.0       ?       ? 
1 1 1   57    6   18 o    159.4    4.8    0.0000   0.0000          ?        ?   254.7701  15.3245          ?        ?      159.4        4.8       ?       ? 
1 1 1   57    6   19 o    271.5    3.5    0.0000   0.0000          ?        ?   738.1310  19.1556          ?        ?      271.5        3.5       ?       ? 
1 1 1   57    6   20 o     71.4   10.7    0.0000   0.0000          ?        ?    51.7203  15.3245          ?        ?       71.4       10.7       ?       ? 
1 1 1   57    6   21 o    153.0    5.4    0.0000   0.0000          ?        ?   234.9760  16.6016          ?        ?      153.0        5.4       ?       ? 
1 1 1   57    6   22 o    136.3    5.6    0.0000   0.0000          ?        ?   186.4483  15.3245          ?        ?      136.3        5.6       ?       ? 
1 1 1   57    6   23 o    226.1    4.0    0.0000   0.0000          ?        ?   512.0943  17.8786          ?        ?      226.1        4.0       ?       ? 
1 1 1   57    6   24 o    285.1    2.9    0.0000   0.0000          ?        ?   813.4766  16.6016          ?        ?      285.1        2.9       ?       ? 
1 1 1   57    6   25 o    190.9    4.0    0.0000   0.0000          ?        ?   365.2344  15.3245          ?        ?      190.9        4.0       ?       ? 
1 1 1   57    6   26 o    219.8    3.8    0.0000   0.0000          ?        ?   483.9994  16.6016          ?        ?      219.8        3.8       ?       ? 
1 1 1   57    6   27 o    167.2    4.8    0.0000   0.0000          ?        ?   280.3110  15.9630          ?        ?      167.2        4.8       ?       ? 
1 1 1   57    6   28 o     28.4   12.9    0.0000   0.0000          ?        ?    -8.9393  15.9630          ?        ?       28.4       12.9       ?       ? 
1 1 1   57    6   29 o     59.5   12.7    0.0000   0.0000          ?        ?    37.6728  14.6860          ?        ?       59.5       12.7       ?       ? 
1 1 1   57    6   30 o     28.6   13.0    0.0000   0.0000          ?        ?   -10.2163  16.6016          ?        ?       28.6       13.0       ?       ? 
1 1 1   57    6   31 o     60.4   13.1    0.0000   0.0000          ?        ?    38.9498  15.3245          ?        ?       60.4       13.1       ?       ? 
1 1 1   57    6   32 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   57    6   33 o     94.6    8.4    0.0000   0.0000          ?        ?    90.6701  15.9630          ?        ?       94.6        8.4       ?       ? 
1 1 1   57    6   34 o     30.3   13.1    0.0000   0.0000          ?        ?    -1.2770  14.6860          ?        ?       30.3       13.1       ?       ? 
1 1 1   57    6   35 o     45.1   15.1    0.0000   0.0000          ?        ?    20.4327  15.9630          ?        ?       45.1       15.1       ?       ? 
1 1 1   57    7    0 o    284.7    4.7  812.1995  26.8179   812.1995  26.8179   812.1995  26.8179      284.7      4.7      284.7        4.7     0.0     0.0 
1 1 1   57    7    1 o    109.7    6.1    0.0000   0.0000          ?        ?   120.6806  13.4090          ?        ?      109.7        6.1       ?       ? 
1 1 1   57    7    2 o    179.6    4.3    0.0000   0.0000          ?        ?   323.0919  15.3245          ?        ?      179.6        4.3       ?       ? 
1 1 1   57    7    3 o    164.0    4.5    0.0000   0.0000          ?        ?   269.4561  14.6860          ?        ?      164.0        4.5       ?       ? 
1 1 1   57    7    4 o    286.3    3.2    0.0000   0.0000          ?        ?   820.5003  18.5171          ?        ?      286.3        3.2       ?       ? 
1 1 1   57    7    5 o     63.6   10.5    0.0000   0.0000          ?        ?    40.8654  13.4090          ?        ?       63.6       10.5       ?       ? 
1 1 1   57    7    6 o    240.6    3.6    0.0000   0.0000          ?        ?   579.7776  17.2401          ?        ?      240.6        3.6       ?       ? 
1 1 1   57    7    7 o    193.6    4.0    0.0000   0.0000          ?        ?   375.4507  15.3245          ?        ?      193.6        4.0       ?       ? 
1 1 1   57    7    8 o    276.1    3.1    0.0000   0.0000          ?        ?   763.0333  17.2401          ?        ?      276.1        3.1       ?       ? 
1 1 1   57    7    9 o    158.8    4.6    0.0000   0.0000          ?        ?   252.8546  14.6860          ?        ?      158.8        4.6       ?       ? 
1 1 1   57    7   10 o    146.1    5.2    0.0000   0.0000          ?        ?   213.9047  15.3245          ?        ?      146.1        5.2       ?       ? 
1 1 1   57    7   11 o    139.1    5.5    0.0000   0.0000          ?        ?   194.1106  15.3245          ?        ?      139.1        5.5       ?       ? 
1 1 1   57    7   12 o    188.1    4.2    0.0000   0.0000          ?        ?   354.3795  15.9630          ?        ?      188.1        4.2       ?       ? 
1 1 1   57    7   13 o    132.5    5.5    0.0000   0.0000          ?        ?   176.2320  14.6860          ?        ?      132.5        5.5       ?       ? 
1 1 1   57    7   14 o    193.1    4.1    0.0000   0.0000          ?        ?   373.5352  15.9630          ?        ?      193.1        4.1       ?       ? 
1 1 1   57    7   15 o    221.3    3.8    0.0000   0.0000          ?        ?   490.3846  16.6016          ?        ?      221.3        3.8       ?       ? 
1 1 1   57    7   16 o    116.3    7.1    0.0000   0.0000          ?        ?   136.0051  16.6016          ?        ?      116.3        7.1       ?       ? 
1 1 1   57    7   17 f    180.0    5.0    0.0000   0.0000          ?        ?   325.0075  17.8786          ?        ?      180.0        5.0       ?       ? 
1 1 1   57    7   18 o     25.7   12.1    0.0000   0.0000          ?        ?   -19.1556  16.6016          ?        ?       25.7       12.1       ?       ? 
1 1 1   57    7   19 o     59.6   13.2    0.0000   0.0000          ?        ?    37.6728  15.3245          ?        ?       59.6       13.2       ?       ? 
1 1 1   57    7   20 o    145.5    5.5    0.0000   0.0000          ?        ?   212.6277  15.9630          ?        ?      145.5        5.5       ?       ? 
1 1 1   57    7   21 o     62.2   12.8    0.0000   0.0000          ?        ?    40.8654  15.3245          ?        ?       62.2       12.8       ?       ? 
1 1 1   57    7   22 o    164.9    4.8    0.0000   0.0000          ?        ?   272.6487  15.9630          ?        ?      164.9        4.8       ?       ? 
1 1 1   57    7   23 o    193.1    4.0    0.0000   0.0000          ?        ?   373.5352  15.3245          ?        ?      193.1        4.0       ?       ? 
1 1 1   57    7   24 o    197.9    4.0    0.0000   0.0000          ?        ?   392.6908  15.9630          ?        ?      197.9        4.0       ?       ? 
1 1 1   57    7   25 o    135.7    5.9    0.0000   0.0000          ?        ?   185.1713  15.9630          ?        ?      135.7        5.9       ?       ? 
1 1 1   57    7   26 o     53.6   14.1    0.0000   0.0000          ?        ?    30.6490  15.3245          ?        ?       53.6       14.1       ?       ? 
1 1 1   57    7   27 o     66.9   12.4    0.0000   0.0000          ?        ?    47.2506  15.9630          ?        ?       66.9       12.4       ?       ? 
1 1 1   57    7   28 o     89.9    8.5    0.0000   0.0000          ?        ?    81.7308  15.3245          ?        ?       89.9        8.5       ?       ? 
1 1 1   57    7   29 o    162.2    5.1    0.0000   0.0000          ?        ?   264.3480  16.6016          ?        ?      162.2        5.1       ?       ? 
1 1 1   57    7   30 o    103.4    7.4    0.0000   0.0000          ?        ?   107.9102  15.3245          ?        ?      103.4        7.4       ?       ? 
1 1 1   57    7   31 o    104.3    7.3    0.0000   0.0000          ?        ?   109.8257  15.3245          ?        ?      104.3        7.3       ?       ? 
1 1 1   57    7   32 o    181.2    4.4    0.0000   0.0000          ?        ?   329.4771  15.9630          ?        ?      181.2        4.4       ?       ? 
1 1 1   57    7   33 o    148.6    5.4    0.0000   0.0000          ?        ?   222.2055  15.9630          ?        ?      148.6        5.4       ?       ? 
1 1 1   57    8    0 o    142.1    7.9  204.3269  22.3483   204.3269  22.3483   204.3269  22.3483      142.1      7.9      142.1        7.9     0.0     0.0 
1 1 1   57    8    1 o    387.7    3.2    0.0000   0.0000          ?        ?  1504.9955  24.9023          ?        ?      387.7        3.2       ?       ? 
1 1 1   57    8    2 o    172.7    4.1    0.0000   0.0000          ?        ?   298.8281  14.0475          ?        ?      172.7        4.1       ?       ? 
1 1 1   57    8    3 o    131.9    5.1    0.0000   0.0000          ?        ?   174.3164  13.4090          ?        ?      131.9        5.1       ?       ? 
1 1 1   57    8    4 o    260.1    3.4    0.0000   0.0000          ?        ?   677.4714  17.8786          ?        ?      260.1        3.4       ?       ? 
1 1 1   57    8    5 o    212.5    3.8    0.0000   0.0000          ?        ?   452.0733  15.9630          ?        ?      212.5        3.8       ?       ? 
1 1 1   57    8    6 o    214.0    3.6    0.0000   0.0000          ?        ?   458.4586  15.3245          ?        ?      214.0        3.6       ?       ? 
1 1 1   57    8    7 o    368.6    3.3    0.0000   0.0000          ?        ?  1360.0510  24.2638          ?        ?      368.6        3.3       ?       ? 
1 1 1   57    8    8 o    118.0    6.0    0.0000   0.0000          ?        ?   139.8362  14.0475          ?        ?      118.0        6.0       ?       ? 
1 1 1   57    8    9 o     77.5    9.5    0.0000   0.0000          ?        ?    60.6596  14.6860          ?        ?       77.5        9.5       ?       ? 
1 1 1   57    8   10 o     23.5   11.2    0.0000   0.0000          ?        ?   -19.1556  14.6860          ?        ?       23.5       11.2       ?       ? 
1 1 1   57    8   11 o     67.4   10.4    0.0000   0.0000          ?        ?    45.9736  14.0475          ?        ?       67.4       10.4       ?       ? 
1 1 1   57    8   12 o    125.1    5.9    0.0000   0.0000          ?        ?   157.0763  14.6860          ?        ?      125.1        5.9       ?       ? 
1 1 1   57    8   13 o    302.1    3.3    0.0000   0.0000          ?        ?   913.7245  19.7942          ?        ?      302.1        3.3       ?       ? 
1 1 1   57    8   14 o    167.6    4.8    0.0000   0.0000          ?        ?   281.5880  15.9630          ?        ?      167.6        4.8       ?       ? 
1 1 1   57    8   15 o     95.9    8.0    0.0000   0.0000          ?        ?    92.5856  15.3245          ?        ?       95.9        8.0       ?       ? 
1 1 1   57    8   16 o    194.5    4.8    0.0000   0.0000          ?        ?   379.2819  18.5171          ?        ?      194.5        4.8       ?       ? 
1 1 1   57    8   17 o    227.1    3.9    0.0000   0.0000          ?        ?   516.5640  17.8786          ?        ?      227.1        3.9       ?       ? 
1 1 1   57    8   18 o    107.4    7.7    0.0000   0.0000          ?        ?   116.2109  16.6016          ?        ?      107.4        7.7       ?       ? 
1 1 1   57    8   19 o     55.3   13.4    0.0000   0.0000          ?        ?    32.5646  14.6860          ?        ?       55.3       13.4       ?       ? 
1 1 1   57    8   20 o     27.5   12.5    0.0000   0.0000          ?        ?    -9.5778  15.3245          ?        ?       27.5       12.5       ?       ? 
1 1 1   57    8   21 o    134.1    6.0    0.0000   0.0000          ?        ?   180.7016  15.9630          ?        ?      134.1        6.0       ?       ? 
1 1 1   57    8   22 o    150.7    5.3    0.0000   0.0000          ?        ?   227.9522  15.9630          ?        ?      150.7        5.3       ?       ? 
1 1 1   57    8   23 o    178.1    4.5    0.0000   0.0000          ?        ?   317.9838  15.9630          ?        ?      178.1        4.5       ?       ? 
1 1 1   57    8   24 o     24.4   11.6    0.0000   0.0000          ?        ?   -18.5171  15.3245          ?        ?       24.4       11.6       ?       ? 
1 1 1   57    8   25 f     25.3   11.8    0.0000   0.0000          ?        ?   -13.4090  14.6860          ?        ?       25.3       11.8       ?       ? 
1 1 1   57    8   26 o     23.8   11.5    0.0000   0.0000          ?        ?   -22.9868  15.9630          ?        ?       23.8       11.5       ?       ? 
1 1 1   57    8   27 o    220.6    3.9    0.0000   0.0000          ?        ?   487.8305  17.2401          ?        ?      220.6        3.9       ?       ? 
1 1 1   57    8   28 o    184.2    4.3    0.0000   0.0000          ?        ?   340.3320  15.9630          ?        ?      184.2        4.3       ?       ? 
1 1 1   57    8   29 o    218.2    3.8    0.0000   0.0000          ?        ?   477.6142  16.6016          ?        ?      218.2        3.8       ?       ? 
1 1 1   57    8   30 o     49.6   14.5    0.0000   0.0000          ?        ?    26.1794  15.3245          ?        ?       49.6       14.5       ?       ? 
1 1 1   57    8   31 o     27.3   12.6    0.0000   0.0000          ?        ?   -11.4934  15.9630          ?        ?       27.3       12.6       ?       ? 
1 1 1   57    9    0 o    196.4    6.0  387.5826  23.6253   387.5826  23.6253   387.5826  23.6253      196.4      6.0      196.4        6.0     0.0     0.0 
1 1 1   57    9    1 o     96.9    7.2    0.0000   0.0000          ?        ?    94.5012  14.0475          ?        ?       96.9        7.2       ?       ? 
1 1 1   57    9    2 o    236.5    3.4    0.0000   0.0000          ?        ?   559.9835  15.9630          ?        ?      236.5        3.4       ?       ? 
1 1 1   57    9    3 o     98.3    6.5    0.0000   0.0000          ?        ?    97.0553  12.7704          ?        ?       98.3        6.5       ?       ? 
1 1 1   57    9    4 o    238.7    3.6    0.0000   0.0000          ?        ?   570.8383  17.2401          ?        ?      238.7        3.6       ?       ? 
1 1 1   57    9    5 o    258.0    3.7    0.0000   0.0000          ?        ?   666.6166  19.1556          ?        ?      258.0        3.7       ?       ? 
1 1 1   57    9    6 o    113.3    5.9    0.0000   0.0000          ?        ?   128.9814  13.4090          ?        ?      113.3        5.9       ?       ? 
1 1 1   57    9    7 o    167.4    4.6    0.0000   0.0000          ?        ?   280.9495  15.3245          ?        ?      167.4        4.6       ?       ? 
1 1 1   57    9    8 o    121.2    6.3    0.0000   0.0000          ?        ?   147.4985  15.3245          ?        ?      121.2        6.3       ?       ? 
1 1 1   57    9    9 o    394.7    3.4    0.0000   0.0000          ?        ?  1559.9083  26.8179          ?        ?      394.7        3.4       ?       ? 
1 1 1   57    9   10 o    245.1    3.5    0.0000   0.0000          ?        ?   601.4874  17.2401          ?        ?      245.1        3.5       ?       ? 
1 1 1   57    9   11 o    126.6    6.1    0.0000   0.0000          ?        ?   160.9075  15.3245          ?        ?      126.6        6.1       ?       ? 
1 1 1   57    9   12 o    145.6    5.3    0.0000   0.0000          ?        ?   212.6277  15.3245          ?        ?      145.6        5.3       ?       ? 
1 1 1   57    9   13 o    235.9    4.1    0.0000   0.0000          ?        ?   557.4294  19.1556          ?        ?      235.9        4.1       ?       ? 
1 1 1   57    9   14 o     61.8   12.3    0.0000   0.0000          ?        ?    40.2269  14.6860          ?        ?       61.8       12.3       ?       ? 
1 1 1   57    9   15 o    232.2    3.7    0.0000   0.0000          ?        ?   540.1893  17.2401          ?        ?      232.2        3.7       ?       ? 
1 1 1   57    9   16 o     59.0   13.8    0.0000   0.0000          ?        ?    37.0343  15.9630          ?        ?       59.0       13.8       ?       ? 
1 1 1   57    9   17 o    176.0    5.1    0.0000   0.0000          ?        ?   310.9600  17.8786          ?        ?      176.0        5.1       ?       ? 
1 1 1   57    9   18 o    125.5    6.4    0.0000   0.0000          ?        ?   158.3534  15.9630          ?        ?      125.5        6.4       ?       ? 
1 1 1   57    9   19 o     88.4    9.4    0.0000   0.0000          ?        ?    79.1767  16.6016          ?        ?       88.4        9.4       ?       ? 
1 1 1   57    9   20 o     18.2    9.2    0.0000   0.0000          ?        ?   -47.8891  15.3245          ?        ?       18.2        9.2       ?       ? 
1 1 1   57    9   21 o    118.4    6.5    0.0000   0.0000          ?        ?   141.1133  15.3245          ?        ?      118.4        6.5       ?       ? 
1 1 1   57    9   22 o    106.2    6.9    0.0000   0.0000          ?        ?   113.6568  14.6860          ?        ?      106.2        6.9       ?       ? 
1 1 1   57    9   23 o     21.9   10.8    0.0000   0.0000          ?        ?   -34.4802  16.6016          ?        ?       21.9       10.8       ?       ? 
1 1 1   57    9   24 o    120.3    6.4    0.0000   0.0000          ?        ?   145.5829  15.3245          ?        ?      120.3        6.4       ?       ? 
1 1 1   57    9   25 o     26.5   12.2    0.0000   0.0000          ?        ?   -12.1319  15.3245          ?        ?       26.5       12.2       ?       ? 
1 1 1   57    9   26 o     19.4    9.6    0.0000   0.0000          ?        ?   -32.5646  14.0475          ?        ?       19.4        9.6       ?       ? 
1 1 1   57    9   27 o    187.9    4.2    0.0000   0.0000          ?        ?   354.3795  15.9630          ?        ?      187.9        4.2       ?       ? 
1 1 1   57    9   28 o    123.8    6.2    0.0000   0.0000          ?        ?   154.5222  15.3245          ?        ?      123.8        6.2       ?       ? 
1 1 1   57    9   29 o    159.8    4.8    0.0000   0.0000          ?        ?   256.6857  15.3245          ?        ?      159.8        4.8       ?       ? 
1 1 1   57    9   30 o    206.8    3.7    0.0000   0.0000          ?        ?   429.0865  15.3245          ?        ?      206.8        3.7       ?       ? 
1 1 1   57   10    0 o     74.2   13.9   60.6596  18.5171    60.6596  18.5171    60.6596  18.5171       74.2     13.9       74.2       13.9     0.0     0.0 
1 1 1   57   10    1 o     97.0    6.6    0.0000   0.0000          ?        ?    94.5012  12.7704          ?        ?       97.0        6.6       ?       ? 
1 1 1   57   10    2 o    239.3    3.2    0.0000   0.0000          ?        ?   573.3925  15.3245          ?        ?      239.3        3.2       ?       ? 
1 1 1   57   10    3 o    184.0    4.0    0.0000   0.0000          ?        ?   339.0550  14.6860          ?        ?      184.0        4.0       ?       ? 
1 1 1   57   10    4 o    157.4    4.9    0.0000   0.0000          ?        ?   248.3849  15.3245          ?        ?      157.4        4.9       ?       ? 
1 1 1   57   10    5 o    372.8    3.5    0.0000   0.0000          ?        ?  1391.9772  26.1794          ?        ?      372.8        3.5       ?       ? 
1 1 1   57   10    6 o    218.0    4.1    0.0000   0.0000          ?        ?   476.3371  17.8786          ?        ?      218.0        4.1       ?       ? 
1 1 1   57   10    7 o    234.7    3.5    0.0000   0.0000          ?        ?   551.6827  16.6016          ?        ?      234.7        3.5       ?       ? 
1 1 1   57   10    8 o    123.0    5.7    0.0000   0.0000          ?        ?   151.9681  14.0475          ?        ?      123.0        5.7       ?       ? 
1 1 1   57   10    9 o    170.4    4.3    0.0000   0.0000          ?        ?   291.1659  14.6860          ?        ?      170.4        4.3       ?       ? 
1 1 1   57   10   10 o    163.7    4.7    0.0000   0.0000          ?        ?   268.8176  15.3245          ?        ?      163.7        4.7       ?       ? 
1 1 1   57   10   11 o     76.3    8.8    0.0000   0.0000          ?        ?    58.7440  13.4090          ?        ?       76.3        8.8       ?       ? 
1 1 1   57   10   12 o    290.8    3.3    0.0000   0.0000          ?        ?   846.6797  19.1556          ?        ?      290.8        3.3       ?       ? 
1 1 1   57   10   13 o    224.9    4.0    0.0000   0.0000          ?        ?   506.9862  17.8786          ?        ?      224.9        4.0       ?       ? 
1 1 1   57   10   14 o     24.8   11.5    0.0000   0.0000          ?        ?   -10.8549  13.4090          ?        ?       24.8       11.5       ?       ? 
1 1 1   57   10   15 o    111.2    6.6    0.0000   0.0000          ?        ?   124.5117  14.6860          ?        ?      111.2        6.6       ?       ? 
1 1 1   57   10   16 o    246.6    3.5    0.0000   0.0000          ?        ?   609.1497  17.2401          ?        ?      246.6        3.5       ?       ? 
1 1 1   57   10   17 o    286.0    3.5    0.0000   0.0000          ?        ?   819.2233  19.7942          ?        ?      286.0        3.5       ?       ? 
1 1 1   57   10   18 o    120.1    5.8    0.0000   0.0000          ?        ?   144.9444  14.0475          ?        ?      120.1        5.8       ?       ? 
1 1 1   57   10   19 o     63.6   12.5    0.0000   0.0000          ?        ?    42.7809  15.3245          ?        ?       63.6       12.5       ?       ? 
1 1 1   57   10   20 o    114.8    7.2    0.0000   0.0000          ?        ?   132.8125  16.6016          ?        ?      114.8        7.2       ?       ? 
1 1 1   57   10   21 o    336.1    2.8    0.0000   0.0000          ?        ?  1131.4603  19.1556          ?        ?      336.1        2.8       ?       ? 
1 1 1   57   10   22 o    164.2    5.1    0.0000   0.0000          ?        ?   270.7332  16.6016          ?        ?      164.2        5.1       ?       ? 
1 1 1   57   10   23 o    251.3    3.6    0.0000   0.0000          ?        ?   632.7749  17.8786          ?        ?      251.3        3.6       ?       ? 
1 1 1   57   10   24 o    195.7    4.7    0.0000   0.0000          ?        ?   384.3900  18.5171          ?        ?      195.7        4.7       ?       ? 
1 1 1   57   10   25 o     59.9   12.6    0.0000   0.0000          ?        ?    38.3113  14.6860          ?        ?       59.9       12.6       ?       ? 
1 1 1   57   10   26 o    134.2    5.9    0.0000   0.0000          ?        ?   181.3401  15.9630          ?        ?      134.2        5.9       ?       ? 
1 1 1   57   10   27 o    159.4    4.8    0.0000   0.0000          ?        ?   255.4086  15.3245          ?        ?      159.4        4.8       ?       ? 
1 1 1   57   10   28 o    141.4    5.4    0.0000   0.0000          ?        ?   201.1343  15.3245          ?        ?      141.4        5.4       ?       ? 
1 1 1   57   11    0 o    146.2    6.8  215.8203  19.7942   215.8203  19.7942   215.8203  19.7942      146.2      6.8      146.2        6.8     0.0     0.0 
1 1 1   57   11    1 o    213.4    4.2    0.0000   0.0000          ?        ?   456.5430  17.8786          ?        ?      213.4        4.2       ?       ? 
1 1 1   57   11    2 o     37.4   13.1    0.0000   0.0000          ?        ?    12.7704  12.1319          ?        ?       37.4       13.1       ?       ? 
1 1 1   57   11    3 o     47.9   12.5    0.0000   0.0000          ?        ?    24.2638  12.1319          ?        ?       47.9       12.5       ?       ? 
1 1 1   57   11    4 o    102.7    6.2    0.0000   0.0000          ?        ?   105.9946  12.7704          ?        ?      102.7        6.2       ?       ? 
1 1 1   57   11    5 o    337.2    2.9    0.0000   0.0000          ?        ?  1138.4841  19.7942          ?        ?      337.2        2.9       ?       ? 
1 1 1   57   11    6 o    198.5    3.7    0.0000   0.0000          ?        ?   394.6064  14.6860          ?        ?      198.5        3.7       ?       ? 
1 1 1   57   11    7 o    283.7    3.6    0.0000   0.0000          ?        ?   806.4528  20.4327          ?        ?      283.7        3.6       ?       ? 
1 1 1   57   11    8 f    171.9    4.5    0.0000   0.0000          ?        ?   296.2740  15.3245          ?        ?      171.9        4.5       ?       ? 
1 1 1   57   11    9 o     22.6   10.8    0.0000   0.0000          ?        ?   -19.7942  14.0475          ?        ?       22.6       10.8       ?       ? 
1 1 1   57   11   10 o    152.4    4.6    0.0000   0.0000          ?        ?   233.0604  14.0475          ?        ?      152.4        4.6       ?       ? 
1 1 1   57   11   11 o     41.8   13.8    0.0000   0.0000          ?        ?    17.2401  13.4090          ?        ?       41.8       13.8       ?       ? 
1 1 1   57   11   12 o     47.5   13.9    0.0000   0.0000          ?        ?    23.6253  14.0475          ?        ?       47.5       13.9       ?       ? 
1 1 1   57   11   13 o    121.6    6.3    0.0000   0.0000          ?        ?   148.7755  15.3245          ?        ?      121.6        6.3       ?       ? 
1 1 1   57   11   14 o    110.6    7.2    0.0000   0.0000          ?        ?   123.2347  15.9630          ?        ?      110.6        7.2       ?       ? 
1 1 1   57   11   15 o    128.0    5.7    0.0000   0.0000          ?        ?   164.7386  14.6860          ?        ?      128.0        5.7       ?       ? 
1 1 1   57   11   16 o    135.9    5.9    0.0000   0.0000          ?        ?   185.8098  15.9630          ?        ?      135.9        5.9       ?       ? 
1 1 1   57   11   17 o     21.9   10.6    0.0000   0.0000          ?        ?   -24.9023  14.6860          ?        ?       21.9       10.6       ?       ? 
1 1 1   57   11   18 o    164.8    5.0    0.0000   0.0000          ?        ?   272.6487  16.6016          ?        ?      164.8        5.0       ?       ? 
1 1 1   57   11   19 o     85.9    8.9    0.0000   0.0000          ?        ?    74.7070  15.3245          ?        ?       85.9        8.9       ?       ? 
1 1 1   57   11   20 o    292.7    3.6    0.0000   0.0000          ?        ?   858.8116  21.0712          ?        ?      292.7        3.6       ?       ? 
1 1 1   57   11   21 o     32.3   13.7    0.0000   0.0000          ?        ?     1.2770  15.3245          ?        ?       32.3       13.7       ?       ? 
1 1 1   57   11   22 o    113.4    6.5    0.0000   0.0000          ?        ?   129.6199  14.6860          ?        ?      113.4        6.5       ?       ? 
1 1 1   57   11   23 o    323.6    2.9    0.0000   0.0000          ?        ?  1049.0911  18.5171          ?        ?      323.6        2.9       ?       ? 
1 1 1   57   11   24 o    199.4    4.2    0.0000   0.0000          ?        ?   399.0760  16.6016          ?        ?      199.4        4.2       ?       ? 
1 1 1   57   11   25 o    294.0    3.4    0.0000   0.0000          ?        ?   866.4738  19.7942          ?        ?      294.0        3.4       ?       ? 
1 1 1   57   12    0 o     65.6   15.1   49.8047  17.2401    49.8047  17.2401    49.8047  17.2401       65.6     15.1       65.6       15.1     0.0     0.0 
1 1 1   57   12    1 o    214.1    3.7    0.0000   0.0000          ?        ?   459.0970  15.9630          ?        ?      214.1        3.7       ?       ? 
1 1 1   57   12    2 o     82.7    7.3    0.0000   0.0000          ?        ?    68.9603  12.1319          ?        ?       82.7        7.3       ?       ? 
1 1 1   57   12    3 o    138.2    4.6    0.0000   0.0000          ?        ?   191.5565  12.7704          ?        ?      138.2        4.6       ?       ? 
1 1 1   57   12    4 o    164.2    3.9    0.0000   0.0000          ?        ?   270.0946  12.7704          ?        ?      164.2        3.9       ?       ? 
1 1 1   57   12    5 o     85.8    6.3    0.0000   0.0000          ?        ?    74.0685  10.8549          ?        ?       85.8        6.3       ?       ? 
1 1 1   57   12    6 o    193.4    3.6    0.0000   0.0000          ?        ?   374.8122  14.0475          ?        ?      193.4        3.6       ?       ? 
1 1 1   57   12    7 o    307.4    3.1    0.0000   0.0000          ?        ?   946.2890  19.1556          ?        ?      307.4        3.1       ?       ? 
1 1 1   57   12    8 o    248.6    3.5    0.0000   0.0000          ?        ?   619.3660  17.2401          ?        ?      248.6        3.5       ?       ? 
1 1 1   57   12    9 o    370.5    3.4    0.0000   0.0000          ?        ?  1375.3755  24.9023          ?        ?      370.5        3.4       ?       ? 
1 1 1   57   12   10 o    215.1    3.7    0.0000   0.0000          ?        ?   463.5667  15.9630          ?        ?      215.1        3.7       ?       ? 
1 1 1   57   12   11 o    155.1    4.7    0.0000   0.0000          ?        ?   241.3612  14.6860          ?        ?      155.1        4.7       ?       ? 
1 1 1   57   12   12 o    124.5    5.6    0.0000   0.0000          ?        ?   155.7993  14.0475          ?        ?      124.5        5.6       ?       ? 
1 1 1   57   12   13 f     85.6    8.2    0.0000   0.0000          ?        ?    74.0685  14.0475          ?        ?       85.6        8.2       ?       ? 
1 1 1   57   12   14 o     75.6   10.1    0.0000   0.0000          ?        ?    58.1055  15.3245          ?        ?       75.6       10.1       ?       ? 
1 1 1   57   12   15 f    221.3    3.8    0.0000   0.0000          ?        ?   491.0231  16.6016          ?        ?      221.3        3.8       ?       ? 
1 1 1   57   12   16 o    193.8    4.3    0.0000   0.0000          ?        ?   376.7278  16.6016          ?        ?      193.8        4.3       ?       ? 
1 1 1   57   12   17 o     79.8   11.2    0.0000   0.0000          ?        ?    65.1292  17.8786          ?        ?       79.8       11.2       ?       ? 
1 1 1   57   12   18 o    149.7    5.5    0.0000   0.0000          ?        ?   225.3981  16.6016          ?        ?      149.7        5.5       ?       ? 
1 1 1   57   12   19 o     39.3   14.6    0.0000   0.0000          ?        ?    12.7704  15.3245          ?        ?       39.3       14.6       ?       ? 
1 1 1   57   12   20 o     27.4   12.4    0.0000   0.0000          ?        ?    -7.6623  14.6860          ?        ?       27.4       12.4       ?       ? 
1 1 1   57   12   21 o    127.0    6.8    0.0000   0.0000          ?        ?   162.8230  17.2401          ?        ?      127.0        6.8       ?       ? 
1 1 1   57   12   22 o    261.7    3.3    0.0000   0.0000          ?        ?   686.4108  17.2401          ?        ?      261.7        3.3       ?       ? 
1 1 1   57   12   23 o     95.7    7.0    0.0000   0.0000          ?        ?    92.5856  13.4090          ?        ?       95.7        7.0       ?       ? 
1 1 1   57   13    0 o    268.9    5.0  725.3605  26.8179   725.3605  26.8179   725.3605  26.8179      268.9      5.0      268.9        5.0     0.0     0.0 
1 1 1   57   13    1 o     28.6   13.0    0.0000   0.0000          ?        ?    -8.3008  15.9630          ?        ?       28.6       13.0       ?       ? 
1 1 1   57   13    2 o     29.7   12.9    0.0000   0.0000          ?        ?    -1.2770  14.0475          ?        ?       29.7       12.9       ?       ? 
1 1 1   57   13    3 o     73.4   11.3    0.0000   0.0000          ?        ?    54.9129  16.6016          ?        ?       73.4       11.3       ?       ? 
1 1 1   57   13    4 o    198.4    4.3    0.0000   0.0000          ?        ?   394.6064  17.2401          ?        ?      198.4        4.3       ?       ? 
1 1 1   57   13    5 o     54.7   13.5    0.0000   0.0000          ?        ?    31.9261  14.6860          ?        ?       54.7       13.5       ?       ? 
1 1 1   57   13    6 o    211.1    4.1    0.0000   0.0000          ?        ?   446.9651  17.2401          ?        ?      211.1        4.1       ?       ? 
1 1 1   57   13    7 o    138.1    5.1    0.0000   0.0000          ?        ?   191.5565  14.0475          ?        ?      138.1        5.1       ?       ? 
1 1 1   57   13    8 o    171.1    4.3    0.0000   0.0000          ?        ?   293.7199  14.6860          ?        ?      171.1        4.3       ?       ? 
1 1 1   57   13    9 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   57   13   10 o     77.0    8.3    0.0000   0.0000          ?        ?    60.0210  12.7704          ?        ?       77.0        8.3       ?       ? 
1 1 1   57   13   11 f     49.0   12.9    0.0000   0.0000          ?        ?    25.5409  12.7704          ?        ?       49.0       12.9       ?       ? 
1 1 1   57   13   12 o    160.1    4.6    0.0000   0.0000          ?        ?   257.3242  14.6860          ?        ?      160.1        4.6       ?       ? 
1 1 1   57   13   13 o    149.9    4.5    0.0000   0.0000          ?        ?   225.3981  13.4090          ?        ?      149.9        4.5       ?       ? 
1 1 1   57   13   14 o    123.8    5.2    0.0000   0.0000          ?        ?   153.8837  12.7704          ?        ?      123.8        5.2       ?       ? 
1 1 1   57   13   15 o     73.9    9.5    0.0000   0.0000          ?        ?    55.5514  14.0475          ?        ?       73.9        9.5       ?       ? 
1 1 1   57   13   16 o     36.2   14.1    0.0000   0.0000          ?        ?     8.9393  14.6860          ?        ?       36.2       14.1       ?       ? 
1 1 1   57   13   17 o     64.4   12.3    0.0000   0.0000          ?        ?    44.0580  15.3245          ?        ?       64.4       12.3       ?       ? 
1 1 1   57   13   18 o     78.3   10.2    0.0000   0.0000          ?        ?    62.5751  15.9630          ?        ?       78.3       10.2       ?       ? 
1 1 1   57   13   19 o    140.0    5.7    0.0000   0.0000          ?        ?   197.3032  15.9630          ?        ?      140.0        5.7       ?       ? 
1 1 1   57   13   20 o    262.1    3.3    0.0000   0.0000          ?        ?   688.3264  17.2401          ?        ?      262.1        3.3       ?       ? 
1 1 1   57   14    0 o    388.3    7.7 1517.1274  59.3825  1517.1274  59.3825  1517.1274  59.3825      388.3      7.7      388.3        7.7     0.0     0.0 
1 1 1   57   14    1 o    158.2    7.9    0.0000   0.0000          ?        ?   252.8546  24.9023          ?        ?      158.2        7.9       ?       ? 
1 1 1   57   14    2 o    290.2    5.6    0.0000   0.0000          ?        ?   846.6797  32.5646          ?        ?      290.2        5.6       ?       ? 
1 1 1   57   14    3 o    261.1    5.0    0.0000   0.0000          ?        ?   684.4952  26.1794          ?        ?      261.1        5.0       ?       ? 
1 1 1   57   14    4 o    158.7    4.6    0.0000   0.0000          ?        ?   252.8546  14.6860          ?        ?      158.7        4.6       ?       ? 
1 1 1   57   14    5 o    376.4    4.1    0.0000   0.0000          ?        ?  1420.7106  30.6490          ?        ?      376.4        4.1       ?       ? 
1 1 1   57   14    6 o    220.7    3.9    0.0000   0.0000          ?        ?   488.4691  17.2401          ?        ?      220.7        3.9       ?       ? 
1 1 1   57   14    7 o    208.9    4.4    0.0000   0.0000          ?        ?   438.0258  18.5171          ?        ?      208.9        4.4       ?       ? 
1 1 1   57   14    8 o    159.2    5.4    0.0000   0.0000          ?        ?   254.7701  17.2401          ?        ?      159.2        5.4       ?       ? 
1 1 1   57   14    9 o    135.8    6.3    0.0000   0.0000          ?        ?   185.8098  17.2401          ?        ?      135.8        6.3       ?       ? 
1 1 1   57   14   10 o     81.5    7.4    0.0000   0.0000          ?        ?    67.0448  12.1319          ?        ?       81.5        7.4       ?       ? 
1 1 1   57   14   11 o    118.7    5.6    0.0000   0.0000          ?        ?   141.7518  13.4090          ?        ?      118.7        5.6       ?       ? 
1 1 1   57   14   12 o    157.7    4.7    0.0000   0.0000          ?        ?   249.6619  14.6860          ?        ?      157.7        4.7       ?       ? 
1 1 1   57   14   13 o     69.8   10.5    0.0000   0.0000          ?        ?    49.8047  14.6860          ?        ?       69.8       10.5       ?       ? 
1 1 1   57   14   14 o    142.0    4.7    0.0000   0.0000          ?        ?   202.4114  13.4090          ?        ?      142.0        4.7       ?       ? 
1 1 1   57   14   15 o    109.5    5.8    0.0000   0.0000          ?        ?   120.6806  12.7704          ?        ?      109.5        5.8       ?       ? 
1 1 1   57   14   16 o     68.6    9.3    0.0000   0.0000          ?        ?    47.8891  12.7704          ?        ?       68.6        9.3       ?       ? 
1 1 1   57   15    0 o     50.3   24.9   39.5883  30.0105    39.5883  30.0105    39.5883  30.0105       50.3     24.9       50.3       24.9     0.0     0.0 
1 1 1   57   15    1 f     93.1   11.3    0.0000   0.0000          ?        ?    88.7545  21.0712          ?        ?       93.1       11.3       ?       ? 
1 1 1   57   15    2 o    123.4   10.1    0.0000   0.0000          ?        ?   155.1608  24.9023          ?        ?      123.4       10.1       ?       ? 
1 1 1   57   15    3 o    295.0    5.2    0.0000   0.0000          ?        ?   874.7747  30.6490          ?        ?      295.0        5.2       ?       ? 
1 1 1   57   15    4 o    102.5   10.6    0.0000   0.0000          ?        ?   107.2716  21.7097          ?        ?      102.5       10.6       ?       ? 
1 1 1   57   15    5 o    125.9    8.6    0.0000   0.0000          ?        ?   160.9075  21.7097          ?        ?      125.9        8.6       ?       ? 
1 1 1   57   15    6 o     41.9   16.7    0.0000   0.0000          ?        ?    10.8549  21.0712          ?        ?       41.9       16.7       ?       ? 
1 1 1   57   15    7 o     19.8    9.8    0.0000   0.0000          ?        ?   -30.6490  14.0475          ?        ?       19.8        9.8       ?       ? 
1 1 1   57   15    8 o     93.0    7.2    0.0000   0.0000          ?        ?    87.4775  13.4090          ?        ?       93.0        7.2       ?       ? 
1 1 1   57   15    9 o    116.9    6.6    0.0000   0.0000          ?        ?   137.9207  15.3245          ?        ?      116.9        6.6       ?       ? 
1 1 1   57   15   10 o     43.6   14.4    0.0000   0.0000          ?        ?    19.1556  14.6860          ?        ?       43.6       14.4       ?       ? 
1 1 1   57   15   11 o     43.6   14.4    0.0000   0.0000          ?        ?    19.1556  14.6860          ?        ?       43.6       14.4       ?       ? 
1 1 1   57   15   12 o    100.8    7.6    0.0000   0.0000          ?        ?   102.8020  15.3245          ?        ?      100.8        7.6       ?       ? 
1 1 1   57   16    0 o     55.2   28.7   49.1662  40.8654    49.1662  40.8654    49.1662  40.8654       55.2     28.7       55.2       28.7     0.0     0.0 
1 1 1   57   16    1 o    271.1    4.4    0.0000   0.0000          ?        ?   738.1310  23.6253          ?        ?      271.1        4.4       ?       ? 
1 1 1   57   16    2 o    250.3    5.4    0.0000   0.0000          ?        ?   630.2208  26.8179          ?        ?      250.3        5.4       ?       ? 
1 1 1   57   16    3 o    161.5    7.9    0.0000   0.0000          ?        ?   264.3480  25.5409          ?        ?      161.5        7.9       ?       ? 
1 1 1   57   16    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   58    0    0 o    761.5    8.0 5807.3540 121.9576  5807.3540 121.9576  5807.3540 121.9576      761.5      8.0      761.5        8.0     0.0     0.0 
1 1 1   58    0    1 o    130.5    8.6  173.0394  22.3483   173.0394  22.3483   173.0394  22.3483      130.5      8.6      130.5        8.6     0.0     0.0 
1 1 1   58    0    2 o     23.9   15.9   -3.1926  19.1556    -3.1926  19.1556    -3.1926  19.1556       23.9     15.9       23.9       15.9     0.0     0.0 
1 1 1   58    0    3 o     21.2   14.5   -9.5778  18.5171    -9.5778  18.5171    -9.5778  18.5171       21.2     14.5       21.2       14.5     0.0     0.0 
1 1 1   58    0    4 o    311.0    5.3  969.2759  33.2031   969.2759  33.2031   969.2759  33.2031      311.0      5.3      311.0        5.3     0.0     0.0 
1 1 1   58    0    5 o     15.1   11.1  -35.1187  17.8786   -35.1187  17.8786   -35.1187  17.8786       15.1     11.1       15.1       11.1     0.0     0.0 
1 1 1   58    0    6 o     14.8   10.9  -40.2269  18.5171   -40.2269  18.5171   -40.2269  18.5171       14.8     10.9       14.8       10.9     0.0     0.0 
1 1 1   58    0    7 o    236.5    4.7  560.6220  22.3483   560.6220  22.3483   560.6220  22.3483      236.5      4.7      236.5        4.7     0.0     0.0 
1 1 1   58    0    8 o    244.5    4.7  598.9333  22.9868   598.9333  22.9868   598.9333  22.9868      244.5      4.7      244.5        4.7     0.0     0.0 
1 1 1   58    0    9 o    149.2    7.3  224.7596  21.7097   224.7596  21.7097   224.7596  21.7097      149.2      7.3      149.2        7.3     0.0     0.0 
1 1 1   58    0   10 o    649.7    5.3 4226.3750  68.3218  4226.3750  68.3218  4226.3750  68.3218      649.7      5.3      649.7        5.3     0.0     0.0 
1 1 1   58    0   11 o    139.1    8.3  196.0261  22.9868   196.0261  22.9868   196.0261  22.9868      139.1      8.3      139.1        8.3     0.0     0.0 
1 1 1   58    0   12 o    412.5    4.3 1703.5756  35.7572  1703.5756  35.7572  1703.5756  35.7572      412.5      4.3      412.5        4.3     0.0     0.0 
1 1 1   58    0   13 o     79.7   14.6   69.5989  21.0712    69.5989  21.0712    69.5989  21.0712       79.7     14.6       79.7       14.6     0.0     0.0 
1 1 1   58    0   14 o     14.7   10.9  -55.5514  21.0712   -55.5514  21.0712   -55.5514  21.0712       14.7     10.9       14.7       10.9     0.0     0.0 
1 1 1   58    0   15 o     23.1   16.0  -15.3245  23.6253   -15.3245  23.6253   -15.3245  23.6253       23.1     16.0       23.1       16.0     0.0     0.0 
1 1 1   58    0   16 o     24.2   16.3   -7.0237  21.7097    -7.0237  21.7097    -7.0237  21.7097       24.2     16.3       24.2       16.3     0.0     0.0 
1 1 1   58    0   17 o     22.9   15.5   -7.0237  19.7942    -7.0237  19.7942    -7.0237  19.7942       22.9     15.5       22.9       15.5     0.0     0.0 
1 1 1   58    0   18 o    183.2    5.9  337.1394  21.7097   337.1394  21.7097   337.1394  21.7097      183.2      5.9      183.2        5.9     0.0     0.0 
1 1 1   58    0   19 o    147.7    7.6  220.2900  22.3483   220.2900  22.3483   220.2900  22.3483      147.7      7.6      147.7        7.6     0.0     0.0 
1 1 1   58    0   20 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   58    0   21 o     41.7   20.9   26.1794  21.0712    26.1794  21.0712    26.1794  21.0712       41.7     20.9       41.7       20.9     0.0     0.0 
1 1 1   58    0   22 o     23.3   16.1  -15.9630  24.2638   -15.9630  24.2638   -15.9630  24.2638       23.3     16.1       23.3       16.1     0.0     0.0 
1 1 1   58    0   23 o     85.6   15.1   79.8152  23.6253    79.8152  23.6253    79.8152  23.6253       85.6     15.1       85.6       15.1     0.0     0.0 
1 1 1   58    0   24 o     31.2   18.5   11.4934  19.7942    11.4934  19.7942    11.4934  19.7942       31.2     18.5       31.2       18.5     0.0     0.0 
1 1 1   58    0   25 o    392.5    3.6 1542.0298  28.0950  1542.0298  28.0950  1542.0298  28.0950      392.5      3.6      392.5        3.6     0.0     0.0 
1 1 1   58    0   26 o     74.4   16.2   63.2136  21.0712    63.2136  21.0712    63.2136  21.0712       74.4     16.2       74.4       16.2     0.0     0.0 
1 1 1   58    0   27 o    250.4    4.8  628.3053  24.2638   628.3053  24.2638   628.3053  24.2638      250.4      4.8      250.4        4.8     0.0     0.0 
1 1 1   58    0   28 o    302.8    4.4  918.1941  26.8179   918.1941  26.8179   918.1941  26.8179      302.8      4.4      302.8        4.4     0.0     0.0 
1 1 1   58    0   29 f    244.1    5.1  597.6562  24.9023   597.6562  24.9023   597.6562  24.9023      244.1      5.1      244.1        5.1     0.0     0.0 
1 1 1   58    0   30 o     21.7   15.1  -17.2401  22.3483   -17.2401  22.3483   -17.2401  22.3483       21.7     15.1       21.7       15.1     0.0     0.0 
1 1 1   58    0   31 o     56.5   20.8   43.4195  21.7097    43.4195  21.7097    43.4195  21.7097       56.5     20.8       56.5       20.8     0.0     0.0 
1 1 1   58    0   32 o    139.3    7.8  196.6647  21.7097   196.6647  21.7097   196.6647  21.7097      139.3      7.8      139.3        7.8     0.0     0.0 
1 1 1   58    0   33 o     44.4   21.9   30.0105  22.9868    30.0105  22.9868    30.0105  22.9868       44.4     21.9       44.4       21.9     0.0     0.0 
1 1 1   58    0   34 o     18.4   13.3  -30.6490  21.7097   -30.6490  21.7097   -30.6490  21.7097       18.4     13.3       18.4       13.3     0.0     0.0 
1 1 1   58    0   35 o     68.0   19.0   56.8284  22.3483    56.8284  22.3483    56.8284  22.3483       68.0     19.0       68.0       19.0     0.0     0.0 
1 1 1   58    0   36 o     17.5   12.7  -42.1424  22.9868   -42.1424  22.9868   -42.1424  22.9868       17.5     12.7       17.5       12.7     0.0     0.0 
1 1 1   58    0   37 o    183.5    6.5  339.0550  23.6253   339.0550  23.6253   339.0550  23.6253      183.5      6.5      183.5        6.5     0.0     0.0 
1 1 1   58    0   38 o    132.0    8.5  177.5090  22.3483   177.5090  22.3483   177.5090  22.3483      132.0      8.5      132.0        8.5     0.0     0.0 
1 1 1   58    0   39 o    224.1    5.6  504.4321  24.9023   504.4321  24.9023   504.4321  24.9023      224.1      5.6      224.1        5.6     0.0     0.0 
1 1 1   58    0   40 o    197.5    6.0  392.6908  23.6253   392.6908  23.6253   392.6908  23.6253      197.5      6.0      197.5        6.0     0.0     0.0 
1 1 1   58    1    0 o    132.5    8.3  178.1475  21.7097   178.1475  21.7097   178.1475  21.7097      132.5      8.3      132.5        8.3     0.0     0.0 
1 1 1   58    1    1 o    444.2    3.2    0.0000   0.0000          ?        ?  1974.9473  28.0950          ?        ?      444.2        3.2       ?       ? 
1 1 1   58    1    2 o    364.2    2.9    0.0000   0.0000          ?        ?  1327.4865  21.0712          ?        ?      364.2        2.9       ?       ? 
1 1 1   58    1    3 o    364.0    2.9    0.0000   0.0000          ?        ?  1325.5709  21.0712          ?        ?      364.0        2.9       ?       ? 
1 1 1   58    1    4 o    103.7    6.8    0.0000   0.0000          ?        ?   107.9102  14.0475          ?        ?      103.7        6.8       ?       ? 
1 1 1   58    1    5 f     90.9    7.7    0.0000   0.0000          ?        ?    83.0078  14.0475          ?        ?       90.9        7.7       ?       ? 
1 1 1   58    1    6 o     36.0   13.6    0.0000   0.0000          ?        ?     9.5778  13.4090          ?        ?       36.0       13.6       ?       ? 
1 1 1   58    1    7 o    197.6    4.0    0.0000   0.0000          ?        ?   390.7752  15.9630          ?        ?      197.6        4.0       ?       ? 
1 1 1   58    1    8 o    104.6    7.0    0.0000   0.0000          ?        ?   109.8257  14.6860          ?        ?      104.6        7.0       ?       ? 
1 1 1   58    1    9 o     70.3    9.1    0.0000   0.0000          ?        ?    49.8047  12.7704          ?        ?       70.3        9.1       ?       ? 
1 1 1   58    1   10 o    269.7    3.2    0.0000   0.0000          ?        ?   727.9147  17.2401          ?        ?      269.7        3.2       ?       ? 
1 1 1   58    1   11 o    366.8    3.0    0.0000   0.0000          ?        ?  1346.6421  22.3483          ?        ?      366.8        3.0       ?       ? 
1 1 1   58    1   12 o    221.0    3.9    0.0000   0.0000          ?        ?   489.1075  17.2401          ?        ?      221.0        3.9       ?       ? 
1 1 1   58    1   13 f    352.0    3.4    0.0000   0.0000          ?        ?  1240.0090  23.6253          ?        ?      352.0        3.4       ?       ? 
1 1 1   58    1   14 o    219.1    4.2    0.0000   0.0000          ?        ?   480.8068  18.5171          ?        ?      219.1        4.2       ?       ? 
1 1 1   58    1   15 o    468.8    3.5    0.0000   0.0000          ?        ?  2200.3455  32.5646          ?        ?      468.8        3.5       ?       ? 
1 1 1   58    1   16 o    133.0    6.2    0.0000   0.0000          ?        ?   177.5090  16.6016          ?        ?      133.0        6.2       ?       ? 
1 1 1   58    1   17 o    254.9    3.9    0.0000   0.0000          ?        ?   650.6536  19.7942          ?        ?      254.9        3.9       ?       ? 
1 1 1   58    1   18 o    141.2    5.7    0.0000   0.0000          ?        ?   199.8573  15.9630          ?        ?      141.2        5.7       ?       ? 
1 1 1   58    1   19 o     51.7   13.9    0.0000   0.0000          ?        ?    28.0950  14.6860          ?        ?       51.7       13.9       ?       ? 
1 1 1   58    1   20 f    138.9    5.7    0.0000   0.0000          ?        ?   193.4720  15.9630          ?        ?      138.9        5.7       ?       ? 
1 1 1   58    1   21 o    396.8    3.3    0.0000   0.0000          ?        ?  1575.8713  26.1794          ?        ?      396.8        3.3       ?       ? 
1 1 1   58    1   22 o    323.7    3.3    0.0000   0.0000          ?        ?  1049.0911  21.0712          ?        ?      323.7        3.3       ?       ? 
1 1 1   58    1   23 o    174.9    4.2    0.0000   0.0000          ?        ?   306.4904  14.6860          ?        ?      174.9        4.2       ?       ? 
1 1 1   58    1   24 o     75.4   10.2    0.0000   0.0000          ?        ?    57.4669  15.3245          ?        ?       75.4       10.2       ?       ? 
1 1 1   58    1   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   58    1   26 o    113.5    7.0    0.0000   0.0000          ?        ?   129.6199  15.9630          ?        ?      113.5        7.0       ?       ? 
1 1 1   58    1   27 o    162.9    4.9    0.0000   0.0000          ?        ?   266.2635  15.9630          ?        ?      162.9        4.9       ?       ? 
1 1 1   58    1   28 o     81.1    9.5    0.0000   0.0000          ?        ?    66.4062  15.3245          ?        ?       81.1        9.5       ?       ? 
1 1 1   58    1   29 o    220.5    3.8    0.0000   0.0000          ?        ?   487.1920  16.6016          ?        ?      220.5        3.8       ?       ? 
1 1 1   58    1   30 o    222.3    3.4    0.0000   0.0000          ?        ?   494.8542  15.3245          ?        ?      222.3        3.4       ?       ? 
1 1 1   58    1   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   58    1   32 o     38.2   14.5    0.0000   0.0000          ?        ?    10.8549  15.3245          ?        ?       38.2       14.5       ?       ? 
1 1 1   58    1   33 o     17.1    8.7    0.0000   0.0000          ?        ?   -55.5514  15.3245          ?        ?       17.1        8.7       ?       ? 
1 1 1   58    1   34 o     28.1   12.8    0.0000   0.0000          ?        ?    -9.5778  15.9630          ?        ?       28.1       12.8       ?       ? 
1 1 1   58    1   35 o    154.8    5.2    0.0000   0.0000          ?        ?   240.7227  15.9630          ?        ?      154.8        5.2       ?       ? 
1 1 1   58    1   36 o     35.6   14.6    0.0000   0.0000          ?        ?     5.1082  16.6016          ?        ?       35.6       14.6       ?       ? 
1 1 1   58    1   37 o    255.7    3.5    0.0000   0.0000          ?        ?   655.1232  17.8786          ?        ?      255.7        3.5       ?       ? 
1 1 1   58    1   38 o    249.6    3.5    0.0000   0.0000          ?        ?   624.4742  17.2401          ?        ?      249.6        3.5       ?       ? 
1 1 1   58    1   39 o     75.3   11.0    0.0000   0.0000          ?        ?    58.1055  16.6016          ?        ?       75.3       11.0       ?       ? 
1 1 1   58    2    0 o    350.2    4.0 1227.8771  28.0950  1227.8771  28.0950  1227.8771  28.0950      350.2      4.0      350.2        4.0     0.0     0.0 
1 1 1   58    2    1 o    241.2    3.3    0.0000   0.0000          ?        ?   582.3317  15.9630          ?        ?      241.2        3.3       ?       ? 
1 1 1   58    2    2 o    311.6    3.4    0.0000   0.0000          ?        ?   971.8299  21.0712          ?        ?      311.6        3.4       ?       ? 
1 1 1   58    2    3 f    160.3    4.6    0.0000   0.0000          ?        ?   257.3242  14.6860          ?        ?      160.3        4.6       ?       ? 
1 1 1   58    2    4 o    194.5    3.9    0.0000   0.0000          ?        ?   378.6433  15.3245          ?        ?      194.5        3.9       ?       ? 
1 1 1   58    2    5 o    165.0    5.0    0.0000   0.0000          ?        ?   272.6487  16.6016          ?        ?      165.0        5.0       ?       ? 
1 1 1   58    2    6 o    285.2    3.5    0.0000   0.0000          ?        ?   814.1151  19.7942          ?        ?      285.2        3.5       ?       ? 
1 1 1   58    2    7 o    486.7    3.5    0.0000   0.0000          ?        ?  2371.4692  33.8416          ?        ?      486.7        3.5       ?       ? 
1 1 1   58    2    8 o    177.8    4.1    0.0000   0.0000          ?        ?   316.7067  14.6860          ?        ?      177.8        4.1       ?       ? 
1 1 1   58    2    9 o     21.2   10.3    0.0000   0.0000          ?        ?   -24.9023  14.0475          ?        ?       21.2       10.3       ?       ? 
1 1 1   58    2   10 o     88.7    8.3    0.0000   0.0000          ?        ?    79.1767  14.6860          ?        ?       88.7        8.3       ?       ? 
1 1 1   58    2   11 o    269.0    3.2    0.0000   0.0000          ?        ?   724.0836  17.2401          ?        ?      269.0        3.2       ?       ? 
1 1 1   58    2   12 o     82.0    9.0    0.0000   0.0000          ?        ?    67.6833  14.6860          ?        ?       82.0        9.0       ?       ? 
1 1 1   58    2   13 o    174.4    4.2    0.0000   0.0000          ?        ?   304.5748  14.6860          ?        ?      174.4        4.2       ?       ? 
1 1 1   58    2   14 o    265.5    3.5    0.0000   0.0000          ?        ?   705.5664  18.5171          ?        ?      265.5        3.5       ?       ? 
1 1 1   58    2   15 o     86.1    8.9    0.0000   0.0000          ?        ?    74.7070  15.3245          ?        ?       86.1        8.9       ?       ? 
1 1 1   58    2   16 o     79.6    9.6    0.0000   0.0000          ?        ?    63.8522  15.3245          ?        ?       79.6        9.6       ?       ? 
1 1 1   58    2   17 o     83.1    9.6    0.0000   0.0000          ?        ?    69.5989  15.9630          ?        ?       83.1        9.6       ?       ? 
1 1 1   58    2   18 o    395.9    3.4    0.0000   0.0000          ?        ?  1568.8477  26.8179          ?        ?      395.9        3.4       ?       ? 
1 1 1   58    2   19 o    230.3    3.7    0.0000   0.0000          ?        ?   531.2500  17.2401          ?        ?      230.3        3.7       ?       ? 
1 1 1   58    2   20 o    269.3    3.2    0.0000   0.0000          ?        ?   725.9991  17.2401          ?        ?      269.3        3.2       ?       ? 
1 1 1   58    2   21 o    184.0    4.3    0.0000   0.0000          ?        ?   339.0550  15.9630          ?        ?      184.0        4.3       ?       ? 
1 1 1   58    2   22 o    149.0    6.0    0.0000   0.0000          ?        ?   222.8441  17.8786          ?        ?      149.0        6.0       ?       ? 
1 1 1   58    2   23 o    270.2    3.4    0.0000   0.0000          ?        ?   731.1072  18.5171          ?        ?      270.2        3.4       ?       ? 
1 1 1   58    2   24 o    250.9    3.4    0.0000   0.0000          ?        ?   630.2208  17.2401          ?        ?      250.9        3.4       ?       ? 
1 1 1   58    2   25 o    199.9    4.2    0.0000   0.0000          ?        ?   400.3531  16.6016          ?        ?      199.9        4.2       ?       ? 
1 1 1   58    2   26 o     96.2    8.0    0.0000   0.0000          ?        ?    93.2242  15.3245          ?        ?       96.2        8.0       ?       ? 
1 1 1   58    2   27 o    160.6    4.8    0.0000   0.0000          ?        ?   258.6013  15.3245          ?        ?      160.6        4.8       ?       ? 
1 1 1   58    2   28 o     28.5   12.8    0.0000   0.0000          ?        ?    -7.0237  15.3245          ?        ?       28.5       12.8       ?       ? 
1 1 1   58    2   29 f     69.6   10.5    0.0000   0.0000          ?        ?    49.1662  14.6860          ?        ?       69.6       10.5       ?       ? 
1 1 1   58    2   30 o     48.3   14.6    0.0000   0.0000          ?        ?    24.2638  15.3245          ?        ?       48.3       14.6       ?       ? 
1 1 1   58    2   31 o     98.7    7.8    0.0000   0.0000          ?        ?    98.3323  15.3245          ?        ?       98.7        7.8       ?       ? 
1 1 1   58    2   32 o    127.2    6.3    0.0000   0.0000          ?        ?   162.8230  15.9630          ?        ?      127.2        6.3       ?       ? 
1 1 1   58    2   33 o    206.1    4.2    0.0000   0.0000          ?        ?   425.8939  17.2401          ?        ?      206.1        4.2       ?       ? 
1 1 1   58    2   34 o    150.6    5.3    0.0000   0.0000          ?        ?   227.9522  15.9630          ?        ?      150.6        5.3       ?       ? 
1 1 1   58    2   35 o    225.7    3.7    0.0000   0.0000          ?        ?   510.8173  16.6016          ?        ?      225.7        3.7       ?       ? 
1 1 1   58    2   36 o    179.1    4.5    0.0000   0.0000          ?        ?   321.8149  15.9630          ?        ?      179.1        4.5       ?       ? 
1 1 1   58    2   37 o     17.7    8.9    0.0000   0.0000          ?        ?   -56.1899  15.9630          ?        ?       17.7        8.9       ?       ? 
1 1 1   58    2   38 o    116.0    6.9    0.0000   0.0000          ?        ?   136.0051  15.9630          ?        ?      116.0        6.9       ?       ? 
1 1 1   58    3    0 o    257.3    5.2  663.4240  26.8179   663.4240  26.8179   663.4240  26.8179      257.3      5.2      257.3        5.2     0.0     0.0 
1 1 1   58    3    1 f    161.0    5.0    0.0000   0.0000          ?        ?   259.8783  15.9630          ?        ?      161.0        5.0       ?       ? 
1 1 1   58    3    2 o    334.2    3.3    0.0000   0.0000          ?        ?  1118.0514  22.3483          ?        ?      334.2        3.3       ?       ? 
1 1 1   58    3    3 o    229.1    3.5    0.0000   0.0000          ?        ?   525.5033  15.9630          ?        ?      229.1        3.5       ?       ? 
1 1 1   58    3    4 o     83.2    8.1    0.0000   0.0000          ?        ?    69.5989  13.4090          ?        ?       83.2        8.1       ?       ? 
1 1 1   58    3    5 o    278.8    3.2    0.0000   0.0000          ?        ?   777.7194  17.8786          ?        ?      278.8        3.2       ?       ? 
1 1 1   58    3    6 o    179.6    4.3    0.0000   0.0000          ?        ?   323.0919  15.3245          ?        ?      179.6        4.3       ?       ? 
1 1 1   58    3    7 o    195.1    4.3    0.0000   0.0000          ?        ?   381.1974  16.6016          ?        ?      195.1        4.3       ?       ? 
1 1 1   58    3    8 o     62.3   13.2    0.0000   0.0000          ?        ?    40.8654  15.9630          ?        ?       62.3       13.2       ?       ? 
1 1 1   58    3    9 o    146.9    5.4    0.0000   0.0000          ?        ?   216.4588  15.9630          ?        ?      146.9        5.4       ?       ? 
1 1 1   58    3   10 o    204.1    3.9    0.0000   0.0000          ?        ?   416.9547  15.9630          ?        ?      204.1        3.9       ?       ? 
1 1 1   58    3   11 o     27.6   12.5    0.0000   0.0000          ?        ?    -7.6623  14.6860          ?        ?       27.6       12.5       ?       ? 
1 1 1   58    3   12 o    103.7    6.8    0.0000   0.0000          ?        ?   107.9102  14.0475          ?        ?      103.7        6.8       ?       ? 
1 1 1   58    3   13 o    125.9    6.1    0.0000   0.0000          ?        ?   158.9919  15.3245          ?        ?      125.9        6.1       ?       ? 
1 1 1   58    3   14 f    184.8    4.7    0.0000   0.0000          ?        ?   342.2476  17.2401          ?        ?      184.8        4.7       ?       ? 
1 1 1   58    3   15 o    103.9    7.4    0.0000   0.0000          ?        ?   108.5487  15.3245          ?        ?      103.9        7.4       ?       ? 
1 1 1   58    3   16 o    228.7    3.6    0.0000   0.0000          ?        ?   523.5877  16.6016          ?        ?      228.7        3.6       ?       ? 
1 1 1   58    3   17 o    353.3    2.9    0.0000   0.0000          ?        ?  1249.5868  20.4327          ?        ?      353.3        2.9       ?       ? 
1 1 1   58    3   18 o    277.4    3.1    0.0000   0.0000          ?        ?   770.0571  17.2401          ?        ?      277.4        3.1       ?       ? 
1 1 1   58    3   19 o    125.3    6.6    0.0000   0.0000          ?        ?   157.7148  16.6016          ?        ?      125.3        6.6       ?       ? 
1 1 1   58    3   20 o    276.7    3.7    0.0000   0.0000          ?        ?   766.8644  20.4327          ?        ?      276.7        3.7       ?       ? 
1 1 1   58    3   21 o    136.7    6.1    0.0000   0.0000          ?        ?   187.7254  16.6016          ?        ?      136.7        6.1       ?       ? 
1 1 1   58    3   22 f    134.1    6.4    0.0000   0.0000          ?        ?   180.7016  17.2401          ?        ?      134.1        6.4       ?       ? 
1 1 1   58    3   23 o    402.3    2.9    0.0000   0.0000          ?        ?  1619.9293  22.9868          ?        ?      402.3        2.9       ?       ? 
1 1 1   58    3   24 o     21.8   10.8    0.0000   0.0000          ?        ?   -38.3113  17.2401          ?        ?       21.8       10.8       ?       ? 
1 1 1   58    3   25 o    195.9    4.1    0.0000   0.0000          ?        ?   384.3900  15.9630          ?        ?      195.9        4.1       ?       ? 
1 1 1   58    3   26 o    101.6    7.9    0.0000   0.0000          ?        ?   104.0790  15.9630          ?        ?      101.6        7.9       ?       ? 
1 1 1   58    3   27 o    112.9    6.8    0.0000   0.0000          ?        ?   128.3428  15.3245          ?        ?      112.9        6.8       ?       ? 
1 1 1   58    3   28 o     97.8    7.8    0.0000   0.0000          ?        ?    96.4168  15.3245          ?        ?       97.8        7.8       ?       ? 
1 1 1   58    3   29 o    126.0    6.1    0.0000   0.0000          ?        ?   159.6304  15.3245          ?        ?      126.0        6.1       ?       ? 
1 1 1   58    3   30 o     59.0   13.3    0.0000   0.0000          ?        ?    37.0343  15.3245          ?        ?       59.0       13.3       ?       ? 
1 1 1   58    3   31 o    112.3    7.1    0.0000   0.0000          ?        ?   127.0658  15.9630          ?        ?      112.3        7.1       ?       ? 
1 1 1   58    3   32 f     64.6   12.3    0.0000   0.0000          ?        ?    44.0580  15.3245          ?        ?       64.6       12.3       ?       ? 
1 1 1   58    3   33 o    261.6    3.3    0.0000   0.0000          ?        ?   685.7722  17.2401          ?        ?      261.6        3.3       ?       ? 
1 1 1   58    3   34 o    320.7    3.0    0.0000   0.0000          ?        ?  1029.9354  19.1556          ?        ?      320.7        3.0       ?       ? 
1 1 1   58    3   35 o     42.3   15.0    0.0000   0.0000          ?        ?    16.6016  15.9630          ?        ?       42.3       15.0       ?       ? 
1 1 1   58    3   36 o     23.2   11.2    0.0000   0.0000          ?        ?   -24.9023  15.9630          ?        ?       23.2       11.2       ?       ? 
1 1 1   58    4    0 o    103.4   10.1  110.4642  20.4327   110.4642  20.4327   110.4642  20.4327      103.4     10.1      103.4       10.1     0.0     0.0 
1 1 1   58    4    1 f     17.5    8.8    0.0000   0.0000          ?        ?   -43.4195  14.0475          ?        ?       17.5        8.8       ?       ? 
1 1 1   58    4    2 o     51.0   13.1    0.0000   0.0000          ?        ?    27.4564  13.4090          ?        ?       51.0       13.1       ?       ? 
1 1 1   58    4    3 o    229.0    3.6    0.0000   0.0000          ?        ?   524.8647  16.6016          ?        ?      229.0        3.6       ?       ? 
1 1 1   58    4    4 f    123.1    5.7    0.0000   0.0000          ?        ?   151.9681  14.0475          ?        ?      123.1        5.7       ?       ? 
1 1 1   58    4    5 o    214.1    3.9    0.0000   0.0000          ?        ?   459.0970  16.6016          ?        ?      214.1        3.9       ?       ? 
1 1 1   58    4    6 o     47.7   13.9    0.0000   0.0000          ?        ?    23.6253  14.0475          ?        ?       47.7       13.9       ?       ? 
1 1 1   58    4    7 o    167.6    4.6    0.0000   0.0000          ?        ?   281.5880  15.3245          ?        ?      167.6        4.6       ?       ? 
1 1 1   58    4    8 o    429.7    3.2    0.0000   0.0000          ?        ?  1847.8816  27.4564          ?        ?      429.7        3.2       ?       ? 
1 1 1   58    4    9 o    174.3    4.9    0.0000   0.0000          ?        ?   304.5748  17.2401          ?        ?      174.3        4.9       ?       ? 
1 1 1   58    4   10 o    204.0    4.2    0.0000   0.0000          ?        ?   416.9547  17.2401          ?        ?      204.0        4.2       ?       ? 
1 1 1   58    4   11 o    134.0    5.7    0.0000   0.0000          ?        ?   180.0631  15.3245          ?        ?      134.0        5.7       ?       ? 
1 1 1   58    4   12 o    269.4    3.4    0.0000   0.0000          ?        ?   726.6376  18.5171          ?        ?      269.4        3.4       ?       ? 
1 1 1   58    4   13 o    184.0    4.3    0.0000   0.0000          ?        ?   339.0550  15.9630          ?        ?      184.0        4.3       ?       ? 
1 1 1   58    4   14 o    161.1    4.4    0.0000   0.0000          ?        ?   259.8783  14.0475          ?        ?      161.1        4.4       ?       ? 
1 1 1   58    4   15 o     68.5   12.6    0.0000   0.0000          ?        ?    49.1662  16.6016          ?        ?       68.5       12.6       ?       ? 
1 1 1   58    4   16 o    227.1    3.8    0.0000   0.0000          ?        ?   516.5640  17.2401          ?        ?      227.1        3.8       ?       ? 
1 1 1   58    4   17 o    145.4    5.5    0.0000   0.0000          ?        ?   211.9892  15.9630          ?        ?      145.4        5.5       ?       ? 
1 1 1   58    4   18 o     45.1   15.1    0.0000   0.0000          ?        ?    19.7942  15.9630          ?        ?       45.1       15.1       ?       ? 
1 1 1   58    4   19 o    133.5    5.7    0.0000   0.0000          ?        ?   178.7861  15.3245          ?        ?      133.5        5.7       ?       ? 
1 1 1   58    4   20 o    244.0    3.8    0.0000   0.0000          ?        ?   596.3792  18.5171          ?        ?      244.0        3.8       ?       ? 
1 1 1   58    4   21 f    116.2    7.4    0.0000   0.0000          ?        ?   136.0051  17.2401          ?        ?      116.2        7.4       ?       ? 
1 1 1   58    4   22 o     17.5    8.8    0.0000   0.0000          ?        ?   -52.9973  15.3245          ?        ?       17.5        8.8       ?       ? 
1 1 1   58    4   23 o     99.4    7.7    0.0000   0.0000          ?        ?    99.6094  15.3245          ?        ?       99.4        7.7       ?       ? 
1 1 1   58    4   24 o    332.7    3.0    0.0000   0.0000          ?        ?  1107.8350  19.7942          ?        ?      332.7        3.0       ?       ? 
1 1 1   58    4   25 o    212.4    4.1    0.0000   0.0000          ?        ?   452.0733  17.2401          ?        ?      212.4        4.1       ?       ? 
1 1 1   58    4   26 o    223.7    3.7    0.0000   0.0000          ?        ?   501.2395  16.6016          ?        ?      223.7        3.7       ?       ? 
1 1 1   58    4   27 o    192.4    4.3    0.0000   0.0000          ?        ?   370.9810  16.6016          ?        ?      192.4        4.3       ?       ? 
1 1 1   58    4   28 o    202.4    4.3    0.0000   0.0000          ?        ?   410.5694  17.2401          ?        ?      202.4        4.3       ?       ? 
1 1 1   58    4   29 o    153.4    5.2    0.0000   0.0000          ?        ?   236.2530  15.9630          ?        ?      153.4        5.2       ?       ? 
1 1 1   58    4   30 o    118.1    6.8    0.0000   0.0000          ?        ?   140.4748  15.9630          ?        ?      118.1        6.8       ?       ? 
1 1 1   58    4   31 o     64.5   12.3    0.0000   0.0000          ?        ?    44.0580  15.3245          ?        ?       64.5       12.3       ?       ? 
1 1 1   58    4   32 o    264.2    3.3    0.0000   0.0000          ?        ?   699.1812  17.2401          ?        ?      264.2        3.3       ?       ? 
1 1 1   58    4   33 o    301.7    3.0    0.0000   0.0000          ?        ?   911.8089  17.8786          ?        ?      301.7        3.0       ?       ? 
1 1 1   58    4   34 o    245.1    3.5    0.0000   0.0000          ?        ?   602.1259  17.2401          ?        ?      245.1        3.5       ?       ? 
1 1 1   58    4   35 o    105.7    7.2    0.0000   0.0000          ?        ?   113.0183  15.3245          ?        ?      105.7        7.2       ?       ? 
1 1 1   58    5    0 o    282.9    4.3  801.3447  24.2638   801.3447  24.2638   801.3447  24.2638      282.9      4.3      282.9        4.3     0.0     0.0 
1 1 1   58    5    1 o    186.6    4.1    0.0000   0.0000          ?        ?   348.6328  15.3245          ?        ?      186.6        4.1       ?       ? 
1 1 1   58    5    2 o    230.2    3.7    0.0000   0.0000          ?        ?   530.6115  17.2401          ?        ?      230.2        3.7       ?       ? 
1 1 1   58    5    3 o     27.7   12.4    0.0000   0.0000          ?        ?    -5.7467  14.0475          ?        ?       27.7       12.4       ?       ? 
1 1 1   58    5    4 o     46.6   14.0    0.0000   0.0000          ?        ?    22.3483  14.0475          ?        ?       46.6       14.0       ?       ? 
1 1 1   58    5    5 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   58    5    6 o    214.5    4.0    0.0000   0.0000          ?        ?   461.0126  17.2401          ?        ?      214.5        4.0       ?       ? 
1 1 1   58    5    7 o    107.5    7.1    0.0000   0.0000          ?        ?   116.2109  15.3245          ?        ?      107.5        7.1       ?       ? 
1 1 1   58    5    8 o    206.6    4.3    0.0000   0.0000          ?        ?   427.8095  17.8786          ?        ?      206.6        4.3       ?       ? 
1 1 1   58    5    9 o     20.3   10.1    0.0000   0.0000          ?        ?   -35.7572  15.3245          ?        ?       20.3       10.1       ?       ? 
1 1 1   58    5   10 o    118.8    6.4    0.0000   0.0000          ?        ?   141.7518  15.3245          ?        ?      118.8        6.4       ?       ? 
1 1 1   58    5   11 o    157.6    4.7    0.0000   0.0000          ?        ?   249.0234  14.6860          ?        ?      157.6        4.7       ?       ? 
1 1 1   58    5   12 o     80.0    8.8    0.0000   0.0000          ?        ?    64.4907  14.0475          ?        ?       80.0        8.8       ?       ? 
1 1 1   58    5   13 o    334.7    3.3    0.0000   0.0000          ?        ?  1121.2440  22.3483          ?        ?      334.7        3.3       ?       ? 
1 1 1   58    5   14 o     62.2   13.2    0.0000   0.0000          ?        ?    40.8654  15.9630          ?        ?       62.2       13.2       ?       ? 
1 1 1   58    5   15 o     24.0   11.3    0.0000   0.0000          ?        ?   -15.3245  14.0475          ?        ?       24.0       11.3       ?       ? 
1 1 1   58    5   16 o    183.6    4.5    0.0000   0.0000          ?        ?   337.7780  16.6016          ?        ?      183.6        4.5       ?       ? 
1 1 1   58    5   17 o    167.8    4.8    0.0000   0.0000          ?        ?   282.2266  15.9630          ?        ?      167.8        4.8       ?       ? 
1 1 1   58    5   18 o    118.2    7.0    0.0000   0.0000          ?        ?   140.4748  16.6016          ?        ?      118.2        7.0       ?       ? 
1 1 1   58    5   19 o    138.1    6.0    0.0000   0.0000          ?        ?   191.5565  16.6016          ?        ?      138.1        6.0       ?       ? 
1 1 1   58    5   20 o     29.1   13.0    0.0000   0.0000          ?        ?    -5.7467  15.3245          ?        ?       29.1       13.0       ?       ? 
1 1 1   58    5   21 o    105.9    8.1    0.0000   0.0000          ?        ?   113.0183  17.2401          ?        ?      105.9        8.1       ?       ? 
1 1 1   58    5   22 o    325.2    3.2    0.0000   0.0000          ?        ?  1058.6688  21.0712          ?        ?      325.2        3.2       ?       ? 
1 1 1   58    5   23 o    324.4    3.1    0.0000   0.0000          ?        ?  1053.5607  20.4327          ?        ?      324.4        3.1       ?       ? 
1 1 1   58    5   24 o    281.6    3.3    0.0000   0.0000          ?        ?   794.3209  18.5171          ?        ?      281.6        3.3       ?       ? 
1 1 1   58    5   25 o     29.0   13.0    0.0000   0.0000          ?        ?    -5.7467  15.3245          ?        ?       29.0       13.0       ?       ? 
1 1 1   58    5   26 o    213.0    3.9    0.0000   0.0000          ?        ?   454.6274  16.6016          ?        ?      213.0        3.9       ?       ? 
1 1 1   58    5   27 o     69.9   11.4    0.0000   0.0000          ?        ?    49.8047  15.9630          ?        ?       69.9       11.4       ?       ? 
1 1 1   58    5   28 o     27.4   12.5    0.0000   0.0000          ?        ?    -9.5778  15.3245          ?        ?       27.4       12.5       ?       ? 
1 1 1   58    5   29 o    138.2    5.8    0.0000   0.0000          ?        ?   192.1950  15.9630          ?        ?      138.2        5.8       ?       ? 
1 1 1   58    5   30 o    113.4    7.0    0.0000   0.0000          ?        ?   129.6199  15.9630          ?        ?      113.4        7.0       ?       ? 
1 1 1   58    5   31 o    146.7    5.4    0.0000   0.0000          ?        ?   216.4588  15.9630          ?        ?      146.7        5.4       ?       ? 
1 1 1   58    5   32 o     38.4   14.7    0.0000   0.0000          ?        ?    10.8549  15.9630          ?        ?       38.4       14.7       ?       ? 
1 1 1   58    5   33 f     21.8   10.6    0.0000   0.0000          ?        ?   -24.9023  14.6860          ?        ?       21.8       10.6       ?       ? 
1 1 1   58    5   34 o     20.3   10.1    0.0000   0.0000          ?        ?   -35.1187  15.3245          ?        ?       20.3       10.1       ?       ? 
1 1 1   58    6    0 o    192.8    5.8  373.5352  22.3483   373.5352  22.3483   373.5352  22.3483      192.8      5.8      192.8        5.8     0.0     0.0 
1 1 1   58    6    1 o     47.0   13.5    0.0000   0.0000          ?        ?    22.9868  13.4090          ?        ?       47.0       13.5       ?       ? 
1 1 1   58    6    2 o    223.9    3.7    0.0000   0.0000          ?        ?   501.8780  16.6016          ?        ?      223.9        3.7       ?       ? 
1 1 1   58    6    3 o    151.6    5.1    0.0000   0.0000          ?        ?   230.5063  15.3245          ?        ?      151.6        5.1       ?       ? 
1 1 1   58    6    4 o    197.7    3.9    0.0000   0.0000          ?        ?   391.4138  15.3245          ?        ?      197.7        3.9       ?       ? 
1 1 1   58    6    5 o     61.5   11.8    0.0000   0.0000          ?        ?    39.5883  14.0475          ?        ?       61.5       11.8       ?       ? 
1 1 1   58    6    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   58    6    7 o     18.7    9.3    0.0000   0.0000          ?        ?   -36.3957  14.0475          ?        ?       18.7        9.3       ?       ? 
1 1 1   58    6    8 o    143.0    5.4    0.0000   0.0000          ?        ?   204.9654  15.3245          ?        ?      143.0        5.4       ?       ? 
1 1 1   58    6    9 o     24.7   11.6    0.0000   0.0000          ?        ?   -15.3245  14.6860          ?        ?       24.7       11.6       ?       ? 
1 1 1   58    6   10 o     72.9    9.6    0.0000   0.0000          ?        ?    53.6358  14.0475          ?        ?       72.9        9.6       ?       ? 
1 1 1   58    6   11 o     19.6    9.7    0.0000   0.0000          ?        ?   -35.7572  14.6860          ?        ?       19.6        9.7       ?       ? 
1 1 1   58    6   12 o     60.5   11.5    0.0000   0.0000          ?        ?    38.3113  13.4090          ?        ?       60.5       11.5       ?       ? 
1 1 1   58    6   13 o     21.8   10.6    0.0000   0.0000          ?        ?   -25.5409  14.6860          ?        ?       21.8       10.6       ?       ? 
1 1 1   58    6   14 o    123.0    6.2    0.0000   0.0000          ?        ?   151.9681  15.3245          ?        ?      123.0        6.2       ?       ? 
1 1 1   58    6   15 o     50.1   14.9    0.0000   0.0000          ?        ?    26.1794  15.9630          ?        ?       50.1       14.9       ?       ? 
1 1 1   58    6   16 o     87.9    8.7    0.0000   0.0000          ?        ?    77.8996  15.3245          ?        ?       87.9        8.7       ?       ? 
1 1 1   58    6   17 o    316.0    3.5    0.0000   0.0000          ?        ?   999.9249  22.3483          ?        ?      316.0        3.5       ?       ? 
1 1 1   58    6   18 o    241.3    4.0    0.0000   0.0000          ?        ?   583.6088  19.1556          ?        ?      241.3        4.0       ?       ? 
1 1 1   58    6   19 o     33.5   13.9    0.0000   0.0000          ?        ?     3.1926  15.3245          ?        ?       33.5       13.9       ?       ? 
1 1 1   58    6   20 o     57.9   14.8    0.0000   0.0000          ?        ?    35.7572  17.2401          ?        ?       57.9       14.8       ?       ? 
1 1 1   58    6   21 o    180.2    4.6    0.0000   0.0000          ?        ?   325.6460  16.6016          ?        ?      180.2        4.6       ?       ? 
1 1 1   58    6   22 o     33.5   13.9    0.0000   0.0000          ?        ?     3.1926  15.3245          ?        ?       33.5       13.9       ?       ? 
1 1 1   58    6   23 o     90.3    8.5    0.0000   0.0000          ?        ?    82.3693  15.3245          ?        ?       90.3        8.5       ?       ? 
1 1 1   58    6   24 o    209.2    4.1    0.0000   0.0000          ?        ?   438.6643  17.2401          ?        ?      209.2        4.1       ?       ? 
1 1 1   58    6   25 o     43.6   14.8    0.0000   0.0000          ?        ?    18.5171  15.3245          ?        ?       43.6       14.8       ?       ? 
1 1 1   58    6   26 o    256.2    3.2    0.0000   0.0000          ?        ?   657.6772  16.6016          ?        ?      256.2        3.2       ?       ? 
1 1 1   58    6   27 o    193.7    4.1    0.0000   0.0000          ?        ?   376.0892  15.9630          ?        ?      193.7        4.1       ?       ? 
1 1 1   58    6   28 o    184.7    4.5    0.0000   0.0000          ?        ?   342.2476  16.6016          ?        ?      184.7        4.5       ?       ? 
1 1 1   58    6   29 o     64.4   12.9    0.0000   0.0000          ?        ?    44.0580  15.9630          ?        ?       64.4       12.9       ?       ? 
1 1 1   58    6   30 o     38.1   15.0    0.0000   0.0000          ?        ?     9.5778  16.6016          ?        ?       38.1       15.0       ?       ? 
1 1 1   58    6   31 o    237.3    3.6    0.0000   0.0000          ?        ?   564.4531  17.2401          ?        ?      237.3        3.6       ?       ? 
1 1 1   58    6   32 o    309.3    2.9    0.0000   0.0000          ?        ?   958.4210  17.8786          ?        ?      309.3        2.9       ?       ? 
1 1 1   58    7    0 o     15.5   11.4  -38.3113  19.1556   -38.3113  19.1556   -38.3113  19.1556       15.5     11.4       15.5       11.4     0.0     0.0 
1 1 1   58    7    1 o     91.9    7.3    0.0000   0.0000          ?        ?    84.9234  13.4090          ?        ?       91.9        7.3       ?       ? 
1 1 1   58    7    2 o    146.5    4.8    0.0000   0.0000          ?        ?   215.1818  14.0475          ?        ?      146.5        4.8       ?       ? 
1 1 1   58    7    3 o     95.9    8.0    0.0000   0.0000          ?        ?    92.5856  15.3245          ?        ?       95.9        8.0       ?       ? 
1 1 1   58    7    4 o    260.8    3.8    0.0000   0.0000          ?        ?   681.3026  19.7942          ?        ?      260.8        3.8       ?       ? 
1 1 1   58    7    5 o    108.4    7.1    0.0000   0.0000          ?        ?   118.1265  15.3245          ?        ?      108.4        7.1       ?       ? 
1 1 1   58    7    6 o     53.2   14.1    0.0000   0.0000          ?        ?    30.0105  15.3245          ?        ?       53.2       14.1       ?       ? 
1 1 1   58    7    7 o    221.7    3.9    0.0000   0.0000          ?        ?   492.3002  17.2401          ?        ?      221.7        3.9       ?       ? 
1 1 1   58    7    8 o    184.0    4.2    0.0000   0.0000          ?        ?   339.0550  15.3245          ?        ?      184.0        4.2       ?       ? 
1 1 1   58    7    9 o     25.0   11.8    0.0000   0.0000          ?        ?   -16.6016  15.3245          ?        ?       25.0       11.8       ?       ? 
1 1 1   58    7   10 o     28.3   12.9    0.0000   0.0000          ?        ?    -9.5778  15.9630          ?        ?       28.3       12.9       ?       ? 
1 1 1   58    7   11 o    147.1    5.6    0.0000   0.0000          ?        ?   217.0974  16.6016          ?        ?      147.1        5.6       ?       ? 
1 1 1   58    7   12 o    137.7    5.8    0.0000   0.0000          ?        ?   190.2794  15.9630          ?        ?      137.7        5.8       ?       ? 
1 1 1   58    7   13 o     71.9   10.2    0.0000   0.0000          ?        ?    52.3588  14.6860          ?        ?       71.9       10.2       ?       ? 
1 1 1   58    7   14 o    112.1    7.1    0.0000   0.0000          ?        ?   126.4273  15.9630          ?        ?      112.1        7.1       ?       ? 
1 1 1   58    7   15 o    183.9    4.5    0.0000   0.0000          ?        ?   339.0550  16.6016          ?        ?      183.9        4.5       ?       ? 
1 1 1   58    7   16 f    259.1    3.5    0.0000   0.0000          ?        ?   672.3633  17.8786          ?        ?      259.1        3.5       ?       ? 
1 1 1   58    7   17 o    136.7    5.6    0.0000   0.0000          ?        ?   187.7254  15.3245          ?        ?      136.7        5.6       ?       ? 
1 1 1   58    7   18 f     87.0    9.2    0.0000   0.0000          ?        ?    76.6226  15.9630          ?        ?       87.0        9.2       ?       ? 
1 1 1   58    7   19 o    145.2    6.2    0.0000   0.0000          ?        ?   211.9892  17.8786          ?        ?      145.2        6.2       ?       ? 
1 1 1   58    7   20 o     58.5   13.4    0.0000   0.0000          ?        ?    36.3957  15.3245          ?        ?       58.5       13.4       ?       ? 
1 1 1   58    7   21 o    110.3    6.9    0.0000   0.0000          ?        ?   122.5962  15.3245          ?        ?      110.3        6.9       ?       ? 
1 1 1   58    7   22 o     64.0   12.9    0.0000   0.0000          ?        ?    43.4195  15.9630          ?        ?       64.0       12.9       ?       ? 
1 1 1   58    7   23 o     27.7   12.7    0.0000   0.0000          ?        ?   -10.8549  15.9630          ?        ?       27.7       12.7       ?       ? 
1 1 1   58    7   24 o    150.6    5.3    0.0000   0.0000          ?        ?   227.9522  15.9630          ?        ?      150.6        5.3       ?       ? 
1 1 1   58    7   25 o    259.6    3.3    0.0000   0.0000          ?        ?   674.9174  17.2401          ?        ?      259.6        3.3       ?       ? 
1 1 1   58    7   26 o    171.6    4.8    0.0000   0.0000          ?        ?   295.6355  16.6016          ?        ?      171.6        4.8       ?       ? 
1 1 1   58    7   27 o    361.0    2.8    0.0000   0.0000          ?        ?  1305.1382  20.4327          ?        ?      361.0        2.8       ?       ? 
1 1 1   58    7   28 o    173.8    4.6    0.0000   0.0000          ?        ?   303.2978  15.9630          ?        ?      173.8        4.6       ?       ? 
1 1 1   58    7   29 o    118.3    6.7    0.0000   0.0000          ?        ?   141.1133  15.9630          ?        ?      118.3        6.7       ?       ? 
1 1 1   58    7   30 f    111.9    6.6    0.0000   0.0000          ?        ?   126.4273  14.6860          ?        ?      111.9        6.6       ?       ? 
1 1 1   58    8    0 o    201.6    5.4  408.0153  21.7097   408.0153  21.7097   408.0153  21.7097      201.6      5.4      201.6        5.4     0.0     0.0 
1 1 1   58    8    1 o    110.8    6.3    0.0000   0.0000          ?        ?   123.2347  14.0475          ?        ?      110.8        6.3       ?       ? 
1 1 1   58    8    2 o    175.8    4.0    0.0000   0.0000          ?        ?   309.6830  14.0475          ?        ?      175.8        4.0       ?       ? 
1 1 1   58    8    3 o    215.0    3.9    0.0000   0.0000          ?        ?   462.9282  16.6016          ?        ?      215.0        3.9       ?       ? 
1 1 1   58    8    4 o    301.9    3.5    0.0000   0.0000          ?        ?   912.4474  21.0712          ?        ?      301.9        3.5       ?       ? 
1 1 1   58    8    5 o    148.7    4.7    0.0000   0.0000          ?        ?   221.5670  14.0475          ?        ?      148.7        4.7       ?       ? 
1 1 1   58    8    6 o     51.1   14.4    0.0000   0.0000          ?        ?    27.4564  15.3245          ?        ?       51.1       14.4       ?       ? 
1 1 1   58    8    7 f    301.9    3.8    0.0000   0.0000          ?        ?   913.0859  22.9868          ?        ?      301.9        3.8       ?       ? 
1 1 1   58    8    8 o    181.8    4.6    0.0000   0.0000          ?        ?   331.3927  16.6016          ?        ?      181.8        4.6       ?       ? 
1 1 1   58    8    9 o    150.5    5.1    0.0000   0.0000          ?        ?   227.3137  15.3245          ?        ?      150.5        5.1       ?       ? 
1 1 1   58    8   10 o     92.8    7.9    0.0000   0.0000          ?        ?    86.8389  14.6860          ?        ?       92.8        7.9       ?       ? 
1 1 1   58    8   11 o    155.9    5.1    0.0000   0.0000          ?        ?   243.9153  15.9630          ?        ?      155.9        5.1       ?       ? 
1 1 1   58    8   12 o    254.6    3.6    0.0000   0.0000          ?        ?   649.3765  18.5171          ?        ?      254.6        3.6       ?       ? 
1 1 1   58    8   13 o    206.5    3.9    0.0000   0.0000          ?        ?   427.1710  15.9630          ?        ?      206.5        3.9       ?       ? 
1 1 1   58    8   14 o    118.4    6.7    0.0000   0.0000          ?        ?   141.1133  15.9630          ?        ?      118.4        6.7       ?       ? 
1 1 1   58    8   15 o     82.2    9.3    0.0000   0.0000          ?        ?    68.3218  15.3245          ?        ?       82.2        9.3       ?       ? 
1 1 1   58    8   16 o    130.0    6.4    0.0000   0.0000          ?        ?   169.8468  16.6016          ?        ?      130.0        6.4       ?       ? 
1 1 1   58    8   17 o    376.3    3.1    0.0000   0.0000          ?        ?  1417.5181  22.9868          ?        ?      376.3        3.1       ?       ? 
1 1 1   58    8   18 o    108.8    7.9    0.0000   0.0000          ?        ?   119.4035  17.2401          ?        ?      108.8        7.9       ?       ? 
1 1 1   58    8   19 o     47.5   13.9    0.0000   0.0000          ?        ?    23.6253  14.0475          ?        ?       47.5       13.9       ?       ? 
1 1 1   58    8   20 o     56.9   12.7    0.0000   0.0000          ?        ?    34.4802  14.0475          ?        ?       56.9       12.7       ?       ? 
1 1 1   58    8   21 o    117.9    6.5    0.0000   0.0000          ?        ?   139.8362  15.3245          ?        ?      117.9        6.5       ?       ? 
1 1 1   58    8   22 o    103.1    7.1    0.0000   0.0000          ?        ?   107.2716  14.6860          ?        ?      103.1        7.1       ?       ? 
1 1 1   58    8   23 o     33.6   14.1    0.0000   0.0000          ?        ?     2.5541  15.9630          ?        ?       33.6       14.1       ?       ? 
1 1 1   58    8   24 f    254.6    3.5    0.0000   0.0000          ?        ?   649.3765  17.8786          ?        ?      254.6        3.5       ?       ? 
1 1 1   58    8   25 o    288.2    3.2    0.0000   0.0000          ?        ?   831.9937  18.5171          ?        ?      288.2        3.2       ?       ? 
1 1 1   58    8   26 f    128.4    6.2    0.0000   0.0000          ?        ?   166.0156  15.9630          ?        ?      128.4        6.2       ?       ? 
1 1 1   58    8   27 o    121.5    6.3    0.0000   0.0000          ?        ?   148.7755  15.3245          ?        ?      121.5        6.3       ?       ? 
1 1 1   58    8   28 o     99.9    7.4    0.0000   0.0000          ?        ?   100.8864  14.6860          ?        ?       99.9        7.4       ?       ? 
1 1 1   58    9    0 o    179.5    5.5  323.7305  19.7942   323.7305  19.7942   323.7305  19.7942      179.5      5.5      179.5        5.5     0.0     0.0 
1 1 1   58    9    1 o    125.6    5.8    0.0000   0.0000          ?        ?   158.3534  14.6860          ?        ?      125.6        5.8       ?       ? 
1 1 1   58    9    2 o    205.1    3.9    0.0000   0.0000          ?        ?   421.4243  15.9630          ?        ?      205.1        3.9       ?       ? 
1 1 1   58    9    3 o    333.3    3.2    0.0000   0.0000          ?        ?  1112.3047  21.0712          ?        ?      333.3        3.2       ?       ? 
1 1 1   58    9    4 o    416.0    3.6    0.0000   0.0000          ?        ?  1733.5862  30.0105          ?        ?      416.0        3.6       ?       ? 
1 1 1   58    9    5 o    136.5    6.1    0.0000   0.0000          ?        ?   187.0868  16.6016          ?        ?      136.5        6.1       ?       ? 
1 1 1   58    9    6 o     78.3    9.4    0.0000   0.0000          ?        ?    61.9366  14.6860          ?        ?       78.3        9.4       ?       ? 
1 1 1   58    9    7 o    162.8    4.3    0.0000   0.0000          ?        ?   265.6250  14.0475          ?        ?      162.8        4.3       ?       ? 
1 1 1   58    9    8 o    258.1    3.3    0.0000   0.0000          ?        ?   667.2551  17.2401          ?        ?      258.1        3.3       ?       ? 
1 1 1   58    9    9 o    203.2    4.1    0.0000   0.0000          ?        ?   413.7620  16.6016          ?        ?      203.2        4.1       ?       ? 
1 1 1   58    9   10 o    124.3    5.9    0.0000   0.0000          ?        ?   155.1608  14.6860          ?        ?      124.3        5.9       ?       ? 
1 1 1   58    9   11 o    228.9    3.9    0.0000   0.0000          ?        ?   524.8647  17.8786          ?        ?      228.9        3.9       ?       ? 
1 1 1   58    9   12 o    376.0    3.7    0.0000   0.0000          ?        ?  1416.2410  28.0950          ?        ?      376.0        3.7       ?       ? 
1 1 1   58    9   13 o    138.6    5.5    0.0000   0.0000          ?        ?   192.8335  15.3245          ?        ?      138.6        5.5       ?       ? 
1 1 1   58    9   14 o    114.4    6.1    0.0000   0.0000          ?        ?   131.5355  14.0475          ?        ?      114.4        6.1       ?       ? 
1 1 1   58    9   15 o    190.3    4.9    0.0000   0.0000          ?        ?   363.3188  18.5171          ?        ?      190.3        4.9       ?       ? 
1 1 1   58    9   16 o    472.5    3.2    0.0000   0.0000          ?        ?  2236.1028  30.6490          ?        ?      472.5        3.2       ?       ? 
1 1 1   58    9   17 o     59.4   13.7    0.0000   0.0000          ?        ?    37.6728  15.9630          ?        ?       59.4       13.7       ?       ? 
1 1 1   58    9   18 o     37.1   14.8    0.0000   0.0000          ?        ?     7.6623  16.6016          ?        ?       37.1       14.8       ?       ? 
1 1 1   58    9   19 o    115.2    7.8    0.0000   0.0000          ?        ?   134.0895  17.8786          ?        ?      115.2        7.8       ?       ? 
1 1 1   58    9   20 o    199.1    4.3    0.0000   0.0000          ?        ?   397.7990  17.2401          ?        ?      199.1        4.3       ?       ? 
1 1 1   58    9   21 o    168.6    5.1    0.0000   0.0000          ?        ?   285.4192  17.2401          ?        ?      168.6        5.1       ?       ? 
1 1 1   58    9   22 o    142.3    5.4    0.0000   0.0000          ?        ?   203.6884  15.3245          ?        ?      142.3        5.4       ?       ? 
1 1 1   58    9   23 o     75.1   10.2    0.0000   0.0000          ?        ?    57.4669  15.3245          ?        ?       75.1       10.2       ?       ? 
1 1 1   58    9   24 o     58.7   13.3    0.0000   0.0000          ?        ?    37.0343  15.3245          ?        ?       58.7       13.3       ?       ? 
1 1 1   58    9   25 o    118.2    6.7    0.0000   0.0000          ?        ?   141.1133  15.9630          ?        ?      118.2        6.7       ?       ? 
1 1 1   58    9   26 o    191.5    4.0    0.0000   0.0000          ?        ?   367.7885  15.3245          ?        ?      191.5        4.0       ?       ? 
1 1 1   58   10    0 o     83.7   11.2   72.1529  18.5171    72.1529  18.5171    72.1529  18.5171       83.7     11.2       83.7       11.2     0.0     0.0 
1 1 1   58   10    1 o    146.9    4.8    0.0000   0.0000          ?        ?   216.4588  14.0475          ?        ?      146.9        4.8       ?       ? 
1 1 1   58   10    2 o    146.7    4.8    0.0000   0.0000          ?        ?   215.8203  14.0475          ?        ?      146.7        4.8       ?       ? 
1 1 1   58   10    3 o     30.1   12.9    0.0000   0.0000          ?        ?    -0.6385  14.0475          ?        ?       30.1       12.9       ?       ? 
1 1 1   58   10    4 o    171.5    4.3    0.0000   0.0000          ?        ?   294.9970  14.6860          ?        ?      171.5        4.3       ?       ? 
1 1 1   58   10    5 o    193.0    4.1    0.0000   0.0000          ?        ?   373.5352  15.9630          ?        ?      193.0        4.1       ?       ? 
1 1 1   58   10    6 o    152.2    4.6    0.0000   0.0000          ?        ?   232.4219  14.0475          ?        ?      152.2        4.6       ?       ? 
1 1 1   58   10    7 o     18.1    9.0    0.0000   0.0000          ?        ?   -35.7572  13.4090          ?        ?       18.1        9.0       ?       ? 
1 1 1   58   10    8 o    271.3    3.6    0.0000   0.0000          ?        ?   737.4925  19.7942          ?        ?      271.3        3.6       ?       ? 
1 1 1   58   10    9 o    216.7    4.0    0.0000   0.0000          ?        ?   470.5904  17.2401          ?        ?      216.7        4.0       ?       ? 
1 1 1   58   10   10 o    218.0    3.7    0.0000   0.0000          ?        ?   476.3371  15.9630          ?        ?      218.0        3.7       ?       ? 
1 1 1   58   10   11 o    207.1    3.9    0.0000   0.0000          ?        ?   429.7251  15.9630          ?        ?      207.1        3.9       ?       ? 
1 1 1   58   10   12 o    165.6    4.4    0.0000   0.0000          ?        ?   275.2028  14.6860          ?        ?      165.6        4.4       ?       ? 
1 1 1   58   10   13 o     22.5   10.7    0.0000   0.0000          ?        ?   -17.2401  13.4090          ?        ?       22.5       10.7       ?       ? 
1 1 1   58   10   14 o     34.5   13.7    0.0000   0.0000          ?        ?     7.0237  14.0475          ?        ?       34.5       13.7       ?       ? 
1 1 1   58   10   15 o    177.5    4.5    0.0000   0.0000          ?        ?   316.0682  15.9630          ?        ?      177.5        4.5       ?       ? 
1 1 1   58   10   16 o    118.1    6.2    0.0000   0.0000          ?        ?   140.4748  14.6860          ?        ?      118.1        6.2       ?       ? 
1 1 1   58   10   17 o    240.7    3.6    0.0000   0.0000          ?        ?   580.4161  17.2401          ?        ?      240.7        3.6       ?       ? 
1 1 1   58   10   18 o    266.9    3.5    0.0000   0.0000          ?        ?   713.8672  18.5171          ?        ?      266.9        3.5       ?       ? 
1 1 1   58   10   19 o    281.2    3.4    0.0000   0.0000          ?        ?   792.4053  19.1556          ?        ?      281.2        3.4       ?       ? 
1 1 1   58   10   20 o    165.9    5.0    0.0000   0.0000          ?        ?   276.4799  16.6016          ?        ?      165.9        5.0       ?       ? 
1 1 1   58   10   21 o     91.1    9.1    0.0000   0.0000          ?        ?    84.2849  16.6016          ?        ?       91.1        9.1       ?       ? 
1 1 1   58   10   22 o    148.5    5.2    0.0000   0.0000          ?        ?   221.5670  15.3245          ?        ?      148.5        5.2       ?       ? 
1 1 1   58   10   23 o     27.9   12.6    0.0000   0.0000          ?        ?    -6.3852  14.6860          ?        ?       27.9       12.6       ?       ? 
1 1 1   58   10   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   58   11    0 o    256.5    4.5  659.5928  22.9868   659.5928  22.9868   659.5928  22.9868      256.5      4.5      256.5        4.5     0.0     0.0 
1 1 1   58   11    1 o    175.7    4.2    0.0000   0.0000          ?        ?   309.6830  14.6860          ?        ?      175.7        4.2       ?       ? 
1 1 1   58   11    2 o     61.0    9.4    0.0000   0.0000          ?        ?    37.6728  11.4934          ?        ?       61.0        9.4       ?       ? 
1 1 1   58   11    3 o    295.4    3.1    0.0000   0.0000          ?        ?   874.1360  18.5171          ?        ?      295.4        3.1       ?       ? 
1 1 1   58   11    4 o     56.5   12.2    0.0000   0.0000          ?        ?    33.8416  13.4090          ?        ?       56.5       12.2       ?       ? 
1 1 1   58   11    5 o     74.1    9.1    0.0000   0.0000          ?        ?    55.5514  13.4090          ?        ?       74.1        9.1       ?       ? 
1 1 1   58   11    6 o     30.1   12.9    0.0000   0.0000          ?        ?    -0.6385  14.0475          ?        ?       30.1       12.9       ?       ? 
1 1 1   58   11    7 o     26.7   12.2    0.0000   0.0000          ?        ?    -9.5778  14.6860          ?        ?       26.7       12.2       ?       ? 
1 1 1   58   11    8 f    207.2    4.0    0.0000   0.0000          ?        ?   430.3636  16.6016          ?        ?      207.2        4.0       ?       ? 
1 1 1   58   11    9 o    229.7    3.9    0.0000   0.0000          ?        ?   528.6959  17.8786          ?        ?      229.7        3.9       ?       ? 
1 1 1   58   11   10 o    306.8    3.3    0.0000   0.0000          ?        ?   943.0964  20.4327          ?        ?      306.8        3.3       ?       ? 
1 1 1   58   11   11 o    169.4    4.7    0.0000   0.0000          ?        ?   287.9732  15.9630          ?        ?      169.4        4.7       ?       ? 
1 1 1   58   11   12 o     44.3   14.4    0.0000   0.0000          ?        ?    19.7942  14.6860          ?        ?       44.3       14.4       ?       ? 
1 1 1   58   11   13 o    166.7    4.6    0.0000   0.0000          ?        ?   279.0340  15.3245          ?        ?      166.7        4.6       ?       ? 
1 1 1   58   11   14 f    291.9    3.4    0.0000   0.0000          ?        ?   853.7034  19.7942          ?        ?      291.9        3.4       ?       ? 
1 1 1   58   11   15 o    280.7    3.5    0.0000   0.0000          ?        ?   789.8513  19.7942          ?        ?      280.7        3.5       ?       ? 
1 1 1   58   11   16 o    217.1    4.0    0.0000   0.0000          ?        ?   472.5060  17.2401          ?        ?      217.1        4.0       ?       ? 
1 1 1   58   11   17 o     31.9   13.6    0.0000   0.0000          ?        ?     0.6385  15.3245          ?        ?       31.9       13.6       ?       ? 
1 1 1   58   11   18 f     22.9   11.2    0.0000   0.0000          ?        ?   -29.3720  16.6016          ?        ?       22.9       11.2       ?       ? 
1 1 1   58   11   19 o     58.3   12.9    0.0000   0.0000          ?        ?    36.3957  14.6860          ?        ?       58.3       12.9       ?       ? 
1 1 1   58   11   20 o     90.5    8.1    0.0000   0.0000          ?        ?    83.0078  14.6860          ?        ?       90.5        8.1       ?       ? 
1 1 1   58   11   21 o    261.0    3.5    0.0000   0.0000          ?        ?   683.2181  18.5171          ?        ?      261.0        3.5       ?       ? 
1 1 1   58   12    0 o     71.2   14.1   56.8284  17.8786    56.8284  17.8786    56.8284  17.8786       71.2     14.1       71.2       14.1     0.0     0.0 
1 1 1   58   12    1 o    150.8    4.0    0.0000   0.0000          ?        ?   227.9522  12.1319          ?        ?      150.8        4.0       ?       ? 
1 1 1   58   12    2 o    170.1    3.8    0.0000   0.0000          ?        ?   289.8888  12.7704          ?        ?      170.1        3.8       ?       ? 
1 1 1   58   12    3 o    208.3    3.2    0.0000   0.0000          ?        ?   434.8332  13.4090          ?        ?      208.3        3.2       ?       ? 
1 1 1   58   12    4 o    110.7    5.5    0.0000   0.0000          ?        ?   123.2347  12.1319          ?        ?      110.7        5.5       ?       ? 
1 1 1   58   12    5 o    142.1    4.0    0.0000   0.0000          ?        ?   202.4114  11.4934          ?        ?      142.1        4.0       ?       ? 
1 1 1   58   12    6 o    147.7    4.5    0.0000   0.0000          ?        ?   219.0129  13.4090          ?        ?      147.7        4.5       ?       ? 
1 1 1   58   12    7 o    216.1    3.5    0.0000   0.0000          ?        ?   468.0364  15.3245          ?        ?      216.1        3.5       ?       ? 
1 1 1   58   12    8 o    171.9    4.1    0.0000   0.0000          ?        ?   296.2740  14.0475          ?        ?      171.9        4.1       ?       ? 
1 1 1   58   12    9 o    200.4    4.0    0.0000   0.0000          ?        ?   402.9071  15.9630          ?        ?      200.4        4.0       ?       ? 
1 1 1   58   12   10 o    166.8    4.0    0.0000   0.0000          ?        ?   279.0340  13.4090          ?        ?      166.8        4.0       ?       ? 
1 1 1   58   12   11 o    239.2    3.5    0.0000   0.0000          ?        ?   573.3925  16.6016          ?        ?      239.2        3.5       ?       ? 
1 1 1   58   12   12 o    150.8    5.3    0.0000   0.0000          ?        ?   228.5907  15.9630          ?        ?      150.8        5.3       ?       ? 
1 1 1   58   12   13 o    125.2    5.9    0.0000   0.0000          ?        ?   157.7148  14.6860          ?        ?      125.2        5.9       ?       ? 
1 1 1   58   12   14 o    118.1    5.9    0.0000   0.0000          ?        ?   140.4748  14.0475          ?        ?      118.1        5.9       ?       ? 
1 1 1   58   12   15 o    204.1    3.8    0.0000   0.0000          ?        ?   417.5931  15.3245          ?        ?      204.1        3.8       ?       ? 
1 1 1   58   12   16 o    225.8    3.8    0.0000   0.0000          ?        ?   511.4558  17.2401          ?        ?      225.8        3.8       ?       ? 
1 1 1   58   12   17 o    201.2    4.0    0.0000   0.0000          ?        ?   406.0997  15.9630          ?        ?      201.2        4.0       ?       ? 
1 1 1   58   12   18 o    291.4    3.7    0.0000   0.0000          ?        ?   851.7878  21.7097          ?        ?      291.4        3.7       ?       ? 
1 1 1   58   13    0 o     60.1   24.5   52.3588  28.7335    52.3588  28.7335    52.3588  28.7335       60.1     24.5       60.1       24.5     0.0     0.0 
1 1 1   58   13    1 o    101.5    7.2    0.0000   0.0000          ?        ?   104.0790  14.6860          ?        ?      101.5        7.2       ?       ? 
1 1 1   58   13    2 o     44.7   12.9    0.0000   0.0000          ?        ?    21.0712  12.1319          ?        ?       44.7       12.9       ?       ? 
1 1 1   58   13    3 o    121.3    6.1    0.0000   0.0000          ?        ?   148.1370  14.6860          ?        ?      121.3        6.1       ?       ? 
1 1 1   58   13    4 o    136.3    5.9    0.0000   0.0000          ?        ?   187.0868  15.9630          ?        ?      136.3        5.9       ?       ? 
1 1 1   58   13    5 o    156.1    5.9    0.0000   0.0000          ?        ?   245.1923  18.5171          ?        ?      156.1        5.9       ?       ? 
1 1 1   58   13    6 o     28.9   13.3    0.0000   0.0000          ?        ?   -12.7704  17.8786          ?        ?       28.9       13.3       ?       ? 
1 1 1   58   13    7 o     54.2   16.3    0.0000   0.0000          ?        ?    31.2876  19.1556          ?        ?       54.2       16.3       ?       ? 
1 1 1   58   13    8 o    262.1    4.0    0.0000   0.0000          ?        ?   688.9648  21.0712          ?        ?      262.1        4.0       ?       ? 
1 1 1   58   13    9 o     75.5    9.7    0.0000   0.0000          ?        ?    58.1055  14.6860          ?        ?       75.5        9.7       ?       ? 
1 1 1   58   13   10 o    233.3    3.1    0.0000   0.0000          ?        ?   545.2975  14.6860          ?        ?      233.3        3.1       ?       ? 
1 1 1   58   13   11 o    100.0    6.7    0.0000   0.0000          ?        ?   100.8864  13.4090          ?        ?      100.0        6.7       ?       ? 
1 1 1   58   13   12 o     24.4   11.1    0.0000   0.0000          ?        ?    -7.6623  12.1319          ?        ?       24.4       11.1       ?       ? 
1 1 1   58   13   13 o    204.3    3.9    0.0000   0.0000          ?        ?   418.8702  15.9630          ?        ?      204.3        3.9       ?       ? 
1 1 1   58   13   14 o     46.5   13.6    0.0000   0.0000          ?        ?    22.9868  13.4090          ?        ?       46.5       13.6       ?       ? 
1 1 1   58   14    0 o     16.4   12.3 -104.7175  31.9261  -104.7175  31.9261  -104.7175  31.9261       16.4     12.3       16.4       12.3     0.0     0.0 
1 1 1   58   14    1 o     79.7   13.2    0.0000   0.0000          ?        ?    65.7677  21.0712          ?        ?       79.7       13.2       ?       ? 
1 1 1   58   14    2 o     66.1   16.5    0.0000   0.0000          ?        ?    47.8891  21.7097          ?        ?       66.1       16.5       ?       ? 
1 1 1   58   14    3 o     34.3   16.1    0.0000   0.0000          ?        ?   -28.0950  28.7335          ?        ?       34.3       16.1       ?       ? 
1 1 1   58   14    4 o     82.3   14.9    0.0000   0.0000          ?        ?    72.7915  23.6253          ?        ?       82.3       14.9       ?       ? 
1 1 1   58   14    5 o     37.1   14.6    0.0000   0.0000          ?        ?     8.9393  15.9630          ?        ?       37.1       14.6       ?       ? 
1 1 1   58   14    6 o     17.4    8.7    0.0000   0.0000          ?        ?   -35.1187  12.7704          ?        ?       17.4        8.7       ?       ? 
1 1 1   58   14    7 o     38.0   13.7    0.0000   0.0000          ?        ?    12.7704  13.4090          ?        ?       38.0       13.7       ?       ? 
1 1 1   58   14    8 o     63.5   12.0    0.0000   0.0000          ?        ?    42.7809  14.6860          ?        ?       63.5       12.0       ?       ? 
1 1 1   58   14    9 o     88.3    8.7    0.0000   0.0000          ?        ?    79.1767  15.3245          ?        ?       88.3        8.7       ?       ? 
1 1 1   59    0    0 o    229.6    7.7  529.3344  35.1187   529.3344  35.1187   529.3344  35.1187      229.6      7.7      229.6        7.7     0.0     0.0 
1 1 1   59    0    1 o     89.9   12.1   85.5619  21.0712    85.5619  21.0712    85.5619  21.0712       89.9     12.1       89.9       12.1     0.0     0.0 
1 1 1   59    0    2 o     13.3    9.9  -52.9973  18.5171   -52.9973  18.5171   -52.9973  18.5171       13.3      9.9       13.3        9.9     0.0     0.0 
1 1 1   59    0    3 o    187.4    5.5  352.4639  20.4327   352.4639  20.4327   352.4639  20.4327      187.4      5.5      187.4        5.5     0.0     0.0 
1 1 1   59    0    4 o     12.3    9.2  -69.5989  19.1556   -69.5989  19.1556   -69.5989  19.1556       12.3      9.2       12.3        9.2     0.0     0.0 
1 1 1   59    0    5 o     16.4   12.1  -44.0580  21.7097   -44.0580  21.7097   -44.0580  21.7097       16.4     12.1       16.4       12.1     0.0     0.0 
1 1 1   59    0    6 o     16.9   12.2  -30.0105  19.1556   -30.0105  19.1556   -30.0105  19.1556       16.9     12.2       16.9       12.2     0.0     0.0 
1 1 1   59    0    7 o    259.6    5.2  675.5559  26.8179   675.5559  26.8179   675.5559  26.8179      259.6      5.2      259.6        5.2     0.0     0.0 
1 1 1   59    0    8 o    374.7    4.5 1406.0247  33.8416  1406.0247  33.8416  1406.0247  33.8416      374.7      4.5      374.7        4.5     0.0     0.0 
1 1 1   59    0    9 o    331.3    4.4 1098.8958  29.3720  1098.8958  29.3720  1098.8958  29.3720      331.3      4.4      331.3        4.4     0.0     0.0 
1 1 1   59    0   10 o    345.9    4.9 1198.5051  33.8416  1198.5051  33.8416  1198.5051  33.8416      345.9      4.9      345.9        4.9     0.0     0.0 
1 1 1   59    0   11 o    225.5    5.4  510.1788  24.2638   510.1788  24.2638   510.1788  24.2638      225.5      5.4      225.5        5.4     0.0     0.0 
1 1 1   59    0   12 o    197.3    5.7  390.7752  22.3483   390.7752  22.3483   390.7752  22.3483      197.3      5.7      197.3        5.7     0.0     0.0 
1 1 1   59    0   13 o    135.8    7.3  186.4483  19.7942   186.4483  19.7942   186.4483  19.7942      135.8      7.3      135.8        7.3     0.0     0.0 
1 1 1   59    0   14 o    265.2    4.9  704.9279  26.1794   704.9279  26.1794   704.9279  26.1794      265.2      4.9      265.2        4.9     0.0     0.0 
1 1 1   59    0   15 o    103.0   13.3  108.5487  27.4564   108.5487  27.4564   108.5487  27.4564      103.0     13.3      103.0       13.3     0.0     0.0 
1 1 1   59    0   16 o     71.1   20.7   62.5751  25.5409    62.5751  25.5409    62.5751  25.5409       71.1     20.7       71.1       20.7     0.0     0.0 
1 1 1   59    0   17 o     38.6   21.1   21.7097  22.9868    21.7097  22.9868    21.7097  22.9868       38.6     21.1       38.6       21.1     0.0     0.0 
1 1 1   59    0   18 o    328.5    4.8 1081.0171  31.2876  1081.0171  31.2876  1081.0171  31.2876      328.5      4.8      328.5        4.8     0.0     0.0 
1 1 1   59    0   19 o    224.9    5.7  507.6247  25.5409   507.6247  25.5409   507.6247  25.5409      224.9      5.7      224.9        5.7     0.0     0.0 
1 1 1   59    0   20 o    301.0    4.2  907.3393  25.5409   907.3393  25.5409   907.3393  25.5409      301.0      4.2      301.0        4.2     0.0     0.0 
1 1 1   59    0   21 o     91.9   11.4   88.7545  20.4327    88.7545  20.4327    88.7545  20.4327       91.9     11.4       91.9       11.4     0.0     0.0 
1 1 1   59    0   22 o    194.9    6.6  381.8359  25.5409   381.8359  25.5409   381.8359  25.5409      194.9      6.6      194.9        6.6     0.0     0.0 
1 1 1   59    0   23 o    169.0    7.0  287.9732  23.6253   287.9732  23.6253   287.9732  23.6253      169.0      7.0      169.0        7.0     0.0     0.0 
1 1 1   59    0   24 o     25.4   17.1   -7.0237  23.6253    -7.0237  23.6253    -7.0237  23.6253       25.4     17.1       25.4       17.1     0.0     0.0 
1 1 1   59    0   25 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   59    0   26 o    167.7    7.1  283.5036  23.6253   283.5036  23.6253   283.5036  23.6253      167.7      7.1      167.7        7.1     0.0     0.0 
1 1 1   59    0   27 o    112.7   10.1  130.8969  22.3483   130.8969  22.3483   130.8969  22.3483      112.7     10.1      112.7       10.1     0.0     0.0 
1 1 1   59    0   28 o    474.0    3.9 2249.5117  37.0343  2249.5117  37.0343  2249.5117  37.0343      474.0      3.9      474.0        3.9     0.0     0.0 
1 1 1   59    0   29 o     85.4   14.6   79.1767  22.9868    79.1767  22.9868    79.1767  22.9868       85.4     14.6       85.4       14.6     0.0     0.0 
1 1 1   59    0   30 o     50.8   21.0   37.0343  21.0712    37.0343  21.0712    37.0343  21.0712       50.8     21.0       50.8       21.0     0.0     0.0 
1 1 1   59    0   31 o    357.0    4.3 1276.4047  30.6490  1276.4047  30.6490  1276.4047  30.6490      357.0      4.3      357.0        4.3     0.0     0.0 
1 1 1   59    0   32 f    216.4    5.8  470.5904  24.9023   470.5904  24.9023   470.5904  24.9023      216.4      5.8      216.4        5.8     0.0     0.0 
1 1 1   59    0   33 o     88.3   12.7   81.7308  21.7097    81.7308  21.7097    81.7308  21.7097       88.3     12.7       88.3       12.7     0.0     0.0 
1 1 1   59    0   34 o     68.8   20.3   59.3825  24.2638    59.3825  24.2638    59.3825  24.2638       68.8     20.3       68.8       20.3     0.0     0.0 
1 1 1   59    0   35 o     24.9   16.6   -4.4697  21.7097    -4.4697  21.7097    -4.4697  21.7097       24.9     16.6       24.9       16.6     0.0     0.0 
1 1 1   59    0   36 o     31.7   19.3   10.8549  22.3483    10.8549  22.3483    10.8549  22.3483       31.7     19.3       31.7       19.3     0.0     0.0 
1 1 1   59    0   37 o    109.6   11.0  125.1502  23.6253   125.1502  23.6253   125.1502  23.6253      109.6     11.0      109.6       11.0     0.0     0.0 
1 1 1   59    0   38 o    214.6    5.5  462.9282  23.6253   462.9282  23.6253   462.9282  23.6253      214.6      5.5      214.6        5.5     0.0     0.0 
1 1 1   59    1    0 o    475.0    4.6 2259.0894  43.4195  2259.0894  43.4195  2259.0894  43.4195      475.0      4.6      475.0        4.6     0.0     0.0 
1 1 1   59    1    1 o    256.3    3.6    0.0000   0.0000          ?        ?   657.6772  18.5171          ?        ?      256.3        3.6       ?       ? 
1 1 1   59    1    2 o    353.3    3.3    0.0000   0.0000          ?        ?  1249.5868  22.9868          ?        ?      353.3        3.3       ?       ? 
1 1 1   59    1    3 o    272.9    3.3    0.0000   0.0000          ?        ?   745.1547  17.8786          ?        ?      272.9        3.3       ?       ? 
1 1 1   59    1    4 o    153.1    4.8    0.0000   0.0000          ?        ?   234.9760  14.6860          ?        ?      153.1        4.8       ?       ? 
1 1 1   59    1    5 o    267.9    3.2    0.0000   0.0000          ?        ?   718.3369  17.2401          ?        ?      267.9        3.2       ?       ? 
1 1 1   59    1    6 o     33.8   13.4    0.0000   0.0000          ?        ?     6.3852  13.4090          ?        ?       33.8       13.4       ?       ? 
1 1 1   59    1    7 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   59    1    8 o     73.4    9.6    0.0000   0.0000          ?        ?    54.2743  14.0475          ?        ?       73.4        9.6       ?       ? 
1 1 1   59    1    9 o    175.1    4.9    0.0000   0.0000          ?        ?   307.1289  17.2401          ?        ?      175.1        4.9       ?       ? 
1 1 1   59    1   10 o    150.2    5.1    0.0000   0.0000          ?        ?   226.0367  15.3245          ?        ?      150.2        5.1       ?       ? 
1 1 1   59    1   11 o    307.6    3.4    0.0000   0.0000          ?        ?   946.9276  21.0712          ?        ?      307.6        3.4       ?       ? 
1 1 1   59    1   12 o     87.2    8.8    0.0000   0.0000          ?        ?    76.6226  15.3245          ?        ?       87.2        8.8       ?       ? 
1 1 1   59    1   13 o    238.1    4.3    0.0000   0.0000          ?        ?   567.6458  20.4327          ?        ?      238.1        4.3       ?       ? 
1 1 1   59    1   14 o    175.8    4.4    0.0000   0.0000          ?        ?   309.6830  15.3245          ?        ?      175.8        4.4       ?       ? 
1 1 1   59    1   15 o    158.6    5.8    0.0000   0.0000          ?        ?   252.2160  18.5171          ?        ?      158.6        5.8       ?       ? 
1 1 1   59    1   16 o    139.0    6.4    0.0000   0.0000          ?        ?   194.1106  17.8786          ?        ?      139.0        6.4       ?       ? 
1 1 1   59    1   17 o    253.5    4.0    0.0000   0.0000          ?        ?   643.6298  20.4327          ?        ?      253.5        4.0       ?       ? 
1 1 1   59    1   18 o    245.3    4.0    0.0000   0.0000          ?        ?   602.7644  19.7942          ?        ?      245.3        4.0       ?       ? 
1 1 1   59    1   19 o    137.0    6.1    0.0000   0.0000          ?        ?   188.3639  16.6016          ?        ?      137.0        6.1       ?       ? 
1 1 1   59    1   20 o    129.8    6.4    0.0000   0.0000          ?        ?   169.2082  16.6016          ?        ?      129.8        6.4       ?       ? 
1 1 1   59    1   21 o     20.6   10.2    0.0000   0.0000          ?        ?   -37.6728  15.9630          ?        ?       20.6       10.2       ?       ? 
1 1 1   59    1   22 o    122.9    7.0    0.0000   0.0000          ?        ?   151.9681  17.2401          ?        ?      122.9        7.0       ?       ? 
1 1 1   59    1   23 o    154.1    5.2    0.0000   0.0000          ?        ?   238.1686  15.9630          ?        ?      154.1        5.2       ?       ? 
1 1 1   59    1   24 o    228.5    4.1    0.0000   0.0000          ?        ?   522.9492  18.5171          ?        ?      228.5        4.1       ?       ? 
1 1 1   59    1   25 o    109.2    7.3    0.0000   0.0000          ?        ?   120.0421  15.9630          ?        ?      109.2        7.3       ?       ? 
1 1 1   59    1   26 f    227.4    3.7    0.0000   0.0000          ?        ?   517.8410  16.6016          ?        ?      227.4        3.7       ?       ? 
1 1 1   59    1   27 o    321.6    3.0    0.0000   0.0000          ?        ?  1035.6820  19.1556          ?        ?      321.6        3.0       ?       ? 
1 1 1   59    1   28 o    219.9    3.9    0.0000   0.0000          ?        ?   484.6379  17.2401          ?        ?      219.9        3.9       ?       ? 
1 1 1   59    1   29 o     66.0   12.5    0.0000   0.0000          ?        ?    45.9736  15.9630          ?        ?       66.0       12.5       ?       ? 
1 1 1   59    1   30 o     35.1   14.3    0.0000   0.0000          ?        ?     5.1082  15.9630          ?        ?       35.1       14.3       ?       ? 
1 1 1   59    1   31 o    147.9    5.4    0.0000   0.0000          ?        ?   219.6514  15.9630          ?        ?      147.9        5.4       ?       ? 
1 1 1   59    1   32 o    390.6    2.8    0.0000   0.0000          ?        ?  1527.3438  21.7097          ?        ?      390.6        2.8       ?       ? 
1 1 1   59    1   33 o     27.9   12.7    0.0000   0.0000          ?        ?   -10.2163  15.9630          ?        ?       27.9       12.7       ?       ? 
1 1 1   59    1   34 o    129.9    5.9    0.0000   0.0000          ?        ?   169.8468  15.3245          ?        ?      129.9        5.9       ?       ? 
1 1 1   59    1   35 o     23.1   11.1    0.0000   0.0000          ?        ?   -22.9868  15.3245          ?        ?       23.1       11.1       ?       ? 
1 1 1   59    1   36 o     68.5   12.6    0.0000   0.0000          ?        ?    49.8047  16.6016          ?        ?       68.5       12.6       ?       ? 
1 1 1   59    1   37 o     88.3    8.7    0.0000   0.0000          ?        ?    79.1767  15.3245          ?        ?       88.3        8.7       ?       ? 
1 1 1   59    2    0 o     19.1   13.7  -27.4564  21.7097   -27.4564  21.7097   -27.4564  21.7097       19.1     13.7       19.1       13.7     0.0     0.0 
1 1 1   59    2    1 o    260.5    3.1    0.0000   0.0000          ?        ?   679.3870  15.9630          ?        ?      260.5        3.1       ?       ? 
1 1 1   59    2    2 o    193.1    4.0    0.0000   0.0000          ?        ?   373.5352  15.3245          ?        ?      193.1        4.0       ?       ? 
1 1 1   59    2    3 o    219.4    3.8    0.0000   0.0000          ?        ?   482.0838  16.6016          ?        ?      219.4        3.8       ?       ? 
1 1 1   59    2    4 o    174.7    4.9    0.0000   0.0000          ?        ?   305.8519  17.2401          ?        ?      174.7        4.9       ?       ? 
1 1 1   59    2    5 o    161.2    5.0    0.0000   0.0000          ?        ?   260.5168  15.9630          ?        ?      161.2        5.0       ?       ? 
1 1 1   59    2    6 o    203.9    4.1    0.0000   0.0000          ?        ?   416.3161  16.6016          ?        ?      203.9        4.1       ?       ? 
1 1 1   59    2    7 o    253.9    3.5    0.0000   0.0000          ?        ?   645.5453  17.8786          ?        ?      253.9        3.5       ?       ? 
1 1 1   59    2    8 o     35.9   14.6    0.0000   0.0000          ?        ?     5.1082  16.6016          ?        ?       35.9       14.6       ?       ? 
1 1 1   59    2    9 o    157.6    4.7    0.0000   0.0000          ?        ?   249.0234  14.6860          ?        ?      157.6        4.7       ?       ? 
1 1 1   59    2   10 o    434.2    3.2    0.0000   0.0000          ?        ?  1887.4700  28.0950          ?        ?      434.2        3.2       ?       ? 
1 1 1   59    2   11 o    102.0    8.8    0.0000   0.0000          ?        ?   104.7175  17.8786          ?        ?      102.0        8.8       ?       ? 
1 1 1   59    2   12 o    155.1    5.8    0.0000   0.0000          ?        ?   241.3612  17.8786          ?        ?      155.1        5.8       ?       ? 
1 1 1   59    2   13 o    219.0    3.6    0.0000   0.0000          ?        ?   480.1682  15.9630          ?        ?      219.0        3.6       ?       ? 
1 1 1   59    2   14 o    171.0    4.5    0.0000   0.0000          ?        ?   293.0815  15.3245          ?        ?      171.0        4.5       ?       ? 
1 1 1   59    2   15 o     40.1   15.4    0.0000   0.0000          ?        ?    11.4934  17.2401          ?        ?       40.1       15.4       ?       ? 
1 1 1   59    2   16 o    152.0    5.5    0.0000   0.0000          ?        ?   231.7833  16.6016          ?        ?      152.0        5.5       ?       ? 
1 1 1   59    2   17 o    215.7    4.1    0.0000   0.0000          ?        ?   466.1208  17.8786          ?        ?      215.7        4.1       ?       ? 
1 1 1   59    2   18 o     27.4   12.3    0.0000   0.0000          ?        ?    -6.3852  14.0475          ?        ?       27.4       12.3       ?       ? 
1 1 1   59    2   19 o     29.5   13.2    0.0000   0.0000          ?        ?    -6.3852  15.9630          ?        ?       29.5       13.2       ?       ? 
1 1 1   59    2   20 o    275.6    3.5    0.0000   0.0000          ?        ?   760.4792  19.1556          ?        ?      275.6        3.5       ?       ? 
1 1 1   59    2   21 o     25.6   11.9    0.0000   0.0000          ?        ?   -12.7704  14.6860          ?        ?       25.6       11.9       ?       ? 
1 1 1   59    2   22 o    194.7    4.1    0.0000   0.0000          ?        ?   379.9204  15.9630          ?        ?      194.7        4.1       ?       ? 
1 1 1   59    2   23 o    119.0    6.4    0.0000   0.0000          ?        ?   142.3903  15.3245          ?        ?      119.0        6.4       ?       ? 
1 1 1   59    2   24 o     21.8   10.7    0.0000   0.0000          ?        ?   -31.9261  15.9630          ?        ?       21.8       10.7       ?       ? 
1 1 1   59    2   25 o    304.2    3.0    0.0000   0.0000          ?        ?   926.4949  18.5171          ?        ?      304.2        3.0       ?       ? 
1 1 1   59    2   26 o    199.4    4.2    0.0000   0.0000          ?        ?   398.4375  16.6016          ?        ?      199.4        4.2       ?       ? 
1 1 1   59    2   27 o    231.5    3.6    0.0000   0.0000          ?        ?   536.9967  16.6016          ?        ?      231.5        3.6       ?       ? 
1 1 1   59    2   28 o    269.8    3.3    0.0000   0.0000          ?        ?   729.1917  17.8786          ?        ?      269.8        3.3       ?       ? 
1 1 1   59    2   29 o     17.4    8.8    0.0000   0.0000          ?        ?   -53.6358  15.3245          ?        ?       17.4        8.8       ?       ? 
1 1 1   59    2   30 o     20.1   10.0    0.0000   0.0000          ?        ?   -40.2269  15.9630          ?        ?       20.1       10.0       ?       ? 
1 1 1   59    2   31 o    127.4    6.3    0.0000   0.0000          ?        ?   163.4615  15.9630          ?        ?      127.4        6.3       ?       ? 
1 1 1   59    2   32 o    131.1    6.1    0.0000   0.0000          ?        ?   173.0394  15.9630          ?        ?      131.1        6.1       ?       ? 
1 1 1   59    2   33 o    214.9    3.9    0.0000   0.0000          ?        ?   462.9282  16.6016          ?        ?      214.9        3.9       ?       ? 
1 1 1   59    2   34 f    123.0    6.5    0.0000   0.0000          ?        ?   152.6067  15.9630          ?        ?      123.0        6.5       ?       ? 
1 1 1   59    2   35 o     84.2    9.1    0.0000   0.0000          ?        ?    72.1529  15.3245          ?        ?       84.2        9.1       ?       ? 
1 1 1   59    3    0 o    158.7    7.3  254.1316  22.9868   254.1316  22.9868   254.1316  22.9868      158.7      7.3      158.7        7.3     0.0     0.0 
1 1 1   59    3    1 o     69.3   10.6    0.0000   0.0000          ?        ?    48.5276  14.6860          ?        ?       69.3       10.6       ?       ? 
1 1 1   59    3    2 o    163.6    4.5    0.0000   0.0000          ?        ?   268.1791  14.6860          ?        ?      163.6        4.5       ?       ? 
1 1 1   59    3    3 o    355.7    3.5    0.0000   0.0000          ?        ?  1266.8269  24.9023          ?        ?      355.7        3.5       ?       ? 
1 1 1   59    3    4 o    108.8    6.5    0.0000   0.0000          ?        ?   118.7650  14.0475          ?        ?      108.8        6.5       ?       ? 
1 1 1   59    3    5 o     64.4   12.3    0.0000   0.0000          ?        ?    43.4195  15.3245          ?        ?       64.4       12.3       ?       ? 
1 1 1   59    3    6 o    125.6    6.1    0.0000   0.0000          ?        ?   158.3534  15.3245          ?        ?      125.6        6.1       ?       ? 
1 1 1   59    3    7 o    207.4    4.9    0.0000   0.0000          ?        ?   431.0021  20.4327          ?        ?      207.4        4.9       ?       ? 
1 1 1   59    3    8 o    106.1    6.9    0.0000   0.0000          ?        ?   113.0183  14.6860          ?        ?      106.1        6.9       ?       ? 
1 1 1   59    3    9 o     77.1   10.4    0.0000   0.0000          ?        ?    60.0210  15.9630          ?        ?       77.1       10.4       ?       ? 
1 1 1   59    3   10 o     17.0    8.6    0.0000   0.0000          ?        ?   -42.1424  13.4090          ?        ?       17.0        8.6       ?       ? 
1 1 1   59    3   11 o    113.0    6.8    0.0000   0.0000          ?        ?   128.3428  15.3245          ?        ?      113.0        6.8       ?       ? 
1 1 1   59    3   12 o    232.4    3.7    0.0000   0.0000          ?        ?   540.8278  17.2401          ?        ?      232.4        3.7       ?       ? 
1 1 1   59    3   13 f     84.6    9.1    0.0000   0.0000          ?        ?    72.1529  15.3245          ?        ?       84.6        9.1       ?       ? 
1 1 1   59    3   14 o     53.8   14.5    0.0000   0.0000          ?        ?    30.6490  15.9630          ?        ?       53.8       14.5       ?       ? 
1 1 1   59    3   15 o    199.5    4.6    0.0000   0.0000          ?        ?   399.0760  18.5171          ?        ?      199.5        4.6       ?       ? 
1 1 1   59    3   16 o    163.0    4.9    0.0000   0.0000          ?        ?   266.2635  15.9630          ?        ?      163.0        4.9       ?       ? 
1 1 1   59    3   17 o    269.3    3.2    0.0000   0.0000          ?        ?   725.9991  17.2401          ?        ?      269.3        3.2       ?       ? 
1 1 1   59    3   18 o    171.3    4.8    0.0000   0.0000          ?        ?   294.3585  16.6016          ?        ?      171.3        4.8       ?       ? 
1 1 1   59    3   19 o    189.2    4.9    0.0000   0.0000          ?        ?   358.8492  18.5171          ?        ?      189.2        4.9       ?       ? 
1 1 1   59    3   20 o    106.9    6.9    0.0000   0.0000          ?        ?   114.9339  14.6860          ?        ?      106.9        6.9       ?       ? 
1 1 1   59    3   21 o    195.7    4.4    0.0000   0.0000          ?        ?   383.7515  17.2401          ?        ?      195.7        4.4       ?       ? 
1 1 1   59    3   22 f    136.2    6.1    0.0000   0.0000          ?        ?   186.4483  16.6016          ?        ?      136.2        6.1       ?       ? 
1 1 1   59    3   23 o     96.5    7.9    0.0000   0.0000          ?        ?    93.8627  15.3245          ?        ?       96.5        7.9       ?       ? 
1 1 1   59    3   24 o     77.7   10.7    0.0000   0.0000          ?        ?    61.2981  16.6016          ?        ?       77.7       10.7       ?       ? 
1 1 1   59    3   25 o    310.2    3.2    0.0000   0.0000          ?        ?   963.5291  19.7942          ?        ?      310.2        3.2       ?       ? 
1 1 1   59    3   26 o    140.6    5.9    0.0000   0.0000          ?        ?   198.5802  16.6016          ?        ?      140.6        5.9       ?       ? 
1 1 1   59    3   27 o    165.6    5.0    0.0000   0.0000          ?        ?   275.2028  16.6016          ?        ?      165.6        5.0       ?       ? 
1 1 1   59    3   28 o    338.1    3.0    0.0000   0.0000          ?        ?  1144.8693  20.4327          ?        ?      338.1        3.0       ?       ? 
1 1 1   59    3   29 o    220.0    3.9    0.0000   0.0000          ?        ?   485.2764  17.2401          ?        ?      220.0        3.9       ?       ? 
1 1 1   59    3   30 o    188.1    4.6    0.0000   0.0000          ?        ?   355.0180  17.2401          ?        ?      188.1        4.6       ?       ? 
1 1 1   59    3   31 o    149.1    5.4    0.0000   0.0000          ?        ?   223.4826  15.9630          ?        ?      149.1        5.4       ?       ? 
1 1 1   59    3   32 f    154.3    5.2    0.0000   0.0000          ?        ?   239.4456  15.9630          ?        ?      154.3        5.2       ?       ? 
1 1 1   59    3   33 o    221.7    3.7    0.0000   0.0000          ?        ?   492.9387  16.6016          ?        ?      221.7        3.7       ?       ? 
1 1 1   59    3   34 o     96.6    7.9    0.0000   0.0000          ?        ?    94.5012  15.3245          ?        ?       96.6        7.9       ?       ? 
1 1 1   59    4    0 o    122.6    9.0  153.2452  21.7097   153.2452  21.7097   153.2452  21.7097      122.6      9.0      122.6        9.0     0.0     0.0 
1 1 1   59    4    1 o    129.6    6.4    0.0000   0.0000          ?        ?   168.5697  16.6016          ?        ?      129.6        6.4       ?       ? 
1 1 1   59    4    2 o    142.7    5.6    0.0000   0.0000          ?        ?   204.3269  15.9630          ?        ?      142.7        5.6       ?       ? 
1 1 1   59    4    3 o    218.7    3.9    0.0000   0.0000          ?        ?   478.8912  17.2401          ?        ?      218.7        3.9       ?       ? 
1 1 1   59    4    4 o    295.7    3.7    0.0000   0.0000          ?        ?   875.4132  21.7097          ?        ?      295.7        3.7       ?       ? 
1 1 1   59    4    5 o    235.1    3.8    0.0000   0.0000          ?        ?   553.5982  17.8786          ?        ?      235.1        3.8       ?       ? 
1 1 1   59    4    6 o    210.2    3.8    0.0000   0.0000          ?        ?   442.4955  15.9630          ?        ?      210.2        3.8       ?       ? 
1 1 1   59    4    7 o    246.7    3.9    0.0000   0.0000          ?        ?   609.7881  19.1556          ?        ?      246.7        3.9       ?       ? 
1 1 1   59    4    8 o    270.2    3.9    0.0000   0.0000          ?        ?   731.1072  21.0712          ?        ?      270.2        3.9       ?       ? 
1 1 1   59    4    9 o    378.2    3.7    0.0000   0.0000          ?        ?  1432.2040  28.0950          ?        ?      378.2        3.7       ?       ? 
1 1 1   59    4   10 o    152.1    4.8    0.0000   0.0000          ?        ?   231.7833  14.6860          ?        ?      152.1        4.8       ?       ? 
1 1 1   59    4   11 o    203.4    3.6    0.0000   0.0000          ?        ?   414.4005  14.6860          ?        ?      203.4        3.6       ?       ? 
1 1 1   59    4   12 o    212.8    3.8    0.0000   0.0000          ?        ?   453.3503  15.9630          ?        ?      212.8        3.8       ?       ? 
1 1 1   59    4   13 o    298.2    3.6    0.0000   0.0000          ?        ?   890.7377  21.7097          ?        ?      298.2        3.6       ?       ? 
1 1 1   59    4   14 o     31.9   13.7    0.0000   0.0000          ?        ?    -1.2770  15.9630          ?        ?       31.9       13.7       ?       ? 
1 1 1   59    4   15 o    144.2    5.5    0.0000   0.0000          ?        ?   208.7966  15.9630          ?        ?      144.2        5.5       ?       ? 
1 1 1   59    4   16 o     72.2   11.5    0.0000   0.0000          ?        ?    52.9973  16.6016          ?        ?       72.2       11.5       ?       ? 
1 1 1   59    4   17 o    157.4    6.7    0.0000   0.0000          ?        ?   249.0234  21.0712          ?        ?      157.4        6.7       ?       ? 
1 1 1   59    4   18 o    140.1    6.8    0.0000   0.0000          ?        ?   197.3032  19.1556          ?        ?      140.1        6.8       ?       ? 
1 1 1   59    4   19 f    297.7    3.5    0.0000   0.0000          ?        ?   887.5450  21.0712          ?        ?      297.7        3.5       ?       ? 
1 1 1   59    4   20 o    104.3    8.3    0.0000   0.0000          ?        ?   109.8257  17.2401          ?        ?      104.3        8.3       ?       ? 
1 1 1   59    4   21 o    166.0    5.0    0.0000   0.0000          ?        ?   276.4799  16.6016          ?        ?      166.0        5.0       ?       ? 
1 1 1   59    4   22 o    117.3    7.1    0.0000   0.0000          ?        ?   138.5592  16.6016          ?        ?      117.3        7.1       ?       ? 
1 1 1   59    4   23 o    215.5    4.1    0.0000   0.0000          ?        ?   465.4823  17.8786          ?        ?      215.5        4.1       ?       ? 
1 1 1   59    4   24 o     94.1    8.5    0.0000   0.0000          ?        ?    89.3930  15.9630          ?        ?       94.1        8.5       ?       ? 
1 1 1   59    4   25 o     59.9   13.6    0.0000   0.0000          ?        ?    38.3113  15.9630          ?        ?       59.9       13.6       ?       ? 
1 1 1   59    4   26 o    114.3    6.4    0.0000   0.0000          ?        ?   131.5355  14.6860          ?        ?      114.3        6.4       ?       ? 
1 1 1   59    4   27 o    262.4    3.2    0.0000   0.0000          ?        ?   689.6033  16.6016          ?        ?      262.4        3.2       ?       ? 
1 1 1   59    4   28 o    197.5    4.2    0.0000   0.0000          ?        ?   391.4138  16.6016          ?        ?      197.5        4.2       ?       ? 
1 1 1   59    4   29 o    167.1    4.8    0.0000   0.0000          ?        ?   280.3110  15.9630          ?        ?      167.1        4.8       ?       ? 
1 1 1   59    4   30 o     57.1   14.1    0.0000   0.0000          ?        ?    35.1187  15.9630          ?        ?       57.1       14.1       ?       ? 
1 1 1   59    4   31 o     49.5   14.1    0.0000   0.0000          ?        ?    26.1794  14.6860          ?        ?       49.5       14.1       ?       ? 
1 1 1   59    4   32 o     85.7    8.9    0.0000   0.0000          ?        ?    74.7070  15.3245          ?        ?       85.7        8.9       ?       ? 
1 1 1   59    5    0 o    171.2    7.5  295.6355  25.5409   295.6355  25.5409   295.6355  25.5409      171.2      7.5      171.2        7.5     0.0     0.0 
1 1 1   59    5    1 o     65.5   10.7    0.0000   0.0000          ?        ?    43.4195  14.0475          ?        ?       65.5       10.7       ?       ? 
1 1 1   59    5    2 o    306.3    3.5    0.0000   0.0000          ?        ?   939.2654  21.7097          ?        ?      306.3        3.5       ?       ? 
1 1 1   59    5    3 o    129.6    5.9    0.0000   0.0000          ?        ?   168.5697  15.3245          ?        ?      129.6        5.9       ?       ? 
1 1 1   59    5    4 o    164.0    4.7    0.0000   0.0000          ?        ?   269.4561  15.3245          ?        ?      164.0        4.7       ?       ? 
1 1 1   59    5    5 o    333.7    3.4    0.0000   0.0000          ?        ?  1114.8588  22.9868          ?        ?      333.7        3.4       ?       ? 
1 1 1   59    5    6 o    255.8    3.6    0.0000   0.0000          ?        ?   655.1232  18.5171          ?        ?      255.8        3.6       ?       ? 
1 1 1   59    5    7 o    119.1    6.4    0.0000   0.0000          ?        ?   142.3903  15.3245          ?        ?      119.1        6.4       ?       ? 
1 1 1   59    5    8 o    182.0    4.4    0.0000   0.0000          ?        ?   332.0312  15.9630          ?        ?      182.0        4.4       ?       ? 
1 1 1   59    5    9 o    181.7    4.2    0.0000   0.0000          ?        ?   330.7542  15.3245          ?        ?      181.7        4.2       ?       ? 
1 1 1   59    5   10 o    116.1    6.3    0.0000   0.0000          ?        ?   135.3666  14.6860          ?        ?      116.1        6.3       ?       ? 
1 1 1   59    5   11 o    254.4    3.6    0.0000   0.0000          ?        ?   648.0994  18.5171          ?        ?      254.4        3.6       ?       ? 
1 1 1   59    5   12 o    165.9    4.6    0.0000   0.0000          ?        ?   275.8413  15.3245          ?        ?      165.9        4.6       ?       ? 
1 1 1   59    5   13 o     27.3   12.6    0.0000   0.0000          ?        ?   -12.1319  15.9630          ?        ?       27.3       12.6       ?       ? 
1 1 1   59    5   14 f    114.9    6.7    0.0000   0.0000          ?        ?   132.8125  15.3245          ?        ?      114.9        6.7       ?       ? 
1 1 1   59    5   15 o     46.0   15.1    0.0000   0.0000          ?        ?    21.0712  15.9630          ?        ?       46.0       15.1       ?       ? 
1 1 1   59    5   16 o    294.9    3.6    0.0000   0.0000          ?        ?   870.9435  21.0712          ?        ?      294.9        3.6       ?       ? 
1 1 1   59    5   17 o     45.5   15.1    0.0000   0.0000          ?        ?    20.4327  15.9630          ?        ?       45.5       15.1       ?       ? 
1 1 1   59    5   18 o    162.6    5.9    0.0000   0.0000          ?        ?   265.6250  19.1556          ?        ?      162.6        5.9       ?       ? 
1 1 1   59    5   19 o    232.7    4.4    0.0000   0.0000          ?        ?   542.7434  20.4327          ?        ?      232.7        4.4       ?       ? 
1 1 1   59    5   20 o    192.8    4.5    0.0000   0.0000          ?        ?   372.8966  17.2401          ?        ?      192.8        4.5       ?       ? 
1 1 1   59    5   21 o    135.8    7.3    0.0000   0.0000          ?        ?   185.8098  19.7942          ?        ?      135.8        7.3       ?       ? 
1 1 1   59    5   22 f    431.0    3.0    0.0000   0.0000          ?        ?  1860.0134  25.5409          ?        ?      431.0        3.0       ?       ? 
1 1 1   59    5   23 o    104.6    8.2    0.0000   0.0000          ?        ?   110.4642  17.2401          ?        ?      104.6        8.2       ?       ? 
1 1 1   59    5   24 o     75.1   11.1    0.0000   0.0000          ?        ?    57.4669  16.6016          ?        ?       75.1       11.1       ?       ? 
1 1 1   59    5   25 o    128.0    5.7    0.0000   0.0000          ?        ?   164.7386  14.6860          ?        ?      128.0        5.7       ?       ? 
1 1 1   59    5   26 f    207.6    4.0    0.0000   0.0000          ?        ?   432.2791  16.6016          ?        ?      207.6        4.0       ?       ? 
1 1 1   59    5   27 o    163.8    4.9    0.0000   0.0000          ?        ?   269.4561  15.9630          ?        ?      163.8        4.9       ?       ? 
1 1 1   59    5   28 o    120.4    6.9    0.0000   0.0000          ?        ?   146.2215  16.6016          ?        ?      120.4        6.9       ?       ? 
1 1 1   59    5   29 o     54.9   14.8    0.0000   0.0000          ?        ?    32.5646  16.6016          ?        ?       54.9       14.8       ?       ? 
1 1 1   59    5   30 o    182.9    4.4    0.0000   0.0000          ?        ?   335.8624  15.9630          ?        ?      182.9        4.4       ?       ? 
1 1 1   59    5   31 o     67.9   10.8    0.0000   0.0000          ?        ?    47.2506  14.6860          ?        ?       67.9       10.8       ?       ? 
1 1 1   59    6    0 o     91.4   10.7   87.4775  19.1556    87.4775  19.1556    87.4775  19.1556       91.4     10.7       91.4       10.7     0.0     0.0 
1 1 1   59    6    1 o     94.6    7.1    0.0000   0.0000          ?        ?    90.0316  13.4090          ?        ?       94.6        7.1       ?       ? 
1 1 1   59    6    2 o    264.0    3.6    0.0000   0.0000          ?        ?   697.9042  19.1556          ?        ?      264.0        3.6       ?       ? 
1 1 1   59    6    3 o    145.4    5.3    0.0000   0.0000          ?        ?   211.9892  15.3245          ?        ?      145.4        5.3       ?       ? 
1 1 1   59    6    4 o    135.4    5.4    0.0000   0.0000          ?        ?   183.8942  14.6860          ?        ?      135.4        5.4       ?       ? 
1 1 1   59    6    5 o    328.5    3.3    0.0000   0.0000          ?        ?  1080.3785  21.7097          ?        ?      328.5        3.3       ?       ? 
1 1 1   59    6    6 o    394.4    3.3    0.0000   0.0000          ?        ?  1557.3542  26.1794          ?        ?      394.4        3.3       ?       ? 
1 1 1   59    6    7 o    307.8    3.4    0.0000   0.0000          ?        ?   948.8432  21.0712          ?        ?      307.8        3.4       ?       ? 
1 1 1   59    6    8 o    291.6    3.2    0.0000   0.0000          ?        ?   851.1494  18.5171          ?        ?      291.6        3.2       ?       ? 
1 1 1   59    6    9 o     99.2    7.4    0.0000   0.0000          ?        ?    98.9709  14.6860          ?        ?       99.2        7.4       ?       ? 
1 1 1   59    6   10 o     58.0   13.5    0.0000   0.0000          ?        ?    35.7572  15.3245          ?        ?       58.0       13.5       ?       ? 
1 1 1   59    6   11 o    237.6    3.8    0.0000   0.0000          ?        ?   565.7302  17.8786          ?        ?      237.6        3.8       ?       ? 
1 1 1   59    6   12 o    256.9    3.4    0.0000   0.0000          ?        ?   660.8699  17.2401          ?        ?      256.9        3.4       ?       ? 
1 1 1   59    6   13 o    290.2    3.4    0.0000   0.0000          ?        ?   843.4871  19.7942          ?        ?      290.2        3.4       ?       ? 
1 1 1   59    6   14 o     91.7    8.4    0.0000   0.0000          ?        ?    84.9234  15.3245          ?        ?       91.7        8.4       ?       ? 
1 1 1   59    6   15 o    164.4    5.2    0.0000   0.0000          ?        ?   271.3717  17.2401          ?        ?      164.4        5.2       ?       ? 
1 1 1   59    6   16 o    116.2    7.1    0.0000   0.0000          ?        ?   136.0051  16.6016          ?        ?      116.2        7.1       ?       ? 
1 1 1   59    6   17 o    283.8    3.8    0.0000   0.0000          ?        ?   807.0914  21.7097          ?        ?      283.8        3.8       ?       ? 
1 1 1   59    6   18 o     66.3   13.5    0.0000   0.0000          ?        ?    46.6121  17.2401          ?        ?       66.3       13.5       ?       ? 
1 1 1   59    6   19 o    238.5    3.7    0.0000   0.0000          ?        ?   570.1998  17.8786          ?        ?      238.5        3.7       ?       ? 
1 1 1   59    6   20 o    236.2    4.2    0.0000   0.0000          ?        ?   559.3449  19.7942          ?        ?      236.2        4.2       ?       ? 
1 1 1   59    6   21 f    201.3    4.1    0.0000   0.0000          ?        ?   406.0997  16.6016          ?        ?      201.3        4.1       ?       ? 
1 1 1   59    6   22 o    219.6    4.1    0.0000   0.0000          ?        ?   483.3608  17.8786          ?        ?      219.6        4.1       ?       ? 
1 1 1   59    6   23 o    479.4    2.9    0.0000   0.0000          ?        ?  2301.2319  28.0950          ?        ?      479.4        2.9       ?       ? 
1 1 1   59    6   24 o     96.3    8.3    0.0000   0.0000          ?        ?    93.8627  15.9630          ?        ?       96.3        8.3       ?       ? 
1 1 1   59    6   25 o    135.0    5.7    0.0000   0.0000          ?        ?   183.2557  15.3245          ?        ?      135.0        5.7       ?       ? 
1 1 1   59    6   26 o    141.4    5.4    0.0000   0.0000          ?        ?   201.1343  15.3245          ?        ?      141.4        5.4       ?       ? 
1 1 1   59    6   27 o    135.1    5.9    0.0000   0.0000          ?        ?   183.8942  15.9630          ?        ?      135.1        5.9       ?       ? 
1 1 1   59    6   28 o     58.1   13.9    0.0000   0.0000          ?        ?    36.3957  15.9630          ?        ?       58.1       13.9       ?       ? 
1 1 1   59    6   29 o    148.0    5.4    0.0000   0.0000          ?        ?   220.2900  15.9630          ?        ?      148.0        5.4       ?       ? 
1 1 1   59    7    0 o    194.8    5.7  381.1974  22.3483   381.1974  22.3483   381.1974  22.3483      194.8      5.7      194.8        5.7     0.0     0.0 
1 1 1   59    7    1 o    151.6    4.8    0.0000   0.0000          ?        ?   230.5063  14.6860          ?        ?      151.6        4.8       ?       ? 
1 1 1   59    7    2 o    253.1    3.4    0.0000   0.0000          ?        ?   641.7142  17.2401          ?        ?      253.1        3.4       ?       ? 
1 1 1   59    7    3 o    296.3    3.4    0.0000   0.0000          ?        ?   879.2443  20.4327          ?        ?      296.3        3.4       ?       ? 
1 1 1   59    7    4 o     76.7    9.2    0.0000   0.0000          ?        ?    59.3825  14.0475          ?        ?       76.7        9.2       ?       ? 
1 1 1   59    7    5 o    158.4    5.0    0.0000   0.0000          ?        ?   251.5775  15.9630          ?        ?      158.4        5.0       ?       ? 
1 1 1   59    7    6 o    161.2    5.0    0.0000   0.0000          ?        ?   260.5168  15.9630          ?        ?      161.2        5.0       ?       ? 
1 1 1   59    7    7 o     59.6   13.2    0.0000   0.0000          ?        ?    37.6728  15.3245          ?        ?       59.6       13.2       ?       ? 
1 1 1   59    7    8 o     96.5    7.9    0.0000   0.0000          ?        ?    93.8627  15.3245          ?        ?       96.5        7.9       ?       ? 
1 1 1   59    7    9 o     51.5   14.3    0.0000   0.0000          ?        ?    28.0950  15.3245          ?        ?       51.5       14.3       ?       ? 
1 1 1   59    7   10 o    120.6    6.6    0.0000   0.0000          ?        ?   146.2215  15.9630          ?        ?      120.6        6.6       ?       ? 
1 1 1   59    7   11 o    269.1    3.8    0.0000   0.0000          ?        ?   725.3605  20.4327          ?        ?      269.1        3.8       ?       ? 
1 1 1   59    7   12 o     66.7   11.9    0.0000   0.0000          ?        ?    46.6121  15.3245          ?        ?       66.7       11.9       ?       ? 
1 1 1   59    7   13 o     73.1   10.5    0.0000   0.0000          ?        ?    54.2743  15.3245          ?        ?       73.1       10.5       ?       ? 
1 1 1   59    7   14 o     24.1   11.4    0.0000   0.0000          ?        ?   -17.2401  14.6860          ?        ?       24.1       11.4       ?       ? 
1 1 1   59    7   15 o    167.9    4.8    0.0000   0.0000          ?        ?   282.8651  15.9630          ?        ?      167.9        4.8       ?       ? 
1 1 1   59    7   16 o    135.3    5.9    0.0000   0.0000          ?        ?   183.8942  15.9630          ?        ?      135.3        5.9       ?       ? 
1 1 1   59    7   17 o    305.6    3.4    0.0000   0.0000          ?        ?   935.4342  21.0712          ?        ?      305.6        3.4       ?       ? 
1 1 1   59    7   18 o     87.9   10.2    0.0000   0.0000          ?        ?    78.5382  17.8786          ?        ?       87.9       10.2       ?       ? 
1 1 1   59    7   19 o    107.4    7.1    0.0000   0.0000          ?        ?   116.2109  15.3245          ?        ?      107.4        7.1       ?       ? 
1 1 1   59    7   20 o     87.7    9.1    0.0000   0.0000          ?        ?    77.8996  15.9630          ?        ?       87.7        9.1       ?       ? 
1 1 1   59    7   21 o    263.3    3.8    0.0000   0.0000          ?        ?   694.7115  19.7942          ?        ?      263.3        3.8       ?       ? 
1 1 1   59    7   22 o    170.0    5.4    0.0000   0.0000          ?        ?   290.5273  18.5171          ?        ?      170.0        5.4       ?       ? 
1 1 1   59    7   23 o    146.5    5.7    0.0000   0.0000          ?        ?   215.8203  16.6016          ?        ?      146.5        5.7       ?       ? 
1 1 1   59    7   24 o    122.0    6.5    0.0000   0.0000          ?        ?   150.0526  15.9630          ?        ?      122.0        6.5       ?       ? 
1 1 1   59    7   25 o     73.4   10.0    0.0000   0.0000          ?        ?    54.9129  14.6860          ?        ?       73.4       10.0       ?       ? 
1 1 1   59    7   26 o    171.8    4.5    0.0000   0.0000          ?        ?   296.2740  15.3245          ?        ?      171.8        4.5       ?       ? 
1 1 1   59    7   27 o    225.4    3.7    0.0000   0.0000          ?        ?   509.5403  16.6016          ?        ?      225.4        3.7       ?       ? 
1 1 1   59    8    0 o     15.9   11.5  -30.0105  17.8786   -30.0105  17.8786   -30.0105  17.8786       15.9     11.5       15.9       11.5     0.0     0.0 
1 1 1   59    8    1 o     30.8   13.2    0.0000   0.0000          ?        ?    -0.6385  14.6860          ?        ?       30.8       13.2       ?       ? 
1 1 1   59    8    2 o    108.3    7.4    0.0000   0.0000          ?        ?   118.1265  15.9630          ?        ?      108.3        7.4       ?       ? 
1 1 1   59    8    3 f    110.4    6.7    0.0000   0.0000          ?        ?   122.5962  14.6860          ?        ?      110.4        6.7       ?       ? 
1 1 1   59    8    4 o    284.2    3.5    0.0000   0.0000          ?        ?   809.0069  19.7942          ?        ?      284.2        3.5       ?       ? 
1 1 1   59    8    5 o    260.9    3.3    0.0000   0.0000          ?        ?   681.9411  17.2401          ?        ?      260.9        3.3       ?       ? 
1 1 1   59    8    6 o     88.6    8.3    0.0000   0.0000          ?        ?    79.1767  14.6860          ?        ?       88.6        8.3       ?       ? 
1 1 1   59    8    7 o    208.7    4.1    0.0000   0.0000          ?        ?   436.7488  17.2401          ?        ?      208.7        4.1       ?       ? 
1 1 1   59    8    8 o    152.2    4.8    0.0000   0.0000          ?        ?   232.4219  14.6860          ?        ?      152.2        4.8       ?       ? 
1 1 1   59    8    9 o    259.7    3.6    0.0000   0.0000          ?        ?   675.5559  18.5171          ?        ?      259.7        3.6       ?       ? 
1 1 1   59    8   10 o    222.4    3.9    0.0000   0.0000          ?        ?   495.4928  17.2401          ?        ?      222.4        3.9       ?       ? 
1 1 1   59    8   11 o    136.7    6.1    0.0000   0.0000          ?        ?   187.7254  16.6016          ?        ?      136.7        6.1       ?       ? 
1 1 1   59    8   12 o    161.3    4.7    0.0000   0.0000          ?        ?   261.1554  15.3245          ?        ?      161.3        4.7       ?       ? 
1 1 1   59    8   13 o    106.5    7.5    0.0000   0.0000          ?        ?   114.2954  15.9630          ?        ?      106.5        7.5       ?       ? 
1 1 1   59    8   14 o    261.2    3.4    0.0000   0.0000          ?        ?   683.2181  17.8786          ?        ?      261.2        3.4       ?       ? 
1 1 1   59    8   15 o    172.2    4.8    0.0000   0.0000          ?        ?   297.5511  16.6016          ?        ?      172.2        4.8       ?       ? 
1 1 1   59    8   16 f     51.4   14.7    0.0000   0.0000          ?        ?    28.0950  15.9630          ?        ?       51.4       14.7       ?       ? 
1 1 1   59    8   17 o     75.8   11.8    0.0000   0.0000          ?        ?    58.7440  17.8786          ?        ?       75.8       11.8       ?       ? 
1 1 1   59    8   18 o     34.8   14.1    0.0000   0.0000          ?        ?     5.7467  15.3245          ?        ?       34.8       14.1       ?       ? 
1 1 1   59    8   19 o    224.6    4.0    0.0000   0.0000          ?        ?   505.7091  17.8786          ?        ?      224.6        4.0       ?       ? 
1 1 1   59    8   20 o    202.2    4.6    0.0000   0.0000          ?        ?   410.5694  18.5171          ?        ?      202.2        4.6       ?       ? 
1 1 1   59    8   21 o    197.5    4.0    0.0000   0.0000          ?        ?   391.4138  15.9630          ?        ?      197.5        4.0       ?       ? 
1 1 1   59    8   22 o     47.7   15.0    0.0000   0.0000          ?        ?    23.6253  15.9630          ?        ?       47.7       15.0       ?       ? 
1 1 1   59    8   23 o    118.0    6.8    0.0000   0.0000          ?        ?   140.4748  15.9630          ?        ?      118.0        6.8       ?       ? 
1 1 1   59    8   24 o     22.5   11.1    0.0000   0.0000          ?        ?   -34.4802  17.2401          ?        ?       22.5       11.1       ?       ? 
1 1 1   59    8   25 o     19.4    9.6    0.0000   0.0000          ?        ?   -36.3957  14.6860          ?        ?       19.4        9.6       ?       ? 
1 1 1   59    9    0 o     89.5   11.0   84.2849  19.1556    84.2849  19.1556    84.2849  19.1556       89.5     11.0       89.5       11.0     0.0     0.0 
1 1 1   59    9    1 o    195.0    4.1    0.0000   0.0000          ?        ?   381.1974  15.9630          ?        ?      195.0        4.1       ?       ? 
1 1 1   59    9    2 o    281.5    3.3    0.0000   0.0000          ?        ?   793.6824  18.5171          ?        ?      281.5        3.3       ?       ? 
1 1 1   59    9    3 o     34.2   13.6    0.0000   0.0000          ?        ?     6.3852  14.0475          ?        ?       34.2       13.6       ?       ? 
1 1 1   59    9    4 o    122.7    6.0    0.0000   0.0000          ?        ?   151.3296  14.6860          ?        ?      122.7        6.0       ?       ? 
1 1 1   59    9    5 o     58.3   11.4    0.0000   0.0000          ?        ?    35.7572  12.7704          ?        ?       58.3       11.4       ?       ? 
1 1 1   59    9    6 o    281.0    3.5    0.0000   0.0000          ?        ?   791.1283  19.7942          ?        ?      281.0        3.5       ?       ? 
1 1 1   59    9    7 o    331.5    3.6    0.0000   0.0000          ?        ?  1100.8113  23.6253          ?        ?      331.5        3.6       ?       ? 
1 1 1   59    9    8 f    158.0    4.6    0.0000   0.0000          ?        ?   250.3005  14.6860          ?        ?      158.0        4.6       ?       ? 
1 1 1   59    9    9 o     86.6    9.2    0.0000   0.0000          ?        ?    75.9841  15.9630          ?        ?       86.6        9.2       ?       ? 
1 1 1   59    9   10 o    248.9    3.7    0.0000   0.0000          ?        ?   620.6430  18.5171          ?        ?      248.9        3.7       ?       ? 
1 1 1   59    9   11 o    162.5    4.9    0.0000   0.0000          ?        ?   264.9865  15.9630          ?        ?      162.5        4.9       ?       ? 
1 1 1   59    9   12 o    126.8    5.8    0.0000   0.0000          ?        ?   161.5460  14.6860          ?        ?      126.8        5.8       ?       ? 
1 1 1   59    9   13 o    183.8    4.3    0.0000   0.0000          ?        ?   339.0550  15.9630          ?        ?      183.8        4.3       ?       ? 
1 1 1   59    9   14 o    107.9    7.1    0.0000   0.0000          ?        ?   117.4880  15.3245          ?        ?      107.9        7.1       ?       ? 
1 1 1   59    9   15 o     22.8   11.1    0.0000   0.0000          ?        ?   -30.0105  16.6016          ?        ?       22.8       11.1       ?       ? 
1 1 1   59    9   16 o    130.8    7.8    0.0000   0.0000          ?        ?   173.0394  20.4327          ?        ?      130.8        7.8       ?       ? 
1 1 1   59    9   17 o    186.0    4.8    0.0000   0.0000          ?        ?   347.3558  17.8786          ?        ?      186.0        4.8       ?       ? 
1 1 1   59    9   18 o     25.2   11.8    0.0000   0.0000          ?        ?   -13.4090  14.6860          ?        ?       25.2       11.8       ?       ? 
1 1 1   59    9   19 o     26.9   12.5    0.0000   0.0000          ?        ?   -12.7704  15.9630          ?        ?       26.9       12.5       ?       ? 
1 1 1   59    9   20 o    120.8    7.4    0.0000   0.0000          ?        ?   147.4985  17.8786          ?        ?      120.8        7.4       ?       ? 
1 1 1   59    9   21 o    107.2    7.4    0.0000   0.0000          ?        ?   116.2109  15.9630          ?        ?      107.2        7.4       ?       ? 
1 1 1   59    9   22 o    223.9    3.3    0.0000   0.0000          ?        ?   502.5165  14.6860          ?        ?      223.9        3.3       ?       ? 
1 1 1   59   10    0 o    217.0    4.7  472.5060  20.4327   472.5060  20.4327   472.5060  20.4327      217.0      4.7      217.0        4.7     0.0     0.0 
1 1 1   59   10    1 o    217.4    4.0    0.0000   0.0000          ?        ?   473.7830  17.2401          ?        ?      217.4        4.0       ?       ? 
1 1 1   59   10    2 f    225.0    3.4    0.0000   0.0000          ?        ?   506.9862  15.3245          ?        ?      225.0        3.4       ?       ? 
1 1 1   59   10    3 o    184.5    4.5    0.0000   0.0000          ?        ?   341.6091  16.6016          ?        ?      184.5        4.5       ?       ? 
1 1 1   59   10    4 o    142.2    5.2    0.0000   0.0000          ?        ?   203.0499  14.6860          ?        ?      142.2        5.2       ?       ? 
1 1 1   59   10    5 o    216.1    4.0    0.0000   0.0000          ?        ?   468.0364  17.2401          ?        ?      216.1        4.0       ?       ? 
1 1 1   59   10    6 o    496.7    3.5    0.0000   0.0000          ?        ?  2472.3557  34.4802          ?        ?      496.7        3.5       ?       ? 
1 1 1   59   10    7 o    274.3    3.6    0.0000   0.0000          ?        ?   754.0941  19.7942          ?        ?      274.3        3.6       ?       ? 
1 1 1   59   10    8 o    367.4    3.3    0.0000   0.0000          ?        ?  1352.3888  24.2638          ?        ?      367.4        3.3       ?       ? 
1 1 1   59   10    9 o    380.1    3.3    0.0000   0.0000          ?        ?  1447.5286  24.9023          ?        ?      380.1        3.3       ?       ? 
1 1 1   59   10   10 o    118.1    6.8    0.0000   0.0000          ?        ?   140.4748  15.9630          ?        ?      118.1        6.8       ?       ? 
1 1 1   59   10   11 o    200.4    4.1    0.0000   0.0000          ?        ?   402.9071  16.6016          ?        ?      200.4        4.1       ?       ? 
1 1 1   59   10   12 o     69.4   11.0    0.0000   0.0000          ?        ?    49.1662  15.3245          ?        ?       69.4       11.0       ?       ? 
1 1 1   59   10   13 o    215.3    4.0    0.0000   0.0000          ?        ?   464.8438  17.2401          ?        ?      215.3        4.0       ?       ? 
1 1 1   59   10   14 o    198.0    5.0    0.0000   0.0000          ?        ?   393.9678  19.7942          ?        ?      198.0        5.0       ?       ? 
1 1 1   59   10   15 o    214.2    4.3    0.0000   0.0000          ?        ?   460.3741  18.5171          ?        ?      214.2        4.3       ?       ? 
1 1 1   59   10   16 o     91.6   10.1    0.0000   0.0000          ?        ?    85.5619  18.5171          ?        ?       91.6       10.1       ?       ? 
1 1 1   59   10   17 o    215.9    4.4    0.0000   0.0000          ?        ?   468.0364  19.1556          ?        ?      215.9        4.4       ?       ? 
1 1 1   59   10   18 o    220.1    3.9    0.0000   0.0000          ?        ?   485.9149  17.2401          ?        ?      220.1        3.9       ?       ? 
1 1 1   59   10   19 o    141.5    6.1    0.0000   0.0000          ?        ?   201.7728  17.2401          ?        ?      141.5        6.1       ?       ? 
1 1 1   59   11    0 o     75.1   12.3   60.6596  17.2401    60.6596  17.2401    60.6596  17.2401       75.1     12.3       75.1       12.3     0.0     0.0 
1 1 1   59   11    1 o     30.0   12.8    0.0000   0.0000          ?        ?     0.6385  13.4090          ?        ?       30.0       12.8       ?       ? 
1 1 1   59   11    2 o    246.7    3.5    0.0000   0.0000          ?        ?   609.7881  17.2401          ?        ?      246.7        3.5       ?       ? 
1 1 1   59   11    3 o     83.4    7.7    0.0000   0.0000          ?        ?    70.2374  12.7704          ?        ?       83.4        7.7       ?       ? 
1 1 1   59   11    4 o     94.2    6.8    0.0000   0.0000          ?        ?    89.3930  12.7704          ?        ?       94.2        6.8       ?       ? 
1 1 1   59   11    5 o    240.4    3.7    0.0000   0.0000          ?        ?   579.1391  17.8786          ?        ?      240.4        3.7       ?       ? 
1 1 1   59   11    6 o     68.6    9.8    0.0000   0.0000          ?        ?    47.8891  13.4090          ?        ?       68.6        9.8       ?       ? 
1 1 1   59   11    7 o    158.3    4.4    0.0000   0.0000          ?        ?   251.5775  14.0475          ?        ?      158.3        4.4       ?       ? 
1 1 1   59   11    8 o    156.4    4.9    0.0000   0.0000          ?        ?   245.8308  15.3245          ?        ?      156.4        4.9       ?       ? 
1 1 1   59   11    9 o    254.4    3.8    0.0000   0.0000          ?        ?   648.7380  19.1556          ?        ?      254.4        3.8       ?       ? 
1 1 1   59   11   10 o     85.8    8.6    0.0000   0.0000          ?        ?    74.7070  14.6860          ?        ?       85.8        8.6       ?       ? 
1 1 1   59   11   11 o     95.0    7.7    0.0000   0.0000          ?        ?    91.3086  14.6860          ?        ?       95.0        7.7       ?       ? 
1 1 1   59   11   12 o    272.7    3.6    0.0000   0.0000          ?        ?   745.7933  19.7942          ?        ?      272.7        3.6       ?       ? 
1 1 1   59   11   13 f    119.5    5.9    0.0000   0.0000          ?        ?   143.6674  14.0475          ?        ?      119.5        5.9       ?       ? 
1 1 1   59   11   14 o     66.7   12.4    0.0000   0.0000          ?        ?    47.2506  15.9630          ?        ?       66.7       12.4       ?       ? 
1 1 1   59   11   15 o     72.0   10.6    0.0000   0.0000          ?        ?    52.9973  15.3245          ?        ?       72.0       10.6       ?       ? 
1 1 1   59   11   16 o    164.5    5.0    0.0000   0.0000          ?        ?   272.0102  16.6016          ?        ?      164.5        5.0       ?       ? 
1 1 1   59   12    0 o     63.0   15.2   46.6121  16.6016    46.6121  16.6016    46.6121  16.6016       63.0     15.2       63.0       15.2     0.0     0.0 
1 1 1   59   12    1 o    115.6    4.7    0.0000   0.0000          ?        ?   134.0895  10.8549          ?        ?      115.6        4.7       ?       ? 
1 1 1   59   12    2 o    176.7    3.6    0.0000   0.0000          ?        ?   312.8756  12.7704          ?        ?      176.7        3.6       ?       ? 
1 1 1   59   12    3 o     87.2    5.9    0.0000   0.0000          ?        ?    76.6226  10.2163          ?        ?       87.2        5.9       ?       ? 
1 1 1   59   12    4 o    161.0    3.8    0.0000   0.0000          ?        ?   259.8783  12.1319          ?        ?      161.0        3.8       ?       ? 
1 1 1   59   12    5 o     88.7    6.1    0.0000   0.0000          ?        ?    79.1767  10.8549          ?        ?       88.7        6.1       ?       ? 
1 1 1   59   12    6 o     81.8    7.4    0.0000   0.0000          ?        ?    67.6833  12.1319          ?        ?       81.8        7.4       ?       ? 
1 1 1   59   12    7 o    255.5    3.4    0.0000   0.0000          ?        ?   654.4847  17.2401          ?        ?      255.5        3.4       ?       ? 
1 1 1   59   12    8 o     58.5   11.9    0.0000   0.0000          ?        ?    36.3957  13.4090          ?        ?       58.5       11.9       ?       ? 
1 1 1   59   12    9 o    280.7    3.3    0.0000   0.0000          ?        ?   789.8513  18.5171          ?        ?      280.7        3.3       ?       ? 
1 1 1   59   12   10 o     46.5   13.6    0.0000   0.0000          ?        ?    22.9868  13.4090          ?        ?       46.5       13.6       ?       ? 
1 1 1   59   12   11 o    132.1    5.3    0.0000   0.0000          ?        ?   175.5934  14.0475          ?        ?      132.1        5.3       ?       ? 
1 1 1   59   12   12 o     84.4    7.6    0.0000   0.0000          ?        ?    72.1529  12.7704          ?        ?       84.4        7.6       ?       ? 
1 1 1   59   13    0 o     37.3   21.4   19.7942  24.9023    19.7942  24.9023    19.7942  24.9023       37.3     21.4       37.3       21.4     0.0     0.0 
1 1 1   59   13    1 o    243.7    4.5    0.0000   0.0000          ?        ?   596.3792  21.7097          ?        ?      243.7        4.5       ?       ? 
1 1 1   59   13    2 o    114.9    5.6    0.0000   0.0000          ?        ?   132.8125  12.7704          ?        ?      114.9        5.6       ?       ? 
1 1 1   59   13    3 o    184.3    4.0    0.0000   0.0000          ?        ?   340.9706  14.6860          ?        ?      184.3        4.0       ?       ? 
1 1 1   59   13    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   60    0    0 o    524.0    7.7 2750.7510  81.0922  2750.7510  81.0922  2750.7510  81.0922      524.0      7.7      524.0        7.7     0.0     0.0 
1 1 1   60    0    1 o    308.0    4.4  950.1202  26.8179   950.1202  26.8179   950.1202  26.8179      308.0      4.4      308.0        4.4     0.0     0.0 
1 1 1   60    0    2 o    400.9    4.6 1609.7130  37.0343  1609.7130  37.0343  1609.7130  37.0343      400.9      4.6      400.9        4.6     0.0     0.0 
1 1 1   60    0    3 o    148.4    7.1  222.2055  21.0712   222.2055  21.0712   222.2055  21.0712      148.4      7.1      148.4        7.1     0.0     0.0 
1 1 1   60    0    4 o    466.8    5.3 2182.4668  49.8047  2182.4668  49.8047  2182.4668  49.8047      466.8      5.3      466.8        5.3     0.0     0.0 
1 1 1   60    0    5 o    191.3    6.0  367.7885  22.9868   367.7885  22.9868   367.7885  22.9868      191.3      6.0      191.3        6.0     0.0     0.0 
1 1 1   60    0    6 o    309.6    4.1  959.6980  25.5409   959.6980  25.5409   959.6980  25.5409      309.6      4.1      309.6        4.1     0.0     0.0 
1 1 1   60    0    7 f    293.6    4.9  863.9198  28.7335   863.9198  28.7335   863.9198  28.7335      293.6      4.9      293.6        4.9     0.0     0.0 
1 1 1   60    0    8 o    103.7   11.0  111.7413  22.3483   111.7413  22.3483   111.7413  22.3483      103.7     11.0      103.7       11.0     0.0     0.0 
1 1 1   60    0    9 o     61.1   19.1   47.2506  20.4327    47.2506  20.4327    47.2506  20.4327       61.1     19.1       61.1       19.1     0.0     0.0 
1 1 1   60    0   10 o    404.9    4.2 1641.6392  33.8416  1641.6392  33.8416  1641.6392  33.8416      404.9      4.2      404.9        4.2     0.0     0.0 
1 1 1   60    0   11 o    188.4    6.3  356.9336  23.6253   356.9336  23.6253   356.9336  23.6253      188.4      6.3      188.4        6.3     0.0     0.0 
1 1 1   60    0   12 o    268.9    5.0  724.7220  26.8179   724.7220  26.8179   724.7220  26.8179      268.9      5.0      268.9        5.0     0.0     0.0 
1 1 1   60    0   13 o     55.6   22.1   43.4195  23.6253    43.4195  23.6253    43.4195  23.6253       55.6     22.1       55.6       22.1     0.0     0.0 
1 1 1   60    0   14 o    325.0    4.7 1058.0303  30.6490  1058.0303  30.6490  1058.0303  30.6490      325.0      4.7      325.0        4.7     0.0     0.0 
1 1 1   60    0   15 o    247.9    6.1  616.8119  30.0105   616.8119  30.0105   616.8119  30.0105      247.9      6.1      247.9        6.1     0.0     0.0 
1 1 1   60    0   16 f    276.1    5.2  764.3104  28.7335   764.3104  28.7335   764.3104  28.7335      276.1      5.2      276.1        5.2     0.0     0.0 
1 1 1   60    0   17 o     34.9   21.0   13.4090  26.1794    13.4090  26.1794    13.4090  26.1794       34.9     21.0       34.9       21.0     0.0     0.0 
1 1 1   60    0   18 o    201.5    6.0  408.0153  24.2638   408.0153  24.2638   408.0153  24.2638      201.5      6.0      201.5        6.0     0.0     0.0 
1 1 1   60    0   19 o    159.3    6.2  255.4086  19.7942   255.4086  19.7942   255.4086  19.7942      159.3      6.2      159.3        6.2     0.0     0.0 
1 1 1   60    0   20 o    407.4    4.1 1661.4333  33.2031  1661.4333  33.2031  1661.4333  33.2031      407.4      4.1      407.4        4.1     0.0     0.0 
1 1 1   60    0   21 o    155.2    7.7  243.2767  23.6253   243.2767  23.6253   243.2767  23.6253      155.2      7.7      155.2        7.7     0.0     0.0 
1 1 1   60    0   22 o    365.1    4.3 1335.1488  31.2876  1335.1488  31.2876  1335.1488  31.2876      365.1      4.3      365.1        4.3     0.0     0.0 
1 1 1   60    0   23 o    510.9    4.4 2613.4690  45.3350  2613.4690  45.3350  2613.4690  45.3350      510.9      4.4      510.9        4.4     0.0     0.0 
1 1 1   60    0   24 o     89.8   13.4   84.9234  22.9868    84.9234  22.9868    84.9234  22.9868       89.8     13.4       89.8       13.4     0.0     0.0 
1 1 1   60    0   25 o    210.7    5.8  445.6881  24.2638   445.6881  24.2638   445.6881  24.2638      210.7      5.8      210.7        5.8     0.0     0.0 
1 1 1   60    0   26 o    234.1    5.1  549.7671  23.6253   549.7671  23.6253   549.7671  23.6253      234.1      5.1      234.1        5.1     0.0     0.0 
1 1 1   60    0   27 f     67.8   20.1   57.4669  23.6253    57.4669  23.6253    57.4669  23.6253       67.8     20.1       67.8       20.1     0.0     0.0 
1 1 1   60    0   28 o    191.5    6.3  369.0655  24.2638   369.0655  24.2638   369.0655  24.2638      191.5      6.3      191.5        6.3     0.0     0.0 
1 1 1   60    0   29 o    292.7    4.5  858.8116  26.1794   858.8116  26.1794   858.8116  26.1794      292.7      4.5      292.7        4.5     0.0     0.0 
1 1 1   60    0   30 o    411.3    3.8 1693.9978  31.2876  1693.9978  31.2876  1693.9978  31.2876      411.3      3.8      411.3        3.8     0.0     0.0 
1 1 1   60    0   31 o     45.3   21.7   31.2876  22.3483    31.2876  22.3483    31.2876  22.3483       45.3     21.7       45.3       21.7     0.0     0.0 
1 1 1   60    0   32 o    110.6   10.9  127.0658  23.6253   127.0658  23.6253   127.0658  23.6253      110.6     10.9      110.6       10.9     0.0     0.0 
1 1 1   60    0   33 o    282.1    4.6  798.1520  26.1794   798.1520  26.1794   798.1520  26.1794      282.1      4.6      282.1        4.6     0.0     0.0 
1 1 1   60    0   34 o    110.9    9.9  127.0658  21.7097   127.0658  21.7097   127.0658  21.7097      110.9      9.9      110.9        9.9     0.0     0.0 
1 1 1   60    0   35 o     70.9   17.7   60.0210  21.7097    60.0210  21.7097    60.0210  21.7097       70.9     17.7       70.9       17.7     0.0     0.0 
1 1 1   60    1    0 o    251.7    4.7  634.6905  23.6253   634.6905  23.6253   634.6905  23.6253      251.7      4.7      251.7        4.7     0.0     0.0 
1 1 1   60    1    1 o     55.5   13.8    0.0000   0.0000          ?        ?    32.5646  15.3245          ?        ?       55.5       13.8       ?       ? 
1 1 1   60    1    2 o    193.8    4.0    0.0000   0.0000          ?        ?   376.0892  15.3245          ?        ?      193.8        4.0       ?       ? 
1 1 1   60    1    3 o    212.8    3.8    0.0000   0.0000          ?        ?   453.3503  15.9630          ?        ?      212.8        3.8       ?       ? 
1 1 1   60    1    4 o     93.3    7.5    0.0000   0.0000          ?        ?    87.4775  14.0475          ?        ?       93.3        7.5       ?       ? 
1 1 1   60    1    5 o    274.2    3.5    0.0000   0.0000          ?        ?   752.8170  19.1556          ?        ?      274.2        3.5       ?       ? 
1 1 1   60    1    6 o    270.7    3.3    0.0000   0.0000          ?        ?   733.6614  17.8786          ?        ?      270.7        3.3       ?       ? 
1 1 1   60    1    7 o    217.0    4.3    0.0000   0.0000          ?        ?   471.8675  18.5171          ?        ?      217.0        4.3       ?       ? 
1 1 1   60    1    8 o    220.4    4.1    0.0000   0.0000          ?        ?   486.5535  17.8786          ?        ?      220.4        4.1       ?       ? 
1 1 1   60    1    9 o    265.7    3.2    0.0000   0.0000          ?        ?   706.8434  17.2401          ?        ?      265.7        3.2       ?       ? 
1 1 1   60    1   10 o    135.9    5.6    0.0000   0.0000          ?        ?   185.1713  15.3245          ?        ?      135.9        5.6       ?       ? 
1 1 1   60    1   11 o    190.1    4.2    0.0000   0.0000          ?        ?   362.0418  15.9630          ?        ?      190.1        4.2       ?       ? 
1 1 1   60    1   12 o     19.5    9.8    0.0000   0.0000          ?        ?   -57.4669  17.8786          ?        ?       19.5        9.8       ?       ? 
1 1 1   60    1   13 o     19.1    9.5    0.0000   0.0000          ?        ?   -38.3113  14.6860          ?        ?       19.1        9.5       ?       ? 
1 1 1   60    1   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   60    1   15 o     58.0   14.4    0.0000   0.0000          ?        ?    35.7572  16.6016          ?        ?       58.0       14.4       ?       ? 
1 1 1   60    1   16 o    351.0    3.7    0.0000   0.0000          ?        ?  1233.6238  26.1794          ?        ?      351.0        3.7       ?       ? 
1 1 1   60    1   17 o    168.9    4.5    0.0000   0.0000          ?        ?   286.0577  15.3245          ?        ?      168.9        4.5       ?       ? 
1 1 1   60    1   18 o    256.0    3.9    0.0000   0.0000          ?        ?   656.4003  19.7942          ?        ?      256.0        3.9       ?       ? 
1 1 1   60    1   19 o     51.6   13.9    0.0000   0.0000          ?        ?    28.0950  14.6860          ?        ?       51.6       13.9       ?       ? 
1 1 1   60    1   20 o     69.1   13.9    0.0000   0.0000          ?        ?    50.4432  18.5171          ?        ?       69.1       13.9       ?       ? 
1 1 1   60    1   21 o    141.8    5.2    0.0000   0.0000          ?        ?   201.7728  14.6860          ?        ?      141.8        5.2       ?       ? 
1 1 1   60    1   22 o     23.0   11.0    0.0000   0.0000          ?        ?   -21.0712  14.6860          ?        ?       23.0       11.0       ?       ? 
1 1 1   60    1   23 o    301.2    3.2    0.0000   0.0000          ?        ?   908.6163  19.1556          ?        ?      301.2        3.2       ?       ? 
1 1 1   60    1   24 o    222.0    3.6    0.0000   0.0000          ?        ?   493.5772  15.9630          ?        ?      222.0        3.6       ?       ? 
1 1 1   60    1   25 o    225.9    3.7    0.0000   0.0000          ?        ?   511.4558  16.6016          ?        ?      225.9        3.7       ?       ? 
1 1 1   60    1   26 o    200.5    4.1    0.0000   0.0000          ?        ?   402.9071  16.6016          ?        ?      200.5        4.1       ?       ? 
1 1 1   60    1   27 o     19.1    9.6    0.0000   0.0000          ?        ?   -45.9736  15.9630          ?        ?       19.1        9.6       ?       ? 
1 1 1   60    1   28 o    158.7    5.0    0.0000   0.0000          ?        ?   252.8546  15.9630          ?        ?      158.7        5.0       ?       ? 
1 1 1   60    1   29 o    103.1    7.4    0.0000   0.0000          ?        ?   107.2716  15.3245          ?        ?      103.1        7.4       ?       ? 
1 1 1   60    1   30 o    180.7    4.6    0.0000   0.0000          ?        ?   327.5616  16.6016          ?        ?      180.7        4.6       ?       ? 
1 1 1   60    1   31 o    342.3    2.8    0.0000   0.0000          ?        ?  1173.6028  19.1556          ?        ?      342.3        2.8       ?       ? 
1 1 1   60    1   32 o    113.0    7.1    0.0000   0.0000          ?        ?   128.9814  15.9630          ?        ?      113.0        7.1       ?       ? 
1 1 1   60    1   33 o    219.8    3.8    0.0000   0.0000          ?        ?   484.6379  16.6016          ?        ?      219.8        3.8       ?       ? 
1 1 1   60    1   34 o    218.2    3.7    0.0000   0.0000          ?        ?   477.6142  15.9630          ?        ?      218.2        3.7       ?       ? 
1 1 1   60    2    0 f    250.7    4.5  629.5823  22.3483   629.5823  22.3483   629.5823  22.3483      250.7      4.5      250.7        4.5     0.0     0.0 
1 1 1   60    2    1 o    162.4    4.7    0.0000   0.0000          ?        ?   264.3480  15.3245          ?        ?      162.4        4.7       ?       ? 
1 1 1   60    2    2 o    144.5    5.7    0.0000   0.0000          ?        ?   209.4351  16.6016          ?        ?      144.5        5.7       ?       ? 
1 1 1   60    2    3 o     77.1   10.4    0.0000   0.0000          ?        ?    60.0210  15.9630          ?        ?       77.1       10.4       ?       ? 
1 1 1   60    2    4 f    211.5    4.1    0.0000   0.0000          ?        ?   448.2422  17.2401          ?        ?      211.5        4.1       ?       ? 
1 1 1   60    2    5 o    224.0    3.7    0.0000   0.0000          ?        ?   502.5165  16.6016          ?        ?      224.0        3.7       ?       ? 
1 1 1   60    2    6 o    110.2    6.7    0.0000   0.0000          ?        ?   121.9576  14.6860          ?        ?      110.2        6.7       ?       ? 
1 1 1   60    2    7 o    148.2    5.2    0.0000   0.0000          ?        ?   220.2900  15.3245          ?        ?      148.2        5.2       ?       ? 
1 1 1   60    2    8 o    216.9    4.0    0.0000   0.0000          ?        ?   471.2290  17.2401          ?        ?      216.9        4.0       ?       ? 
1 1 1   60    2    9 o    424.2    3.5    0.0000   0.0000          ?        ?  1801.2695  29.3720          ?        ?      424.2        3.5       ?       ? 
1 1 1   60    2   10 o    395.0    3.9    0.0000   0.0000          ?        ?  1562.4624  30.6490          ?        ?      395.0        3.9       ?       ? 
1 1 1   60    2   11 f     97.5    8.5    0.0000   0.0000          ?        ?    95.7782  16.6016          ?        ?       97.5        8.5       ?       ? 
1 1 1   60    2   12 o    375.6    3.2    0.0000   0.0000          ?        ?  1412.4098  24.2638          ?        ?      375.6        3.2       ?       ? 
1 1 1   60    2   13 o    139.5    5.9    0.0000   0.0000          ?        ?   195.3876  16.6016          ?        ?      139.5        5.9       ?       ? 
1 1 1   60    2   14 o    262.8    4.3    0.0000   0.0000          ?        ?   692.1575  22.3483          ?        ?      262.8        4.3       ?       ? 
1 1 1   60    2   15 o    159.0    5.2    0.0000   0.0000          ?        ?   253.4931  16.6016          ?        ?      159.0        5.2       ?       ? 
1 1 1   60    2   16 o    112.4    7.4    0.0000   0.0000          ?        ?   127.0658  16.6016          ?        ?      112.4        7.4       ?       ? 
1 1 1   60    2   17 o    183.2    4.5    0.0000   0.0000          ?        ?   336.5009  16.6016          ?        ?      183.2        4.5       ?       ? 
1 1 1   60    2   18 o    190.8    4.9    0.0000   0.0000          ?        ?   365.2344  18.5171          ?        ?      190.8        4.9       ?       ? 
1 1 1   60    2   19 o    154.1    5.2    0.0000   0.0000          ?        ?   238.1686  15.9630          ?        ?      154.1        5.2       ?       ? 
1 1 1   60    2   20 o     18.7    9.4    0.0000   0.0000          ?        ?   -40.2269  14.6860          ?        ?       18.7        9.4       ?       ? 
1 1 1   60    2   21 o    159.4    5.0    0.0000   0.0000          ?        ?   254.7701  15.9630          ?        ?      159.4        5.0       ?       ? 
1 1 1   60    2   22 f    279.6    3.3    0.0000   0.0000          ?        ?   782.8275  18.5171          ?        ?      279.6        3.3       ?       ? 
1 1 1   60    2   23 o    151.1    5.1    0.0000   0.0000          ?        ?   229.2293  15.3245          ?        ?      151.1        5.1       ?       ? 
1 1 1   60    2   24 o    423.9    2.9    0.0000   0.0000          ?        ?  1799.3539  24.2638          ?        ?      423.9        2.9       ?       ? 
1 1 1   60    2   25 o    115.7    6.9    0.0000   0.0000          ?        ?   134.7281  15.9630          ?        ?      115.7        6.9       ?       ? 
1 1 1   60    2   26 o    121.3    6.3    0.0000   0.0000          ?        ?   148.1370  15.3245          ?        ?      121.3        6.3       ?       ? 
1 1 1   60    2   27 o     94.4    7.8    0.0000   0.0000          ?        ?    90.0316  14.6860          ?        ?       94.4        7.8       ?       ? 
1 1 1   60    2   28 o     28.2   12.7    0.0000   0.0000          ?        ?    -7.6623  15.3245          ?        ?       28.2       12.7       ?       ? 
1 1 1   60    2   29 o    218.9    3.6    0.0000   0.0000          ?        ?   480.1682  15.9630          ?        ?      218.9        3.6       ?       ? 
1 1 1   60    2   30 o    241.3    3.4    0.0000   0.0000          ?        ?   583.6088  16.6016          ?        ?      241.3        3.4       ?       ? 
1 1 1   60    2   31 o    178.3    4.5    0.0000   0.0000          ?        ?   319.2608  15.9630          ?        ?      178.3        4.5       ?       ? 
1 1 1   60    2   32 o    196.0    4.1    0.0000   0.0000          ?        ?   385.6671  15.9630          ?        ?      196.0        4.1       ?       ? 
1 1 1   60    2   33 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   60    3    0 o     21.6   14.7   -8.3008  18.5171    -8.3008  18.5171    -8.3008  18.5171       21.6     14.7       21.6       14.7     0.0     0.0 
1 1 1   60    3    1 o    171.2    4.8    0.0000   0.0000          ?        ?   293.7199  16.6016          ?        ?      171.2        4.8       ?       ? 
1 1 1   60    3    2 o    256.5    3.9    0.0000   0.0000          ?        ?   658.9543  19.7942          ?        ?      256.5        3.9       ?       ? 
1 1 1   60    3    3 o    187.7    4.8    0.0000   0.0000          ?        ?   353.1024  17.8786          ?        ?      187.7        4.8       ?       ? 
1 1 1   60    3    4 o    189.4    4.9    0.0000   0.0000          ?        ?   359.4877  18.5171          ?        ?      189.4        4.9       ?       ? 
1 1 1   60    3    5 o    108.1    7.7    0.0000   0.0000          ?        ?   117.4880  16.6016          ?        ?      108.1        7.7       ?       ? 
1 1 1   60    3    6 o    111.6    6.6    0.0000   0.0000          ?        ?   125.1502  14.6860          ?        ?      111.6        6.6       ?       ? 
1 1 1   60    3    7 o    183.0    4.7    0.0000   0.0000          ?        ?   335.8624  17.2401          ?        ?      183.0        4.7       ?       ? 
1 1 1   60    3    8 o    371.5    3.8    0.0000   0.0000          ?        ?  1382.3993  28.0950          ?        ?      371.5        3.8       ?       ? 
1 1 1   60    3    9 o    427.1    3.4    0.0000   0.0000          ?        ?  1826.1719  28.7335          ?        ?      427.1        3.4       ?       ? 
1 1 1   60    3   10 o    272.5    3.9    0.0000   0.0000          ?        ?   743.8777  21.0712          ?        ?      272.5        3.9       ?       ? 
1 1 1   60    3   11 o     91.1    8.1    0.0000   0.0000          ?        ?    83.6463  14.6860          ?        ?       91.1        8.1       ?       ? 
1 1 1   60    3   12 o    226.8    4.4    0.0000   0.0000          ?        ?   515.2869  19.7942          ?        ?      226.8        4.4       ?       ? 
1 1 1   60    3   13 o     83.7    9.5    0.0000   0.0000          ?        ?    70.8759  15.9630          ?        ?       83.7        9.5       ?       ? 
1 1 1   60    3   14 o    167.2    4.6    0.0000   0.0000          ?        ?   280.3110  15.3245          ?        ?      167.2        4.6       ?       ? 
1 1 1   60    3   15 o    148.2    5.4    0.0000   0.0000          ?        ?   220.2900  15.9630          ?        ?      148.2        5.4       ?       ? 
1 1 1   60    3   16 o    188.7    5.6    0.0000   0.0000          ?        ?   357.5721  21.0712          ?        ?      188.7        5.6       ?       ? 
1 1 1   60    3   17 o    136.5    5.8    0.0000   0.0000          ?        ?   187.0868  15.9630          ?        ?      136.5        5.8       ?       ? 
1 1 1   60    3   18 o     54.8   14.8    0.0000   0.0000          ?        ?    31.9261  16.6016          ?        ?       54.8       14.8       ?       ? 
1 1 1   60    3   19 o    208.7    4.4    0.0000   0.0000          ?        ?   436.7488  18.5171          ?        ?      208.7        4.4       ?       ? 
1 1 1   60    3   20 o    151.9    5.9    0.0000   0.0000          ?        ?   231.7833  17.8786          ?        ?      151.9        5.9       ?       ? 
1 1 1   60    3   21 o    116.0    6.9    0.0000   0.0000          ?        ?   135.3666  15.9630          ?        ?      116.0        6.9       ?       ? 
1 1 1   60    3   22 o     35.7   14.3    0.0000   0.0000          ?        ?     7.0237  15.3245          ?        ?       35.7       14.3       ?       ? 
1 1 1   60    3   23 o     25.1   12.0    0.0000   0.0000          ?        ?   -21.0712  16.6016          ?        ?       25.1       12.0       ?       ? 
1 1 1   60    3   24 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   60    3   25 o     97.1    7.6    0.0000   0.0000          ?        ?    95.1397  14.6860          ?        ?       97.1        7.6       ?       ? 
1 1 1   60    3   26 o    220.9    3.9    0.0000   0.0000          ?        ?   489.1075  17.2401          ?        ?      220.9        3.9       ?       ? 
1 1 1   60    3   27 o     26.2   12.2    0.0000   0.0000          ?        ?   -12.7704  15.3245          ?        ?       26.2       12.2       ?       ? 
1 1 1   60    3   28 o     19.7    9.9    0.0000   0.0000          ?        ?   -42.1424  15.9630          ?        ?       19.7        9.9       ?       ? 
1 1 1   60    3   29 o    173.8    4.6    0.0000   0.0000          ?        ?   303.2978  15.9630          ?        ?      173.8        4.6       ?       ? 
1 1 1   60    3   30 o    154.1    5.2    0.0000   0.0000          ?        ?   238.8071  15.9630          ?        ?      154.1        5.2       ?       ? 
1 1 1   60    3   31 o     69.7   11.0    0.0000   0.0000          ?        ?    49.8047  15.3245          ?        ?       69.7       11.0       ?       ? 
1 1 1   60    4    0 o     32.1   19.1   12.1319  21.0712    12.1319  21.0712    12.1319  21.0712       32.1     19.1       32.1       19.1     0.0     0.0 
1 1 1   60    4    1 o     25.9   12.0    0.0000   0.0000          ?        ?   -12.1319  14.6860          ?        ?       25.9       12.0       ?       ? 
1 1 1   60    4    2 o     83.8    9.5    0.0000   0.0000          ?        ?    70.8759  15.9630          ?        ?       83.8        9.5       ?       ? 
1 1 1   60    4    3 o    239.3    3.7    0.0000   0.0000          ?        ?   573.3925  17.8786          ?        ?      239.3        3.7       ?       ? 
1 1 1   60    4    4 o    197.3    4.0    0.0000   0.0000          ?        ?   390.1367  15.9630          ?        ?      197.3        4.0       ?       ? 
1 1 1   60    4    5 o     47.3   15.4    0.0000   0.0000          ?        ?    22.3483  16.6016          ?        ?       47.3       15.4       ?       ? 
1 1 1   60    4    6 o     98.2    7.5    0.0000   0.0000          ?        ?    97.0553  14.6860          ?        ?       98.2        7.5       ?       ? 
1 1 1   60    4    7 o    354.9    3.6    0.0000   0.0000          ?        ?  1261.7188  25.5409          ?        ?      354.9        3.6       ?       ? 
1 1 1   60    4    8 o    327.8    3.5    0.0000   0.0000          ?        ?  1075.9089  22.9868          ?        ?      327.8        3.5       ?       ? 
1 1 1   60    4    9 o     47.0   15.0    0.0000   0.0000          ?        ?    22.3483  15.9630          ?        ?       47.0       15.0       ?       ? 
1 1 1   60    4   10 o    169.8    4.9    0.0000   0.0000          ?        ?   289.2503  16.6016          ?        ?      169.8        4.9       ?       ? 
1 1 1   60    4   11 o    244.5    3.7    0.0000   0.0000          ?        ?   598.9333  17.8786          ?        ?      244.5        3.7       ?       ? 
1 1 1   60    4   12 o    205.4    4.4    0.0000   0.0000          ?        ?   422.7013  17.8786          ?        ?      205.4        4.4       ?       ? 
1 1 1   60    4   13 o    277.3    3.7    0.0000   0.0000          ?        ?   770.0571  20.4327          ?        ?      277.3        3.7       ?       ? 
1 1 1   60    4   14 o     83.0    9.2    0.0000   0.0000          ?        ?    69.5989  15.3245          ?        ?       83.0        9.2       ?       ? 
1 1 1   60    4   15 o    188.3    4.6    0.0000   0.0000          ?        ?   355.6566  17.2401          ?        ?      188.3        4.6       ?       ? 
1 1 1   60    4   16 o    100.0    8.0    0.0000   0.0000          ?        ?   100.8864  15.9630          ?        ?      100.0        8.0       ?       ? 
1 1 1   60    4   17 o    158.2    5.9    0.0000   0.0000          ?        ?   251.5775  18.5171          ?        ?      158.2        5.9       ?       ? 
1 1 1   60    4   18 o     33.3   14.2    0.0000   0.0000          ?        ?     0.6385  16.6016          ?        ?       33.3       14.2       ?       ? 
1 1 1   60    4   19 o    140.3    6.4    0.0000   0.0000          ?        ?   197.9417  17.8786          ?        ?      140.3        6.4       ?       ? 
1 1 1   60    4   20 o     74.7   11.1    0.0000   0.0000          ?        ?    56.8284  16.6016          ?        ?       74.7       11.1       ?       ? 
1 1 1   60    4   21 o    276.4    3.1    0.0000   0.0000          ?        ?   764.9489  17.2401          ?        ?      276.4        3.1       ?       ? 
1 1 1   60    4   22 o    210.9    3.9    0.0000   0.0000          ?        ?   445.6881  16.6016          ?        ?      210.9        3.9       ?       ? 
1 1 1   60    4   23 o    164.6    4.8    0.0000   0.0000          ?        ?   272.0102  15.9630          ?        ?      164.6        4.8       ?       ? 
1 1 1   60    4   24 o    188.4    4.6    0.0000   0.0000          ?        ?   356.2951  17.2401          ?        ?      188.4        4.6       ?       ? 
1 1 1   60    4   25 o     79.6   10.0    0.0000   0.0000          ?        ?    64.4907  15.9630          ?        ?       79.6       10.0       ?       ? 
1 1 1   60    4   26 o    171.2    4.7    0.0000   0.0000          ?        ?   294.3585  15.9630          ?        ?      171.2        4.7       ?       ? 
1 1 1   60    4   27 o    124.6    6.1    0.0000   0.0000          ?        ?   156.4378  15.3245          ?        ?      124.6        6.1       ?       ? 
1 1 1   60    4   28 o     88.0    8.7    0.0000   0.0000          ?        ?    78.5382  15.3245          ?        ?       88.0        8.7       ?       ? 
1 1 1   60    4   29 o     34.1   13.8    0.0000   0.0000          ?        ?     5.7467  14.6860          ?        ?       34.1       13.8       ?       ? 
1 1 1   60    5    0 o     57.9   19.7   44.0580  20.4327    44.0580  20.4327    44.0580  20.4327       57.9     19.7       57.9       19.7     0.0     0.0 
1 1 1   60    5    1 o     74.1   10.3    0.0000   0.0000          ?        ?    55.5514  15.3245          ?        ?       74.1       10.3       ?       ? 
1 1 1   60    5    2 o    191.6    4.2    0.0000   0.0000          ?        ?   367.7885  15.9630          ?        ?      191.6        4.2       ?       ? 
1 1 1   60    5    3 o    340.5    3.4    0.0000   0.0000          ?        ?  1160.8323  22.9868          ?        ?      340.5        3.4       ?       ? 
1 1 1   60    5    4 f    276.9    3.6    0.0000   0.0000          ?        ?   768.1415  19.7942          ?        ?      276.9        3.6       ?       ? 
1 1 1   60    5    5 o    126.5    6.3    0.0000   0.0000          ?        ?   160.9075  15.9630          ?        ?      126.5        6.3       ?       ? 
1 1 1   60    5    6 f    116.0    6.9    0.0000   0.0000          ?        ?   135.3666  15.9630          ?        ?      116.0        6.9       ?       ? 
1 1 1   60    5    7 f    154.7    5.0    0.0000   0.0000          ?        ?   240.0841  15.3245          ?        ?      154.7        5.0       ?       ? 
1 1 1   60    5    8 o     58.1   13.0    0.0000   0.0000          ?        ?    35.7572  14.6860          ?        ?       58.1       13.0       ?       ? 
1 1 1   60    5    9 o    106.3    7.2    0.0000   0.0000          ?        ?   113.6568  15.3245          ?        ?      106.3        7.2       ?       ? 
1 1 1   60    5   10 o    200.0    4.1    0.0000   0.0000          ?        ?   400.9916  16.6016          ?        ?      200.0        4.1       ?       ? 
1 1 1   60    5   11 o     57.5   13.5    0.0000   0.0000          ?        ?    35.1187  15.3245          ?        ?       57.5       13.5       ?       ? 
1 1 1   60    5   12 o    219.0    4.1    0.0000   0.0000          ?        ?   480.8068  17.8786          ?        ?      219.0        4.1       ?       ? 
1 1 1   60    5   13 o    313.7    3.5    0.0000   0.0000          ?        ?   985.8774  21.7097          ?        ?      313.7        3.5       ?       ? 
1 1 1   60    5   14 o    104.7    7.9    0.0000   0.0000          ?        ?   110.4642  16.6016          ?        ?      104.7        7.9       ?       ? 
1 1 1   60    5   15 o     54.3   15.3    0.0000   0.0000          ?        ?    31.2876  17.2401          ?        ?       54.3       15.3       ?       ? 
1 1 1   60    5   16 f     52.7   15.0    0.0000   0.0000          ?        ?    29.3720  16.6016          ?        ?       52.7       15.0       ?       ? 
1 1 1   60    5   17 o    175.5    5.1    0.0000   0.0000          ?        ?   309.0445  17.8786          ?        ?      175.5        5.1       ?       ? 
1 1 1   60    5   18 o     83.6    9.9    0.0000   0.0000          ?        ?    70.8759  16.6016          ?        ?       83.6        9.9       ?       ? 
1 1 1   60    5   19 o     86.6    9.2    0.0000   0.0000          ?        ?    75.9841  15.9630          ?        ?       86.6        9.2       ?       ? 
1 1 1   60    5   20 o     21.6   10.5    0.0000   0.0000          ?        ?   -26.1794  14.6860          ?        ?       21.6       10.5       ?       ? 
1 1 1   60    5   21 o     92.9    9.3    0.0000   0.0000          ?        ?    87.4775  17.2401          ?        ?       92.9        9.3       ?       ? 
1 1 1   60    5   22 o     59.3   13.7    0.0000   0.0000          ?        ?    37.6728  15.9630          ?        ?       59.3       13.7       ?       ? 
1 1 1   60    5   23 o    161.1    5.0    0.0000   0.0000          ?        ?   260.5168  15.9630          ?        ?      161.1        5.0       ?       ? 
1 1 1   60    5   24 o     34.3   14.2    0.0000   0.0000          ?        ?     3.8311  15.9630          ?        ?       34.3       14.2       ?       ? 
1 1 1   60    5   25 o     19.5    9.8    0.0000   0.0000          ?        ?   -43.4195  15.9630          ?        ?       19.5        9.8       ?       ? 
1 1 1   60    5   26 o     22.5   11.0    0.0000   0.0000          ?        ?   -28.0950  15.9630          ?        ?       22.5       11.0       ?       ? 
1 1 1   60    5   27 f    193.8    4.0    0.0000   0.0000          ?        ?   376.7278  15.3245          ?        ?      193.8        4.0       ?       ? 
1 1 1   60    6    0 o     95.7   10.9   95.7782  20.4327    95.7782  20.4327    95.7782  20.4327       95.7     10.9       95.7       10.9     0.0     0.0 
1 1 1   60    6    1 o    166.2    4.8    0.0000   0.0000          ?        ?   277.1184  15.9630          ?        ?      166.2        4.8       ?       ? 
1 1 1   60    6    2 o    104.5    6.7    0.0000   0.0000          ?        ?   109.8257  14.0475          ?        ?      104.5        6.7       ?       ? 
1 1 1   60    6    3 o    323.4    3.3    0.0000   0.0000          ?        ?  1047.1754  21.0712          ?        ?      323.4        3.3       ?       ? 
1 1 1   60    6    4 o    159.2    4.8    0.0000   0.0000          ?        ?   254.1316  15.3245          ?        ?      159.2        4.8       ?       ? 
1 1 1   60    6    5 f    240.1    3.6    0.0000   0.0000          ?        ?   577.2236  17.2401          ?        ?      240.1        3.6       ?       ? 
1 1 1   60    6    6 o     84.5    8.7    0.0000   0.0000          ?        ?    72.1529  14.6860          ?        ?       84.5        8.7       ?       ? 
1 1 1   60    6    7 o    101.6    7.5    0.0000   0.0000          ?        ?   104.0790  15.3245          ?        ?      101.6        7.5       ?       ? 
1 1 1   60    6    8 o    334.2    3.2    0.0000   0.0000          ?        ?  1118.6898  21.7097          ?        ?      334.2        3.2       ?       ? 
1 1 1   60    6    9 o    136.5    5.6    0.0000   0.0000          ?        ?   187.0868  15.3245          ?        ?      136.5        5.6       ?       ? 
1 1 1   60    6   10 o    162.1    5.5    0.0000   0.0000          ?        ?   263.7094  17.8786          ?        ?      162.1        5.5       ?       ? 
1 1 1   60    6   11 o     96.2   10.0    0.0000   0.0000          ?        ?    93.8627  19.1556          ?        ?       96.2       10.0       ?       ? 
1 1 1   60    6   12 o    231.7    4.1    0.0000   0.0000          ?        ?   538.2737  19.1556          ?        ?      231.7        4.1       ?       ? 
1 1 1   60    6   13 o    104.1    7.4    0.0000   0.0000          ?        ?   109.1872  15.3245          ?        ?      104.1        7.4       ?       ? 
1 1 1   60    6   14 o    100.6    7.6    0.0000   0.0000          ?        ?   102.1635  15.3245          ?        ?      100.6        7.6       ?       ? 
1 1 1   60    6   15 o    222.7    4.3    0.0000   0.0000          ?        ?   497.4084  19.1556          ?        ?      222.7        4.3       ?       ? 
1 1 1   60    6   16 o    170.7    5.1    0.0000   0.0000          ?        ?   292.4429  17.2401          ?        ?      170.7        5.1       ?       ? 
1 1 1   60    6   17 o     22.1   10.8    0.0000   0.0000          ?        ?   -30.0105  15.9630          ?        ?       22.1       10.8       ?       ? 
1 1 1   60    6   18 o    205.0    5.1    0.0000   0.0000          ?        ?   422.0628  21.0712          ?        ?      205.0        5.1       ?       ? 
1 1 1   60    6   19 o     73.9   13.9    0.0000   0.0000          ?        ?    58.1055  19.7942          ?        ?       73.9       13.9       ?       ? 
1 1 1   60    6   20 o    129.4    6.2    0.0000   0.0000          ?        ?   168.5697  15.9630          ?        ?      129.4        6.2       ?       ? 
1 1 1   60    6   21 o    238.2    3.9    0.0000   0.0000          ?        ?   568.9227  18.5171          ?        ?      238.2        3.9       ?       ? 
1 1 1   60    6   22 o    189.9    4.9    0.0000   0.0000          ?        ?   362.0418  18.5171          ?        ?      189.9        4.9       ?       ? 
1 1 1   60    6   23 o     25.5   12.0    0.0000   0.0000          ?        ?   -14.6860  15.3245          ?        ?       25.5       12.0       ?       ? 
1 1 1   60    6   24 o    235.9    3.8    0.0000   0.0000          ?        ?   558.0679  17.8786          ?        ?      235.9        3.8       ?       ? 
1 1 1   60    6   25 o    118.0    6.8    0.0000   0.0000          ?        ?   140.4748  15.9630          ?        ?      118.0        6.8       ?       ? 
1 1 1   60    7    0 o    277.8    5.2  773.8882  28.7335   773.8882  28.7335   773.8882  28.7335      277.8      5.2      277.8        5.2     0.0     0.0 
1 1 1   60    7    1 o    174.8    4.7    0.0000   0.0000          ?        ?   306.4904  16.6016          ?        ?      174.8        4.7       ?       ? 
1 1 1   60    7    2 o     50.9   14.0    0.0000   0.0000          ?        ?    27.4564  14.6860          ?        ?       50.9       14.0       ?       ? 
1 1 1   60    7    3 o     94.5    7.4    0.0000   0.0000          ?        ?    90.0316  14.0475          ?        ?       94.5        7.4       ?       ? 
1 1 1   60    7    4 o     18.5    9.2    0.0000   0.0000          ?        ?   -33.8416  13.4090          ?        ?       18.5        9.2       ?       ? 
1 1 1   60    7    5 o    120.0    6.4    0.0000   0.0000          ?        ?   144.9444  15.3245          ?        ?      120.0        6.4       ?       ? 
1 1 1   60    7    6 o    178.9    4.6    0.0000   0.0000          ?        ?   321.1764  16.6016          ?        ?      178.9        4.6       ?       ? 
1 1 1   60    7    7 o     86.4    8.5    0.0000   0.0000          ?        ?    75.3456  14.6860          ?        ?       86.4        8.5       ?       ? 
1 1 1   60    7    8 o    137.6    5.6    0.0000   0.0000          ?        ?   190.2794  15.3245          ?        ?      137.6        5.6       ?       ? 
1 1 1   60    7    9 o    129.0    5.9    0.0000   0.0000          ?        ?   167.2927  15.3245          ?        ?      129.0        5.9       ?       ? 
1 1 1   60    7   10 f     93.7    8.2    0.0000   0.0000          ?        ?    88.7545  15.3245          ?        ?       93.7        8.2       ?       ? 
1 1 1   60    7   11 o    120.0    8.2    0.0000   0.0000          ?        ?   145.5829  19.7942          ?        ?      120.0        8.2       ?       ? 
1 1 1   60    7   12 o     27.7   12.6    0.0000   0.0000          ?        ?    -8.9393  15.3245          ?        ?       27.7       12.6       ?       ? 
1 1 1   60    7   13 o    147.6    5.4    0.0000   0.0000          ?        ?   219.0129  15.9630          ?        ?      147.6        5.4       ?       ? 
1 1 1   60    7   14 f    198.2    4.5    0.0000   0.0000          ?        ?   393.9678  17.8786          ?        ?      198.2        4.5       ?       ? 
1 1 1   60    7   15 o    256.5    4.0    0.0000   0.0000          ?        ?   659.5928  20.4327          ?        ?      256.5        4.0       ?       ? 
1 1 1   60    7   16 o    142.0    6.3    0.0000   0.0000          ?        ?   203.0499  17.8786          ?        ?      142.0        6.3       ?       ? 
1 1 1   60    7   17 o     39.8   15.1    0.0000   0.0000          ?        ?    12.1319  16.6016          ?        ?       39.8       15.1       ?       ? 
1 1 1   60    7   18 o    127.7    7.5    0.0000   0.0000          ?        ?   164.7386  19.1556          ?        ?      127.7        7.5       ?       ? 
1 1 1   60    7   19 o    141.4    5.6    0.0000   0.0000          ?        ?   201.1343  15.9630          ?        ?      141.4        5.6       ?       ? 
1 1 1   60    7   20 o     63.4   14.9    0.0000   0.0000          ?        ?    43.4195  18.5171          ?        ?       63.4       14.9       ?       ? 
1 1 1   60    7   21 o     48.2   15.9    0.0000   0.0000          ?        ?    23.6253  17.8786          ?        ?       48.2       15.9       ?       ? 
1 1 1   60    7   22 o    199.4    4.5    0.0000   0.0000          ?        ?   399.0760  17.8786          ?        ?      199.4        4.5       ?       ? 
1 1 1   60    7   23 o     93.8    8.9    0.0000   0.0000          ?        ?    89.3930  16.6016          ?        ?       93.8        8.9       ?       ? 
1 1 1   60    8    0 o     71.5   15.9   58.7440  19.7942    58.7440  19.7942    58.7440  19.7942       71.5     15.9       71.5       15.9     0.0     0.0 
1 1 1   60    8    1 o    197.3    4.0    0.0000   0.0000          ?        ?   390.1367  15.9630          ?        ?      197.3        4.0       ?       ? 
1 1 1   60    8    2 o    172.0    4.6    0.0000   0.0000          ?        ?   296.9126  15.9630          ?        ?      172.0        4.6       ?       ? 
1 1 1   60    8    3 o     76.6    9.2    0.0000   0.0000          ?        ?    59.3825  14.0475          ?        ?       76.6        9.2       ?       ? 
1 1 1   60    8    4 o    128.1    5.5    0.0000   0.0000          ?        ?   164.7386  14.0475          ?        ?      128.1        5.5       ?       ? 
1 1 1   60    8    5 o    132.0    5.1    0.0000   0.0000          ?        ?   174.9549  13.4090          ?        ?      132.0        5.1       ?       ? 
1 1 1   60    8    6 o    155.9    4.5    0.0000   0.0000          ?        ?   243.9153  14.0475          ?        ?      155.9        4.5       ?       ? 
1 1 1   60    8    7 o    317.3    3.7    0.0000   0.0000          ?        ?  1008.8642  23.6253          ?        ?      317.3        3.7       ?       ? 
1 1 1   60    8    8 o    118.6    6.7    0.0000   0.0000          ?        ?   141.7518  15.9630          ?        ?      118.6        6.7       ?       ? 
1 1 1   60    8    9 o     94.0    8.1    0.0000   0.0000          ?        ?    89.3930  15.3245          ?        ?       94.0        8.1       ?       ? 
1 1 1   60    8   10 o     40.0   14.1    0.0000   0.0000          ?        ?    14.6860  14.0475          ?        ?       40.0       14.1       ?       ? 
1 1 1   60    8   11 o    118.1    6.2    0.0000   0.0000          ?        ?   140.4748  14.6860          ?        ?      118.1        6.2       ?       ? 
1 1 1   60    8   12 o     41.2   14.7    0.0000   0.0000          ?        ?    15.3245  15.3245          ?        ?       41.2       14.7       ?       ? 
1 1 1   60    8   13 o     66.2   13.0    0.0000   0.0000          ?        ?    46.6121  16.6016          ?        ?       66.2       13.0       ?       ? 
1 1 1   60    8   14 o    114.7    7.2    0.0000   0.0000          ?        ?   132.8125  16.6016          ?        ?      114.7        7.2       ?       ? 
1 1 1   60    8   15 o    152.8    5.8    0.0000   0.0000          ?        ?   234.9760  17.8786          ?        ?      152.8        5.8       ?       ? 
1 1 1   60    8   16 o    248.4    4.0    0.0000   0.0000          ?        ?   618.7275  19.7942          ?        ?      248.4        4.0       ?       ? 
1 1 1   60    8   17 o    342.7    3.5    0.0000   0.0000          ?        ?  1177.4338  24.2638          ?        ?      342.7        3.5       ?       ? 
1 1 1   60    8   18 o    297.5    3.3    0.0000   0.0000          ?        ?   886.9065  19.7942          ?        ?      297.5        3.3       ?       ? 
1 1 1   60    8   19 o    118.9    7.8    0.0000   0.0000          ?        ?   143.0288  18.5171          ?        ?      118.9        7.8       ?       ? 
1 1 1   60    8   20 o    143.8    5.8    0.0000   0.0000          ?        ?   208.1580  16.6016          ?        ?      143.8        5.8       ?       ? 
1 1 1   60    9    0 o     99.3    9.8  102.1635  19.1556   102.1635  19.1556   102.1635  19.1556       99.3      9.8       99.3        9.8     0.0     0.0 
1 1 1   60    9    1 o    146.6    5.0    0.0000   0.0000          ?        ?   215.8203  14.6860          ?        ?      146.6        5.0       ?       ? 
1 1 1   60    9    2 o    254.4    3.5    0.0000   0.0000          ?        ?   648.7380  17.8786          ?        ?      254.4        3.5       ?       ? 
1 1 1   60    9    3 o    125.7    6.1    0.0000   0.0000          ?        ?   158.9919  15.3245          ?        ?      125.7        6.1       ?       ? 
1 1 1   60    9    4 o    144.2    4.9    0.0000   0.0000          ?        ?   208.7966  14.0475          ?        ?      144.2        4.9       ?       ? 
1 1 1   60    9    5 o     84.9    7.9    0.0000   0.0000          ?        ?    72.7915  13.4090          ?        ?       84.9        7.9       ?       ? 
1 1 1   60    9    6 o    171.5    4.5    0.0000   0.0000          ?        ?   294.9970  15.3245          ?        ?      171.5        4.5       ?       ? 
1 1 1   60    9    7 o     97.1    7.2    0.0000   0.0000          ?        ?    95.1397  14.0475          ?        ?       97.1        7.2       ?       ? 
1 1 1   60    9    8 o    275.2    3.5    0.0000   0.0000          ?        ?   759.2022  19.1556          ?        ?      275.2        3.5       ?       ? 
1 1 1   60    9    9 o     97.7    7.5    0.0000   0.0000          ?        ?    96.4168  14.6860          ?        ?       97.7        7.5       ?       ? 
1 1 1   60    9   10 o    234.0    3.8    0.0000   0.0000          ?        ?   549.1286  17.8786          ?        ?      234.0        3.8       ?       ? 
1 1 1   60    9   11 o    281.8    3.9    0.0000   0.0000          ?        ?   796.2365  21.7097          ?        ?      281.8        3.9       ?       ? 
1 1 1   60    9   12 o    214.8    4.0    0.0000   0.0000          ?        ?   462.9282  17.2401          ?        ?      214.8        4.0       ?       ? 
1 1 1   60    9   13 o    127.1    6.3    0.0000   0.0000          ?        ?   162.8230  15.9630          ?        ?      127.1        6.3       ?       ? 
1 1 1   60    9   14 o    130.5    6.9    0.0000   0.0000          ?        ?   171.7623  17.8786          ?        ?      130.5        6.9       ?       ? 
1 1 1   60    9   15 o    319.9    3.5    0.0000   0.0000          ?        ?  1026.1042  22.3483          ?        ?      319.9        3.5       ?       ? 
1 1 1   60    9   16 o     70.2   10.9    0.0000   0.0000          ?        ?    50.4432  15.3245          ?        ?       70.2       10.9       ?       ? 
1 1 1   60    9   17 o     71.8   11.6    0.0000   0.0000          ?        ?    52.9973  16.6016          ?        ?       71.8       11.6       ?       ? 
1 1 1   60   10    0 o     31.4   17.7   14.0475  16.6016    14.0475  16.6016    14.0475  16.6016       31.4     17.7       31.4       17.7     0.0     0.0 
1 1 1   60   10    1 o     33.6   13.6    0.0000   0.0000          ?        ?     5.7467  14.0475          ?        ?       33.6       13.6       ?       ? 
1 1 1   60   10    2 o     39.4   14.1    0.0000   0.0000          ?        ?    14.0475  14.0475          ?        ?       39.4       14.1       ?       ? 
1 1 1   60   10    3 o    181.0    4.4    0.0000   0.0000          ?        ?   328.8386  15.9630          ?        ?      181.0        4.4       ?       ? 
1 1 1   60   10    4 o     57.9   12.5    0.0000   0.0000          ?        ?    35.7572  14.0475          ?        ?       57.9       12.5       ?       ? 
1 1 1   60   10    5 o     28.1   12.5    0.0000   0.0000          ?        ?    -4.4697  14.0475          ?        ?       28.1       12.5       ?       ? 
1 1 1   60   10    6 o    233.4    4.4    0.0000   0.0000          ?        ?   546.5745  20.4327          ?        ?      233.4        4.4       ?       ? 
1 1 1   60   10    7 o    171.7    5.0    0.0000   0.0000          ?        ?   296.2740  17.2401          ?        ?      171.7        5.0       ?       ? 
1 1 1   60   10    8 o    236.9    3.8    0.0000   0.0000          ?        ?   562.5375  17.8786          ?        ?      236.9        3.8       ?       ? 
1 1 1   60   10    9 o    169.0    4.5    0.0000   0.0000          ?        ?   286.6962  15.3245          ?        ?      169.0        4.5       ?       ? 
1 1 1   60   10   10 o    166.9    4.6    0.0000   0.0000          ?        ?   279.6725  15.3245          ?        ?      166.9        4.6       ?       ? 
1 1 1   60   10   11 o    199.3    4.2    0.0000   0.0000          ?        ?   398.4375  16.6016          ?        ?      199.3        4.2       ?       ? 
1 1 1   60   10   12 o     21.4   10.4    0.0000   0.0000          ?        ?   -23.6253  14.0475          ?        ?       21.4       10.4       ?       ? 
1 1 1   60   10   13 o    160.3    4.6    0.0000   0.0000          ?        ?   257.9627  14.6860          ?        ?      160.3        4.6       ?       ? 
1 1 1   60   10   14 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   60   11    0 o     54.3   18.4   38.9498  17.8786    38.9498  17.8786    38.9498  17.8786       54.3     18.4       54.3       18.4     0.0     0.0 
1 1 1   60   11    1 o    151.0    4.9    0.0000   0.0000          ?        ?   229.2293  14.6860          ?        ?      151.0        4.9       ?       ? 
1 1 1   60   11    2 o    283.8    3.1    0.0000   0.0000          ?        ?   807.0914  17.8786          ?        ?      283.8        3.1       ?       ? 
1 1 1   60   11    3 f    122.0    4.7    0.0000   0.0000          ?        ?   149.4141  11.4934          ?        ?      122.0        4.7       ?       ? 
1 1 1   60   11    4 o     21.5   10.4    0.0000   0.0000          ?        ?   -20.4327  13.4090          ?        ?       21.5       10.4       ?       ? 
1 1 1   60   11    5 o    114.0    6.2    0.0000   0.0000          ?        ?   130.8969  14.0475          ?        ?      114.0        6.2       ?       ? 
1 1 1   60   11    6 o     55.1   12.5    0.0000   0.0000          ?        ?    32.5646  13.4090          ?        ?       55.1       12.5       ?       ? 
1 1 1   60   11    7 o     20.7   10.0    0.0000   0.0000          ?        ?   -20.4327  12.7704          ?        ?       20.7       10.0       ?       ? 
1 1 1   60   11    8 o    233.0    3.7    0.0000   0.0000          ?        ?   544.6590  17.2401          ?        ?      233.0        3.7       ?       ? 
1 1 1   61    0    0 o    160.7   10.0  261.7939  31.9261   261.7939  31.9261   261.7939  31.9261      160.7     10.0      160.7       10.0     0.0     0.0 
1 1 1   61    0    1 o    396.7    4.6 1575.8713  36.3957  1575.8713  36.3957  1575.8713  36.3957      396.7      4.6      396.7        4.6     0.0     0.0 
1 1 1   61    0    2 f    102.7   10.5  109.1872  21.0712   109.1872  21.0712   109.1872  21.0712      102.7     10.5      102.7       10.5     0.0     0.0 
1 1 1   61    0    3 o    190.1    6.1  363.3188  22.9868   363.3188  22.9868   363.3188  22.9868      190.1      6.1      190.1        6.1     0.0     0.0 
1 1 1   61    0    4 o     17.3   12.5  -30.0105  19.7942   -30.0105  19.7942   -30.0105  19.7942       17.3     12.5       17.3       12.5     0.0     0.0 
1 1 1   61    0    5 o    281.2    5.5  793.0438  30.6490   793.0438  30.6490   793.0438  30.6490      281.2      5.5      281.2        5.5     0.0     0.0 
1 1 1   61    0    6 o    281.0    4.5  791.1283  25.5409   791.1283  25.5409   791.1283  25.5409      281.0      4.5      281.0        4.5     0.0     0.0 
1 1 1   61    0    7 o    267.4    4.8  716.4213  25.5409   716.4213  25.5409   716.4213  25.5409      267.4      4.8      267.4        4.8     0.0     0.0 
1 1 1   61    0    8 o    377.2    4.2 1424.5417  31.9261  1424.5417  31.9261  1424.5417  31.9261      377.2      4.2      377.2        4.2     0.0     0.0 
1 1 1   61    0    9 o    398.4    5.1 1589.9188  40.2269  1589.9188  40.2269  1589.9188  40.2269      398.4      5.1      398.4        5.1     0.0     0.0 
1 1 1   61    0   10 o     26.9   18.1   -7.0237  26.1794    -7.0237  26.1794    -7.0237  26.1794       26.9     18.1       26.9       18.1     0.0     0.0 
1 1 1   61    0   11 f     26.0   17.7  -11.4934  26.8179   -11.4934  26.8179   -11.4934  26.8179       26.0     17.7       26.0       17.7     0.0     0.0 
1 1 1   61    0   12 o    338.9    4.1 1149.9775  28.0950  1149.9775  28.0950  1149.9775  28.0950      338.9      4.1      338.9        4.1     0.0     0.0 
1 1 1   61    0   13 o    155.8    8.7  245.8308  26.8179   245.8308  26.8179   245.8308  26.8179      155.8      8.7      155.8        8.7     0.0     0.0 
1 1 1   61    0   14 o    374.6    5.9 1407.3016  44.0580  1407.3016  44.0580  1407.3016  44.0580      374.6      5.9      374.6        5.9     0.0     0.0 
1 1 1   61    0   15 o    200.7    5.9  404.8227  23.6253   404.8227  23.6253   404.8227  23.6253      200.7      5.9      200.7        5.9     0.0     0.0 
1 1 1   61    0   16 o     66.0   19.5   54.2743  22.3483    54.2743  22.3483    54.2743  22.3483       66.0     19.5       66.0       19.5     0.0     0.0 
1 1 1   61    0   17 o    400.8    4.5 1609.0745  36.3957  1609.0745  36.3957  1609.0745  36.3957      400.8      4.5      400.8        4.5     0.0     0.0 
1 1 1   61    0   18 o    116.2    9.8  138.5592  22.3483   138.5592  22.3483   138.5592  22.3483      116.2      9.8      116.2        9.8     0.0     0.0 
1 1 1   61    0   19 o    429.3    5.0 1846.6046  42.7809  1846.6046  42.7809  1846.6046  42.7809      429.3      5.0      429.3        5.0     0.0     0.0 
1 1 1   61    0   20 o    211.9    6.5  451.4348  27.4564   451.4348  27.4564   451.4348  27.4564      211.9      6.5      211.9        6.5     0.0     0.0 
1 1 1   61    0   21 o     29.7   18.0    9.5778  19.1556     9.5778  19.1556     9.5778  19.1556       29.7     18.0       29.7       18.0     0.0     0.0 
1 1 1   61    0   22 o     59.8   21.2   47.8891  22.9868    47.8891  22.9868    47.8891  22.9868       59.8     21.2       59.8       21.2     0.0     0.0 
1 1 1   61    0   23 o    246.5    4.9  609.1497  24.2638   609.1497  24.2638   609.1497  24.2638      246.5      4.9      246.5        4.9     0.0     0.0 
1 1 1   61    0   24 o    131.0    8.9  174.9549  22.9868   174.9549  22.9868   174.9549  22.9868      131.0      8.9      131.0        8.9     0.0     0.0 
1 1 1   61    0   25 o     80.4   13.8   70.2374  20.4327    70.2374  20.4327    70.2374  20.4327       80.4     13.8       80.4       13.8     0.0     0.0 
1 1 1   61    0   26 o    233.4    5.1  546.5745  23.6253   546.5745  23.6253   546.5745  23.6253      233.4      5.1      233.4        5.1     0.0     0.0 
1 1 1   61    0   27 o    336.4    4.2 1134.0144  28.0950  1134.0144  28.0950  1134.0144  28.0950      336.4      4.2      336.4        4.2     0.0     0.0 
1 1 1   61    0   28 o     44.3   21.6   30.0105  22.3483    30.0105  22.3483    30.0105  22.3483       44.3     21.6       44.3       21.6     0.0     0.0 
1 1 1   61    0   29 o     34.3   19.9   15.9630  21.7097    15.9630  21.7097    15.9630  21.7097       34.3     19.9       34.3       19.9     0.0     0.0 
1 1 1   61    0   30 o     90.0   12.8   84.9234  22.3483    84.9234  22.3483    84.9234  22.3483       90.0     12.8       90.0       12.8     0.0     0.0 
1 1 1   61    0   31 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   61    0   32 o     93.2   12.5   90.0316  22.9868    90.0316  22.9868    90.0316  22.9868       93.2     12.5       93.2       12.5     0.0     0.0 
1 1 1   61    0   33 o     16.6   12.2  -45.3350  22.3483   -45.3350  22.3483   -45.3350  22.3483       16.6     12.2       16.6       12.2     0.0     0.0 
1 1 1   61    1    0 o    489.1    5.7 2397.0103  56.1899  2397.0103  56.1899  2397.0103  56.1899      489.1      5.7      489.1        5.7     0.0     0.0 
1 1 1   61    1    1 o    228.8    4.2    0.0000   0.0000          ?        ?   524.2263  19.1556          ?        ?      228.8        4.2       ?       ? 
1 1 1   61    1    2 o    145.4    5.3    0.0000   0.0000          ?        ?   211.9892  15.3245          ?        ?      145.4        5.3       ?       ? 
1 1 1   61    1    3 o    166.8    4.8    0.0000   0.0000          ?        ?   279.0340  15.9630          ?        ?      166.8        4.8       ?       ? 
1 1 1   61    1    4 o     25.9   12.2    0.0000   0.0000          ?        ?   -18.5171  16.6016          ?        ?       25.9       12.2       ?       ? 
1 1 1   61    1    5 o     38.3   14.5    0.0000   0.0000          ?        ?    10.8549  15.3245          ?        ?       38.3       14.5       ?       ? 
1 1 1   61    1    6 o    310.1    4.2    0.0000   0.0000          ?        ?   963.5291  26.1794          ?        ?      310.1        4.2       ?       ? 
1 1 1   61    1    7 o     47.8   15.3    0.0000   0.0000          ?        ?    22.9868  16.6016          ?        ?       47.8       15.3       ?       ? 
1 1 1   61    1    8 o    158.8    5.2    0.0000   0.0000          ?        ?   252.8546  16.6016          ?        ?      158.8        5.2       ?       ? 
1 1 1   61    1    9 o    366.5    3.5    0.0000   0.0000          ?        ?  1344.7266  25.5409          ?        ?      366.5        3.5       ?       ? 
1 1 1   61    1   10 o    343.1    3.7    0.0000   0.0000          ?        ?  1178.7109  25.5409          ?        ?      343.1        3.7       ?       ? 
1 1 1   61    1   11 o    321.3    3.7    0.0000   0.0000          ?        ?  1033.7665  23.6253          ?        ?      321.3        3.7       ?       ? 
1 1 1   61    1   12 o    398.2    3.4    0.0000   0.0000          ?        ?  1587.3647  26.8179          ?        ?      398.2        3.4       ?       ? 
1 1 1   61    1   13 o    248.6    4.1    0.0000   0.0000          ?        ?   619.3660  20.4327          ?        ?      248.6        4.1       ?       ? 
1 1 1   61    1   14 o    117.2    6.3    0.0000   0.0000          ?        ?   137.9207  14.6860          ?        ?      117.2        6.3       ?       ? 
1 1 1   61    1   15 o    252.7    4.2    0.0000   0.0000          ?        ?   639.7986  21.0712          ?        ?      252.7        4.2       ?       ? 
1 1 1   61    1   16 o    363.1    2.9    0.0000   0.0000          ?        ?  1319.8242  21.0712          ?        ?      363.1        2.9       ?       ? 
1 1 1   61    1   17 o    179.9    4.6    0.0000   0.0000          ?        ?   324.3690  16.6016          ?        ?      179.9        4.6       ?       ? 
1 1 1   61    1   18 o     49.6   15.9    0.0000   0.0000          ?        ?    24.9023  17.8786          ?        ?       49.6       15.9       ?       ? 
1 1 1   61    1   19 o    193.6    4.9    0.0000   0.0000          ?        ?   376.0892  19.1556          ?        ?      193.6        4.9       ?       ? 
1 1 1   61    1   20 o    310.7    3.4    0.0000   0.0000          ?        ?   966.7217  21.0712          ?        ?      310.7        3.4       ?       ? 
1 1 1   61    1   21 o    290.2    3.3    0.0000   0.0000          ?        ?   843.4871  19.1556          ?        ?      290.2        3.3       ?       ? 
1 1 1   61    1   22 o    150.2    6.0    0.0000   0.0000          ?        ?   226.6752  17.8786          ?        ?      150.2        6.0       ?       ? 
1 1 1   61    1   23 o    419.5    2.7    0.0000   0.0000          ?        ?  1761.6812  22.9868          ?        ?      419.5        2.7       ?       ? 
1 1 1   61    1   24 o    169.8    4.5    0.0000   0.0000          ?        ?   289.2503  15.3245          ?        ?      169.8        4.5       ?       ? 
1 1 1   61    1   25 o    159.7    4.6    0.0000   0.0000          ?        ?   256.0471  14.6860          ?        ?      159.7        4.6       ?       ? 
1 1 1   61    1   26 o     28.3   12.6    0.0000   0.0000          ?        ?    -5.7467  14.6860          ?        ?       28.3       12.6       ?       ? 
1 1 1   61    1   27 f     93.3    8.2    0.0000   0.0000          ?        ?    88.1160  15.3245          ?        ?       93.3        8.2       ?       ? 
1 1 1   61    1   28 o    122.3    6.5    0.0000   0.0000          ?        ?   150.6911  15.9630          ?        ?      122.3        6.5       ?       ? 
1 1 1   61    1   29 o     20.5   10.2    0.0000   0.0000          ?        ?   -37.6728  15.9630          ?        ?       20.5       10.2       ?       ? 
1 1 1   61    1   30 o    193.9    4.4    0.0000   0.0000          ?        ?   377.3663  17.2401          ?        ?      193.9        4.4       ?       ? 
1 1 1   61    1   31 o    229.1    3.6    0.0000   0.0000          ?        ?   526.1418  16.6016          ?        ?      229.1        3.6       ?       ? 
1 1 1   61    2    0 o    375.5    4.7 1412.4098  35.1187  1412.4098  35.1187  1412.4098  35.1187      375.5      4.7      375.5        4.7     0.0     0.0 
1 1 1   61    2    1 o    332.4    3.6    0.0000   0.0000          ?        ?  1106.5580  23.6253          ?        ?      332.4        3.6       ?       ? 
1 1 1   61    2    2 o    148.8    5.4    0.0000   0.0000          ?        ?   222.2055  15.9630          ?        ?      148.8        5.4       ?       ? 
1 1 1   61    2    3 o    197.0    4.5    0.0000   0.0000          ?        ?   388.8597  17.8786          ?        ?      197.0        4.5       ?       ? 
1 1 1   61    2    4 o    355.3    3.3    0.0000   0.0000          ?        ?  1264.2728  23.6253          ?        ?      355.3        3.3       ?       ? 
1 1 1   61    2    5 o    268.2    3.5    0.0000   0.0000          ?        ?   720.2524  18.5171          ?        ?      268.2        3.5       ?       ? 
1 1 1   61    2    6 f     89.6    9.3    0.0000   0.0000          ?        ?    81.0922  16.6016          ?        ?       89.6        9.3       ?       ? 
1 1 1   61    2    7 o    189.9    4.7    0.0000   0.0000          ?        ?   361.4032  17.8786          ?        ?      189.9        4.7       ?       ? 
1 1 1   61    2    8 o     34.7   14.5    0.0000   0.0000          ?        ?     3.1926  16.6016          ?        ?       34.7       14.5       ?       ? 
1 1 1   61    2    9 o    259.8    4.7    0.0000   0.0000          ?        ?   676.8329  24.2638          ?        ?      259.8        4.7       ?       ? 
1 1 1   61    2   10 o     49.6   14.9    0.0000   0.0000          ?        ?    25.5409  15.9630          ?        ?       49.6       14.9       ?       ? 
1 1 1   61    2   11 o    263.0    3.5    0.0000   0.0000          ?        ?   692.7960  18.5171          ?        ?      263.0        3.5       ?       ? 
1 1 1   61    2   12 o     33.4   14.3    0.0000   0.0000          ?        ?    -0.6385  17.2401          ?        ?       33.4       14.3       ?       ? 
1 1 1   61    2   13 o     60.0   14.1    0.0000   0.0000          ?        ?    38.3113  16.6016          ?        ?       60.0       14.1       ?       ? 
1 1 1   61    2   14 o    158.3    5.8    0.0000   0.0000          ?        ?   251.5775  18.5171          ?        ?      158.3        5.8       ?       ? 
1 1 1   61    2   15 f    407.6    3.5    0.0000   0.0000          ?        ?  1663.9874  28.7335          ?        ?      407.6        3.5       ?       ? 
1 1 1   61    2   16 f    114.5    7.5    0.0000   0.0000          ?        ?   132.1740  17.2401          ?        ?      114.5        7.5       ?       ? 
1 1 1   61    2   17 o     60.8   15.2    0.0000   0.0000          ?        ?    39.5883  18.5171          ?        ?       60.8       15.2       ?       ? 
1 1 1   61    2   18 o    120.6    6.4    0.0000   0.0000          ?        ?   146.2215  15.3245          ?        ?      120.6        6.4       ?       ? 
1 1 1   61    2   19 o    271.2    3.4    0.0000   0.0000          ?        ?   736.8539  18.5171          ?        ?      271.2        3.4       ?       ? 
1 1 1   61    2   20 o    250.9    3.7    0.0000   0.0000          ?        ?   630.8594  18.5171          ?        ?      250.9        3.7       ?       ? 
1 1 1   61    2   21 o     77.7   10.3    0.0000   0.0000          ?        ?    61.2981  15.9630          ?        ?       77.7       10.3       ?       ? 
1 1 1   61    2   22 o    166.7    5.0    0.0000   0.0000          ?        ?   279.0340  16.6016          ?        ?      166.7        5.0       ?       ? 
1 1 1   61    2   23 o    154.4    5.2    0.0000   0.0000          ?        ?   239.4456  15.9630          ?        ?      154.4        5.2       ?       ? 
1 1 1   61    2   24 o     95.0    8.4    0.0000   0.0000          ?        ?    91.3086  15.9630          ?        ?       95.0        8.4       ?       ? 
1 1 1   61    2   25 o    197.2    4.2    0.0000   0.0000          ?        ?   390.1367  16.6016          ?        ?      197.2        4.2       ?       ? 
1 1 1   61    2   26 o    141.2    5.7    0.0000   0.0000          ?        ?   200.4958  15.9630          ?        ?      141.2        5.7       ?       ? 
1 1 1   61    2   27 o    180.3    4.4    0.0000   0.0000          ?        ?   326.2845  15.9630          ?        ?      180.3        4.4       ?       ? 
1 1 1   61    2   28 f     67.7   12.2    0.0000   0.0000          ?        ?    48.5276  15.9630          ?        ?       67.7       12.2       ?       ? 
1 1 1   61    2   29 o     51.7   14.7    0.0000   0.0000          ?        ?    28.7335  15.9630          ?        ?       51.7       14.7       ?       ? 
1 1 1   61    3    0 o    127.3    8.4  164.7386  21.0712   164.7386  21.0712   164.7386  21.0712      127.3      8.4      127.3        8.4     0.0     0.0 
1 1 1   61    3    1 o    193.7    4.3    0.0000   0.0000          ?        ?   376.0892  16.6016          ?        ?      193.7        4.3       ?       ? 
1 1 1   61    3    2 o    202.1    4.3    0.0000   0.0000          ?        ?   409.2924  17.2401          ?        ?      202.1        4.3       ?       ? 
1 1 1   61    3    3 o    215.5    4.3    0.0000   0.0000          ?        ?   465.4823  18.5171          ?        ?      215.5        4.3       ?       ? 
1 1 1   61    3    4 o    365.5    3.7    0.0000   0.0000          ?        ?  1337.7028  26.8179          ?        ?      365.5        3.7       ?       ? 
1 1 1   61    3    5 o    107.8    7.1    0.0000   0.0000          ?        ?   116.8494  15.3245          ?        ?      107.8        7.1       ?       ? 
1 1 1   61    3    6 o    374.0    3.3    0.0000   0.0000          ?        ?  1400.9164  24.9023          ?        ?      374.0        3.3       ?       ? 
1 1 1   61    3    7 o    156.9    5.9    0.0000   0.0000          ?        ?   247.1079  18.5171          ?        ?      156.9        5.9       ?       ? 
1 1 1   61    3    8 o    420.3    3.4    0.0000   0.0000          ?        ?  1768.7050  28.7335          ?        ?      420.3        3.4       ?       ? 
1 1 1   61    3    9 o    362.1    3.9    0.0000   0.0000          ?        ?  1313.4390  28.0950          ?        ?      362.1        3.9       ?       ? 
1 1 1   61    3   10 o    290.9    4.0    0.0000   0.0000          ?        ?   847.9567  22.9868          ?        ?      290.9        4.0       ?       ? 
1 1 1   61    3   11 o    332.1    3.6    0.0000   0.0000          ?        ?  1104.6425  23.6253          ?        ?      332.1        3.6       ?       ? 
1 1 1   61    3   12 o    382.0    3.8    0.0000   0.0000          ?        ?  1461.5759  28.7335          ?        ?      382.0        3.8       ?       ? 
1 1 1   61    3   13 o    171.5    4.8    0.0000   0.0000          ?        ?   294.9970  16.6016          ?        ?      171.5        4.8       ?       ? 
1 1 1   61    3   14 o    168.8    5.7    0.0000   0.0000          ?        ?   286.0577  19.1556          ?        ?      168.8        5.7       ?       ? 
1 1 1   61    3   15 o    101.7    7.2    0.0000   0.0000          ?        ?   104.0790  14.6860          ?        ?      101.7        7.2       ?       ? 
1 1 1   61    3   16 o    190.5    4.7    0.0000   0.0000          ?        ?   363.9573  17.8786          ?        ?      190.5        4.7       ?       ? 
1 1 1   61    3   17 o    125.2    6.9    0.0000   0.0000          ?        ?   157.7148  17.2401          ?        ?      125.2        6.9       ?       ? 
1 1 1   61    3   18 o    177.1    5.9    0.0000   0.0000          ?        ?   315.4297  21.0712          ?        ?      177.1        5.9       ?       ? 
1 1 1   61    3   19 o     37.1   15.6    0.0000   0.0000          ?        ?     2.5541  19.7942          ?        ?       37.1       15.6       ?       ? 
1 1 1   61    3   20 o    215.9    4.0    0.0000   0.0000          ?        ?   467.3978  17.2401          ?        ?      215.9        4.0       ?       ? 
1 1 1   61    3   21 f    106.8    7.2    0.0000   0.0000          ?        ?   114.9339  15.3245          ?        ?      106.8        7.2       ?       ? 
1 1 1   61    3   22 o    221.2    3.9    0.0000   0.0000          ?        ?   490.3846  17.2401          ?        ?      221.2        3.9       ?       ? 
1 1 1   61    3   23 o    183.4    4.7    0.0000   0.0000          ?        ?   337.7780  17.2401          ?        ?      183.4        4.7       ?       ? 
1 1 1   61    3   24 o    217.1    3.8    0.0000   0.0000          ?        ?   472.5060  16.6016          ?        ?      217.1        3.8       ?       ? 
1 1 1   61    3   25 o     76.7   10.4    0.0000   0.0000          ?        ?    60.0210  15.9630          ?        ?       76.7       10.4       ?       ? 
1 1 1   61    3   26 o    103.5    8.0    0.0000   0.0000          ?        ?   108.5487  16.6016          ?        ?      103.5        8.0       ?       ? 
1 1 1   61    3   27 o    109.5    7.3    0.0000   0.0000          ?        ?   121.3191  15.9630          ?        ?      109.5        7.3       ?       ? 
1 1 1   61    3   28 o    180.2    4.6    0.0000   0.0000          ?        ?   326.2845  16.6016          ?        ?      180.2        4.6       ?       ? 
1 1 1   61    4    0 o    182.7    6.5  335.8624  23.6253   335.8624  23.6253   335.8624  23.6253      182.7      6.5      182.7        6.5     0.0     0.0 
1 1 1   61    4    1 o    152.0    4.6    0.0000   0.0000          ?        ?   231.7833  14.0475          ?        ?      152.0        4.6       ?       ? 
1 1 1   61    4    2 o    180.2    4.4    0.0000   0.0000          ?        ?   325.6460  15.9630          ?        ?      180.2        4.4       ?       ? 
1 1 1   61    4    3 o     73.1   10.9    0.0000   0.0000          ?        ?    54.2743  15.9630          ?        ?       73.1       10.9       ?       ? 
1 1 1   61    4    4 o    128.1    5.7    0.0000   0.0000          ?        ?   164.7386  14.6860          ?        ?      128.1        5.7       ?       ? 
1 1 1   61    4    5 o    268.8    3.9    0.0000   0.0000          ?        ?   724.0836  21.0712          ?        ?      268.8        3.9       ?       ? 
1 1 1   61    4    6 o     73.2   10.0    0.0000   0.0000          ?        ?    54.2743  14.6860          ?        ?       73.2       10.0       ?       ? 
1 1 1   61    4    7 o    158.9    5.8    0.0000   0.0000          ?        ?   253.4931  18.5171          ?        ?      158.9        5.8       ?       ? 
1 1 1   61    4    8 o    295.8    3.7    0.0000   0.0000          ?        ?   876.6902  21.7097          ?        ?      295.8        3.7       ?       ? 
1 1 1   61    4    9 o    207.7    4.0    0.0000   0.0000          ?        ?   432.2791  16.6016          ?        ?      207.7        4.0       ?       ? 
1 1 1   61    4   10 o    119.2    7.2    0.0000   0.0000          ?        ?   143.0288  17.2401          ?        ?      119.2        7.2       ?       ? 
1 1 1   61    4   11 o    356.9    3.8    0.0000   0.0000          ?        ?  1276.4047  26.8179          ?        ?      356.9        3.8       ?       ? 
1 1 1   61    4   12 f    195.4    4.7    0.0000   0.0000          ?        ?   383.1130  18.5171          ?        ?      195.4        4.7       ?       ? 
1 1 1   61    4   13 o     20.1    9.9    0.0000   0.0000          ?        ?   -29.3720  14.0475          ?        ?       20.1        9.9       ?       ? 
1 1 1   61    4   14 o    103.4    7.7    0.0000   0.0000          ?        ?   107.9102  15.9630          ?        ?      103.4        7.7       ?       ? 
1 1 1   61    4   15 o     26.5   12.4    0.0000   0.0000          ?        ?   -14.0475  15.9630          ?        ?       26.5       12.4       ?       ? 
1 1 1   61    4   16 o     25.8   12.3    0.0000   0.0000          ?        ?   -21.0712  17.2401          ?        ?       25.8       12.3       ?       ? 
1 1 1   61    4   17 o    142.0    6.7    0.0000   0.0000          ?        ?   203.0499  19.1556          ?        ?      142.0        6.7       ?       ? 
1 1 1   61    4   18 o     91.0   10.2    0.0000   0.0000          ?        ?    84.2849  18.5171          ?        ?       91.0       10.2       ?       ? 
1 1 1   61    4   19 o    187.4    4.6    0.0000   0.0000          ?        ?   352.4639  17.2401          ?        ?      187.4        4.6       ?       ? 
1 1 1   61    4   20 o     78.9   12.1    0.0000   0.0000          ?        ?    63.8522  19.1556          ?        ?       78.9       12.1       ?       ? 
1 1 1   61    4   21 o     37.6   14.7    0.0000   0.0000          ?        ?     9.5778  15.9630          ?        ?       37.6       14.7       ?       ? 
1 1 1   61    4   22 o     78.4    9.8    0.0000   0.0000          ?        ?    62.5751  15.3245          ?        ?       78.4        9.8       ?       ? 
1 1 1   61    4   23 o     98.2    8.5    0.0000   0.0000          ?        ?    97.6938  16.6016          ?        ?       98.2        8.5       ?       ? 
1 1 1   61    4   24 o     50.2   14.9    0.0000   0.0000          ?        ?    26.8179  15.9630          ?        ?       50.2       14.9       ?       ? 
1 1 1   61    4   25 o     20.4   10.1    0.0000   0.0000          ?        ?   -34.4802  15.3245          ?        ?       20.4       10.1       ?       ? 
1 1 1   61    4   26 o     26.6   12.2    0.0000   0.0000          ?        ?    -9.5778  14.6860          ?        ?       26.6       12.2       ?       ? 
1 1 1   61    5    0 o    111.3   10.8  128.3428  23.6253   128.3428  23.6253   128.3428  23.6253      111.3     10.8      111.3       10.8     0.0     0.0 
1 1 1   61    5    1 o    103.6    6.8    0.0000   0.0000          ?        ?   107.9102  14.0475          ?        ?      103.6        6.8       ?       ? 
1 1 1   61    5    2 o    225.2    4.0    0.0000   0.0000          ?        ?   508.2632  17.8786          ?        ?      225.2        4.0       ?       ? 
1 1 1   61    5    3 o    236.7    3.8    0.0000   0.0000          ?        ?   561.2605  17.8786          ?        ?      236.7        3.8       ?       ? 
1 1 1   61    5    4 o     83.7    9.5    0.0000   0.0000          ?        ?    70.8759  15.9630          ?        ?       83.7        9.5       ?       ? 
1 1 1   61    5    5 o     97.5    7.5    0.0000   0.0000          ?        ?    95.7782  14.6860          ?        ?       97.5        7.5       ?       ? 
1 1 1   61    5    6 o    305.5    3.7    0.0000   0.0000          ?        ?   934.7956  22.3483          ?        ?      305.5        3.7       ?       ? 
1 1 1   61    5    7 o    301.6    3.5    0.0000   0.0000          ?        ?   911.1703  21.0712          ?        ?      301.6        3.5       ?       ? 
1 1 1   61    5    8 o    231.5    4.0    0.0000   0.0000          ?        ?   536.9967  18.5171          ?        ?      231.5        4.0       ?       ? 
1 1 1   61    5    9 o     43.3   15.6    0.0000   0.0000          ?        ?    16.6016  17.2401          ?        ?       43.3       15.6       ?       ? 
1 1 1   61    5   10 o     37.7   13.7    0.0000   0.0000          ?        ?    12.1319  13.4090          ?        ?       37.7       13.7       ?       ? 
1 1 1   61    5   11 o    217.1    4.0    0.0000   0.0000          ?        ?   472.5060  17.2401          ?        ?      217.1        4.0       ?       ? 
1 1 1   61    5   12 o     94.7    8.4    0.0000   0.0000          ?        ?    90.6701  15.9630          ?        ?       94.7        8.4       ?       ? 
1 1 1   61    5   13 f    254.8    3.9    0.0000   0.0000          ?        ?   650.6536  19.7942          ?        ?      254.8        3.9       ?       ? 
1 1 1   61    5   14 f    134.3    5.9    0.0000   0.0000          ?        ?   181.3401  15.9630          ?        ?      134.3        5.9       ?       ? 
1 1 1   61    5   15 o    118.1    6.8    0.0000   0.0000          ?        ?   140.4748  15.9630          ?        ?      118.1        6.8       ?       ? 
1 1 1   61    5   16 f    168.6    5.1    0.0000   0.0000          ?        ?   285.4192  17.2401          ?        ?      168.6        5.1       ?       ? 
1 1 1   61    5   17 o    288.7    3.6    0.0000   0.0000          ?        ?   835.1863  21.0712          ?        ?      288.7        3.6       ?       ? 
1 1 1   61    5   18 o    325.5    3.6    0.0000   0.0000          ?        ?  1061.8615  23.6253          ?        ?      325.5        3.6       ?       ? 
1 1 1   61    5   19 o    141.4    5.9    0.0000   0.0000          ?        ?   201.1343  16.6016          ?        ?      141.4        5.9       ?       ? 
1 1 1   61    5   20 o     82.0   11.7    0.0000   0.0000          ?        ?    68.9603  19.1556          ?        ?       82.0       11.7       ?       ? 
1 1 1   61    5   21 f     54.0   15.3    0.0000   0.0000          ?        ?    31.2876  17.2401          ?        ?       54.0       15.3       ?       ? 
1 1 1   61    5   22 o    102.3    8.1    0.0000   0.0000          ?        ?   105.9946  16.6016          ?        ?      102.3        8.1       ?       ? 
1 1 1   61    5   23 o     82.4    8.9    0.0000   0.0000          ?        ?    68.9603  14.6860          ?        ?       82.4        8.9       ?       ? 
1 1 1   61    5   24 o    149.3    5.1    0.0000   0.0000          ?        ?   224.1211  15.3245          ?        ?      149.3        5.1       ?       ? 
1 1 1   61    6    0 o    206.3    5.1  427.1710  21.0712   427.1710  21.0712   427.1710  21.0712      206.3      5.1      206.3        5.1     0.0     0.0 
1 1 1   61    6    1 f     81.0    8.7    0.0000   0.0000          ?        ?    66.4062  14.0475          ?        ?       81.0        8.7       ?       ? 
1 1 1   61    6    2 o    112.6    6.5    0.0000   0.0000          ?        ?   127.7043  14.6860          ?        ?      112.6        6.5       ?       ? 
1 1 1   61    6    3 o     72.3    9.7    0.0000   0.0000          ?        ?    52.9973  14.0475          ?        ?       72.3        9.7       ?       ? 
1 1 1   61    6    4 o     51.4   13.9    0.0000   0.0000          ?        ?    28.0950  14.6860          ?        ?       51.4       13.9       ?       ? 
1 1 1   61    6    5 o     33.3   14.2    0.0000   0.0000          ?        ?     0.6385  16.6016          ?        ?       33.3       14.2       ?       ? 
1 1 1   61    6    6 o    105.2    8.2    0.0000   0.0000          ?        ?   111.7413  17.2401          ?        ?      105.2        8.2       ?       ? 
1 1 1   61    6    7 o     54.1   14.0    0.0000   0.0000          ?        ?    31.2876  15.3245          ?        ?       54.1       14.0       ?       ? 
1 1 1   61    6    8 f     89.5    8.9    0.0000   0.0000          ?        ?    81.0922  15.9630          ?        ?       89.5        8.9       ?       ? 
1 1 1   61    6    9 o     89.3    7.9    0.0000   0.0000          ?        ?    80.4537  14.0475          ?        ?       89.3        7.9       ?       ? 
1 1 1   61    6   10 o    218.4    3.9    0.0000   0.0000          ?        ?   478.2527  17.2401          ?        ?      218.4        3.9       ?       ? 
1 1 1   61    6   11 o     60.7   12.0    0.0000   0.0000          ?        ?    38.9498  14.0475          ?        ?       60.7       12.0       ?       ? 
1 1 1   61    6   12 o    202.7    3.9    0.0000   0.0000          ?        ?   411.8464  15.9630          ?        ?      202.7        3.9       ?       ? 
1 1 1   61    6   13 o    119.1    7.2    0.0000   0.0000          ?        ?   143.0288  17.2401          ?        ?      119.1        7.2       ?       ? 
1 1 1   61    6   14 o     31.3   13.5    0.0000   0.0000          ?        ?    -0.6385  15.3245          ?        ?       31.3       13.5       ?       ? 
1 1 1   61    6   15 o     28.1   12.8    0.0000   0.0000          ?        ?    -9.5778  15.9630          ?        ?       28.1       12.8       ?       ? 
1 1 1   61    6   16 o    233.8    4.9    0.0000   0.0000          ?        ?   549.1286  22.9868          ?        ?      233.8        4.9       ?       ? 
1 1 1   61    6   17 o    161.7    5.9    0.0000   0.0000          ?        ?   263.0709  19.1556          ?        ?      161.7        5.9       ?       ? 
1 1 1   61    6   18 o    158.4    5.0    0.0000   0.0000          ?        ?   252.2160  15.9630          ?        ?      158.4        5.0       ?       ? 
1 1 1   61    6   19 o    227.7    4.3    0.0000   0.0000          ?        ?   520.3951  19.7942          ?        ?      227.7        4.3       ?       ? 
1 1 1   61    6   20 o    124.3    6.4    0.0000   0.0000          ?        ?   155.7993  15.9630          ?        ?      124.3        6.4       ?       ? 
1 1 1   61    6   21 o     82.7    8.9    0.0000   0.0000          ?        ?    69.5989  14.6860          ?        ?       82.7        8.9       ?       ? 
1 1 1   61    7    0 o    140.5    7.3  199.8573  20.4327   199.8573  20.4327   199.8573  20.4327      140.5      7.3      140.5        7.3     0.0     0.0 
1 1 1   61    7    1 o    166.2    4.2    0.0000   0.0000          ?        ?   277.1184  14.0475          ?        ?      166.2        4.2       ?       ? 
1 1 1   61    7    2 o    214.6    3.9    0.0000   0.0000          ?        ?   461.6512  16.6016          ?        ?      214.6        3.9       ?       ? 
1 1 1   61    7    3 o    129.0    5.9    0.0000   0.0000          ?        ?   167.2927  15.3245          ?        ?      129.0        5.9       ?       ? 
1 1 1   61    7    4 o    116.0    6.3    0.0000   0.0000          ?        ?   135.3666  14.6860          ?        ?      116.0        6.3       ?       ? 
1 1 1   61    7    5 o    114.0    6.7    0.0000   0.0000          ?        ?   130.8969  15.3245          ?        ?      114.0        6.7       ?       ? 
1 1 1   61    7    6 o    322.3    3.6    0.0000   0.0000          ?        ?  1040.7903  22.9868          ?        ?      322.3        3.6       ?       ? 
1 1 1   61    7    7 o    151.9    5.0    0.0000   0.0000          ?        ?   231.7833  15.3245          ?        ?      151.9        5.0       ?       ? 
1 1 1   61    7    8 o    209.3    4.3    0.0000   0.0000          ?        ?   439.3029  17.8786          ?        ?      209.3        4.3       ?       ? 
1 1 1   61    7    9 f     56.3   12.8    0.0000   0.0000          ?        ?    33.8416  14.0475          ?        ?       56.3       12.8       ?       ? 
1 1 1   61    7   10 o    105.0    7.0    0.0000   0.0000          ?        ?   111.1028  14.6860          ?        ?      105.0        7.0       ?       ? 
1 1 1   61    7   11 o    153.1    5.2    0.0000   0.0000          ?        ?   235.6145  15.9630          ?        ?      153.1        5.2       ?       ? 
1 1 1   61    7   12 o    263.2    4.0    0.0000   0.0000          ?        ?   694.7115  21.0712          ?        ?      263.2        4.0       ?       ? 
1 1 1   61    7   13 o    163.3    6.6    0.0000   0.0000          ?        ?   268.8176  21.7097          ?        ?      163.3        6.6       ?       ? 
1 1 1   61    7   14 o     34.7   14.6    0.0000   0.0000          ?        ?     2.5541  17.2401          ?        ?       34.7       14.6       ?       ? 
1 1 1   61    7   15 o     65.5   13.6    0.0000   0.0000          ?        ?    45.9736  17.2401          ?        ?       65.5       13.6       ?       ? 
1 1 1   61    7   16 o    146.7    5.7    0.0000   0.0000          ?        ?   216.4588  16.6016          ?        ?      146.7        5.7       ?       ? 
1 1 1   61    7   17 o    117.6    7.3    0.0000   0.0000          ?        ?   139.8362  17.2401          ?        ?      117.6        7.3       ?       ? 
1 1 1   61    7   18 f    195.3    4.7    0.0000   0.0000          ?        ?   383.1130  18.5171          ?        ?      195.3        4.7       ?       ? 
1 1 1   61    8    0 o    119.8    9.7  147.4985  22.9868   147.4985  22.9868   147.4985  22.9868      119.8      9.7      119.8        9.7     0.0     0.0 
1 1 1   61    8    1 o     48.5   14.2    0.0000   0.0000          ?        ?    24.9023  14.6860          ?        ?       48.5       14.2       ?       ? 
1 1 1   61    8    2 o     73.9    9.5    0.0000   0.0000          ?        ?    55.5514  14.0475          ?        ?       73.9        9.5       ?       ? 
1 1 1   61    8    3 o     34.6   13.9    0.0000   0.0000          ?        ?     6.3852  14.6860          ?        ?       34.6       13.9       ?       ? 
1 1 1   61    8    4 o     16.5    8.4    0.0000   0.0000          ?        ?   -50.4432  14.0475          ?        ?       16.5        8.4       ?       ? 
1 1 1   61    8    5 o    121.2    6.8    0.0000   0.0000          ?        ?   148.1370  16.6016          ?        ?      121.2        6.8       ?       ? 
1 1 1   61    8    6 o     78.4    9.8    0.0000   0.0000          ?        ?    62.5751  15.3245          ?        ?       78.4        9.8       ?       ? 
1 1 1   61    8    7 o    303.6    3.5    0.0000   0.0000          ?        ?   923.9408  21.0712          ?        ?      303.6        3.5       ?       ? 
1 1 1   61    8    8 o    111.2    6.3    0.0000   0.0000          ?        ?   124.5117  14.0475          ?        ?      111.2        6.3       ?       ? 
1 1 1   61    8    9 o     99.6    7.7    0.0000   0.0000          ?        ?   100.2479  15.3245          ?        ?       99.6        7.7       ?       ? 
1 1 1   61    8   10 o    207.0    4.6    0.0000   0.0000          ?        ?   430.3636  19.1556          ?        ?      207.0        4.6       ?       ? 
1 1 1   61    8   11 o    276.8    3.7    0.0000   0.0000          ?        ?   768.1415  20.4327          ?        ?      276.8        3.7       ?       ? 
1 1 1   61    8   12 o    265.4    3.9    0.0000   0.0000          ?        ?   706.2049  20.4327          ?        ?      265.4        3.9       ?       ? 
1 1 1   61    8   13 o     90.1    8.5    0.0000   0.0000          ?        ?    82.3693  15.3245          ?        ?       90.1        8.5       ?       ? 
1 1 1   61    8   14 o    191.9    4.2    0.0000   0.0000          ?        ?   369.7040  15.9630          ?        ?      191.9        4.2       ?       ? 
1 1 1   61    8   15 o     90.5    8.1    0.0000   0.0000          ?        ?    83.0078  14.6860          ?        ?       90.5        8.1       ?       ? 
1 1 1   61    9    0 o    201.8    6.3  409.9309  25.5409   409.9309  25.5409   409.9309  25.5409      201.8      6.3      201.8        6.3     0.0     0.0 
1 1 1   61    9    1 o    198.6    4.3    0.0000   0.0000          ?        ?   395.8834  17.2401          ?        ?      198.6        4.3       ?       ? 
1 1 1   61    9    2 o    191.4    4.2    0.0000   0.0000          ?        ?   367.7885  15.9630          ?        ?      191.4        4.2       ?       ? 
1 1 1   61    9    3 o    179.0    4.6    0.0000   0.0000          ?        ?   321.8149  16.6016          ?        ?      179.0        4.6       ?       ? 
1 1 1   61    9    4 o    157.7    4.7    0.0000   0.0000          ?        ?   249.6619  14.6860          ?        ?      157.7        4.7       ?       ? 
1 1 1   61    9    5 o    237.1    4.0    0.0000   0.0000          ?        ?   563.8146  19.1556          ?        ?      237.1        4.0       ?       ? 
1 1 1   61    9    6 o     73.0    9.6    0.0000   0.0000          ?        ?    54.2743  14.0475          ?        ?       73.0        9.6       ?       ? 
1 1 1   61    9    7 o    288.5    3.5    0.0000   0.0000          ?        ?   834.5477  20.4327          ?        ?      288.5        3.5       ?       ? 
1 1 1   61    9    8 o    139.3    5.5    0.0000   0.0000          ?        ?   195.3876  15.3245          ?        ?      139.3        5.5       ?       ? 
1 1 1   61    9    9 o    159.8    5.2    0.0000   0.0000          ?        ?   256.6857  16.6016          ?        ?      159.8        5.2       ?       ? 
1 1 1   61    9   10 o    151.0    5.3    0.0000   0.0000          ?        ?   229.2293  15.9630          ?        ?      151.0        5.3       ?       ? 
1 1 1   62    0    0 o    365.6    7.2 1340.2568  52.3588  1340.2568  52.3588  1340.2568  52.3588      365.6      7.2      365.6        7.2     0.0     0.0 
1 1 1   62    0    1 o    343.6    5.5 1183.8191  37.6728  1183.8191  37.6728  1183.8191  37.6728      343.6      5.5      343.6        5.5     0.0     0.0 
1 1 1   62    0    2 o    155.5    8.7  245.1923  26.8179   245.1923  26.8179   245.1923  26.8179      155.5      8.7      155.5        8.7     0.0     0.0 
1 1 1   62    0    3 o     22.8   15.6  -10.2163  21.0712   -10.2163  21.0712   -10.2163  21.0712       22.8     15.6       22.8       15.6     0.0     0.0 
1 1 1   62    0    4 o     17.3   12.5  -32.5646  20.4327   -32.5646  20.4327   -32.5646  20.4327       17.3     12.5       17.3       12.5     0.0     0.0 
1 1 1   62    0    5 o     17.7   12.8  -35.1187  21.7097   -35.1187  21.7097   -35.1187  21.7097       17.7     12.8       17.7       12.8     0.0     0.0 
1 1 1   62    0    6 o     67.4   20.2   56.8284  23.6253    56.8284  23.6253    56.8284  23.6253       67.4     20.2       67.4       20.2     0.0     0.0 
1 1 1   62    0    7 o    343.4    4.9 1181.2650  33.8416  1181.2650  33.8416  1181.2650  33.8416      343.4      4.9      343.4        4.9     0.0     0.0 
1 1 1   62    0    8 o     24.5   16.7  -11.4934  24.2638   -11.4934  24.2638   -11.4934  24.2638       24.5     16.7       24.5       16.7     0.0     0.0 
1 1 1   62    0    9 o    189.2    6.6  360.1262  24.9023   360.1262  24.9023   360.1262  24.9023      189.2      6.6      189.2        6.6     0.0     0.0 
1 1 1   62    0   10 o    224.3    6.4  505.7091  28.7335   505.7091  28.7335   505.7091  28.7335      224.3      6.4      224.3        6.4     0.0     0.0 
1 1 1   62    0   11 o    133.1    8.5  180.0631  22.3483   180.0631  22.3483   180.0631  22.3483      133.1      8.5      133.1        8.5     0.0     0.0 
1 1 1   62    0   12 o    225.2    5.5  508.9017  24.9023   508.9017  24.9023   508.9017  24.9023      225.2      5.5      225.2        5.5     0.0     0.0 
1 1 1   62    0   13 o     25.5   16.8   -1.9156  21.0712    -1.9156  21.0712    -1.9156  21.0712       25.5     16.8       25.5       16.8     0.0     0.0 
1 1 1   62    0   14 o     59.7   19.4   45.9736  20.4327    45.9736  20.4327    45.9736  20.4327       59.7     19.4       59.7       19.4     0.0     0.0 
1 1 1   62    0   15 o     36.7   20.5   19.1556  22.3483    19.1556  22.3483    19.1556  22.3483       36.7     20.5       36.7       20.5     0.0     0.0 
1 1 1   62    0   16 o     78.6   16.6   70.2374  22.9868    70.2374  22.9868    70.2374  22.9868       78.6     16.6       78.6       16.6     0.0     0.0 
1 1 1   62    0   17 o    189.0    8.1  360.7647  30.6490   360.7647  30.6490   360.7647  30.6490      189.0      8.1      189.0        8.1     0.0     0.0 
1 1 1   62    0   18 o    187.1    7.5  353.1024  28.0950   353.1024  28.0950   353.1024  28.0950      187.1      7.5      187.1        7.5     0.0     0.0 
1 1 1   62    0   19 f    119.6    8.1  145.5829  19.1556   145.5829  19.1556   145.5829  19.1556      119.6      8.1      119.6        8.1     0.0     0.0 
1 1 1   62    0   20 f     94.0   14.8   94.5012  26.1794    94.5012  26.1794    94.5012  26.1794       94.0     14.8       94.0       14.8     0.0     0.0 
1 1 1   62    0   21 o    285.0    4.8  814.1151  27.4564   814.1151  27.4564   814.1151  27.4564      285.0      4.8      285.0        4.8     0.0     0.0 
1 1 1   62    0   22 o    237.0    5.9  564.4531  28.0950   564.4531  28.0950   564.4531  28.0950      237.0      5.9      237.0        5.9     0.0     0.0 
1 1 1   62    0   23 o    157.0    8.2  249.6619  25.5409   249.6619  25.5409   249.6619  25.5409      157.0      8.2      157.0        8.2     0.0     0.0 
1 1 1   62    0   24 o    482.3    4.0 2329.3269  38.3113  2329.3269  38.3113  2329.3269  38.3113      482.3      4.0      482.3        4.0     0.0     0.0 
1 1 1   62    0   25 o    157.5    6.7  250.3005  21.0712   250.3005  21.0712   250.3005  21.0712      157.5      6.7      157.5        6.7     0.0     0.0 
1 1 1   62    0   26 o    166.3    6.5  279.0340  21.7097   279.0340  21.7097   279.0340  21.7097      166.3      6.5      166.3        6.5     0.0     0.0 
1 1 1   62    0   27 o    132.5    9.0  179.4246  23.6253   179.4246  23.6253   179.4246  23.6253      132.5      9.0      132.5        9.0     0.0     0.0 
1 1 1   62    0   28 f     17.4   12.6  -33.8416  21.0712   -33.8416  21.0712   -33.8416  21.0712       17.4     12.6       17.4       12.6     0.0     0.0 
1 1 1   62    0   29 o    219.4    5.5  483.9994  24.2638   483.9994  24.2638   483.9994  24.2638      219.4      5.5      219.4        5.5     0.0     0.0 
1 1 1   62    0   30 o    290.8    4.2  847.9567  24.2638   847.9567  24.2638   847.9567  24.2638      290.8      4.2      290.8        4.2     0.0     0.0 
1 1 1   62    1    0 o    110.4    9.4  125.1502  20.4327   125.1502  20.4327   125.1502  20.4327      110.4      9.4      110.4        9.4     0.0     0.0 
1 1 1   62    1    1 o    127.8    6.0    0.0000   0.0000          ?        ?   164.1001  15.3245          ?        ?      127.8        6.0       ?       ? 
1 1 1   62    1    2 o     77.4    9.9    0.0000   0.0000          ?        ?    60.6596  15.3245          ?        ?       77.4        9.9       ?       ? 
1 1 1   62    1    3 o    150.7    5.5    0.0000   0.0000          ?        ?   227.9522  16.6016          ?        ?      150.7        5.5       ?       ? 
1 1 1   62    1    4 o    248.8    3.6    0.0000   0.0000          ?        ?   620.0045  17.8786          ?        ?      248.8        3.6       ?       ? 
1 1 1   62    1    5 o     80.2   10.8    0.0000   0.0000          ?        ?    65.1292  17.2401          ?        ?       80.2       10.8       ?       ? 
1 1 1   62    1    6 o    264.6    4.9    0.0000   0.0000          ?        ?   702.3738  26.1794          ?        ?      264.6        4.9       ?       ? 
1 1 1   62    1    7 o     73.2   10.5    0.0000   0.0000          ?        ?    54.2743  15.3245          ?        ?       73.2       10.5       ?       ? 
1 1 1   62    1    8 o    175.2    4.6    0.0000   0.0000          ?        ?   307.7674  15.9630          ?        ?      175.2        4.6       ?       ? 
1 1 1   62    1    9 o    304.8    3.4    0.0000   0.0000          ?        ?   930.3260  20.4327          ?        ?      304.8        3.4       ?       ? 
1 1 1   62    1   10 o    371.0    3.8    0.0000   0.0000          ?        ?  1379.2067  28.0950          ?        ?      371.0        3.8       ?       ? 
1 1 1   62    1   11 o    108.1    8.9    0.0000   0.0000          ?        ?   118.1265  19.1556          ?        ?      108.1        8.9       ?       ? 
1 1 1   62    1   12 o    135.5    6.4    0.0000   0.0000          ?        ?   184.5327  17.2401          ?        ?      135.5        6.4       ?       ? 
1 1 1   62    1   13 o    128.2    8.5    0.0000   0.0000          ?        ?   166.0156  21.7097          ?        ?      128.2        8.5       ?       ? 
1 1 1   62    1   14 o    316.8    4.6    0.0000   0.0000          ?        ?  1006.3101  29.3720          ?        ?      316.8        4.6       ?       ? 
1 1 1   62    1   15 o     70.9   11.3    0.0000   0.0000          ?        ?    51.0817  15.9630          ?        ?       70.9       11.3       ?       ? 
1 1 1   62    1   16 f    258.8    3.9    0.0000   0.0000          ?        ?   671.0862  20.4327          ?        ?      258.8        3.9       ?       ? 
1 1 1   62    1   17 o    114.5    7.2    0.0000   0.0000          ?        ?   132.1740  16.6016          ?        ?      114.5        7.2       ?       ? 
1 1 1   62    1   18 o    200.6    4.3    0.0000   0.0000          ?        ?   403.5457  17.2401          ?        ?      200.6        4.3       ?       ? 
1 1 1   62    1   19 o     81.8   11.7    0.0000   0.0000          ?        ?    68.3218  19.1556          ?        ?       81.8       11.7       ?       ? 
1 1 1   62    1   20 o    168.0    5.3    0.0000   0.0000          ?        ?   283.5036  17.8786          ?        ?      168.0        5.3       ?       ? 
1 1 1   62    1   21 o    187.1    4.3    0.0000   0.0000          ?        ?   351.1869  15.9630          ?        ?      187.1        4.3       ?       ? 
1 1 1   62    1   22 f    299.7    3.3    0.0000   0.0000          ?        ?   899.6769  19.7942          ?        ?      299.7        3.3       ?       ? 
1 1 1   62    1   23 o    170.8    5.0    0.0000   0.0000          ?        ?   293.0815  17.2401          ?        ?      170.8        5.0       ?       ? 
1 1 1   62    1   24 o     24.5   11.8    0.0000   0.0000          ?        ?   -22.9868  16.6016          ?        ?       24.5       11.8       ?       ? 
1 1 1   62    1   25 o    195.9    4.2    0.0000   0.0000          ?        ?   385.0285  16.6016          ?        ?      195.9        4.2       ?       ? 
1 1 1   62    1   26 o    185.7    4.3    0.0000   0.0000          ?        ?   346.0787  15.9630          ?        ?      185.7        4.3       ?       ? 
1 1 1   62    1   27 o    297.1    3.0    0.0000   0.0000          ?        ?   884.3525  17.8786          ?        ?      297.1        3.0       ?       ? 
1 1 1   62    1   28 o    104.6    7.0    0.0000   0.0000          ?        ?   110.4642  14.6860          ?        ?      104.6        7.0       ?       ? 
1 1 1   62    2    0 o    250.3    6.6  629.5823  33.2031   629.5823  33.2031   629.5823  33.2031      250.3      6.6      250.3        6.6     0.0     0.0 
1 1 1   62    2    1 o     23.0   11.3    0.0000   0.0000          ?        ?   -35.7572  17.8786          ?        ?       23.0       11.3       ?       ? 
1 1 1   62    2    2 o     49.4   15.6    0.0000   0.0000          ?        ?    24.9023  17.2401          ?        ?       49.4       15.6       ?       ? 
1 1 1   62    2    3 o     40.8   15.0    0.0000   0.0000          ?        ?    14.0475  15.9630          ?        ?       40.8       15.0       ?       ? 
1 1 1   62    2    4 o     29.6   13.4    0.0000   0.0000          ?        ?    -9.5778  17.2401          ?        ?       29.6       13.4       ?       ? 
1 1 1   62    2    5 o    163.1    5.3    0.0000   0.0000          ?        ?   266.9020  17.2401          ?        ?      163.1        5.3       ?       ? 
1 1 1   62    2    6 o    159.0    6.4    0.0000   0.0000          ?        ?   254.1316  20.4327          ?        ?      159.0        6.4       ?       ? 
1 1 1   62    2    7 o    337.3    4.0    0.0000   0.0000          ?        ?  1139.7611  26.8179          ?        ?      337.3        4.0       ?       ? 
1 1 1   62    2    8 o    410.9    4.0    0.0000   0.0000          ?        ?  1691.4437  32.5646          ?        ?      410.9        4.0       ?       ? 
1 1 1   62    2    9 o    320.2    3.8    0.0000   0.0000          ?        ?  1027.3812  24.2638          ?        ?      320.2        3.8       ?       ? 
1 1 1   62    2   10 o    149.6    5.5    0.0000   0.0000          ?        ?   224.7596  16.6016          ?        ?      149.6        5.5       ?       ? 
1 1 1   62    2   11 o    284.6    4.4    0.0000   0.0000          ?        ?   812.1995  24.9023          ?        ?      284.6        4.4       ?       ? 
1 1 1   62    2   12 o    104.2    9.2    0.0000   0.0000          ?        ?   109.8257  19.1556          ?        ?      104.2        9.2       ?       ? 
1 1 1   62    2   13 o    105.6    7.6    0.0000   0.0000          ?        ?   112.3798  15.9630          ?        ?      105.6        7.6       ?       ? 
1 1 1   62    2   14 o     70.4   11.3    0.0000   0.0000          ?        ?    50.4432  15.9630          ?        ?       70.4       11.3       ?       ? 
1 1 1   62    2   15 o    216.0    4.7    0.0000   0.0000          ?        ?   468.0364  20.4327          ?        ?      216.0        4.7       ?       ? 
1 1 1   62    2   16 f     84.3   10.2    0.0000   0.0000          ?        ?    72.1529  17.2401          ?        ?       84.3       10.2       ?       ? 
1 1 1   62    2   17 o     45.4   15.6    0.0000   0.0000          ?        ?    19.7942  17.2401          ?        ?       45.4       15.6       ?       ? 
1 1 1   62    2   18 o     74.5   12.0    0.0000   0.0000          ?        ?    56.8284  17.8786          ?        ?       74.5       12.0       ?       ? 
1 1 1   62    2   19 o    139.8    5.9    0.0000   0.0000          ?        ?   196.6647  16.6016          ?        ?      139.8        5.9       ?       ? 
1 1 1   62    2   20 o    227.7    3.8    0.0000   0.0000          ?        ?   519.7566  17.2401          ?        ?      227.7        3.8       ?       ? 
1 1 1   62    2   21 o    119.2    6.4    0.0000   0.0000          ?        ?   143.0288  15.3245          ?        ?      119.2        6.4       ?       ? 
1 1 1   62    2   22 o    170.3    4.5    0.0000   0.0000          ?        ?   291.1659  15.3245          ?        ?      170.3        4.5       ?       ? 
1 1 1   62    2   23 o    133.3    6.0    0.0000   0.0000          ?        ?   178.7861  15.9630          ?        ?      133.3        6.0       ?       ? 
1 1 1   62    2   24 o    133.6    6.4    0.0000   0.0000          ?        ?   180.0631  17.2401          ?        ?      133.6        6.4       ?       ? 
1 1 1   62    2   25 o    127.5    6.8    0.0000   0.0000          ?        ?   164.1001  17.2401          ?        ?      127.5        6.8       ?       ? 
1 1 1   62    2   26 o    120.9    6.3    0.0000   0.0000          ?        ?   147.4985  15.3245          ?        ?      120.9        6.3       ?       ? 
1 1 1   62    3    0 o    195.8    5.4  385.0285  21.0712   385.0285  21.0712   385.0285  21.0712      195.8      5.4      195.8        5.4     0.0     0.0 
1 1 1   62    3    1 o    190.2    4.0    0.0000   0.0000          ?        ?   362.6803  15.3245          ?        ?      190.2        4.0       ?       ? 
1 1 1   62    3    2 o    142.2    5.8    0.0000   0.0000          ?        ?   203.0499  16.6016          ?        ?      142.2        5.8       ?       ? 
1 1 1   62    3    3 o    254.7    4.8    0.0000   0.0000          ?        ?   650.6536  24.2638          ?        ?      254.7        4.8       ?       ? 
1 1 1   62    3    4 o    207.8    4.1    0.0000   0.0000          ?        ?   432.9177  17.2401          ?        ?      207.8        4.1       ?       ? 
1 1 1   62    3    5 o    225.4    4.5    0.0000   0.0000          ?        ?   509.5403  20.4327          ?        ?      225.4        4.5       ?       ? 
1 1 1   62    3    6 o     65.2   12.2    0.0000   0.0000          ?        ?    44.6965  15.3245          ?        ?       65.2       12.2       ?       ? 
1 1 1   62    3    7 o    184.0    4.9    0.0000   0.0000          ?        ?   339.6935  17.8786          ?        ?      184.0        4.9       ?       ? 
1 1 1   62    3    8 o     29.1   13.3    0.0000   0.0000          ?        ?   -10.8549  17.2401          ?        ?       29.1       13.3       ?       ? 
1 1 1   62    3    9 o     67.4   12.8    0.0000   0.0000          ?        ?    47.8891  16.6016          ?        ?       67.4       12.8       ?       ? 
1 1 1   62    3   10 o    278.0    4.0    0.0000   0.0000          ?        ?   774.5267  22.3483          ?        ?      278.0        4.0       ?       ? 
1 1 1   62    3   11 o     30.8   14.0    0.0000   0.0000          ?        ?   -11.4934  19.1556          ?        ?       30.8       14.0       ?       ? 
1 1 1   62    3   12 o     33.6   14.2    0.0000   0.0000          ?        ?     1.2770  16.6016          ?        ?       33.6       14.2       ?       ? 
1 1 1   62    3   13 o     35.6   14.6    0.0000   0.0000          ?        ?     5.1082  16.6016          ?        ?       35.6       14.6       ?       ? 
1 1 1   62    3   14 o    207.3    4.3    0.0000   0.0000          ?        ?   431.0021  17.8786          ?        ?      207.3        4.3       ?       ? 
1 1 1   62    3   15 o    221.3    4.0    0.0000   0.0000          ?        ?   491.0231  17.8786          ?        ?      221.3        4.0       ?       ? 
1 1 1   62    3   16 o    214.4    3.9    0.0000   0.0000          ?        ?   461.0126  16.6016          ?        ?      214.4        3.9       ?       ? 
1 1 1   62    3   17 o    115.3    7.5    0.0000   0.0000          ?        ?   134.0895  17.2401          ?        ?      115.3        7.5       ?       ? 
1 1 1   62    3   18 o    112.4    9.4    0.0000   0.0000          ?        ?   128.3428  21.0712          ?        ?      112.4        9.4       ?       ? 
1 1 1   62    3   19 o    222.6    4.6    0.0000   0.0000          ?        ?   497.4084  20.4327          ?        ?      222.6        4.6       ?       ? 
1 1 1   62    3   20 o    154.3    5.8    0.0000   0.0000          ?        ?   239.4456  17.8786          ?        ?      154.3        5.8       ?       ? 
1 1 1   62    3   21 o    157.0    4.9    0.0000   0.0000          ?        ?   247.7464  15.3245          ?        ?      157.0        4.9       ?       ? 
1 1 1   62    3   22 o    225.7    4.0    0.0000   0.0000          ?        ?   510.8173  17.8786          ?        ?      225.7        4.0       ?       ? 
1 1 1   62    3   23 o    179.0    4.8    0.0000   0.0000          ?        ?   321.8149  17.2401          ?        ?      179.0        4.8       ?       ? 
1 1 1   62    3   24 o    239.7    3.6    0.0000   0.0000          ?        ?   575.9465  17.2401          ?        ?      239.7        3.6       ?       ? 
1 1 1   62    4    0 o     49.1   21.1   35.1187  21.0712    35.1187  21.0712    35.1187  21.0712       49.1     21.1       49.1       21.1     0.0     0.0 
1 1 1   62    4    1 o     32.8   13.6    0.0000   0.0000          ?        ?     3.1926  14.6860          ?        ?       32.8       13.6       ?       ? 
1 1 1   62    4    2 o     63.4   11.5    0.0000   0.0000          ?        ?    42.1424  14.0475          ?        ?       63.4       11.5       ?       ? 
1 1 1   62    4    3 o     19.3    9.6    0.0000   0.0000          ?        ?   -37.0343  14.6860          ?        ?       19.3        9.6       ?       ? 
1 1 1   62    4    4 o     19.6    9.8    0.0000   0.0000          ?        ?   -47.2506  16.6016          ?        ?       19.6        9.8       ?       ? 
1 1 1   62    4    5 o     38.2   15.0    0.0000   0.0000          ?        ?     9.5778  16.6016          ?        ?       38.2       15.0       ?       ? 
1 1 1   62    4    6 o    154.6    5.6    0.0000   0.0000          ?        ?   240.0841  17.2401          ?        ?      154.6        5.6       ?       ? 
1 1 1   62    4    7 o    113.4    7.0    0.0000   0.0000          ?        ?   129.6199  15.9630          ?        ?      113.4        7.0       ?       ? 
1 1 1   62    4    8 o    185.2    4.7    0.0000   0.0000          ?        ?   344.1632  17.2401          ?        ?      185.2        4.7       ?       ? 
1 1 1   62    4    9 o    163.2    5.3    0.0000   0.0000          ?        ?   267.5406  17.2401          ?        ?      163.2        5.3       ?       ? 
1 1 1   62    4   10 o     76.1    9.7    0.0000   0.0000          ?        ?    58.7440  14.6860          ?        ?       76.1        9.7       ?       ? 
1 1 1   62    4   11 o     55.1   14.3    0.0000   0.0000          ?        ?    32.5646  15.9630          ?        ?       55.1       14.3       ?       ? 
1 1 1   62    4   12 o    100.1    8.9    0.0000   0.0000          ?        ?   101.5249  17.8786          ?        ?      100.1        8.9       ?       ? 
1 1 1   62    4   13 o     84.7    9.0    0.0000   0.0000          ?        ?    72.7915  15.3245          ?        ?       84.7        9.0       ?       ? 
1 1 1   62    4   14 o    276.6    3.7    0.0000   0.0000          ?        ?   766.8644  20.4327          ?        ?      276.6        3.7       ?       ? 
1 1 1   62    4   15 o    211.8    4.5    0.0000   0.0000          ?        ?   450.1577  19.1556          ?        ?      211.8        4.5       ?       ? 
1 1 1   62    4   16 o    207.7    5.2    0.0000   0.0000          ?        ?   433.5562  21.7097          ?        ?      207.7        5.2       ?       ? 
1 1 1   62    4   17 o    110.6    8.4    0.0000   0.0000          ?        ?   123.8732  18.5171          ?        ?      110.6        8.4       ?       ? 
1 1 1   62    4   18 o    177.4    5.9    0.0000   0.0000          ?        ?   316.7067  21.0712          ?        ?      177.4        5.9       ?       ? 
1 1 1   62    4   19 o     26.9   12.7    0.0000   0.0000          ?        ?   -19.1556  17.8786          ?        ?       26.9       12.7       ?       ? 
1 1 1   62    4   20 o     75.7   11.0    0.0000   0.0000          ?        ?    58.7440  16.6016          ?        ?       75.7       11.0       ?       ? 
1 1 1   62    4   21 o    103.3    7.4    0.0000   0.0000          ?        ?   107.9102  15.3245          ?        ?      103.3        7.4       ?       ? 
1 1 1   62    4   22 o    139.6    5.3    0.0000   0.0000          ?        ?   196.0261  14.6860          ?        ?      139.6        5.3       ?       ? 
1 1 1   62    5    0 o     16.9   12.2  -24.2638  17.8786   -24.2638  17.8786   -24.2638  17.8786       16.9     12.2       16.9       12.2     0.0     0.0 
1 1 1   62    5    1 o     20.7   10.1    0.0000   0.0000          ?        ?   -26.8179  14.0475          ?        ?       20.7       10.1       ?       ? 
1 1 1   62    5    2 o     45.3   15.1    0.0000   0.0000          ?        ?    20.4327  15.9630          ?        ?       45.3       15.1       ?       ? 
1 1 1   62    5    3 o     22.6   10.9    0.0000   0.0000          ?        ?   -24.9023  15.3245          ?        ?       22.6       10.9       ?       ? 
1 1 1   62    5    4 o    109.7    7.0    0.0000   0.0000          ?        ?   121.3191  15.3245          ?        ?      109.7        7.0       ?       ? 
1 1 1   62    5    5 o    159.9    5.0    0.0000   0.0000          ?        ?   256.6857  15.9630          ?        ?      159.9        5.0       ?       ? 
1 1 1   62    5    6 o    170.4    4.5    0.0000   0.0000          ?        ?   291.1659  15.3245          ?        ?      170.4        4.5       ?       ? 
1 1 1   62    5    7 o    166.5    5.0    0.0000   0.0000          ?        ?   278.3954  16.6016          ?        ?      166.5        5.0       ?       ? 
1 1 1   62    5    8 o     84.0    9.1    0.0000   0.0000          ?        ?    71.5144  15.3245          ?        ?       84.0        9.1       ?       ? 
1 1 1   62    5    9 o     87.7    8.7    0.0000   0.0000          ?        ?    77.8996  15.3245          ?        ?       87.7        8.7       ?       ? 
1 1 1   62    5   10 o    180.2    4.4    0.0000   0.0000          ?        ?   325.6460  15.9630          ?        ?      180.2        4.4       ?       ? 
1 1 1   62    5   11 o    355.0    3.1    0.0000   0.0000          ?        ?  1262.3572  21.7097          ?        ?      355.0        3.1       ?       ? 
1 1 1   62    5   12 o     97.0    7.9    0.0000   0.0000          ?        ?    95.1397  15.3245          ?        ?       97.0        7.9       ?       ? 
1 1 1   62    5   13 o     76.7   10.4    0.0000   0.0000          ?        ?    60.0210  15.9630          ?        ?       76.7       10.4       ?       ? 
1 1 1   62    5   14 o    204.0    4.2    0.0000   0.0000          ?        ?   417.5931  17.2401          ?        ?      204.0        4.2       ?       ? 
1 1 1   62    5   15 o    217.2    4.7    0.0000   0.0000          ?        ?   473.7830  20.4327          ?        ?      217.2        4.7       ?       ? 
1 1 1   62    5   16 o     96.6    9.9    0.0000   0.0000          ?        ?    95.1397  19.1556          ?        ?       96.6        9.9       ?       ? 
1 1 1   62    5   17 o     76.0   11.8    0.0000   0.0000          ?        ?    59.3825  17.8786          ?        ?       76.0       11.8       ?       ? 
1 1 1   62    5   18 o     77.6   11.5    0.0000   0.0000          ?        ?    61.9366  17.8786          ?        ?       77.6       11.5       ?       ? 
1 1 1   62    5   19 o    200.4    4.8    0.0000   0.0000          ?        ?   403.5457  19.1556          ?        ?      200.4        4.8       ?       ? 
1 1 1   62    6    0 o     30.2   18.5    8.9393  21.0712     8.9393  21.0712     8.9393  21.0712       30.2     18.5       30.2       18.5     0.0     0.0 
1 1 1   62    6    1 o     96.1    7.6    0.0000   0.0000          ?        ?    93.2242  14.6860          ?        ?       96.1        7.6       ?       ? 
1 1 1   62    6    2 o    214.1    3.9    0.0000   0.0000          ?        ?   459.7356  16.6016          ?        ?      214.1        3.9       ?       ? 
1 1 1   62    6    3 o     40.4   14.1    0.0000   0.0000          ?        ?    15.3245  14.0475          ?        ?       40.4       14.1       ?       ? 
1 1 1   62    6    4 o     70.0   10.0    0.0000   0.0000          ?        ?    49.8047  14.0475          ?        ?       70.0       10.0       ?       ? 
1 1 1   62    6    5 o     17.7    8.9    0.0000   0.0000          ?        ?   -46.6121  14.6860          ?        ?       17.7        8.9       ?       ? 
1 1 1   62    6    6 o     34.8   14.1    0.0000   0.0000          ?        ?     5.7467  15.3245          ?        ?       34.8       14.1       ?       ? 
1 1 1   62    6    7 o    173.6    5.2    0.0000   0.0000          ?        ?   302.6593  17.8786          ?        ?      173.6        5.2       ?       ? 
1 1 1   62    6    8 o    167.6    4.8    0.0000   0.0000          ?        ?   282.2266  15.9630          ?        ?      167.6        4.8       ?       ? 
1 1 1   62    6    9 o    233.5    3.8    0.0000   0.0000          ?        ?   546.5745  17.8786          ?        ?      233.5        3.8       ?       ? 
1 1 1   62    6   10 o    110.2    7.0    0.0000   0.0000          ?        ?   122.5962  15.3245          ?        ?      110.2        7.0       ?       ? 
1 1 1   62    6   11 o     75.3   11.4    0.0000   0.0000          ?        ?    58.1055  17.2401          ?        ?       75.3       11.4       ?       ? 
1 1 1   62    6   12 o    183.0    5.9    0.0000   0.0000          ?        ?   337.1394  21.7097          ?        ?      183.0        5.9       ?       ? 
1 1 1   62    6   13 o     80.9   11.0    0.0000   0.0000          ?        ?    67.0448  17.8786          ?        ?       80.9       11.0       ?       ? 
1 1 1   62    6   14 o    109.6    7.3    0.0000   0.0000          ?        ?   121.3191  15.9630          ?        ?      109.6        7.3       ?       ? 
1 1 1   62    6   15 o     93.5   10.6    0.0000   0.0000          ?        ?    89.3930  19.7942          ?        ?       93.5       10.6       ?       ? 
1 1 1   62    6   16 o    341.8    3.4    0.0000   0.0000          ?        ?  1171.0486  22.9868          ?        ?      341.8        3.4       ?       ? 
1 1 1   62    7    0 o    118.1    9.0  143.0288  21.0712   143.0288  21.0712   143.0288  21.0712      118.1      9.0      118.1        9.0     0.0     0.0 
1 1 1   62    7    1 o     25.2   11.8    0.0000   0.0000          ?        ?   -13.4090  14.6860          ?        ?       25.2       11.8       ?       ? 
1 1 1   62    7    2 o     20.0    9.9    0.0000   0.0000          ?        ?   -33.2031  14.6860          ?        ?       20.0        9.9       ?       ? 
1 1 1   62    7    3 o    179.9    4.6    0.0000   0.0000          ?        ?   325.0075  16.6016          ?        ?      179.9        4.6       ?       ? 
1 1 1   62    7    4 f    212.9    4.2    0.0000   0.0000          ?        ?   454.6274  17.8786          ?        ?      212.9        4.2       ?       ? 
1 1 1   62    7    5 o    271.8    3.9    0.0000   0.0000          ?        ?   740.6851  21.0712          ?        ?      271.8        3.9       ?       ? 
1 1 1   62    7    6 o    227.0    3.8    0.0000   0.0000          ?        ?   516.5640  17.2401          ?        ?      227.0        3.8       ?       ? 
1 1 1   62    7    7 o     98.2    8.1    0.0000   0.0000          ?        ?    97.6938  15.9630          ?        ?       98.2        8.1       ?       ? 
1 1 1   62    7    8 o    164.7    5.2    0.0000   0.0000          ?        ?   272.6487  17.2401          ?        ?      164.7        5.2       ?       ? 
1 1 1   62    7    9 o    149.1    5.1    0.0000   0.0000          ?        ?   223.4826  15.3245          ?        ?      149.1        5.1       ?       ? 
1 1 1   62    7   10 f    101.0    8.2    0.0000   0.0000          ?        ?   103.4405  16.6016          ?        ?      101.0        8.2       ?       ? 
1 1 1   62    7   11 o    185.8    4.5    0.0000   0.0000          ?        ?   346.7172  16.6016          ?        ?      185.8        4.5       ?       ? 
1 1 1   62    7   12 o    226.2    4.1    0.0000   0.0000          ?        ?   513.3714  18.5171          ?        ?      226.2        4.1       ?       ? 
1 1 1   62    8    0 f    298.3    5.4  893.2917  31.9261   893.2917  31.9261   893.2917  31.9261      298.3      5.4      298.3        5.4     0.0     0.0 
1 1 1   62    8    1 o    262.9    3.9    0.0000   0.0000          ?        ?   693.4344  20.4327          ?        ?      262.9        3.9       ?       ? 
1 1 1   62    8    2 o    211.2    4.2    0.0000   0.0000          ?        ?   447.6036  17.8786          ?        ?      211.2        4.2       ?       ? 
1 1 1   62    8    3 o    360.5    3.4    0.0000   0.0000          ?        ?  1302.5841  24.2638          ?        ?      360.5        3.4       ?       ? 
1 1 1   62    8    4 o     95.0    7.1    0.0000   0.0000          ?        ?    91.3086  13.4090          ?        ?       95.0        7.1       ?       ? 
1 1 1   62    8    5 o    113.5    7.0    0.0000   0.0000          ?        ?   130.2584  15.9630          ?        ?      113.5        7.0       ?       ? 
1 1 1   62    8    6 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   63    0    0 o     37.0   22.2   15.3245  28.7335    15.3245  28.7335    15.3245  28.7335       37.0     22.2       37.0       22.2     0.0     0.0 
1 1 1   63    0    1 o     14.6   10.9  -72.1529  23.6253   -72.1529  23.6253   -72.1529  23.6253       14.6     10.9       14.6       10.9     0.0     0.0 
1 1 1   63    0    2 o    134.2    8.6  183.2557  22.9868   183.2557  22.9868   183.2557  22.9868      134.2      8.6      134.2        8.6     0.0     0.0 
1 1 1   63    0    3 o     16.2   11.9  -39.5883  20.4327   -39.5883  20.4327   -39.5883  20.4327       16.2     11.9       16.2       11.9     0.0     0.0 
1 1 1   63    0    4 o     15.5   11.4  -51.7203  21.7097   -51.7203  21.7097   -51.7203  21.7097       15.5     11.4       15.5       11.4     0.0     0.0 
1 1 1   63    0    5 o     27.1   18.2   -7.6623  26.8179    -7.6623  26.8179    -7.6623  26.8179       27.1     18.2       27.1       18.2     0.0     0.0 
1 1 1   63    0    6 o     26.5   17.8   -7.0237  25.5409    -7.0237  25.5409    -7.0237  25.5409       26.5     17.8       26.5       17.8     0.0     0.0 
1 1 1   63    0    7 o    213.2    6.9  457.1815  29.3720   457.1815  29.3720   457.1815  29.3720      213.2      6.9      213.2        6.9     0.0     0.0 
1 1 1   63    0    8 o    302.7    5.6  918.8326  33.8416   918.8326  33.8416   918.8326  33.8416      302.7      5.6      302.7        5.6     0.0     0.0 
1 1 1   63    0    9 o     22.0   15.7  -28.7335  26.8179   -28.7335  26.8179   -28.7335  26.8179       22.0     15.7       22.0       15.7     0.0     0.0 
1 1 1   63    0   10 o    140.6    8.2  200.4958  22.9868   200.4958  22.9868   200.4958  22.9868      140.6      8.2      140.6        8.2     0.0     0.0 
1 1 1   63    0   11 o     20.2   14.4  -28.0950  23.6253   -28.0950  23.6253   -28.0950  23.6253       20.2     14.4       20.2       14.4     0.0     0.0 
1 1 1   63    0   12 o     34.7   21.0   13.4090  26.1794    13.4090  26.1794    13.4090  26.1794       34.7     21.0       34.7       21.0     0.0     0.0 
1 1 1   63    0   13 o    113.5   10.9  133.4510  24.2638   133.4510  24.2638   133.4510  24.2638      113.5     10.9      113.5       10.9     0.0     0.0 
1 1 1   63    0   14 f    187.0    6.2  351.8254  22.9868   351.8254  22.9868   351.8254  22.9868      187.0      6.2      187.0        6.2     0.0     0.0 
1 1 1   63    0   15 o    112.9   10.3  131.5355  22.9868   131.5355  22.9868   131.5355  22.9868      112.9     10.3      112.9       10.3     0.0     0.0 
1 1 1   63    0   16 o     15.8   11.7  -67.0448  24.9023   -67.0448  24.9023   -67.0448  24.9023       15.8     11.7       15.8       11.7     0.0     0.0 
1 1 1   63    0   17 o     16.9   12.5  -62.5751  26.1794   -62.5751  26.1794   -62.5751  26.1794       16.9     12.5       16.9       12.5     0.0     0.0 
1 1 1   63    0   18 o     14.9   11.1  -68.3218  23.6253   -68.3218  23.6253   -68.3218  23.6253       14.9     11.1       14.9       11.1     0.0     0.0 
1 1 1   63    0   19 o     26.4   18.0  -10.8549  27.4564   -10.8549  27.4564   -10.8549  27.4564       26.4     18.0       26.4       18.0     0.0     0.0 
1 1 1   63    0   20 o     34.0   20.2   14.0475  23.6253    14.0475  23.6253    14.0475  23.6253       34.0     20.2       34.0       20.2     0.0     0.0 
1 1 1   63    0   21 o     18.9   13.5  -23.6253  20.4327   -23.6253  20.4327   -23.6253  20.4327       18.9     13.5       18.9       13.5     0.0     0.0 
1 1 1   63    0   22 f    153.6    7.5  238.8071  22.9868   238.8071  22.9868   238.8071  22.9868      153.6      7.5      153.6        7.5     0.0     0.0 
1 1 1   63    0   23 o    117.5   10.8  143.0288  24.9023   143.0288  24.9023   143.0288  24.9023      117.5     10.8      117.5       10.8     0.0     0.0 
1 1 1   63    0   24 o    233.6    5.2  547.8516  24.2638   547.8516  24.2638   547.8516  24.2638      233.6      5.2      233.6        5.2     0.0     0.0 
1 1 1   63    0   25 o     57.2   21.9   45.9736  23.6253    45.9736  23.6253    45.9736  23.6253       57.2     21.9       57.2       21.9     0.0     0.0 
1 1 1   63    0   26 f     52.4   22.0   40.2269  22.9868    40.2269  22.9868    40.2269  22.9868       52.4     22.0       52.4       22.0     0.0     0.0 
1 1 1   63    1    0 o     20.7   14.5  -19.7942  21.7097   -19.7942  21.7097   -19.7942  21.7097       20.7     14.5       20.7       14.5     0.0     0.0 
1 1 1   63    1    1 o     73.2   10.0    0.0000   0.0000          ?        ?    54.2743  14.6860          ?        ?       73.2       10.0       ?       ? 
1 1 1   63    1    2 o    100.1    7.7    0.0000   0.0000          ?        ?   100.8864  15.3245          ?        ?      100.1        7.7       ?       ? 
1 1 1   63    1    3 o     35.1   14.3    0.0000   0.0000          ?        ?     5.1082  15.9630          ?        ?       35.1       14.3       ?       ? 
1 1 1   63    1    4 o     63.5   13.5    0.0000   0.0000          ?        ?    42.7809  16.6016          ?        ?       63.5       13.5       ?       ? 
1 1 1   63    1    5 o    213.7    4.3    0.0000   0.0000          ?        ?   457.8200  18.5171          ?        ?      213.7        4.3       ?       ? 
1 1 1   63    1    6 o     54.2   14.9    0.0000   0.0000          ?        ?    31.2876  16.6016          ?        ?       54.2       14.9       ?       ? 
1 1 1   63    1    7 o    148.5    5.8    0.0000   0.0000          ?        ?   221.5670  17.2401          ?        ?      148.5        5.8       ?       ? 
1 1 1   63    1    8 o    181.0    4.1    0.0000   0.0000          ?        ?   328.2001  14.6860          ?        ?      181.0        4.1       ?       ? 
1 1 1   63    1    9 o    179.4    5.3    0.0000   0.0000          ?        ?   323.0919  19.1556          ?        ?      179.4        5.3       ?       ? 
1 1 1   63    1   10 o    221.2    5.9    0.0000   0.0000          ?        ?   491.6617  26.1794          ?        ?      221.2        5.9       ?       ? 
1 1 1   63    1   11 o    362.1    3.7    0.0000   0.0000          ?        ?  1314.0775  26.8179          ?        ?      362.1        3.7       ?       ? 
1 1 1   63    1   12 o    237.8    4.8    0.0000   0.0000          ?        ?   567.6458  22.9868          ?        ?      237.8        4.8       ?       ? 
1 1 1   63    1   13 o    352.8    3.5    0.0000   0.0000          ?        ?  1247.0327  24.9023          ?        ?      352.8        3.5       ?       ? 
1 1 1   63    1   14 f     95.5   10.0    0.0000   0.0000          ?        ?    92.5856  19.1556          ?        ?       95.5       10.0       ?       ? 
1 1 1   63    1   15 o     60.6   15.3    0.0000   0.0000          ?        ?    39.5883  18.5171          ?        ?       60.6       15.3       ?       ? 
1 1 1   63    1   16 o    126.0    5.8    0.0000   0.0000          ?        ?   159.6304  14.6860          ?        ?      126.0        5.8       ?       ? 
1 1 1   63    1   17 o    191.0    5.5    0.0000   0.0000          ?        ?   366.5114  21.0712          ?        ?      191.0        5.5       ?       ? 
1 1 1   63    1   18 o    257.4    4.3    0.0000   0.0000          ?        ?   664.7010  22.3483          ?        ?      257.4        4.3       ?       ? 
1 1 1   63    1   19 o    187.1    5.3    0.0000   0.0000          ?        ?   351.8254  19.7942          ?        ?      187.1        5.3       ?       ? 
1 1 1   63    1   20 f    211.1    4.2    0.0000   0.0000          ?        ?   446.9651  17.8786          ?        ?      211.1        4.2       ?       ? 
1 1 1   63    1   21 o    309.7    3.2    0.0000   0.0000          ?        ?   960.9750  19.7942          ?        ?      309.7        3.2       ?       ? 
1 1 1   63    1   22 o    379.2    3.1    0.0000   0.0000          ?        ?  1440.5049  23.6253          ?        ?      379.2        3.1       ?       ? 
1 1 1   63    1   23 f    273.8    3.6    0.0000   0.0000          ?        ?   751.5399  19.7942          ?        ?      273.8        3.6       ?       ? 
1 1 1   63    1   24 o    237.4    3.6    0.0000   0.0000          ?        ?   565.0916  17.2401          ?        ?      237.4        3.6       ?       ? 
1 1 1   63    2    0 o    201.9    6.8  410.5694  27.4564   410.5694  27.4564   410.5694  27.4564      201.9      6.8      201.9        6.8     0.0     0.0 
1 1 1   63    2    1 o    229.9    4.0    0.0000   0.0000          ?        ?   529.9730  18.5171          ?        ?      229.9        4.0       ?       ? 
1 1 1   63    2    2 o    144.4    5.5    0.0000   0.0000          ?        ?   209.4351  15.9630          ?        ?      144.4        5.5       ?       ? 
1 1 1   63    2    3 o     57.9   13.5    0.0000   0.0000          ?        ?    35.7572  15.3245          ?        ?       57.9       13.5       ?       ? 
1 1 1   63    2    4 o    160.9    5.2    0.0000   0.0000          ?        ?   259.8783  16.6016          ?        ?      160.9        5.2       ?       ? 
1 1 1   63    2    5 o     56.8   14.6    0.0000   0.0000          ?        ?    34.4802  16.6016          ?        ?       56.8       14.6       ?       ? 
1 1 1   63    2    6 o     45.2   14.8    0.0000   0.0000          ?        ?    20.4327  15.3245          ?        ?       45.2       14.8       ?       ? 
1 1 1   63    2    7 o    229.2    5.7    0.0000   0.0000          ?        ?   528.0574  26.1794          ?        ?      229.2        5.7       ?       ? 
1 1 1   63    2    8 o     31.1   13.6    0.0000   0.0000          ?        ?    -2.5541  15.9630          ?        ?       31.1       13.6       ?       ? 
1 1 1   63    2    9 o     88.1    9.1    0.0000   0.0000          ?        ?    78.5382  15.9630          ?        ?       88.1        9.1       ?       ? 
1 1 1   63    2   10 o    176.7    4.9    0.0000   0.0000          ?        ?   313.5141  17.2401          ?        ?      176.7        4.9       ?       ? 
1 1 1   63    2   11 o     99.5    9.0    0.0000   0.0000          ?        ?   100.2479  17.8786          ?        ?       99.5        9.0       ?       ? 
1 1 1   63    2   12 o    143.9    7.3    0.0000   0.0000          ?        ?   208.7966  21.0712          ?        ?      143.9        7.3       ?       ? 
1 1 1   63    2   13 o    312.8    3.6    0.0000   0.0000          ?        ?   980.7693  22.3483          ?        ?      312.8        3.6       ?       ? 
1 1 1   63    2   14 o     95.9    8.7    0.0000   0.0000          ?        ?    93.2242  16.6016          ?        ?       95.9        8.7       ?       ? 
1 1 1   63    2   15 o    344.1    3.6    0.0000   0.0000          ?        ?  1187.0117  24.9023          ?        ?      344.1        3.6       ?       ? 
1 1 1   63    2   16 o    124.2    7.5    0.0000   0.0000          ?        ?   155.7993  18.5171          ?        ?      124.2        7.5       ?       ? 
1 1 1   63    2   17 o    160.9    6.2    0.0000   0.0000          ?        ?   260.5168  19.7942          ?        ?      160.9        6.2       ?       ? 
1 1 1   63    2   18 o    122.7    7.0    0.0000   0.0000          ?        ?   151.9681  17.2401          ?        ?      122.7        7.0       ?       ? 
1 1 1   63    2   19 o     91.0    9.5    0.0000   0.0000          ?        ?    84.2849  17.2401          ?        ?       91.0        9.5       ?       ? 
1 1 1   63    2   20 o    131.0    6.6    0.0000   0.0000          ?        ?   173.0394  17.2401          ?        ?      131.0        6.6       ?       ? 
1 1 1   63    2   21 o     34.2   14.2    0.0000   0.0000          ?        ?     3.8311  15.9630          ?        ?       34.2       14.2       ?       ? 
1 1 1   63    2   22 o     66.7   12.4    0.0000   0.0000          ?        ?    47.2506  15.9630          ?        ?       66.7       12.4       ?       ? 
1 1 1   63    3    0 o     87.2   15.2   83.0078  24.2638    83.0078  24.2638    83.0078  24.2638       87.2     15.2       87.2       15.2     0.0     0.0 
1 1 1   63    3    1 o    131.1    6.3    0.0000   0.0000          ?        ?   173.0394  16.6016          ?        ?      131.1        6.3       ?       ? 
1 1 1   63    3    2 o    220.5    4.5    0.0000   0.0000          ?        ?   487.8305  19.7942          ?        ?      220.5        4.5       ?       ? 
1 1 1   63    3    3 f     64.5   12.8    0.0000   0.0000          ?        ?    44.0580  15.9630          ?        ?       64.5       12.8       ?       ? 
1 1 1   63    3    4 o    177.7    4.7    0.0000   0.0000          ?        ?   316.7067  16.6016          ?        ?      177.7        4.7       ?       ? 
1 1 1   63    3    5 o    184.6    5.2    0.0000   0.0000          ?        ?   342.2476  19.1556          ?        ?      184.6        5.2       ?       ? 
1 1 1   63    3    6 o    212.8    4.2    0.0000   0.0000          ?        ?   453.9889  17.8786          ?        ?      212.8        4.2       ?       ? 
1 1 1   63    3    7 o     79.8    9.2    0.0000   0.0000          ?        ?    64.4907  14.6860          ?        ?       79.8        9.2       ?       ? 
1 1 1   63    3    8 f    173.2    5.3    0.0000   0.0000          ?        ?   301.3822  18.5171          ?        ?      173.2        5.3       ?       ? 
1 1 1   63    3    9 o     72.9   11.4    0.0000   0.0000          ?        ?    54.2743  16.6016          ?        ?       72.9       11.4       ?       ? 
1 1 1   63    3   10 o     92.9    8.6    0.0000   0.0000          ?        ?    87.4775  15.9630          ?        ?       92.9        8.6       ?       ? 
1 1 1   63    3   11 o    218.4    4.2    0.0000   0.0000          ?        ?   478.2527  18.5171          ?        ?      218.4        4.2       ?       ? 
1 1 1   63    3   12 o    219.0    3.9    0.0000   0.0000          ?        ?   480.8068  17.2401          ?        ?      219.0        3.9       ?       ? 
1 1 1   63    3   13 o     32.0   13.5    0.0000   0.0000          ?        ?     1.9156  14.6860          ?        ?       32.0       13.5       ?       ? 
1 1 1   63    3   14 o     51.4   15.1    0.0000   0.0000          ?        ?    28.0950  16.6016          ?        ?       51.4       15.1       ?       ? 
1 1 1   63    3   15 o     86.8    9.6    0.0000   0.0000          ?        ?    76.6226  16.6016          ?        ?       86.8        9.6       ?       ? 
1 1 1   63    3   16 o    247.9    4.8    0.0000   0.0000          ?        ?   617.4504  23.6253          ?        ?      247.9        4.8       ?       ? 
1 1 1   63    3   17 o     99.2    8.0    0.0000   0.0000          ?        ?    99.6094  15.9630          ?        ?       99.2        8.0       ?       ? 
1 1 1   63    3   18 o     43.2   16.5    0.0000   0.0000          ?        ?    14.6860  19.7942          ?        ?       43.2       16.5       ?       ? 
1 1 1   63    3   19 o     71.4   11.2    0.0000   0.0000          ?        ?    52.3588  15.9630          ?        ?       71.4       11.2       ?       ? 
1 1 1   63    3   20 f     93.8    8.9    0.0000   0.0000          ?        ?    89.3930  16.6016          ?        ?       93.8        8.9       ?       ? 
1 1 1   63    4    0 o     43.7   21.8   29.3720  22.9868    29.3720  22.9868    29.3720  22.9868       43.7     21.8       43.7       21.8     0.0     0.0 
1 1 1   63    4    1 o     79.2   10.1    0.0000   0.0000          ?        ?    63.8522  15.9630          ?        ?       79.2       10.1       ?       ? 
1 1 1   63    4    2 o    141.5    5.2    0.0000   0.0000          ?        ?   201.1343  14.6860          ?        ?      141.5        5.2       ?       ? 
1 1 1   63    4    3 o    260.0    3.6    0.0000   0.0000          ?        ?   677.4714  18.5171          ?        ?      260.0        3.6       ?       ? 
1 1 1   63    4    4 o    125.2    5.9    0.0000   0.0000          ?        ?   157.7148  14.6860          ?        ?      125.2        5.9       ?       ? 
1 1 1   63    4    5 o    130.1    6.1    0.0000   0.0000          ?        ?   170.4853  15.9630          ?        ?      130.1        6.1       ?       ? 
1 1 1   63    4    6 o    206.8    4.2    0.0000   0.0000          ?        ?   429.0865  17.2401          ?        ?      206.8        4.2       ?       ? 
1 1 1   63    4    7 o    151.3    6.3    0.0000   0.0000          ?        ?   230.5063  19.1556          ?        ?      151.3        6.3       ?       ? 
1 1 1   63    4    8 o    278.2    3.6    0.0000   0.0000          ?        ?   775.8038  19.7942          ?        ?      278.2        3.6       ?       ? 
1 1 1   63    4    9 o    174.0    4.4    0.0000   0.0000          ?        ?   303.9363  15.3245          ?        ?      174.0        4.4       ?       ? 
1 1 1   63    4   10 o    286.0    3.5    0.0000   0.0000          ?        ?   819.8618  19.7942          ?        ?      286.0        3.5       ?       ? 
1 1 1   63    4   11 o     63.6   12.0    0.0000   0.0000          ?        ?    42.7809  14.6860          ?        ?       63.6       12.0       ?       ? 
1 1 1   63    4   12 o     81.1   10.2    0.0000   0.0000          ?        ?    67.0448  16.6016          ?        ?       81.1       10.2       ?       ? 
1 1 1   63    4   13 o    106.1    7.2    0.0000   0.0000          ?        ?   113.6568  15.3245          ?        ?      106.1        7.2       ?       ? 
1 1 1   63    4   14 o     97.6    7.9    0.0000   0.0000          ?        ?    96.4168  15.3245          ?        ?       97.6        7.9       ?       ? 
1 1 1   63    4   15 o    279.2    4.0    0.0000   0.0000          ?        ?   782.1890  22.3483          ?        ?      279.2        4.0       ?       ? 
1 1 1   63    4   16 o    268.8    3.7    0.0000   0.0000          ?        ?   724.7220  19.7942          ?        ?      268.8        3.7       ?       ? 
1 1 1   63    4   17 o    168.6    4.5    0.0000   0.0000          ?        ?   285.4192  15.3245          ?        ?      168.6        4.5       ?       ? 
1 1 1   63    5    0 o     25.3   16.2    2.5541  17.8786     2.5541  17.8786     2.5541  17.8786       25.3     16.2       25.3       16.2     0.0     0.0 
1 1 1   63    5    1 o     25.7   11.7    0.0000   0.0000          ?        ?    -8.3008  13.4090          ?        ?       25.7       11.7       ?       ? 
1 1 1   63    5    2 o    191.6    4.5    0.0000   0.0000          ?        ?   368.4270  17.2401          ?        ?      191.6        4.5       ?       ? 
1 1 1   63    5    3 o     84.2    9.5    0.0000   0.0000          ?        ?    72.1529  15.9630          ?        ?       84.2        9.5       ?       ? 
1 1 1   63    5    4 o     29.7   13.0    0.0000   0.0000          ?        ?    -2.5541  14.6860          ?        ?       29.7       13.0       ?       ? 
1 1 1   63    5    5 o    199.9    4.3    0.0000   0.0000          ?        ?   400.9916  17.2401          ?        ?      199.9        4.3       ?       ? 
1 1 1   63    5    6 o    195.0    4.9    0.0000   0.0000          ?        ?   381.8359  19.1556          ?        ?      195.0        4.9       ?       ? 
1 1 1   63    5    7 o    221.3    4.3    0.0000   0.0000          ?        ?   491.6617  19.1556          ?        ?      221.3        4.3       ?       ? 
1 1 1   63    5    8 o    261.6    4.0    0.0000   0.0000          ?        ?   686.4108  21.0712          ?        ?      261.6        4.0       ?       ? 
1 1 1   63    5    9 o    156.8    5.1    0.0000   0.0000          ?        ?   247.1079  15.9630          ?        ?      156.8        5.1       ?       ? 
1 1 1   63    5   10 o    141.8    5.6    0.0000   0.0000          ?        ?   202.4114  15.9630          ?        ?      141.8        5.6       ?       ? 
1 1 1   63    5   11 o     47.5   15.7    0.0000   0.0000          ?        ?    22.9868  17.2401          ?        ?       47.5       15.7       ?       ? 
1 1 1   63    5   12 o     75.5   11.8    0.0000   0.0000          ?        ?    58.7440  17.8786          ?        ?       75.5       11.8       ?       ? 
1 1 1   63    5   13 o    109.2    7.6    0.0000   0.0000          ?        ?   120.6806  16.6016          ?        ?      109.2        7.6       ?       ? 
1 1 1   63    6    0 o    146.2    7.2  216.4588  21.0712   216.4588  21.0712   216.4588  21.0712      146.2      7.2      146.2        7.2     0.0     0.0 
1 1 1   63    6    1 o    242.8    3.8    0.0000   0.0000          ?        ?   591.2710  18.5171          ?        ?      242.8        3.8       ?       ? 
1 1 1   63    6    2 o    197.0    4.2    0.0000   0.0000          ?        ?   389.4982  16.6016          ?        ?      197.0        4.2       ?       ? 
1 1 1   63    6    3 o     32.4   13.4    0.0000   0.0000          ?        ?     3.8311  14.0475          ?        ?       32.4       13.4       ?       ? 
1 1 1   63    6    4 o     83.5    8.8    0.0000   0.0000          ?        ?    70.8759  14.6860          ?        ?       83.5        8.8       ?       ? 
1 1 1   63    6    5 o    127.7    6.7    0.0000   0.0000          ?        ?   164.7386  17.2401          ?        ?      127.7        6.7       ?       ? 
1 1 1   63    6    6 o    203.8    4.2    0.0000   0.0000          ?        ?   416.9547  17.2401          ?        ?      203.8        4.2       ?       ? 
1 1 1   63    6    7 o    219.0    4.1    0.0000   0.0000          ?        ?   481.4453  17.8786          ?        ?      219.0        4.1       ?       ? 
1 1 1   63    6    8 o     70.6   10.4    0.0000   0.0000          ?        ?    51.0817  14.6860          ?        ?       70.6       10.4       ?       ? 
1 1 1   64    0    0 o    102.9   15.7  111.7413  30.6490   111.7413  30.6490   111.7413  30.6490      102.9     15.7      102.9       15.7     0.0     0.0 
1 1 1   64    0    1 o     66.6   20.3   56.1899  23.6253    56.1899  23.6253    56.1899  23.6253       66.6     20.3       66.6       20.3     0.0     0.0 
1 1 1   64    0    2 o    186.7    6.2  350.5484  22.9868   350.5484  22.9868   350.5484  22.9868      186.7      6.2      186.7        6.2     0.0     0.0 
1 1 1   64    0    3 o     34.6   20.1   15.9630  22.3483    15.9630  22.3483    15.9630  22.3483       34.6     20.1       34.6       20.1     0.0     0.0 
1 1 1   64    0    4 x        ?      ?         ?        ?          ?        ?          ?        ?          ?        ?          ?          ?       ?       ? 
1 1 1   64    0    5 o     86.8   13.7   80.4537  22.3483    80.4537  22.3483    80.4537  22.3483       86.8     13.7       86.8       13.7     0.0     0.0 
1 1 1   64    0    6 o     17.1   12.7  -75.9841  28.7335   -75.9841  28.7335   -75.9841  28.7335       17.1     12.7       17.1       12.7     0.0     0.0 
1 1 1   64    0    7 o    197.4    7.3  392.6908  28.7335   392.6908  28.7335   392.6908  28.7335      197.4      7.3      197.4        7.3     0.0     0.0 
1 1 1   64    0    8 o    143.0    9.9  208.7966  28.0950   208.7966  28.0950   208.7966  28.0950      143.0      9.9      143.0        9.9     0.0     0.0 
1 1 1   64    0    9 o    120.6    9.9  149.4141  23.6253   149.4141  23.6253   149.4141  23.6253      120.6      9.9      120.6        9.9     0.0     0.0 
1 1 1   64    0   10 f     19.0   13.6  -25.5409  21.0712   -25.5409  21.0712   -25.5409  21.0712       19.0     13.6       19.0       13.6     0.0     0.0 
1 1 1   64    0   11 f    129.3   10.2  171.7623  26.1794   171.7623  26.1794   171.7623  26.1794      129.3     10.2      129.3       10.2     0.0     0.0 
1 1 1   64    0   12 o     42.8   21.5   28.0950  22.3483    28.0950  22.3483    28.0950  22.3483       42.8     21.5       42.8       21.5     0.0     0.0 
1 1 1   64    0   13 o     44.5   24.8   29.3720  32.5646    29.3720  32.5646    29.3720  32.5646       44.5     24.8       44.5       24.8     0.0     0.0 
1 1 1   64    0   14 o    412.9    4.6 1708.6840  38.3113  1708.6840  38.3113  1708.6840  38.3113      412.9      4.6      412.9        4.6     0.0     0.0 
1 1 1   64    0   15 o    160.3    9.6  261.7939  30.6490   261.7939  30.6490   261.7939  30.6490      160.3      9.6      160.3        9.6     0.0     0.0 
1 1 1   64    0   16 o    435.0    6.2 1900.2404  54.2743  1900.2404  54.2743  1900.2404  54.2743      435.0      6.2      435.0        6.2     0.0     0.0 
1 1 1   64    0   17 o     66.8   19.3   55.5514  22.3483    55.5514  22.3483    55.5514  22.3483       66.8     19.3       66.8       19.3     0.0     0.0 
1 1 1   64    0   18 f    114.6   12.5  137.9207  28.0950   137.9207  28.0950   137.9207  28.0950      114.6     12.5      114.6       12.5     0.0     0.0 
1 1 1   64    0   19 o    428.1    5.0 1837.6652  42.7809  1837.6652  42.7809  1837.6652  42.7809      428.1      5.0      428.1        5.0     0.0     0.0 
1 1 1   64    0   20 o    136.7    9.2  190.9180  24.9023   190.9180  24.9023   190.9180  24.9023      136.7      9.2      136.7        9.2     0.0     0.0 
1 1 1   64    0   21 o     20.3   14.3  -19.1556  21.0712   -19.1556  21.0712   -19.1556  21.0712       20.3     14.3       20.3       14.3     0.0     0.0 
1 1 1   64    0   22 o    111.3    8.7  127.0658  19.1556   127.0658  19.1556   127.0658  19.1556      111.3      8.7      111.3        8.7     0.0     0.0 
1 1 1   64    1    0 o    250.3    6.0  629.5823  30.0105   629.5823  30.0105   629.5823  30.0105      250.3      6.0      250.3        6.0     0.0     0.0 
1 1 1   64    1    1 o    199.9    4.8    0.0000   0.0000          ?        ?   400.9916  19.1556          ?        ?      199.9        4.8       ?       ? 
1 1 1   64    1    2 o    202.6    4.7    0.0000   0.0000          ?        ?   411.8464  19.1556          ?        ?      202.6        4.7       ?       ? 
1 1 1   64    1    3 o    140.3    6.1    0.0000   0.0000          ?        ?   197.9417  17.2401          ?        ?      140.3        6.1       ?       ? 
1 1 1   64    1    4 o    208.5    4.6    0.0000   0.0000          ?        ?   436.1103  19.1556          ?        ?      208.5        4.6       ?       ? 
1 1 1   64    1    5 o    326.5    3.8    0.0000   0.0000          ?        ?  1068.2467  24.9023          ?        ?      326.5        3.8       ?       ? 
1 1 1   64    1    6 o    178.1    5.0    0.0000   0.0000          ?        ?   318.6223  17.8786          ?        ?      178.1        5.0       ?       ? 
1 1 1   64    1    7 o     64.7   13.7    0.0000   0.0000          ?        ?    44.6965  17.2401          ?        ?       64.7       13.7       ?       ? 
1 1 1   64    1    8 o    138.3    5.5    0.0000   0.0000          ?        ?   192.1950  15.3245          ?        ?      138.3        5.5       ?       ? 
1 1 1   64    1    9 o    130.1    7.8    0.0000   0.0000          ?        ?   171.1238  20.4327          ?        ?      130.1        7.8       ?       ? 
1 1 1   64    1   10 o     58.2   14.3    0.0000   0.0000          ?        ?    36.3957  16.6016          ?        ?       58.2       14.3       ?       ? 
1 1 1   64    1   11 o    271.0    3.7    0.0000   0.0000          ?        ?   736.2155  19.7942          ?        ?      271.0        3.7       ?       ? 
1 1 1   64    1   12 o    202.6    5.2    0.0000   0.0000          ?        ?   412.4850  21.0712          ?        ?      202.6        5.2       ?       ? 
1 1 1   64    1   13 o    289.2    3.8    0.0000   0.0000          ?        ?   838.3789  21.7097          ?        ?      289.2        3.8       ?       ? 
1 1 1   64    1   14 o    144.0    6.4    0.0000   0.0000          ?        ?   208.7966  18.5171          ?        ?      144.0        6.4       ?       ? 
1 1 1   64    1   15 o    132.3    7.2    0.0000   0.0000          ?        ?   176.8705  19.1556          ?        ?      132.3        7.2       ?       ? 
1 1 1   64    1   16 f    140.1    6.6    0.0000   0.0000          ?        ?   197.9417  18.5171          ?        ?      140.1        6.6       ?       ? 
1 1 1   64    1   17 o     20.2   10.1    0.0000   0.0000          ?        ?   -43.4195  16.6016          ?        ?       20.2       10.1       ?       ? 
1 1 1   64    1   18 o    125.2    7.1    0.0000   0.0000          ?        ?   158.3534  17.8786          ?        ?      125.2        7.1       ?       ? 
1 1 1   64    1   19 o    120.1    8.0    0.0000   0.0000          ?        ?   146.2215  19.1556          ?        ?      120.1        8.0       ?       ? 
1 1 1   64    1   20 o    137.8    6.3    0.0000   0.0000          ?        ?   191.5565  17.2401          ?        ?      137.8        6.3       ?       ? 
1 1 1   64    2    0 o    170.7    8.3  294.9970  28.0950   294.9970  28.0950   294.9970  28.0950      170.7      8.3      170.7        8.3     0.0     0.0 
1 1 1   64    2    1 o    136.4    5.9    0.0000   0.0000          ?        ?   187.0868  15.9630          ?        ?      136.4        5.9       ?       ? 
1 1 1   64    2    2 o    117.3    6.5    0.0000   0.0000          ?        ?   138.5592  15.3245          ?        ?      117.3        6.5       ?       ? 
1 1 1   64    2    3 o     82.3   10.5    0.0000   0.0000          ?        ?    68.9603  17.2401          ?        ?       82.3       10.5       ?       ? 
1 1 1   64    2    4 o     97.9    8.5    0.0000   0.0000          ?        ?    97.0553  16.6016          ?        ?       97.9        8.5       ?       ? 
1 1 1   64    2    5 o     26.1   12.3    0.0000   0.0000          ?        ?   -19.7942  17.2401          ?        ?       26.1       12.3       ?       ? 
1 1 1   64    2    6 o    172.0    4.6    0.0000   0.0000          ?        ?   296.9126  15.9630          ?        ?      172.0        4.6       ?       ? 
1 1 1   64    2    7 o    251.9    3.5    0.0000   0.0000          ?        ?   635.9675  17.8786          ?        ?      251.9        3.5       ?       ? 
1 1 1   64    2    8 o    189.4    4.7    0.0000   0.0000          ?        ?   360.1262  17.8786          ?        ?      189.4        4.7       ?       ? 
1 1 1   64    2    9 o    162.3    5.9    0.0000   0.0000          ?        ?   264.9865  19.1556          ?        ?      162.3        5.9       ?       ? 
1 1 1   64    2   10 o    111.8    8.0    0.0000   0.0000          ?        ?   126.4273  17.8786          ?        ?      111.8        8.0       ?       ? 
1 1 1   64    2   11 o    106.8    8.4    0.0000   0.0000          ?        ?   115.5724  17.8786          ?        ?      106.8        8.4       ?       ? 
1 1 1   64    2   12 o    205.3    5.0    0.0000   0.0000          ?        ?   423.3398  20.4327          ?        ?      205.3        5.0       ?       ? 
1 1 1   64    2   13 o    208.7    4.9    0.0000   0.0000          ?        ?   437.3873  20.4327          ?        ?      208.7        4.9       ?       ? 
1 1 1   64    2   14 o    132.3    7.2    0.0000   0.0000          ?        ?   176.8705  19.1556          ?        ?      132.3        7.2       ?       ? 
1 1 1   64    2   15 o     30.6   14.1    0.0000   0.0000          ?        ?   -13.4090  19.7942          ?        ?       30.6       14.1       ?       ? 
1 1 1   64    2   16 o    202.8    4.6    0.0000   0.0000          ?        ?   413.1235  18.5171          ?        ?      202.8        4.6       ?       ? 
1 1 1   64    2   17 o     38.8   15.2    0.0000   0.0000          ?        ?    10.2163  17.2401          ?        ?       38.8       15.2       ?       ? 
1 1 1   64    3    0 o     20.9   14.3  -10.2163  18.5171   -10.2163  18.5171   -10.2163  18.5171       20.9     14.3       20.9       14.3     0.0     0.0 
1 1 1   64    3    1 o     58.3   13.4    0.0000   0.0000          ?        ?    36.3957  15.3245          ?        ?       58.3       13.4       ?       ? 
1 1 1   64    3    2 o    221.5    4.3    0.0000   0.0000          ?        ?   492.3002  19.1556          ?        ?      221.5        4.3       ?       ? 
1 1 1   64    3    3 o    134.9    6.2    0.0000   0.0000          ?        ?   183.2557  16.6016          ?        ?      134.9        6.2       ?       ? 
1 1 1   64    3    4 o    119.1    7.0    0.0000   0.0000          ?        ?   143.0288  16.6016          ?        ?      119.1        7.0       ?       ? 
1 1 1   64    3    5 o     45.5   15.4    0.0000   0.0000          ?        ?    20.4327  16.6016          ?        ?       45.5       15.4       ?       ? 
1 1 1   64    3    6 o    212.5    4.4    0.0000   0.0000          ?        ?   453.3503  18.5171          ?        ?      212.5        4.4       ?       ? 
1 1 1   64    3    7 o    157.4    5.3    0.0000   0.0000          ?        ?   249.0234  16.6016          ?        ?      157.4        5.3       ?       ? 
1 1 1   64    3    8 o    174.7    4.4    0.0000   0.0000          ?        ?   306.4904  15.3245          ?        ?      174.7        4.4       ?       ? 
1 1 1   64    3    9 o     79.2    9.3    0.0000   0.0000          ?        ?    63.8522  14.6860          ?        ?       79.2        9.3       ?       ? 
1 1 1   64    3   10 f     62.9   14.5    0.0000   0.0000          ?        ?    42.7809  17.8786          ?        ?       62.9       14.5       ?       ? 
1 1 1   64    3   11 f     96.4    8.9    0.0000   0.0000          ?        ?    94.5012  17.2401          ?        ?       96.4        8.9       ?       ? 
1 1 1   64    3   12 o    127.7    7.3    0.0000   0.0000          ?        ?   164.7386  18.5171          ?        ?      127.7        7.3       ?       ? 
1 1 1   64    3   13 o    189.7    4.7    0.0000   0.0000          ?        ?   361.4032  17.8786          ?        ?      189.7        4.7       ?       ? 
1 1 1   64    3   14 o    108.3    7.7    0.0000   0.0000          ?        ?   118.7650  16.6016          ?        ?      108.3        7.7       ?       ? 
1 1 1   64    4    0 o     85.6   14.6   79.8152  22.9868    79.8152  22.9868    79.8152  22.9868       85.6     14.6       85.6       14.6     0.0     0.0 
1 1 1   64    4    1 o     29.0   12.7    0.0000   0.0000          ?        ?    -2.5541  14.0475          ?        ?       29.0       12.7       ?       ? 
1 1 1   64    4    2 o     37.5   14.2    0.0000   0.0000          ?        ?    10.8549  14.6860          ?        ?       37.5       14.2       ?       ? 
1 1 1   64    4    3 o    143.1    5.8    0.0000   0.0000          ?        ?   206.2425  16.6016          ?        ?      143.1        5.8       ?       ? 
1 1 1   64    4    4 o    246.7    3.6    0.0000   0.0000          ?        ?   610.4266  17.8786          ?        ?      246.7        3.6       ?       ? 
1 1 1   64    4    5 o     72.3   11.5    0.0000   0.0000          ?        ?    53.6358  16.6016          ?        ?       72.3       11.5       ?       ? 
1 1 1   64    4    6 o    223.1    4.2    0.0000   0.0000          ?        ?   499.3239  18.5171          ?        ?      223.1        4.2       ?       ? 
1 1 1   64    4    7 o     45.2   14.4    0.0000   0.0000          ?        ?    21.0712  14.6860          ?        ?       45.2       14.4       ?       ? 
1 1 1   64    4    8 o     58.5   14.3    0.0000   0.0000          ?        ?    37.0343  16.6016          ?        ?       58.5       14.3       ?       ? 
1 1 1   64    4    9 o    189.0    4.7    0.0000   0.0000          ?        ?   358.8492  17.8786          ?        ?      189.0        4.7       ?       ? 
1 1 1   65    0    0 o    623.6    7.5 3899.4517  93.2242  3899.4517  93.2242  3899.4517  93.2242      623.6      7.5      623.6        7.5     0.0     0.0 
1 1 1   65    0    1 o    194.0    6.9  379.2819  26.8179   379.2819  26.8179   379.2819  26.8179      194.0      6.9      194.0        6.9     0.0     0.0 
1 1 1   65    0    2 o    115.9    8.6  137.2822  19.7942   137.2822  19.7942   137.2822  19.7942      115.9      8.6      115.9        8.6     0.0     0.0 
1 1 1   65    0    3 o    152.6    9.1  236.8915  27.4564   236.8915  27.4564   236.8915  27.4564      152.6      9.1      152.6        9.1     0.0     0.0 
1 1 1   65    0    4 o    419.7    5.0 1766.1509  42.1424  1766.1509  42.1424  1766.1509  42.1424      419.7      5.0      419.7        5.0     0.0     0.0 
1 1 1   65    0    5 o    149.2    7.8  225.3981  22.9868   225.3981  22.9868   225.3981  22.9868      149.2      7.8      149.2        7.8     0.0     0.0 
1 1 1   65    0    6 o    327.7    5.0 1077.1859  32.5646  1077.1859  32.5646  1077.1859  32.5646      327.7      5.0      327.7        5.0     0.0     0.0 
1 1 1   65    0    7 o    171.6    6.7  296.9126  22.9868   296.9126  22.9868   296.9126  22.9868      171.6      6.7      171.6        6.7     0.0     0.0 
1 1 1   65    0    8 o     79.5   18.0   73.4300  24.9023    73.4300  24.9023    73.4300  24.9023       79.5     18.0       79.5       18.0     0.0     0.0 
1 1 1   65    0    9 o    155.3    8.9  245.1923  27.4564   245.1923  27.4564   245.1923  27.4564      155.3      8.9      155.3        8.9     0.0     0.0 
1 1 1   65    0   10 o    426.7    6.4 1828.7260  54.9129  1828.7260  54.9129  1828.7260  54.9129      426.7      6.4      426.7        6.4     0.0     0.0 
1 1 1   65    0   11 o     23.2   16.5  -34.4802  30.6490   -34.4802  30.6490   -34.4802  30.6490       23.2     16.5       23.2       16.5     0.0     0.0 
1 1 1   65    0   12 o     19.6   13.9  -22.3483  21.0712   -22.3483  21.0712   -22.3483  21.0712       19.6     13.9       19.6       13.9     0.0     0.0 
1 1 1   65    0   13 o     25.7   17.6  -13.4090  27.4564   -13.4090  27.4564   -13.4090  27.4564       25.7     17.6       25.7       17.6     0.0     0.0 
1 1 1   65    0   14 o    164.4    8.2  273.9258  26.8179   273.9258  26.8179   273.9258  26.8179      164.4      8.2      164.4        8.2     0.0     0.0 
1 1 1   65    0   15 o    163.6    9.4  272.6487  30.6490   272.6487  30.6490   272.6487  30.6490      163.6      9.4      163.6        9.4     0.0     0.0 
1 1 1   65    0   16 o     16.4   12.1  -53.6358  23.6253   -53.6358  23.6253   -53.6358  23.6253       16.4     12.1       16.4       12.1     0.0     0.0 
1 1 1   65    0   17 o    145.4    8.6  215.1818  24.9023   215.1818  24.9023   215.1818  24.9023      145.4      8.6      145.4        8.6     0.0     0.0 
1 1 1   65    1    0 o    277.9    5.9  775.8038  32.5646   775.8038  32.5646   775.8038  32.5646      277.9      5.9      277.9        5.9     0.0     0.0 
1 1 1   65    1    1 o    388.1    4.2    0.0000   0.0000          ?        ?  1511.3806  32.5646          ?        ?      388.1        4.2       ?       ? 
1 1 1   65    1    2 o    249.2    4.9    0.0000   0.0000          ?        ?   623.8356  24.2638          ?        ?      249.2        4.9       ?       ? 
1 1 1   65    1    3 o    114.7    7.0    0.0000   0.0000          ?        ?   132.8125  15.9630          ?        ?      114.7        7.0       ?       ? 
1 1 1   65    1    4 o     56.1   14.2    0.0000   0.0000          ?        ?    33.8416  15.9630          ?        ?       56.1       14.2       ?       ? 
1 1 1   65    1    5 o    288.9    3.8    0.0000   0.0000          ?        ?   837.1019  21.7097          ?        ?      288.9        3.8       ?       ? 
1 1 1   65    1    6 o     65.2   10.3    0.0000   0.0000          ?        ?    43.4195  13.4090          ?        ?       65.2       10.3       ?       ? 
1 1 1   65    1    7 o     81.6   11.7    0.0000   0.0000          ?        ?    68.3218  19.1556          ?        ?       81.6       11.7       ?       ? 
1 1 1   65    1    8 o     78.3   10.2    0.0000   0.0000          ?        ?    62.5751  15.9630          ?        ?       78.3       10.2       ?       ? 
1 1 1   65    1    9 o     84.0   11.0    0.0000   0.0000          ?        ?    72.1529  18.5171          ?        ?       84.0       11.0       ?       ? 
1 1 1   65    1   10 f    102.6    9.6    0.0000   0.0000          ?        ?   107.2716  19.7942          ?        ?      102.6        9.6       ?       ? 
1 1 1   65    1   11 o    204.0    5.0    0.0000   0.0000          ?        ?   418.2317  20.4327          ?        ?      204.0        5.0       ?       ? 
1 1 1   65    1   12 o    117.4    8.4    0.0000   0.0000          ?        ?   139.8362  19.7942          ?        ?      117.4        8.4       ?       ? 
1 1 1   65    1   13 o     25.5   12.3    0.0000   0.0000          ?        ?   -26.8179  18.5171          ?        ?       25.5       12.3       ?       ? 
1 1 1   65    1   14 o     43.3   15.8    0.0000   0.0000          ?        ?    16.6016  17.8786          ?        ?       43.3       15.8       ?       ? 
1 1 1   65    2    0 o    149.6    8.4  227.3137  24.9023   227.3137  24.9023   227.3137  24.9023      149.6      8.4      149.6        8.4     0.0     0.0 
1 1 1   65    2    1 o    130.0    6.6    0.0000   0.0000          ?        ?   170.4853  17.2401          ?        ?      130.0        6.6       ?       ? 
1 1 1   65    2    2 f    184.5    4.3    0.0000   0.0000          ?        ?   341.6091  15.9630          ?        ?      184.5        4.3       ?       ? 
1 1 1   65    2    3 o    319.1    3.4    0.0000   0.0000          ?        ?  1020.3576  21.7097          ?        ?      319.1        3.4       ?       ? 
1 1 1   65    2    4 o     83.8    9.5    0.0000   0.0000          ?        ?    71.5144  15.9630          ?        ?       83.8        9.5       ?       ? 
1 1 1   65    2    5 o    184.6    4.5    0.0000   0.0000          ?        ?   342.2476  16.6016          ?        ?      184.6        4.5       ?       ? 
1 1 1   65    2    6 o     93.2    8.2    0.0000   0.0000          ?        ?    88.1160  15.3245          ?        ?       93.2        8.2       ?       ? 
1 1 1   65    2    7 o    195.3    4.7    0.0000   0.0000          ?        ?   383.1130  18.5171          ?        ?      195.3        4.7       ?       ? 
1 1 1   65    2    8 o    189.9    5.4    0.0000   0.0000          ?        ?   362.6803  20.4327          ?        ?      189.9        5.4       ?       ? 
1 1 1   65    2    9 o    162.2    4.9    0.0000   0.0000          ?        ?   264.3480  15.9630          ?        ?      162.2        4.9       ?       ? 
1 1 1   65    2   10 o     30.3   13.3    0.0000   0.0000          ?        ?    -2.5541  15.3245          ?        ?       30.3       13.3       ?       ? 
1 1 1   66    0    0 o    285.4    7.7  818.5847  44.0580   818.5847  44.0580   818.5847  44.0580      285.4      7.7      285.4        7.7     0.0     0.0 
1 1 1   66    0    1 o     94.9   13.0   93.8627  24.2638    93.8627  24.2638    93.8627  24.2638       94.9     13.0       94.9       13.0     0.0     0.0 
1 1 1   66    0    2 o    144.8    7.5  212.6277  21.7097   212.6277  21.7097   212.6277  21.7097      144.8      7.5      144.8        7.5     0.0     0.0 
1 1 1   66    0    3 f    245.3    6.8  605.9570  33.2031   605.9570  33.2031   605.9570  33.2031      245.3      6.8      245.3        6.8     0.0     0.0 
1 1 1   66    0    4 o     24.1   16.5  -10.8549  23.6253   -10.8549  23.6253   -10.8549  23.6253       24.1     16.5       24.1       16.5     0.0     0.0 
1 1 1   66    0    5 o     27.5   18.1   -1.2770  24.2638    -1.2770  24.2638    -1.2770  24.2638       27.5     18.1       27.5       18.1     0.0     0.0 
1 1 1   66    0    6 o    317.1    5.1 1008.8642  32.5646  1008.8642  32.5646  1008.8642  32.5646      317.1      5.1      317.1        5.1     0.0     0.0 
1 1 1   66    0    7 o     40.3   22.9   23.6253  28.0950    23.6253  28.0950    23.6253  28.0950       40.3     22.9       40.3       22.9     0.0     0.0 
1 1 1   66    0    8 o     24.2   16.8  -15.9630  26.1794   -15.9630  26.1794   -15.9630  26.1794       24.2     16.8       24.2       16.8     0.0     0.0 
1 1 1   66    0    9 o     96.2   12.3   98.3323  22.9868    98.3323  22.9868    98.3323  22.9868       96.2     12.3       96.2       12.3     0.0     0.0 
1 1 1   66    0   10 o    239.3    7.1  577.2236  33.8416   577.2236  33.8416   577.2236  33.8416      239.3      7.1      239.3        7.1     0.0     0.0 
1 1 1   66    1    0 o     37.4   22.3   17.8786  28.7335    17.8786  28.7335    17.8786  28.7335       37.4     22.3       37.4       22.3     0.0     0.0 
1 1 1   66    1    1 o     83.3   10.0    0.0000   0.0000          ?        ?    70.8759  16.6016          ?        ?       83.3       10.0       ?       ? 
1 1 1   66    1    2 o     99.5    9.3    0.0000   0.0000          ?        ?   100.8864  18.5171          ?        ?       99.5        9.3       ?       ? 
#END OF REFLECTIONS
